NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
588075 | 2mnh | 19892 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H THR 2 H THR 2 123.902 -18.855 0.512 2 HA THR 2 HA THR 2 125.612 -17.232 0.508 3 HB THR 2 HB THR 2 124.646 -17.243 -2.371 4 HG1 THR 2 HG1 THR 2 125.547 -19.117 -2.396 5 HG21 THR 2 HG21 THR 2 126.123 -15.513 -2.537 6 HG22 THR 2 HG22 THR 2 127.327 -16.800 -2.480 7 HG23 THR 2 HG23 THR 2 126.915 -15.912 -1.013 8 H SER 3 H SER 3 124.060 -15.411 -2.076 9 HA SER 3 HA SER 3 122.898 -13.470 -0.159 10 HB2 SER 3 HB2 SER 3 124.312 -11.675 -0.985 11 HG SER 3 HG SER 3 125.473 -13.636 -2.664 12 H THR 4 H THR 4 121.427 -11.980 -1.245 13 HA THR 4 HA THR 4 120.893 -12.594 -4.119 14 HB THR 4 HB THR 4 118.807 -12.367 -1.928 15 HG1 THR 4 HG1 THR 4 119.809 -14.661 -3.255 16 HG21 THR 4 HG21 THR 4 118.410 -11.907 -4.521 17 HG22 THR 4 HG22 THR 4 117.223 -12.773 -3.546 18 HG23 THR 4 HG23 THR 4 118.346 -13.669 -4.569 19 H VAL 5 H VAL 5 120.401 -10.771 -5.305 20 HA VAL 5 HA VAL 5 120.247 -8.170 -3.824 21 HB VAL 5 HB VAL 5 120.964 -8.852 -6.702 22 HG11 VAL 5 HG11 VAL 5 120.325 -6.643 -6.889 23 HG12 VAL 5 HG12 VAL 5 121.979 -6.403 -6.327 24 HG13 VAL 5 HG13 VAL 5 120.637 -6.299 -5.188 25 HG21 VAL 5 HG21 VAL 5 122.516 -9.500 -4.665 26 HG22 VAL 5 HG22 VAL 5 122.873 -7.774 -4.647 27 HG23 VAL 5 HG23 VAL 5 123.214 -8.730 -6.089 28 H THR 6 H THR 6 118.389 -6.881 -4.116 29 HA THR 6 HA THR 6 116.526 -7.472 -6.323 30 HB THR 6 HB THR 6 115.745 -7.834 -3.412 31 HG1 THR 6 HG1 THR 6 116.682 -9.685 -3.778 32 HG21 THR 6 HG21 THR 6 114.105 -8.799 -5.707 33 HG22 THR 6 HG22 THR 6 114.101 -7.067 -5.377 34 HG23 THR 6 HG23 THR 6 113.590 -8.204 -4.129 35 H GLY 7 H GLY 7 115.501 -5.560 -6.901 36 HA2 GLY 7 HA2 GLY 7 114.682 -3.575 -4.978 37 H GLY 8 H GLY 8 114.123 -1.436 -6.286 38 HA2 GLY 8 HA2 GLY 8 113.770 -1.469 -9.092 39 H TYR 9 H TYR 9 110.733 -0.711 -8.096 40 HA TYR 9 HA TYR 9 111.442 2.027 -7.113 41 HB2 TYR 9 HB2 TYR 9 111.129 1.746 -9.672 42 HD1 TYR 9 HD2 TYR 9 112.221 3.900 -9.129 43 HD2 TYR 9 HD1 TYR 9 108.003 3.307 -8.580 44 HE1 TYR 9 HE2 TYR 9 111.897 6.353 -8.983 45 HE2 TYR 9 HE1 TYR 9 107.678 5.763 -8.435 46 HH TYR 9 HH TYR 9 109.983 7.978 -9.403 47 H ALA 10 H ALA 10 109.535 3.085 -6.040 48 HA ALA 10 HA ALA 10 107.338 1.148 -5.388 49 HB1 ALA 10 HB1 ALA 10 109.389 1.496 -3.740 50 HB2 ALA 10 HB2 ALA 10 107.747 1.364 -3.110 51 HB3 ALA 10 HB3 ALA 10 108.496 2.950 -3.292 52 H GLN 11 H GLN 11 105.466 2.124 -5.988 53 HA GLN 11 HA GLN 11 105.228 5.105 -5.775 54 HB2 GLN 11 HB2 GLN 11 103.681 2.997 -7.330 55 HG2 GLN 11 HG2 GLN 11 105.620 5.143 -8.251 56 HE21 GLN 11 HE21 GLN 11 106.085 4.846 -10.650 57 HE22 GLN 11 HE22 GLN 11 104.847 4.253 -11.648 58 H SER 12 H SER 12 103.474 5.945 -4.501 59 HA SER 12 HA SER 12 101.639 3.970 -3.237 60 HB2 SER 12 HB2 SER 12 102.383 4.552 -1.030 61 HG SER 12 HG SER 12 104.134 6.421 -2.220 62 H ASP 13 H ASP 13 99.794 4.915 -2.256 63 HA ASP 13 HA ASP 13 98.931 7.493 -3.348 64 HB2 ASP 13 HB2 ASP 13 97.507 5.421 -2.979 65 H ALA 14 H ALA 14 98.424 9.364 -1.940 66 HA ALA 14 HA ALA 14 99.899 9.273 0.670 67 HB1 ALA 14 HB1 ALA 14 101.100 11.083 -0.005 68 HB2 ALA 14 HB2 ALA 14 99.701 11.841 -0.766 69 HB3 ALA 14 HB3 ALA 14 100.604 10.592 -1.624 70 H GLN 15 H GLN 15 98.072 9.112 2.043 71 HA GLN 15 HA GLN 15 95.745 10.870 1.690 72 HB2 GLN 15 HB2 GLN 15 96.671 9.026 3.922 73 HG2 GLN 15 HG2 GLN 15 94.600 8.657 1.733 74 HE21 GLN 15 HE21 GLN 15 93.776 6.344 1.761 75 HE22 GLN 15 HE22 GLN 15 93.683 5.530 3.247 76 H GLY 16 H GLY 16 95.953 13.004 2.200 77 HA2 GLY 16 HA2 GLY 16 96.190 14.745 3.895 78 H GLN 17 H GLN 17 98.345 13.238 1.731 79 HA GLN 17 HA GLN 17 100.024 15.715 1.531 80 HB2 GLN 17 HB2 GLN 17 100.567 12.816 0.829 81 HG2 GLN 17 HG2 GLN 17 101.806 14.673 2.881 82 HE21 GLN 17 HE21 GLN 17 103.357 13.423 4.304 83 HE22 GLN 17 HE22 GLN 17 104.205 12.111 3.639 84 H MET 18 H MET 18 100.575 16.336 -0.733 85 HA MET 18 HA MET 18 98.300 15.767 -2.569 86 HB2 MET 18 HB2 MET 18 98.969 18.090 -1.909 87 HG2 MET 18 HG2 MET 18 99.282 17.321 -4.827 88 HE1 MET 18 HE1 MET 18 97.413 19.715 -2.789 89 HE2 MET 18 HE2 MET 18 97.856 21.341 -3.301 90 HE3 MET 18 HE3 MET 18 98.882 20.474 -2.161 91 H ASN 19 H ASN 19 98.586 14.729 -4.518 92 HA ASN 19 HA ASN 19 99.634 13.571 -6.280 93 HB2 ASN 19 HB2 ASN 19 100.887 15.850 -6.200 94 HD21 ASN 19 HD21 ASN 19 103.354 15.575 -7.570 95 HD22 ASN 19 HD22 ASN 19 103.130 14.572 -8.920 96 H LYS 20 H LYS 20 100.510 11.538 -6.431 97 HA LYS 20 HA LYS 20 101.310 10.122 -4.044 98 HB2 LYS 20 HB2 LYS 20 101.481 9.469 -7.005 99 HG2 LYS 20 HG2 LYS 20 99.414 8.850 -4.871 100 HD2 LYS 20 HD2 LYS 20 99.638 7.965 -7.765 101 HE2 LYS 20 HE2 LYS 20 97.439 6.711 -6.966 102 HZ1 LYS 20 HZ1 LYS 20 97.504 9.610 -7.639 103 HZ2 LYS 20 HZ2 LYS 20 96.298 8.492 -8.066 104 HZ3 LYS 20 HZ3 LYS 20 97.848 8.379 -8.753 105 H MET 21 H MET 21 103.464 8.713 -4.257 106 HA MET 21 HA MET 21 105.693 10.520 -5.140 107 HB2 MET 21 HB2 MET 21 105.425 8.871 -2.605 108 HG2 MET 21 HG2 MET 21 105.404 11.859 -3.135 109 HE1 MET 21 HE1 MET 21 104.209 9.398 -0.660 110 HE2 MET 21 HE2 MET 21 104.973 9.763 0.885 111 HE3 MET 21 HE3 MET 21 105.876 8.890 -0.351 112 H GLY 22 H GLY 22 107.813 9.247 -5.278 113 HA2 GLY 22 HA2 GLY 22 107.520 6.351 -5.795 114 H GLY 23 H GLY 23 109.377 5.338 -5.123 115 HA2 GLY 23 HA2 GLY 23 111.916 6.918 -5.197 116 H PHE 24 H PHE 24 113.796 5.331 -4.509 117 HA PHE 24 HA PHE 24 113.474 2.844 -6.149 118 HB2 PHE 24 HB2 PHE 24 115.097 4.612 -6.861 119 HD1 PHE 24 HD1 PHE 24 115.025 2.763 -8.524 120 HD2 PHE 24 HD2 PHE 24 117.354 2.487 -4.925 121 HE1 PHE 24 HE1 PHE 24 116.284 0.856 -9.485 122 HE2 PHE 24 HE2 PHE 24 118.613 0.579 -5.886 123 HZ PHE 24 HZ PHE 24 118.079 -0.236 -8.167 124 H ASN 25 H ASN 25 113.957 0.859 -5.188 125 HA ASN 25 HA ASN 25 114.793 0.939 -2.304 126 HB2 ASN 25 HB2 ASN 25 112.414 0.349 -2.779 127 HD21 ASN 25 HD21 ASN 25 113.216 0.344 -0.415 128 HD22 ASN 25 HD22 ASN 25 113.390 -1.161 0.351 129 H LEU 26 H LEU 26 116.686 -0.099 -1.896 130 HA LEU 26 HA LEU 26 117.593 -2.276 -3.766 131 HB2 LEU 26 HB2 LEU 26 118.895 -0.119 -3.833 132 HG LEU 26 HG LEU 26 120.221 -2.593 -2.700 133 HD11 LEU 26 HD11 LEU 26 120.956 -2.833 -5.070 134 HD12 LEU 26 HD12 LEU 26 120.019 -1.397 -5.481 135 HD13 LEU 26 HD13 LEU 26 119.200 -2.850 -4.908 136 HD21 LEU 26 HD21 LEU 26 121.555 -0.505 -2.242 137 HD22 LEU 26 HD22 LEU 26 121.573 -0.197 -3.978 138 HD23 LEU 26 HD23 LEU 26 122.361 -1.635 -3.330 139 H LYS 27 H LYS 27 118.020 -4.303 -2.629 140 HA LYS 27 HA LYS 27 118.172 -4.096 0.341 141 HB2 LYS 27 HB2 LYS 27 115.861 -4.505 -0.464 142 HG2 LYS 27 HG2 LYS 27 117.117 -6.976 0.764 143 HD2 LYS 27 HD2 LYS 27 114.832 -7.019 1.902 144 HE2 LYS 27 HE2 LYS 27 115.337 -7.544 -1.020 145 HZ1 LYS 27 HZ1 LYS 27 112.780 -8.067 0.406 146 HZ2 LYS 27 HZ2 LYS 27 113.103 -8.285 -1.247 147 HZ3 LYS 27 HZ3 LYS 27 113.018 -6.719 -0.595 148 H TYR 28 H TYR 28 119.446 -5.677 1.302 149 HA TYR 28 HA TYR 28 120.949 -7.517 -0.532 150 HB2 TYR 28 HB2 TYR 28 121.620 -6.350 2.195 151 HD1 TYR 28 HD1 TYR 28 123.402 -6.609 -1.074 152 HD2 TYR 28 HD2 TYR 28 121.518 -4.019 1.788 153 HE1 TYR 28 HE1 TYR 28 124.230 -4.630 -2.319 154 HE2 TYR 28 HE2 TYR 28 122.345 -2.040 0.543 155 HH TYR 28 HH TYR 28 124.740 -2.230 -1.825 156 H ARG 29 H ARG 29 121.052 -9.742 0.054 157 HA ARG 29 HA ARG 29 119.361 -10.556 2.402 158 HB2 ARG 29 HB2 ARG 29 118.278 -10.772 0.168 159 HG2 ARG 29 HG2 ARG 29 119.011 -13.360 1.572 160 HD2 ARG 29 HD2 ARG 29 118.120 -13.777 -0.713 161 HE ARG 29 HE ARG 29 116.835 -11.607 -0.887 162 HH11 ARG 29 HH21 ARG 29 115.320 -13.078 1.617 163 HH12 ARG 29 HH22 ARG 29 113.737 -13.119 0.916 164 HH21 ARG 29 HH11 ARG 29 114.823 -12.203 -2.246 165 HH22 ARG 29 HH12 ARG 29 113.455 -12.623 -1.270 166 H TYR 30 H TYR 30 120.062 -12.365 3.555 167 HA TYR 30 HA TYR 30 122.576 -13.725 2.662 168 HB2 TYR 30 HB2 TYR 30 123.027 -11.873 4.290 169 HD1 TYR 30 HD1 TYR 30 125.147 -12.959 3.577 170 HD2 TYR 30 HD2 TYR 30 122.652 -14.651 6.637 171 HE1 TYR 30 HE1 TYR 30 127.021 -14.415 4.300 172 HE2 TYR 30 HE2 TYR 30 124.526 -16.107 7.360 173 HH TYR 30 HH TYR 30 127.367 -16.506 5.491 174 H GLU 31 H GLU 31 122.421 -15.965 2.935 175 HA GLU 31 HA GLU 31 120.394 -17.021 4.861 176 HB2 GLU 31 HB2 GLU 31 120.686 -17.735 1.922 177 HG2 GLU 31 HG2 GLU 31 118.478 -16.355 3.482 178 H GLU 32 H GLU 32 120.881 -19.225 5.548 179 HA GLU 32 HA GLU 32 123.705 -20.038 4.976 180 HB2 GLU 32 HB2 GLU 32 121.855 -20.563 7.328 181 HG2 GLU 32 HG2 GLU 32 124.272 -18.756 7.002 182 H ASP 33 H ASP 33 124.037 -22.043 4.092 183 HA ASP 33 HA ASP 33 121.976 -23.534 2.840 184 HB2 ASP 33 HB2 ASP 33 124.772 -24.265 3.761 185 H ASN 34 H ASN 34 123.183 -23.672 6.132 186 HA ASN 34 HA ASN 34 122.395 -26.310 6.860 187 HB2 ASN 34 HB2 ASN 34 122.490 -23.706 8.416 188 HD21 ASN 34 HD21 ASN 34 124.624 -23.592 9.638 189 HD22 ASN 34 HD22 ASN 34 125.993 -24.319 8.945 190 H SER 35 H SER 35 120.506 -23.259 6.915 191 HA SER 35 HA SER 35 118.016 -24.907 6.964 192 HB2 SER 35 HB2 SER 35 119.018 -22.916 8.971 193 HG SER 35 HG SER 35 117.301 -25.085 9.407 194 HA PRO 36 HA PRO 36 116.571 -21.709 4.284 195 HB2 PRO 36 HB2 PRO 36 113.893 -21.669 4.807 196 HG2 PRO 36 HG2 PRO 36 113.675 -22.864 6.724 197 HD2 PRO 36 HD2 PRO 36 115.571 -23.491 7.776 198 H LEU 37 H LEU 37 117.670 -20.545 6.649 199 HA LEU 37 HA LEU 37 115.712 -18.550 7.633 200 HB2 LEU 37 HB2 LEU 37 117.330 -19.745 9.117 201 HG LEU 37 HG LEU 37 117.564 -16.743 8.816 202 HD11 LEU 37 HD11 LEU 37 115.356 -17.723 9.428 203 HD12 LEU 37 HD12 LEU 37 116.035 -16.741 10.727 204 HD13 LEU 37 HD13 LEU 37 116.113 -18.500 10.819 205 HD21 LEU 37 HD21 LEU 37 119.510 -17.165 10.031 206 HD22 LEU 37 HD22 LEU 37 118.855 -18.628 10.766 207 HD23 LEU 37 HD23 LEU 37 118.322 -17.044 11.329 208 H GLY 38 H GLY 38 115.521 -16.590 6.641 209 HA2 GLY 38 HA2 GLY 38 117.900 -15.510 5.191 210 H VAL 39 H VAL 39 118.297 -13.390 5.579 211 HA VAL 39 HA VAL 39 116.171 -11.733 6.900 212 HB VAL 39 HB VAL 39 119.154 -11.855 7.495 213 HG11 VAL 39 HG11 VAL 39 118.866 -10.101 8.956 214 HG12 VAL 39 HG12 VAL 39 117.187 -10.521 9.293 215 HG13 VAL 39 HG13 VAL 39 117.603 -9.682 7.798 216 HG21 VAL 39 HG21 VAL 39 118.310 -12.729 9.728 217 HG22 VAL 39 HG22 VAL 39 118.106 -13.839 8.372 218 HG23 VAL 39 HG23 VAL 39 116.728 -12.915 8.971 219 H ILE 40 H ILE 40 115.898 -9.748 5.779 220 HA ILE 40 HA ILE 40 118.079 -9.012 3.859 221 HB ILE 40 HB ILE 40 116.225 -8.346 2.348 222 HG12 ILE 40 HG12 ILE 40 114.453 -9.502 4.532 223 HG21 ILE 40 HG21 ILE 40 115.181 -10.954 2.685 224 HG22 ILE 40 HG22 ILE 40 116.863 -11.030 3.206 225 HG23 ILE 40 HG23 ILE 40 116.467 -10.450 1.590 226 HD11 ILE 40 HD11 ILE 40 112.768 -9.581 3.029 227 HD12 ILE 40 HD12 ILE 40 114.018 -9.476 1.791 228 HD13 ILE 40 HD13 ILE 40 113.199 -8.016 2.345 229 H GLY 41 H GLY 41 118.534 -6.832 3.637 230 HA2 GLY 41 HA2 GLY 41 117.061 -4.927 5.425 231 H SER 42 H SER 42 115.993 -3.421 4.194 232 HA SER 42 HA SER 42 117.160 -2.724 1.514 233 HB2 SER 42 HB2 SER 42 115.110 -4.195 1.560 234 HG SER 42 HG SER 42 114.218 -3.105 -0.099 235 H PHE 43 H PHE 43 117.115 -0.544 0.912 236 HA PHE 43 HA PHE 43 116.169 1.400 3.000 237 HB2 PHE 43 HB2 PHE 43 118.358 1.584 0.894 238 HD1 PHE 43 HD2 PHE 43 118.334 2.518 4.482 239 HD2 PHE 43 HD1 PHE 43 119.610 -0.361 1.561 240 HE1 PHE 43 HE2 PHE 43 119.817 1.464 6.168 241 HE2 PHE 43 HE1 PHE 43 121.093 -1.415 3.247 242 HZ PHE 43 HZ PHE 43 121.196 -0.502 5.551 243 H THR 44 H THR 44 114.829 3.136 2.220 244 HA THR 44 HA THR 44 114.171 3.032 -0.709 245 HB THR 44 HB THR 44 112.266 3.348 1.632 246 HG1 THR 44 HG1 THR 44 111.647 1.238 1.058 247 HG21 THR 44 HG21 THR 44 110.531 3.029 -0.104 248 HG22 THR 44 HG22 THR 44 111.789 2.995 -1.340 249 HG23 THR 44 HG23 THR 44 111.503 4.468 -0.414 250 H TYR 45 H TYR 45 113.972 5.064 -1.690 251 HA TYR 45 HA TYR 45 113.875 7.464 0.088 252 HB2 TYR 45 HB2 TYR 45 116.190 6.854 -0.762 253 HD1 TYR 45 HD1 TYR 45 116.140 8.793 0.854 254 HD2 TYR 45 HD2 TYR 45 115.328 9.255 -3.338 255 HE1 TYR 45 HE1 TYR 45 116.549 11.231 1.044 256 HE2 TYR 45 HE2 TYR 45 115.736 11.694 -3.148 257 HH TYR 45 HH TYR 45 116.972 13.239 -1.654 258 H THR 46 H THR 46 111.840 8.244 -0.462 259 HA THR 46 HA THR 46 111.111 8.303 -3.376 260 HB THR 46 HB THR 46 109.317 8.081 -0.940 261 HG1 THR 46 HG1 THR 46 110.192 6.154 -0.960 262 HG21 THR 46 HG21 THR 46 108.699 8.806 -3.541 263 HG22 THR 46 HG22 THR 46 107.569 8.134 -2.365 264 HG23 THR 46 HG23 THR 46 108.372 7.072 -3.518 265 H GLU 47 H GLU 47 110.242 10.243 -4.178 266 HA GLU 47 HA GLU 47 109.836 12.485 -2.243 267 HB2 GLU 47 HB2 GLU 47 111.501 12.463 -4.779 268 HG2 GLU 47 HG2 GLU 47 112.197 12.887 -1.856 269 H LYS 48 H LYS 48 108.631 14.312 -3.303 270 HA LYS 48 HA LYS 48 106.330 13.357 -4.781 271 HB2 LYS 48 HB2 LYS 48 106.447 15.251 -3.111 272 HG2 LYS 48 HG2 LYS 48 105.398 15.921 -5.879 273 HD2 LYS 48 HD2 LYS 48 104.766 17.046 -3.135 274 HE2 LYS 48 HE2 LYS 48 103.142 16.838 -5.591 275 HZ1 LYS 48 HZ1 LYS 48 103.540 19.451 -4.219 276 HZ2 LYS 48 HZ2 LYS 48 102.500 19.149 -5.527 277 HZ3 LYS 48 HZ3 LYS 48 104.184 19.061 -5.738 278 H SER 49 H SER 49 105.847 13.680 -6.996 279 HA SER 49 HA SER 49 107.961 13.643 -8.892 280 HB2 SER 49 HB2 SER 49 105.074 14.513 -9.224 281 HG SER 49 HG SER 49 105.620 11.996 -9.935 282 H ARG 50 H ARG 50 108.794 15.272 -10.278 283 HA ARG 50 HA ARG 50 108.108 18.103 -9.557 284 HB2 ARG 50 HB2 ARG 50 110.806 16.797 -10.036 285 HG2 ARG 50 HG2 ARG 50 109.517 18.064 -7.599 286 HD2 ARG 50 HD2 ARG 50 111.928 18.641 -7.760 287 HE ARG 50 HE ARG 50 112.223 15.701 -8.264 288 HH11 ARG 50 HH11 ARG 50 112.750 17.516 -10.518 289 HH12 ARG 50 HH12 ARG 50 114.460 17.773 -10.426 290 HH21 ARG 50 HH21 ARG 50 114.722 16.638 -7.160 291 HH22 ARG 50 HH22 ARG 50 115.577 17.276 -8.525 292 H THR 51 H THR 51 108.489 19.636 -11.320 293 HA THR 51 HA THR 51 108.296 18.352 -14.017 294 HB THR 51 HB THR 51 107.181 20.457 -14.632 295 HG1 THR 51 HG1 THR 51 108.125 21.993 -13.458 296 HG21 THR 51 HG21 THR 51 105.926 18.603 -13.430 297 HG22 THR 51 HG22 THR 51 105.193 20.203 -13.319 298 HG23 THR 51 HG23 THR 51 106.102 19.553 -11.954 299 H ALA 52 H ALA 52 109.431 19.505 -15.801 300 HA ALA 52 HA ALA 52 112.186 20.013 -15.259 301 HB1 ALA 52 HB1 ALA 52 110.610 21.061 -17.619 302 HB2 ALA 52 HB2 ALA 52 110.958 19.344 -17.423 303 HB3 ALA 52 HB3 ALA 52 112.281 20.498 -17.593 304 H SER 53 H SER 53 109.412 22.203 -15.571 305 HA SER 53 HA SER 53 110.853 24.678 -15.649 306 HB2 SER 53 HB2 SER 53 108.679 25.620 -15.083 307 HG SER 53 HG SER 53 107.724 24.588 -13.535 308 H SER 54 H SER 54 110.050 22.499 -13.020 309 HA SER 54 HA SER 54 110.309 24.286 -10.804 310 HB2 SER 54 HB2 SER 54 110.974 21.337 -11.067 311 HG SER 54 HG SER 54 108.579 22.704 -10.427 312 H GLY 55 H GLY 55 112.147 24.579 -9.382 313 HA2 GLY 55 HA2 GLY 55 114.675 24.875 -10.802 314 H ASP 56 H ASP 56 116.514 24.249 -8.764 315 HA ASP 56 HA ASP 56 116.558 21.283 -8.992 316 HB2 ASP 56 HB2 ASP 56 118.596 23.389 -8.205 317 H TYR 57 H TYR 57 115.179 23.272 -6.835 318 HA TYR 57 HA TYR 57 116.339 22.237 -4.336 319 HB2 TYR 57 HB2 TYR 57 115.472 24.558 -4.661 320 HD1 TYR 57 HD2 TYR 57 116.600 24.341 -2.455 321 HD2 TYR 57 HD1 TYR 57 112.543 23.067 -3.062 322 HE1 TYR 57 HE2 TYR 57 116.251 24.283 0.000 323 HE2 TYR 57 HE1 TYR 57 112.194 23.009 -0.607 324 HH TYR 57 HH TYR 57 113.203 24.100 1.418 325 H ASN 58 H ASN 58 115.313 20.731 -2.963 326 HA ASN 58 HA ASN 58 113.016 19.225 -4.170 327 HB2 ASN 58 HB2 ASN 58 115.309 18.142 -3.885 328 HD21 ASN 58 HD21 ASN 58 114.089 16.474 -1.216 329 HD22 ASN 58 HD22 ASN 58 113.092 15.371 -2.035 330 H LYS 59 H LYS 59 111.129 19.601 -3.080 331 HA LYS 59 HA LYS 59 110.821 21.061 -0.695 332 HB2 LYS 59 HB2 LYS 59 109.122 18.885 -1.953 333 HG2 LYS 59 HG2 LYS 59 109.111 21.913 -2.136 334 HD2 LYS 59 HD2 LYS 59 107.236 19.832 -3.304 335 HE2 LYS 59 HE2 LYS 59 107.849 22.664 -4.039 336 HZ1 LYS 59 HZ1 LYS 59 105.111 21.491 -4.003 337 HZ2 LYS 59 HZ2 LYS 59 105.535 23.052 -4.526 338 HZ3 LYS 59 HZ3 LYS 59 105.673 22.635 -2.884 339 H ASN 60 H ASN 60 109.594 17.758 -0.391 340 HA ASN 60 HA ASN 60 111.259 17.473 2.079 341 HB2 ASN 60 HB2 ASN 60 109.345 16.106 2.875 342 HD21 ASN 60 HD21 ASN 60 106.773 17.442 1.511 343 HD22 ASN 60 HD22 ASN 60 106.393 16.311 0.304 344 H GLN 61 H GLN 61 111.855 15.217 2.650 345 HA GLN 61 HA GLN 61 112.209 13.480 0.219 346 HB2 GLN 61 HB2 GLN 61 114.038 14.005 2.587 347 HG2 GLN 61 HG2 GLN 61 114.323 14.673 -0.360 348 HE21 GLN 61 HE21 GLN 61 116.305 16.109 -0.675 349 HE22 GLN 61 HE22 GLN 61 117.650 15.857 0.330 350 H TYR 62 H TYR 62 112.131 11.157 0.654 351 HA TYR 62 HA TYR 62 110.834 10.483 3.278 352 HB2 TYR 62 HB2 TYR 62 109.375 10.431 1.250 353 HD1 TYR 62 HD1 TYR 62 108.077 9.920 3.313 354 HD2 TYR 62 HD2 TYR 62 110.419 6.930 1.305 355 HE1 TYR 62 HE1 TYR 62 106.878 8.143 4.560 356 HE2 TYR 62 HE2 TYR 62 109.220 5.153 2.552 357 HH TYR 62 HH TYR 62 107.937 5.109 4.907 358 H TYR 63 H TYR 63 112.593 9.671 4.371 359 HA TYR 63 HA TYR 63 114.261 7.545 3.067 360 HB2 TYR 63 HB2 TYR 63 115.291 9.563 4.195 361 HD1 TYR 63 HD2 TYR 63 117.004 8.227 2.981 362 HD2 TYR 63 HD1 TYR 63 115.588 7.098 6.875 363 HE1 TYR 63 HE2 TYR 63 118.946 6.707 3.246 364 HE2 TYR 63 HE1 TYR 63 117.530 5.578 7.141 365 HH TYR 63 HH TYR 63 119.108 4.310 5.491 366 H GLY 64 H GLY 64 114.230 5.376 3.951 367 HA2 GLY 64 HA2 GLY 64 112.729 4.974 6.451 368 H ILE 65 H ILE 65 112.871 2.839 7.229 369 HA ILE 65 HA ILE 65 115.128 1.224 6.064 370 HB ILE 65 HB ILE 65 115.722 0.683 8.408 371 HG12 ILE 65 HG12 ILE 65 113.529 2.645 9.158 372 HG21 ILE 65 HG21 ILE 65 116.607 2.747 7.233 373 HG22 ILE 65 HG22 ILE 65 116.638 2.828 8.994 374 HG23 ILE 65 HG23 ILE 65 115.380 3.676 8.095 375 HD11 ILE 65 HD11 ILE 65 115.737 1.265 10.598 376 HD12 ILE 65 HD12 ILE 65 114.179 1.319 11.422 377 HD13 ILE 65 HD13 ILE 65 114.971 2.817 10.936 378 H THR 66 H THR 66 114.660 -0.973 5.775 379 HA THR 66 HA THR 66 112.301 -2.120 7.162 380 HB THR 66 HB THR 66 111.348 -2.805 4.956 381 HG1 THR 66 HG1 THR 66 112.224 -1.750 3.121 382 HG21 THR 66 HG21 THR 66 110.345 -0.706 4.480 383 HG22 THR 66 HG22 THR 66 111.772 0.183 5.012 384 HG23 THR 66 HG23 THR 66 110.754 -0.638 6.194 385 H ALA 67 H ALA 67 112.545 -4.319 7.506 386 HA ALA 67 HA ALA 67 114.310 -5.960 5.846 387 HB1 ALA 67 HB1 ALA 67 115.391 -6.443 8.343 388 HB2 ALA 67 HB2 ALA 67 115.113 -4.702 8.392 389 HB3 ALA 67 HB3 ALA 67 116.122 -5.398 7.124 390 H GLY 68 H GLY 68 113.993 -8.266 6.406 391 HA2 GLY 68 HA2 GLY 68 112.294 -9.010 8.634 392 HA PRO 69 HA PRO 69 113.764 -13.026 7.728 393 HB2 PRO 69 HB2 PRO 69 111.593 -14.676 7.975 394 HG2 PRO 69 HG2 PRO 69 109.893 -13.124 7.929 395 HD2 PRO 69 HD2 PRO 69 110.300 -10.874 8.094 396 H ALA 70 H ALA 70 113.621 -14.900 6.185 397 HA ALA 70 HA ALA 70 111.895 -14.457 3.798 398 HB1 ALA 70 HB1 ALA 70 114.329 -14.948 2.645 399 HB2 ALA 70 HB2 ALA 70 114.809 -14.010 4.059 400 HB3 ALA 70 HB3 ALA 70 113.670 -13.331 2.896 401 H TYR 71 H TYR 71 111.367 -16.405 2.788 402 HA TYR 71 HA TYR 71 112.745 -18.869 3.819 403 HB2 TYR 71 HB2 TYR 71 110.433 -18.401 4.690 404 HD1 TYR 71 HD2 TYR 71 111.681 -20.428 5.646 405 HD2 TYR 71 HD1 TYR 71 109.358 -20.580 2.042 406 HE1 TYR 71 HE2 TYR 71 111.567 -22.899 5.825 407 HE2 TYR 71 HE1 TYR 71 109.245 -23.051 2.214 408 HH TYR 71 HH TYR 71 109.765 -24.729 4.871 409 H ARG 72 H ARG 72 113.229 -20.446 2.267 410 HA ARG 72 HA ARG 72 113.053 -19.561 -0.566 411 HB2 ARG 72 HB2 ARG 72 115.198 -20.245 0.508 412 HG2 ARG 72 HG2 ARG 72 114.196 -22.079 -1.693 413 HD2 ARG 72 HD2 ARG 72 117.017 -21.336 -0.824 414 HE ARG 72 HE ARG 72 117.237 -21.631 -3.177 415 HH11 ARG 72 HH21 ARG 72 116.754 -24.602 -1.961 416 HH12 ARG 72 HH22 ARG 72 115.886 -25.264 -3.306 417 HH21 ARG 72 HH11 ARG 72 115.406 -22.193 -4.846 418 HH22 ARG 72 HH12 ARG 72 115.122 -23.899 -4.940 419 H ILE 73 H ILE 73 111.543 -20.433 -1.898 420 HA ILE 73 HA ILE 73 110.430 -23.137 -1.270 421 HB ILE 73 HB ILE 73 109.007 -20.674 -2.351 422 HG12 ILE 73 HG12 ILE 73 108.719 -22.073 0.327 423 HG21 ILE 73 HG21 ILE 73 107.966 -22.629 -3.264 424 HG22 ILE 73 HG22 ILE 73 106.968 -22.140 -1.894 425 HG23 ILE 73 HG23 ILE 73 108.089 -23.492 -1.731 426 HD11 ILE 73 HD11 ILE 73 107.319 -20.124 0.879 427 HD12 ILE 73 HD12 ILE 73 106.672 -20.969 -0.527 428 HD13 ILE 73 HD13 ILE 73 107.577 -19.470 -0.738 429 H ASN 74 H ASN 74 111.121 -24.438 -2.904 430 HA ASN 74 HA ASN 74 111.731 -25.181 -5.068 431 HB2 ASN 74 HB2 ASN 74 109.724 -23.005 -5.760 432 HD21 ASN 74 HD21 ASN 74 107.542 -23.636 -5.397 433 HD22 ASN 74 HD22 ASN 74 107.100 -25.121 -4.703 434 H ASP 75 H ASP 75 112.435 -24.119 -7.364 435 HA ASP 75 HA ASP 75 114.544 -22.163 -6.667 436 HB2 ASP 75 HB2 ASP 75 115.398 -22.798 -8.906 437 H TRP 76 H TRP 76 111.416 -21.679 -7.385 438 HA TRP 76 HA TRP 76 112.030 -19.190 -8.912 439 HB2 TRP 76 HB2 TRP 76 109.977 -19.697 -10.313 440 HD1 TRP 76 HD1 TRP 76 108.532 -20.883 -7.896 441 HE1 TRP 76 HE1 TRP 76 107.486 -23.231 -7.947 442 HE3 TRP 76 HE3 TRP 76 111.173 -22.950 -11.753 443 HZ2 TRP 76 HZ2 TRP 76 107.724 -25.664 -9.424 444 HZ3 TRP 76 HZ3 TRP 76 110.736 -25.283 -12.462 445 HH2 TRP 76 HH2 TRP 76 109.015 -26.642 -11.303 446 H ALA 77 H ALA 77 111.129 -19.973 -6.047 447 HA ALA 77 HA ALA 77 108.982 -17.920 -5.905 448 HB1 ALA 77 HB1 ALA 77 107.591 -19.773 -6.082 449 HB2 ALA 77 HB2 ALA 77 107.823 -19.717 -4.335 450 HB3 ALA 77 HB3 ALA 77 108.758 -20.848 -5.313 451 H SER 78 H SER 78 109.567 -16.555 -4.292 452 HA SER 78 HA SER 78 110.809 -17.688 -1.807 453 HB2 SER 78 HB2 SER 78 111.648 -15.216 -3.361 454 HG SER 78 HG SER 78 113.537 -17.072 -2.988 455 H ILE 79 H ILE 79 110.160 -16.549 0.131 456 HA ILE 79 HA ILE 79 108.177 -14.337 -0.311 457 HB ILE 79 HB ILE 79 106.833 -15.380 1.492 458 HG12 ILE 79 HG12 ILE 79 108.866 -17.630 1.340 459 HG21 ILE 79 HG21 ILE 79 106.255 -16.018 -0.755 460 HG22 ILE 79 HG22 ILE 79 106.229 -17.487 0.221 461 HG23 ILE 79 HG23 ILE 79 107.600 -17.156 -0.838 462 HD11 ILE 79 HD11 ILE 79 107.533 -18.770 2.879 463 HD12 ILE 79 HD12 ILE 79 106.309 -17.985 1.881 464 HD13 ILE 79 HD13 ILE 79 106.748 -17.295 3.444 465 H TYR 80 H TYR 80 108.408 -12.592 1.072 466 HA TYR 80 HA TYR 80 110.097 -12.897 3.501 467 HB2 TYR 80 HB2 TYR 80 111.630 -11.177 2.767 468 HD1 TYR 80 HD2 TYR 80 110.185 -11.915 -0.564 469 HD2 TYR 80 HD1 TYR 80 110.811 -8.931 2.462 470 HE1 TYR 80 HE2 TYR 80 109.478 -10.150 -2.158 471 HE2 TYR 80 HE1 TYR 80 110.106 -7.167 0.868 472 HH TYR 80 HH TYR 80 109.891 -7.648 -2.426 473 H GLY 81 H GLY 81 110.095 -10.842 4.794 474 HA2 GLY 81 HA2 GLY 81 107.577 -9.270 4.396 475 H VAL 82 H VAL 82 107.672 -7.137 5.600 476 HA VAL 82 HA VAL 82 110.477 -6.151 5.934 477 HB VAL 82 HB VAL 82 109.802 -4.149 4.621 478 HG11 VAL 82 HG11 VAL 82 109.766 -5.253 2.430 479 HG12 VAL 82 HG12 VAL 82 109.287 -6.773 3.187 480 HG13 VAL 82 HG13 VAL 82 110.880 -6.089 3.512 481 HG21 VAL 82 HG21 VAL 82 107.502 -5.129 3.276 482 HG22 VAL 82 HG22 VAL 82 107.601 -3.732 4.347 483 HG23 VAL 82 HG23 VAL 82 107.181 -5.314 5.001 484 H VAL 83 H VAL 83 110.718 -4.837 7.687 485 HA VAL 83 HA VAL 83 108.334 -3.540 8.917 486 HB VAL 83 HB VAL 83 108.706 -5.747 9.984 487 HG11 VAL 83 HG11 VAL 83 111.451 -5.018 9.672 488 HG12 VAL 83 HG12 VAL 83 110.792 -6.532 10.288 489 HG13 VAL 83 HG13 VAL 83 111.142 -5.208 11.398 490 HG21 VAL 83 HG21 VAL 83 109.361 -3.256 11.564 491 HG22 VAL 83 HG22 VAL 83 109.176 -4.826 12.347 492 HG23 VAL 83 HG23 VAL 83 107.824 -4.115 11.466 493 H GLY 84 H GLY 84 108.917 -1.581 10.051 494 HA2 GLY 84 HA2 GLY 84 111.310 -0.719 10.996 495 H VAL 85 H VAL 85 111.578 1.739 9.488 496 HA VAL 85 HA VAL 85 108.963 3.061 10.107 497 HB VAL 85 HB VAL 85 110.266 4.824 11.273 498 HG11 VAL 85 HG11 VAL 85 110.861 3.459 13.236 499 HG12 VAL 85 HG12 VAL 85 110.819 2.003 12.241 500 HG13 VAL 85 HG13 VAL 85 109.338 2.914 12.534 501 HG21 VAL 85 HG21 VAL 85 112.606 4.661 11.589 502 HG22 VAL 85 HG22 VAL 85 112.382 4.245 9.890 503 HG23 VAL 85 HG23 VAL 85 112.643 2.972 11.082 504 H GLY 86 H GLY 86 109.409 5.540 9.649 505 HA2 GLY 86 HA2 GLY 86 110.691 5.932 6.977 506 H TYR 87 H TYR 87 111.234 8.181 6.532 507 HA TYR 87 HA TYR 87 110.969 9.967 8.932 508 HB2 TYR 87 HB2 TYR 87 113.264 9.563 6.990 509 HD1 TYR 87 HD1 TYR 87 113.132 10.113 10.661 510 HD2 TYR 87 HD2 TYR 87 113.715 7.264 7.500 511 HE1 TYR 87 HE1 TYR 87 113.931 8.444 12.312 512 HE2 TYR 87 HE2 TYR 87 114.513 5.595 9.151 513 HH TYR 87 HH TYR 87 114.042 5.884 12.430 514 H GLY 88 H GLY 88 110.130 11.972 8.484 515 HA2 GLY 88 HA2 GLY 88 109.830 12.713 5.601 516 H LYS 89 H LYS 89 111.263 14.294 5.123 517 HA LYS 89 HA LYS 89 112.044 16.253 7.236 518 HB2 LYS 89 HB2 LYS 89 113.170 15.540 4.506 519 HG2 LYS 89 HG2 LYS 89 114.086 14.929 7.333 520 HD2 LYS 89 HD2 LYS 89 115.387 14.405 4.643 521 HE2 LYS 89 HE2 LYS 89 116.776 13.630 7.146 522 HZ1 LYS 89 HZ1 LYS 89 117.523 13.409 4.814 523 HZ2 LYS 89 HZ2 LYS 89 116.240 12.335 4.517 524 HZ3 LYS 89 HZ3 LYS 89 117.467 11.915 5.614 525 H PHE 90 H PHE 90 110.854 18.119 7.201 526 HA PHE 90 HA PHE 90 109.954 19.175 4.538 527 HB2 PHE 90 HB2 PHE 90 108.634 19.283 7.271 528 HD1 PHE 90 HD1 PHE 90 107.246 18.642 3.894 529 HD2 PHE 90 HD2 PHE 90 108.484 16.906 7.622 530 HE1 PHE 90 HE1 PHE 90 106.182 16.497 3.248 531 HE2 PHE 90 HE2 PHE 90 107.420 14.761 6.977 532 HZ PHE 90 HZ PHE 90 106.268 14.557 4.790 533 H GLN 91 H GLN 91 110.122 21.446 4.262 534 HA GLN 91 HA GLN 91 111.149 23.560 4.535 535 HB2 GLN 91 HB2 GLN 91 110.378 22.846 7.384 536 HG2 GLN 91 HG2 GLN 91 108.897 24.395 5.234 537 HE21 GLN 91 HE21 GLN 91 106.601 24.862 6.015 538 HE22 GLN 91 HE22 GLN 91 106.355 25.143 7.671 539 H THR 92 H THR 92 113.055 21.462 4.401 540 HA THR 92 HA THR 92 114.938 21.683 6.636 541 HB THR 92 HB THR 92 115.235 20.522 3.847 542 HG1 THR 92 HG1 THR 92 113.790 19.198 4.582 543 HG21 THR 92 HG21 THR 92 116.758 20.151 6.434 544 HG22 THR 92 HG22 THR 92 117.385 20.726 4.889 545 HG23 THR 92 HG23 THR 92 116.895 19.042 5.070 546 H THR 93 H THR 93 116.546 23.200 6.802 547 HA THR 93 HA THR 93 117.464 24.609 4.335 548 HB THR 93 HB THR 93 115.624 25.854 5.507 549 HG1 THR 93 HG1 THR 93 116.793 27.807 5.566 550 HG21 THR 93 HG21 THR 93 116.915 25.040 7.816 551 HG22 THR 93 HG22 THR 93 115.655 26.271 7.729 552 HG23 THR 93 HG23 THR 93 117.353 26.744 7.699 553 H GLU 94 H GLU 94 119.615 25.478 4.531 554 HA GLU 94 HA GLU 94 121.426 23.976 6.191 555 HB2 GLU 94 HB2 GLU 94 121.708 26.533 4.579 556 HG2 GLU 94 HG2 GLU 94 122.343 23.627 3.972 557 H TYR 95 H TYR 95 119.867 27.126 6.540 558 HA TYR 95 HA TYR 95 121.501 27.939 8.836 559 HB2 TYR 95 HB2 TYR 95 119.201 28.960 7.220 560 HD1 TYR 95 HD1 TYR 95 122.188 29.901 9.301 561 HD2 TYR 95 HD2 TYR 95 120.123 30.296 5.555 562 HE1 TYR 95 HE1 TYR 95 124.025 31.327 8.439 563 HE2 TYR 95 HE2 TYR 95 121.959 31.722 4.693 564 HH TYR 95 HH TYR 95 124.155 33.215 6.555 565 HA PRO 96 HA PRO 96 119.079 26.146 12.040 566 HB2 PRO 96 HB2 PRO 96 118.929 28.154 13.899 567 HG2 PRO 96 HG2 PRO 96 119.641 29.930 12.609 568 HD2 PRO 96 HD2 PRO 96 120.647 29.632 10.562 569 H THR 97 H THR 97 116.894 25.979 12.674 570 HA THR 97 HA THR 97 115.032 27.948 11.422 571 HB THR 97 HB THR 97 113.419 26.082 11.658 572 HG1 THR 97 HG1 THR 97 114.177 24.131 12.519 573 HG21 THR 97 HG21 THR 97 114.344 24.713 9.978 574 HG22 THR 97 HG22 THR 97 115.985 24.915 10.592 575 HG23 THR 97 HG23 THR 97 115.182 26.251 9.766 576 H TYR 98 H TYR 98 116.489 27.977 14.235 577 HA TYR 98 HA TYR 98 115.959 28.766 16.387 578 HB2 TYR 98 HB2 TYR 98 113.360 29.520 15.007 579 HD1 TYR 98 HD1 TYR 98 116.262 31.411 16.404 580 HD2 TYR 98 HD2 TYR 98 114.029 30.346 12.893 581 HE1 TYR 98 HE1 TYR 98 117.575 33.042 15.074 582 HE2 TYR 98 HE2 TYR 98 115.342 31.976 11.563 583 HH TYR 98 HH TYR 98 116.682 33.935 11.859 584 H LYS 99 H LYS 99 114.904 25.996 15.320 585 HA LYS 99 HA LYS 99 112.946 25.544 17.552 586 HB2 LYS 99 HB2 LYS 99 113.242 24.272 14.813 587 HG2 LYS 99 HG2 LYS 99 111.037 25.894 16.121 588 HD2 LYS 99 HD2 LYS 99 111.216 24.561 13.402 589 HE2 LYS 99 HE2 LYS 99 110.151 27.005 13.746 590 HZ1 LYS 99 HZ1 LYS 99 107.994 25.095 14.493 591 HZ2 LYS 99 HZ2 LYS 99 107.891 26.791 14.455 592 HZ3 LYS 99 HZ3 LYS 99 108.855 26.022 15.623 593 H ASN 100 H ASN 100 113.355 23.735 18.892 594 HA ASN 100 HA ASN 100 116.022 22.861 19.292 595 HB2 ASN 100 HB2 ASN 100 113.996 22.758 20.832 596 HD21 ASN 100 HD21 ASN 100 113.807 20.132 22.045 597 HD22 ASN 100 HD22 ASN 100 115.374 19.653 22.489 598 H ASP 101 H ASP 101 113.352 21.257 17.531 599 HA ASP 101 HA ASP 101 115.092 20.028 15.598 600 HB2 ASP 101 HB2 ASP 101 114.876 17.679 16.449 601 H THR 102 H THR 102 113.878 18.892 13.989 602 HA THR 102 HA THR 102 110.929 18.671 14.439 603 HB THR 102 HB THR 102 112.299 19.956 12.053 604 HG1 THR 102 HG1 THR 102 110.827 21.118 14.181 605 HG21 THR 102 HG21 THR 102 109.936 18.754 11.964 606 HG22 THR 102 HG22 THR 102 110.194 20.299 11.153 607 HG23 THR 102 HG23 THR 102 109.399 20.251 12.726 608 H SER 103 H SER 103 110.344 16.605 13.877 609 HA SER 103 HA SER 103 111.459 15.377 11.426 610 HB2 SER 103 HB2 SER 103 113.062 14.904 13.277 611 HG SER 103 HG SER 103 113.298 12.920 12.585 612 H ASP 104 H ASP 104 109.913 14.080 10.475 613 HA ASP 104 HA ASP 104 107.540 13.285 12.143 614 HB2 ASP 104 HB2 ASP 104 107.291 15.124 10.382 615 H TYR 105 H TYR 105 107.622 11.049 12.412 616 HA TYR 105 HA TYR 105 108.419 9.411 10.037 617 HB2 TYR 105 HB2 TYR 105 109.802 8.054 11.537 618 HD1 TYR 105 HD2 TYR 105 109.607 11.111 13.617 619 HD2 TYR 105 HD1 TYR 105 108.769 6.904 13.389 620 HE1 TYR 105 HE2 TYR 105 109.153 11.069 16.055 621 HE2 TYR 105 HE1 TYR 105 108.315 6.862 15.827 622 HH TYR 105 HH TYR 105 107.527 9.160 17.587 623 H GLY 106 H GLY 106 107.833 7.043 10.408 624 HA2 GLY 106 HA2 GLY 106 105.651 6.476 12.282 625 H PHE 107 H PHE 107 104.776 4.073 11.491 626 HA PHE 107 HA PHE 107 107.294 2.509 11.059 627 HB2 PHE 107 HB2 PHE 107 104.619 1.846 12.331 628 HD1 PHE 107 HD2 PHE 107 108.096 1.204 13.441 629 HD2 PHE 107 HD1 PHE 107 104.607 3.663 13.913 630 HE1 PHE 107 HE2 PHE 107 109.070 2.191 15.497 631 HE2 PHE 107 HE1 PHE 107 105.580 4.650 15.969 632 HZ PHE 107 HZ PHE 107 107.812 3.914 16.762 633 H SER 108 H SER 108 107.245 0.690 9.607 634 HA SER 108 HA SER 108 104.943 0.677 7.675 635 HB2 SER 108 HB2 SER 108 107.915 0.333 7.169 636 HG SER 108 HG SER 108 106.653 2.373 5.933 637 H TYR 109 H TYR 109 104.475 -1.412 6.722 638 HA TYR 109 HA TYR 109 105.928 -3.791 7.695 639 HB2 TYR 109 HB2 TYR 109 104.300 -3.120 9.486 640 HD1 TYR 109 HD2 TYR 109 105.668 -5.076 10.194 641 HD2 TYR 109 HD1 TYR 109 102.236 -5.510 7.647 642 HE1 TYR 109 HE2 TYR 109 105.625 -7.510 10.666 643 HE2 TYR 109 HE1 TYR 109 102.194 -7.945 8.120 644 HH TYR 109 HH TYR 109 104.737 -9.604 9.438 645 H GLY 110 H GLY 110 105.531 -5.612 6.305 646 HA2 GLY 110 HA2 GLY 110 103.348 -6.027 4.609 647 H ALA 111 H ALA 111 104.153 -7.189 2.426 648 HA ALA 111 HA ALA 111 106.711 -8.599 2.602 649 HB1 ALA 111 HB1 ALA 111 105.651 -9.873 4.296 650 HB2 ALA 111 HB2 ALA 111 105.380 -10.836 2.844 651 HB3 ALA 111 HB3 ALA 111 104.089 -9.817 3.480 652 H GLY 112 H GLY 112 106.826 -10.254 0.693 653 HA2 GLY 112 HA2 GLY 112 104.665 -10.026 -1.281 654 H LEU 113 H LEU 113 105.812 -11.068 -3.482 655 HA LEU 113 HA LEU 113 107.390 -13.458 -2.596 656 HB2 LEU 113 HB2 LEU 113 105.826 -14.828 -3.999 657 HG LEU 113 HG LEU 113 105.117 -12.494 -5.170 658 HD11 LEU 113 HD11 LEU 113 104.562 -15.025 -5.645 659 HD12 LEU 113 HD12 LEU 113 103.558 -13.760 -6.355 660 HD13 LEU 113 HD13 LEU 113 103.009 -14.617 -4.914 661 HD21 LEU 113 HD21 LEU 113 102.572 -12.411 -4.295 662 HD22 LEU 113 HD22 LEU 113 103.836 -11.391 -3.607 663 HD23 LEU 113 HD23 LEU 113 103.363 -12.882 -2.791 664 H GLN 114 H GLN 114 108.632 -14.448 -4.382 665 HA GLN 114 HA GLN 114 109.005 -12.603 -6.712 666 HB2 GLN 114 HB2 GLN 114 110.854 -12.789 -5.045 667 HG2 GLN 114 HG2 GLN 114 111.454 -14.126 -7.702 668 HE21 GLN 114 HE21 GLN 114 113.300 -15.307 -6.863 669 HE22 GLN 114 HE22 GLN 114 114.664 -14.516 -6.234 670 H PHE 115 H PHE 115 108.969 -13.572 -8.784 671 HA PHE 115 HA PHE 115 108.814 -16.540 -8.965 672 HB2 PHE 115 HB2 PHE 115 106.526 -15.591 -8.628 673 HD1 PHE 115 HD2 PHE 115 106.413 -18.065 -8.774 674 HD2 PHE 115 HD1 PHE 115 106.648 -15.602 -12.285 675 HE1 PHE 115 HE2 PHE 115 105.692 -19.985 -10.169 676 HE2 PHE 115 HE1 PHE 115 105.927 -17.521 -13.680 677 HZ PHE 115 HZ PHE 115 105.448 -19.713 -12.621 678 H ASN 116 H ASN 116 109.374 -17.315 -11.031 679 HA ASN 116 HA ASN 116 109.665 -15.775 -13.422 680 HB2 ASN 116 HB2 ASN 116 111.558 -15.147 -11.417 681 HD21 ASN 116 HD21 ASN 116 110.073 -13.344 -12.453 682 HD22 ASN 116 HD22 ASN 116 110.742 -12.493 -13.760 683 HA PRO 117 HA PRO 117 110.771 -19.946 -14.597 684 HB2 PRO 117 HB2 PRO 117 110.497 -19.612 -17.293 685 HG2 PRO 117 HG2 PRO 117 110.146 -17.402 -17.609 686 HD2 PRO 117 HD2 PRO 117 110.622 -16.128 -15.811 687 H MET 118 H MET 118 112.960 -18.305 -13.938 688 HA MET 118 HA MET 118 114.940 -19.065 -15.995 689 HB2 MET 118 HB2 MET 118 114.467 -16.287 -14.872 690 HG2 MET 118 HG2 MET 118 114.266 -17.467 -17.656 691 HE1 MET 118 HE1 MET 118 116.607 -14.566 -18.296 692 HE2 MET 118 HE2 MET 118 115.891 -15.839 -19.282 693 HE3 MET 118 HE3 MET 118 116.480 -16.213 -17.664 694 H GLU 119 H GLU 119 116.786 -19.733 -15.014 695 HA GLU 119 HA GLU 119 116.891 -20.239 -12.207 696 HB2 GLU 119 HB2 GLU 119 119.001 -20.231 -14.379 697 HG2 GLU 119 HG2 GLU 119 117.287 -22.421 -13.162 698 H ASN 120 H ASN 120 118.465 -17.628 -14.147 699 HA ASN 120 HA ASN 120 119.576 -16.554 -11.588 700 HB2 ASN 120 HB2 ASN 120 120.265 -16.078 -14.500 701 HD21 ASN 120 HD21 ASN 120 121.972 -17.458 -15.239 702 HD22 ASN 120 HD22 ASN 120 122.602 -18.729 -14.307 703 H VAL 121 H VAL 121 116.808 -16.027 -13.295 704 HA VAL 121 HA VAL 121 116.950 -13.062 -12.833 705 HB VAL 121 HB VAL 121 115.391 -14.627 -14.915 706 HG11 VAL 121 HG11 VAL 121 114.687 -12.502 -15.774 707 HG12 VAL 121 HG12 VAL 121 115.772 -11.635 -14.688 708 HG13 VAL 121 HG13 VAL 121 114.360 -12.472 -14.041 709 HG21 VAL 121 HG21 VAL 121 117.438 -12.637 -15.701 710 HG22 VAL 121 HG22 VAL 121 117.076 -14.213 -16.401 711 HG23 VAL 121 HG23 VAL 121 118.070 -14.101 -14.949 712 H ALA 122 H ALA 122 115.295 -12.193 -11.595 713 HA ALA 122 HA ALA 122 112.925 -13.898 -10.992 714 HB1 ALA 122 HB1 ALA 122 113.539 -14.289 -8.846 715 HB2 ALA 122 HB2 ALA 122 114.156 -12.651 -8.630 716 HB3 ALA 122 HB3 ALA 122 115.160 -13.877 -9.403 717 H LEU 123 H LEU 123 111.088 -12.759 -10.630 718 HA LEU 123 HA LEU 123 111.264 -9.764 -10.342 719 HB2 LEU 123 HB2 LEU 123 110.496 -10.652 -12.575 720 HG LEU 123 HG LEU 123 108.625 -9.105 -10.788 721 HD11 LEU 123 HD11 LEU 123 109.785 -8.045 -13.312 722 HD12 LEU 123 HD12 LEU 123 110.927 -8.391 -12.015 723 HD13 LEU 123 HD13 LEU 123 109.599 -7.262 -11.743 724 HD21 LEU 123 HD21 LEU 123 107.492 -8.537 -13.072 725 HD22 LEU 123 HD22 LEU 123 107.042 -10.036 -12.259 726 HD23 LEU 123 HD23 LEU 123 108.177 -10.072 -13.608 727 H ASP 124 H ASP 124 110.031 -8.963 -8.513 728 HA ASP 124 HA ASP 124 108.098 -10.914 -7.331 729 HB2 ASP 124 HB2 ASP 124 109.121 -10.443 -5.117 730 H PHE 125 H PHE 125 106.480 -9.979 -6.018 731 HA PHE 125 HA PHE 125 106.196 -6.997 -6.241 732 HB2 PHE 125 HB2 PHE 125 104.125 -9.210 -6.448 733 HD1 PHE 125 HD2 PHE 125 104.579 -6.059 -8.350 734 HD2 PHE 125 HD1 PHE 125 105.074 -10.326 -8.356 735 HE1 PHE 125 HE2 PHE 125 105.069 -5.999 -10.780 736 HE2 PHE 125 HE1 PHE 125 105.564 -10.265 -10.787 737 HZ PHE 125 HZ PHE 125 105.562 -8.102 -11.999 738 H SER 126 H SER 126 105.613 -5.963 -4.326 739 HA SER 126 HA SER 126 104.656 -7.607 -2.034 740 HB2 SER 126 HB2 SER 126 106.466 -6.784 -0.630 741 HG SER 126 HG SER 126 108.136 -5.537 -1.798 742 H TYR 127 H TYR 127 103.703 -6.265 -0.340 743 HA TYR 127 HA TYR 127 103.190 -3.427 -1.140 744 HB2 TYR 127 HB2 TYR 127 100.823 -3.789 -0.649 745 HD1 TYR 127 HD2 TYR 127 101.786 -7.340 -1.089 746 HD2 TYR 127 HD1 TYR 127 100.167 -4.400 1.592 747 HE1 TYR 127 HE2 TYR 127 101.083 -9.142 0.463 748 HE2 TYR 127 HE1 TYR 127 99.464 -6.202 3.144 749 HH TYR 127 HH TYR 127 100.568 -8.968 3.366 750 H GLU 128 H GLU 128 103.085 -1.987 0.600 751 HA GLU 128 HA GLU 128 102.991 -3.037 3.367 752 HB2 GLU 128 HB2 GLU 128 105.139 -1.913 3.911 753 HG2 GLU 128 HG2 GLU 128 105.235 -1.417 0.919 754 H GLN 129 H GLN 129 102.201 -1.481 4.819 755 HA GLN 129 HA GLN 129 101.454 1.165 3.617 756 HB2 GLN 129 HB2 GLN 129 100.199 -0.515 5.814 757 HG2 GLN 129 HG2 GLN 129 99.252 0.156 3.009 758 HE21 GLN 129 HE21 GLN 129 97.234 -1.170 2.500 759 HE22 GLN 129 HE22 GLN 129 96.152 -1.508 3.764 760 H SER 130 H SER 130 101.863 3.043 4.871 761 HA SER 130 HA SER 130 103.413 2.621 7.407 762 HB2 SER 130 HB2 SER 130 104.822 3.164 5.419 763 HG SER 130 HG SER 130 104.657 5.389 7.146 764 H ARG 131 H ARG 131 102.838 4.000 9.082 765 HA ARG 131 HA ARG 131 100.872 6.182 8.462 766 HB2 ARG 131 HB2 ARG 131 99.892 4.085 9.453 767 HG2 ARG 131 HG2 ARG 131 99.880 6.537 11.244 768 HD2 ARG 131 HD2 ARG 131 97.560 5.657 11.818 769 HE ARG 131 HE ARG 131 99.453 3.689 12.849 770 HH11 ARG 131 HH11 ARG 131 97.634 5.705 14.332 771 HH12 ARG 131 HH12 ARG 131 98.830 6.695 15.101 772 HH21 ARG 131 HH21 ARG 131 101.438 5.537 13.131 773 HH22 ARG 131 HH22 ARG 131 100.982 6.600 14.421 774 H ILE 132 H ILE 132 101.571 8.142 9.214 775 HA ILE 132 HA ILE 132 103.668 8.170 11.357 776 HB ILE 132 HB ILE 132 103.151 10.043 9.022 777 HG12 ILE 132 HG12 ILE 132 105.462 8.141 9.502 778 HG21 ILE 132 HG21 ILE 132 104.397 11.536 10.148 779 HG22 ILE 132 HG22 ILE 132 105.743 10.399 10.114 780 HG23 ILE 132 HG23 ILE 132 104.623 10.401 11.477 781 HD11 ILE 132 HD11 ILE 132 104.603 9.713 7.054 782 HD12 ILE 132 HD12 ILE 132 106.021 8.671 7.176 783 HD13 ILE 132 HD13 ILE 132 105.935 10.156 8.122 784 H ARG 133 H ARG 133 101.189 8.097 12.361 785 HA ARG 133 HA ARG 133 99.751 9.231 13.828 786 HB2 ARG 133 HB2 ARG 133 101.938 10.307 14.454 787 HG2 ARG 133 HG2 ARG 133 99.437 12.023 14.518 788 HD2 ARG 133 HD2 ARG 133 101.546 13.311 14.996 789 HE ARG 133 HE ARG 133 102.790 11.301 15.939 790 HH11 ARG 133 HH11 ARG 133 103.375 13.688 17.626 791 HH12 ARG 133 HH12 ARG 133 103.054 13.102 19.224 792 HH21 ARG 133 HH21 ARG 133 101.251 10.346 18.137 793 HH22 ARG 133 HH22 ARG 133 101.851 11.209 19.513 794 H SER 134 H SER 134 100.700 11.594 11.272 795 HA SER 134 HA SER 134 97.774 12.103 10.865 796 HB2 SER 134 HB2 SER 134 100.194 13.777 11.117 797 HG SER 134 HG SER 134 97.778 14.961 11.313 798 H VAL 135 H VAL 135 100.536 10.754 9.372 799 HA VAL 135 HA VAL 135 99.336 11.255 6.661 800 HB VAL 135 HB VAL 135 102.213 10.704 7.460 801 HG11 VAL 135 HG11 VAL 135 102.761 11.140 5.157 802 HG12 VAL 135 HG12 VAL 135 101.103 11.624 4.797 803 HG13 VAL 135 HG13 VAL 135 101.470 9.938 5.162 804 HG21 VAL 135 HG21 VAL 135 101.438 12.928 8.193 805 HG22 VAL 135 HG22 VAL 135 100.839 13.260 6.567 806 HG23 VAL 135 HG23 VAL 135 102.570 13.080 6.849 807 H ASP 136 H ASP 136 98.663 9.456 5.581 808 HA ASP 136 HA ASP 136 99.748 6.788 6.397 809 HB2 ASP 136 HB2 ASP 136 97.520 7.310 7.424 810 H VAL 137 H VAL 137 100.780 6.069 4.554 811 HA VAL 137 HA VAL 137 99.421 6.548 1.927 812 HB VAL 137 HB VAL 137 101.721 6.715 1.014 813 HG11 VAL 137 HG11 VAL 137 101.858 8.917 1.564 814 HG12 VAL 137 HG12 VAL 137 101.951 8.577 3.292 815 HG13 VAL 137 HG13 VAL 137 100.384 8.611 2.483 816 HG21 VAL 137 HG21 VAL 137 102.753 5.199 2.737 817 HG22 VAL 137 HG22 VAL 137 102.614 6.510 3.908 818 HG23 VAL 137 HG23 VAL 137 103.651 6.698 2.495 819 H GLY 138 H GLY 138 99.507 4.801 0.430 820 HA2 GLY 138 HA2 GLY 138 100.220 2.163 1.643 821 H THR 139 H THR 139 102.372 1.833 1.113 822 HA THR 139 HA THR 139 103.208 2.416 -1.701 823 HB THR 139 HB THR 139 104.883 1.984 0.786 824 HG1 THR 139 HG1 THR 139 104.991 4.292 0.750 825 HG21 THR 139 HG21 THR 139 105.412 2.858 -2.034 826 HG22 THR 139 HG22 THR 139 106.328 1.740 -1.024 827 HG23 THR 139 HG23 THR 139 106.427 3.476 -0.730 828 H TRP 140 H TRP 140 104.237 0.849 -2.913 829 HA TRP 140 HA TRP 140 104.525 -1.884 -1.725 830 HB2 TRP 140 HB2 TRP 140 103.579 -2.746 -3.864 831 HD1 TRP 140 HD1 TRP 140 101.670 0.468 -4.200 832 HE1 TRP 140 HE1 TRP 140 102.161 1.537 -6.494 833 HE3 TRP 140 HE3 TRP 140 105.556 -2.471 -5.729 834 HZ2 TRP 140 HZ2 TRP 140 103.966 1.193 -8.686 835 HZ3 TRP 140 HZ3 TRP 140 106.642 -2.078 -7.922 836 HH2 TRP 140 HH2 TRP 140 105.853 -0.251 -9.401 837 H ILE 141 H ILE 141 106.359 -3.022 -2.525 838 HA ILE 141 HA ILE 141 108.160 -1.435 -4.331 839 HB ILE 141 HB ILE 141 108.807 -3.422 -2.125 840 HG12 ILE 141 HG12 ILE 141 109.132 -0.404 -2.185 841 HG21 ILE 141 HG21 ILE 141 111.113 -2.229 -2.464 842 HG22 ILE 141 HG22 ILE 141 110.469 -1.815 -4.053 843 HG23 ILE 141 HG23 ILE 141 110.640 -3.507 -3.584 844 HD11 ILE 141 HD11 ILE 141 109.850 -0.619 0.086 845 HD12 ILE 141 HD12 ILE 141 110.746 -1.841 -0.815 846 HD13 ILE 141 HD13 ILE 141 109.351 -2.309 0.156 847 H ALA 142 H ALA 142 108.743 -2.442 -6.228 848 HA ALA 142 HA ALA 142 108.710 -5.412 -6.380 849 HB1 ALA 142 HB1 ALA 142 106.987 -5.506 -7.935 850 HB2 ALA 142 HB2 ALA 142 107.289 -3.870 -8.519 851 HB3 ALA 142 HB3 ALA 142 106.456 -4.119 -6.985 852 H GLY 143 H GLY 143 110.136 -6.189 -7.978 853 HA2 GLY 143 HA2 GLY 143 111.147 -4.606 -10.145 854 H VAL 144 H VAL 144 113.926 -5.833 -9.223 855 HA VAL 144 HA VAL 144 113.363 -8.531 -10.411 856 HB VAL 144 HB VAL 144 115.660 -8.309 -11.352 857 HG11 VAL 144 HG11 VAL 144 114.194 -7.588 -12.965 858 HG12 VAL 144 HG12 VAL 144 115.000 -6.050 -12.661 859 HG13 VAL 144 HG13 VAL 144 113.447 -6.396 -11.902 860 HG21 VAL 144 HG21 VAL 144 116.921 -6.290 -11.091 861 HG22 VAL 144 HG22 VAL 144 116.412 -6.750 -9.467 862 HG23 VAL 144 HG23 VAL 144 115.567 -5.462 -10.324 863 H GLY 145 H GLY 145 115.157 -10.137 -9.869 864 HA2 GLY 145 HA2 GLY 145 116.398 -9.746 -7.215 865 H TYR 146 H TYR 146 118.333 -10.815 -7.089 866 HA TYR 146 HA TYR 146 118.932 -12.924 -9.139 867 HB2 TYR 146 HB2 TYR 146 119.857 -10.649 -9.677 868 HD1 TYR 146 HD2 TYR 146 120.367 -12.270 -11.492 869 HD2 TYR 146 HD1 TYR 146 122.718 -12.073 -7.903 870 HE1 TYR 146 HE2 TYR 146 122.164 -13.571 -12.599 871 HE2 TYR 146 HE1 TYR 146 124.516 -13.375 -9.010 872 HH TYR 146 HH TYR 146 124.194 -15.205 -11.496 873 H ARG 147 H ARG 147 120.376 -14.584 -8.361 874 HA ARG 147 HA ARG 147 121.034 -14.432 -5.436 875 HB2 ARG 147 HB2 ARG 147 120.269 -16.764 -5.250 876 HG2 ARG 147 HG2 ARG 147 119.740 -16.439 -8.215 877 HD2 ARG 147 HD2 ARG 147 118.718 -18.574 -6.302 878 HE ARG 147 HE ARG 147 119.246 -18.608 -9.185 879 HH11 ARG 147 HH11 ARG 147 116.420 -19.252 -7.561 880 HH12 ARG 147 HH12 ARG 147 116.353 -20.938 -7.952 881 HH21 ARG 147 HH21 ARG 147 119.552 -21.027 -9.287 882 HH22 ARG 147 HH22 ARG 147 118.126 -21.942 -8.929 883 H PHE 148 H PHE 148 123.187 -14.695 -5.140 884 HA PHE 148 HA PHE 148 124.952 -15.663 -7.245 885 HB2 PHE 148 HB2 PHE 148 125.310 -14.960 -4.316 886 HD1 PHE 148 HD2 PHE 148 127.188 -13.872 -7.312 887 HD2 PHE 148 HD1 PHE 148 124.104 -12.869 -4.495 888 HE1 PHE 148 HE2 PHE 148 127.186 -11.537 -8.146 889 HE2 PHE 148 HE1 PHE 148 124.104 -10.534 -5.328 890 HZ PHE 148 HZ PHE 148 125.644 -9.867 -7.153 Start of MODEL 2 1 H THR 2 H THR 2 123.946 -17.637 2.457 2 HA THR 2 HA THR 2 125.172 -17.682 -0.266 3 HB THR 2 HB THR 2 123.394 -19.436 0.026 4 HG1 THR 2 HG1 THR 2 122.965 -19.058 -1.973 5 HG21 THR 2 HG21 THR 2 122.026 -18.150 1.667 6 HG22 THR 2 HG22 THR 2 121.073 -18.751 0.310 7 HG23 THR 2 HG23 THR 2 121.551 -17.055 0.368 8 H SER 3 H SER 3 124.301 -15.875 -1.639 9 HA SER 3 HA SER 3 123.221 -13.612 0.013 10 HB2 SER 3 HB2 SER 3 125.676 -13.485 -0.465 11 HG SER 3 HG SER 3 125.486 -11.411 -0.786 12 H THR 4 H THR 4 121.672 -12.304 -1.072 13 HA THR 4 HA THR 4 121.063 -13.031 -3.900 14 HB THR 4 HB THR 4 119.029 -12.702 -1.673 15 HG1 THR 4 HG1 THR 4 119.673 -14.639 -1.193 16 HG21 THR 4 HG21 THR 4 118.560 -12.327 -4.260 17 HG22 THR 4 HG22 THR 4 117.404 -13.182 -3.238 18 HG23 THR 4 HG23 THR 4 118.513 -14.090 -4.265 19 H VAL 5 H VAL 5 120.602 -11.248 -5.144 20 HA VAL 5 HA VAL 5 120.468 -8.591 -3.761 21 HB VAL 5 HB VAL 5 121.196 -9.364 -6.610 22 HG11 VAL 5 HG11 VAL 5 120.272 -7.043 -6.264 23 HG12 VAL 5 HG12 VAL 5 121.935 -7.073 -6.851 24 HG13 VAL 5 HG13 VAL 5 121.606 -6.739 -5.151 25 HG21 VAL 5 HG21 VAL 5 123.514 -8.651 -5.778 26 HG22 VAL 5 HG22 VAL 5 122.916 -10.195 -5.171 27 HG23 VAL 5 HG23 VAL 5 122.851 -8.760 -4.148 28 H THR 6 H THR 6 118.652 -7.261 -4.151 29 HA THR 6 HA THR 6 116.791 -7.953 -6.336 30 HB THR 6 HB THR 6 115.984 -8.052 -3.411 31 HG1 THR 6 HG1 THR 6 116.914 -9.940 -3.663 32 HG21 THR 6 HG21 THR 6 113.818 -8.546 -4.138 33 HG22 THR 6 HG22 THR 6 114.363 -9.035 -5.742 34 HG23 THR 6 HG23 THR 6 114.331 -7.327 -5.305 35 H GLY 7 H GLY 7 115.962 -6.023 -7.119 36 HA2 GLY 7 HA2 GLY 7 115.213 -3.865 -5.318 37 H GLY 8 H GLY 8 114.463 -1.912 -6.676 38 HA2 GLY 8 HA2 GLY 8 114.032 -2.159 -9.493 39 H TYR 9 H TYR 9 111.105 -1.128 -8.736 40 HA TYR 9 HA TYR 9 111.981 1.648 -7.981 41 HB2 TYR 9 HB2 TYR 9 109.929 0.741 -10.032 42 HD1 TYR 9 HD1 TYR 9 112.604 3.328 -10.077 43 HD2 TYR 9 HD2 TYR 9 111.337 -0.526 -11.488 44 HE1 TYR 9 HE1 TYR 9 114.490 3.297 -11.687 45 HE2 TYR 9 HE2 TYR 9 113.223 -0.557 -13.098 46 HH TYR 9 HH TYR 9 115.677 0.717 -13.076 47 H ALA 10 H ALA 10 110.251 2.915 -6.874 48 HA ALA 10 HA ALA 10 108.074 1.179 -5.753 49 HB1 ALA 10 HB1 ALA 10 110.116 1.506 -4.278 50 HB2 ALA 10 HB2 ALA 10 108.591 2.029 -3.560 51 HB3 ALA 10 HB3 ALA 10 109.708 3.221 -4.226 52 H GLN 11 H GLN 11 106.177 2.093 -6.367 53 HA GLN 11 HA GLN 11 105.965 5.088 -6.472 54 HB2 GLN 11 HB2 GLN 11 104.443 2.868 -7.892 55 HG2 GLN 11 HG2 GLN 11 106.363 4.969 -8.947 56 HE21 GLN 11 HE21 GLN 11 106.871 4.480 -11.313 57 HE22 GLN 11 HE22 GLN 11 105.645 3.806 -12.276 58 H SER 12 H SER 12 104.248 6.008 -5.210 59 HA SER 12 HA SER 12 102.338 4.136 -3.907 60 HB2 SER 12 HB2 SER 12 103.125 4.685 -1.702 61 HG SER 12 HG SER 12 105.236 6.134 -2.054 62 H ASP 13 H ASP 13 100.573 5.172 -2.892 63 HA ASP 13 HA ASP 13 100.036 7.965 -3.782 64 HB2 ASP 13 HB2 ASP 13 98.351 5.763 -2.515 65 H ALA 14 H ALA 14 99.457 9.560 -2.051 66 HA ALA 14 HA ALA 14 100.225 8.644 0.683 67 HB1 ALA 14 HB1 ALA 14 102.176 9.657 -0.149 68 HB2 ALA 14 HB2 ALA 14 101.396 10.963 0.745 69 HB3 ALA 14 HB3 ALA 14 101.268 10.897 -1.013 70 H GLN 15 H GLN 15 98.586 9.052 2.008 71 HA GLN 15 HA GLN 15 96.431 10.910 1.441 72 HB2 GLN 15 HB2 GLN 15 97.324 9.407 3.929 73 HG2 GLN 15 HG2 GLN 15 95.122 8.850 1.915 74 HE21 GLN 15 HE21 GLN 15 94.165 6.628 2.343 75 HE22 GLN 15 HE22 GLN 15 94.101 6.065 3.943 76 H GLY 16 H GLY 16 96.656 13.072 1.646 77 HA2 GLY 16 HA2 GLY 16 97.042 15.032 3.102 78 H GLN 17 H GLN 17 98.866 13.237 0.852 79 HA GLN 17 HA GLN 17 100.359 15.685 -0.038 80 HB2 GLN 17 HB2 GLN 17 100.944 12.727 -0.383 81 HG2 GLN 17 HG2 GLN 17 102.346 14.893 1.214 82 HE21 GLN 17 HE21 GLN 17 104.041 13.766 2.699 83 HE22 GLN 17 HE22 GLN 17 104.928 12.489 2.019 84 H MET 18 H MET 18 100.401 16.001 -2.408 85 HA MET 18 HA MET 18 97.921 14.980 -3.693 86 HB2 MET 18 HB2 MET 18 99.910 17.178 -4.329 87 HG2 MET 18 HG2 MET 18 97.046 17.180 -3.331 88 HE1 MET 18 HE1 MET 18 96.203 19.344 -2.345 89 HE2 MET 18 HE2 MET 18 96.582 20.966 -2.921 90 HE3 MET 18 HE3 MET 18 97.679 20.155 -1.806 91 H ASN 19 H ASN 19 101.012 15.831 -5.231 92 HA ASN 19 HA ASN 19 100.805 13.784 -7.232 93 HB2 ASN 19 HB2 ASN 19 103.138 15.425 -6.197 94 HD21 ASN 19 HD21 ASN 19 103.475 17.353 -7.684 95 HD22 ASN 19 HD22 ASN 19 102.124 18.029 -8.458 96 H LYS 20 H LYS 20 101.485 11.677 -7.231 97 HA LYS 20 HA LYS 20 102.286 10.368 -4.787 98 HB2 LYS 20 HB2 LYS 20 102.364 8.394 -6.233 99 HG2 LYS 20 HG2 LYS 20 102.345 10.414 -8.499 100 HD2 LYS 20 HD2 LYS 20 101.932 7.416 -8.440 101 HE2 LYS 20 HE2 LYS 20 102.002 7.823 -11.048 102 HZ1 LYS 20 HZ1 LYS 20 104.391 7.707 -9.272 103 HZ2 LYS 20 HZ2 LYS 20 104.333 7.152 -10.878 104 HZ3 LYS 20 HZ3 LYS 20 103.402 6.391 -9.678 105 H MET 21 H MET 21 104.353 8.807 -4.994 106 HA MET 21 HA MET 21 106.647 10.504 -5.939 107 HB2 MET 21 HB2 MET 21 106.398 8.728 -3.487 108 HG2 MET 21 HG2 MET 21 106.357 11.733 -3.870 109 HE1 MET 21 HE1 MET 21 107.185 8.732 -1.031 110 HE2 MET 21 HE2 MET 21 105.537 9.047 -1.569 111 HE3 MET 21 HE3 MET 21 106.040 9.545 0.044 112 H GLY 22 H GLY 22 108.644 9.218 -6.413 113 HA2 GLY 22 HA2 GLY 22 108.242 6.328 -6.922 114 H GLY 23 H GLY 23 110.107 5.300 -6.323 115 HA2 GLY 23 HA2 GLY 23 112.696 6.710 -6.768 116 H PHE 24 H PHE 24 114.251 4.820 -5.319 117 HA PHE 24 HA PHE 24 113.717 2.280 -6.823 118 HB2 PHE 24 HB2 PHE 24 116.158 2.209 -7.255 119 HD1 PHE 24 HD2 PHE 24 115.756 5.858 -6.793 120 HD2 PHE 24 HD1 PHE 24 117.695 2.292 -5.387 121 HE1 PHE 24 HE2 PHE 24 117.308 7.236 -5.434 122 HE2 PHE 24 HE1 PHE 24 119.247 3.670 -4.031 123 HZ PHE 24 HZ PHE 24 119.053 6.142 -4.053 124 H ASN 25 H ASN 25 114.777 0.387 -5.812 125 HA ASN 25 HA ASN 25 115.497 0.756 -2.932 126 HB2 ASN 25 HB2 ASN 25 113.026 0.266 -3.373 127 HD21 ASN 25 HD21 ASN 25 111.899 -1.289 -1.705 128 HD22 ASN 25 HD22 ASN 25 112.785 -1.655 -0.305 129 H LEU 26 H LEU 26 117.213 -0.495 -2.357 130 HA LEU 26 HA LEU 26 117.977 -2.811 -4.123 131 HB2 LEU 26 HB2 LEU 26 119.467 -0.775 -4.167 132 HG LEU 26 HG LEU 26 120.525 -3.340 -2.958 133 HD11 LEU 26 HD11 LEU 26 121.457 -3.267 -5.470 134 HD12 LEU 26 HD12 LEU 26 120.028 -2.258 -5.695 135 HD13 LEU 26 HD13 LEU 26 119.857 -3.906 -5.091 136 HD21 LEU 26 HD21 LEU 26 122.043 -0.978 -4.114 137 HD22 LEU 26 HD22 LEU 26 122.759 -2.544 -3.731 138 HD23 LEU 26 HD23 LEU 26 122.102 -1.537 -2.442 139 H LYS 27 H LYS 27 118.385 -4.835 -2.908 140 HA LYS 27 HA LYS 27 118.197 -4.534 0.051 141 HB2 LYS 27 HB2 LYS 27 116.769 -6.517 -1.747 142 HG2 LYS 27 HG2 LYS 27 115.759 -4.131 -0.171 143 HD2 LYS 27 HD2 LYS 27 114.296 -6.314 -1.687 144 HE2 LYS 27 HE2 LYS 27 113.537 -3.522 -0.966 145 HZ1 LYS 27 HZ1 LYS 27 111.310 -4.242 -0.421 146 HZ2 LYS 27 HZ2 LYS 27 112.404 -5.006 0.632 147 HZ3 LYS 27 HZ3 LYS 27 111.728 -5.868 -0.667 148 H TYR 28 H TYR 28 119.385 -6.065 1.225 149 HA TYR 28 HA TYR 28 121.158 -7.901 -0.361 150 HB2 TYR 28 HB2 TYR 28 121.562 -6.481 2.299 151 HD1 TYR 28 HD1 TYR 28 123.750 -6.966 -0.668 152 HD2 TYR 28 HD2 TYR 28 121.321 -4.218 1.568 153 HE1 TYR 28 HE1 TYR 28 124.640 -5.083 -2.014 154 HE2 TYR 28 HE2 TYR 28 122.211 -2.335 0.221 155 HH TYR 28 HH TYR 28 124.286 -1.862 -1.126 156 H ARG 29 H ARG 29 121.113 -10.092 0.287 157 HA ARG 29 HA ARG 29 119.442 -10.738 2.700 158 HB2 ARG 29 HB2 ARG 29 118.269 -11.029 0.537 159 HG2 ARG 29 HG2 ARG 29 119.035 -13.644 1.879 160 HD2 ARG 29 HD2 ARG 29 116.616 -12.869 0.202 161 HE ARG 29 HE ARG 29 116.021 -14.406 2.068 162 HH11 ARG 29 HH11 ARG 29 118.869 -15.655 0.929 163 HH12 ARG 29 HH12 ARG 29 118.298 -17.274 0.701 164 HH21 ARG 29 HH21 ARG 29 114.968 -16.457 1.218 165 HH22 ARG 29 HH22 ARG 29 116.090 -17.728 0.864 166 H TYR 30 H TYR 30 120.166 -12.420 3.980 167 HA TYR 30 HA TYR 30 122.563 -13.971 3.085 168 HB2 TYR 30 HB2 TYR 30 123.154 -12.030 4.563 169 HD1 TYR 30 HD1 TYR 30 125.200 -13.252 3.850 170 HD2 TYR 30 HD2 TYR 30 122.759 -14.623 7.109 171 HE1 TYR 30 HE1 TYR 30 127.039 -14.735 4.605 172 HE2 TYR 30 HE2 TYR 30 124.599 -16.105 7.863 173 HH TYR 30 HH TYR 30 126.757 -17.235 6.417 174 H GLU 31 H GLU 31 122.281 -16.171 3.501 175 HA GLU 31 HA GLU 31 120.306 -16.991 5.583 176 HB2 GLU 31 HB2 GLU 31 119.203 -16.786 3.347 177 HG2 GLU 31 HG2 GLU 31 119.561 -19.603 4.419 178 H GLU 32 H GLU 32 120.729 -19.107 6.429 179 HA GLU 32 HA GLU 32 123.430 -20.183 5.743 180 HB2 GLU 32 HB2 GLU 32 122.773 -19.393 8.077 181 HG2 GLU 32 HG2 GLU 32 123.555 -22.299 7.691 182 H ASP 33 H ASP 33 123.557 -22.181 4.786 183 HA ASP 33 HA ASP 33 121.343 -23.521 3.641 184 HB2 ASP 33 HB2 ASP 33 124.116 -24.459 4.435 185 H ASN 34 H ASN 34 122.667 -23.766 6.869 186 HA ASN 34 HA ASN 34 121.746 -26.342 7.636 187 HB2 ASN 34 HB2 ASN 34 123.285 -24.704 8.835 188 HD21 ASN 34 HD21 ASN 34 121.096 -24.515 11.369 189 HD22 ASN 34 HD22 ASN 34 121.313 -26.065 12.028 190 H SER 35 H SER 35 120.045 -23.193 7.680 191 HA SER 35 HA SER 35 117.473 -24.697 7.942 192 HB2 SER 35 HB2 SER 35 118.718 -22.699 9.772 193 HG SER 35 HG SER 35 118.183 -24.188 11.147 194 HA PRO 36 HA PRO 36 116.054 -21.632 5.096 195 HB2 PRO 36 HB2 PRO 36 113.402 -21.465 5.714 196 HG2 PRO 36 HG2 PRO 36 113.207 -22.521 7.710 197 HD2 PRO 36 HD2 PRO 36 115.128 -23.084 8.749 198 H LEU 37 H LEU 37 117.236 -20.390 7.430 199 HA LEU 37 HA LEU 37 115.395 -18.255 8.310 200 HB2 LEU 37 HB2 LEU 37 118.028 -19.387 9.028 201 HG LEU 37 HG LEU 37 117.240 -18.842 11.297 202 HD11 LEU 37 HD11 LEU 37 114.634 -17.829 10.272 203 HD12 LEU 37 HD12 LEU 37 116.001 -16.716 10.217 204 HD13 LEU 37 HD13 LEU 37 115.497 -17.420 11.755 205 HD21 LEU 37 HD21 LEU 37 116.409 -20.920 10.447 206 HD22 LEU 37 HD22 LEU 37 115.221 -20.108 9.428 207 HD23 LEU 37 HD23 LEU 37 115.025 -20.110 11.180 208 H GLY 38 H GLY 38 115.005 -16.917 6.512 209 HA2 GLY 38 HA2 GLY 38 117.411 -15.783 5.145 210 H VAL 39 H VAL 39 117.881 -13.651 5.436 211 HA VAL 39 HA VAL 39 115.786 -11.872 6.633 212 HB VAL 39 HB VAL 39 118.741 -12.059 7.334 213 HG11 VAL 39 HG11 VAL 39 118.210 -9.841 7.779 214 HG12 VAL 39 HG12 VAL 39 117.746 -10.596 9.304 215 HG13 VAL 39 HG13 VAL 39 116.515 -10.203 8.102 216 HG21 VAL 39 HG21 VAL 39 116.333 -12.753 9.042 217 HG22 VAL 39 HG22 VAL 39 118.032 -13.031 9.425 218 HG23 VAL 39 HG23 VAL 39 117.256 -13.954 8.139 219 H ILE 40 H ILE 40 115.567 -9.997 5.390 220 HA ILE 40 HA ILE 40 117.828 -9.333 3.537 221 HB ILE 40 HB ILE 40 114.830 -9.060 3.152 222 HG12 ILE 40 HG12 ILE 40 116.791 -10.953 1.828 223 HG21 ILE 40 HG21 ILE 40 115.634 -7.439 1.724 224 HG22 ILE 40 HG22 ILE 40 115.852 -8.846 0.684 225 HG23 ILE 40 HG23 ILE 40 117.221 -8.197 1.588 226 HD11 ILE 40 HD11 ILE 40 114.862 -10.357 0.437 227 HD12 ILE 40 HD12 ILE 40 113.767 -10.739 1.767 228 HD13 ILE 40 HD13 ILE 40 114.706 -12.021 1.001 229 H GLY 41 H GLY 41 118.403 -7.170 3.377 230 HA2 GLY 41 HA2 GLY 41 116.984 -5.257 5.190 231 H SER 42 H SER 42 116.340 -3.226 4.214 232 HA SER 42 HA SER 42 116.845 -3.003 1.270 233 HB2 SER 42 HB2 SER 42 114.740 -4.160 1.590 234 HG SER 42 HG SER 42 114.204 -1.430 1.075 235 H PHE 43 H PHE 43 116.997 -0.906 0.494 236 HA PHE 43 HA PHE 43 116.511 1.334 2.436 237 HB2 PHE 43 HB2 PHE 43 118.923 0.759 1.997 238 HD1 PHE 43 HD2 PHE 43 118.799 2.594 3.654 239 HD2 PHE 43 HD1 PHE 43 118.383 3.327 -0.558 240 HE1 PHE 43 HE2 PHE 43 119.174 5.015 4.038 241 HE2 PHE 43 HE1 PHE 43 118.758 5.748 -0.174 242 HZ PHE 43 HZ PHE 43 119.153 6.592 2.124 243 H THR 44 H THR 44 115.239 3.039 1.530 244 HA THR 44 HA THR 44 114.703 2.837 -1.417 245 HB THR 44 HB THR 44 112.713 3.374 0.808 246 HG1 THR 44 HG1 THR 44 112.249 1.300 0.726 247 HG21 THR 44 HG21 THR 44 111.667 4.316 -0.999 248 HG22 THR 44 HG22 THR 44 111.248 2.634 -1.327 249 HG23 THR 44 HG23 THR 44 112.608 3.383 -2.162 250 H TYR 45 H TYR 45 114.608 4.822 -2.497 251 HA TYR 45 HA TYR 45 114.579 7.310 -0.844 252 HB2 TYR 45 HB2 TYR 45 116.901 6.657 -1.505 253 HD1 TYR 45 HD2 TYR 45 116.943 8.792 -0.231 254 HD2 TYR 45 HD1 TYR 45 116.044 8.673 -4.430 255 HE1 TYR 45 HE2 TYR 45 117.346 11.234 -0.386 256 HE2 TYR 45 HE1 TYR 45 116.447 11.115 -4.584 257 HH TYR 45 HH TYR 45 116.488 13.063 -3.173 258 H THR 46 H THR 46 112.629 8.171 -1.517 259 HA THR 46 HA THR 46 111.967 8.054 -4.447 260 HB THR 46 HB THR 46 110.037 8.361 -2.136 261 HG1 THR 46 HG1 THR 46 110.612 6.425 -1.594 262 HG21 THR 46 HG21 THR 46 108.402 7.815 -3.672 263 HG22 THR 46 HG22 THR 46 109.504 6.865 -4.665 264 HG23 THR 46 HG23 THR 46 109.550 8.628 -4.736 265 H GLU 47 H GLU 47 111.217 10.029 -5.425 266 HA GLU 47 HA GLU 47 111.392 12.457 -3.673 267 HB2 GLU 47 HB2 GLU 47 113.323 12.068 -5.218 268 HG2 GLU 47 HG2 GLU 47 111.510 14.411 -5.884 269 H LYS 48 H LYS 48 110.035 14.264 -4.413 270 HA LYS 48 HA LYS 48 107.742 13.412 -6.150 271 HB2 LYS 48 HB2 LYS 48 106.281 14.567 -4.563 272 HG2 LYS 48 HG2 LYS 48 108.867 15.245 -3.126 273 HD2 LYS 48 HD2 LYS 48 105.961 15.480 -2.310 274 HE2 LYS 48 HE2 LYS 48 108.406 16.960 -1.296 275 HZ1 LYS 48 HZ1 LYS 48 107.097 17.369 0.668 276 HZ2 LYS 48 HZ2 LYS 48 107.199 15.689 0.438 277 HZ3 LYS 48 HZ3 LYS 48 105.775 16.522 0.030 278 H SER 49 H SER 49 106.831 15.094 -7.451 279 HA SER 49 HA SER 49 108.445 17.624 -7.582 280 HB2 SER 49 HB2 SER 49 108.833 15.976 -9.421 281 HG SER 49 HG SER 49 107.649 17.710 -10.980 282 H ARG 50 H ARG 50 107.251 19.530 -7.691 283 HA ARG 50 HA ARG 50 104.268 19.276 -7.903 284 HB2 ARG 50 HB2 ARG 50 105.974 20.961 -6.042 285 HG2 ARG 50 HG2 ARG 50 104.060 18.650 -5.593 286 HD2 ARG 50 HD2 ARG 50 103.789 20.372 -3.832 287 HE ARG 50 HE ARG 50 106.769 20.205 -3.503 288 HH11 ARG 50 HH21 ARG 50 104.269 21.757 -2.098 289 HH12 ARG 50 HH22 ARG 50 104.753 23.371 -2.500 290 HH21 ARG 50 HH11 ARG 50 107.201 22.364 -4.740 291 HH22 ARG 50 HH12 ARG 50 106.413 23.715 -3.995 292 H THR 51 H THR 51 103.215 21.097 -8.893 293 HA THR 51 HA THR 51 103.036 22.801 -10.521 294 HB THR 51 HB THR 51 105.559 23.791 -9.165 295 HG1 THR 51 HG1 THR 51 104.400 24.235 -7.452 296 HG21 THR 51 HG21 THR 51 104.214 24.898 -11.219 297 HG22 THR 51 HG22 THR 51 104.994 25.864 -9.966 298 HG23 THR 51 HG23 THR 51 103.263 25.540 -9.879 299 H ALA 52 H ALA 52 104.318 20.512 -11.535 300 HA ALA 52 HA ALA 52 105.751 19.794 -13.273 301 HB1 ALA 52 HB1 ALA 52 105.367 21.113 -15.101 302 HB2 ALA 52 HB2 ALA 52 105.984 22.560 -14.302 303 HB3 ALA 52 HB3 ALA 52 104.335 22.018 -13.994 304 H SER 53 H SER 53 107.781 21.334 -14.617 305 HA SER 53 HA SER 53 110.081 21.819 -14.401 306 HB2 SER 53 HB2 SER 53 108.724 23.667 -13.085 307 HG SER 53 HG SER 53 110.649 24.262 -13.816 308 H SER 54 H SER 54 112.018 21.473 -12.825 309 HA SER 54 HA SER 54 111.537 19.214 -10.933 310 HB2 SER 54 HB2 SER 54 113.255 17.905 -12.057 311 HG SER 54 HG SER 54 113.658 19.337 -14.245 312 H GLY 55 H GLY 55 113.427 18.873 -9.491 313 HA2 GLY 55 HA2 GLY 55 115.265 19.603 -8.211 314 H ASP 56 H ASP 56 112.761 20.398 -7.420 315 HA ASP 56 HA ASP 56 112.272 23.192 -7.190 316 HB2 ASP 56 HB2 ASP 56 111.621 20.843 -5.380 317 H TYR 57 H TYR 57 112.834 24.693 -5.560 318 HA TYR 57 HA TYR 57 115.437 24.516 -4.401 319 HB2 TYR 57 HB2 TYR 57 113.032 26.231 -3.694 320 HD1 TYR 57 HD2 TYR 57 116.451 26.866 -5.061 321 HD2 TYR 57 HD1 TYR 57 112.222 26.880 -5.817 322 HE1 TYR 57 HE2 TYR 57 116.844 27.981 -7.241 323 HE2 TYR 57 HE1 TYR 57 112.616 27.996 -7.997 324 HH TYR 57 HH TYR 57 114.378 28.292 -9.617 325 H ASN 58 H ASN 58 112.286 23.520 -3.214 326 HA ASN 58 HA ASN 58 112.796 23.394 -0.411 327 HB2 ASN 58 HB2 ASN 58 111.138 21.630 -2.246 328 HD21 ASN 58 HD21 ASN 58 108.990 22.525 -2.620 329 HD22 ASN 58 HD22 ASN 58 108.626 24.145 -2.270 330 H LYS 59 H LYS 59 113.501 21.087 -3.020 331 HA LYS 59 HA LYS 59 114.865 19.161 -3.068 332 HB2 LYS 59 HB2 LYS 59 116.129 20.761 -0.820 333 HG2 LYS 59 HG2 LYS 59 116.652 20.588 -3.803 334 HD2 LYS 59 HD2 LYS 59 118.166 22.020 -1.599 335 HE2 LYS 59 HE2 LYS 59 117.967 22.464 -4.528 336 HZ1 LYS 59 HZ1 LYS 59 120.532 22.199 -3.038 337 HZ2 LYS 59 HZ2 LYS 59 120.397 22.906 -4.577 338 HZ3 LYS 59 HZ3 LYS 59 120.027 21.263 -4.359 339 H ASN 60 H ASN 60 112.519 18.563 -1.828 340 HA ASN 60 HA ASN 60 112.984 17.464 0.865 341 HB2 ASN 60 HB2 ASN 60 110.684 17.323 -1.116 342 HD21 ASN 60 HD21 ASN 60 108.912 18.871 -0.419 343 HD22 ASN 60 HD22 ASN 60 109.347 20.296 0.394 344 H GLN 61 H GLN 61 113.555 15.341 1.272 345 HA GLN 61 HA GLN 61 113.580 13.445 -1.060 346 HB2 GLN 61 HB2 GLN 61 115.512 13.785 1.255 347 HG2 GLN 61 HG2 GLN 61 115.811 14.266 -1.728 348 HE21 GLN 61 HE21 GLN 61 117.993 15.294 -2.190 349 HE22 GLN 61 HE22 GLN 61 119.315 14.871 -1.213 350 H TYR 62 H TYR 62 113.200 11.178 -0.502 351 HA TYR 62 HA TYR 62 111.695 10.865 2.072 352 HB2 TYR 62 HB2 TYR 62 110.419 10.723 -0.063 353 HD1 TYR 62 HD2 TYR 62 108.906 10.496 1.896 354 HD2 TYR 62 HD1 TYR 62 111.168 7.174 0.382 355 HE1 TYR 62 HE2 TYR 62 107.461 8.932 3.167 356 HE2 TYR 62 HE1 TYR 62 109.723 5.609 1.654 357 HH TYR 62 HH TYR 62 107.378 5.628 2.593 358 H TYR 63 H TYR 63 112.547 9.515 3.498 359 HA TYR 63 HA TYR 63 114.656 7.555 2.618 360 HB2 TYR 63 HB2 TYR 63 114.061 8.906 5.267 361 HD1 TYR 63 HD2 TYR 63 117.268 8.238 3.543 362 HD2 TYR 63 HD1 TYR 63 114.246 11.161 4.421 363 HE1 TYR 63 HE2 TYR 63 118.760 10.034 2.706 364 HE2 TYR 63 HE1 TYR 63 115.739 12.957 3.586 365 HH TYR 63 HH TYR 63 119.057 12.450 2.978 366 H GLY 64 H GLY 64 114.310 5.358 3.010 367 HA2 GLY 64 HA2 GLY 64 112.159 4.595 4.901 368 H ILE 65 H ILE 65 113.133 3.154 6.189 369 HA ILE 65 HA ILE 65 115.177 1.294 5.027 370 HB ILE 65 HB ILE 65 114.503 2.046 7.898 371 HG12 ILE 65 HG12 ILE 65 116.841 2.909 6.166 372 HG21 ILE 65 HG21 ILE 65 115.556 -0.040 8.043 373 HG22 ILE 65 HG22 ILE 65 116.922 1.070 8.150 374 HG23 ILE 65 HG23 ILE 65 116.561 0.260 6.626 375 HD11 ILE 65 HD11 ILE 65 116.089 3.214 9.030 376 HD12 ILE 65 HD12 ILE 65 116.768 4.635 8.237 377 HD13 ILE 65 HD13 ILE 65 117.687 3.132 8.291 378 H THR 66 H THR 66 114.666 -0.933 4.999 379 HA THR 66 HA THR 66 112.395 -1.861 6.647 380 HB THR 66 HB THR 66 111.452 -2.855 4.427 381 HG1 THR 66 HG1 THR 66 112.325 -2.138 2.668 382 HG21 THR 66 HG21 THR 66 111.203 0.123 4.515 383 HG22 THR 66 HG22 THR 66 110.693 -0.802 5.927 384 HG23 THR 66 HG23 THR 66 109.944 -1.103 4.358 385 H ALA 67 H ALA 67 112.617 -4.006 7.206 386 HA ALA 67 HA ALA 67 114.358 -5.798 5.626 387 HB1 ALA 67 HB1 ALA 67 115.772 -6.263 7.556 388 HB2 ALA 67 HB2 ALA 67 114.770 -5.238 8.582 389 HB3 ALA 67 HB3 ALA 67 115.750 -4.517 7.306 390 H GLY 68 H GLY 68 113.849 -8.060 6.110 391 HA2 GLY 68 HA2 GLY 68 111.992 -8.718 8.250 392 HA PRO 69 HA PRO 69 113.583 -12.721 7.487 393 HB2 PRO 69 HB2 PRO 69 111.497 -14.355 8.160 394 HG2 PRO 69 HG2 PRO 69 109.762 -12.857 8.223 395 HD2 PRO 69 HD2 PRO 69 110.119 -10.614 8.017 396 H ALA 70 H ALA 70 113.090 -14.844 6.257 397 HA ALA 70 HA ALA 70 111.188 -14.487 3.985 398 HB1 ALA 70 HB1 ALA 70 113.512 -13.567 3.472 399 HB2 ALA 70 HB2 ALA 70 112.943 -14.818 2.367 400 HB3 ALA 70 HB3 ALA 70 114.108 -15.219 3.628 401 H TYR 71 H TYR 71 110.291 -16.470 3.358 402 HA TYR 71 HA TYR 71 111.457 -18.918 4.657 403 HB2 TYR 71 HB2 TYR 71 108.589 -18.140 4.040 404 HD1 TYR 71 HD2 TYR 71 110.192 -19.723 6.994 405 HD2 TYR 71 HD1 TYR 71 108.490 -16.138 5.352 406 HE1 TYR 71 HE2 TYR 71 110.211 -18.683 9.245 407 HE2 TYR 71 HE1 TYR 71 108.509 -15.097 7.603 408 HH TYR 71 HH TYR 71 108.959 -16.857 10.436 409 H ARG 72 H ARG 72 111.868 -20.639 3.321 410 HA ARG 72 HA ARG 72 111.104 -20.361 0.438 411 HB2 ARG 72 HB2 ARG 72 113.518 -20.397 1.062 412 HG2 ARG 72 HG2 ARG 72 112.578 -22.904 -0.370 413 HD2 ARG 72 HD2 ARG 72 114.786 -22.619 -1.574 414 HE ARG 72 HE ARG 72 115.078 -23.101 1.367 415 HH11 ARG 72 HH11 ARG 72 113.496 -24.516 -1.180 416 HH12 ARG 72 HH12 ARG 72 114.349 -26.023 -1.127 417 HH21 ARG 72 HH21 ARG 72 116.715 -24.907 1.148 418 HH22 ARG 72 HH22 ARG 72 116.171 -26.244 0.191 419 H ILE 73 H ILE 73 108.975 -21.344 0.773 420 HA ILE 73 HA ILE 73 108.939 -24.151 1.754 421 HB ILE 73 HB ILE 73 106.506 -23.834 1.711 422 HG12 ILE 73 HG12 ILE 73 107.065 -21.099 0.517 423 HG21 ILE 73 HG21 ILE 73 108.044 -21.475 2.827 424 HG22 ILE 73 HG22 ILE 73 107.620 -22.964 3.671 425 HG23 ILE 73 HG23 ILE 73 106.359 -21.819 3.213 426 HD11 ILE 73 HD11 ILE 73 104.504 -21.312 0.171 427 HD12 ILE 73 HD12 ILE 73 105.087 -20.959 1.798 428 HD13 ILE 73 HD13 ILE 73 104.593 -22.597 1.374 429 H ASN 74 H ASN 74 108.573 -22.248 -1.175 430 HA ASN 74 HA ASN 74 108.493 -24.786 -2.764 431 HB2 ASN 74 HB2 ASN 74 106.926 -22.215 -3.184 432 HD21 ASN 74 HD21 ASN 74 104.739 -22.367 -2.435 433 HD22 ASN 74 HD22 ASN 74 104.153 -23.696 -1.559 434 H ASP 75 H ASP 75 110.142 -24.813 -4.257 435 HA ASP 75 HA ASP 75 112.106 -22.772 -4.489 436 HB2 ASP 75 HB2 ASP 75 111.239 -25.004 -6.355 437 H TRP 76 H TRP 76 109.141 -23.350 -6.322 438 HA TRP 76 HA TRP 76 109.562 -21.601 -8.515 439 HB2 TRP 76 HB2 TRP 76 107.084 -22.427 -6.981 440 HD1 TRP 76 HD1 TRP 76 107.320 -24.969 -7.042 441 HE1 TRP 76 HE1 TRP 76 107.842 -26.715 -8.866 442 HE3 TRP 76 HE3 TRP 76 108.515 -21.867 -10.921 443 HZ2 TRP 76 HZ2 TRP 76 108.662 -26.787 -11.606 444 HZ3 TRP 76 HZ3 TRP 76 109.162 -22.800 -13.123 445 HH2 TRP 76 HH2 TRP 76 109.237 -25.253 -13.470 446 H ALA 77 H ALA 77 108.387 -20.867 -5.213 447 HA ALA 77 HA ALA 77 108.813 -17.976 -5.813 448 HB1 ALA 77 HB1 ALA 77 106.410 -18.877 -6.219 449 HB2 ALA 77 HB2 ALA 77 106.593 -17.403 -5.268 450 HB3 ALA 77 HB3 ALA 77 106.302 -18.944 -4.460 451 H SER 78 H SER 78 109.065 -16.667 -3.922 452 HA SER 78 HA SER 78 109.500 -18.164 -1.351 453 HB2 SER 78 HB2 SER 78 111.120 -15.911 -2.590 454 HG SER 78 HG SER 78 112.367 -17.427 -3.328 455 H ILE 79 H ILE 79 109.259 -16.701 0.608 456 HA ILE 79 HA ILE 79 107.391 -14.424 -0.002 457 HB ILE 79 HB ILE 79 107.539 -16.282 2.396 458 HG12 ILE 79 HG12 ILE 79 105.477 -16.129 0.174 459 HG21 ILE 79 HG21 ILE 79 105.289 -15.242 2.894 460 HG22 ILE 79 HG22 ILE 79 105.629 -14.056 1.634 461 HG23 ILE 79 HG23 ILE 79 106.654 -14.139 3.067 462 HD11 ILE 79 HD11 ILE 79 105.758 -17.644 2.730 463 HD12 ILE 79 HD12 ILE 79 105.097 -18.514 1.345 464 HD13 ILE 79 HD13 ILE 79 104.303 -17.053 1.930 465 H TYR 80 H TYR 80 107.911 -12.448 0.878 466 HA TYR 80 HA TYR 80 110.133 -12.339 2.891 467 HB2 TYR 80 HB2 TYR 80 109.707 -10.578 0.451 468 HD1 TYR 80 HD2 TYR 80 112.638 -12.402 1.868 469 HD2 TYR 80 HD1 TYR 80 109.798 -12.126 -1.342 470 HE1 TYR 80 HE2 TYR 80 113.924 -14.090 0.585 471 HE2 TYR 80 HE1 TYR 80 111.083 -13.814 -2.625 472 HH TYR 80 HH TYR 80 113.576 -14.599 -2.645 473 H GLY 81 H GLY 81 110.032 -10.469 4.291 474 HA2 GLY 81 HA2 GLY 81 107.449 -8.961 4.194 475 H VAL 82 H VAL 82 107.660 -6.803 5.357 476 HA VAL 82 HA VAL 82 110.496 -5.855 5.437 477 HB VAL 82 HB VAL 82 109.754 -3.860 4.158 478 HG11 VAL 82 HG11 VAL 82 109.093 -6.512 2.839 479 HG12 VAL 82 HG12 VAL 82 110.700 -5.796 2.963 480 HG13 VAL 82 HG13 VAL 82 109.458 -5.010 1.989 481 HG21 VAL 82 HG21 VAL 82 107.545 -3.399 4.115 482 HG22 VAL 82 HG22 VAL 82 107.146 -4.995 4.747 483 HG23 VAL 82 HG23 VAL 82 107.337 -4.757 3.011 484 H VAL 83 H VAL 83 110.916 -4.641 7.181 485 HA VAL 83 HA VAL 83 108.738 -3.166 8.587 486 HB VAL 83 HB VAL 83 110.770 -5.046 9.848 487 HG11 VAL 83 HG11 VAL 83 109.789 -2.874 11.046 488 HG12 VAL 83 HG12 VAL 83 109.980 -4.393 11.921 489 HG13 VAL 83 HG13 VAL 83 108.399 -3.932 11.289 490 HG21 VAL 83 HG21 VAL 83 109.173 -6.482 8.915 491 HG22 VAL 83 HG22 VAL 83 107.864 -5.316 9.115 492 HG23 VAL 83 HG23 VAL 83 108.494 -6.182 10.516 493 H GLY 84 H GLY 84 109.555 -1.224 9.585 494 HA2 GLY 84 HA2 GLY 84 112.080 -0.567 10.362 495 H VAL 85 H VAL 85 112.463 1.837 8.772 496 HA VAL 85 HA VAL 85 110.102 3.426 9.732 497 HB VAL 85 HB VAL 85 111.762 5.122 10.440 498 HG11 VAL 85 HG11 VAL 85 112.773 2.561 11.603 499 HG12 VAL 85 HG12 VAL 85 111.054 2.920 11.770 500 HG13 VAL 85 HG13 VAL 85 112.255 4.036 12.418 501 HG21 VAL 85 HG21 VAL 85 113.467 4.417 8.689 502 HG22 VAL 85 HG22 VAL 85 113.848 3.042 9.727 503 HG23 VAL 85 HG23 VAL 85 114.125 4.686 10.304 504 H GLY 86 H GLY 86 109.733 5.421 8.737 505 HA2 GLY 86 HA2 GLY 86 111.034 5.942 6.108 506 H TYR 87 H TYR 87 111.461 8.149 5.883 507 HA TYR 87 HA TYR 87 109.690 10.070 7.271 508 HB2 TYR 87 HB2 TYR 87 111.472 10.970 8.642 509 HD1 TYR 87 HD2 TYR 87 113.313 11.970 7.349 510 HD2 TYR 87 HD1 TYR 87 113.164 7.755 8.165 511 HE1 TYR 87 HE2 TYR 87 115.707 11.766 6.731 512 HE2 TYR 87 HE1 TYR 87 115.558 7.552 7.552 513 HH TYR 87 HH TYR 87 117.277 10.083 5.991 514 H GLY 88 H GLY 88 110.268 12.341 6.728 515 HA2 GLY 88 HA2 GLY 88 111.804 12.544 4.173 516 H LYS 89 H LYS 89 112.762 14.638 3.820 517 HA LYS 89 HA LYS 89 112.960 16.348 6.276 518 HB2 LYS 89 HB2 LYS 89 114.891 14.792 5.893 519 HG2 LYS 89 HG2 LYS 89 115.450 17.751 5.505 520 HD2 LYS 89 HD2 LYS 89 117.207 15.466 6.455 521 HE2 LYS 89 HE2 LYS 89 118.798 17.713 6.342 522 HZ1 LYS 89 HZ1 LYS 89 117.242 16.420 8.521 523 HZ2 LYS 89 HZ2 LYS 89 118.520 17.499 8.815 524 HZ3 LYS 89 HZ3 LYS 89 118.812 16.033 8.008 525 H PHE 90 H PHE 90 112.882 18.547 5.883 526 HA PHE 90 HA PHE 90 112.632 19.429 3.025 527 HB2 PHE 90 HB2 PHE 90 111.441 20.460 5.622 528 HD1 PHE 90 HD2 PHE 90 110.461 18.244 6.087 529 HD2 PHE 90 HD1 PHE 90 109.805 20.253 2.347 530 HE1 PHE 90 HE2 PHE 90 108.593 16.693 5.581 531 HE2 PHE 90 HE1 PHE 90 107.938 18.704 1.842 532 HZ PHE 90 HZ PHE 90 107.331 16.922 3.458 533 H GLN 91 H GLN 91 113.606 21.495 2.500 534 HA GLN 91 HA GLN 91 115.744 22.355 4.427 535 HB2 GLN 91 HB2 GLN 91 116.474 21.216 2.319 536 HG2 GLN 91 HG2 GLN 91 117.118 24.169 2.579 537 HE21 GLN 91 HE21 GLN 91 119.792 22.118 2.238 538 HE22 GLN 91 HE22 GLN 91 120.064 22.333 0.576 539 H THR 92 H THR 92 114.794 24.158 5.395 540 HA THR 92 HA THR 92 113.920 26.354 3.549 541 HB THR 92 HB THR 92 112.150 26.840 5.224 542 HG1 THR 92 HG1 THR 92 113.060 24.438 6.422 543 HG21 THR 92 HG21 THR 92 111.988 25.069 3.283 544 HG22 THR 92 HG22 THR 92 110.693 25.186 4.474 545 HG23 THR 92 HG23 THR 92 111.906 23.913 4.613 546 H THR 93 H THR 93 114.242 28.518 4.468 547 HA THR 93 HA THR 93 116.201 28.597 6.741 548 HB THR 93 HB THR 93 117.385 30.341 5.468 549 HG1 THR 93 HG1 THR 93 115.447 29.806 3.469 550 HG21 THR 93 HG21 THR 93 117.716 27.795 5.056 551 HG22 THR 93 HG22 THR 93 118.408 28.926 3.894 552 HG23 THR 93 HG23 THR 93 116.899 28.095 3.522 553 H GLU 94 H GLU 94 116.194 30.674 7.906 554 HA GLU 94 HA GLU 94 115.092 32.428 9.027 555 HB2 GLU 94 HB2 GLU 94 113.961 32.707 6.224 556 HG2 GLU 94 HG2 GLU 94 116.442 32.780 6.394 557 H TYR 95 H TYR 95 113.589 31.850 10.546 558 HA TYR 95 HA TYR 95 110.935 30.823 9.590 559 HB2 TYR 95 HB2 TYR 95 112.515 30.299 12.129 560 HD1 TYR 95 HD2 TYR 95 110.833 28.682 9.180 561 HD2 TYR 95 HD1 TYR 95 114.225 28.761 11.816 562 HE1 TYR 95 HE2 TYR 95 111.860 26.812 7.917 563 HE2 TYR 95 HE1 TYR 95 115.251 26.891 10.552 564 HH TYR 95 HH TYR 95 115.066 25.970 8.161 565 HA PRO 96 HA PRO 96 109.999 34.740 11.724 566 HB2 PRO 96 HB2 PRO 96 107.755 35.328 10.270 567 HG2 PRO 96 HG2 PRO 96 107.590 33.564 8.835 568 HD2 PRO 96 HD2 PRO 96 109.099 31.877 8.976 569 H THR 97 H THR 97 107.167 32.851 10.571 570 HA THR 97 HA THR 97 106.446 32.248 13.389 571 HB THR 97 HB THR 97 105.461 34.449 12.700 572 HG1 THR 97 HG1 THR 97 104.334 33.289 14.200 573 HG21 THR 97 HG21 THR 97 103.914 32.772 10.704 574 HG22 THR 97 HG22 THR 97 105.207 33.897 10.286 575 HG23 THR 97 HG23 THR 97 103.710 34.498 10.998 576 H TYR 98 H TYR 98 105.279 30.307 13.565 577 HA TYR 98 HA TYR 98 104.617 28.137 12.881 578 HB2 TYR 98 HB2 TYR 98 103.320 29.934 10.808 579 HD1 TYR 98 HD1 TYR 98 101.995 27.709 13.482 580 HD2 TYR 98 HD2 TYR 98 102.652 31.753 12.194 581 HE1 TYR 98 HE1 TYR 98 100.599 28.533 15.358 582 HE2 TYR 98 HE2 TYR 98 101.256 32.578 14.072 583 HH TYR 98 HH TYR 98 100.284 30.556 16.662 584 H LYS 99 H LYS 99 104.204 26.928 10.478 585 HA LYS 99 HA LYS 99 105.339 25.883 8.693 586 HB2 LYS 99 HB2 LYS 99 106.464 28.700 8.507 587 HG2 LYS 99 HG2 LYS 99 104.067 27.354 7.223 588 HD2 LYS 99 HD2 LYS 99 105.286 30.101 6.801 589 HE2 LYS 99 HE2 LYS 99 102.732 30.014 6.947 590 HZ1 LYS 99 HZ1 LYS 99 101.765 28.878 4.958 591 HZ2 LYS 99 HZ2 LYS 99 102.507 27.821 6.062 592 HZ3 LYS 99 HZ3 LYS 99 103.303 28.246 4.623 593 H ASN 100 H ASN 100 106.479 25.244 11.096 594 HA ASN 100 HA ASN 100 109.187 25.882 11.579 595 HB2 ASN 100 HB2 ASN 100 107.638 23.292 11.915 596 HD21 ASN 100 HD21 ASN 100 106.800 23.157 14.221 597 HD22 ASN 100 HD22 ASN 100 106.402 24.596 15.028 598 H ASP 101 H ASP 101 107.780 23.701 9.182 599 HA ASP 101 HA ASP 101 108.762 22.487 7.412 600 HB2 ASP 101 HB2 ASP 101 110.853 24.636 7.902 601 H THR 102 H THR 102 109.130 21.296 9.910 602 HA THR 102 HA THR 102 111.991 20.530 10.123 603 HB THR 102 HB THR 102 109.769 19.416 11.807 604 HG1 THR 102 HG1 THR 102 109.588 21.295 12.916 605 HG21 THR 102 HG21 THR 102 111.712 20.209 13.492 606 HG22 THR 102 HG22 THR 102 112.672 20.014 12.026 607 HG23 THR 102 HG23 THR 102 111.751 18.652 12.665 608 H SER 103 H SER 103 112.058 17.976 10.783 609 HA SER 103 HA SER 103 110.912 16.543 8.425 610 HB2 SER 103 HB2 SER 103 113.165 15.897 10.355 611 HG SER 103 HG SER 103 113.573 17.640 8.953 612 H ASP 104 H ASP 104 109.977 14.391 8.798 613 HA ASP 104 HA ASP 104 109.108 13.883 11.628 614 HB2 ASP 104 HB2 ASP 104 107.401 15.109 10.233 615 H TYR 105 H TYR 105 109.073 11.658 12.171 616 HA TYR 105 HA TYR 105 109.915 9.780 9.998 617 HB2 TYR 105 HB2 TYR 105 110.360 9.753 13.000 618 HD1 TYR 105 HD2 TYR 105 111.202 12.081 12.955 619 HD2 TYR 105 HD1 TYR 105 112.855 9.034 10.417 620 HE1 TYR 105 HE2 TYR 105 113.170 13.522 12.504 621 HE2 TYR 105 HE1 TYR 105 114.821 10.476 9.967 622 HH TYR 105 HH TYR 105 115.513 13.262 11.791 623 H GLY 106 H GLY 106 109.140 7.532 10.266 624 HA2 GLY 106 HA2 GLY 106 106.893 6.981 12.047 625 H PHE 107 H PHE 107 105.894 4.678 11.082 626 HA PHE 107 HA PHE 107 108.339 3.034 10.500 627 HB2 PHE 107 HB2 PHE 107 105.790 2.454 12.034 628 HD1 PHE 107 HD2 PHE 107 109.352 1.666 12.710 629 HD2 PHE 107 HD1 PHE 107 106.026 4.214 13.655 630 HE1 PHE 107 HE2 PHE 107 110.600 2.575 14.651 631 HE2 PHE 107 HE1 PHE 107 107.274 5.124 15.595 632 HZ PHE 107 HZ PHE 107 109.561 4.304 16.093 633 H SER 108 H SER 108 108.037 1.136 9.151 634 HA SER 108 HA SER 108 105.644 1.281 7.341 635 HB2 SER 108 HB2 SER 108 108.539 0.622 6.710 636 HG SER 108 HG SER 108 108.349 2.785 7.020 637 H TYR 109 H TYR 109 104.952 -0.787 6.469 638 HA TYR 109 HA TYR 109 106.186 -3.261 7.521 639 HB2 TYR 109 HB2 TYR 109 104.650 -2.397 9.292 640 HD1 TYR 109 HD1 TYR 109 105.756 -4.505 10.024 641 HD2 TYR 109 HD2 TYR 109 102.287 -4.523 7.490 642 HE1 TYR 109 HE1 TYR 109 105.400 -6.906 10.530 643 HE2 TYR 109 HE2 TYR 109 101.931 -6.925 7.996 644 HH TYR 109 HH TYR 109 103.532 -8.899 8.757 645 H GLY 110 H GLY 110 105.653 -5.069 6.170 646 HA2 GLY 110 HA2 GLY 110 103.415 -5.319 4.491 647 H ALA 111 H ALA 111 104.111 -6.648 2.357 648 HA ALA 111 HA ALA 111 106.491 -8.315 2.583 649 HB1 ALA 111 HB1 ALA 111 103.931 -9.812 3.020 650 HB2 ALA 111 HB2 ALA 111 104.627 -8.953 4.394 651 HB3 ALA 111 HB3 ALA 111 105.559 -10.204 3.572 652 H GLY 112 H GLY 112 106.443 -10.026 0.754 653 HA2 GLY 112 HA2 GLY 112 104.227 -9.796 -1.151 654 H LEU 113 H LEU 113 105.300 -10.938 -3.361 655 HA LEU 113 HA LEU 113 106.690 -13.421 -2.402 656 HB2 LEU 113 HB2 LEU 113 104.213 -13.677 -2.679 657 HG LEU 113 HG LEU 113 106.083 -15.113 -4.570 658 HD11 LEU 113 HD11 LEU 113 104.672 -16.449 -2.325 659 HD12 LEU 113 HD12 LEU 113 105.871 -15.239 -1.870 660 HD13 LEU 113 HD13 LEU 113 106.342 -16.617 -2.865 661 HD21 LEU 113 HD21 LEU 113 103.466 -14.991 -5.141 662 HD22 LEU 113 HD22 LEU 113 103.400 -16.247 -3.905 663 HD23 LEU 113 HD23 LEU 113 104.391 -16.478 -5.347 664 H GLN 114 H GLN 114 108.073 -14.421 -4.071 665 HA GLN 114 HA GLN 114 108.621 -12.619 -6.400 666 HB2 GLN 114 HB2 GLN 114 110.367 -12.691 -4.633 667 HG2 GLN 114 HG2 GLN 114 111.089 -14.140 -7.200 668 HE21 GLN 114 HE21 GLN 114 113.124 -11.567 -6.472 669 HE22 GLN 114 HE22 GLN 114 114.374 -12.425 -5.708 670 H PHE 115 H PHE 115 109.020 -13.689 -8.418 671 HA PHE 115 HA PHE 115 108.208 -16.579 -8.486 672 HB2 PHE 115 HB2 PHE 115 107.915 -14.326 -10.503 673 HD1 PHE 115 HD2 PHE 115 105.577 -16.983 -9.391 674 HD2 PHE 115 HD1 PHE 115 106.644 -12.831 -9.115 675 HE1 PHE 115 HE2 PHE 115 103.433 -16.509 -8.238 676 HE2 PHE 115 HE1 PHE 115 104.500 -12.358 -7.962 677 HZ PHE 115 HZ PHE 115 102.895 -14.196 -7.523 678 H ASN 116 H ASN 116 109.371 -17.923 -10.029 679 HA ASN 116 HA ASN 116 112.084 -16.834 -10.699 680 HB2 ASN 116 HB2 ASN 116 111.533 -18.806 -9.021 681 HD21 ASN 116 HD21 ASN 116 113.641 -17.839 -8.493 682 HD22 ASN 116 HD22 ASN 116 115.063 -18.380 -9.245 683 HA PRO 117 HA PRO 117 109.886 -17.995 -14.699 684 HB2 PRO 117 HB2 PRO 117 110.209 -15.573 -15.939 685 HG2 PRO 117 HG2 PRO 117 111.212 -14.396 -14.223 686 HD2 PRO 117 HD2 PRO 117 111.228 -15.164 -12.050 687 H MET 118 H MET 118 112.878 -16.690 -13.611 688 HA MET 118 HA MET 118 114.315 -17.919 -15.879 689 HB2 MET 118 HB2 MET 118 114.556 -15.060 -14.893 690 HG2 MET 118 HG2 MET 118 113.805 -16.262 -17.571 691 HE1 MET 118 HE1 MET 118 113.312 -13.347 -19.712 692 HE2 MET 118 HE2 MET 118 112.155 -13.147 -18.399 693 HE3 MET 118 HE3 MET 118 112.530 -14.762 -18.994 694 H GLU 119 H GLU 119 116.193 -18.845 -15.138 695 HA GLU 119 HA GLU 119 116.563 -19.404 -12.384 696 HB2 GLU 119 HB2 GLU 119 118.443 -19.538 -14.755 697 HG2 GLU 119 HG2 GLU 119 116.614 -21.566 -13.433 698 H ASN 120 H ASN 120 118.213 -16.928 -14.419 699 HA ASN 120 HA ASN 120 119.848 -16.131 -12.084 700 HB2 ASN 120 HB2 ASN 120 121.052 -14.827 -13.753 701 HD21 ASN 120 HD21 ASN 120 121.226 -14.269 -16.163 702 HD22 ASN 120 HD22 ASN 120 119.791 -13.944 -17.011 703 H VAL 121 H VAL 121 116.787 -15.244 -13.231 704 HA VAL 121 HA VAL 121 116.941 -12.722 -11.663 705 HB VAL 121 HB VAL 121 115.952 -11.440 -13.563 706 HG11 VAL 121 HG11 VAL 121 118.008 -11.113 -14.703 707 HG12 VAL 121 HG12 VAL 121 118.505 -12.787 -14.451 708 HG13 VAL 121 HG13 VAL 121 118.464 -11.664 -13.093 709 HG21 VAL 121 HG21 VAL 121 114.891 -13.101 -14.886 710 HG22 VAL 121 HG22 VAL 121 116.348 -14.091 -14.957 711 HG23 VAL 121 HG23 VAL 121 116.267 -12.574 -15.853 712 H ALA 122 H ALA 122 115.206 -12.745 -10.328 713 HA ALA 122 HA ALA 122 112.653 -13.995 -11.292 714 HB1 ALA 122 HB1 ALA 122 113.106 -15.310 -9.478 715 HB2 ALA 122 HB2 ALA 122 112.557 -13.923 -8.536 716 HB3 ALA 122 HB3 ALA 122 114.278 -14.160 -8.833 717 H LEU 123 H LEU 123 110.669 -12.839 -10.621 718 HA LEU 123 HA LEU 123 111.176 -9.952 -9.990 719 HB2 LEU 123 HB2 LEU 123 108.869 -11.308 -11.428 720 HG LEU 123 HG LEU 123 110.989 -11.441 -12.703 721 HD11 LEU 123 HD11 LEU 123 110.189 -9.910 -14.653 722 HD12 LEU 123 HD12 LEU 123 108.821 -9.550 -13.600 723 HD13 LEU 123 HD13 LEU 123 109.122 -11.208 -14.118 724 HD21 LEU 123 HD21 LEU 123 112.020 -9.267 -13.448 725 HD22 LEU 123 HD22 LEU 123 112.195 -9.572 -11.720 726 HD23 LEU 123 HD23 LEU 123 110.978 -8.432 -12.295 727 H ASP 124 H ASP 124 109.928 -9.012 -8.286 728 HA ASP 124 HA ASP 124 107.982 -10.821 -6.922 729 HB2 ASP 124 HB2 ASP 124 109.067 -10.193 -4.761 730 H PHE 125 H PHE 125 106.376 -9.742 -5.724 731 HA PHE 125 HA PHE 125 106.271 -6.757 -5.979 732 HB2 PHE 125 HB2 PHE 125 104.947 -8.002 -7.729 733 HD1 PHE 125 HD2 PHE 125 104.861 -5.557 -8.144 734 HD2 PHE 125 HD1 PHE 125 102.353 -7.445 -5.213 735 HE1 PHE 125 HE2 PHE 125 103.420 -3.539 -8.078 736 HE2 PHE 125 HE1 PHE 125 100.913 -5.428 -5.147 737 HZ PHE 125 HZ PHE 125 101.446 -3.475 -6.579 738 H SER 126 H SER 126 105.416 -5.741 -4.111 739 HA SER 126 HA SER 126 104.180 -7.474 -2.021 740 HB2 SER 126 HB2 SER 126 105.821 -6.769 -0.391 741 HG SER 126 HG SER 126 107.071 -5.098 -0.708 742 H TYR 127 H TYR 127 103.237 -6.153 -0.243 743 HA TYR 127 HA TYR 127 102.347 -3.453 -1.211 744 HB2 TYR 127 HB2 TYR 127 101.075 -5.456 0.693 745 HD1 TYR 127 HD2 TYR 127 101.284 -7.341 -0.855 746 HD2 TYR 127 HD1 TYR 127 99.486 -3.641 -2.082 747 HE1 TYR 127 HE2 TYR 127 100.357 -8.458 -2.866 748 HE2 TYR 127 HE1 TYR 127 98.559 -4.756 -4.093 749 HH TYR 127 HH TYR 127 97.934 -7.155 -4.738 750 H GLU 128 H GLU 128 103.071 -1.740 0.048 751 HA GLU 128 HA GLU 128 103.936 -2.356 2.856 752 HB2 GLU 128 HB2 GLU 128 105.792 -2.063 1.215 753 HG2 GLU 128 HG2 GLU 128 105.462 0.147 3.269 754 H GLN 129 H GLN 129 103.052 -1.046 4.387 755 HA GLN 129 HA GLN 129 101.768 1.524 3.513 756 HB2 GLN 129 HB2 GLN 129 100.195 -0.342 4.083 757 HG2 GLN 129 HG2 GLN 129 100.298 1.990 6.022 758 HE21 GLN 129 HE21 GLN 129 97.253 1.675 4.785 759 HE22 GLN 129 HE22 GLN 129 96.548 0.697 5.980 760 H SER 130 H SER 130 102.662 3.287 4.562 761 HA SER 130 HA SER 130 103.998 2.806 7.207 762 HB2 SER 130 HB2 SER 130 105.572 2.981 5.278 763 HG SER 130 HG SER 130 105.739 5.337 6.805 764 H ARG 131 H ARG 131 103.697 4.441 8.740 765 HA ARG 131 HA ARG 131 101.990 6.768 7.909 766 HB2 ARG 131 HB2 ARG 131 101.979 5.071 10.429 767 HG2 ARG 131 HG2 ARG 131 99.969 5.459 8.188 768 HD2 ARG 131 HD2 ARG 131 98.859 5.281 10.404 769 HE ARG 131 HE ARG 131 100.858 3.119 10.752 770 HH11 ARG 131 HH11 ARG 131 98.366 2.074 11.918 771 HH12 ARG 131 HH12 ARG 131 98.383 2.718 13.525 772 HH21 ARG 131 HH21 ARG 131 100.766 5.136 12.817 773 HH22 ARG 131 HH22 ARG 131 99.742 4.452 14.035 774 H ILE 132 H ILE 132 102.915 8.731 8.396 775 HA ILE 132 HA ILE 132 105.218 8.767 10.314 776 HB ILE 132 HB ILE 132 104.595 10.773 8.130 777 HG12 ILE 132 HG12 ILE 132 104.752 8.595 7.013 778 HG21 ILE 132 HG21 ILE 132 106.756 11.542 8.464 779 HG22 ILE 132 HG22 ILE 132 107.324 9.994 9.088 780 HG23 ILE 132 HG23 ILE 132 106.327 11.040 10.098 781 HD11 ILE 132 HD11 ILE 132 107.113 8.288 8.838 782 HD12 ILE 132 HD12 ILE 132 107.126 7.474 7.274 783 HD13 ILE 132 HD13 ILE 132 105.851 7.122 8.440 784 H ARG 133 H ARG 133 103.044 8.930 11.753 785 HA ARG 133 HA ARG 133 101.888 10.275 13.295 786 HB2 ARG 133 HB2 ARG 133 104.170 11.413 13.273 787 HG2 ARG 133 HG2 ARG 133 101.758 13.195 13.740 788 HD2 ARG 133 HD2 ARG 133 103.268 14.148 15.533 789 HE ARG 133 HE ARG 133 103.364 14.565 12.693 790 HH11 ARG 133 HH11 ARG 133 106.122 14.674 14.449 791 HH12 ARG 133 HH12 ARG 133 106.359 16.388 14.377 792 HH21 ARG 133 HH21 ARG 133 103.205 17.036 13.088 793 HH22 ARG 133 HH22 ARG 133 104.707 17.726 13.607 794 H SER 134 H SER 134 102.319 12.312 10.344 795 HA SER 134 HA SER 134 99.329 12.595 10.283 796 HB2 SER 134 HB2 SER 134 99.657 14.897 9.717 797 HG SER 134 HG SER 134 102.419 14.309 9.521 798 H VAL 135 H VAL 135 101.769 11.122 8.665 799 HA VAL 135 HA VAL 135 100.489 11.639 5.994 800 HB VAL 135 HB VAL 135 103.393 11.026 6.631 801 HG11 VAL 135 HG11 VAL 135 103.141 10.252 4.461 802 HG12 VAL 135 HG12 VAL 135 103.479 11.954 4.146 803 HG13 VAL 135 HG13 VAL 135 101.817 11.362 4.109 804 HG21 VAL 135 HG21 VAL 135 103.827 13.353 6.077 805 HG22 VAL 135 HG22 VAL 135 102.599 13.306 7.340 806 HG23 VAL 135 HG23 VAL 135 102.132 13.612 5.667 807 H ASP 136 H ASP 136 99.773 9.816 4.951 808 HA ASP 136 HA ASP 136 100.792 7.153 5.877 809 HB2 ASP 136 HB2 ASP 136 98.555 7.788 6.837 810 H VAL 137 H VAL 137 101.880 6.377 4.042 811 HA VAL 137 HA VAL 137 100.607 6.878 1.389 812 HB VAL 137 HB VAL 137 103.505 6.458 2.201 813 HG11 VAL 137 HG11 VAL 137 102.479 5.915 -0.232 814 HG12 VAL 137 HG12 VAL 137 104.093 6.587 -0.010 815 HG13 VAL 137 HG13 VAL 137 102.745 7.649 -0.416 816 HG21 VAL 137 HG21 VAL 137 103.165 8.607 2.943 817 HG22 VAL 137 HG22 VAL 137 101.785 8.870 1.878 818 HG23 VAL 137 HG23 VAL 137 103.425 8.970 1.237 819 H GLY 138 H GLY 138 100.479 5.091 -0.046 820 HA2 GLY 138 HA2 GLY 138 101.104 2.426 1.167 821 H THR 139 H THR 139 103.112 1.864 0.370 822 HA THR 139 HA THR 139 103.707 2.506 -2.490 823 HB THR 139 HB THR 139 105.560 1.757 -0.214 824 HG1 THR 139 HG1 THR 139 105.534 3.783 0.345 825 HG21 THR 139 HG21 THR 139 106.663 1.418 -2.294 826 HG22 THR 139 HG22 THR 139 107.194 3.005 -1.737 827 HG23 THR 139 HG23 THR 139 105.958 2.878 -2.989 828 H TRP 140 H TRP 140 104.225 0.919 -3.915 829 HA TRP 140 HA TRP 140 104.160 -1.919 -2.948 830 HB2 TRP 140 HB2 TRP 140 103.561 -0.677 -5.661 831 HD1 TRP 140 HD1 TRP 140 101.638 -2.884 -3.126 832 HE1 TRP 140 HE1 TRP 140 99.354 -1.774 -2.676 833 HE3 TRP 140 HE3 TRP 140 102.141 1.348 -5.939 834 HZ2 TRP 140 HZ2 TRP 140 97.930 0.593 -3.412 835 HZ3 TRP 140 HZ3 TRP 140 100.307 3.011 -6.047 836 HH2 TRP 140 HH2 TRP 140 98.204 2.640 -4.788 837 H ILE 141 H ILE 141 105.943 -3.235 -3.550 838 HA ILE 141 HA ILE 141 108.197 -1.790 -4.905 839 HB ILE 141 HB ILE 141 108.215 -4.160 -3.007 840 HG12 ILE 141 HG12 ILE 141 107.411 -2.152 -1.855 841 HG21 ILE 141 HG21 ILE 141 110.321 -2.564 -4.420 842 HG22 ILE 141 HG22 ILE 141 110.243 -4.302 -4.126 843 HG23 ILE 141 HG23 ILE 141 110.673 -3.203 -2.814 844 HD11 ILE 141 HD11 ILE 141 108.030 -0.246 -2.989 845 HD12 ILE 141 HD12 ILE 141 109.614 -0.890 -3.419 846 HD13 ILE 141 HD13 ILE 141 109.327 -0.266 -1.794 847 H ALA 142 H ALA 142 108.867 -2.586 -6.854 848 HA ALA 142 HA ALA 142 108.303 -5.452 -7.512 849 HB1 ALA 142 HB1 ALA 142 107.859 -4.246 -9.889 850 HB2 ALA 142 HB2 ALA 142 107.364 -2.938 -8.814 851 HB3 ALA 142 HB3 ALA 142 106.570 -4.509 -8.715 852 H GLY 143 H GLY 143 110.188 -6.395 -8.292 853 HA2 GLY 143 HA2 GLY 143 112.009 -4.859 -9.987 854 H VAL 144 H VAL 144 114.339 -6.300 -9.398 855 HA VAL 144 HA VAL 144 113.617 -9.012 -10.454 856 HB VAL 144 HB VAL 144 114.856 -7.491 -11.951 857 HG11 VAL 144 HG11 VAL 144 116.771 -7.387 -9.615 858 HG12 VAL 144 HG12 VAL 144 116.005 -6.041 -10.459 859 HG13 VAL 144 HG13 VAL 144 117.274 -6.973 -11.254 860 HG21 VAL 144 HG21 VAL 144 116.808 -9.573 -10.959 861 HG22 VAL 144 HG22 VAL 144 116.548 -9.019 -12.613 862 HG23 VAL 144 HG23 VAL 144 115.332 -10.018 -11.816 863 H GLY 145 H GLY 145 115.343 -10.720 -9.862 864 HA2 GLY 145 HA2 GLY 145 116.563 -10.230 -7.192 865 H TYR 146 H TYR 146 118.514 -11.197 -6.958 866 HA TYR 146 HA TYR 146 119.360 -13.263 -8.972 867 HB2 TYR 146 HB2 TYR 146 120.973 -11.070 -7.612 868 HD1 TYR 146 HD1 TYR 146 120.989 -12.023 -11.167 869 HD2 TYR 146 HD2 TYR 146 119.480 -9.249 -8.256 870 HE1 TYR 146 HE1 TYR 146 120.279 -10.497 -12.988 871 HE2 TYR 146 HE2 TYR 146 118.769 -7.724 -10.077 872 HH TYR 146 HH TYR 146 118.606 -8.682 -13.315 873 H ARG 147 H ARG 147 120.323 -15.130 -8.002 874 HA ARG 147 HA ARG 147 120.789 -14.972 -5.037 875 HB2 ARG 147 HB2 ARG 147 118.692 -16.137 -5.727 876 HG2 ARG 147 HG2 ARG 147 120.875 -17.917 -4.596 877 HD2 ARG 147 HD2 ARG 147 117.842 -18.128 -4.463 878 HE ARG 147 HE ARG 147 119.009 -18.723 -2.307 879 HH11 ARG 147 HH21 ARG 147 117.759 -21.107 -4.052 880 HH12 ARG 147 HH22 ARG 147 118.871 -22.356 -3.601 881 HH21 ARG 147 HH11 ARG 147 121.147 -20.175 -2.155 882 HH22 ARG 147 HH12 ARG 147 120.790 -21.829 -2.528 883 H PHE 148 H PHE 148 122.909 -15.368 -4.579 884 HA PHE 148 HA PHE 148 124.356 -17.457 -6.162 885 HB2 PHE 148 HB2 PHE 148 124.759 -15.116 -7.015 886 HD1 PHE 148 HD1 PHE 148 125.875 -16.760 -8.488 887 HD2 PHE 148 HD2 PHE 148 127.605 -15.546 -4.749 888 HE1 PHE 148 HE1 PHE 148 128.054 -17.715 -9.187 889 HE2 PHE 148 HE2 PHE 148 129.784 -16.501 -5.447 890 HZ PHE 148 HZ PHE 148 130.010 -17.586 -7.667 Start of MODEL 3 1 H THR 2 H THR 2 123.764 -17.896 0.305 2 HA THR 2 HA THR 2 125.765 -17.021 -1.751 3 HB THR 2 HB THR 2 123.943 -17.345 -3.390 4 HG1 THR 2 HG1 THR 2 122.481 -18.419 -1.218 5 HG21 THR 2 HG21 THR 2 125.465 -19.283 -2.333 6 HG22 THR 2 HG22 THR 2 124.245 -19.617 -3.562 7 HG23 THR 2 HG23 THR 2 123.883 -19.901 -1.861 8 H SER 3 H SER 3 124.743 -15.080 -3.049 9 HA SER 3 HA SER 3 123.560 -13.186 -1.048 10 HB2 SER 3 HB2 SER 3 124.671 -11.475 -2.404 11 HG SER 3 HG SER 3 125.870 -12.164 -4.230 12 H THR 4 H THR 4 121.802 -11.810 -1.789 13 HA THR 4 HA THR 4 120.579 -12.617 -4.396 14 HB THR 4 HB THR 4 119.142 -12.283 -1.748 15 HG1 THR 4 HG1 THR 4 119.511 -14.316 -1.449 16 HG21 THR 4 HG21 THR 4 117.181 -12.765 -2.861 17 HG22 THR 4 HG22 THR 4 118.002 -13.676 -4.128 18 HG23 THR 4 HG23 THR 4 118.044 -11.913 -4.142 19 H VAL 5 H VAL 5 119.715 -10.900 -5.531 20 HA VAL 5 HA VAL 5 119.744 -8.211 -4.194 21 HB VAL 5 HB VAL 5 120.126 -9.002 -7.105 22 HG11 VAL 5 HG11 VAL 5 120.888 -6.626 -7.324 23 HG12 VAL 5 HG12 VAL 5 120.361 -6.344 -5.665 24 HG13 VAL 5 HG13 VAL 5 119.181 -6.768 -6.905 25 HG21 VAL 5 HG21 VAL 5 122.012 -8.464 -4.831 26 HG22 VAL 5 HG22 VAL 5 122.488 -7.995 -6.463 27 HG23 VAL 5 HG23 VAL 5 122.118 -9.681 -6.102 28 H THR 6 H THR 6 117.803 -7.045 -4.271 29 HA THR 6 HA THR 6 115.706 -7.805 -6.217 30 HB THR 6 HB THR 6 115.352 -8.016 -3.207 31 HG1 THR 6 HG1 THR 6 116.375 -9.818 -3.767 32 HG21 THR 6 HG21 THR 6 113.378 -9.111 -5.143 33 HG22 THR 6 HG22 THR 6 113.418 -7.358 -4.957 34 HG23 THR 6 HG23 THR 6 113.117 -8.388 -3.557 35 H GLY 7 H GLY 7 114.673 -5.904 -6.836 36 HA2 GLY 7 HA2 GLY 7 114.035 -3.832 -4.901 37 H GLY 8 H GLY 8 113.122 -1.845 -6.154 38 HA2 GLY 8 HA2 GLY 8 112.338 -2.088 -8.894 39 H TYR 9 H TYR 9 109.510 -1.126 -7.836 40 HA TYR 9 HA TYR 9 110.307 1.575 -6.861 41 HB2 TYR 9 HB2 TYR 9 109.125 2.638 -8.699 42 HD1 TYR 9 HD2 TYR 9 109.436 -0.731 -10.223 43 HD2 TYR 9 HD1 TYR 9 106.748 2.353 -8.913 44 HE1 TYR 9 HE2 TYR 9 107.559 -1.883 -11.363 45 HE2 TYR 9 HE1 TYR 9 104.870 1.201 -10.052 46 HH TYR 9 HH TYR 9 104.417 -1.329 -10.747 47 H ALA 10 H ALA 10 108.334 2.803 -6.019 48 HA ALA 10 HA ALA 10 105.996 0.999 -5.529 49 HB1 ALA 10 HB1 ALA 10 106.209 1.851 -3.086 50 HB2 ALA 10 HB2 ALA 10 107.858 2.282 -3.540 51 HB3 ALA 10 HB3 ALA 10 107.328 0.602 -3.629 52 H GLN 11 H GLN 11 104.078 2.056 -5.561 53 HA GLN 11 HA GLN 11 104.073 5.052 -5.674 54 HB2 GLN 11 HB2 GLN 11 103.237 3.729 -7.642 55 HG2 GLN 11 HG2 GLN 11 101.074 5.209 -6.107 56 HE21 GLN 11 HE21 GLN 11 99.670 6.419 -7.872 57 HE22 GLN 11 HE22 GLN 11 99.258 5.507 -9.242 58 H SER 12 H SER 12 103.215 6.024 -3.822 59 HA SER 12 HA SER 12 101.446 4.309 -2.104 60 HB2 SER 12 HB2 SER 12 103.453 6.396 -1.226 61 HG SER 12 HG SER 12 104.922 4.918 -1.356 62 H ASP 13 H ASP 13 99.757 5.310 -1.018 63 HA ASP 13 HA ASP 13 98.927 8.003 -1.999 64 HB2 ASP 13 HB2 ASP 13 97.419 5.951 -2.061 65 H ALA 14 H ALA 14 98.470 9.672 -0.300 66 HA ALA 14 HA ALA 14 99.569 8.950 2.373 67 HB1 ALA 14 HB1 ALA 14 101.308 9.997 1.029 68 HB2 ALA 14 HB2 ALA 14 100.794 11.122 2.286 69 HB3 ALA 14 HB3 ALA 14 100.229 11.332 0.628 70 H GLN 15 H GLN 15 98.157 9.440 3.890 71 HA GLN 15 HA GLN 15 95.824 11.120 3.471 72 HB2 GLN 15 HB2 GLN 15 95.969 9.109 4.973 73 HG2 GLN 15 HG2 GLN 15 95.289 11.753 6.296 74 HE21 GLN 15 HE21 GLN 15 92.871 9.493 6.693 75 HE22 GLN 15 HE22 GLN 15 93.308 8.881 8.214 76 H GLY 16 H GLY 16 96.026 13.287 3.403 77 HA2 GLY 16 HA2 GLY 16 96.439 15.393 4.619 78 H GLN 17 H GLN 17 98.592 13.382 2.737 79 HA GLN 17 HA GLN 17 99.521 15.793 1.204 80 HB2 GLN 17 HB2 GLN 17 101.257 14.463 2.419 81 HG2 GLN 17 HG2 GLN 17 101.363 14.206 -0.603 82 HE21 GLN 17 HE21 GLN 17 103.819 14.580 -1.242 83 HE22 GLN 17 HE22 GLN 17 104.958 13.757 -0.289 84 H MET 18 H MET 18 97.874 15.847 -0.382 85 HA MET 18 HA MET 18 96.643 13.579 -1.600 86 HB2 MET 18 HB2 MET 18 97.115 16.420 -2.548 87 HG2 MET 18 HG2 MET 18 94.793 15.061 -1.148 88 HE1 MET 18 HE1 MET 18 93.120 18.595 -0.460 89 HE2 MET 18 HE2 MET 18 93.976 17.284 0.349 90 HE3 MET 18 HE3 MET 18 92.490 16.943 -0.534 91 H ASN 19 H ASN 19 99.484 15.489 -2.605 92 HA ASN 19 HA ASN 19 99.910 14.359 -5.160 93 HB2 ASN 19 HB2 ASN 19 101.930 15.256 -3.079 94 HD21 ASN 19 HD21 ASN 19 99.782 16.230 -5.804 95 HD22 ASN 19 HD22 ASN 19 99.683 17.859 -5.341 96 H LYS 20 H LYS 20 100.227 12.263 -5.702 97 HA LYS 20 HA LYS 20 100.938 10.197 -3.796 98 HB2 LYS 20 HB2 LYS 20 100.828 8.767 -5.781 99 HG2 LYS 20 HG2 LYS 20 100.924 11.383 -7.317 100 HD2 LYS 20 HD2 LYS 20 100.311 8.545 -8.176 101 HE2 LYS 20 HE2 LYS 20 101.665 10.742 -9.627 102 HZ1 LYS 20 HZ1 LYS 20 100.303 10.316 -11.612 103 HZ2 LYS 20 HZ2 LYS 20 99.376 10.984 -10.355 104 HZ3 LYS 20 HZ3 LYS 20 99.275 9.323 -10.701 105 H MET 21 H MET 21 102.928 8.809 -4.039 106 HA MET 21 HA MET 21 105.266 10.405 -5.042 107 HB2 MET 21 HB2 MET 21 104.968 8.716 -2.540 108 HG2 MET 21 HG2 MET 21 105.238 11.702 -2.997 109 HE1 MET 21 HE1 MET 21 104.796 9.537 0.981 110 HE2 MET 21 HE2 MET 21 105.587 8.620 -0.298 111 HE3 MET 21 HE3 MET 21 103.966 9.260 -0.556 112 H GLY 22 H GLY 22 107.107 9.140 -5.687 113 HA2 GLY 22 HA2 GLY 22 106.687 6.221 -6.096 114 H GLY 23 H GLY 23 108.538 5.189 -5.410 115 HA2 GLY 23 HA2 GLY 23 111.134 6.621 -5.804 116 H PHE 24 H PHE 24 112.906 4.891 -4.838 117 HA PHE 24 HA PHE 24 112.285 2.286 -6.195 118 HB2 PHE 24 HB2 PHE 24 114.840 3.921 -6.108 119 HD1 PHE 24 HD1 PHE 24 113.225 2.038 -8.860 120 HD2 PHE 24 HD2 PHE 24 113.928 5.907 -7.130 121 HE1 PHE 24 HE1 PHE 24 112.352 3.117 -10.916 122 HE2 PHE 24 HE2 PHE 24 113.057 6.986 -9.186 123 HZ PHE 24 HZ PHE 24 112.268 5.591 -11.078 124 H ASN 25 H ASN 25 113.531 0.459 -5.334 125 HA ASN 25 HA ASN 25 114.607 0.847 -2.567 126 HB2 ASN 25 HB2 ASN 25 112.108 0.229 -2.728 127 HD21 ASN 25 HD21 ASN 25 111.261 -1.142 -0.827 128 HD22 ASN 25 HD22 ASN 25 112.332 -1.458 0.452 129 H LEU 26 H LEU 26 116.460 -0.322 -2.249 130 HA LEU 26 HA LEU 26 117.022 -2.637 -4.094 131 HB2 LEU 26 HB2 LEU 26 118.291 -0.352 -4.327 132 HG LEU 26 HG LEU 26 120.420 -1.510 -4.812 133 HD11 LEU 26 HD11 LEU 26 119.283 -4.098 -3.833 134 HD12 LEU 26 HD12 LEU 26 120.016 -3.012 -2.653 135 HD13 LEU 26 HD13 LEU 26 120.968 -3.609 -4.012 136 HD21 LEU 26 HD21 LEU 26 118.242 -1.777 -6.210 137 HD22 LEU 26 HD22 LEU 26 118.202 -3.413 -5.553 138 HD23 LEU 26 HD23 LEU 26 119.576 -2.887 -6.526 139 H LYS 27 H LYS 27 117.502 -4.585 -2.906 140 HA LYS 27 HA LYS 27 118.100 -4.189 0.000 141 HB2 LYS 27 HB2 LYS 27 116.325 -6.280 -1.296 142 HG2 LYS 27 HG2 LYS 27 115.638 -3.697 0.127 143 HD2 LYS 27 HD2 LYS 27 113.893 -6.043 -0.683 144 HE2 LYS 27 HE2 LYS 27 113.228 -3.199 0.108 145 HZ1 LYS 27 HZ1 LYS 27 111.625 -5.695 0.373 146 HZ2 LYS 27 HZ2 LYS 27 110.999 -4.128 0.564 147 HZ3 LYS 27 HZ3 LYS 27 112.172 -4.714 1.644 148 H TYR 28 H TYR 28 119.551 -5.654 0.892 149 HA TYR 28 HA TYR 28 120.841 -7.624 -0.974 150 HB2 TYR 28 HB2 TYR 28 121.941 -6.061 1.395 151 HD1 TYR 28 HD2 TYR 28 123.249 -6.761 -2.016 152 HD2 TYR 28 HD1 TYR 28 121.548 -3.834 0.628 153 HE1 TYR 28 HE2 TYR 28 123.760 -4.977 -3.661 154 HE2 TYR 28 HE1 TYR 28 122.060 -2.051 -1.017 155 HH TYR 28 HH TYR 28 124.119 -2.095 -3.191 156 H ARG 29 H ARG 29 120.713 -9.768 -0.259 157 HA ARG 29 HA ARG 29 119.820 -10.188 2.577 158 HB2 ARG 29 HB2 ARG 29 118.061 -10.503 0.879 159 HG2 ARG 29 HG2 ARG 29 119.092 -13.062 2.142 160 HD2 ARG 29 HD2 ARG 29 116.350 -12.390 1.004 161 HE ARG 29 HE ARG 29 116.626 -13.873 3.176 162 HH11 ARG 29 HH21 ARG 29 115.231 -14.616 0.285 163 HH12 ARG 29 HH22 ARG 29 115.289 -16.337 0.463 164 HH21 ARG 29 HH11 ARG 29 117.354 -16.248 3.244 165 HH22 ARG 29 HH12 ARG 29 116.490 -17.260 2.136 166 H TYR 30 H TYR 30 120.850 -11.715 3.732 167 HA TYR 30 HA TYR 30 122.945 -13.400 2.391 168 HB2 TYR 30 HB2 TYR 30 123.766 -11.548 3.858 169 HD1 TYR 30 HD1 TYR 30 125.677 -12.799 2.867 170 HD2 TYR 30 HD2 TYR 30 123.610 -14.205 6.359 171 HE1 TYR 30 HE1 TYR 30 127.557 -14.342 3.358 172 HE2 TYR 30 HE2 TYR 30 125.488 -15.749 6.850 173 HH TYR 30 HH TYR 30 128.190 -15.636 6.142 174 H GLU 31 H GLU 31 122.827 -15.630 2.875 175 HA GLU 31 HA GLU 31 121.079 -16.517 5.108 176 HB2 GLU 31 HB2 GLU 31 119.763 -17.914 3.543 177 HG2 GLU 31 HG2 GLU 31 121.446 -16.522 1.433 178 H GLU 32 H GLU 32 121.289 -18.900 5.466 179 HA GLU 32 HA GLU 32 123.959 -19.912 4.562 180 HB2 GLU 32 HB2 GLU 32 123.520 -19.353 7.010 181 HG2 GLU 32 HG2 GLU 32 124.130 -22.233 6.279 182 H ASP 33 H ASP 33 123.893 -21.758 3.329 183 HA ASP 33 HA ASP 33 121.504 -22.895 2.312 184 HB2 ASP 33 HB2 ASP 33 124.323 -23.974 2.609 185 H ASN 34 H ASN 34 123.252 -23.595 5.262 186 HA ASN 34 HA ASN 34 122.308 -26.225 5.811 187 HB2 ASN 34 HB2 ASN 34 123.025 -23.893 7.615 188 HD21 ASN 34 HD21 ASN 34 125.356 -24.157 8.362 189 HD22 ASN 34 HD22 ASN 34 126.463 -24.903 7.312 190 H SER 35 H SER 35 120.820 -23.046 6.491 191 HA SER 35 HA SER 35 118.280 -24.501 7.144 192 HB2 SER 35 HB2 SER 35 118.019 -22.572 8.855 193 HG SER 35 HG SER 35 120.390 -22.111 9.490 194 HA PRO 36 HA PRO 36 116.461 -21.420 4.546 195 HB2 PRO 36 HB2 PRO 36 113.903 -21.387 5.498 196 HG2 PRO 36 HG2 PRO 36 113.965 -22.526 7.451 197 HD2 PRO 36 HD2 PRO 36 116.039 -22.889 8.257 198 H LEU 37 H LEU 37 117.783 -20.321 7.009 199 HA LEU 37 HA LEU 37 115.980 -18.167 7.934 200 HB2 LEU 37 HB2 LEU 37 118.901 -18.784 8.500 201 HG LEU 37 HG LEU 37 117.387 -20.634 9.150 202 HD11 LEU 37 HD11 LEU 37 117.810 -20.370 11.722 203 HD12 LEU 37 HD12 LEU 37 118.660 -18.898 11.252 204 HD13 LEU 37 HD13 LEU 37 119.193 -20.461 10.632 205 HD21 LEU 37 HD21 LEU 37 115.284 -19.502 9.405 206 HD22 LEU 37 HD22 LEU 37 115.954 -18.393 10.603 207 HD23 LEU 37 HD23 LEU 37 115.721 -20.094 11.008 208 H GLY 38 H GLY 38 116.140 -16.030 7.246 209 HA2 GLY 38 HA2 GLY 38 118.461 -15.233 5.582 210 H VAL 39 H VAL 39 118.917 -13.074 5.708 211 HA VAL 39 HA VAL 39 116.952 -11.282 7.095 212 HB VAL 39 HB VAL 39 119.966 -11.470 7.478 213 HG11 VAL 39 HG11 VAL 39 119.245 -9.195 7.802 214 HG12 VAL 39 HG12 VAL 39 119.450 -9.904 9.404 215 HG13 VAL 39 HG13 VAL 39 117.834 -9.715 8.723 216 HG21 VAL 39 HG21 VAL 39 117.605 -12.513 9.021 217 HG22 VAL 39 HG22 VAL 39 119.075 -12.059 9.882 218 HG23 VAL 39 HG23 VAL 39 119.130 -13.317 8.648 219 H ILE 40 H ILE 40 116.611 -9.403 5.854 220 HA ILE 40 HA ILE 40 118.705 -8.741 3.815 221 HB ILE 40 HB ILE 40 116.760 -9.918 2.867 222 HG12 ILE 40 HG12 ILE 40 116.533 -6.980 2.176 223 HG21 ILE 40 HG21 ILE 40 115.333 -8.331 4.769 224 HG22 ILE 40 HG22 ILE 40 114.702 -9.590 3.710 225 HG23 ILE 40 HG23 ILE 40 114.734 -7.914 3.163 226 HD11 ILE 40 HD11 ILE 40 115.519 -7.703 0.277 227 HD12 ILE 40 HD12 ILE 40 115.289 -9.224 1.138 228 HD13 ILE 40 HD13 ILE 40 116.673 -9.019 0.064 229 H GLY 41 H GLY 41 119.113 -6.542 3.514 230 HA2 GLY 41 HA2 GLY 41 117.720 -4.668 5.383 231 H SER 42 H SER 42 116.589 -2.948 4.437 232 HA SER 42 HA SER 42 116.869 -2.646 1.465 233 HB2 SER 42 HB2 SER 42 114.378 -2.371 1.488 234 HG SER 42 HG SER 42 114.236 -3.516 3.990 235 H PHE 43 H PHE 43 116.775 -0.551 0.671 236 HA PHE 43 HA PHE 43 116.277 1.657 2.649 237 HB2 PHE 43 HB2 PHE 43 118.342 1.438 0.423 238 HD1 PHE 43 HD1 PHE 43 118.644 2.823 3.839 239 HD2 PHE 43 HD2 PHE 43 119.430 -0.546 1.292 240 HE1 PHE 43 HE1 PHE 43 120.131 1.858 5.572 241 HE2 PHE 43 HE2 PHE 43 120.917 -1.510 3.026 242 HZ PHE 43 HZ PHE 43 121.268 -0.308 5.166 243 H THR 44 H THR 44 114.770 3.196 1.837 244 HA THR 44 HA THR 44 114.195 3.027 -1.101 245 HB THR 44 HB THR 44 112.636 1.647 0.281 246 HG1 THR 44 HG1 THR 44 111.832 2.495 -1.601 247 HG21 THR 44 HG21 THR 44 111.265 4.035 1.353 248 HG22 THR 44 HG22 THR 44 112.810 3.659 2.116 249 HG23 THR 44 HG23 THR 44 111.522 2.455 2.093 250 H TYR 45 H TYR 45 113.481 4.972 -2.057 251 HA TYR 45 HA TYR 45 113.159 7.345 -0.305 252 HB2 TYR 45 HB2 TYR 45 114.803 8.584 -1.648 253 HD1 TYR 45 HD2 TYR 45 115.882 5.116 -2.423 254 HD2 TYR 45 HD1 TYR 45 114.591 8.893 -4.008 255 HE1 TYR 45 HE2 TYR 45 116.513 4.375 -4.702 256 HE2 TYR 45 HE1 TYR 45 115.224 8.153 -6.289 257 HH TYR 45 HH TYR 45 116.678 6.543 -7.359 258 H THR 46 H THR 46 111.116 7.960 -0.891 259 HA THR 46 HA THR 46 110.416 7.907 -3.809 260 HB THR 46 HB THR 46 108.670 7.530 -1.356 261 HG1 THR 46 HG1 THR 46 109.340 5.567 -1.482 262 HG21 THR 46 HG21 THR 46 107.671 6.582 -3.923 263 HG22 THR 46 HG22 THR 46 107.948 8.324 -3.917 264 HG23 THR 46 HG23 THR 46 106.881 7.597 -2.718 265 H GLU 47 H GLU 47 109.635 9.808 -4.673 266 HA GLU 47 HA GLU 47 108.593 11.953 -2.933 267 HB2 GLU 47 HB2 GLU 47 111.095 12.099 -2.896 268 HG2 GLU 47 HG2 GLU 47 109.673 14.309 -4.412 269 H LYS 48 H LYS 48 107.765 13.781 -4.327 270 HA LYS 48 HA LYS 48 106.347 12.808 -6.650 271 HB2 LYS 48 HB2 LYS 48 105.624 14.622 -5.075 272 HG2 LYS 48 HG2 LYS 48 105.902 15.399 -7.996 273 HD2 LYS 48 HD2 LYS 48 104.044 16.412 -5.820 274 HE2 LYS 48 HE2 LYS 48 103.496 17.964 -7.963 275 HZ1 LYS 48 HZ1 LYS 48 102.435 15.295 -7.186 276 HZ2 LYS 48 HZ2 LYS 48 101.598 16.373 -8.198 277 HZ3 LYS 48 HZ3 LYS 48 101.942 16.805 -6.592 278 H SER 49 H SER 49 106.820 13.134 -8.851 279 HA SER 49 HA SER 49 109.621 13.701 -9.529 280 HB2 SER 49 HB2 SER 49 108.243 11.886 -10.539 281 HG SER 49 HG SER 49 108.728 12.523 -12.753 282 H ARG 50 H ARG 50 110.370 15.524 -10.616 283 HA ARG 50 HA ARG 50 108.378 17.699 -11.180 284 HB2 ARG 50 HB2 ARG 50 111.175 17.809 -10.009 285 HG2 ARG 50 HG2 ARG 50 108.430 18.453 -8.892 286 HD2 ARG 50 HD2 ARG 50 111.213 18.881 -7.740 287 HE ARG 50 HE ARG 50 108.825 19.443 -6.127 288 HH11 ARG 50 HH11 ARG 50 111.825 18.067 -6.045 289 HH12 ARG 50 HH12 ARG 50 111.391 16.692 -5.087 290 HH21 ARG 50 HH21 ARG 50 107.981 17.268 -5.323 291 HH22 ARG 50 HH22 ARG 50 109.215 16.239 -4.676 292 H THR 51 H THR 51 109.055 19.179 -12.919 293 HA THR 51 HA THR 51 110.295 17.797 -15.167 294 HB THR 51 HB THR 51 109.762 19.895 -16.328 295 HG1 THR 51 HG1 THR 51 110.363 21.407 -14.854 296 HG21 THR 51 HG21 THR 51 107.417 19.847 -16.062 297 HG22 THR 51 HG22 THR 51 107.532 19.460 -14.346 298 HG23 THR 51 HG23 THR 51 107.934 18.240 -15.554 299 H ALA 52 H ALA 52 112.168 18.794 -16.368 300 HA ALA 52 HA ALA 52 114.442 19.195 -14.633 301 HB1 ALA 52 HB1 ALA 52 115.344 19.929 -17.048 302 HB2 ALA 52 HB2 ALA 52 113.816 19.210 -17.555 303 HB3 ALA 52 HB3 ALA 52 114.994 18.242 -16.670 304 H SER 53 H SER 53 114.147 21.065 -13.348 305 HA SER 53 HA SER 53 114.097 23.667 -14.844 306 HB2 SER 53 HB2 SER 53 112.876 22.953 -12.157 307 HG SER 53 HG SER 53 111.040 22.747 -13.209 308 H SER 54 H SER 54 115.422 25.342 -13.917 309 HA SER 54 HA SER 54 117.925 24.588 -12.818 310 HB2 SER 54 HB2 SER 54 116.433 27.221 -12.583 311 HG SER 54 HG SER 54 117.006 27.574 -14.599 312 H GLY 55 H GLY 55 114.904 25.502 -11.229 313 HA2 GLY 55 HA2 GLY 55 116.206 25.222 -8.561 314 H ASP 56 H ASP 56 116.277 23.029 -8.127 315 HA ASP 56 HA ASP 56 114.437 21.049 -8.990 316 HB2 ASP 56 HB2 ASP 56 116.227 21.262 -6.550 317 H TYR 57 H TYR 57 114.453 23.009 -6.006 318 HA TYR 57 HA TYR 57 112.804 23.281 -4.327 319 HB2 TYR 57 HB2 TYR 57 111.850 24.339 -6.377 320 HD1 TYR 57 HD2 TYR 57 111.195 25.606 -4.339 321 HD2 TYR 57 HD1 TYR 57 109.108 22.060 -5.573 322 HE1 TYR 57 HE2 TYR 57 109.308 26.195 -2.841 323 HE2 TYR 57 HE1 TYR 57 107.221 22.650 -4.076 324 HH TYR 57 HH TYR 57 106.834 25.694 -2.717 325 H ASN 58 H ASN 58 113.135 21.322 -3.094 326 HA ASN 58 HA ASN 58 111.394 19.008 -3.840 327 HB2 ASN 58 HB2 ASN 58 112.954 17.734 -2.414 328 HD21 ASN 58 HD21 ASN 58 114.883 17.764 -1.001 329 HD22 ASN 58 HD22 ASN 58 115.318 19.174 -0.166 330 H LYS 59 H LYS 59 109.449 19.135 -2.784 331 HA LYS 59 HA LYS 59 109.085 20.573 -0.291 332 HB2 LYS 59 HB2 LYS 59 107.374 20.318 -2.060 333 HG2 LYS 59 HG2 LYS 59 106.633 19.017 0.578 334 HD2 LYS 59 HD2 LYS 59 104.955 20.299 -1.599 335 HE2 LYS 59 HE2 LYS 59 104.253 19.484 1.245 336 HZ1 LYS 59 HZ1 LYS 59 102.756 18.648 -0.535 337 HZ2 LYS 59 HZ2 LYS 59 102.500 20.250 -1.039 338 HZ3 LYS 59 HZ3 LYS 59 101.996 19.750 0.505 339 H ASN 60 H ASN 60 107.603 17.407 -0.272 340 HA ASN 60 HA ASN 60 109.245 16.715 2.118 341 HB2 ASN 60 HB2 ASN 60 106.577 15.727 1.060 342 HD21 ASN 60 HD21 ASN 60 104.819 16.991 1.805 343 HD22 ASN 60 HD22 ASN 60 104.988 18.336 2.826 344 H GLN 61 H GLN 61 110.372 14.758 2.214 345 HA GLN 61 HA GLN 61 110.408 13.100 -0.290 346 HB2 GLN 61 HB2 GLN 61 112.580 13.797 1.715 347 HG2 GLN 61 HG2 GLN 61 112.233 14.465 -1.224 348 HE21 GLN 61 HE21 GLN 61 114.080 15.630 -2.110 349 HE22 GLN 61 HE22 GLN 61 115.583 15.644 -1.323 350 H TYR 62 H TYR 62 110.486 10.808 0.026 351 HA TYR 62 HA TYR 62 109.784 9.921 2.804 352 HB2 TYR 62 HB2 TYR 62 108.058 9.711 1.029 353 HD1 TYR 62 HD1 TYR 62 107.138 8.899 3.183 354 HD2 TYR 62 HD2 TYR 62 109.613 6.415 0.703 355 HE1 TYR 62 HE1 TYR 62 106.400 6.898 4.450 356 HE2 TYR 62 HE2 TYR 62 108.876 4.414 1.970 357 HH TYR 62 HH TYR 62 107.963 3.964 4.323 358 H TYR 63 H TYR 63 111.983 9.580 3.428 359 HA TYR 63 HA TYR 63 113.396 7.327 2.021 360 HB2 TYR 63 HB2 TYR 63 114.500 9.569 2.003 361 HD1 TYR 63 HD2 TYR 63 115.936 7.990 0.768 362 HD2 TYR 63 HD1 TYR 63 115.965 8.164 5.058 363 HE1 TYR 63 HE2 TYR 63 118.053 6.698 0.805 364 HE2 TYR 63 HE1 TYR 63 118.083 6.874 5.096 365 HH TYR 63 HH TYR 63 120.099 6.598 3.157 366 H GLY 64 H GLY 64 113.993 5.500 3.381 367 HA2 GLY 64 HA2 GLY 64 113.887 5.838 6.272 368 H ILE 65 H ILE 65 114.079 3.805 7.386 369 HA ILE 65 HA ILE 65 115.907 1.917 5.919 370 HB ILE 65 HB ILE 65 116.799 1.422 8.173 371 HG12 ILE 65 HG12 ILE 65 114.826 3.495 9.172 372 HG21 ILE 65 HG21 ILE 65 117.953 3.210 7.196 373 HG22 ILE 65 HG22 ILE 65 117.450 3.883 8.747 374 HG23 ILE 65 HG23 ILE 65 116.557 4.285 7.281 375 HD11 ILE 65 HD11 ILE 65 116.509 1.549 10.756 376 HD12 ILE 65 HD12 ILE 65 115.680 2.994 11.334 377 HD13 ILE 65 HD13 ILE 65 117.107 3.146 10.309 378 H THR 66 H THR 66 115.416 -0.298 5.870 379 HA THR 66 HA THR 66 113.190 -1.300 7.543 380 HB THR 66 HB THR 66 112.329 -2.233 5.175 381 HG1 THR 66 HG1 THR 66 114.040 -1.103 4.091 382 HG21 THR 66 HG21 THR 66 110.572 -0.773 5.443 383 HG22 THR 66 HG22 THR 66 111.627 0.614 5.714 384 HG23 THR 66 HG23 THR 66 111.351 -0.552 7.009 385 H ALA 67 H ALA 67 113.385 -3.516 7.946 386 HA ALA 67 HA ALA 67 115.093 -5.214 6.248 387 HB1 ALA 67 HB1 ALA 67 116.635 -5.698 8.116 388 HB2 ALA 67 HB2 ALA 67 115.751 -4.571 9.145 389 HB3 ALA 67 HB3 ALA 67 116.647 -3.973 7.749 390 H GLY 68 H GLY 68 114.760 -7.505 6.819 391 HA2 GLY 68 HA2 GLY 68 113.086 -8.217 9.081 392 HA PRO 69 HA PRO 69 114.792 -12.147 8.218 393 HB2 PRO 69 HB2 PRO 69 112.848 -13.856 9.100 394 HG2 PRO 69 HG2 PRO 69 111.066 -12.424 9.304 395 HD2 PRO 69 HD2 PRO 69 111.314 -10.166 9.068 396 H ALA 70 H ALA 70 114.273 -14.301 7.079 397 HA ALA 70 HA ALA 70 112.208 -14.026 4.939 398 HB1 ALA 70 HB1 ALA 70 114.699 -13.245 4.441 399 HB2 ALA 70 HB2 ALA 70 113.798 -14.169 3.239 400 HB3 ALA 70 HB3 ALA 70 114.974 -14.979 4.271 401 H TYR 71 H TYR 71 111.227 -15.987 4.513 402 HA TYR 71 HA TYR 71 112.489 -18.456 5.666 403 HB2 TYR 71 HB2 TYR 71 109.578 -17.605 5.574 404 HD1 TYR 71 HD1 TYR 71 111.749 -19.076 8.217 405 HD2 TYR 71 HD2 TYR 71 109.668 -15.584 6.829 406 HE1 TYR 71 HE1 TYR 71 112.193 -17.951 10.381 407 HE2 TYR 71 HE2 TYR 71 110.114 -14.458 8.993 408 HH TYR 71 HH TYR 71 112.379 -15.503 11.175 409 H ARG 72 H ARG 72 112.280 -20.341 4.417 410 HA ARG 72 HA ARG 72 111.430 -19.927 1.584 411 HB2 ARG 72 HB2 ARG 72 113.706 -20.804 2.196 412 HG2 ARG 72 HG2 ARG 72 111.912 -22.780 0.751 413 HD2 ARG 72 HD2 ARG 72 114.070 -23.272 -0.492 414 HE ARG 72 HE ARG 72 114.415 -24.019 2.346 415 HH11 ARG 72 HH11 ARG 72 114.764 -25.866 -0.027 416 HH12 ARG 72 HH12 ARG 72 113.339 -26.844 0.083 417 HH21 ARG 72 HH21 ARG 72 111.695 -24.677 2.234 418 HH22 ARG 72 HH22 ARG 72 111.602 -26.171 1.362 419 H ILE 73 H ILE 73 109.116 -20.083 2.006 420 HA ILE 73 HA ILE 73 107.892 -22.271 3.412 421 HB ILE 73 HB ILE 73 106.900 -20.035 2.885 422 HG12 ILE 73 HG12 ILE 73 105.213 -22.230 1.672 423 HG21 ILE 73 HG21 ILE 73 106.045 -19.575 0.664 424 HG22 ILE 73 HG22 ILE 73 106.551 -21.166 0.093 425 HG23 ILE 73 HG23 ILE 73 107.761 -19.957 0.526 426 HD11 ILE 73 HD11 ILE 73 104.613 -19.886 3.504 427 HD12 ILE 73 HD12 ILE 73 103.425 -21.045 2.907 428 HD13 ILE 73 HD13 ILE 73 104.248 -19.965 1.781 429 H ASN 74 H ASN 74 108.848 -21.834 0.030 430 HA ASN 74 HA ASN 74 108.562 -24.742 -0.422 431 HB2 ASN 74 HB2 ASN 74 106.335 -23.501 -0.807 432 HD21 ASN 74 HD21 ASN 74 104.999 -24.290 -2.902 433 HD22 ASN 74 HD22 ASN 74 105.472 -25.802 -3.511 434 H ASP 75 H ASP 75 109.279 -25.216 -2.787 435 HA ASP 75 HA ASP 75 111.867 -24.055 -3.255 436 HB2 ASP 75 HB2 ASP 75 109.991 -25.700 -4.988 437 H TRP 76 H TRP 76 112.516 -22.538 -4.837 438 HA TRP 76 HA TRP 76 112.299 -20.608 -6.180 439 HB2 TRP 76 HB2 TRP 76 109.950 -22.305 -7.085 440 HD1 TRP 76 HD1 TRP 76 113.283 -21.027 -8.584 441 HE1 TRP 76 HE1 TRP 76 114.584 -23.061 -9.486 442 HE3 TRP 76 HE3 TRP 76 110.112 -24.782 -7.204 443 HZ2 TRP 76 HZ2 TRP 76 114.314 -25.906 -9.608 444 HZ3 TRP 76 HZ3 TRP 76 110.656 -27.144 -7.726 445 HH2 TRP 76 HH2 TRP 76 112.751 -27.710 -8.925 446 H ALA 77 H ALA 77 110.735 -20.817 -3.521 447 HA ALA 77 HA ALA 77 109.040 -18.412 -4.008 448 HB1 ALA 77 HB1 ALA 77 108.128 -20.843 -2.443 449 HB2 ALA 77 HB2 ALA 77 107.720 -20.582 -4.139 450 HB3 ALA 77 HB3 ALA 77 107.155 -19.448 -2.910 451 H SER 78 H SER 78 109.462 -16.909 -2.425 452 HA SER 78 HA SER 78 110.377 -17.864 0.261 453 HB2 SER 78 HB2 SER 78 111.672 -15.733 -1.469 454 HG SER 78 HG SER 78 112.692 -18.223 -0.605 455 H ILE 79 H ILE 79 109.989 -16.291 1.973 456 HA ILE 79 HA ILE 79 108.083 -14.103 1.193 457 HB ILE 79 HB ILE 79 106.959 -14.578 3.340 458 HG12 ILE 79 HG12 ILE 79 108.931 -16.868 3.617 459 HG21 ILE 79 HG21 ILE 79 106.790 -16.064 1.074 460 HG22 ILE 79 HG22 ILE 79 105.775 -16.337 2.490 461 HG23 ILE 79 HG23 ILE 79 107.217 -17.319 2.237 462 HD11 ILE 79 HD11 ILE 79 107.402 -15.963 5.949 463 HD12 ILE 79 HD12 ILE 79 107.618 -17.595 5.317 464 HD13 ILE 79 HD13 ILE 79 106.370 -16.547 4.643 465 H TYR 80 H TYR 80 108.426 -12.081 2.200 466 HA TYR 80 HA TYR 80 110.784 -11.890 4.049 467 HB2 TYR 80 HB2 TYR 80 110.057 -10.122 1.691 468 HD1 TYR 80 HD2 TYR 80 113.256 -11.609 2.873 469 HD2 TYR 80 HD1 TYR 80 110.141 -11.715 -0.082 470 HE1 TYR 80 HE2 TYR 80 114.612 -13.164 1.500 471 HE2 TYR 80 HE1 TYR 80 111.499 -13.269 -1.458 472 HH TYR 80 HH TYR 80 113.899 -13.857 -1.735 473 H GLY 81 H GLY 81 110.718 -10.078 5.507 474 HA2 GLY 81 HA2 GLY 81 108.053 -8.721 5.717 475 H VAL 82 H VAL 82 108.266 -6.524 6.833 476 HA VAL 82 HA VAL 82 111.032 -5.407 6.650 477 HB VAL 82 HB VAL 82 110.114 -3.544 5.278 478 HG11 VAL 82 HG11 VAL 82 109.488 -6.252 4.070 479 HG12 VAL 82 HG12 VAL 82 111.124 -5.621 4.263 480 HG13 VAL 82 HG13 VAL 82 109.976 -4.790 3.212 481 HG21 VAL 82 HG21 VAL 82 107.879 -3.238 5.232 482 HG22 VAL 82 HG22 VAL 82 107.619 -4.766 6.072 483 HG23 VAL 82 HG23 VAL 82 107.721 -4.734 4.312 484 H VAL 83 H VAL 83 111.457 -4.021 8.297 485 HA VAL 83 HA VAL 83 109.231 -2.544 9.620 486 HB VAL 83 HB VAL 83 110.138 -3.288 11.831 487 HG11 VAL 83 HG11 VAL 83 109.592 -5.768 10.223 488 HG12 VAL 83 HG12 VAL 83 108.337 -4.539 10.391 489 HG13 VAL 83 HG13 VAL 83 108.998 -5.329 11.823 490 HG21 VAL 83 HG21 VAL 83 112.434 -3.855 10.646 491 HG22 VAL 83 HG22 VAL 83 111.683 -5.430 10.400 492 HG23 VAL 83 HG23 VAL 83 111.902 -4.804 12.033 493 H GLY 84 H GLY 84 110.012 -0.562 10.641 494 HA2 GLY 84 HA2 GLY 84 112.520 0.249 11.277 495 H VAL 85 H VAL 85 112.716 2.635 9.652 496 HA VAL 85 HA VAL 85 110.222 4.047 10.525 497 HB VAL 85 HB VAL 85 112.078 4.301 12.107 498 HG11 VAL 85 HG11 VAL 85 114.014 5.808 11.186 499 HG12 VAL 85 HG12 VAL 85 113.533 5.158 9.621 500 HG13 VAL 85 HG13 VAL 85 114.062 4.069 10.902 501 HG21 VAL 85 HG21 VAL 85 110.629 6.185 12.042 502 HG22 VAL 85 HG22 VAL 85 111.276 6.729 10.494 503 HG23 VAL 85 HG23 VAL 85 112.256 6.860 11.954 504 H GLY 86 H GLY 86 109.487 5.682 9.344 505 HA2 GLY 86 HA2 GLY 86 110.620 6.095 6.608 506 H TYR 87 H TYR 87 111.084 8.294 5.868 507 HA TYR 87 HA TYR 87 111.206 10.288 8.112 508 HB2 TYR 87 HB2 TYR 87 113.370 9.199 7.529 509 HD1 TYR 87 HD1 TYR 87 113.105 11.033 9.422 510 HD2 TYR 87 HD2 TYR 87 114.153 11.867 5.343 511 HE1 TYR 87 HE1 TYR 87 114.106 13.192 10.122 512 HE2 TYR 87 HE2 TYR 87 115.153 14.027 6.041 513 HH TYR 87 HH TYR 87 114.965 15.624 7.891 514 H GLY 88 H GLY 88 110.253 12.197 7.668 515 HA2 GLY 88 HA2 GLY 88 109.628 12.859 4.818 516 H LYS 89 H LYS 89 111.107 14.318 4.064 517 HA LYS 89 HA LYS 89 112.262 16.288 6.006 518 HB2 LYS 89 HB2 LYS 89 113.705 14.582 4.829 519 HG2 LYS 89 HG2 LYS 89 114.209 17.507 4.196 520 HD2 LYS 89 HD2 LYS 89 116.044 15.094 4.285 521 HE2 LYS 89 HE2 LYS 89 117.753 16.998 3.648 522 HZ1 LYS 89 HZ1 LYS 89 118.171 17.136 6.063 523 HZ2 LYS 89 HZ2 LYS 89 117.794 15.553 5.572 524 HZ3 LYS 89 HZ3 LYS 89 116.626 16.502 6.361 525 H PHE 90 H PHE 90 111.686 18.380 5.753 526 HA PHE 90 HA PHE 90 110.597 19.285 3.106 527 HB2 PHE 90 HB2 PHE 90 109.014 19.244 5.028 528 HD1 PHE 90 HD1 PHE 90 107.918 20.069 2.928 529 HD2 PHE 90 HD2 PHE 90 110.199 22.657 5.488 530 HE1 PHE 90 HE1 PHE 90 106.891 22.049 1.843 531 HE2 PHE 90 HE2 PHE 90 109.172 24.636 4.402 532 HZ PHE 90 HZ PHE 90 107.519 24.332 2.579 533 H GLN 91 H GLN 91 111.690 21.009 2.136 534 HA GLN 91 HA GLN 91 113.326 22.670 1.805 535 HB2 GLN 91 HB2 GLN 91 111.927 23.641 3.683 536 HG2 GLN 91 HG2 GLN 91 114.898 24.263 3.644 537 HE21 GLN 91 HE21 GLN 91 112.922 26.972 3.363 538 HE22 GLN 91 HE22 GLN 91 112.914 27.463 4.988 539 H THR 92 H THR 92 115.206 21.636 1.211 540 HA THR 92 HA THR 92 116.734 19.794 2.716 541 HB THR 92 HB THR 92 116.930 20.207 0.292 542 HG1 THR 92 HG1 THR 92 119.209 20.190 0.228 543 HG21 THR 92 HG21 THR 92 117.900 22.193 -0.605 544 HG22 THR 92 HG22 THR 92 118.417 22.745 0.989 545 HG23 THR 92 HG23 THR 92 116.705 22.740 0.570 546 H THR 93 H THR 93 116.998 23.351 2.572 547 HA THR 93 HA THR 93 119.378 23.497 4.224 548 HB THR 93 HB THR 93 117.215 25.554 3.664 549 HG1 THR 93 HG1 THR 93 118.429 26.047 1.869 550 HG21 THR 93 HG21 THR 93 118.786 27.189 4.277 551 HG22 THR 93 HG22 THR 93 120.145 26.076 4.115 552 HG23 THR 93 HG23 THR 93 119.040 25.925 5.481 553 H GLU 94 H GLU 94 119.502 23.402 6.427 554 HA GLU 94 HA GLU 94 116.967 23.680 8.013 555 HB2 GLU 94 HB2 GLU 94 119.326 21.801 8.385 556 HG2 GLU 94 HG2 GLU 94 116.447 21.317 7.551 557 H TYR 95 H TYR 95 117.278 24.577 10.169 558 HA TYR 95 HA TYR 95 119.457 26.546 10.307 559 HB2 TYR 95 HB2 TYR 95 117.096 25.815 12.066 560 HD1 TYR 95 HD1 TYR 95 115.671 25.847 10.037 561 HD2 TYR 95 HD2 TYR 95 118.147 29.189 11.108 562 HE1 TYR 95 HE1 TYR 95 114.405 27.287 8.466 563 HE2 TYR 95 HE2 TYR 95 116.880 30.630 9.537 564 HH TYR 95 HH TYR 95 114.732 30.710 8.443 565 HA PRO 96 HA PRO 96 122.085 23.998 12.791 566 HB2 PRO 96 HB2 PRO 96 123.542 25.934 14.067 567 HG2 PRO 96 HG2 PRO 96 122.292 27.794 13.535 568 HD2 PRO 96 HD2 PRO 96 120.634 27.736 11.949 569 H THR 97 H THR 97 121.597 22.995 14.689 570 HA THR 97 HA THR 97 120.538 22.579 16.761 571 HB THR 97 HB THR 97 121.460 24.089 18.496 572 HG1 THR 97 HG1 THR 97 121.248 26.045 17.429 573 HG21 THR 97 HG21 THR 97 123.586 23.724 16.397 574 HG22 THR 97 HG22 THR 97 122.832 22.329 17.167 575 HG23 THR 97 HG23 THR 97 123.708 23.507 18.143 576 H TYR 98 H TYR 98 118.924 24.329 14.806 577 HA TYR 98 HA TYR 98 117.053 25.411 16.875 578 HB2 TYR 98 HB2 TYR 98 118.096 26.733 14.357 579 HD1 TYR 98 HD2 TYR 98 117.344 26.994 18.027 580 HD2 TYR 98 HD1 TYR 98 119.831 28.252 14.757 581 HE1 TYR 98 HE2 TYR 98 118.796 28.232 19.608 582 HE2 TYR 98 HE1 TYR 98 121.282 29.493 16.341 583 HH TYR 98 HH TYR 98 120.376 30.171 19.517 584 H LYS 99 H LYS 99 114.860 25.126 16.365 585 HA LYS 99 HA LYS 99 112.992 24.129 15.331 586 HB2 LYS 99 HB2 LYS 99 114.681 24.837 12.907 587 HG2 LYS 99 HG2 LYS 99 112.503 26.321 14.412 588 HD2 LYS 99 HD2 LYS 99 113.977 26.998 11.847 589 HE2 LYS 99 HE2 LYS 99 111.812 28.766 12.831 590 HZ1 LYS 99 HZ1 LYS 99 114.542 28.989 11.666 591 HZ2 LYS 99 HZ2 LYS 99 113.544 30.329 11.974 592 HZ3 LYS 99 HZ3 LYS 99 113.066 29.150 10.847 593 H ASN 100 H ASN 100 114.819 22.277 16.322 594 HA ASN 100 HA ASN 100 115.828 20.319 14.536 595 HB2 ASN 100 HB2 ASN 100 116.110 20.625 17.068 596 HD21 ASN 100 HD21 ASN 100 116.057 18.137 18.398 597 HD22 ASN 100 HD22 ASN 100 116.820 16.965 17.436 598 H ASP 101 H ASP 101 112.536 21.031 15.440 599 HA ASP 101 HA ASP 101 111.462 18.409 14.682 600 HB2 ASP 101 HB2 ASP 101 110.235 21.098 15.357 601 H THR 102 H THR 102 112.872 20.391 12.633 602 HA THR 102 HA THR 102 110.909 21.245 10.737 603 HB THR 102 HB THR 102 113.763 20.291 10.320 604 HG1 THR 102 HG1 THR 102 114.201 21.977 11.463 605 HG21 THR 102 HG21 THR 102 113.041 20.578 8.157 606 HG22 THR 102 HG22 THR 102 113.425 22.259 8.531 607 HG23 THR 102 HG23 THR 102 111.757 21.694 8.623 608 H SER 103 H SER 103 112.502 18.142 11.281 609 HA SER 103 HA SER 103 110.859 16.934 9.078 610 HB2 SER 103 HB2 SER 103 112.678 15.296 8.923 611 HG SER 103 HG SER 103 113.427 15.055 10.923 612 H ASP 104 H ASP 104 110.045 14.714 9.576 613 HA ASP 104 HA ASP 104 109.861 14.146 12.516 614 HB2 ASP 104 HB2 ASP 104 107.886 15.404 11.525 615 H TYR 105 H TYR 105 109.491 11.878 13.007 616 HA TYR 105 HA TYR 105 110.232 10.042 10.758 617 HB2 TYR 105 HB2 TYR 105 110.563 9.832 13.770 618 HD1 TYR 105 HD2 TYR 105 111.622 12.033 13.967 619 HD2 TYR 105 HD1 TYR 105 113.050 9.115 11.156 620 HE1 TYR 105 HE2 TYR 105 113.710 13.338 13.672 621 HE2 TYR 105 HE1 TYR 105 115.138 10.421 10.862 622 HH TYR 105 HH TYR 105 116.215 12.647 12.907 623 H GLY 106 H GLY 106 109.190 7.940 10.736 624 HA2 GLY 106 HA2 GLY 106 106.779 7.589 12.431 625 H PHE 107 H PHE 107 106.005 5.254 12.280 626 HA PHE 107 HA PHE 107 108.353 3.484 11.840 627 HB2 PHE 107 HB2 PHE 107 105.659 3.147 13.196 628 HD1 PHE 107 HD1 PHE 107 109.079 2.294 14.328 629 HD2 PHE 107 HD2 PHE 107 105.853 5.119 14.578 630 HE1 PHE 107 HE1 PHE 107 110.180 3.380 16.267 631 HE2 PHE 107 HE2 PHE 107 106.954 6.205 16.517 632 HZ PHE 107 HZ PHE 107 109.118 5.335 17.362 633 H SER 108 H SER 108 108.276 1.689 10.442 634 HA SER 108 HA SER 108 105.891 1.532 8.622 635 HB2 SER 108 HB2 SER 108 107.966 2.536 7.653 636 HG SER 108 HG SER 108 107.662 -0.010 6.525 637 H TYR 109 H TYR 109 105.256 -0.589 7.991 638 HA TYR 109 HA TYR 109 106.771 -2.927 8.978 639 HB2 TYR 109 HB2 TYR 109 105.366 -2.085 10.879 640 HD1 TYR 109 HD2 TYR 109 106.759 -4.034 11.566 641 HD2 TYR 109 HD1 TYR 109 103.044 -4.524 9.464 642 HE1 TYR 109 HE2 TYR 109 106.707 -6.427 12.215 643 HE2 TYR 109 HE1 TYR 109 102.993 -6.917 10.114 644 HH TYR 109 HH TYR 109 105.711 -8.504 11.493 645 H GLY 110 H GLY 110 106.217 -4.819 7.761 646 HA2 GLY 110 HA2 GLY 110 103.828 -5.267 6.349 647 H ALA 111 H ALA 111 104.338 -6.646 4.225 648 HA ALA 111 HA ALA 111 106.831 -8.165 4.221 649 HB1 ALA 111 HB1 ALA 111 105.082 -8.814 6.217 650 HB2 ALA 111 HB2 ALA 111 106.179 -9.980 5.475 651 HB3 ALA 111 HB3 ALA 111 104.505 -9.874 4.929 652 H GLY 112 H GLY 112 106.663 -9.950 2.470 653 HA2 GLY 112 HA2 GLY 112 104.241 -9.880 0.816 654 H LEU 113 H LEU 113 105.076 -11.119 -1.430 655 HA LEU 113 HA LEU 113 106.654 -13.508 -0.513 656 HB2 LEU 113 HB2 LEU 113 104.169 -13.431 -2.266 657 HG LEU 113 HG LEU 113 103.685 -12.862 0.107 658 HD11 LEU 113 HD11 LEU 113 102.054 -14.166 -1.208 659 HD12 LEU 113 HD12 LEU 113 102.031 -14.660 0.485 660 HD13 LEU 113 HD13 LEU 113 102.848 -15.661 -0.715 661 HD21 LEU 113 HD21 LEU 113 105.640 -14.047 1.090 662 HD22 LEU 113 HD22 LEU 113 104.895 -15.589 0.668 663 HD23 LEU 113 HD23 LEU 113 104.126 -14.534 1.853 664 H GLN 114 H GLN 114 107.910 -14.538 -2.288 665 HA GLN 114 HA GLN 114 108.154 -12.785 -4.703 666 HB2 GLN 114 HB2 GLN 114 110.047 -12.747 -3.068 667 HG2 GLN 114 HG2 GLN 114 110.581 -14.081 -5.739 668 HE21 GLN 114 HE21 GLN 114 112.641 -11.535 -5.302 669 HE22 GLN 114 HE22 GLN 114 113.971 -12.345 -4.626 670 H PHE 115 H PHE 115 108.128 -13.855 -6.699 671 HA PHE 115 HA PHE 115 107.733 -16.832 -6.627 672 HB2 PHE 115 HB2 PHE 115 106.651 -14.685 -8.483 673 HD1 PHE 115 HD1 PHE 115 105.026 -17.618 -6.901 674 HD2 PHE 115 HD2 PHE 115 105.560 -13.358 -6.797 675 HE1 PHE 115 HE1 PHE 115 103.166 -17.423 -5.272 676 HE2 PHE 115 HE2 PHE 115 103.701 -13.164 -5.168 677 HZ PHE 115 HZ PHE 115 102.504 -15.196 -4.405 678 H ASN 116 H ASN 116 108.542 -17.968 -8.589 679 HA ASN 116 HA ASN 116 110.867 -16.543 -9.846 680 HB2 ASN 116 HB2 ASN 116 110.616 -18.966 -8.291 681 HD21 ASN 116 HD21 ASN 116 113.316 -18.459 -10.527 682 HD22 ASN 116 HD22 ASN 116 114.356 -17.749 -9.389 683 HA PRO 117 HA PRO 117 107.990 -17.778 -13.239 684 HB2 PRO 117 HB2 PRO 117 108.579 -15.632 -14.837 685 HG2 PRO 117 HG2 PRO 117 110.152 -14.585 -13.514 686 HD2 PRO 117 HD2 PRO 117 110.472 -15.152 -11.308 687 H MET 118 H MET 118 111.374 -17.443 -12.907 688 HA MET 118 HA MET 118 111.821 -19.070 -15.311 689 HB2 MET 118 HB2 MET 118 113.239 -16.440 -14.768 690 HG2 MET 118 HG2 MET 118 111.201 -17.245 -16.862 691 HE1 MET 118 HE1 MET 118 112.806 -16.380 -19.508 692 HE2 MET 118 HE2 MET 118 113.099 -17.473 -18.157 693 HE3 MET 118 HE3 MET 118 114.311 -16.267 -18.585 694 H GLU 119 H GLU 119 114.268 -19.606 -15.276 695 HA GLU 119 HA GLU 119 114.918 -20.927 -12.832 696 HB2 GLU 119 HB2 GLU 119 115.675 -21.525 -15.137 697 HG2 GLU 119 HG2 GLU 119 117.861 -21.004 -13.097 698 H ASN 120 H ASN 120 116.082 -17.822 -14.198 699 HA ASN 120 HA ASN 120 117.408 -17.301 -11.558 700 HB2 ASN 120 HB2 ASN 120 119.099 -16.093 -12.834 701 HD21 ASN 120 HD21 ASN 120 119.968 -15.633 -15.126 702 HD22 ASN 120 HD22 ASN 120 118.840 -15.226 -16.326 703 H VAL 121 H VAL 121 114.615 -16.473 -12.815 704 HA VAL 121 HA VAL 121 114.956 -13.533 -12.283 705 HB VAL 121 HB VAL 121 112.812 -14.907 -13.930 706 HG11 VAL 121 HG11 VAL 121 113.670 -12.020 -13.624 707 HG12 VAL 121 HG12 VAL 121 112.152 -12.730 -13.075 708 HG13 VAL 121 HG13 VAL 121 112.488 -12.591 -14.801 709 HG21 VAL 121 HG21 VAL 121 115.477 -13.707 -14.712 710 HG22 VAL 121 HG22 VAL 121 114.146 -13.833 -15.862 711 HG23 VAL 121 HG23 VAL 121 114.830 -15.290 -15.142 712 H ALA 122 H ALA 122 113.625 -12.650 -10.725 713 HA ALA 122 HA ALA 122 111.434 -14.356 -9.609 714 HB1 ALA 122 HB1 ALA 122 112.323 -14.008 -7.356 715 HB2 ALA 122 HB2 ALA 122 113.615 -12.996 -8.002 716 HB3 ALA 122 HB3 ALA 122 113.571 -14.718 -8.381 717 H LEU 123 H LEU 123 109.655 -13.207 -8.996 718 HA LEU 123 HA LEU 123 109.815 -10.206 -9.032 719 HB2 LEU 123 HB2 LEU 123 107.732 -12.253 -9.810 720 HG LEU 123 HG LEU 123 107.608 -10.875 -11.850 721 HD11 LEU 123 HD11 LEU 123 108.424 -8.806 -10.332 722 HD12 LEU 123 HD12 LEU 123 108.606 -8.827 -12.086 723 HD13 LEU 123 HD13 LEU 123 109.970 -9.254 -11.052 724 HD21 LEU 123 HD21 LEU 123 110.552 -11.205 -11.412 725 HD22 LEU 123 HD22 LEU 123 109.563 -11.690 -12.789 726 HD23 LEU 123 HD23 LEU 123 109.525 -12.635 -11.301 727 H ASP 124 H ASP 124 108.625 -9.099 -7.232 728 HA ASP 124 HA ASP 124 107.616 -10.917 -5.098 729 HB2 ASP 124 HB2 ASP 124 110.059 -10.517 -4.783 730 H PHE 125 H PHE 125 105.907 -9.981 -3.948 731 HA PHE 125 HA PHE 125 105.344 -7.076 -4.468 732 HB2 PHE 125 HB2 PHE 125 103.465 -9.457 -4.256 733 HD1 PHE 125 HD1 PHE 125 103.464 -6.513 -6.510 734 HD2 PHE 125 HD2 PHE 125 104.359 -10.696 -6.118 735 HE1 PHE 125 HE1 PHE 125 103.740 -6.685 -8.968 736 HE2 PHE 125 HE2 PHE 125 104.635 -10.868 -8.577 737 HZ PHE 125 HZ PHE 125 104.325 -8.862 -10.002 738 H SER 126 H SER 126 105.275 -5.929 -2.552 739 HA SER 126 HA SER 126 104.580 -7.429 -0.047 740 HB2 SER 126 HB2 SER 126 106.731 -5.338 -0.492 741 HG SER 126 HG SER 126 107.739 -7.053 -1.140 742 H TYR 127 H TYR 127 103.499 -6.187 1.562 743 HA TYR 127 HA TYR 127 102.346 -3.588 0.596 744 HB2 TYR 127 HB2 TYR 127 101.287 -5.691 2.521 745 HD1 TYR 127 HD2 TYR 127 101.599 -7.538 0.945 746 HD2 TYR 127 HD1 TYR 127 99.498 -3.972 -0.199 747 HE1 TYR 127 HE2 TYR 127 100.726 -8.697 -1.065 748 HE2 TYR 127 HE1 TYR 127 98.627 -5.130 -2.210 749 HH TYR 127 HH TYR 127 98.176 -7.579 -2.868 750 H GLU 128 H GLU 128 102.973 -1.817 1.803 751 HA GLU 128 HA GLU 128 103.775 -2.250 4.656 752 HB2 GLU 128 HB2 GLU 128 105.257 -0.690 2.516 753 HG2 GLU 128 HG2 GLU 128 105.926 -3.256 3.992 754 H GLN 129 H GLN 129 103.494 -0.398 5.998 755 HA GLN 129 HA GLN 129 102.166 1.985 4.781 756 HB2 GLN 129 HB2 GLN 129 100.437 1.843 6.540 757 HG2 GLN 129 HG2 GLN 129 101.992 -0.630 7.352 758 HE21 GLN 129 HE21 GLN 129 100.332 -0.110 9.963 759 HE22 GLN 129 HE22 GLN 129 98.861 -0.895 9.643 760 H SER 130 H SER 130 102.595 3.934 5.970 761 HA SER 130 HA SER 130 104.389 3.640 8.354 762 HB2 SER 130 HB2 SER 130 104.730 5.454 5.947 763 HG SER 130 HG SER 130 106.211 3.228 6.880 764 H ARG 131 H ARG 131 104.137 5.262 9.924 765 HA ARG 131 HA ARG 131 102.095 7.388 9.376 766 HB2 ARG 131 HB2 ARG 131 102.374 5.543 11.772 767 HG2 ARG 131 HG2 ARG 131 100.213 5.889 9.669 768 HD2 ARG 131 HD2 ARG 131 100.327 4.189 12.189 769 HE ARG 131 HE ARG 131 98.969 3.729 9.634 770 HH11 ARG 131 HH11 ARG 131 99.979 1.818 11.905 771 HH12 ARG 131 HH12 ARG 131 98.475 1.092 12.362 772 HH21 ARG 131 HH21 ARG 131 96.535 3.451 10.719 773 HH22 ARG 131 HH22 ARG 131 96.525 2.017 11.690 774 H ILE 132 H ILE 132 102.892 9.390 9.920 775 HA ILE 132 HA ILE 132 105.220 9.519 11.803 776 HB ILE 132 HB ILE 132 104.474 11.226 9.401 777 HG12 ILE 132 HG12 ILE 132 106.802 9.321 9.779 778 HG21 ILE 132 HG21 ILE 132 105.707 12.747 10.591 779 HG22 ILE 132 HG22 ILE 132 107.058 11.824 9.932 780 HG23 ILE 132 HG23 ILE 132 106.487 11.503 11.569 781 HD11 ILE 132 HD11 ILE 132 106.548 9.647 7.127 782 HD12 ILE 132 HD12 ILE 132 107.516 10.743 8.113 783 HD13 ILE 132 HD13 ILE 132 105.873 11.190 7.649 784 H ARG 133 H ARG 133 102.938 9.590 13.141 785 HA ARG 133 HA ARG 133 101.689 10.854 14.661 786 HB2 ARG 133 HB2 ARG 133 103.589 13.027 13.720 787 HG2 ARG 133 HG2 ARG 133 103.668 11.095 16.057 788 HD2 ARG 133 HD2 ARG 133 105.470 13.429 15.308 789 HE ARG 133 HE ARG 133 107.027 11.848 16.180 790 HH11 ARG 133 HH11 ARG 133 105.212 12.873 18.697 791 HH12 ARG 133 HH12 ARG 133 105.287 11.415 19.630 792 HH21 ARG 133 HH21 ARG 133 106.643 9.525 17.060 793 HH22 ARG 133 HH22 ARG 133 106.098 9.521 18.704 794 H SER 134 H SER 134 102.306 13.010 11.827 795 HA SER 134 HA SER 134 99.349 13.512 11.773 796 HB2 SER 134 HB2 SER 134 99.886 15.738 11.101 797 HG SER 134 HG SER 134 102.588 14.951 10.874 798 H VAL 135 H VAL 135 101.815 11.951 10.063 799 HA VAL 135 HA VAL 135 100.299 12.295 7.490 800 HB VAL 135 HB VAL 135 103.269 11.860 7.960 801 HG11 VAL 135 HG11 VAL 135 102.231 10.875 5.843 802 HG12 VAL 135 HG12 VAL 135 103.535 12.034 5.590 803 HG13 VAL 135 HG13 VAL 135 101.858 12.532 5.369 804 HG21 VAL 135 HG21 VAL 135 101.997 14.293 6.718 805 HG22 VAL 135 HG22 VAL 135 103.585 14.138 7.467 806 HG23 VAL 135 HG23 VAL 135 102.137 14.165 8.472 807 H ASP 136 H ASP 136 99.538 10.395 6.629 808 HA ASP 136 HA ASP 136 100.781 7.824 7.548 809 HB2 ASP 136 HB2 ASP 136 98.643 8.394 8.729 810 H VAL 137 H VAL 137 101.709 7.026 5.640 811 HA VAL 137 HA VAL 137 100.111 7.287 3.133 812 HB VAL 137 HB VAL 137 103.104 7.120 3.625 813 HG11 VAL 137 HG11 VAL 137 102.030 8.069 1.030 814 HG12 VAL 137 HG12 VAL 137 101.824 6.347 1.355 815 HG13 VAL 137 HG13 VAL 137 103.437 7.061 1.368 816 HG21 VAL 137 HG21 VAL 137 102.774 9.304 4.192 817 HG22 VAL 137 HG22 VAL 137 101.180 9.360 3.441 818 HG23 VAL 137 HG23 VAL 137 102.627 9.546 2.452 819 H GLY 138 H GLY 138 99.926 5.409 1.831 820 HA2 GLY 138 HA2 GLY 138 100.831 2.869 3.127 821 H THR 139 H THR 139 102.592 1.970 2.121 822 HA THR 139 HA THR 139 103.028 2.661 -0.764 823 HB THR 139 HB THR 139 105.012 1.994 1.429 824 HG1 THR 139 HG1 THR 139 105.151 4.084 1.749 825 HG21 THR 139 HG21 THR 139 106.434 3.286 -0.456 826 HG22 THR 139 HG22 THR 139 105.224 2.525 -1.488 827 HG23 THR 139 HG23 THR 139 106.245 1.532 -0.447 828 H TRP 140 H TRP 140 103.343 1.027 -2.193 829 HA TRP 140 HA TRP 140 103.452 -1.783 -1.144 830 HB2 TRP 140 HB2 TRP 140 102.353 -0.600 -3.722 831 HD1 TRP 140 HD1 TRP 140 101.076 -2.877 -0.861 832 HE1 TRP 140 HE1 TRP 140 98.842 -1.911 -0.009 833 HE3 TRP 140 HE3 TRP 140 100.744 1.294 -3.788 834 HZ2 TRP 140 HZ2 TRP 140 97.139 0.334 -0.504 835 HZ3 TRP 140 HZ3 TRP 140 98.807 2.826 -3.579 836 HH2 TRP 140 HH2 TRP 140 97.006 2.352 -1.941 837 H ILE 141 H ILE 141 105.165 -3.069 -1.941 838 HA ILE 141 HA ILE 141 107.091 -1.666 -3.764 839 HB ILE 141 HB ILE 141 107.524 -3.840 -1.687 840 HG12 ILE 141 HG12 ILE 141 108.234 -0.889 -1.604 841 HG21 ILE 141 HG21 ILE 141 109.298 -2.420 -3.642 842 HG22 ILE 141 HG22 ILE 141 109.325 -4.107 -3.128 843 HG23 ILE 141 HG23 ILE 141 109.959 -2.850 -2.065 844 HD11 ILE 141 HD11 ILE 141 108.388 -3.081 0.489 845 HD12 ILE 141 HD12 ILE 141 108.810 -1.387 0.743 846 HD13 ILE 141 HD13 ILE 141 109.766 -2.379 -0.358 847 H ALA 142 H ALA 142 107.571 -2.628 -5.688 848 HA ALA 142 HA ALA 142 107.075 -5.545 -6.047 849 HB1 ALA 142 HB1 ALA 142 105.342 -5.217 -7.495 850 HB2 ALA 142 HB2 ALA 142 106.154 -3.864 -8.282 851 HB3 ALA 142 HB3 ALA 142 105.243 -3.601 -6.795 852 H GLY 143 H GLY 143 108.739 -6.423 -7.290 853 HA2 GLY 143 HA2 GLY 143 110.068 -4.909 -9.370 854 H VAL 144 H VAL 144 112.650 -6.233 -8.774 855 HA VAL 144 HA VAL 144 111.904 -9.004 -9.649 856 HB VAL 144 HB VAL 144 114.025 -8.885 -10.948 857 HG11 VAL 144 HG11 VAL 144 112.319 -8.254 -12.355 858 HG12 VAL 144 HG12 VAL 144 113.197 -6.725 -12.311 859 HG13 VAL 144 HG13 VAL 144 111.778 -6.957 -11.289 860 HG21 VAL 144 HG21 VAL 144 115.079 -7.218 -9.322 861 HG22 VAL 144 HG22 VAL 144 114.112 -5.974 -10.114 862 HG23 VAL 144 HG23 VAL 144 115.321 -6.870 -11.035 863 H GLY 145 H GLY 145 113.919 -10.511 -9.333 864 HA2 GLY 145 HA2 GLY 145 115.474 -9.946 -6.896 865 H TYR 146 H TYR 146 117.400 -11.062 -6.907 866 HA TYR 146 HA TYR 146 117.734 -13.292 -8.881 867 HB2 TYR 146 HB2 TYR 146 118.502 -11.075 -9.759 868 HD1 TYR 146 HD2 TYR 146 118.777 -12.900 -11.444 869 HD2 TYR 146 HD1 TYR 146 121.662 -12.211 -8.338 870 HE1 TYR 146 HE2 TYR 146 120.438 -14.265 -12.684 871 HE2 TYR 146 HE1 TYR 146 123.321 -13.575 -9.576 872 HH TYR 146 HH TYR 146 123.212 -15.467 -11.316 873 H ARG 147 H ARG 147 119.429 -14.793 -8.276 874 HA ARG 147 HA ARG 147 120.511 -14.446 -5.501 875 HB2 ARG 147 HB2 ARG 147 119.892 -16.778 -5.043 876 HG2 ARG 147 HG2 ARG 147 118.904 -16.697 -7.905 877 HD2 ARG 147 HD2 ARG 147 118.265 -18.681 -5.688 878 HE ARG 147 HE ARG 147 117.382 -19.118 -8.467 879 HH11 ARG 147 HH21 ARG 147 117.779 -21.261 -6.367 880 HH12 ARG 147 HH22 ARG 147 119.232 -22.024 -6.920 881 HH21 ARG 147 HH11 ARG 147 120.108 -19.422 -9.037 882 HH22 ARG 147 HH12 ARG 147 120.550 -20.984 -8.431 883 H PHE 148 H PHE 148 122.705 -14.599 -5.570 884 HA PHE 148 HA PHE 148 123.964 -16.202 -7.768 885 HB2 PHE 148 HB2 PHE 148 124.349 -13.726 -7.631 886 HD1 PHE 148 HD2 PHE 148 125.406 -14.727 -9.663 887 HD2 PHE 148 HD1 PHE 148 127.301 -14.857 -5.810 888 HE1 PHE 148 HE2 PHE 148 127.567 -15.279 -10.745 889 HE2 PHE 148 HE1 PHE 148 129.463 -15.409 -6.893 890 HZ PHE 148 HZ PHE 148 129.596 -15.620 -9.360 Start of MODEL 4 1 H THR 2 H THR 2 123.404 -18.323 2.133 2 HA THR 2 HA THR 2 124.379 -18.834 -0.660 3 HB THR 2 HB THR 2 122.009 -18.923 -1.302 4 HG1 THR 2 HG1 THR 2 120.463 -18.866 0.433 5 HG21 THR 2 HG21 THR 2 121.791 -21.091 -0.674 6 HG22 THR 2 HG22 THR 2 121.857 -20.694 1.042 7 HG23 THR 2 HG23 THR 2 123.350 -20.860 0.117 8 H SER 3 H SER 3 123.730 -17.068 -2.192 9 HA SER 3 HA SER 3 123.431 -14.421 -0.801 10 HB2 SER 3 HB2 SER 3 125.715 -14.923 -1.681 11 HG SER 3 HG SER 3 125.894 -12.993 -2.791 12 H THR 4 H THR 4 121.845 -13.077 -1.676 13 HA THR 4 HA THR 4 120.666 -13.849 -4.313 14 HB THR 4 HB THR 4 119.178 -13.246 -1.747 15 HG1 THR 4 HG1 THR 4 119.937 -15.261 -1.540 16 HG21 THR 4 HG21 THR 4 117.242 -13.255 -2.937 17 HG22 THR 4 HG22 THR 4 117.808 -14.522 -4.025 18 HG23 THR 4 HG23 THR 4 118.290 -12.847 -4.297 19 H VAL 5 H VAL 5 119.884 -12.108 -5.500 20 HA VAL 5 HA VAL 5 120.183 -9.374 -4.287 21 HB VAL 5 HB VAL 5 122.043 -9.975 -5.804 22 HG11 VAL 5 HG11 VAL 5 119.825 -10.381 -7.833 23 HG12 VAL 5 HG12 VAL 5 120.888 -11.629 -7.185 24 HG13 VAL 5 HG13 VAL 5 121.547 -10.358 -8.214 25 HG21 VAL 5 HG21 VAL 5 121.492 -7.653 -5.822 26 HG22 VAL 5 HG22 VAL 5 120.047 -7.929 -6.795 27 HG23 VAL 5 HG23 VAL 5 121.646 -8.111 -7.518 28 H THR 6 H THR 6 118.479 -7.939 -4.748 29 HA THR 6 HA THR 6 116.534 -8.584 -6.872 30 HB THR 6 HB THR 6 115.810 -8.556 -3.923 31 HG1 THR 6 HG1 THR 6 115.994 -10.637 -4.020 32 HG21 THR 6 HG21 THR 6 113.933 -9.547 -5.996 33 HG22 THR 6 HG22 THR 6 114.194 -7.803 -5.959 34 HG23 THR 6 HG23 THR 6 113.605 -8.638 -4.521 35 H GLY 7 H GLY 7 115.785 -6.632 -7.705 36 HA2 GLY 7 HA2 GLY 7 115.446 -4.328 -5.888 37 H GLY 8 H GLY 8 114.144 -2.593 -6.974 38 HA2 GLY 8 HA2 GLY 8 113.081 -3.092 -9.636 39 H TYR 9 H TYR 9 110.711 -1.731 -9.539 40 HA TYR 9 HA TYR 9 111.455 0.953 -8.406 41 HB2 TYR 9 HB2 TYR 9 110.020 0.265 -10.997 42 HD1 TYR 9 HD1 TYR 9 112.924 2.439 -10.116 43 HD2 TYR 9 HD2 TYR 9 111.579 -1.101 -12.144 44 HE1 TYR 9 HE1 TYR 9 115.165 2.175 -11.146 45 HE2 TYR 9 HE2 TYR 9 113.820 -1.365 -13.172 46 HH TYR 9 HH TYR 9 115.998 0.939 -13.446 47 H ALA 10 H ALA 10 109.598 2.256 -7.688 48 HA ALA 10 HA ALA 10 106.970 0.842 -7.625 49 HB1 ALA 10 HB1 ALA 10 106.881 0.997 -5.209 50 HB2 ALA 10 HB2 ALA 10 108.385 1.916 -5.171 51 HB3 ALA 10 HB3 ALA 10 108.401 0.218 -5.648 52 H GLN 11 H GLN 11 105.186 2.252 -7.167 53 HA GLN 11 HA GLN 11 105.739 5.139 -7.685 54 HB2 GLN 11 HB2 GLN 11 103.221 3.433 -7.726 55 HG2 GLN 11 HG2 GLN 11 104.873 4.627 -9.975 56 HE21 GLN 11 HE21 GLN 11 104.041 3.777 -12.134 57 HE22 GLN 11 HE22 GLN 11 102.379 3.472 -12.296 58 H SER 12 H SER 12 105.067 6.718 -6.129 59 HA SER 12 HA SER 12 104.301 5.564 -3.472 60 HB2 SER 12 HB2 SER 12 106.512 6.684 -3.743 61 HG SER 12 HG SER 12 106.313 7.523 -1.814 62 H ASP 13 H ASP 13 102.473 6.211 -2.498 63 HA ASP 13 HA ASP 13 101.068 8.697 -3.387 64 HB2 ASP 13 HB2 ASP 13 100.166 6.634 -4.538 65 H ALA 14 H ALA 14 100.713 9.869 -1.462 66 HA ALA 14 HA ALA 14 100.324 8.299 1.027 67 HB1 ALA 14 HB1 ALA 14 102.020 9.616 2.089 68 HB2 ALA 14 HB2 ALA 14 102.088 10.737 0.731 69 HB3 ALA 14 HB3 ALA 14 102.694 9.092 0.547 70 H GLN 15 H GLN 15 99.287 9.409 2.662 71 HA GLN 15 HA GLN 15 97.285 11.375 1.848 72 HB2 GLN 15 HB2 GLN 15 96.915 9.475 3.455 73 HG2 GLN 15 HG2 GLN 15 96.547 12.282 4.550 74 HE21 GLN 15 HE21 GLN 15 93.799 10.319 4.684 75 HE22 GLN 15 HE22 GLN 15 93.921 9.819 6.302 76 H GLY 16 H GLY 16 97.769 13.496 1.785 77 HA2 GLY 16 HA2 GLY 16 98.411 15.547 3.006 78 H GLN 17 H GLN 17 100.317 13.230 1.196 79 HA GLN 17 HA GLN 17 101.712 15.483 -0.219 80 HB2 GLN 17 HB2 GLN 17 103.082 13.776 1.038 81 HG2 GLN 17 HG2 GLN 17 104.556 13.212 -0.960 82 HE21 GLN 17 HE21 GLN 17 103.695 16.126 -2.387 83 HE22 GLN 17 HE22 GLN 17 104.532 17.186 -1.359 84 H MET 18 H MET 18 100.137 15.875 -1.853 85 HA MET 18 HA MET 18 98.678 13.818 -3.235 86 HB2 MET 18 HB2 MET 18 99.408 16.680 -3.919 87 HG2 MET 18 HG2 MET 18 96.963 15.389 -2.672 88 HE1 MET 18 HE1 MET 18 98.820 18.533 -2.835 89 HE2 MET 18 HE2 MET 18 97.699 19.812 -3.293 90 HE3 MET 18 HE3 MET 18 98.431 18.805 -4.539 91 H ASN 19 H ASN 19 101.558 15.710 -4.223 92 HA ASN 19 HA ASN 19 101.932 14.638 -6.791 93 HB2 ASN 19 HB2 ASN 19 103.939 15.500 -4.688 94 HD21 ASN 19 HD21 ASN 19 104.550 17.855 -5.105 95 HD22 ASN 19 HD22 ASN 19 103.368 18.892 -5.746 96 H LYS 20 H LYS 20 102.552 12.697 -7.557 97 HA LYS 20 HA LYS 20 103.137 10.466 -5.734 98 HB2 LYS 20 HB2 LYS 20 102.992 10.755 -8.755 99 HG2 LYS 20 HG2 LYS 20 101.019 9.738 -6.685 100 HD2 LYS 20 HD2 LYS 20 100.897 9.799 -9.717 101 HE2 LYS 20 HE2 LYS 20 98.764 9.209 -7.631 102 HZ1 LYS 20 HZ1 LYS 20 97.510 8.477 -9.583 103 HZ2 LYS 20 HZ2 LYS 20 98.916 7.542 -9.390 104 HZ3 LYS 20 HZ3 LYS 20 98.856 8.758 -10.576 105 H MET 21 H MET 21 105.138 9.205 -5.861 106 HA MET 21 HA MET 21 107.443 10.690 -7.085 107 HB2 MET 21 HB2 MET 21 107.241 9.364 -4.362 108 HG2 MET 21 HG2 MET 21 107.394 12.264 -5.237 109 HE1 MET 21 HE1 MET 21 107.897 9.886 -1.596 110 HE2 MET 21 HE2 MET 21 106.465 9.979 -2.617 111 HE3 MET 21 HE3 MET 21 106.561 10.958 -1.156 112 H GLY 22 H GLY 22 109.395 9.271 -7.321 113 HA2 GLY 22 HA2 GLY 22 108.594 6.565 -8.270 114 H GLY 23 H GLY 23 109.794 4.646 -7.487 115 HA2 GLY 23 HA2 GLY 23 111.306 5.167 -4.961 116 H PHE 24 H PHE 24 113.268 4.255 -5.059 117 HA PHE 24 HA PHE 24 113.675 1.860 -6.825 118 HB2 PHE 24 HB2 PHE 24 115.595 3.983 -5.791 119 HD1 PHE 24 HD2 PHE 24 115.183 2.642 -9.210 120 HD2 PHE 24 HD1 PHE 24 114.302 5.893 -6.544 121 HE1 PHE 24 HE2 PHE 24 114.456 4.027 -11.137 122 HE2 PHE 24 HE1 PHE 24 113.576 7.277 -8.470 123 HZ PHE 24 HZ PHE 24 113.653 6.343 -10.766 124 H ASN 25 H ASN 25 114.198 -0.047 -5.711 125 HA ASN 25 HA ASN 25 115.326 0.242 -2.951 126 HB2 ASN 25 HB2 ASN 25 112.795 -0.082 -3.098 127 HD21 ASN 25 HD21 ASN 25 112.123 -2.585 -1.725 128 HD22 ASN 25 HD22 ASN 25 113.008 -2.611 -0.276 129 H LEU 26 H LEU 26 117.113 -1.022 -2.712 130 HA LEU 26 HA LEU 26 117.361 -3.496 -4.406 131 HB2 LEU 26 HB2 LEU 26 119.519 -1.571 -3.451 132 HG LEU 26 HG LEU 26 118.078 -0.576 -5.200 133 HD11 LEU 26 HD11 LEU 26 120.228 0.226 -5.493 134 HD12 LEU 26 HD12 LEU 26 120.005 -0.587 -7.042 135 HD13 LEU 26 HD13 LEU 26 120.905 -1.383 -5.751 136 HD21 LEU 26 HD21 LEU 26 117.104 -2.238 -6.474 137 HD22 LEU 26 HD22 LEU 26 118.541 -3.259 -6.430 138 HD23 LEU 26 HD23 LEU 26 118.476 -1.874 -7.520 139 H LYS 27 H LYS 27 117.611 -5.363 -3.093 140 HA LYS 27 HA LYS 27 118.598 -4.894 -0.314 141 HB2 LYS 27 HB2 LYS 27 116.753 -6.292 0.484 142 HG2 LYS 27 HG2 LYS 27 116.031 -6.467 -2.460 143 HD2 LYS 27 HD2 LYS 27 114.532 -7.252 0.051 144 HE2 LYS 27 HE2 LYS 27 113.437 -7.942 -2.634 145 HZ1 LYS 27 HZ1 LYS 27 113.581 -9.258 0.035 146 HZ2 LYS 27 HZ2 LYS 27 112.546 -9.695 -1.239 147 HZ3 LYS 27 HZ3 LYS 27 112.351 -8.199 -0.457 148 H TYR 28 H TYR 28 119.721 -6.596 0.616 149 HA TYR 28 HA TYR 28 120.485 -8.851 -1.213 150 HB2 TYR 28 HB2 TYR 28 121.910 -7.552 1.140 151 HD1 TYR 28 HD1 TYR 28 122.971 -8.502 -2.301 152 HD2 TYR 28 HD2 TYR 28 122.012 -5.292 0.389 153 HE1 TYR 28 HE1 TYR 28 123.822 -6.861 -3.954 154 HE2 TYR 28 HE2 TYR 28 122.864 -3.652 -1.264 155 HH TYR 28 HH TYR 28 123.212 -3.547 -3.736 156 H ARG 29 H ARG 29 120.106 -10.945 -0.458 157 HA ARG 29 HA ARG 29 118.983 -11.186 2.312 158 HB2 ARG 29 HB2 ARG 29 117.291 -11.455 0.604 159 HG2 ARG 29 HG2 ARG 29 118.213 -14.164 1.617 160 HD2 ARG 29 HD2 ARG 29 115.485 -13.259 0.616 161 HE ARG 29 HE ARG 29 115.868 -15.075 2.550 162 HH11 ARG 29 HH11 ARG 29 116.733 -16.352 -0.358 163 HH12 ARG 29 HH12 ARG 29 115.495 -17.561 -0.431 164 HH21 ARG 29 HH21 ARG 29 113.719 -16.285 2.261 165 HH22 ARG 29 HH22 ARG 29 113.789 -17.524 1.052 166 H TYR 30 H TYR 30 119.888 -12.683 3.625 167 HA TYR 30 HA TYR 30 121.875 -14.611 2.462 168 HB2 TYR 30 HB2 TYR 30 121.846 -13.152 5.130 169 HD1 TYR 30 HD2 TYR 30 124.578 -13.738 2.693 170 HD2 TYR 30 HD1 TYR 30 121.761 -10.905 4.270 171 HE1 TYR 30 HE2 TYR 30 125.761 -11.905 1.515 172 HE2 TYR 30 HE1 TYR 30 122.945 -9.071 3.094 173 HH TYR 30 HH TYR 30 125.127 -8.593 2.165 174 H GLU 31 H GLU 31 121.576 -16.769 3.120 175 HA GLU 31 HA GLU 31 119.612 -17.297 5.314 176 HB2 GLU 31 HB2 GLU 31 118.540 -17.342 3.049 177 HG2 GLU 31 HG2 GLU 31 118.828 -20.018 4.452 178 H GLU 32 H GLU 32 120.078 -19.249 6.479 179 HA GLU 32 HA GLU 32 122.735 -20.448 5.854 180 HB2 GLU 32 HB2 GLU 32 120.998 -20.343 8.339 181 HG2 GLU 32 HG2 GLU 32 123.597 -18.971 7.587 182 H ASP 33 H ASP 33 122.890 -22.615 5.419 183 HA ASP 33 HA ASP 33 120.766 -24.123 4.374 184 HB2 ASP 33 HB2 ASP 33 123.387 -24.935 5.661 185 H ASN 34 H ASN 34 121.749 -23.821 7.757 186 HA ASN 34 HA ASN 34 120.532 -26.178 8.789 187 HB2 ASN 34 HB2 ASN 34 120.633 -24.958 10.926 188 HD21 ASN 34 HD21 ASN 34 120.965 -22.878 12.054 189 HD22 ASN 34 HD22 ASN 34 120.643 -21.408 11.268 190 H SER 35 H SER 35 119.088 -22.923 8.278 191 HA SER 35 HA SER 35 116.409 -24.184 8.191 192 HB2 SER 35 HB2 SER 35 117.551 -22.683 10.456 193 HG SER 35 HG SER 35 115.121 -23.882 10.708 194 HA PRO 36 HA PRO 36 115.661 -20.682 5.595 195 HB2 PRO 36 HB2 PRO 36 112.948 -20.449 5.771 196 HG2 PRO 36 HG2 PRO 36 112.351 -21.756 7.520 197 HD2 PRO 36 HD2 PRO 36 114.049 -22.475 8.815 198 H LEU 37 H LEU 37 116.420 -19.865 8.284 199 HA LEU 37 HA LEU 37 114.617 -17.515 8.768 200 HB2 LEU 37 HB2 LEU 37 114.984 -19.230 10.578 201 HG LEU 37 HG LEU 37 115.930 -16.383 10.968 202 HD11 LEU 37 HD11 LEU 37 113.732 -15.912 11.453 203 HD12 LEU 37 HD12 LEU 37 113.430 -17.512 12.131 204 HD13 LEU 37 HD13 LEU 37 113.467 -17.288 10.382 205 HD21 LEU 37 HD21 LEU 37 115.201 -17.122 13.450 206 HD22 LEU 37 HD22 LEU 37 116.866 -17.255 12.884 207 HD23 LEU 37 HD23 LEU 37 115.816 -18.671 12.876 208 H GLY 38 H GLY 38 115.833 -16.498 6.864 209 HA2 GLY 38 HA2 GLY 38 118.595 -15.653 7.582 210 H VAL 39 H VAL 39 119.040 -13.300 6.680 211 HA VAL 39 HA VAL 39 116.802 -11.472 7.487 212 HB VAL 39 HB VAL 39 119.749 -11.298 8.218 213 HG11 VAL 39 HG11 VAL 39 117.965 -9.226 7.949 214 HG12 VAL 39 HG12 VAL 39 119.354 -9.212 9.033 215 HG13 VAL 39 HG13 VAL 39 117.761 -9.651 9.647 216 HG21 VAL 39 HG21 VAL 39 117.287 -12.173 9.736 217 HG22 VAL 39 HG22 VAL 39 118.718 -11.574 10.575 218 HG23 VAL 39 HG23 VAL 39 118.827 -13.017 9.567 219 H ILE 40 H ILE 40 116.629 -9.637 6.102 220 HA ILE 40 HA ILE 40 118.723 -9.449 3.959 221 HB ILE 40 HB ILE 40 116.875 -8.859 2.458 222 HG12 ILE 40 HG12 ILE 40 115.061 -9.251 4.860 223 HG21 ILE 40 HG21 ILE 40 116.177 -11.016 2.179 224 HG22 ILE 40 HG22 ILE 40 115.667 -11.179 3.859 225 HG23 ILE 40 HG23 ILE 40 117.370 -11.341 3.434 226 HD11 ILE 40 HD11 ILE 40 114.509 -9.566 2.182 227 HD12 ILE 40 HD12 ILE 40 114.093 -7.873 2.445 228 HD13 ILE 40 HD13 ILE 40 113.318 -9.130 3.407 229 H GLY 41 H GLY 41 119.350 -7.370 3.308 230 HA2 GLY 41 HA2 GLY 41 118.383 -5.109 5.022 231 H SER 42 H SER 42 117.384 -3.446 3.892 232 HA SER 42 HA SER 42 117.896 -3.290 0.943 233 HB2 SER 42 HB2 SER 42 115.868 -4.618 1.475 234 HG SER 42 HG SER 42 115.249 -2.065 0.423 235 H PHE 43 H PHE 43 117.867 -1.230 0.088 236 HA PHE 43 HA PHE 43 117.383 1.035 2.005 237 HB2 PHE 43 HB2 PHE 43 119.232 0.737 -0.390 238 HD1 PHE 43 HD1 PHE 43 119.773 2.282 2.934 239 HD2 PHE 43 HD2 PHE 43 120.458 -1.163 0.459 240 HE1 PHE 43 HE1 PHE 43 121.420 1.427 4.579 241 HE2 PHE 43 HE2 PHE 43 122.104 -2.017 2.104 242 HZ PHE 43 HZ PHE 43 122.586 -0.722 4.164 243 H THR 44 H THR 44 115.938 2.655 1.283 244 HA THR 44 HA THR 44 114.885 2.347 -1.512 245 HB THR 44 HB THR 44 113.329 2.931 1.030 246 HG1 THR 44 HG1 THR 44 112.735 0.835 0.961 247 HG21 THR 44 HG21 THR 44 112.532 2.493 -1.854 248 HG22 THR 44 HG22 THR 44 112.210 3.906 -0.849 249 HG23 THR 44 HG23 THR 44 111.386 2.381 -0.518 250 H TYR 45 H TYR 45 114.705 4.305 -2.624 251 HA TYR 45 HA TYR 45 114.872 6.821 -1.031 252 HB2 TYR 45 HB2 TYR 45 117.092 6.140 -1.937 253 HD1 TYR 45 HD2 TYR 45 117.280 8.290 -0.698 254 HD2 TYR 45 HD1 TYR 45 115.938 8.131 -4.775 255 HE1 TYR 45 HE2 TYR 45 117.678 10.728 -0.924 256 HE2 TYR 45 HE1 TYR 45 116.335 10.568 -5.001 257 HH TYR 45 HH TYR 45 117.759 12.307 -3.907 258 H THR 46 H THR 46 112.894 7.738 -1.480 259 HA THR 46 HA THR 46 111.876 7.585 -4.289 260 HB THR 46 HB THR 46 110.427 8.086 -1.668 261 HG1 THR 46 HG1 THR 46 110.431 5.769 -3.288 262 HG21 THR 46 HG21 THR 46 108.611 8.564 -2.896 263 HG22 THR 46 HG22 THR 46 108.807 7.082 -3.830 264 HG23 THR 46 HG23 THR 46 109.631 8.557 -4.333 265 H GLU 47 H GLU 47 111.495 9.570 -5.385 266 HA GLU 47 HA GLU 47 111.747 12.064 -3.751 267 HB2 GLU 47 HB2 GLU 47 113.921 11.360 -4.775 268 HG2 GLU 47 HG2 GLU 47 112.623 13.835 -5.958 269 H LYS 48 H LYS 48 110.867 13.960 -4.898 270 HA LYS 48 HA LYS 48 108.478 13.289 -6.484 271 HB2 LYS 48 HB2 LYS 48 109.673 15.886 -5.459 272 HG2 LYS 48 HG2 LYS 48 107.467 14.095 -4.395 273 HD2 LYS 48 HD2 LYS 48 108.509 16.789 -3.470 274 HE2 LYS 48 HE2 LYS 48 106.358 15.152 -2.111 275 HZ1 LYS 48 HZ1 LYS 48 106.559 17.563 -1.824 276 HZ2 LYS 48 HZ2 LYS 48 108.176 17.381 -1.330 277 HZ3 LYS 48 HZ3 LYS 48 106.918 16.750 -0.379 278 H SER 49 H SER 49 108.172 13.861 -8.662 279 HA SER 49 HA SER 49 110.511 14.133 -10.348 280 HB2 SER 49 HB2 SER 49 108.352 13.018 -10.947 281 HG SER 49 HG SER 49 109.082 13.434 -12.848 282 H ARG 50 H ARG 50 111.132 16.012 -11.588 283 HA ARG 50 HA ARG 50 111.000 18.524 -10.242 284 HB2 ARG 50 HB2 ARG 50 111.594 17.772 -13.121 285 HG2 ARG 50 HG2 ARG 50 113.342 18.198 -10.677 286 HD2 ARG 50 HD2 ARG 50 114.396 19.147 -12.716 287 HE ARG 50 HE ARG 50 113.134 17.717 -14.366 288 HH11 ARG 50 HH11 ARG 50 113.880 15.037 -13.288 289 HH12 ARG 50 HH12 ARG 50 115.143 14.544 -14.365 290 HH21 ARG 50 HH21 ARG 50 115.692 17.735 -15.605 291 HH22 ARG 50 HH22 ARG 50 116.170 16.072 -15.676 292 H THR 51 H THR 51 109.486 20.138 -10.308 293 HA THR 51 HA THR 51 107.383 20.048 -12.443 294 HB THR 51 HB THR 51 107.002 20.615 -9.485 295 HG1 THR 51 HG1 THR 51 106.839 18.550 -9.286 296 HG21 THR 51 HG21 THR 51 105.352 21.006 -11.836 297 HG22 THR 51 HG22 THR 51 105.035 21.471 -10.165 298 HG23 THR 51 HG23 THR 51 104.596 19.859 -10.730 299 H ALA 52 H ALA 52 106.618 22.127 -13.083 300 HA ALA 52 HA ALA 52 108.440 24.312 -12.976 301 HB1 ALA 52 HB1 ALA 52 105.440 24.280 -13.449 302 HB2 ALA 52 HB2 ALA 52 106.664 23.932 -14.670 303 HB3 ALA 52 HB3 ALA 52 106.550 25.547 -13.971 304 H SER 53 H SER 53 105.793 23.390 -10.840 305 HA SER 53 HA SER 53 106.420 25.770 -9.121 306 HB2 SER 53 HB2 SER 53 104.232 25.864 -10.319 307 HG SER 53 HG SER 53 102.999 25.801 -8.165 308 H SER 54 H SER 54 106.666 25.340 -6.920 309 HA SER 54 HA SER 54 107.161 24.037 -5.010 310 HB2 SER 54 HB2 SER 54 104.757 22.567 -6.134 311 HG SER 54 HG SER 54 104.214 24.666 -5.909 312 H GLY 55 H GLY 55 108.352 23.141 -7.697 313 HA2 GLY 55 HA2 GLY 55 108.925 20.323 -6.866 314 H ASP 56 H ASP 56 110.268 22.682 -9.202 315 HA ASP 56 HA ASP 56 112.947 21.895 -9.099 316 HB2 ASP 56 HB2 ASP 56 111.661 24.622 -9.409 317 H TYR 57 H TYR 57 111.202 23.949 -6.785 318 HA TYR 57 HA TYR 57 113.715 24.089 -5.153 319 HB2 TYR 57 HB2 TYR 57 112.907 26.248 -4.385 320 HD1 TYR 57 HD1 TYR 57 110.672 26.016 -7.317 321 HD2 TYR 57 HD2 TYR 57 110.889 26.264 -3.035 322 HE1 TYR 57 HE1 TYR 57 108.244 26.517 -7.222 323 HE2 TYR 57 HE2 TYR 57 108.462 26.763 -2.939 324 HH TYR 57 HH TYR 57 106.739 27.904 -5.026 325 H ASN 58 H ASN 58 113.370 24.090 -2.800 326 HA ASN 58 HA ASN 58 112.493 23.145 -0.827 327 HB2 ASN 58 HB2 ASN 58 110.713 24.836 -1.646 328 HD21 ASN 58 HD21 ASN 58 108.159 23.997 -0.504 329 HD22 ASN 58 HD22 ASN 58 108.442 23.583 1.117 330 H LYS 59 H LYS 59 113.230 21.330 -3.043 331 HA LYS 59 HA LYS 59 111.206 19.232 -3.195 332 HB2 LYS 59 HB2 LYS 59 112.934 18.095 -4.488 333 HG2 LYS 59 HG2 LYS 59 114.800 20.197 -3.341 334 HD2 LYS 59 HD2 LYS 59 115.148 18.148 -5.542 335 HE2 LYS 59 HE2 LYS 59 117.021 17.972 -3.895 336 HZ1 LYS 59 HZ1 LYS 59 117.067 20.891 -4.465 337 HZ2 LYS 59 HZ2 LYS 59 118.343 20.081 -3.691 338 HZ3 LYS 59 HZ3 LYS 59 116.807 20.139 -2.968 339 H ASN 60 H ASN 60 111.138 17.310 -2.001 340 HA ASN 60 HA ASN 60 112.988 17.153 0.350 341 HB2 ASN 60 HB2 ASN 60 110.169 16.140 -0.141 342 HD21 ASN 60 HD21 ASN 60 108.622 17.348 1.356 343 HD22 ASN 60 HD22 ASN 60 108.973 18.961 1.746 344 H GLN 61 H GLN 61 113.582 14.919 1.035 345 HA GLN 61 HA GLN 61 113.642 12.990 -1.267 346 HB2 GLN 61 HB2 GLN 61 115.713 13.628 0.862 347 HG2 GLN 61 HG2 GLN 61 115.719 14.037 -2.145 348 HE21 GLN 61 HE21 GLN 61 117.716 15.279 -2.813 349 HE22 GLN 61 HE22 GLN 61 119.143 15.083 -1.916 350 H TYR 62 H TYR 62 113.455 10.736 -0.661 351 HA TYR 62 HA TYR 62 112.460 10.296 2.138 352 HB2 TYR 62 HB2 TYR 62 110.746 10.271 0.332 353 HD1 TYR 62 HD2 TYR 62 109.703 9.912 2.568 354 HD2 TYR 62 HD1 TYR 62 111.540 6.706 0.378 355 HE1 TYR 62 HE2 TYR 62 108.557 8.262 4.022 356 HE2 TYR 62 HE1 TYR 62 110.394 5.056 1.833 357 HH TYR 62 HH TYR 62 109.232 5.603 4.669 358 H TYR 63 H TYR 63 114.467 9.533 2.901 359 HA TYR 63 HA TYR 63 115.685 7.134 1.584 360 HB2 TYR 63 HB2 TYR 63 117.039 9.137 2.324 361 HD1 TYR 63 HD2 TYR 63 118.435 7.558 1.007 362 HD2 TYR 63 HD1 TYR 63 117.576 6.898 5.164 363 HE1 TYR 63 HE2 TYR 63 120.275 5.900 1.124 364 HE2 TYR 63 HE1 TYR 63 119.417 5.239 5.280 365 HH TYR 63 HH TYR 63 121.719 4.870 2.744 366 H GLY 64 H GLY 64 115.876 5.077 2.850 367 HA2 GLY 64 HA2 GLY 64 114.666 5.076 5.505 368 H ILE 65 H ILE 65 115.483 3.519 6.693 369 HA ILE 65 HA ILE 65 117.175 1.414 5.395 370 HB ILE 65 HB ILE 65 118.162 1.209 7.650 371 HG12 ILE 65 HG12 ILE 65 116.161 3.330 8.502 372 HG21 ILE 65 HG21 ILE 65 117.782 4.096 6.799 373 HG22 ILE 65 HG22 ILE 65 119.016 2.990 6.194 374 HG23 ILE 65 HG23 ILE 65 119.048 3.511 7.879 375 HD11 ILE 65 HD11 ILE 65 117.123 3.123 10.664 376 HD12 ILE 65 HD12 ILE 65 118.501 3.200 9.565 377 HD13 ILE 65 HD13 ILE 65 117.985 1.649 10.225 378 H THR 66 H THR 66 116.552 -0.819 5.610 379 HA THR 66 HA THR 66 114.386 -1.447 7.506 380 HB THR 66 HB THR 66 113.281 -0.525 5.504 381 HG1 THR 66 HG1 THR 66 111.895 -2.223 5.210 382 HG21 THR 66 HG21 THR 66 115.306 -2.067 4.162 383 HG22 THR 66 HG22 THR 66 114.188 -0.884 3.485 384 HG23 THR 66 HG23 THR 66 113.713 -2.577 3.603 385 H ALA 67 H ALA 67 114.256 -3.677 7.987 386 HA ALA 67 HA ALA 67 115.890 -5.586 6.420 387 HB1 ALA 67 HB1 ALA 67 117.263 -6.155 8.296 388 HB2 ALA 67 HB2 ALA 67 116.226 -5.266 9.412 389 HB3 ALA 67 HB3 ALA 67 117.243 -4.391 8.266 390 H GLY 68 H GLY 68 115.156 -7.801 6.818 391 HA2 GLY 68 HA2 GLY 68 113.145 -8.311 8.869 392 HA PRO 69 HA PRO 69 114.415 -12.436 8.142 393 HB2 PRO 69 HB2 PRO 69 112.174 -13.883 8.733 394 HG2 PRO 69 HG2 PRO 69 110.561 -12.259 8.741 395 HD2 PRO 69 HD2 PRO 69 111.107 -10.065 8.480 396 H ALA 70 H ALA 70 113.849 -14.478 6.867 397 HA ALA 70 HA ALA 70 111.986 -14.060 4.584 398 HB1 ALA 70 HB1 ALA 70 114.229 -13.079 4.018 399 HB2 ALA 70 HB2 ALA 70 113.780 -14.420 2.964 400 HB3 ALA 70 HB3 ALA 70 114.943 -14.673 4.266 401 H TYR 71 H TYR 71 111.143 -16.061 3.864 402 HA TYR 71 HA TYR 71 112.353 -18.509 5.120 403 HB2 TYR 71 HB2 TYR 71 109.455 -17.809 4.552 404 HD1 TYR 71 HD2 TYR 71 111.274 -19.236 7.477 405 HD2 TYR 71 HD1 TYR 71 109.174 -15.852 5.866 406 HE1 TYR 71 HE2 TYR 71 111.283 -18.164 9.715 407 HE2 TYR 71 HE1 TYR 71 109.184 -14.781 8.102 408 HH TYR 71 HH TYR 71 110.004 -16.474 10.946 409 H ARG 72 H ARG 72 112.605 -20.287 3.785 410 HA ARG 72 HA ARG 72 111.936 -19.885 0.890 411 HB2 ARG 72 HB2 ARG 72 114.329 -20.111 1.590 412 HG2 ARG 72 HG2 ARG 72 113.211 -22.430 -0.017 413 HD2 ARG 72 HD2 ARG 72 116.003 -21.223 0.112 414 HE ARG 72 HE ARG 72 114.728 -22.251 -2.134 415 HH11 ARG 72 HH11 ARG 72 115.824 -24.871 -0.947 416 HH12 ARG 72 HH12 ARG 72 117.319 -25.011 -1.812 417 HH21 ARG 72 HH21 ARG 72 117.308 -21.715 -2.890 418 HH22 ARG 72 HH22 ARG 72 118.159 -23.224 -2.912 419 H ILE 73 H ILE 73 109.721 -20.706 1.234 420 HA ILE 73 HA ILE 73 109.245 -23.366 2.315 421 HB ILE 73 HB ILE 73 107.583 -21.613 0.468 422 HG12 ILE 73 HG12 ILE 73 108.192 -20.376 2.489 423 HG21 ILE 73 HG21 ILE 73 105.685 -22.853 1.542 424 HG22 ILE 73 HG22 ILE 73 106.869 -23.903 2.320 425 HG23 ILE 73 HG23 ILE 73 106.729 -23.881 0.561 426 HD11 ILE 73 HD11 ILE 73 107.576 -21.294 4.728 427 HD12 ILE 73 HD12 ILE 73 108.830 -22.244 3.931 428 HD13 ILE 73 HD13 ILE 73 107.165 -22.826 3.957 429 H ASN 74 H ASN 74 109.407 -21.972 -0.950 430 HA ASN 74 HA ASN 74 110.148 -24.652 -2.034 431 HB2 ASN 74 HB2 ASN 74 108.017 -22.758 -3.094 432 HD21 ASN 74 HD21 ASN 74 105.885 -23.356 -2.462 433 HD22 ASN 74 HD22 ASN 74 105.547 -24.647 -1.414 434 H ASP 75 H ASP 75 111.556 -24.475 -3.859 435 HA ASP 75 HA ASP 75 113.252 -22.202 -4.043 436 HB2 ASP 75 HB2 ASP 75 112.592 -24.437 -5.987 437 H TRP 76 H TRP 76 110.309 -23.043 -5.806 438 HA TRP 76 HA TRP 76 110.446 -21.144 -7.916 439 HB2 TRP 76 HB2 TRP 76 108.128 -22.361 -6.390 440 HD1 TRP 76 HD1 TRP 76 108.712 -24.843 -6.547 441 HE1 TRP 76 HE1 TRP 76 109.425 -26.438 -8.442 442 HE3 TRP 76 HE3 TRP 76 109.389 -21.476 -10.326 443 HZ2 TRP 76 HZ2 TRP 76 110.182 -26.304 -11.197 444 HZ3 TRP 76 HZ3 TRP 76 110.106 -22.235 -12.573 445 HH2 TRP 76 HH2 TRP 76 110.503 -24.643 -13.013 446 H ALA 77 H ALA 77 109.272 -20.740 -4.555 447 HA ALA 77 HA ALA 77 109.233 -17.791 -5.047 448 HB1 ALA 77 HB1 ALA 77 106.995 -17.801 -3.822 449 HB2 ALA 77 HB2 ALA 77 106.994 -19.552 -4.031 450 HB3 ALA 77 HB3 ALA 77 106.981 -18.495 -5.443 451 H SER 78 H SER 78 109.239 -16.524 -3.064 452 HA SER 78 HA SER 78 110.005 -17.998 -0.568 453 HB2 SER 78 HB2 SER 78 112.013 -17.296 -1.896 454 HG SER 78 HG SER 78 112.691 -15.741 -0.054 455 H ILE 79 H ILE 79 109.609 -16.683 1.403 456 HA ILE 79 HA ILE 79 107.912 -14.257 0.884 457 HB ILE 79 HB ILE 79 106.564 -16.254 1.402 458 HG12 ILE 79 HG12 ILE 79 106.644 -14.518 3.877 459 HG21 ILE 79 HG21 ILE 79 108.276 -17.518 2.637 460 HG22 ILE 79 HG22 ILE 79 106.810 -17.357 3.604 461 HG23 ILE 79 HG23 ILE 79 108.210 -16.342 3.950 462 HD11 ILE 79 HD11 ILE 79 104.379 -15.758 2.283 463 HD12 ILE 79 HD12 ILE 79 104.207 -14.832 3.774 464 HD13 ILE 79 HD13 ILE 79 105.023 -16.395 3.795 465 H TYR 80 H TYR 80 108.383 -12.500 2.203 466 HA TYR 80 HA TYR 80 110.033 -12.942 4.642 467 HB2 TYR 80 HB2 TYR 80 111.713 -11.350 3.821 468 HD1 TYR 80 HD1 TYR 80 110.296 -12.361 0.557 469 HD2 TYR 80 HD2 TYR 80 111.019 -9.098 3.257 470 HE1 TYR 80 HE1 TYR 80 109.718 -10.749 -1.236 471 HE2 TYR 80 HE2 TYR 80 110.440 -7.487 1.461 472 HH TYR 80 HH TYR 80 109.044 -8.511 -1.555 473 H GLY 81 H GLY 81 110.183 -10.989 5.974 474 HA2 GLY 81 HA2 GLY 81 107.808 -9.200 5.626 475 H VAL 82 H VAL 82 108.205 -6.890 6.418 476 HA VAL 82 HA VAL 82 111.070 -6.090 6.186 477 HB VAL 82 HB VAL 82 110.395 -4.376 4.518 478 HG11 VAL 82 HG11 VAL 82 109.363 -6.986 3.466 479 HG12 VAL 82 HG12 VAL 82 111.032 -6.893 4.028 480 HG13 VAL 82 HG13 VAL 82 110.482 -5.844 2.722 481 HG21 VAL 82 HG21 VAL 82 107.896 -5.481 3.671 482 HG22 VAL 82 HG22 VAL 82 108.214 -3.855 4.273 483 HG23 VAL 82 HG23 VAL 82 107.769 -5.138 5.396 484 H VAL 83 H VAL 83 111.601 -4.476 7.554 485 HA VAL 83 HA VAL 83 109.489 -2.682 8.656 486 HB VAL 83 HB VAL 83 109.813 -4.557 10.231 487 HG11 VAL 83 HG11 VAL 83 111.875 -5.517 10.058 488 HG12 VAL 83 HG12 VAL 83 112.299 -4.358 11.316 489 HG13 VAL 83 HG13 VAL 83 112.662 -4.002 9.631 490 HG21 VAL 83 HG21 VAL 83 109.394 -2.365 11.206 491 HG22 VAL 83 HG22 VAL 83 111.107 -1.958 11.109 492 HG23 VAL 83 HG23 VAL 83 110.564 -3.222 12.212 493 H GLY 84 H GLY 84 110.404 -0.555 9.178 494 HA2 GLY 84 HA2 GLY 84 113.174 -0.007 9.270 495 H VAL 85 H VAL 85 113.539 2.368 8.517 496 HA VAL 85 HA VAL 85 111.249 4.013 9.530 497 HB VAL 85 HB VAL 85 114.246 4.423 9.780 498 HG11 VAL 85 HG11 VAL 85 113.454 6.577 10.004 499 HG12 VAL 85 HG12 VAL 85 113.189 6.018 11.654 500 HG13 VAL 85 HG13 VAL 85 111.850 6.047 10.507 501 HG21 VAL 85 HG21 VAL 85 113.493 2.533 11.133 502 HG22 VAL 85 HG22 VAL 85 112.152 3.487 11.769 503 HG23 VAL 85 HG23 VAL 85 113.812 3.907 12.192 504 H GLY 86 H GLY 86 110.721 5.853 8.396 505 HA2 GLY 86 HA2 GLY 86 112.030 6.217 5.738 506 H TYR 87 H TYR 87 112.959 8.239 5.136 507 HA TYR 87 HA TYR 87 113.271 10.186 7.402 508 HB2 TYR 87 HB2 TYR 87 115.075 9.258 5.155 509 HD1 TYR 87 HD1 TYR 87 114.463 7.094 6.598 510 HD2 TYR 87 HD2 TYR 87 116.718 10.455 8.036 511 HE1 TYR 87 HE1 TYR 87 115.447 5.674 8.373 512 HE2 TYR 87 HE2 TYR 87 117.700 9.033 9.815 513 HH TYR 87 HH TYR 87 118.106 6.714 10.298 514 H GLY 88 H GLY 88 112.488 12.218 7.006 515 HA2 GLY 88 HA2 GLY 88 111.920 12.963 4.162 516 H LYS 89 H LYS 89 113.412 14.453 3.532 517 HA LYS 89 HA LYS 89 114.370 16.442 5.566 518 HB2 LYS 89 HB2 LYS 89 115.637 15.292 3.059 519 HG2 LYS 89 HG2 LYS 89 116.230 14.963 6.016 520 HD2 LYS 89 HD2 LYS 89 117.688 13.945 3.558 521 HE2 LYS 89 HE2 LYS 89 118.158 13.347 6.505 522 HZ1 LYS 89 HZ1 LYS 89 119.546 12.670 3.961 523 HZ2 LYS 89 HZ2 LYS 89 119.909 11.940 5.451 524 HZ3 LYS 89 HZ3 LYS 89 120.156 13.607 5.236 525 H PHE 90 H PHE 90 114.086 18.604 5.104 526 HA PHE 90 HA PHE 90 113.298 19.398 2.333 527 HB2 PHE 90 HB2 PHE 90 111.433 20.700 3.306 528 HD1 PHE 90 HD2 PHE 90 111.880 18.176 5.989 529 HD2 PHE 90 HD1 PHE 90 111.851 22.357 5.000 530 HE1 PHE 90 HE2 PHE 90 111.883 18.747 8.402 531 HE2 PHE 90 HE1 PHE 90 111.855 22.928 7.414 532 HZ PHE 90 HZ PHE 90 111.872 21.122 9.114 533 H GLN 91 H GLN 91 113.654 21.732 1.951 534 HA GLN 91 HA GLN 91 115.899 22.781 3.590 535 HB2 GLN 91 HB2 GLN 91 114.657 23.608 0.945 536 HG2 GLN 91 HG2 GLN 91 117.166 22.044 1.631 537 HE21 GLN 91 HE21 GLN 91 115.550 21.711 -1.431 538 HE22 GLN 91 HE22 GLN 91 116.677 22.580 -2.357 539 H THR 92 H THR 92 115.662 24.551 4.918 540 HA THR 92 HA THR 92 113.225 26.254 4.628 541 HB THR 92 HB THR 92 112.905 24.401 6.296 542 HG1 THR 92 HG1 THR 92 112.226 25.832 7.961 543 HG21 THR 92 HG21 THR 92 115.463 24.679 6.968 544 HG22 THR 92 HG22 THR 92 114.271 24.110 8.136 545 HG23 THR 92 HG23 THR 92 114.787 25.797 8.153 546 H THR 93 H THR 93 113.491 28.385 5.638 547 HA THR 93 HA THR 93 116.369 29.184 5.865 548 HB THR 93 HB THR 93 115.050 30.196 4.054 549 HG1 THR 93 HG1 THR 93 115.455 32.022 6.184 550 HG21 THR 93 HG21 THR 93 112.834 30.402 4.471 551 HG22 THR 93 HG22 THR 93 113.264 31.918 5.262 552 HG23 THR 93 HG23 THR 93 113.077 30.447 6.217 553 H GLU 94 H GLU 94 113.755 28.504 7.849 554 HA GLU 94 HA GLU 94 113.694 30.682 9.695 555 HB2 GLU 94 HB2 GLU 94 113.241 27.698 10.022 556 HG2 GLU 94 HG2 GLU 94 111.366 30.023 9.482 557 H TYR 95 H TYR 95 115.881 27.918 9.386 558 HA TYR 95 HA TYR 95 117.441 28.957 11.733 559 HB2 TYR 95 HB2 TYR 95 116.222 26.558 11.483 560 HD1 TYR 95 HD1 TYR 95 119.901 27.041 12.051 561 HD2 TYR 95 HD2 TYR 95 116.029 26.420 13.806 562 HE1 TYR 95 HE1 TYR 95 120.944 26.882 14.296 563 HE2 TYR 95 HE2 TYR 95 117.072 26.261 16.050 564 HH TYR 95 HH TYR 95 120.436 25.918 16.493 565 HA PRO 96 HA PRO 96 120.197 29.639 8.152 566 HB2 PRO 96 HB2 PRO 96 121.824 31.429 9.445 567 HG2 PRO 96 HG2 PRO 96 120.866 31.347 11.547 568 HD2 PRO 96 HD2 PRO 96 118.786 30.420 11.920 569 H THR 97 H THR 97 122.143 28.588 7.757 570 HA THR 97 HA THR 97 123.858 27.010 8.125 571 HB THR 97 HB THR 97 125.492 27.813 9.745 572 HG1 THR 97 HG1 THR 97 124.956 29.087 11.381 573 HG21 THR 97 HG21 THR 97 124.293 30.400 8.908 574 HG22 THR 97 HG22 THR 97 124.629 29.233 7.628 575 HG23 THR 97 HG23 THR 97 125.932 29.790 8.678 576 H TYR 98 H TYR 98 124.941 25.696 10.134 577 HA TYR 98 HA TYR 98 124.553 23.842 11.555 578 HB2 TYR 98 HB2 TYR 98 124.339 25.907 12.978 579 HD1 TYR 98 HD1 TYR 98 125.510 24.025 14.152 580 HD2 TYR 98 HD2 TYR 98 121.227 24.263 13.913 581 HE1 TYR 98 HE1 TYR 98 125.315 22.381 15.998 582 HE2 TYR 98 HE2 TYR 98 121.033 22.617 15.759 583 HH TYR 98 HH TYR 98 123.051 21.960 17.853 584 H LYS 99 H LYS 99 123.335 23.004 9.444 585 HA LYS 99 HA LYS 99 120.456 22.903 9.409 586 HB2 LYS 99 HB2 LYS 99 122.606 21.088 8.265 587 HG2 LYS 99 HG2 LYS 99 121.062 23.440 7.127 588 HD2 LYS 99 HD2 LYS 99 123.034 21.528 5.838 589 HE2 LYS 99 HE2 LYS 99 122.350 24.325 5.253 590 HZ1 LYS 99 HZ1 LYS 99 122.061 22.253 3.134 591 HZ2 LYS 99 HZ2 LYS 99 121.862 23.929 2.946 592 HZ3 LYS 99 HZ3 LYS 99 120.755 23.038 3.878 593 H ASN 100 H ASN 100 122.944 20.811 10.822 594 HA ASN 100 HA ASN 100 122.803 19.047 12.377 595 HB2 ASN 100 HB2 ASN 100 121.543 21.032 13.449 596 HD21 ASN 100 HD21 ASN 100 119.666 19.913 15.385 597 HD22 ASN 100 HD22 ASN 100 120.490 18.701 16.243 598 H ASP 101 H ASP 101 121.334 18.900 9.591 599 HA ASP 101 HA ASP 101 119.964 17.348 8.449 600 HB2 ASP 101 HB2 ASP 101 121.170 15.741 10.720 601 H THR 102 H THR 102 118.428 18.925 10.302 602 HA THR 102 HA THR 102 116.809 17.300 12.049 603 HB THR 102 HB THR 102 117.083 19.732 12.266 604 HG1 THR 102 HG1 THR 102 115.158 18.893 13.042 605 HG21 THR 102 HG21 THR 102 116.803 19.759 9.512 606 HG22 THR 102 HG22 THR 102 116.806 21.183 10.552 607 HG23 THR 102 HG23 THR 102 115.277 20.447 10.069 608 H SER 103 H SER 103 115.566 15.648 11.252 609 HA SER 103 HA SER 103 113.715 16.251 8.987 610 HB2 SER 103 HB2 SER 103 114.376 14.172 7.900 611 HG SER 103 HG SER 103 114.824 12.909 9.660 612 H ASP 104 H ASP 104 111.882 14.709 8.923 613 HA ASP 104 HA ASP 104 111.120 13.803 11.650 614 HB2 ASP 104 HB2 ASP 104 109.653 14.085 9.007 615 H TYR 105 H TYR 105 110.720 11.601 12.137 616 HA TYR 105 HA TYR 105 111.544 9.639 10.025 617 HB2 TYR 105 HB2 TYR 105 111.548 9.393 13.052 618 HD1 TYR 105 HD2 TYR 105 114.096 9.258 10.302 619 HD2 TYR 105 HD1 TYR 105 112.809 11.157 13.934 620 HE1 TYR 105 HE2 TYR 105 116.181 10.601 10.343 621 HE2 TYR 105 HE1 TYR 105 114.895 12.496 13.974 622 HH TYR 105 HH TYR 105 116.642 13.239 11.802 623 H GLY 106 H GLY 106 110.313 7.638 9.921 624 HA2 GLY 106 HA2 GLY 106 107.755 7.559 11.429 625 H PHE 107 H PHE 107 106.852 5.380 11.507 626 HA PHE 107 HA PHE 107 108.927 3.294 11.097 627 HB2 PHE 107 HB2 PHE 107 107.770 3.651 13.278 628 HD1 PHE 107 HD1 PHE 107 109.545 1.925 13.501 629 HD2 PHE 107 HD2 PHE 107 105.656 0.987 11.938 630 HE1 PHE 107 HE1 PHE 107 109.988 -0.491 13.849 631 HE2 PHE 107 HE2 PHE 107 106.098 -1.428 12.286 632 HZ PHE 107 HZ PHE 107 108.264 -2.168 13.241 633 H SER 108 H SER 108 108.653 1.589 9.668 634 HA SER 108 HA SER 108 106.096 1.503 8.094 635 HB2 SER 108 HB2 SER 108 107.507 1.013 6.152 636 HG SER 108 HG SER 108 109.519 0.453 6.380 637 H TYR 109 H TYR 109 105.601 -0.668 7.212 638 HA TYR 109 HA TYR 109 107.098 -2.986 8.195 639 HB2 TYR 109 HB2 TYR 109 105.357 -3.791 9.679 640 HD1 TYR 109 HD2 TYR 109 104.199 -0.274 9.518 641 HD2 TYR 109 HD1 TYR 109 103.213 -4.384 8.751 642 HE1 TYR 109 HE2 TYR 109 101.826 0.359 9.169 643 HE2 TYR 109 HE1 TYR 109 100.842 -3.751 8.403 644 HH TYR 109 HH TYR 109 99.840 -0.528 8.004 645 H GLY 110 H GLY 110 106.278 -4.998 7.189 646 HA2 GLY 110 HA2 GLY 110 103.953 -5.369 5.728 647 H ALA 111 H ALA 111 104.647 -6.647 3.448 648 HA ALA 111 HA ALA 111 107.034 -8.322 3.746 649 HB1 ALA 111 HB1 ALA 111 105.955 -10.292 4.487 650 HB2 ALA 111 HB2 ALA 111 104.359 -9.689 4.042 651 HB3 ALA 111 HB3 ALA 111 105.186 -9.038 5.457 652 H GLY 112 H GLY 112 107.048 -10.020 1.863 653 HA2 GLY 112 HA2 GLY 112 104.985 -9.576 -0.181 654 H LEU 113 H LEU 113 105.881 -10.939 -2.256 655 HA LEU 113 HA LEU 113 107.226 -13.421 -1.260 656 HB2 LEU 113 HB2 LEU 113 104.729 -13.578 -1.116 657 HG LEU 113 HG LEU 113 106.262 -15.299 -3.063 658 HD11 LEU 113 HD11 LEU 113 105.056 -16.288 -0.528 659 HD12 LEU 113 HD12 LEU 113 106.391 -15.146 -0.373 660 HD13 LEU 113 HD13 LEU 113 106.623 -16.659 -1.248 661 HD21 LEU 113 HD21 LEU 113 103.727 -15.177 -3.550 662 HD22 LEU 113 HD22 LEU 113 103.520 -15.981 -1.995 663 HD23 LEU 113 HD23 LEU 113 104.419 -16.777 -3.286 664 H GLN 114 H GLN 114 108.414 -14.538 -2.935 665 HA GLN 114 HA GLN 114 108.792 -12.967 -5.436 666 HB2 GLN 114 HB2 GLN 114 110.325 -15.239 -4.120 667 HG2 GLN 114 HG2 GLN 114 110.957 -12.281 -4.334 668 HE21 GLN 114 HE21 GLN 114 112.909 -11.778 -2.906 669 HE22 GLN 114 HE22 GLN 114 114.121 -12.959 -2.762 670 H PHE 115 H PHE 115 108.314 -13.923 -7.472 671 HA PHE 115 HA PHE 115 107.491 -16.785 -7.526 672 HB2 PHE 115 HB2 PHE 115 105.520 -15.382 -6.931 673 HD1 PHE 115 HD1 PHE 115 104.887 -17.785 -7.021 674 HD2 PHE 115 HD2 PHE 115 105.139 -15.372 -10.565 675 HE1 PHE 115 HE1 PHE 115 103.598 -19.493 -8.275 676 HE2 PHE 115 HE2 PHE 115 103.849 -17.080 -11.820 677 HZ PHE 115 HZ PHE 115 103.079 -19.141 -10.675 678 H ASN 116 H ASN 116 107.631 -17.696 -9.599 679 HA ASN 116 HA ASN 116 107.814 -16.392 -12.101 680 HB2 ASN 116 HB2 ASN 116 110.107 -15.968 -10.419 681 HD21 ASN 116 HD21 ASN 116 111.532 -15.384 -13.215 682 HD22 ASN 116 HD22 ASN 116 110.765 -13.953 -13.709 683 HA PRO 117 HA PRO 117 108.253 -20.760 -12.976 684 HB2 PRO 117 HB2 PRO 117 107.501 -20.639 -15.598 685 HG2 PRO 117 HG2 PRO 117 107.301 -18.437 -16.075 686 HD2 PRO 117 HD2 PRO 117 108.194 -17.058 -14.531 687 H MET 118 H MET 118 110.671 -19.288 -12.924 688 HA MET 118 HA MET 118 112.109 -20.407 -15.259 689 HB2 MET 118 HB2 MET 118 112.207 -17.572 -14.180 690 HG2 MET 118 HG2 MET 118 111.391 -18.728 -16.864 691 HE1 MET 118 HE1 MET 118 110.536 -15.807 -18.841 692 HE2 MET 118 HE2 MET 118 109.451 -15.701 -17.457 693 HE3 MET 118 HE3 MET 118 109.886 -17.279 -18.108 694 H GLU 119 H GLU 119 114.053 -21.229 -14.655 695 HA GLU 119 HA GLU 119 114.637 -21.793 -11.922 696 HB2 GLU 119 HB2 GLU 119 115.279 -23.125 -13.923 697 HG2 GLU 119 HG2 GLU 119 117.555 -22.210 -12.137 698 H ASN 120 H ASN 120 116.306 -19.469 -14.161 699 HA ASN 120 HA ASN 120 117.815 -18.451 -11.801 700 HB2 ASN 120 HB2 ASN 120 118.136 -18.096 -14.793 701 HD21 ASN 120 HD21 ASN 120 119.718 -19.585 -15.693 702 HD22 ASN 120 HD22 ASN 120 120.248 -20.951 -14.837 703 H VAL 121 H VAL 121 114.929 -17.618 -13.210 704 HA VAL 121 HA VAL 121 115.470 -14.682 -12.857 705 HB VAL 121 HB VAL 121 113.419 -16.110 -14.582 706 HG11 VAL 121 HG11 VAL 121 113.011 -13.701 -13.590 707 HG12 VAL 121 HG12 VAL 121 112.670 -14.024 -15.290 708 HG13 VAL 121 HG13 VAL 121 114.169 -13.218 -14.829 709 HG21 VAL 121 HG21 VAL 121 115.562 -14.428 -15.763 710 HG22 VAL 121 HG22 VAL 121 114.861 -15.934 -16.355 711 HG23 VAL 121 HG23 VAL 121 116.084 -15.969 -15.086 712 H ALA 122 H ALA 122 114.194 -13.621 -11.357 713 HA ALA 122 HA ALA 122 111.768 -15.025 -10.322 714 HB1 ALA 122 HB1 ALA 122 113.652 -13.788 -8.369 715 HB2 ALA 122 HB2 ALA 122 114.120 -15.324 -9.098 716 HB3 ALA 122 HB3 ALA 122 112.616 -15.203 -8.186 717 H LEU 123 H LEU 123 110.136 -13.689 -9.739 718 HA LEU 123 HA LEU 123 110.591 -10.720 -9.879 719 HB2 LEU 123 HB2 LEU 123 108.452 -12.631 -10.695 720 HG LEU 123 HG LEU 123 108.175 -11.018 -12.520 721 HD11 LEU 123 HD11 LEU 123 110.395 -9.262 -11.826 722 HD12 LEU 123 HD12 LEU 123 109.092 -9.165 -10.642 723 HD13 LEU 123 HD13 LEU 123 108.763 -8.851 -12.345 724 HD21 LEU 123 HD21 LEU 123 110.049 -11.735 -13.591 725 HD22 LEU 123 HD22 LEU 123 110.401 -12.579 -12.084 726 HD23 LEU 123 HD23 LEU 123 111.123 -11.003 -12.399 727 H ASP 124 H ASP 124 109.534 -9.434 -8.113 728 HA ASP 124 HA ASP 124 108.451 -11.050 -5.861 729 HB2 ASP 124 HB2 ASP 124 110.938 -10.825 -5.648 730 H PHE 125 H PHE 125 106.887 -9.909 -4.703 731 HA PHE 125 HA PHE 125 106.629 -6.980 -5.258 732 HB2 PHE 125 HB2 PHE 125 104.191 -7.352 -5.468 733 HD1 PHE 125 HD1 PHE 125 105.393 -10.756 -6.312 734 HD2 PHE 125 HD2 PHE 125 102.961 -8.390 -3.679 735 HE1 PHE 125 HE1 PHE 125 104.357 -12.822 -5.413 736 HE2 PHE 125 HE2 PHE 125 101.924 -10.455 -2.780 737 HZ PHE 125 HZ PHE 125 102.622 -12.671 -3.647 738 H SER 126 H SER 126 106.008 -5.768 -3.425 739 HA SER 126 HA SER 126 105.227 -7.263 -0.965 740 HB2 SER 126 HB2 SER 126 107.709 -7.105 -1.099 741 HG SER 126 HG SER 126 107.929 -6.085 0.956 742 H TYR 127 H TYR 127 104.120 -5.976 0.557 743 HA TYR 127 HA TYR 127 103.400 -3.207 -0.352 744 HB2 TYR 127 HB2 TYR 127 101.604 -4.926 -0.497 745 HD1 TYR 127 HD2 TYR 127 100.775 -2.697 -1.252 746 HD2 TYR 127 HD1 TYR 127 100.925 -3.784 2.900 747 HE1 TYR 127 HE2 TYR 127 99.243 -0.825 -0.707 748 HE2 TYR 127 HE1 TYR 127 99.394 -1.911 3.446 749 HH TYR 127 HH TYR 127 98.736 0.598 1.332 750 H GLU 128 H GLU 128 104.042 -1.634 1.078 751 HA GLU 128 HA GLU 128 104.328 -2.353 3.970 752 HB2 GLU 128 HB2 GLU 128 106.493 -2.483 2.725 753 HG2 GLU 128 HG2 GLU 128 106.217 -0.188 4.692 754 H GLN 129 H GLN 129 103.543 -0.769 5.330 755 HA GLN 129 HA GLN 129 102.683 1.821 4.085 756 HB2 GLN 129 HB2 GLN 129 100.943 0.238 4.963 757 HG2 GLN 129 HG2 GLN 129 101.250 2.806 6.552 758 HE21 GLN 129 HE21 GLN 129 98.878 3.717 6.865 759 HE22 GLN 129 HE22 GLN 129 97.703 2.577 7.312 760 H SER 130 H SER 130 103.682 3.658 4.868 761 HA SER 130 HA SER 130 105.199 3.422 7.451 762 HB2 SER 130 HB2 SER 130 105.815 5.024 4.947 763 HG SER 130 HG SER 130 107.237 3.458 4.497 764 H ARG 131 H ARG 131 105.084 5.228 8.854 765 HA ARG 131 HA ARG 131 103.289 7.473 8.025 766 HB2 ARG 131 HB2 ARG 131 102.151 7.250 10.205 767 HG2 ARG 131 HG2 ARG 131 104.079 4.938 10.559 768 HD2 ARG 131 HD2 ARG 131 101.599 5.676 12.161 769 HE ARG 131 HE ARG 131 103.234 3.414 13.004 770 HH11 ARG 131 HH11 ARG 131 101.749 5.450 14.743 771 HH12 ARG 131 HH12 ARG 131 103.077 6.257 15.509 772 HH21 ARG 131 HH21 ARG 131 105.442 5.048 13.280 773 HH22 ARG 131 HH22 ARG 131 105.167 6.030 14.681 774 H ILE 132 H ILE 132 104.190 9.443 8.537 775 HA ILE 132 HA ILE 132 106.425 9.489 10.535 776 HB ILE 132 HB ILE 132 105.928 11.148 8.036 777 HG12 ILE 132 HG12 ILE 132 108.090 9.095 8.583 778 HG21 ILE 132 HG21 ILE 132 107.205 12.603 9.283 779 HG22 ILE 132 HG22 ILE 132 108.505 11.598 8.642 780 HG23 ILE 132 HG23 ILE 132 107.894 11.316 10.272 781 HD11 ILE 132 HD11 ILE 132 107.202 10.641 6.135 782 HD12 ILE 132 HD12 ILE 132 108.308 9.269 6.067 783 HD13 ILE 132 HD13 ILE 132 108.765 10.729 6.945 784 H ARG 133 H ARG 133 104.299 9.822 11.927 785 HA ARG 133 HA ARG 133 103.153 11.283 13.354 786 HB2 ARG 133 HB2 ARG 133 105.436 12.403 13.256 787 HG2 ARG 133 HG2 ARG 133 102.966 14.135 13.594 788 HD2 ARG 133 HD2 ARG 133 105.077 15.465 13.399 789 HE ARG 133 HE ARG 133 106.024 13.588 15.542 790 HH11 ARG 133 HH21 ARG 133 107.389 16.297 15.235 791 HH12 ARG 133 HH22 ARG 133 108.724 15.886 14.211 792 HH21 ARG 133 HH11 ARG 133 107.383 12.838 13.240 793 HH22 ARG 133 HH12 ARG 133 108.721 13.927 13.083 794 H SER 134 H SER 134 103.592 13.113 10.275 795 HA SER 134 HA SER 134 100.603 13.388 10.197 796 HB2 SER 134 HB2 SER 134 100.924 15.651 9.502 797 HG SER 134 HG SER 134 103.523 15.972 9.472 798 H VAL 135 H VAL 135 103.069 11.840 8.639 799 HA VAL 135 HA VAL 135 101.742 12.200 5.965 800 HB VAL 135 HB VAL 135 104.668 11.702 6.609 801 HG11 VAL 135 HG11 VAL 135 105.060 11.942 4.246 802 HG12 VAL 135 HG12 VAL 135 103.383 12.406 3.958 803 HG13 VAL 135 HG13 VAL 135 103.771 10.754 4.434 804 HG21 VAL 135 HG21 VAL 135 104.953 14.025 5.726 805 HG22 VAL 135 HG22 VAL 135 103.998 13.978 7.208 806 HG23 VAL 135 HG23 VAL 135 103.198 14.180 5.649 807 H ASP 136 H ASP 136 101.058 10.308 5.020 808 HA ASP 136 HA ASP 136 102.171 7.720 6.046 809 HB2 ASP 136 HB2 ASP 136 99.942 8.329 7.039 810 H VAL 137 H VAL 137 103.169 6.790 4.230 811 HA VAL 137 HA VAL 137 101.970 7.342 1.561 812 HB VAL 137 HB VAL 137 104.737 6.382 2.350 813 HG11 VAL 137 HG11 VAL 137 103.442 7.240 -0.227 814 HG12 VAL 137 HG12 VAL 137 104.426 5.812 0.097 815 HG13 VAL 137 HG13 VAL 137 105.184 7.400 -0.004 816 HG21 VAL 137 HG21 VAL 137 103.676 8.912 2.833 817 HG22 VAL 137 HG22 VAL 137 104.514 9.110 1.296 818 HG23 VAL 137 HG23 VAL 137 105.388 8.523 2.708 819 H GLY 138 H GLY 138 101.542 5.620 0.174 820 HA2 GLY 138 HA2 GLY 138 101.973 2.858 1.228 821 H THR 139 H THR 139 103.326 1.857 -0.210 822 HA THR 139 HA THR 139 102.998 2.513 -3.117 823 HB THR 139 HB THR 139 104.864 3.750 -2.087 824 HG1 THR 139 HG1 THR 139 105.760 1.583 -3.675 825 HG21 THR 139 HG21 THR 139 105.856 0.986 -1.336 826 HG22 THR 139 HG22 THR 139 105.354 2.258 -0.222 827 HG23 THR 139 HG23 THR 139 106.807 2.465 -1.197 828 H TRP 140 H TRP 140 103.555 0.852 -4.567 829 HA TRP 140 HA TRP 140 103.794 -1.892 -3.380 830 HB2 TRP 140 HB2 TRP 140 101.718 -1.323 -4.665 831 HD1 TRP 140 HD1 TRP 140 103.818 -2.946 -7.380 832 HE1 TRP 140 HE1 TRP 140 103.402 -5.491 -7.358 833 HE3 TRP 140 HE3 TRP 140 101.047 -3.352 -3.110 834 HZ2 TRP 140 HZ2 TRP 140 102.067 -7.441 -5.744 835 HZ3 TRP 140 HZ3 TRP 140 100.215 -5.560 -2.354 836 HH2 TRP 140 HH2 TRP 140 100.721 -7.604 -3.665 837 H ILE 141 H ILE 141 105.672 -3.024 -3.962 838 HA ILE 141 HA ILE 141 107.421 -1.706 -6.011 839 HB ILE 141 HB ILE 141 109.280 -2.620 -4.681 840 HG12 ILE 141 HG12 ILE 141 107.141 -3.665 -2.800 841 HG21 ILE 141 HG21 ILE 141 107.532 -0.579 -3.912 842 HG22 ILE 141 HG22 ILE 141 109.165 -0.840 -3.299 843 HG23 ILE 141 HG23 ILE 141 107.781 -1.512 -2.437 844 HD11 ILE 141 HD11 ILE 141 109.438 -4.929 -2.142 845 HD12 ILE 141 HD12 ILE 141 108.949 -3.400 -1.413 846 HD13 ILE 141 HD13 ILE 141 110.103 -3.412 -2.746 847 H ALA 142 H ALA 142 108.459 -2.998 -7.546 848 HA ALA 142 HA ALA 142 107.999 -5.936 -7.530 849 HB1 ALA 142 HB1 ALA 142 106.957 -3.911 -9.517 850 HB2 ALA 142 HB2 ALA 142 106.079 -5.221 -8.728 851 HB3 ALA 142 HB3 ALA 142 107.244 -5.582 -10.002 852 H GLY 143 H GLY 143 109.818 -6.968 -8.433 853 HA2 GLY 143 HA2 GLY 143 111.514 -5.557 -10.350 854 H VAL 144 H VAL 144 113.891 -6.949 -9.803 855 HA VAL 144 HA VAL 144 113.107 -9.701 -10.667 856 HB VAL 144 HB VAL 144 114.431 -8.296 -12.203 857 HG11 VAL 144 HG11 VAL 144 115.609 -6.815 -10.773 858 HG12 VAL 144 HG12 VAL 144 116.858 -7.848 -11.465 859 HG13 VAL 144 HG13 VAL 144 116.285 -8.137 -9.823 860 HG21 VAL 144 HG21 VAL 144 114.819 -10.843 -11.883 861 HG22 VAL 144 HG22 VAL 144 116.320 -10.367 -11.089 862 HG23 VAL 144 HG23 VAL 144 116.036 -9.929 -12.773 863 H GLY 145 H GLY 145 114.653 -11.445 -9.966 864 HA2 GLY 145 HA2 GLY 145 116.118 -10.982 -7.453 865 H TYR 146 H TYR 146 117.756 -12.460 -7.190 866 HA TYR 146 HA TYR 146 117.778 -14.875 -8.969 867 HB2 TYR 146 HB2 TYR 146 119.113 -12.957 -9.864 868 HD1 TYR 146 HD2 TYR 146 119.191 -14.891 -11.427 869 HD2 TYR 146 HD1 TYR 146 121.730 -14.666 -7.970 870 HE1 TYR 146 HE2 TYR 146 120.630 -16.678 -12.368 871 HE2 TYR 146 HE1 TYR 146 123.170 -16.453 -8.911 872 HH TYR 146 HH TYR 146 123.700 -17.362 -11.216 873 H ARG 147 H ARG 147 119.034 -16.656 -8.090 874 HA ARG 147 HA ARG 147 119.683 -16.366 -5.167 875 HB2 ARG 147 HB2 ARG 147 118.379 -18.640 -6.695 876 HG2 ARG 147 HG2 ARG 147 117.389 -16.725 -4.559 877 HD2 ARG 147 HD2 ARG 147 116.516 -19.016 -4.178 878 HE ARG 147 HE ARG 147 115.887 -18.891 -7.107 879 HH11 ARG 147 HH11 ARG 147 114.562 -20.711 -4.826 880 HH12 ARG 147 HH12 ARG 147 115.305 -22.218 -5.243 881 HH21 ARG 147 HH21 ARG 147 117.642 -20.784 -7.368 882 HH22 ARG 147 HH22 ARG 147 117.051 -22.259 -6.681 883 H PHE 148 H PHE 148 121.825 -16.713 -4.815 884 HA PHE 148 HA PHE 148 123.488 -18.104 -6.815 885 HB2 PHE 148 HB2 PHE 148 124.155 -16.004 -5.656 886 HD1 PHE 148 HD1 PHE 148 125.830 -16.600 -7.394 887 HD2 PHE 148 HD2 PHE 148 125.876 -18.397 -3.492 888 HE1 PHE 148 HE1 PHE 148 128.146 -17.398 -7.787 889 HE2 PHE 148 HE2 PHE 148 128.191 -19.194 -3.886 890 HZ PHE 148 HZ PHE 148 129.325 -18.695 -6.034 Start of MODEL 5 1 H THR 2 H THR 2 124.372 -17.003 1.208 2 HA THR 2 HA THR 2 125.858 -16.587 -1.339 3 HB THR 2 HB THR 2 124.217 -18.485 -1.534 4 HG1 THR 2 HG1 THR 2 124.515 -17.557 -3.432 5 HG21 THR 2 HG21 THR 2 121.927 -18.208 -1.196 6 HG22 THR 2 HG22 THR 2 122.010 -16.455 -1.370 7 HG23 THR 2 HG23 THR 2 122.597 -17.224 0.104 8 H SER 3 H SER 3 125.009 -14.646 -2.516 9 HA SER 3 HA SER 3 123.550 -12.751 -0.698 10 HB2 SER 3 HB2 SER 3 125.865 -12.225 -2.594 11 HG SER 3 HG SER 3 126.676 -11.629 -0.311 12 H THR 4 H THR 4 122.037 -11.352 -1.807 13 HA THR 4 HA THR 4 121.768 -11.843 -4.744 14 HB THR 4 HB THR 4 119.412 -12.238 -4.488 15 HG1 THR 4 HG1 THR 4 118.339 -11.790 -2.675 16 HG21 THR 4 HG21 THR 4 121.200 -14.015 -3.612 17 HG22 THR 4 HG22 THR 4 119.466 -14.315 -3.497 18 HG23 THR 4 HG23 THR 4 120.357 -13.737 -2.088 19 H VAL 5 H VAL 5 120.793 -10.109 -5.882 20 HA VAL 5 HA VAL 5 120.736 -7.502 -4.393 21 HB VAL 5 HB VAL 5 121.235 -8.133 -7.327 22 HG11 VAL 5 HG11 VAL 5 121.144 -5.594 -5.711 23 HG12 VAL 5 HG12 VAL 5 120.429 -5.930 -7.289 24 HG13 VAL 5 HG13 VAL 5 122.172 -5.698 -7.141 25 HG21 VAL 5 HG21 VAL 5 123.005 -7.851 -4.940 26 HG22 VAL 5 HG22 VAL 5 123.563 -7.115 -6.443 27 HG23 VAL 5 HG23 VAL 5 123.216 -8.843 -6.382 28 H THR 6 H THR 6 118.798 -6.339 -4.471 29 HA THR 6 HA THR 6 116.803 -6.958 -6.553 30 HB THR 6 HB THR 6 116.257 -7.394 -3.602 31 HG1 THR 6 HG1 THR 6 116.481 -9.297 -5.688 32 HG21 THR 6 HG21 THR 6 114.133 -8.322 -4.382 33 HG22 THR 6 HG22 THR 6 114.596 -8.022 -6.058 34 HG23 THR 6 HG23 THR 6 114.312 -6.667 -4.965 35 H GLY 7 H GLY 7 115.816 -5.034 -7.081 36 HA2 GLY 7 HA2 GLY 7 114.883 -3.159 -5.106 37 H GLY 8 H GLY 8 114.188 -1.034 -6.338 38 HA2 GLY 8 HA2 GLY 8 113.955 -0.984 -9.164 39 H TYR 9 H TYR 9 110.948 -0.261 -8.796 40 HA TYR 9 HA TYR 9 111.257 2.253 -7.225 41 HB2 TYR 9 HB2 TYR 9 110.546 3.578 -9.144 42 HD1 TYR 9 HD1 TYR 9 111.617 0.554 -11.002 43 HD2 TYR 9 HD2 TYR 9 108.366 3.215 -10.104 44 HE1 TYR 9 HE1 TYR 9 110.280 -0.465 -12.824 45 HE2 TYR 9 HE2 TYR 9 107.029 2.195 -11.927 46 HH TYR 9 HH TYR 9 108.113 0.616 -14.338 47 H ALA 10 H ALA 10 109.103 3.266 -6.764 48 HA ALA 10 HA ALA 10 106.766 1.495 -7.312 49 HB1 ALA 10 HB1 ALA 10 106.295 1.728 -4.775 50 HB2 ALA 10 HB2 ALA 10 107.990 2.200 -4.648 51 HB3 ALA 10 HB3 ALA 10 107.563 0.607 -5.272 52 H GLN 11 H GLN 11 104.803 2.586 -7.309 53 HA GLN 11 HA GLN 11 104.886 5.554 -6.857 54 HB2 GLN 11 HB2 GLN 11 103.174 3.800 -8.662 55 HG2 GLN 11 HG2 GLN 11 105.333 5.833 -9.311 56 HE21 GLN 11 HE21 GLN 11 105.800 5.805 -11.715 57 HE22 GLN 11 HE22 GLN 11 104.536 5.445 -12.790 58 H SER 12 H SER 12 103.172 6.393 -5.487 59 HA SER 12 HA SER 12 101.224 4.375 -4.450 60 HB2 SER 12 HB2 SER 12 101.969 4.748 -2.198 61 HG SER 12 HG SER 12 103.762 6.281 -1.935 62 H ASP 13 H ASP 13 99.387 5.275 -3.423 63 HA ASP 13 HA ASP 13 98.683 8.021 -4.234 64 HB2 ASP 13 HB2 ASP 13 97.256 5.810 -2.708 65 H ALA 14 H ALA 14 98.214 9.697 -2.604 66 HA ALA 14 HA ALA 14 99.327 9.042 0.103 67 HB1 ALA 14 HB1 ALA 14 100.614 10.987 0.012 68 HB2 ALA 14 HB2 ALA 14 99.572 11.739 -1.196 69 HB3 ALA 14 HB3 ALA 14 100.670 10.439 -1.663 70 H GLN 15 H GLN 15 97.377 8.917 1.230 71 HA GLN 15 HA GLN 15 95.246 10.898 0.865 72 HB2 GLN 15 HB2 GLN 15 94.945 8.474 1.488 73 HG2 GLN 15 HG2 GLN 15 93.955 10.465 3.555 74 HE21 GLN 15 HE21 GLN 15 91.562 9.696 4.131 75 HE22 GLN 15 HE22 GLN 15 91.383 8.032 4.411 76 H GLY 16 H GLY 16 95.481 12.925 1.715 77 HA2 GLY 16 HA2 GLY 16 95.618 14.371 3.669 78 H GLN 17 H GLN 17 97.977 13.137 1.499 79 HA GLN 17 HA GLN 17 99.817 15.428 2.057 80 HB2 GLN 17 HB2 GLN 17 100.146 12.824 0.541 81 HG2 GLN 17 HG2 GLN 17 101.283 13.840 3.165 82 HE21 GLN 17 HE21 GLN 17 102.415 11.876 4.305 83 HE22 GLN 17 HE22 GLN 17 103.374 10.882 3.319 84 H MET 18 H MET 18 100.929 16.130 -0.157 85 HA MET 18 HA MET 18 99.017 17.524 -1.700 86 HB2 MET 18 HB2 MET 18 101.851 16.638 -2.308 87 HG2 MET 18 HG2 MET 18 101.532 18.024 -0.258 88 HE1 MET 18 HE1 MET 18 100.381 21.411 -3.012 89 HE2 MET 18 HE2 MET 18 99.763 19.862 -3.580 90 HE3 MET 18 HE3 MET 18 101.488 20.058 -3.280 91 H ASN 19 H ASN 19 100.815 14.528 -2.723 92 HA ASN 19 HA ASN 19 98.485 13.548 -4.171 93 HB2 ASN 19 HB2 ASN 19 99.692 15.593 -5.411 94 HD21 ASN 19 HD21 ASN 19 99.795 14.700 -8.181 95 HD22 ASN 19 HD22 ASN 19 98.278 14.038 -8.561 96 H LYS 20 H LYS 20 100.211 12.204 -6.219 97 HA LYS 20 HA LYS 20 101.081 9.933 -4.587 98 HB2 LYS 20 HB2 LYS 20 101.184 10.570 -7.555 99 HG2 LYS 20 HG2 LYS 20 99.255 8.952 -5.863 100 HD2 LYS 20 HD2 LYS 20 99.440 9.353 -8.863 101 HE2 LYS 20 HE2 LYS 20 97.192 8.581 -7.060 102 HZ1 LYS 20 HZ1 LYS 20 97.784 7.236 -9.652 103 HZ2 LYS 20 HZ2 LYS 20 96.440 6.949 -8.652 104 HZ3 LYS 20 HZ3 LYS 20 97.999 6.518 -8.130 105 H MET 21 H MET 21 103.259 9.084 -4.575 106 HA MET 21 HA MET 21 105.391 11.051 -5.354 107 HB2 MET 21 HB2 MET 21 105.116 9.364 -2.845 108 HG2 MET 21 HG2 MET 21 104.968 12.351 -3.347 109 HE1 MET 21 HE1 MET 21 104.473 13.610 0.202 110 HE2 MET 21 HE2 MET 21 103.123 12.730 -0.508 111 HE3 MET 21 HE3 MET 21 104.110 13.780 -1.521 112 H GLY 22 H GLY 22 107.584 9.950 -5.484 113 HA2 GLY 22 HA2 GLY 22 107.283 7.275 -6.776 114 H GLY 23 H GLY 23 108.925 5.579 -6.179 115 HA2 GLY 23 HA2 GLY 23 110.279 6.054 -3.581 116 H PHE 24 H PHE 24 112.296 5.287 -3.785 117 HA PHE 24 HA PHE 24 112.822 3.031 -5.690 118 HB2 PHE 24 HB2 PHE 24 113.911 5.252 -6.077 119 HD1 PHE 24 HD1 PHE 24 114.532 3.684 -7.894 120 HD2 PHE 24 HD2 PHE 24 116.519 3.630 -4.085 121 HE1 PHE 24 HE1 PHE 24 116.364 2.326 -8.869 122 HE2 PHE 24 HE2 PHE 24 118.351 2.273 -5.060 123 HZ PHE 24 HZ PHE 24 118.274 1.621 -7.452 124 H ASN 25 H ASN 25 113.640 1.115 -4.808 125 HA ASN 25 HA ASN 25 114.646 1.214 -1.994 126 HB2 ASN 25 HB2 ASN 25 113.182 -0.653 -1.420 127 HD21 ASN 25 HD21 ASN 25 111.550 -2.243 -2.112 128 HD22 ASN 25 HD22 ASN 25 111.397 -2.676 -3.746 129 H LEU 26 H LEU 26 116.496 0.090 -1.745 130 HA LEU 26 HA LEU 26 117.159 -2.083 -3.728 131 HB2 LEU 26 HB2 LEU 26 118.474 0.052 -3.935 132 HG LEU 26 HG LEU 26 119.884 -2.449 -2.978 133 HD11 LEU 26 HD11 LEU 26 120.422 -2.462 -5.508 134 HD12 LEU 26 HD12 LEU 26 119.147 -1.251 -5.648 135 HD13 LEU 26 HD13 LEU 26 118.772 -2.858 -5.027 136 HD21 LEU 26 HD21 LEU 26 120.968 0.198 -3.896 137 HD22 LEU 26 HD22 LEU 26 121.821 -1.279 -4.342 138 HD23 LEU 26 HD23 LEU 26 121.579 -0.882 -2.641 139 H LYS 27 H LYS 27 117.423 -4.117 -2.654 140 HA LYS 27 HA LYS 27 118.004 -3.960 0.276 141 HB2 LYS 27 HB2 LYS 27 116.191 -5.886 -1.209 142 HG2 LYS 27 HG2 LYS 27 115.523 -3.409 0.407 143 HD2 LYS 27 HD2 LYS 27 113.781 -5.614 -0.729 144 HE2 LYS 27 HE2 LYS 27 112.416 -3.498 0.764 145 HZ1 LYS 27 HZ1 LYS 27 110.912 -3.881 -1.037 146 HZ2 LYS 27 HZ2 LYS 27 111.578 -5.387 -0.616 147 HZ3 LYS 27 HZ3 LYS 27 112.131 -4.567 -1.998 148 H TYR 28 H TYR 28 119.398 -5.510 1.084 149 HA TYR 28 HA TYR 28 120.722 -7.343 -0.894 150 HB2 TYR 28 HB2 TYR 28 121.676 -6.066 1.694 151 HD1 TYR 28 HD2 TYR 28 123.334 -6.523 -1.590 152 HD2 TYR 28 HD1 TYR 28 121.328 -3.778 1.035 153 HE1 TYR 28 HE2 TYR 28 124.040 -4.631 -3.030 154 HE2 TYR 28 HE1 TYR 28 122.034 -1.885 -0.405 155 HH TYR 28 HH TYR 28 123.399 -2.362 -3.527 156 H ARG 29 H ARG 29 120.784 -9.573 -0.354 157 HA ARG 29 HA ARG 29 119.453 -10.313 2.238 158 HB2 ARG 29 HB2 ARG 29 118.096 -10.640 0.176 159 HG2 ARG 29 HG2 ARG 29 119.034 -13.247 1.421 160 HD2 ARG 29 HD2 ARG 29 116.613 -13.883 0.965 161 HE ARG 29 HE ARG 29 118.509 -13.323 -1.294 162 HH11 ARG 29 HH11 ARG 29 117.776 -15.659 0.912 163 HH12 ARG 29 HH12 ARG 29 117.454 -16.924 -0.227 164 HH21 ARG 29 HH21 ARG 29 117.471 -14.812 -2.978 165 HH22 ARG 29 HH22 ARG 29 117.282 -16.444 -2.429 166 H TYR 30 H TYR 30 120.439 -11.824 3.473 167 HA TYR 30 HA TYR 30 122.842 -13.252 2.377 168 HB2 TYR 30 HB2 TYR 30 122.284 -12.147 5.155 169 HD1 TYR 30 HD1 TYR 30 125.249 -12.081 2.902 170 HD2 TYR 30 HD2 TYR 30 122.041 -9.830 4.660 171 HE1 TYR 30 HE1 TYR 30 126.266 -9.980 2.067 172 HE2 TYR 30 HE2 TYR 30 123.057 -7.729 3.825 173 HH TYR 30 HH TYR 30 125.890 -7.219 3.103 174 H GLU 31 H GLU 31 122.830 -15.501 2.752 175 HA GLU 31 HA GLU 31 120.783 -16.594 4.634 176 HB2 GLU 31 HB2 GLU 31 119.885 -16.435 2.302 177 HG2 GLU 31 HG2 GLU 31 120.439 -19.229 3.351 178 H GLU 32 H GLU 32 121.359 -18.683 5.474 179 HA GLU 32 HA GLU 32 124.208 -19.446 4.992 180 HB2 GLU 32 HB2 GLU 32 122.267 -20.017 7.260 181 HG2 GLU 32 HG2 GLU 32 124.635 -18.130 7.036 182 H ASP 33 H ASP 33 124.645 -21.454 4.150 183 HA ASP 33 HA ASP 33 122.640 -23.014 2.850 184 HB2 ASP 33 HB2 ASP 33 125.473 -23.614 3.751 185 H ASN 34 H ASN 34 123.815 -23.062 6.143 186 HA ASN 34 HA ASN 34 123.211 -25.751 6.874 187 HB2 ASN 34 HB2 ASN 34 123.113 -23.142 8.420 188 HD21 ASN 34 HD21 ASN 34 125.224 -22.873 9.657 189 HD22 ASN 34 HD22 ASN 34 126.646 -23.502 8.977 190 H SER 35 H SER 35 121.128 -22.828 6.944 191 HA SER 35 HA SER 35 118.750 -24.642 7.004 192 HB2 SER 35 HB2 SER 35 119.588 -22.476 8.914 193 HG SER 35 HG SER 35 119.844 -24.296 9.920 194 HA PRO 36 HA PRO 36 117.099 -21.632 4.221 195 HB2 PRO 36 HB2 PRO 36 114.423 -21.755 4.743 196 HG2 PRO 36 HG2 PRO 36 114.275 -22.901 6.694 197 HD2 PRO 36 HD2 PRO 36 116.205 -23.337 7.775 198 H LEU 37 H LEU 37 118.065 -20.390 6.653 199 HA LEU 37 HA LEU 37 115.989 -18.447 7.483 200 HB2 LEU 37 HB2 LEU 37 117.661 -19.603 9.014 201 HG LEU 37 HG LEU 37 116.465 -17.273 9.335 202 HD11 LEU 37 HD11 LEU 37 118.850 -17.614 11.108 203 HD12 LEU 37 HD12 LEU 37 117.694 -18.942 11.011 204 HD13 LEU 37 HD13 LEU 37 117.160 -17.346 11.541 205 HD21 LEU 37 HD21 LEU 37 118.493 -15.648 9.899 206 HD22 LEU 37 HD22 LEU 37 117.823 -15.720 8.270 207 HD23 LEU 37 HD23 LEU 37 119.304 -16.596 8.654 208 H GLY 38 H GLY 38 115.716 -16.629 6.281 209 HA2 GLY 38 HA2 GLY 38 118.134 -15.441 4.970 210 H VAL 39 H VAL 39 118.426 -13.288 5.304 211 HA VAL 39 HA VAL 39 116.180 -11.697 6.496 212 HB VAL 39 HB VAL 39 117.786 -12.457 8.227 213 HG11 VAL 39 HG11 VAL 39 119.846 -10.971 6.565 214 HG12 VAL 39 HG12 VAL 39 119.737 -12.726 6.713 215 HG13 VAL 39 HG13 VAL 39 120.133 -11.746 8.124 216 HG21 VAL 39 HG21 VAL 39 117.872 -10.413 9.282 217 HG22 VAL 39 HG22 VAL 39 116.816 -9.964 7.943 218 HG23 VAL 39 HG23 VAL 39 118.539 -9.595 7.868 219 H ILE 40 H ILE 40 115.961 -9.651 5.469 220 HA ILE 40 HA ILE 40 118.158 -8.899 3.572 221 HB ILE 40 HB ILE 40 115.148 -8.588 3.312 222 HG12 ILE 40 HG12 ILE 40 117.005 -10.450 1.810 223 HG21 ILE 40 HG21 ILE 40 117.277 -8.251 1.190 224 HG22 ILE 40 HG22 ILE 40 116.668 -6.900 2.147 225 HG23 ILE 40 HG23 ILE 40 115.574 -7.802 1.097 226 HD11 ILE 40 HD11 ILE 40 114.782 -9.574 0.813 227 HD12 ILE 40 HD12 ILE 40 114.001 -10.582 2.031 228 HD13 ILE 40 HD13 ILE 40 115.044 -11.317 0.816 229 H GLY 41 H GLY 41 118.740 -6.725 3.535 230 HA2 GLY 41 HA2 GLY 41 117.438 -4.946 5.552 231 H SER 42 H SER 42 116.452 -2.994 4.777 232 HA SER 42 HA SER 42 116.602 -2.563 1.813 233 HB2 SER 42 HB2 SER 42 114.640 -3.903 2.357 234 HG SER 42 HG SER 42 113.287 -1.590 2.065 235 H PHE 43 H PHE 43 116.549 -0.440 1.146 236 HA PHE 43 HA PHE 43 116.076 1.668 3.237 237 HB2 PHE 43 HB2 PHE 43 118.051 1.562 0.925 238 HD1 PHE 43 HD2 PHE 43 118.401 2.793 4.404 239 HD2 PHE 43 HD1 PHE 43 119.254 -0.393 1.653 240 HE1 PHE 43 HE2 PHE 43 119.962 1.790 6.050 241 HE2 PHE 43 HE1 PHE 43 120.814 -1.397 3.299 242 HZ PHE 43 HZ PHE 43 121.168 -0.305 5.498 243 H THR 44 H THR 44 114.507 3.197 2.582 244 HA THR 44 HA THR 44 113.748 3.152 -0.326 245 HB THR 44 HB THR 44 111.916 3.279 2.090 246 HG1 THR 44 HG1 THR 44 111.715 1.180 1.891 247 HG21 THR 44 HG21 THR 44 111.107 4.404 0.002 248 HG22 THR 44 HG22 THR 44 110.122 3.021 0.476 249 HG23 THR 44 HG23 THR 44 111.282 2.866 -0.844 250 H TYR 45 H TYR 45 113.450 5.197 -1.228 251 HA TYR 45 HA TYR 45 113.305 7.523 0.640 252 HB2 TYR 45 HB2 TYR 45 114.880 7.233 -1.948 253 HD1 TYR 45 HD2 TYR 45 115.975 8.702 1.252 254 HD2 TYR 45 HD1 TYR 45 116.086 5.224 -1.267 255 HE1 TYR 45 HE2 TYR 45 117.827 7.771 2.616 256 HE2 TYR 45 HE1 TYR 45 117.937 4.296 0.096 257 HH TYR 45 HH TYR 45 119.848 5.565 1.708 258 H THR 46 H THR 46 111.219 8.246 0.262 259 HA THR 46 HA THR 46 110.256 8.313 -2.574 260 HB THR 46 HB THR 46 108.763 8.179 0.068 261 HG1 THR 46 HG1 THR 46 109.157 6.151 -0.175 262 HG21 THR 46 HG21 THR 46 107.312 7.515 -2.386 263 HG22 THR 46 HG22 THR 46 107.831 9.199 -2.328 264 HG23 THR 46 HG23 THR 46 106.827 8.541 -1.037 265 H GLU 47 H GLU 47 109.556 10.344 -3.402 266 HA GLU 47 HA GLU 47 109.433 12.612 -1.455 267 HB2 GLU 47 HB2 GLU 47 111.032 12.480 -4.035 268 HG2 GLU 47 HG2 GLU 47 111.902 12.556 -1.127 269 H LYS 48 H LYS 48 108.401 14.550 -2.470 270 HA LYS 48 HA LYS 48 106.053 13.837 -4.032 271 HB2 LYS 48 HB2 LYS 48 106.161 15.598 -2.270 272 HG2 LYS 48 HG2 LYS 48 105.491 16.575 -5.065 273 HD2 LYS 48 HD2 LYS 48 104.602 17.598 -2.349 274 HE2 LYS 48 HE2 LYS 48 103.246 17.640 -4.827 275 HZ1 LYS 48 HZ1 LYS 48 104.575 20.222 -4.154 276 HZ2 LYS 48 HZ2 LYS 48 103.428 19.995 -5.387 277 HZ3 LYS 48 HZ3 LYS 48 104.949 19.244 -5.490 278 H SER 49 H SER 49 105.793 14.002 -6.250 279 HA SER 49 HA SER 49 108.140 14.541 -7.916 280 HB2 SER 49 HB2 SER 49 106.703 13.754 -9.670 281 HG SER 49 HG SER 49 104.561 13.935 -9.593 282 H ARG 50 H ARG 50 108.416 16.336 -9.292 283 HA ARG 50 HA ARG 50 106.351 18.487 -9.257 284 HB2 ARG 50 HB2 ARG 50 109.267 18.755 -8.446 285 HG2 ARG 50 HG2 ARG 50 106.665 19.065 -6.917 286 HD2 ARG 50 HD2 ARG 50 109.539 19.690 -6.148 287 HE ARG 50 HE ARG 50 108.128 18.374 -4.412 288 HH11 ARG 50 HH21 ARG 50 106.502 21.184 -5.009 289 HH12 ARG 50 HH22 ARG 50 106.550 21.795 -3.390 290 HH21 ARG 50 HH11 ARG 50 108.798 19.403 -2.272 291 HH22 ARG 50 HH12 ARG 50 107.850 20.787 -1.839 292 H THR 51 H THR 51 106.800 20.128 -10.970 293 HA THR 51 HA THR 51 107.483 19.028 -13.495 294 HB THR 51 HB THR 51 107.656 21.915 -12.567 295 HG1 THR 51 HG1 THR 51 105.489 21.985 -12.922 296 HG21 THR 51 HG21 THR 51 108.400 20.969 -14.970 297 HG22 THR 51 HG22 THR 51 107.600 22.529 -14.778 298 HG23 THR 51 HG23 THR 51 106.666 21.112 -15.256 299 H ALA 52 H ALA 52 109.465 20.821 -11.152 300 HA ALA 52 HA ALA 52 111.797 21.185 -11.042 301 HB1 ALA 52 HB1 ALA 52 112.886 18.998 -12.268 302 HB2 ALA 52 HB2 ALA 52 111.232 18.446 -12.007 303 HB3 ALA 52 HB3 ALA 52 112.211 18.976 -10.639 304 H SER 53 H SER 53 110.334 22.173 -13.514 305 HA SER 53 HA SER 53 111.900 21.788 -15.868 306 HB2 SER 53 HB2 SER 53 110.754 23.808 -16.614 307 HG SER 53 HG SER 53 109.703 25.111 -15.085 308 H SER 54 H SER 54 112.269 24.036 -13.140 309 HA SER 54 HA SER 54 114.541 25.443 -14.349 310 HB2 SER 54 HB2 SER 54 114.517 26.631 -12.213 311 HG SER 54 HG SER 54 112.460 25.220 -11.122 312 H GLY 55 H GLY 55 114.046 22.667 -12.275 313 HA2 GLY 55 HA2 GLY 55 116.536 21.493 -12.586 314 H ASP 56 H ASP 56 117.145 20.114 -10.489 315 HA ASP 56 HA ASP 56 114.633 18.798 -9.649 316 HB2 ASP 56 HB2 ASP 56 116.616 17.582 -10.563 317 H TYR 57 H TYR 57 113.719 19.242 -7.680 318 HA TYR 57 HA TYR 57 115.425 20.539 -5.581 319 HB2 TYR 57 HB2 TYR 57 112.445 20.595 -6.156 320 HD1 TYR 57 HD1 TYR 57 114.894 23.209 -5.160 321 HD2 TYR 57 HD2 TYR 57 112.553 21.541 -8.353 322 HE1 TYR 57 HE1 TYR 57 115.451 25.158 -6.586 323 HE2 TYR 57 HE2 TYR 57 113.112 23.492 -9.780 324 HH TYR 57 HH TYR 57 115.585 25.592 -9.132 325 H ASN 58 H ASN 58 115.542 19.569 -3.566 326 HA ASN 58 HA ASN 58 113.928 17.077 -3.138 327 HB2 ASN 58 HB2 ASN 58 115.930 16.146 -2.087 328 HD21 ASN 58 HD21 ASN 58 118.379 16.476 -1.735 329 HD22 ASN 58 HD22 ASN 58 118.901 18.019 -1.257 330 H LYS 59 H LYS 59 113.073 19.656 -2.259 331 HA LYS 59 HA LYS 59 113.761 20.592 0.265 332 HB2 LYS 59 HB2 LYS 59 111.029 20.150 -0.978 333 HG2 LYS 59 HG2 LYS 59 112.941 22.506 -0.917 334 HD2 LYS 59 HD2 LYS 59 110.130 22.240 -2.027 335 HE2 LYS 59 HE2 LYS 59 112.389 24.012 -2.730 336 HZ1 LYS 59 HZ1 LYS 59 111.019 25.979 -2.693 337 HZ2 LYS 59 HZ2 LYS 59 111.043 25.312 -1.131 338 HZ3 LYS 59 HZ3 LYS 59 109.683 25.101 -2.127 339 H ASN 60 H ASN 60 110.886 18.463 0.057 340 HA ASN 60 HA ASN 60 111.719 17.269 2.668 341 HB2 ASN 60 HB2 ASN 60 109.319 16.845 2.935 342 HD21 ASN 60 HD21 ASN 60 107.083 17.139 1.991 343 HD22 ASN 60 HD22 ASN 60 106.878 17.027 0.309 344 H GLN 61 H GLN 61 111.776 14.997 2.904 345 HA GLN 61 HA GLN 61 111.159 13.333 0.507 346 HB2 GLN 61 HB2 GLN 61 113.402 12.326 0.625 347 HG2 GLN 61 HG2 GLN 61 113.759 14.270 2.922 348 HE21 GLN 61 HE21 GLN 61 116.115 12.263 3.474 349 HE22 GLN 61 HE22 GLN 61 117.367 12.875 2.504 350 H TYR 62 H TYR 62 111.198 10.958 1.080 351 HA TYR 62 HA TYR 62 110.395 10.580 3.939 352 HB2 TYR 62 HB2 TYR 62 109.504 9.412 1.315 353 HD1 TYR 62 HD1 TYR 62 107.858 9.809 4.624 354 HD2 TYR 62 HD2 TYR 62 108.298 11.364 0.645 355 HE1 TYR 62 HE1 TYR 62 105.956 11.350 5.017 356 HE2 TYR 62 HE2 TYR 62 106.397 12.906 1.038 357 HH TYR 62 HH TYR 62 105.159 13.556 4.091 358 H TYR 63 H TYR 63 111.961 9.599 5.028 359 HA TYR 63 HA TYR 63 113.786 7.633 3.699 360 HB2 TYR 63 HB2 TYR 63 114.649 9.544 5.081 361 HD1 TYR 63 HD2 TYR 63 116.516 8.316 3.990 362 HD2 TYR 63 HD1 TYR 63 114.699 6.920 7.622 363 HE1 TYR 63 HE2 TYR 63 118.453 6.817 4.382 364 HE2 TYR 63 HE1 TYR 63 116.635 5.421 8.015 365 HH TYR 63 HH TYR 63 118.957 5.215 7.380 366 H GLY 64 H GLY 64 113.849 5.379 4.432 367 HA2 GLY 64 HA2 GLY 64 112.080 4.710 6.684 368 H ILE 65 H ILE 65 112.961 3.136 7.841 369 HA ILE 65 HA ILE 65 115.212 1.533 6.677 370 HB ILE 65 HB ILE 65 114.220 1.908 9.533 371 HG12 ILE 65 HG12 ILE 65 116.622 3.145 8.149 372 HG21 ILE 65 HG21 ILE 65 116.481 0.395 8.277 373 HG22 ILE 65 HG22 ILE 65 115.452 -0.056 9.638 374 HG23 ILE 65 HG23 ILE 65 116.736 1.134 9.859 375 HD11 ILE 65 HD11 ILE 65 115.554 3.086 10.932 376 HD12 ILE 65 HD12 ILE 65 116.202 4.623 10.358 377 HD13 ILE 65 HD13 ILE 65 117.222 3.185 10.371 378 H THR 66 H THR 66 114.855 -0.735 6.344 379 HA THR 66 HA THR 66 112.538 -1.953 7.706 380 HB THR 66 HB THR 66 112.791 -1.754 4.694 381 HG1 THR 66 HG1 THR 66 112.095 0.178 5.412 382 HG21 THR 66 HG21 THR 66 110.242 -2.568 5.927 383 HG22 THR 66 HG22 THR 66 111.552 -3.732 6.133 384 HG23 THR 66 HG23 THR 66 111.070 -3.222 4.515 385 H ALA 67 H ALA 67 112.741 -4.169 7.956 386 HA ALA 67 HA ALA 67 114.771 -5.646 6.367 387 HB1 ALA 67 HB1 ALA 67 114.746 -5.051 9.316 388 HB2 ALA 67 HB2 ALA 67 116.116 -5.092 8.205 389 HB3 ALA 67 HB3 ALA 67 115.392 -6.599 8.770 390 H GLY 68 H GLY 68 114.208 -7.931 6.269 391 HA2 GLY 68 HA2 GLY 68 111.963 -8.904 7.895 392 HA PRO 69 HA PRO 69 113.909 -12.748 7.111 393 HB2 PRO 69 HB2 PRO 69 111.817 -14.492 7.337 394 HG2 PRO 69 HG2 PRO 69 110.023 -13.071 7.247 395 HD2 PRO 69 HD2 PRO 69 110.312 -10.813 7.208 396 H ALA 70 H ALA 70 113.905 -14.641 5.590 397 HA ALA 70 HA ALA 70 112.234 -14.282 3.141 398 HB1 ALA 70 HB1 ALA 70 115.147 -14.847 2.817 399 HB2 ALA 70 HB2 ALA 70 114.701 -13.210 3.294 400 HB3 ALA 70 HB3 ALA 70 114.070 -13.894 1.796 401 H TYR 71 H TYR 71 111.640 -16.259 2.265 402 HA TYR 71 HA TYR 71 112.987 -18.713 3.360 403 HB2 TYR 71 HB2 TYR 71 110.067 -18.189 2.713 404 HD1 TYR 71 HD2 TYR 71 111.770 -19.820 5.588 405 HD2 TYR 71 HD1 TYR 71 109.665 -16.348 4.184 406 HE1 TYR 71 HE2 TYR 71 111.592 -18.986 7.917 407 HE2 TYR 71 HE1 TYR 71 109.487 -15.514 6.513 408 HH TYR 71 HH TYR 71 111.040 -16.000 8.761 409 H ARG 72 H ARG 72 113.388 -20.365 1.885 410 HA ARG 72 HA ARG 72 112.833 -19.748 -0.999 411 HB2 ARG 72 HB2 ARG 72 115.208 -19.884 -0.189 412 HG2 ARG 72 HG2 ARG 72 114.315 -22.083 -2.081 413 HD2 ARG 72 HD2 ARG 72 117.016 -20.739 -1.688 414 HE ARG 72 HE ARG 72 116.643 -21.121 -4.083 415 HH11 ARG 72 HH11 ARG 72 118.611 -23.274 -3.392 416 HH12 ARG 72 HH12 ARG 72 117.873 -24.677 -4.091 417 HH21 ARG 72 HH21 ARG 72 114.754 -23.199 -4.419 418 HH22 ARG 72 HH22 ARG 72 115.690 -24.634 -4.673 419 H ILE 73 H ILE 73 111.200 -21.010 -1.843 420 HA ILE 73 HA ILE 73 110.555 -23.589 -0.499 421 HB ILE 73 HB ILE 73 109.077 -21.875 -2.525 422 HG12 ILE 73 HG12 ILE 73 109.292 -20.791 -0.338 423 HG21 ILE 73 HG21 ILE 73 108.379 -24.194 -2.734 424 HG22 ILE 73 HG22 ILE 73 107.122 -23.303 -1.875 425 HG23 ILE 73 HG23 ILE 73 108.230 -24.345 -0.983 426 HD11 ILE 73 HD11 ILE 73 109.771 -22.580 1.155 427 HD12 ILE 73 HD12 ILE 73 108.330 -23.473 0.669 428 HD13 ILE 73 HD13 ILE 73 108.174 -22.008 1.636 429 H ASN 74 H ASN 74 109.871 -22.914 -3.913 430 HA ASN 74 HA ASN 74 111.979 -24.785 -4.822 431 HB2 ASN 74 HB2 ASN 74 108.991 -25.294 -4.983 432 HD21 ASN 74 HD21 ASN 74 112.164 -26.859 -4.201 433 HD22 ASN 74 HD22 ASN 74 111.603 -27.610 -2.786 434 H ASP 75 H ASP 75 111.717 -25.069 -7.310 435 HA ASP 75 HA ASP 75 111.724 -24.024 -9.428 436 HB2 ASP 75 HB2 ASP 75 109.199 -22.913 -8.164 437 H TRP 76 H TRP 76 113.382 -22.716 -7.538 438 HA TRP 76 HA TRP 76 114.453 -20.647 -7.133 439 HB2 TRP 76 HB2 TRP 76 113.183 -20.196 -9.852 440 HD1 TRP 76 HD1 TRP 76 113.857 -22.304 -11.122 441 HE1 TRP 76 HE1 TRP 76 116.047 -23.622 -11.451 442 HE3 TRP 76 HE3 TRP 76 116.870 -19.851 -7.807 443 HZ2 TRP 76 HZ2 TRP 76 118.723 -23.636 -10.442 444 HZ3 TRP 76 HZ3 TRP 76 119.232 -20.538 -7.510 445 HH2 TRP 76 HH2 TRP 76 120.162 -22.425 -8.822 446 H ALA 77 H ALA 77 111.492 -20.950 -6.364 447 HA ALA 77 HA ALA 77 110.483 -18.177 -6.623 448 HB1 ALA 77 HB1 ALA 77 108.990 -20.109 -6.917 449 HB2 ALA 77 HB2 ALA 77 108.505 -19.194 -5.490 450 HB3 ALA 77 HB3 ALA 77 109.409 -20.697 -5.308 451 H SER 78 H SER 78 110.780 -16.670 -5.017 452 HA SER 78 HA SER 78 111.662 -17.658 -2.318 453 HB2 SER 78 HB2 SER 78 112.499 -15.187 -3.869 454 HG SER 78 HG SER 78 114.371 -16.279 -4.205 455 H ILE 79 H ILE 79 110.881 -16.436 -0.502 456 HA ILE 79 HA ILE 79 108.616 -14.567 -1.138 457 HB ILE 79 HB ILE 79 109.011 -16.479 1.192 458 HG12 ILE 79 HG12 ILE 79 107.078 -16.635 -1.144 459 HG21 ILE 79 HG21 ILE 79 107.684 -14.415 1.693 460 HG22 ILE 79 HG22 ILE 79 106.729 -15.893 1.804 461 HG23 ILE 79 HG23 ILE 79 106.581 -14.854 0.387 462 HD11 ILE 79 HD11 ILE 79 106.196 -18.508 -0.142 463 HD12 ILE 79 HD12 ILE 79 106.724 -17.671 1.319 464 HD13 ILE 79 HD13 ILE 79 107.725 -18.946 0.622 465 H TYR 80 H TYR 80 108.718 -12.561 -0.124 466 HA TYR 80 HA TYR 80 110.859 -12.188 1.945 467 HB2 TYR 80 HB2 TYR 80 110.072 -10.388 -0.368 468 HD1 TYR 80 HD1 TYR 80 112.904 -12.285 1.219 469 HD2 TYR 80 HD2 TYR 80 110.969 -11.044 -2.409 470 HE1 TYR 80 HE1 TYR 80 114.573 -13.552 -0.105 471 HE2 TYR 80 HE2 TYR 80 112.638 -12.312 -3.734 472 HH TYR 80 HH TYR 80 115.506 -13.577 -2.345 473 H GLY 81 H GLY 81 110.392 -10.677 3.575 474 HA2 GLY 81 HA2 GLY 81 107.623 -9.543 3.594 475 H VAL 82 H VAL 82 107.529 -7.480 4.905 476 HA VAL 82 HA VAL 82 110.210 -6.262 5.362 477 HB VAL 82 HB VAL 82 109.474 -4.290 4.016 478 HG11 VAL 82 HG11 VAL 82 109.917 -5.312 1.882 479 HG12 VAL 82 HG12 VAL 82 109.326 -6.876 2.445 480 HG13 VAL 82 HG13 VAL 82 110.830 -6.217 3.090 481 HG21 VAL 82 HG21 VAL 82 107.347 -4.096 3.283 482 HG22 VAL 82 HG22 VAL 82 106.949 -5.540 4.211 483 HG23 VAL 82 HG23 VAL 82 107.412 -5.682 2.517 484 H VAL 83 H VAL 83 110.267 -4.976 7.095 485 HA VAL 83 HA VAL 83 107.746 -3.808 8.215 486 HB VAL 83 HB VAL 83 109.980 -5.232 9.723 487 HG11 VAL 83 HG11 VAL 83 108.092 -5.032 11.551 488 HG12 VAL 83 HG12 VAL 83 107.538 -3.691 10.548 489 HG13 VAL 83 HG13 VAL 83 109.160 -3.663 11.240 490 HG21 VAL 83 HG21 VAL 83 108.093 -6.852 10.268 491 HG22 VAL 83 HG22 VAL 83 108.648 -6.889 8.594 492 HG23 VAL 83 HG23 VAL 83 107.151 -6.053 9.008 493 H GLY 84 H GLY 84 108.197 -1.637 9.101 494 HA2 GLY 84 HA2 GLY 84 110.805 -0.737 9.713 495 H VAL 85 H VAL 85 110.914 1.748 9.250 496 HA VAL 85 HA VAL 85 108.317 2.961 10.115 497 HB VAL 85 HB VAL 85 111.166 3.651 10.911 498 HG11 VAL 85 HG11 VAL 85 109.835 5.631 11.057 499 HG12 VAL 85 HG12 VAL 85 109.904 4.981 12.694 500 HG13 VAL 85 HG13 VAL 85 108.459 4.742 11.710 501 HG21 VAL 85 HG21 VAL 85 110.691 1.621 12.009 502 HG22 VAL 85 HG22 VAL 85 108.981 2.013 12.193 503 HG23 VAL 85 HG23 VAL 85 110.185 2.830 13.188 504 H GLY 86 H GLY 86 107.782 4.896 9.229 505 HA2 GLY 86 HA2 GLY 86 109.341 5.782 6.832 506 H TYR 87 H TYR 87 110.340 7.818 6.776 507 HA TYR 87 HA TYR 87 109.790 9.631 9.108 508 HB2 TYR 87 HB2 TYR 87 112.395 8.811 7.795 509 HD1 TYR 87 HD2 TYR 87 111.390 9.657 11.279 510 HD2 TYR 87 HD1 TYR 87 112.466 6.547 8.518 511 HE1 TYR 87 HE2 TYR 87 111.523 8.039 13.155 512 HE2 TYR 87 HE1 TYR 87 112.601 4.929 10.394 513 HH TYR 87 HH TYR 87 112.604 5.906 13.666 514 H GLY 88 H GLY 88 109.332 11.717 8.499 515 HA2 GLY 88 HA2 GLY 88 110.042 12.532 5.707 516 H LYS 89 H LYS 89 111.286 14.353 5.628 517 HA LYS 89 HA LYS 89 111.196 16.222 7.967 518 HB2 LYS 89 HB2 LYS 89 113.649 16.299 7.892 519 HG2 LYS 89 HG2 LYS 89 113.330 14.320 5.613 520 HD2 LYS 89 HD2 LYS 89 115.740 15.200 7.222 521 HE2 LYS 89 HE2 LYS 89 115.516 14.226 4.393 522 HZ1 LYS 89 HZ1 LYS 89 116.497 12.423 5.687 523 HZ2 LYS 89 HZ2 LYS 89 117.634 13.492 6.358 524 HZ3 LYS 89 HZ3 LYS 89 117.671 13.140 4.695 525 H PHE 90 H PHE 90 111.652 18.417 7.441 526 HA PHE 90 HA PHE 90 112.083 19.115 4.582 527 HB2 PHE 90 HB2 PHE 90 110.070 20.560 4.634 528 HD1 PHE 90 HD2 PHE 90 109.127 18.102 7.241 529 HD2 PHE 90 HD1 PHE 90 109.832 22.243 6.344 530 HE1 PHE 90 HE2 PHE 90 108.111 18.745 9.409 531 HE2 PHE 90 HE1 PHE 90 108.817 22.886 8.514 532 HZ PHE 90 HZ PHE 90 107.957 21.137 10.047 533 H GLN 91 H GLN 91 112.017 21.723 4.535 534 HA GLN 91 HA GLN 91 113.161 23.691 5.180 535 HB2 GLN 91 HB2 GLN 91 111.333 23.446 6.882 536 HG2 GLN 91 HG2 GLN 91 113.904 24.556 8.045 537 HE21 GLN 91 HE21 GLN 91 113.196 24.489 10.243 538 HE22 GLN 91 HE22 GLN 91 111.789 25.268 10.786 539 H THR 92 H THR 92 115.091 24.490 6.524 540 HA THR 92 HA THR 92 117.030 22.262 7.045 541 HB THR 92 HB THR 92 117.316 23.436 4.850 542 HG1 THR 92 HG1 THR 92 119.549 23.998 5.279 543 HG21 THR 92 HG21 THR 92 118.470 25.868 5.895 544 HG22 THR 92 HG22 THR 92 116.787 25.733 6.406 545 HG23 THR 92 HG23 THR 92 117.196 25.675 4.691 546 H THR 93 H THR 93 118.946 23.110 8.392 547 HA THR 93 HA THR 93 119.715 24.054 10.417 548 HB THR 93 HB THR 93 117.863 26.360 9.822 549 HG1 THR 93 HG1 THR 93 118.866 26.763 8.024 550 HG21 THR 93 HG21 THR 93 120.522 25.921 11.120 551 HG22 THR 93 HG22 THR 93 119.167 26.915 11.652 552 HG23 THR 93 HG23 THR 93 120.212 27.476 10.347 553 H GLU 94 H GLU 94 118.731 25.180 12.543 554 HA GLU 94 HA GLU 94 117.315 24.852 14.406 555 HB2 GLU 94 HB2 GLU 94 115.322 24.824 12.114 556 HG2 GLU 94 HG2 GLU 94 116.389 27.061 13.866 557 H TYR 95 H TYR 95 118.567 22.496 13.650 558 HA TYR 95 HA TYR 95 116.824 20.296 13.058 559 HB2 TYR 95 HB2 TYR 95 119.382 20.507 12.963 560 HD1 TYR 95 HD2 TYR 95 118.488 18.772 11.399 561 HD2 TYR 95 HD1 TYR 95 118.921 18.045 15.611 562 HE1 TYR 95 HE2 TYR 95 118.295 16.333 10.998 563 HE2 TYR 95 HE1 TYR 95 118.728 15.606 15.210 564 HH TYR 95 HH TYR 95 117.489 14.192 13.048 565 HA PRO 96 HA PRO 96 114.858 20.164 17.088 566 HB2 PRO 96 HB2 PRO 96 113.348 17.926 16.651 567 HG2 PRO 96 HG2 PRO 96 114.207 17.216 14.640 568 HD2 PRO 96 HD2 PRO 96 115.660 18.502 13.432 569 H THR 97 H THR 97 114.787 18.562 18.914 570 HA THR 97 HA THR 97 117.266 17.262 19.395 571 HB THR 97 HB THR 97 115.676 17.977 21.130 572 HG1 THR 97 HG1 THR 97 116.536 16.462 22.266 573 HG21 THR 97 HG21 THR 97 113.645 16.465 21.503 574 HG22 THR 97 HG22 THR 97 113.927 15.858 19.870 575 HG23 THR 97 HG23 THR 97 113.554 17.563 20.125 576 H TYR 98 H TYR 98 116.934 14.699 20.185 577 HA TYR 98 HA TYR 98 117.056 13.131 17.832 578 HB2 TYR 98 HB2 TYR 98 117.919 12.552 20.099 579 HD1 TYR 98 HD1 TYR 98 118.904 11.062 18.362 580 HD2 TYR 98 HD2 TYR 98 115.015 10.337 20.035 581 HE1 TYR 98 HE1 TYR 98 118.957 8.745 17.479 582 HE2 TYR 98 HE2 TYR 98 115.066 8.020 19.152 583 HH TYR 98 HH TYR 98 117.189 6.989 16.820 584 H LYS 99 H LYS 99 114.298 13.621 20.065 585 HA LYS 99 HA LYS 99 112.427 11.855 18.944 586 HB2 LYS 99 HB2 LYS 99 112.191 13.231 21.008 587 HG2 LYS 99 HG2 LYS 99 109.769 13.932 20.556 588 HD2 LYS 99 HD2 LYS 99 110.618 11.159 19.658 589 HE2 LYS 99 HE2 LYS 99 108.313 10.845 21.068 590 HZ1 LYS 99 HZ1 LYS 99 108.977 10.038 18.865 591 HZ2 LYS 99 HZ2 LYS 99 108.630 11.559 18.191 592 HZ3 LYS 99 HZ3 LYS 99 107.381 10.612 18.846 593 H ASN 100 H ASN 100 113.430 15.046 17.775 594 HA ASN 100 HA ASN 100 112.950 16.181 15.765 595 HB2 ASN 100 HB2 ASN 100 112.352 13.322 14.936 596 HD21 ASN 100 HD21 ASN 100 114.254 12.083 14.552 597 HD22 ASN 100 HD22 ASN 100 115.823 12.672 14.826 598 H ASP 101 H ASP 101 110.873 16.506 17.498 599 HA ASP 101 HA ASP 101 108.303 15.548 16.841 600 HB2 ASP 101 HB2 ASP 101 109.269 18.267 17.785 601 H THR 102 H THR 102 110.200 18.130 15.322 602 HA THR 102 HA THR 102 108.209 19.262 13.632 603 HB THR 102 HB THR 102 111.171 18.836 13.112 604 HG1 THR 102 HG1 THR 102 111.503 20.337 14.543 605 HG21 THR 102 HG21 THR 102 109.671 21.270 12.268 606 HG22 THR 102 HG22 THR 102 109.403 19.793 11.344 607 HG23 THR 102 HG23 THR 102 111.029 20.460 11.489 608 H SER 103 H SER 103 109.937 16.229 13.424 609 HA SER 103 HA SER 103 109.150 15.794 10.593 610 HB2 SER 103 HB2 SER 103 110.632 13.925 10.736 611 HG SER 103 HG SER 103 110.711 14.220 13.537 612 H ASP 104 H ASP 104 108.023 13.692 10.080 613 HA ASP 104 HA ASP 104 106.184 12.791 12.273 614 HB2 ASP 104 HB2 ASP 104 105.206 14.506 10.682 615 H TYR 105 H TYR 105 105.992 10.529 12.341 616 HA TYR 105 HA TYR 105 106.953 9.010 9.952 617 HB2 TYR 105 HB2 TYR 105 108.268 7.613 11.475 618 HD1 TYR 105 HD1 TYR 105 107.824 10.567 13.674 619 HD2 TYR 105 HD2 TYR 105 107.185 6.345 13.207 620 HE1 TYR 105 HE1 TYR 105 107.213 10.396 16.071 621 HE2 TYR 105 HE2 TYR 105 106.574 6.174 15.605 622 HH TYR 105 HH TYR 105 105.569 8.020 17.382 623 H GLY 106 H GLY 106 106.382 6.623 10.165 624 HA2 GLY 106 HA2 GLY 106 104.066 5.974 11.856 625 H PHE 107 H PHE 107 103.344 3.562 11.108 626 HA PHE 107 HA PHE 107 105.894 2.031 10.957 627 HB2 PHE 107 HB2 PHE 107 104.242 1.735 12.807 628 HD1 PHE 107 HD1 PHE 107 106.304 0.391 13.208 629 HD2 PHE 107 HD2 PHE 107 103.149 -0.997 10.645 630 HE1 PHE 107 HE1 PHE 107 107.224 -1.909 13.321 631 HE2 PHE 107 HE2 PHE 107 104.069 -3.297 10.759 632 HZ PHE 107 HZ PHE 107 106.107 -3.753 12.097 633 H SER 108 H SER 108 106.297 0.533 9.301 634 HA SER 108 HA SER 108 104.252 0.389 7.105 635 HB2 SER 108 HB2 SER 108 107.285 0.381 6.982 636 HG SER 108 HG SER 108 106.964 2.435 6.077 637 H TYR 109 H TYR 109 104.051 -1.672 6.062 638 HA TYR 109 HA TYR 109 105.697 -3.933 6.944 639 HB2 TYR 109 HB2 TYR 109 103.873 -5.117 8.032 640 HD1 TYR 109 HD2 TYR 109 102.393 -1.721 8.175 641 HD2 TYR 109 HD1 TYR 109 101.932 -5.748 6.756 642 HE1 TYR 109 HE2 TYR 109 100.032 -1.243 7.586 643 HE2 TYR 109 HE1 TYR 109 99.571 -5.271 6.168 644 HH TYR 109 HH TYR 109 97.802 -3.710 6.791 645 H GLY 110 H GLY 110 105.345 -5.825 5.549 646 HA2 GLY 110 HA2 GLY 110 103.250 -6.200 3.730 647 H ALA 111 H ALA 111 104.226 -7.300 1.557 648 HA ALA 111 HA ALA 111 106.758 -8.713 1.858 649 HB1 ALA 111 HB1 ALA 111 104.119 -10.103 2.444 650 HB2 ALA 111 HB2 ALA 111 105.446 -9.852 3.580 651 HB3 ALA 111 HB3 ALA 111 105.650 -10.947 2.212 652 H GLY 112 H GLY 112 107.016 -10.314 -0.058 653 HA2 GLY 112 HA2 GLY 112 104.912 -10.278 -2.078 654 H LEU 113 H LEU 113 106.302 -11.130 -4.269 655 HA LEU 113 HA LEU 113 108.058 -13.365 -3.310 656 HB2 LEU 113 HB2 LEU 113 106.762 -14.844 -4.860 657 HG LEU 113 HG LEU 113 105.894 -12.508 -5.993 658 HD11 LEU 113 HD11 LEU 113 105.680 -14.383 -7.327 659 HD12 LEU 113 HD12 LEU 113 103.987 -14.140 -6.894 660 HD13 LEU 113 HD13 LEU 113 104.951 -15.345 -6.040 661 HD21 LEU 113 HD21 LEU 113 104.433 -12.071 -4.020 662 HD22 LEU 113 HD22 LEU 113 103.597 -13.591 -4.330 663 HD23 LEU 113 HD23 LEU 113 103.503 -12.279 -5.505 664 H GLN 114 H GLN 114 109.524 -14.184 -5.011 665 HA GLN 114 HA GLN 114 109.839 -12.282 -7.302 666 HB2 GLN 114 HB2 GLN 114 111.541 -12.140 -5.474 667 HG2 GLN 114 HG2 GLN 114 112.505 -13.273 -8.120 668 HE21 GLN 114 HE21 GLN 114 114.726 -13.635 -8.126 669 HE22 GLN 114 HE22 GLN 114 115.829 -12.967 -7.022 670 H PHE 115 H PHE 115 110.193 -13.214 -9.340 671 HA PHE 115 HA PHE 115 110.110 -16.215 -9.460 672 HB2 PHE 115 HB2 PHE 115 108.081 -14.870 -10.203 673 HD1 PHE 115 HD1 PHE 115 108.041 -17.483 -9.996 674 HD2 PHE 115 HD2 PHE 115 109.245 -15.363 -13.532 675 HE1 PHE 115 HE1 PHE 115 107.607 -19.509 -11.358 676 HE2 PHE 115 HE2 PHE 115 108.815 -17.389 -14.894 677 HZ PHE 115 HZ PHE 115 107.995 -19.462 -13.806 678 H ASN 116 H ASN 116 111.279 -17.127 -11.370 679 HA ASN 116 HA ASN 116 113.572 -15.368 -12.180 680 HB2 ASN 116 HB2 ASN 116 113.282 -18.215 -11.310 681 HD21 ASN 116 HD21 ASN 116 116.384 -17.887 -11.018 682 HD22 ASN 116 HD22 ASN 116 116.537 -16.891 -9.652 683 HA PRO 117 HA PRO 117 111.335 -16.725 -16.043 684 HB2 PRO 117 HB2 PRO 117 111.133 -14.234 -17.163 685 HG2 PRO 117 HG2 PRO 117 112.057 -12.940 -15.506 686 HD2 PRO 117 HD2 PRO 117 112.567 -13.807 -13.454 687 H MET 118 H MET 118 114.193 -15.053 -15.151 688 HA MET 118 HA MET 118 115.521 -15.861 -17.662 689 HB2 MET 118 HB2 MET 118 115.553 -13.115 -16.373 690 HG2 MET 118 HG2 MET 118 114.566 -14.135 -19.049 691 HE1 MET 118 HE1 MET 118 117.079 -12.427 -19.320 692 HE2 MET 118 HE2 MET 118 116.506 -11.294 -20.540 693 HE3 MET 118 HE3 MET 118 115.989 -12.977 -20.600 694 H GLU 119 H GLU 119 117.624 -16.480 -17.262 695 HA GLU 119 HA GLU 119 118.358 -17.452 -14.716 696 HB2 GLU 119 HB2 GLU 119 119.184 -18.198 -16.940 697 HG2 GLU 119 HG2 GLU 119 121.314 -17.347 -14.952 698 H ASN 120 H ASN 120 119.757 -14.538 -16.365 699 HA ASN 120 HA ASN 120 121.195 -13.859 -13.885 700 HB2 ASN 120 HB2 ASN 120 121.018 -12.571 -16.621 701 HD21 ASN 120 HD21 ASN 120 122.983 -14.597 -14.367 702 HD22 ASN 120 HD22 ASN 120 123.748 -15.482 -15.596 703 H VAL 121 H VAL 121 118.039 -13.255 -14.786 704 HA VAL 121 HA VAL 121 117.966 -10.867 -13.023 705 HB VAL 121 HB VAL 121 118.438 -10.014 -15.281 706 HG11 VAL 121 HG11 VAL 121 117.284 -12.052 -16.372 707 HG12 VAL 121 HG12 VAL 121 117.094 -10.486 -17.164 708 HG13 VAL 121 HG13 VAL 121 115.787 -11.139 -16.175 709 HG21 VAL 121 HG21 VAL 121 117.167 -8.391 -14.260 710 HG22 VAL 121 HG22 VAL 121 115.822 -9.488 -13.946 711 HG23 VAL 121 HG23 VAL 121 116.052 -8.813 -15.558 712 H ALA 122 H ALA 122 116.309 -11.306 -11.604 713 HA ALA 122 HA ALA 122 113.955 -12.844 -12.614 714 HB1 ALA 122 HB1 ALA 122 114.784 -14.080 -10.852 715 HB2 ALA 122 HB2 ALA 122 113.782 -12.961 -9.926 716 HB3 ALA 122 HB3 ALA 122 115.515 -12.671 -10.081 717 H LEU 123 H LEU 123 111.840 -12.182 -11.490 718 HA LEU 123 HA LEU 123 111.739 -9.198 -11.192 719 HB2 LEU 123 HB2 LEU 123 110.573 -10.241 -13.144 720 HG LEU 123 HG LEU 123 108.911 -8.977 -10.955 721 HD11 LEU 123 HD11 LEU 123 110.863 -7.856 -12.372 722 HD12 LEU 123 HD12 LEU 123 109.384 -6.968 -12.007 723 HD13 LEU 123 HD13 LEU 123 109.590 -7.724 -13.587 724 HD21 LEU 123 HD21 LEU 123 107.076 -8.780 -12.428 725 HD22 LEU 123 HD22 LEU 123 107.617 -10.441 -12.673 726 HD23 LEU 123 HD23 LEU 123 108.051 -9.190 -13.839 727 H ASP 124 H ASP 124 110.444 -8.369 -9.397 728 HA ASP 124 HA ASP 124 109.451 -10.421 -7.470 729 HB2 ASP 124 HB2 ASP 124 111.778 -9.638 -6.930 730 H PHE 125 H PHE 125 107.512 -9.779 -6.468 731 HA PHE 125 HA PHE 125 106.610 -6.956 -6.905 732 HB2 PHE 125 HB2 PHE 125 105.741 -8.712 -8.558 733 HD1 PHE 125 HD2 PHE 125 105.173 -6.394 -9.269 734 HD2 PHE 125 HD1 PHE 125 102.933 -8.459 -6.241 735 HE1 PHE 125 HE2 PHE 125 103.321 -4.767 -9.530 736 HE2 PHE 125 HE1 PHE 125 101.080 -6.831 -6.505 737 HZ PHE 125 HZ PHE 125 101.275 -4.988 -8.151 738 H SER 126 H SER 126 105.806 -6.087 -4.985 739 HA SER 126 HA SER 126 104.785 -7.950 -2.890 740 HB2 SER 126 HB2 SER 126 106.321 -7.021 -1.257 741 HG SER 126 HG SER 126 107.945 -5.513 -2.194 742 H TYR 127 H TYR 127 103.698 -6.735 -1.107 743 HA TYR 127 HA TYR 127 102.494 -4.168 -2.099 744 HB2 TYR 127 HB2 TYR 127 101.408 -6.266 -0.186 745 HD1 TYR 127 HD2 TYR 127 99.875 -4.770 -3.204 746 HD2 TYR 127 HD1 TYR 127 101.801 -8.227 -1.534 747 HE1 TYR 127 HE2 TYR 127 99.204 -6.103 -5.185 748 HE2 TYR 127 HE1 TYR 127 101.129 -9.559 -3.515 749 HH TYR 127 HH TYR 127 100.525 -8.774 -6.136 750 H GLU 128 H GLU 128 102.809 -2.377 -0.772 751 HA GLU 128 HA GLU 128 103.693 -2.869 2.051 752 HB2 GLU 128 HB2 GLU 128 105.581 -2.377 0.487 753 HG2 GLU 128 HG2 GLU 128 104.900 -0.220 2.511 754 H GLN 129 H GLN 129 102.660 -1.578 3.533 755 HA GLN 129 HA GLN 129 101.143 0.809 2.533 756 HB2 GLN 129 HB2 GLN 129 100.302 -1.346 4.502 757 HG2 GLN 129 HG2 GLN 129 99.206 -0.558 1.783 758 HE21 GLN 129 HE21 GLN 129 97.497 -2.183 1.086 759 HE22 GLN 129 HE22 GLN 129 96.528 -2.904 2.278 760 H SER 130 H SER 130 101.101 2.582 4.024 761 HA SER 130 HA SER 130 102.611 2.221 6.584 762 HB2 SER 130 HB2 SER 130 104.099 3.012 4.742 763 HG SER 130 HG SER 130 104.626 5.064 5.882 764 H ARG 131 H ARG 131 101.800 3.483 8.270 765 HA ARG 131 HA ARG 131 99.646 5.460 7.585 766 HB2 ARG 131 HB2 ARG 131 99.765 3.358 9.773 767 HG2 ARG 131 HG2 ARG 131 97.960 3.735 7.362 768 HD2 ARG 131 HD2 ARG 131 96.706 2.906 9.342 769 HE ARG 131 HE ARG 131 99.093 1.157 9.589 770 HH11 ARG 131 HH21 ARG 131 97.343 3.038 11.508 771 HH12 ARG 131 HH22 ARG 131 96.842 1.837 12.650 772 HH21 ARG 131 HH11 ARG 131 97.845 -0.834 10.680 773 HH22 ARG 131 HH12 ARG 131 97.127 -0.356 12.181 774 H ILE 132 H ILE 132 100.045 7.459 8.498 775 HA ILE 132 HA ILE 132 101.913 7.571 10.839 776 HB ILE 132 HB ILE 132 101.619 9.440 8.470 777 HG12 ILE 132 HG12 ILE 132 103.973 7.694 9.214 778 HG21 ILE 132 HG21 ILE 132 102.482 10.940 9.937 779 HG22 ILE 132 HG22 ILE 132 103.990 10.055 9.709 780 HG23 ILE 132 HG23 ILE 132 102.949 9.685 11.084 781 HD11 ILE 132 HD11 ILE 132 103.295 9.621 7.050 782 HD12 ILE 132 HD12 ILE 132 104.179 8.173 6.572 783 HD13 ILE 132 HD13 ILE 132 104.857 9.259 7.785 784 H ARG 133 H ARG 133 99.283 7.374 11.442 785 HA ARG 133 HA ARG 133 97.572 8.399 12.655 786 HB2 ARG 133 HB2 ARG 133 99.654 10.602 12.721 787 HG2 ARG 133 HG2 ARG 133 98.939 8.399 14.679 788 HD2 ARG 133 HD2 ARG 133 100.971 9.286 15.897 789 HE ARG 133 HE ARG 133 98.389 10.064 16.125 790 HH11 ARG 133 HH11 ARG 133 100.445 10.916 18.173 791 HH12 ARG 133 HH12 ARG 133 100.221 12.634 18.197 792 HH21 ARG 133 HH21 ARG 133 98.456 12.714 15.214 793 HH22 ARG 133 HH22 ARG 133 99.095 13.651 16.522 794 H SER 134 H SER 134 98.972 10.964 10.544 795 HA SER 134 HA SER 134 96.182 11.788 9.892 796 HB2 SER 134 HB2 SER 134 98.792 13.077 10.289 797 HG SER 134 HG SER 134 96.339 14.393 10.170 798 H VAL 135 H VAL 135 98.920 10.190 8.485 799 HA VAL 135 HA VAL 135 97.543 10.436 5.830 800 HB VAL 135 HB VAL 135 99.748 10.778 4.763 801 HG11 VAL 135 HG11 VAL 135 99.761 13.049 5.173 802 HG12 VAL 135 HG12 VAL 135 99.646 12.841 6.921 803 HG13 VAL 135 HG13 VAL 135 98.213 12.634 5.913 804 HG21 VAL 135 HG21 VAL 135 100.784 11.018 7.600 805 HG22 VAL 135 HG22 VAL 135 101.720 11.193 6.115 806 HG23 VAL 135 HG23 VAL 135 101.061 9.620 6.560 807 H ASP 136 H ASP 136 97.508 8.621 4.613 808 HA ASP 136 HA ASP 136 99.102 6.240 5.467 809 HB2 ASP 136 HB2 ASP 136 96.149 6.421 4.752 810 H VAL 137 H VAL 137 100.320 5.691 3.650 811 HA VAL 137 HA VAL 137 99.199 6.344 0.960 812 HB VAL 137 HB VAL 137 102.034 5.955 1.983 813 HG11 VAL 137 HG11 VAL 137 101.158 5.640 -0.609 814 HG12 VAL 137 HG12 VAL 137 102.791 6.119 -0.151 815 HG13 VAL 137 HG13 VAL 137 101.599 7.347 -0.577 816 HG21 VAL 137 HG21 VAL 137 100.222 8.293 1.717 817 HG22 VAL 137 HG22 VAL 137 101.874 8.537 1.149 818 HG23 VAL 137 HG23 VAL 137 101.579 8.039 2.815 819 H GLY 138 H GLY 138 99.248 4.724 -0.653 820 HA2 GLY 138 HA2 GLY 138 99.992 1.972 0.268 821 H THR 139 H THR 139 101.732 1.185 -0.893 822 HA THR 139 HA THR 139 102.221 2.399 -3.593 823 HB THR 139 HB THR 139 103.670 3.191 -1.710 824 HG1 THR 139 HG1 THR 139 105.202 3.333 -3.123 825 HG21 THR 139 HG21 THR 139 104.830 1.782 -0.355 826 HG22 THR 139 HG22 THR 139 105.207 0.671 -1.671 827 HG23 THR 139 HG23 THR 139 103.636 0.592 -0.873 828 H TRP 140 H TRP 140 103.200 1.078 -5.162 829 HA TRP 140 HA TRP 140 103.031 -1.875 -4.663 830 HB2 TRP 140 HB2 TRP 140 102.855 -0.239 -7.225 831 HD1 TRP 140 HD1 TRP 140 101.072 1.316 -5.818 832 HE1 TRP 140 HE1 TRP 140 98.560 0.930 -5.397 833 HE3 TRP 140 HE3 TRP 140 100.773 -3.688 -6.784 834 HZ2 TRP 140 HZ2 TRP 140 96.671 -1.215 -5.464 835 HZ3 TRP 140 HZ3 TRP 140 98.606 -4.876 -6.603 836 HH2 TRP 140 HH2 TRP 140 96.556 -3.648 -5.943 837 H ILE 141 H ILE 141 104.966 -3.042 -5.021 838 HA ILE 141 HA ILE 141 107.317 -1.412 -5.925 839 HB ILE 141 HB ILE 141 107.135 -3.828 -4.097 840 HG12 ILE 141 HG12 ILE 141 107.694 -0.915 -3.449 841 HG21 ILE 141 HG21 ILE 141 109.487 -3.331 -3.588 842 HG22 ILE 141 HG22 ILE 141 109.463 -1.986 -4.730 843 HG23 ILE 141 HG23 ILE 141 109.291 -3.642 -5.312 844 HD11 ILE 141 HD11 ILE 141 107.325 -1.782 -1.097 845 HD12 ILE 141 HD12 ILE 141 108.784 -2.389 -1.881 846 HD13 ILE 141 HD13 ILE 141 107.352 -3.413 -1.768 847 H ALA 142 H ALA 142 108.483 -2.122 -7.659 848 HA ALA 142 HA ALA 142 108.250 -4.959 -8.542 849 HB1 ALA 142 HB1 ALA 142 108.076 -3.514 -10.903 850 HB2 ALA 142 HB2 ALA 142 107.085 -2.563 -9.797 851 HB3 ALA 142 HB3 ALA 142 106.711 -4.263 -10.077 852 H GLY 143 H GLY 143 110.325 -5.650 -9.065 853 HA2 GLY 143 HA2 GLY 143 112.204 -3.785 -10.337 854 H VAL 144 H VAL 144 114.545 -5.150 -9.597 855 HA VAL 144 HA VAL 144 114.182 -7.728 -11.080 856 HB VAL 144 HB VAL 144 115.493 -5.974 -12.196 857 HG11 VAL 144 HG11 VAL 144 117.023 -5.997 -9.591 858 HG12 VAL 144 HG12 VAL 144 116.283 -4.622 -10.410 859 HG13 VAL 144 HG13 VAL 144 117.732 -5.371 -11.078 860 HG21 VAL 144 HG21 VAL 144 117.470 -7.261 -12.673 861 HG22 VAL 144 HG22 VAL 144 116.179 -8.413 -12.337 862 HG23 VAL 144 HG23 VAL 144 117.393 -8.068 -11.107 863 H GLY 145 H GLY 145 115.717 -9.480 -10.449 864 HA2 GLY 145 HA2 GLY 145 116.744 -9.281 -7.662 865 H TYR 146 H TYR 146 118.736 -10.200 -7.479 866 HA TYR 146 HA TYR 146 119.612 -12.154 -9.585 867 HB2 TYR 146 HB2 TYR 146 120.465 -9.830 -9.924 868 HD1 TYR 146 HD2 TYR 146 121.273 -11.347 -11.727 869 HD2 TYR 146 HD1 TYR 146 123.209 -11.136 -7.898 870 HE1 TYR 146 HE2 TYR 146 123.266 -12.480 -12.672 871 HE2 TYR 146 HE1 TYR 146 125.202 -12.267 -8.844 872 HH TYR 146 HH TYR 146 126.220 -12.480 -11.261 873 H ARG 147 H ARG 147 120.947 -13.853 -8.794 874 HA ARG 147 HA ARG 147 121.415 -13.882 -5.824 875 HB2 ARG 147 HB2 ARG 147 119.491 -15.257 -6.559 876 HG2 ARG 147 HG2 ARG 147 121.939 -16.852 -5.734 877 HD2 ARG 147 HD2 ARG 147 118.973 -17.504 -5.515 878 HE ARG 147 HE ARG 147 120.082 -18.435 -3.570 879 HH11 ARG 147 HH21 ARG 147 122.908 -18.366 -4.402 880 HH12 ARG 147 HH22 ARG 147 123.268 -20.033 -4.705 881 HH21 ARG 147 HH11 ARG 147 119.941 -20.992 -4.897 882 HH22 ARG 147 HH12 ARG 147 121.589 -21.519 -4.986 883 H PHE 148 H PHE 148 123.590 -13.981 -5.438 884 HA PHE 148 HA PHE 148 125.592 -14.547 -7.397 885 HB2 PHE 148 HB2 PHE 148 125.842 -13.273 -5.251 886 HD1 PHE 148 HD1 PHE 148 127.773 -12.819 -6.737 887 HD2 PHE 148 HD2 PHE 148 127.550 -16.383 -4.350 888 HE1 PHE 148 HE1 PHE 148 130.195 -13.213 -7.099 889 HE2 PHE 148 HE2 PHE 148 129.971 -16.777 -4.712 890 HZ PHE 148 HZ PHE 148 131.294 -15.192 -6.086 Start of MODEL 6 1 H THR 2 H THR 2 123.007 -18.885 0.810 2 HA THR 2 HA THR 2 125.286 -17.758 -0.784 3 HB THR 2 HB THR 2 123.755 -17.872 -2.716 4 HG1 THR 2 HG1 THR 2 121.979 -19.158 -0.923 5 HG21 THR 2 HG21 THR 2 123.975 -20.161 -3.092 6 HG22 THR 2 HG22 THR 2 123.561 -20.576 -1.429 7 HG23 THR 2 HG23 THR 2 125.148 -19.902 -1.800 8 H SER 3 H SER 3 124.593 -15.642 -1.883 9 HA SER 3 HA SER 3 122.904 -14.035 0.008 10 HB2 SER 3 HB2 SER 3 124.354 -12.179 -0.651 11 HG SER 3 HG SER 3 125.639 -12.300 -2.341 12 H THR 4 H THR 4 121.613 -12.266 -1.087 13 HA THR 4 HA THR 4 121.092 -12.836 -3.975 14 HB THR 4 HB THR 4 119.002 -12.462 -1.810 15 HG1 THR 4 HG1 THR 4 119.731 -14.803 -3.228 16 HG21 THR 4 HG21 THR 4 118.079 -13.733 -4.211 17 HG22 THR 4 HG22 THR 4 118.887 -12.225 -4.641 18 HG23 THR 4 HG23 THR 4 117.544 -12.211 -3.500 19 H VAL 5 H VAL 5 120.700 -11.016 -5.168 20 HA VAL 5 HA VAL 5 120.436 -8.400 -3.713 21 HB VAL 5 HB VAL 5 122.712 -8.825 -4.625 22 HG11 VAL 5 HG11 VAL 5 123.055 -9.703 -6.676 23 HG12 VAL 5 HG12 VAL 5 121.986 -8.526 -7.436 24 HG13 VAL 5 HG13 VAL 5 121.319 -10.003 -6.743 25 HG21 VAL 5 HG21 VAL 5 122.577 -6.787 -6.340 26 HG22 VAL 5 HG22 VAL 5 122.341 -6.542 -4.610 27 HG23 VAL 5 HG23 VAL 5 120.946 -6.655 -5.683 28 H THR 6 H THR 6 118.921 -6.940 -4.641 29 HA THR 6 HA THR 6 117.708 -7.560 -7.271 30 HB THR 6 HB THR 6 115.475 -7.788 -6.340 31 HG1 THR 6 HG1 THR 6 115.275 -6.543 -4.654 32 HG21 THR 6 HG21 THR 6 117.243 -9.414 -4.503 33 HG22 THR 6 HG22 THR 6 116.994 -9.819 -6.199 34 HG23 THR 6 HG23 THR 6 115.630 -9.823 -5.085 35 H GLY 7 H GLY 7 117.023 -5.523 -8.237 36 HA2 GLY 7 HA2 GLY 7 116.805 -3.233 -6.351 37 H GLY 8 H GLY 8 115.430 -1.498 -7.201 38 HA2 GLY 8 HA2 GLY 8 114.103 -1.665 -9.736 39 H TYR 9 H TYR 9 111.622 -0.557 -9.063 40 HA TYR 9 HA TYR 9 112.277 1.852 -7.417 41 HB2 TYR 9 HB2 TYR 9 111.472 3.278 -9.231 42 HD1 TYR 9 HD2 TYR 9 112.106 0.240 -11.254 43 HD2 TYR 9 HD1 TYR 9 109.172 3.089 -9.937 44 HE1 TYR 9 HE2 TYR 9 110.504 -0.635 -12.932 45 HE2 TYR 9 HE1 TYR 9 107.570 2.214 -11.616 46 HH TYR 9 HH TYR 9 107.730 -0.610 -13.010 47 H ALA 10 H ALA 10 110.217 3.038 -6.742 48 HA ALA 10 HA ALA 10 107.759 1.358 -7.049 49 HB1 ALA 10 HB1 ALA 10 107.501 1.320 -4.596 50 HB2 ALA 10 HB2 ALA 10 109.017 2.206 -4.425 51 HB3 ALA 10 HB3 ALA 10 109.020 0.571 -5.085 52 H GLN 11 H GLN 11 105.811 2.465 -6.574 53 HA GLN 11 HA GLN 11 106.047 5.449 -6.401 54 HB2 GLN 11 HB2 GLN 11 103.905 5.446 -7.636 55 HG2 GLN 11 HG2 GLN 11 104.184 2.423 -7.618 56 HE21 GLN 11 HE21 GLN 11 103.795 2.190 -9.901 57 HE22 GLN 11 HE22 GLN 11 102.358 2.711 -10.638 58 H SER 12 H SER 12 104.932 6.421 -4.656 59 HA SER 12 HA SER 12 103.413 4.528 -2.892 60 HB2 SER 12 HB2 SER 12 105.125 6.926 -2.194 61 HG SER 12 HG SER 12 106.590 5.375 -1.530 62 H ASP 13 H ASP 13 101.539 5.219 -1.946 63 HA ASP 13 HA ASP 13 100.523 7.969 -2.570 64 HB2 ASP 13 HB2 ASP 13 98.308 6.872 -2.954 65 H ALA 14 H ALA 14 99.534 8.909 -0.697 66 HA ALA 14 HA ALA 14 99.049 7.116 1.613 67 HB1 ALA 14 HB1 ALA 14 101.402 7.980 1.553 68 HB2 ALA 14 HB2 ALA 14 100.505 8.473 2.990 69 HB3 ALA 14 HB3 ALA 14 100.755 9.614 1.669 70 H GLN 15 H GLN 15 97.623 7.893 3.074 71 HA GLN 15 HA GLN 15 95.761 9.989 2.246 72 HB2 GLN 15 HB2 GLN 15 96.025 8.232 4.714 73 HG2 GLN 15 HG2 GLN 15 94.180 8.065 2.309 74 HE21 GLN 15 HE21 GLN 15 92.941 5.941 2.382 75 HE22 GLN 15 HE22 GLN 15 92.521 5.299 3.896 76 H GLY 16 H GLY 16 96.091 12.088 2.741 77 HA2 GLY 16 HA2 GLY 16 96.431 13.838 4.455 78 H GLN 17 H GLN 17 98.610 12.044 2.415 79 HA GLN 17 HA GLN 17 100.220 14.524 1.909 80 HB2 GLN 17 HB2 GLN 17 100.815 11.582 1.441 81 HG2 GLN 17 HG2 GLN 17 101.817 13.577 3.494 82 HE21 GLN 17 HE21 GLN 17 101.969 10.069 3.778 83 HE22 GLN 17 HE22 GLN 17 103.657 9.945 3.648 84 H MET 18 H MET 18 100.277 15.299 -0.224 85 HA MET 18 HA MET 18 98.353 14.055 -2.128 86 HB2 MET 18 HB2 MET 18 99.795 16.722 -1.993 87 HG2 MET 18 HG2 MET 18 96.923 15.873 -1.512 88 HE1 MET 18 HE1 MET 18 99.428 19.109 -2.279 89 HE2 MET 18 HE2 MET 18 99.377 18.441 -0.650 90 HE3 MET 18 HE3 MET 18 98.657 20.016 -0.970 91 H ASN 19 H ASN 19 101.470 15.745 -2.540 92 HA ASN 19 HA ASN 19 102.220 14.748 -5.025 93 HB2 ASN 19 HB2 ASN 19 104.515 15.300 -4.272 94 HD21 ASN 19 HD21 ASN 19 105.833 16.166 -2.361 95 HD22 ASN 19 HD22 ASN 19 105.508 15.544 -0.816 96 H LYS 20 H LYS 20 102.574 12.723 -5.768 97 HA LYS 20 HA LYS 20 102.859 10.425 -3.997 98 HB2 LYS 20 HB2 LYS 20 102.878 9.196 -6.109 99 HG2 LYS 20 HG2 LYS 20 103.344 11.918 -7.371 100 HD2 LYS 20 HD2 LYS 20 102.651 9.218 -8.554 101 HE2 LYS 20 HE2 LYS 20 104.670 10.504 -9.620 102 HZ1 LYS 20 HZ1 LYS 20 103.461 12.626 -9.333 103 HZ2 LYS 20 HZ2 LYS 20 102.323 12.119 -10.489 104 HZ3 LYS 20 HZ3 LYS 20 103.942 12.371 -10.940 105 H MET 21 H MET 21 104.763 8.891 -4.224 106 HA MET 21 HA MET 21 107.310 10.432 -4.627 107 HB2 MET 21 HB2 MET 21 106.555 8.259 -2.653 108 HG2 MET 21 HG2 MET 21 107.145 11.222 -2.370 109 HE1 MET 21 HE1 MET 21 105.289 8.522 -0.619 110 HE2 MET 21 HE2 MET 21 106.075 8.258 0.937 111 HE3 MET 21 HE3 MET 21 106.810 7.621 -0.532 112 H GLY 22 H GLY 22 109.006 9.384 -5.643 113 HA2 GLY 22 HA2 GLY 22 108.635 6.571 -6.563 114 H GLY 23 H GLY 23 110.528 5.460 -6.167 115 HA2 GLY 23 HA2 GLY 23 113.102 6.878 -6.582 116 H PHE 24 H PHE 24 114.708 4.982 -5.231 117 HA PHE 24 HA PHE 24 114.166 2.507 -6.838 118 HB2 PHE 24 HB2 PHE 24 116.758 3.921 -6.134 119 HD1 PHE 24 HD2 PHE 24 115.613 2.308 -9.267 120 HD2 PHE 24 HD1 PHE 24 116.217 6.019 -7.190 121 HE1 PHE 24 HE2 PHE 24 115.256 3.550 -11.383 122 HE2 PHE 24 HE1 PHE 24 115.860 7.261 -9.306 123 HZ PHE 24 HZ PHE 24 115.379 6.027 -11.403 124 H ASN 25 H ASN 25 114.870 0.511 -5.842 125 HA ASN 25 HA ASN 25 115.476 0.698 -2.912 126 HB2 ASN 25 HB2 ASN 25 113.046 0.322 -3.437 127 HD21 ASN 25 HD21 ASN 25 113.022 -2.879 -2.803 128 HD22 ASN 25 HD22 ASN 25 113.353 -2.873 -1.139 129 H LEU 26 H LEU 26 117.133 -0.596 -2.312 130 HA LEU 26 HA LEU 26 118.015 -2.791 -4.167 131 HB2 LEU 26 HB2 LEU 26 119.540 -1.200 -2.066 132 HG LEU 26 HG LEU 26 118.867 0.186 -4.008 133 HD11 LEU 26 HD11 LEU 26 121.099 0.488 -2.923 134 HD12 LEU 26 HD12 LEU 26 121.107 0.935 -4.629 135 HD13 LEU 26 HD13 LEU 26 121.794 -0.608 -4.118 136 HD21 LEU 26 HD21 LEU 26 119.894 -2.212 -5.458 137 HD22 LEU 26 HD22 LEU 26 120.223 -0.637 -6.181 138 HD23 LEU 26 HD23 LEU 26 118.560 -1.136 -5.872 139 H LYS 27 H LYS 27 118.657 -4.873 -3.017 140 HA LYS 27 HA LYS 27 117.866 -5.009 -0.166 141 HB2 LYS 27 HB2 LYS 27 115.838 -5.342 -1.557 142 HG2 LYS 27 HG2 LYS 27 116.843 -7.952 -0.387 143 HD2 LYS 27 HD2 LYS 27 114.367 -8.210 0.109 144 HE2 LYS 27 HE2 LYS 27 114.438 -7.992 -2.835 145 HZ1 LYS 27 HZ1 LYS 27 113.801 -10.280 -2.502 146 HZ2 LYS 27 HZ2 LYS 27 112.969 -9.322 -1.371 147 HZ3 LYS 27 HZ3 LYS 27 114.312 -10.241 -0.886 148 H TYR 28 H TYR 28 119.246 -6.420 0.883 149 HA TYR 28 HA TYR 28 120.661 -8.512 -0.725 150 HB2 TYR 28 HB2 TYR 28 122.058 -6.465 -0.359 151 HD1 TYR 28 HD2 TYR 28 123.328 -8.149 -1.672 152 HD2 TYR 28 HD1 TYR 28 123.024 -8.373 2.608 153 HE1 TYR 28 HE2 TYR 28 125.221 -9.750 -1.620 154 HE2 TYR 28 HE1 TYR 28 124.917 -9.973 2.659 155 HH TYR 28 HH TYR 28 127.016 -10.391 0.887 156 H ARG 29 H ARG 29 120.686 -10.518 0.381 157 HA ARG 29 HA ARG 29 120.046 -10.457 3.299 158 HB2 ARG 29 HB2 ARG 29 118.221 -12.028 2.955 159 HG2 ARG 29 HG2 ARG 29 119.041 -11.889 0.042 160 HD2 ARG 29 HD2 ARG 29 116.570 -13.059 1.373 161 HE ARG 29 HE ARG 29 118.039 -14.028 -0.906 162 HH11 ARG 29 HH11 ARG 29 115.792 -15.374 0.713 163 HH12 ARG 29 HH12 ARG 29 114.602 -15.601 -0.525 164 HH21 ARG 29 HH21 ARG 29 116.108 -13.404 -2.745 165 HH22 ARG 29 HH22 ARG 29 114.780 -14.485 -2.482 166 H TYR 30 H TYR 30 120.675 -12.260 4.454 167 HA TYR 30 HA TYR 30 122.491 -14.200 3.050 168 HB2 TYR 30 HB2 TYR 30 123.547 -12.547 4.611 169 HD1 TYR 30 HD1 TYR 30 125.282 -13.977 3.556 170 HD2 TYR 30 HD2 TYR 30 123.008 -15.307 6.949 171 HE1 TYR 30 HE1 TYR 30 126.929 -15.790 3.948 172 HE2 TYR 30 HE2 TYR 30 124.655 -17.119 7.342 173 HH TYR 30 HH TYR 30 127.184 -17.459 6.768 174 H GLU 31 H GLU 31 122.046 -16.394 3.415 175 HA GLU 31 HA GLU 31 120.047 -17.097 5.526 176 HB2 GLU 31 HB2 GLU 31 118.971 -16.726 3.290 177 HG2 GLU 31 HG2 GLU 31 119.055 -19.590 4.289 178 H GLU 32 H GLU 32 120.403 -19.211 6.407 179 HA GLU 32 HA GLU 32 122.984 -20.463 5.623 180 HB2 GLU 32 HB2 GLU 32 122.369 -19.745 7.986 181 HG2 GLU 32 HG2 GLU 32 122.935 -22.685 7.494 182 H ASP 33 H ASP 33 122.988 -22.385 4.544 183 HA ASP 33 HA ASP 33 120.763 -23.535 3.286 184 HB2 ASP 33 HB2 ASP 33 123.198 -23.877 2.806 185 H ASN 34 H ASN 34 121.854 -24.030 6.588 186 HA ASN 34 HA ASN 34 120.680 -26.566 7.129 187 HB2 ASN 34 HB2 ASN 34 121.111 -24.100 8.842 188 HD21 ASN 34 HD21 ASN 34 123.166 -24.471 10.196 189 HD22 ASN 34 HD22 ASN 34 124.436 -25.344 9.482 190 H SER 35 H SER 35 119.237 -23.283 7.417 191 HA SER 35 HA SER 35 116.544 -24.579 7.285 192 HB2 SER 35 HB2 SER 35 117.719 -22.771 9.383 193 HG SER 35 HG SER 35 117.678 -24.808 10.047 194 HA PRO 36 HA PRO 36 115.697 -21.074 4.723 195 HB2 PRO 36 HB2 PRO 36 112.969 -21.090 4.793 196 HG2 PRO 36 HG2 PRO 36 112.405 -22.528 6.443 197 HD2 PRO 36 HD2 PRO 36 114.111 -23.067 7.816 198 H LEU 37 H LEU 37 116.162 -20.402 7.598 199 HA LEU 37 HA LEU 37 114.198 -18.171 7.983 200 HB2 LEU 37 HB2 LEU 37 116.149 -19.510 9.890 201 HG LEU 37 HG LEU 37 114.303 -20.999 9.173 202 HD11 LEU 37 HD11 LEU 37 114.076 -21.772 11.294 203 HD12 LEU 37 HD12 LEU 37 113.319 -20.279 11.851 204 HD13 LEU 37 HD13 LEU 37 115.076 -20.396 11.759 205 HD21 LEU 37 HD21 LEU 37 111.962 -20.318 9.812 206 HD22 LEU 37 HD22 LEU 37 112.649 -19.344 8.512 207 HD23 LEU 37 HD23 LEU 37 112.577 -18.700 10.152 208 H GLY 38 H GLY 38 115.580 -17.081 6.197 209 HA2 GLY 38 HA2 GLY 38 118.178 -16.065 7.226 210 H VAL 39 H VAL 39 118.475 -13.615 6.368 211 HA VAL 39 HA VAL 39 116.051 -12.044 7.178 212 HB VAL 39 HB VAL 39 117.691 -12.260 9.026 213 HG11 VAL 39 HG11 VAL 39 119.947 -11.228 8.734 214 HG12 VAL 39 HG12 VAL 39 119.602 -11.032 7.015 215 HG13 VAL 39 HG13 VAL 39 119.713 -12.648 7.714 216 HG21 VAL 39 HG21 VAL 39 117.904 -9.911 9.520 217 HG22 VAL 39 HG22 VAL 39 116.406 -10.116 8.612 218 HG23 VAL 39 HG23 VAL 39 117.847 -9.490 7.808 219 H ILE 40 H ILE 40 115.776 -10.088 5.931 220 HA ILE 40 HA ILE 40 117.739 -9.760 3.690 221 HB ILE 40 HB ILE 40 114.768 -9.150 3.826 222 HG12 ILE 40 HG12 ILE 40 116.191 -11.461 2.468 223 HG21 ILE 40 HG21 ILE 40 116.902 -8.647 1.864 224 HG22 ILE 40 HG22 ILE 40 115.310 -7.903 2.013 225 HG23 ILE 40 HG23 ILE 40 115.486 -9.449 1.183 226 HD11 ILE 40 HD11 ILE 40 113.302 -10.617 2.722 227 HD12 ILE 40 HD12 ILE 40 113.768 -12.261 2.288 228 HD13 ILE 40 HD13 ILE 40 114.220 -10.912 1.245 229 H GLY 41 H GLY 41 118.441 -7.653 3.233 230 HA2 GLY 41 HA2 GLY 41 117.405 -5.471 5.008 231 H SER 42 H SER 42 116.488 -3.847 3.805 232 HA SER 42 HA SER 42 117.618 -3.286 1.091 233 HB2 SER 42 HB2 SER 42 115.387 -3.345 0.155 234 HG SER 42 HG SER 42 114.419 -4.015 2.717 235 H PHE 43 H PHE 43 117.506 -1.117 0.471 236 HA PHE 43 HA PHE 43 116.337 0.801 2.471 237 HB2 PHE 43 HB2 PHE 43 118.814 0.964 0.725 238 HD1 PHE 43 HD1 PHE 43 118.205 2.099 4.193 239 HD2 PHE 43 HD2 PHE 43 119.905 -0.961 1.703 240 HE1 PHE 43 HE1 PHE 43 119.370 1.143 6.163 241 HE2 PHE 43 HE2 PHE 43 121.069 -1.917 3.674 242 HZ PHE 43 HZ PHE 43 120.802 -0.865 5.903 243 H THR 44 H THR 44 115.222 2.634 1.574 244 HA THR 44 HA THR 44 114.818 2.564 -1.403 245 HB THR 44 HB THR 44 112.754 3.095 0.758 246 HG1 THR 44 HG1 THR 44 113.297 0.950 0.820 247 HG21 THR 44 HG21 THR 44 111.302 2.496 -1.376 248 HG22 THR 44 HG22 THR 44 112.739 3.052 -2.233 249 HG23 THR 44 HG23 THR 44 111.899 4.137 -1.125 250 H TYR 45 H TYR 45 114.874 4.611 -2.389 251 HA TYR 45 HA TYR 45 114.777 7.015 -0.616 252 HB2 TYR 45 HB2 TYR 45 117.133 6.258 -1.065 253 HD1 TYR 45 HD1 TYR 45 117.039 8.249 0.449 254 HD2 TYR 45 HD2 TYR 45 116.787 8.614 -3.824 255 HE1 TYR 45 HE1 TYR 45 117.561 10.668 0.625 256 HE2 TYR 45 HE2 TYR 45 117.308 11.032 -3.647 257 HH TYR 45 HH TYR 45 118.416 12.465 -0.712 258 H THR 46 H THR 46 112.978 8.037 -1.445 259 HA THR 46 HA THR 46 112.723 8.208 -4.435 260 HB THR 46 HB THR 46 110.321 8.104 -4.115 261 HG1 THR 46 HG1 THR 46 109.559 7.869 -1.904 262 HG21 THR 46 HG21 THR 46 110.555 5.994 -2.253 263 HG22 THR 46 HG22 THR 46 112.075 6.021 -3.143 264 HG23 THR 46 HG23 THR 46 110.549 5.869 -4.011 265 H GLU 47 H GLU 47 111.678 10.215 -5.213 266 HA GLU 47 HA GLU 47 111.981 12.507 -3.304 267 HB2 GLU 47 HB2 GLU 47 112.753 12.253 -6.229 268 HG2 GLU 47 HG2 GLU 47 114.292 11.173 -4.592 269 H LYS 48 H LYS 48 110.721 14.446 -4.041 270 HA LYS 48 HA LYS 48 107.976 13.746 -4.684 271 HB2 LYS 48 HB2 LYS 48 108.724 15.576 -3.162 272 HG2 LYS 48 HG2 LYS 48 107.143 16.476 -5.590 273 HD2 LYS 48 HD2 LYS 48 107.350 17.594 -2.777 274 HE2 LYS 48 HE2 LYS 48 105.482 18.354 -5.057 275 HZ1 LYS 48 HZ1 LYS 48 104.843 20.085 -3.550 276 HZ2 LYS 48 HZ2 LYS 48 106.535 20.139 -3.696 277 HZ3 LYS 48 HZ3 LYS 48 105.820 19.458 -2.313 278 H SER 49 H SER 49 106.830 14.227 -6.607 279 HA SER 49 HA SER 49 108.251 14.068 -9.098 280 HB2 SER 49 HB2 SER 49 106.044 14.248 -10.039 281 HG SER 49 HG SER 49 105.302 15.404 -7.562 282 H ARG 50 H ARG 50 108.340 15.749 -10.781 283 HA ARG 50 HA ARG 50 107.981 18.555 -9.861 284 HB2 ARG 50 HB2 ARG 50 110.319 19.060 -10.478 285 HG2 ARG 50 HG2 ARG 50 110.385 16.096 -11.097 286 HD2 ARG 50 HD2 ARG 50 112.702 18.038 -10.740 287 HE ARG 50 HE ARG 50 113.143 16.495 -12.612 288 HH11 ARG 50 HH21 ARG 50 111.539 14.517 -10.527 289 HH12 ARG 50 HH22 ARG 50 112.720 13.250 -10.492 290 HH21 ARG 50 HH11 ARG 50 115.145 15.101 -12.139 291 HH22 ARG 50 HH12 ARG 50 114.761 13.580 -11.404 292 H THR 51 H THR 51 108.270 20.098 -11.717 293 HA THR 51 HA THR 51 107.310 18.858 -14.262 294 HB THR 51 HB THR 51 106.408 21.119 -14.673 295 HG1 THR 51 HG1 THR 51 106.720 22.704 -13.093 296 HG21 THR 51 HG21 THR 51 105.758 20.484 -11.805 297 HG22 THR 51 HG22 THR 51 105.293 19.372 -13.092 298 HG23 THR 51 HG23 THR 51 104.679 21.025 -13.091 299 H ALA 52 H ALA 52 108.042 20.176 -16.267 300 HA ALA 52 HA ALA 52 110.858 20.028 -16.593 301 HB1 ALA 52 HB1 ALA 52 110.350 21.337 -18.678 302 HB2 ALA 52 HB2 ALA 52 108.722 21.612 -18.057 303 HB3 ALA 52 HB3 ALA 52 109.259 19.974 -18.432 304 H SER 53 H SER 53 108.804 22.720 -15.561 305 HA SER 53 HA SER 53 110.701 24.848 -15.826 306 HB2 SER 53 HB2 SER 53 108.476 24.414 -13.804 307 HG SER 53 HG SER 53 107.373 24.428 -15.588 308 H SER 54 H SER 54 112.004 25.837 -14.092 309 HA SER 54 HA SER 54 113.658 24.040 -12.652 310 HB2 SER 54 HB2 SER 54 113.006 26.940 -12.042 311 HG SER 54 HG SER 54 114.832 27.258 -13.467 312 H GLY 55 H GLY 55 110.837 25.927 -11.532 313 HA2 GLY 55 HA2 GLY 55 109.599 25.801 -9.533 314 H ASP 56 H ASP 56 111.047 22.966 -8.324 315 HA ASP 56 HA ASP 56 112.350 22.558 -6.404 316 HB2 ASP 56 HB2 ASP 56 113.699 25.008 -7.582 317 H TYR 57 H TYR 57 109.953 24.081 -5.924 318 HA TYR 57 HA TYR 57 110.382 26.436 -4.346 319 HB2 TYR 57 HB2 TYR 57 108.222 25.645 -5.308 320 HD1 TYR 57 HD2 TYR 57 108.022 27.991 -4.495 321 HD2 TYR 57 HD1 TYR 57 107.674 24.629 -1.843 322 HE1 TYR 57 HE2 TYR 57 106.996 29.454 -2.775 323 HE2 TYR 57 HE1 TYR 57 106.648 26.093 -0.124 324 HH TYR 57 HH TYR 57 105.593 29.293 -0.827 325 H ASN 58 H ASN 58 110.177 22.983 -3.479 326 HA ASN 58 HA ASN 58 111.914 23.314 -1.168 327 HB2 ASN 58 HB2 ASN 58 109.624 24.277 -0.526 328 HD21 ASN 58 HD21 ASN 58 108.607 23.208 1.796 329 HD22 ASN 58 HD22 ASN 58 109.854 22.771 2.861 330 H LYS 59 H LYS 59 112.885 21.563 -2.503 331 HA LYS 59 HA LYS 59 111.483 19.102 -3.062 332 HB2 LYS 59 HB2 LYS 59 113.505 20.022 -4.226 333 HG2 LYS 59 HG2 LYS 59 113.781 17.255 -3.008 334 HD2 LYS 59 HD2 LYS 59 115.045 18.510 -5.466 335 HE2 LYS 59 HE2 LYS 59 116.143 16.204 -5.631 336 HZ1 LYS 59 HZ1 LYS 59 114.294 15.479 -6.913 337 HZ2 LYS 59 HZ2 LYS 59 114.242 17.176 -6.936 338 HZ3 LYS 59 HZ3 LYS 59 113.186 16.305 -5.930 339 H ASN 60 H ASN 60 111.028 17.461 -1.703 340 HA ASN 60 HA ASN 60 112.351 17.351 0.976 341 HB2 ASN 60 HB2 ASN 60 109.824 16.073 -0.134 342 HD21 ASN 60 HD21 ASN 60 108.016 17.456 -0.064 343 HD22 ASN 60 HD22 ASN 60 108.028 19.012 0.615 344 H GLN 61 H GLN 61 112.882 15.068 1.760 345 HA GLN 61 HA GLN 61 113.665 13.309 -0.548 346 HB2 GLN 61 HB2 GLN 61 114.995 13.848 2.129 347 HG2 GLN 61 HG2 GLN 61 115.865 14.466 -0.713 348 HE21 GLN 61 HE21 GLN 61 117.897 15.823 -0.682 349 HE22 GLN 61 HE22 GLN 61 119.000 15.624 0.592 350 H TYR 62 H TYR 62 113.445 10.986 -0.149 351 HA TYR 62 HA TYR 62 111.664 10.366 2.182 352 HB2 TYR 62 HB2 TYR 62 110.567 10.329 -0.023 353 HD1 TYR 62 HD1 TYR 62 109.018 9.705 1.858 354 HD2 TYR 62 HD2 TYR 62 111.581 6.837 -0.053 355 HE1 TYR 62 HE1 TYR 62 107.660 7.860 2.809 356 HE2 TYR 62 HE2 TYR 62 110.222 4.991 0.896 357 HH TYR 62 HH TYR 62 107.959 5.461 3.373 358 H TYR 63 H TYR 63 112.418 8.945 3.551 359 HA TYR 63 HA TYR 63 114.678 7.119 2.768 360 HB2 TYR 63 HB2 TYR 63 113.915 8.393 5.413 361 HD1 TYR 63 HD1 TYR 63 117.160 7.861 3.675 362 HD2 TYR 63 HD2 TYR 63 114.111 10.684 4.766 363 HE1 TYR 63 HE1 TYR 63 118.618 9.723 2.930 364 HE2 TYR 63 HE2 TYR 63 115.570 12.546 4.021 365 HH TYR 63 HH TYR 63 117.497 12.836 2.404 366 H GLY 64 H GLY 64 114.354 4.919 3.069 367 HA2 GLY 64 HA2 GLY 64 112.141 4.052 4.835 368 H ILE 65 H ILE 65 113.170 2.659 6.156 369 HA ILE 65 HA ILE 65 115.290 0.874 5.026 370 HB ILE 65 HB ILE 65 114.452 1.516 7.884 371 HG12 ILE 65 HG12 ILE 65 116.851 2.501 6.304 372 HG21 ILE 65 HG21 ILE 65 116.639 -0.153 6.663 373 HG22 ILE 65 HG22 ILE 65 115.561 -0.548 8.002 374 HG23 ILE 65 HG23 ILE 65 116.876 0.603 8.238 375 HD11 ILE 65 HD11 ILE 65 117.205 3.955 8.238 376 HD12 ILE 65 HD12 ILE 65 117.151 2.275 8.771 377 HD13 ILE 65 HD13 ILE 65 115.752 3.323 9.012 378 H THR 66 H THR 66 114.816 -1.360 4.896 379 HA THR 66 HA THR 66 112.462 -2.365 6.384 380 HB THR 66 HB THR 66 112.705 -2.607 3.380 381 HG1 THR 66 HG1 THR 66 111.259 -0.765 4.979 382 HG21 THR 66 HG21 THR 66 110.376 -2.989 5.276 383 HG22 THR 66 HG22 THR 66 111.340 -4.296 4.590 384 HG23 THR 66 HG23 THR 66 110.365 -3.273 3.536 385 H ALA 67 H ALA 67 112.670 -4.559 6.881 386 HA ALA 67 HA ALA 67 114.540 -6.252 5.352 387 HB1 ALA 67 HB1 ALA 67 116.047 -5.254 6.920 388 HB2 ALA 67 HB2 ALA 67 115.630 -6.812 7.633 389 HB3 ALA 67 HB3 ALA 67 114.860 -5.339 8.223 390 H GLY 68 H GLY 68 114.064 -8.536 5.774 391 HA2 GLY 68 HA2 GLY 68 112.144 -9.260 7.841 392 HA PRO 69 HA PRO 69 113.714 -13.270 7.138 393 HB2 PRO 69 HB2 PRO 69 111.540 -14.919 7.330 394 HG2 PRO 69 HG2 PRO 69 109.835 -13.388 7.155 395 HD2 PRO 69 HD2 PRO 69 110.227 -11.135 7.220 396 H ALA 70 H ALA 70 113.764 -15.120 5.645 397 HA ALA 70 HA ALA 70 112.148 -14.813 3.144 398 HB1 ALA 70 HB1 ALA 70 115.050 -15.427 2.871 399 HB2 ALA 70 HB2 ALA 70 114.645 -13.781 3.358 400 HB3 ALA 70 HB3 ALA 70 114.014 -14.433 1.846 401 H TYR 71 H TYR 71 111.547 -16.833 2.302 402 HA TYR 71 HA TYR 71 112.779 -19.227 3.638 403 HB2 TYR 71 HB2 TYR 71 110.016 -18.752 2.474 404 HD1 TYR 71 HD1 TYR 71 111.189 -20.266 5.661 405 HD2 TYR 71 HD2 TYR 71 109.386 -16.849 3.783 406 HE1 TYR 71 HE1 TYR 71 110.619 -19.340 7.890 407 HE2 TYR 71 HE2 TYR 71 108.817 -15.923 6.012 408 HH TYR 71 HH TYR 71 110.175 -16.738 8.739 409 H ARG 72 H ARG 72 113.951 -20.507 2.300 410 HA ARG 72 HA ARG 72 113.446 -20.365 -0.650 411 HB2 ARG 72 HB2 ARG 72 115.676 -19.668 0.247 412 HG2 ARG 72 HG2 ARG 72 115.650 -22.244 -1.360 413 HD2 ARG 72 HD2 ARG 72 117.780 -20.089 -1.068 414 HE ARG 72 HE ARG 72 117.679 -20.930 -3.392 415 HH11 ARG 72 HH21 ARG 72 119.687 -22.494 -1.289 416 HH12 ARG 72 HH22 ARG 72 119.820 -23.967 -2.191 417 HH21 ARG 72 HH11 ARG 72 117.287 -23.144 -4.413 418 HH22 ARG 72 HH12 ARG 72 118.461 -24.335 -3.961 419 H ILE 73 H ILE 73 112.669 -22.214 -1.612 420 HA ILE 73 HA ILE 73 113.329 -24.887 -0.686 421 HB ILE 73 HB ILE 73 111.762 -24.147 1.076 422 HG12 ILE 73 HG12 ILE 73 110.284 -26.067 -0.731 423 HG21 ILE 73 HG21 ILE 73 109.562 -23.395 0.619 424 HG22 ILE 73 HG22 ILE 73 109.631 -23.949 -1.054 425 HG23 ILE 73 HG23 ILE 73 110.566 -22.541 -0.552 426 HD11 ILE 73 HD11 ILE 73 110.663 -26.827 2.039 427 HD12 ILE 73 HD12 ILE 73 109.158 -26.575 1.155 428 HD13 ILE 73 HD13 ILE 73 109.957 -25.214 1.940 429 H ASN 74 H ASN 74 111.024 -22.860 -2.497 430 HA ASN 74 HA ASN 74 110.798 -25.018 -4.557 431 HB2 ASN 74 HB2 ASN 74 109.154 -22.544 -3.925 432 HD21 ASN 74 HD21 ASN 74 106.951 -23.245 -3.076 433 HD22 ASN 74 HD22 ASN 74 106.850 -24.683 -2.181 434 H ASP 75 H ASP 75 111.980 -24.720 -6.389 435 HA ASP 75 HA ASP 75 113.634 -22.471 -6.932 436 HB2 ASP 75 HB2 ASP 75 112.431 -24.616 -8.711 437 H TRP 76 H TRP 76 110.293 -23.170 -7.829 438 HA TRP 76 HA TRP 76 109.853 -21.320 -9.901 439 HB2 TRP 76 HB2 TRP 76 108.290 -23.051 -9.002 440 HD1 TRP 76 HD1 TRP 76 106.073 -20.407 -7.783 441 HE1 TRP 76 HE1 TRP 76 104.705 -19.381 -9.712 442 HE3 TRP 76 HE3 TRP 76 108.632 -22.294 -11.779 443 HZ2 TRP 76 HZ2 TRP 76 104.698 -19.363 -12.572 444 HZ3 TRP 76 HZ3 TRP 76 107.924 -21.757 -14.092 445 HH2 TRP 76 HH2 TRP 76 105.962 -20.294 -14.494 446 H ALA 77 H ALA 77 109.734 -20.713 -6.357 447 HA ALA 77 HA ALA 77 110.457 -17.917 -6.749 448 HB1 ALA 77 HB1 ALA 77 108.124 -17.907 -7.514 449 HB2 ALA 77 HB2 ALA 77 108.263 -17.019 -5.997 450 HB3 ALA 77 HB3 ALA 77 107.612 -18.658 -6.002 451 H SER 78 H SER 78 110.447 -16.709 -4.670 452 HA SER 78 HA SER 78 110.629 -18.528 -2.279 453 HB2 SER 78 HB2 SER 78 112.506 -17.116 -1.580 454 HG SER 78 HG SER 78 111.839 -15.154 -2.373 455 H ILE 79 H ILE 79 110.067 -17.398 -0.188 456 HA ILE 79 HA ILE 79 108.291 -15.018 -0.667 457 HB ILE 79 HB ILE 79 107.925 -17.350 1.245 458 HG12 ILE 79 HG12 ILE 79 106.393 -16.643 -1.278 459 HG21 ILE 79 HG21 ILE 79 106.034 -16.307 2.046 460 HG22 ILE 79 HG22 ILE 79 105.732 -15.460 0.529 461 HG23 ILE 79 HG23 ILE 79 106.969 -14.869 1.638 462 HD11 ILE 79 HD11 ILE 79 106.272 -19.325 0.000 463 HD12 ILE 79 HD12 ILE 79 104.994 -18.392 -0.781 464 HD13 ILE 79 HD13 ILE 79 105.481 -18.011 0.872 465 H TYR 80 H TYR 80 108.620 -13.296 0.709 466 HA TYR 80 HA TYR 80 110.123 -13.745 3.239 467 HB2 TYR 80 HB2 TYR 80 111.787 -12.092 2.616 468 HD1 TYR 80 HD2 TYR 80 110.522 -12.774 -0.798 469 HD2 TYR 80 HD1 TYR 80 111.107 -9.811 2.255 470 HE1 TYR 80 HE2 TYR 80 110.002 -10.986 -2.436 471 HE2 TYR 80 HE1 TYR 80 110.588 -8.021 0.619 472 HH TYR 80 HH TYR 80 109.973 -7.548 -1.476 473 H GLY 81 H GLY 81 109.974 -11.907 4.701 474 HA2 GLY 81 HA2 GLY 81 107.518 -10.278 4.224 475 H VAL 82 H VAL 82 107.758 -8.038 5.510 476 HA VAL 82 HA VAL 82 110.506 -6.936 5.222 477 HB VAL 82 HB VAL 82 109.614 -5.144 3.740 478 HG11 VAL 82 HG11 VAL 82 108.898 -7.835 2.582 479 HG12 VAL 82 HG12 VAL 82 110.570 -7.369 2.897 480 HG13 VAL 82 HG13 VAL 82 109.596 -6.442 1.755 481 HG21 VAL 82 HG21 VAL 82 107.392 -4.813 3.602 482 HG22 VAL 82 HG22 VAL 82 107.106 -6.243 4.591 483 HG23 VAL 82 HG23 VAL 82 107.212 -6.392 2.838 484 H VAL 83 H VAL 83 110.892 -5.501 6.876 485 HA VAL 83 HA VAL 83 108.631 -3.964 8.049 486 HB VAL 83 HB VAL 83 108.803 -6.093 9.295 487 HG11 VAL 83 HG11 VAL 83 110.887 -6.989 9.364 488 HG12 VAL 83 HG12 VAL 83 111.119 -5.951 10.770 489 HG13 VAL 83 HG13 VAL 83 111.671 -5.421 9.183 490 HG21 VAL 83 HG21 VAL 83 109.723 -3.577 10.698 491 HG22 VAL 83 HG22 VAL 83 109.312 -5.051 11.575 492 HG23 VAL 83 HG23 VAL 83 108.088 -4.229 10.605 493 H GLY 84 H GLY 84 109.377 -2.031 9.162 494 HA2 GLY 84 HA2 GLY 84 111.879 -1.299 9.952 495 H VAL 85 H VAL 85 112.214 1.152 8.507 496 HA VAL 85 HA VAL 85 109.716 2.608 9.320 497 HB VAL 85 HB VAL 85 111.534 2.699 10.984 498 HG11 VAL 85 HG11 VAL 85 113.094 3.986 8.722 499 HG12 VAL 85 HG12 VAL 85 113.439 2.425 9.467 500 HG13 VAL 85 HG13 VAL 85 113.626 3.907 10.403 501 HG21 VAL 85 HG21 VAL 85 111.263 4.957 11.435 502 HG22 VAL 85 HG22 VAL 85 109.981 4.730 10.244 503 HG23 VAL 85 HG23 VAL 85 111.525 5.430 9.757 504 H GLY 86 H GLY 86 109.062 4.270 8.108 505 HA2 GLY 86 HA2 GLY 86 110.696 5.083 5.723 506 H TYR 87 H TYR 87 111.110 7.294 5.700 507 HA TYR 87 HA TYR 87 109.088 9.120 6.853 508 HB2 TYR 87 HB2 TYR 87 110.638 10.015 8.498 509 HD1 TYR 87 HD2 TYR 87 112.422 6.823 8.039 510 HD2 TYR 87 HD1 TYR 87 112.644 11.093 7.641 511 HE1 TYR 87 HE2 TYR 87 114.882 6.670 7.758 512 HE2 TYR 87 HE1 TYR 87 115.103 10.941 7.364 513 HH TYR 87 HH TYR 87 116.877 8.251 8.152 514 H GLY 88 H GLY 88 109.646 11.422 6.394 515 HA2 GLY 88 HA2 GLY 88 111.683 11.731 4.241 516 H LYS 89 H LYS 89 112.495 13.886 4.040 517 HA LYS 89 HA LYS 89 112.200 15.494 6.532 518 HB2 LYS 89 HB2 LYS 89 114.424 14.659 5.668 519 HG2 LYS 89 HG2 LYS 89 114.103 17.677 5.674 520 HD2 LYS 89 HD2 LYS 89 116.426 17.527 6.681 521 HE2 LYS 89 HE2 LYS 89 115.645 16.976 3.873 522 HZ1 LYS 89 HZ1 LYS 89 117.867 16.368 3.258 523 HZ2 LYS 89 HZ2 LYS 89 117.362 15.293 4.473 524 HZ3 LYS 89 HZ3 LYS 89 118.428 16.563 4.847 525 H PHE 90 H PHE 90 111.010 17.345 6.445 526 HA PHE 90 HA PHE 90 110.515 18.616 3.770 527 HB2 PHE 90 HB2 PHE 90 108.714 18.259 6.189 528 HD1 PHE 90 HD1 PHE 90 109.024 15.810 6.085 529 HD2 PHE 90 HD2 PHE 90 107.749 18.064 2.660 530 HE1 PHE 90 HE1 PHE 90 108.315 13.712 4.968 531 HE2 PHE 90 HE2 PHE 90 107.042 15.968 1.541 532 HZ PHE 90 HZ PHE 90 107.324 13.791 2.696 533 H GLN 91 H GLN 91 110.126 20.974 3.898 534 HA GLN 91 HA GLN 91 110.749 23.141 4.597 535 HB2 GLN 91 HB2 GLN 91 110.246 21.776 7.263 536 HG2 GLN 91 HG2 GLN 91 108.428 23.408 5.461 537 HE21 GLN 91 HE21 GLN 91 106.126 23.323 6.336 538 HE22 GLN 91 HE22 GLN 91 105.904 23.246 8.017 539 H THR 92 H THR 92 112.989 21.717 3.915 540 HA THR 92 HA THR 92 114.946 21.524 6.057 541 HB THR 92 HB THR 92 116.481 21.125 4.171 542 HG1 THR 92 HG1 THR 92 115.939 22.506 2.625 543 HG21 THR 92 HG21 THR 92 114.715 19.407 4.906 544 HG22 THR 92 HG22 THR 92 115.451 19.166 3.322 545 HG23 THR 92 HG23 THR 92 113.837 19.863 3.447 546 H THR 93 H THR 93 116.888 22.921 6.192 547 HA THR 93 HA THR 93 116.189 25.774 5.846 548 HB THR 93 HB THR 93 117.112 24.903 7.962 549 HG1 THR 93 HG1 THR 93 118.561 26.513 8.211 550 HG21 THR 93 HG21 THR 93 118.683 23.298 7.880 551 HG22 THR 93 HG22 THR 93 119.834 24.515 7.331 552 HG23 THR 93 HG23 THR 93 118.927 23.566 6.154 553 H GLU 94 H GLU 94 117.665 27.268 4.779 554 HA GLU 94 HA GLU 94 118.596 26.425 2.211 555 HB2 GLU 94 HB2 GLU 94 119.240 28.841 3.936 556 HG2 GLU 94 HG2 GLU 94 117.197 28.366 1.741 557 H TYR 95 H TYR 95 120.232 26.710 5.336 558 HA TYR 95 HA TYR 95 122.886 26.179 4.137 559 HB2 TYR 95 HB2 TYR 95 121.736 26.896 6.817 560 HD1 TYR 95 HD1 TYR 95 124.985 27.281 4.984 561 HD2 TYR 95 HD2 TYR 95 121.441 29.194 6.479 562 HE1 TYR 95 HE1 TYR 95 125.888 29.487 4.301 563 HE2 TYR 95 HE2 TYR 95 122.344 31.400 5.797 564 HH TYR 95 HH TYR 95 124.910 32.297 5.421 565 HA PRO 96 HA PRO 96 122.652 21.825 4.776 566 HB2 PRO 96 HB2 PRO 96 125.286 21.229 5.223 567 HG2 PRO 96 HG2 PRO 96 126.131 23.345 5.554 568 HD2 PRO 96 HD2 PRO 96 124.908 25.230 5.088 569 H THR 97 H THR 97 122.030 20.705 6.572 570 HA THR 97 HA THR 97 121.643 20.255 8.865 571 HB THR 97 HB THR 97 123.785 19.590 9.941 572 HG1 THR 97 HG1 THR 97 125.643 20.266 9.163 573 HG21 THR 97 HG21 THR 97 124.030 18.825 7.053 574 HG22 THR 97 HG22 THR 97 122.581 18.360 7.946 575 HG23 THR 97 HG23 THR 97 124.167 17.815 8.492 576 H TYR 98 H TYR 98 121.510 23.115 8.328 577 HA TYR 98 HA TYR 98 123.063 24.722 10.090 578 HB2 TYR 98 HB2 TYR 98 121.558 25.501 8.264 579 HD1 TYR 98 HD2 TYR 98 123.031 27.357 9.019 580 HD2 TYR 98 HD1 TYR 98 119.432 26.322 11.120 581 HE1 TYR 98 HE2 TYR 98 123.101 29.531 10.207 582 HE2 TYR 98 HE1 TYR 98 119.501 28.497 12.311 583 HH TYR 98 HH TYR 98 121.467 31.057 11.344 584 H LYS 99 H LYS 99 119.975 23.018 10.641 585 HA LYS 99 HA LYS 99 120.477 23.203 13.579 586 HB2 LYS 99 HB2 LYS 99 118.159 23.911 13.908 587 HG2 LYS 99 HG2 LYS 99 117.971 23.710 10.885 588 HD2 LYS 99 HD2 LYS 99 116.129 24.902 12.970 589 HE2 LYS 99 HE2 LYS 99 114.628 25.112 10.782 590 HZ1 LYS 99 HZ1 LYS 99 114.271 24.007 12.985 591 HZ2 LYS 99 HZ2 LYS 99 114.895 22.576 12.315 592 HZ3 LYS 99 HZ3 LYS 99 113.467 23.256 11.695 593 H ASN 100 H ASN 100 118.658 21.721 14.683 594 HA ASN 100 HA ASN 100 119.039 19.036 13.680 595 HB2 ASN 100 HB2 ASN 100 118.698 19.840 16.075 596 HD21 ASN 100 HD21 ASN 100 115.757 18.235 16.202 597 HD22 ASN 100 HD22 ASN 100 116.322 16.635 16.229 598 H ASP 101 H ASP 101 118.093 18.637 11.681 599 HA ASP 101 HA ASP 101 115.548 19.698 10.826 600 HB2 ASP 101 HB2 ASP 101 117.255 17.359 9.914 601 H THR 102 H THR 102 113.519 18.629 10.724 602 HA THR 102 HA THR 102 113.267 16.189 12.454 603 HB THR 102 HB THR 102 111.297 18.447 11.967 604 HG1 THR 102 HG1 THR 102 111.911 19.099 14.042 605 HG21 THR 102 HG21 THR 102 110.331 17.391 14.129 606 HG22 THR 102 HG22 THR 102 111.301 15.982 13.699 607 HG23 THR 102 HG23 THR 102 110.044 16.557 12.602 608 H SER 103 H SER 103 112.236 14.448 11.516 609 HA SER 103 HA SER 103 110.791 14.897 8.925 610 HB2 SER 103 HB2 SER 103 112.695 12.653 9.668 611 HG SER 103 HG SER 103 114.183 13.791 8.716 612 H ASP 104 H ASP 104 108.979 13.519 8.598 613 HA ASP 104 HA ASP 104 107.857 12.317 11.061 614 HB2 ASP 104 HB2 ASP 104 106.839 12.725 8.229 615 H TYR 105 H TYR 105 107.941 10.107 11.468 616 HA TYR 105 HA TYR 105 108.586 8.298 9.165 617 HB2 TYR 105 HB2 TYR 105 110.081 7.116 10.674 618 HD1 TYR 105 HD2 TYR 105 109.762 10.208 12.691 619 HD2 TYR 105 HD1 TYR 105 109.150 5.959 12.572 620 HE1 TYR 105 HE2 TYR 105 109.356 10.198 15.137 621 HE2 TYR 105 HE1 TYR 105 108.744 5.947 15.018 622 HH TYR 105 HH TYR 105 109.350 7.386 16.988 623 H GLY 106 H GLY 106 107.987 5.947 9.742 624 HA2 GLY 106 HA2 GLY 106 105.880 5.609 11.762 625 H PHE 107 H PHE 107 104.957 3.210 11.424 626 HA PHE 107 HA PHE 107 107.358 1.479 11.127 627 HB2 PHE 107 HB2 PHE 107 104.573 1.096 12.272 628 HD1 PHE 107 HD1 PHE 107 107.910 0.144 13.570 629 HD2 PHE 107 HD2 PHE 107 104.691 2.980 13.775 630 HE1 PHE 107 HE1 PHE 107 108.897 1.114 15.627 631 HE2 PHE 107 HE2 PHE 107 105.678 3.950 15.833 632 HZ PHE 107 HZ PHE 107 107.781 3.017 16.759 633 H SER 108 H SER 108 107.519 -0.049 9.495 634 HA SER 108 HA SER 108 105.241 -0.201 7.555 635 HB2 SER 108 HB2 SER 108 108.224 -0.588 7.174 636 HG SER 108 HG SER 108 108.140 1.439 6.266 637 H TYR 109 H TYR 109 104.817 -2.273 6.578 638 HA TYR 109 HA TYR 109 106.192 -4.673 7.560 639 HB2 TYR 109 HB2 TYR 109 104.278 -5.563 8.742 640 HD1 TYR 109 HD2 TYR 109 103.123 -2.038 8.602 641 HD2 TYR 109 HD1 TYR 109 102.279 -6.111 7.532 642 HE1 TYR 109 HE2 TYR 109 100.814 -1.393 7.964 643 HE2 TYR 109 HE1 TYR 109 99.971 -5.467 6.895 644 HH TYR 109 HH TYR 109 98.711 -3.536 6.259 645 H GLY 110 H GLY 110 105.560 -6.578 6.262 646 HA2 GLY 110 HA2 GLY 110 103.456 -6.912 4.526 647 H ALA 111 H ALA 111 104.453 -7.834 2.173 648 HA ALA 111 HA ALA 111 106.929 -9.376 2.541 649 HB1 ALA 111 HB1 ALA 111 104.275 -10.834 2.362 650 HB2 ALA 111 HB2 ALA 111 105.074 -10.500 3.899 651 HB3 ALA 111 HB3 ALA 111 105.861 -11.528 2.702 652 H GLY 112 H GLY 112 107.321 -10.768 0.485 653 HA2 GLY 112 HA2 GLY 112 105.535 -10.147 -1.775 654 H LEU 113 H LEU 113 106.854 -11.104 -3.869 655 HA LEU 113 HA LEU 113 108.230 -13.635 -3.080 656 HB2 LEU 113 HB2 LEU 113 106.644 -14.853 -4.620 657 HG LEU 113 HG LEU 113 105.991 -12.480 -5.646 658 HD11 LEU 113 HD11 LEU 113 104.308 -13.597 -6.785 659 HD12 LEU 113 HD12 LEU 113 103.701 -14.386 -5.328 660 HD13 LEU 113 HD13 LEU 113 105.178 -14.968 -6.097 661 HD21 LEU 113 HD21 LEU 113 103.499 -12.256 -4.587 662 HD22 LEU 113 HD22 LEU 113 104.871 -11.300 -4.029 663 HD23 LEU 113 HD23 LEU 113 104.397 -12.754 -3.153 664 H GLN 114 H GLN 114 109.641 -14.432 -4.725 665 HA GLN 114 HA GLN 114 110.016 -12.595 -7.064 666 HB2 GLN 114 HB2 GLN 114 111.796 -12.679 -5.322 667 HG2 GLN 114 HG2 GLN 114 112.502 -13.913 -8.003 668 HE21 GLN 114 HE21 GLN 114 114.420 -11.298 -6.980 669 HE22 GLN 114 HE22 GLN 114 115.741 -12.179 -6.381 670 H PHE 115 H PHE 115 110.388 -13.550 -9.118 671 HA PHE 115 HA PHE 115 109.757 -16.478 -9.327 672 HB2 PHE 115 HB2 PHE 115 109.133 -14.098 -11.101 673 HD1 PHE 115 HD1 PHE 115 107.209 -17.176 -10.374 674 HD2 PHE 115 HD2 PHE 115 107.711 -13.003 -9.488 675 HE1 PHE 115 HE1 PHE 115 105.040 -17.170 -9.172 676 HE2 PHE 115 HE2 PHE 115 105.544 -12.998 -8.283 677 HZ PHE 115 HZ PHE 115 104.207 -15.080 -8.127 678 H ASN 116 H ASN 116 110.760 -17.523 -11.279 679 HA ASN 116 HA ASN 116 113.421 -16.296 -11.936 680 HB2 ASN 116 HB2 ASN 116 112.475 -19.084 -11.304 681 HD21 ASN 116 HD21 ASN 116 114.486 -20.044 -9.923 682 HD22 ASN 116 HD22 ASN 116 115.125 -18.961 -8.783 683 HA PRO 117 HA PRO 117 110.977 -16.732 -15.865 684 HB2 PRO 117 HB2 PRO 117 111.954 -14.434 -16.999 685 HG2 PRO 117 HG2 PRO 117 113.356 -13.758 -15.286 686 HD2 PRO 117 HD2 PRO 117 113.203 -14.623 -13.148 687 H MET 118 H MET 118 114.327 -16.506 -15.025 688 HA MET 118 HA MET 118 115.061 -17.975 -17.468 689 HB2 MET 118 HB2 MET 118 116.419 -15.420 -16.544 690 HG2 MET 118 HG2 MET 118 114.643 -16.013 -18.929 691 HE1 MET 118 HE1 MET 118 116.857 -16.129 -19.890 692 HE2 MET 118 HE2 MET 118 117.877 -14.781 -20.390 693 HE3 MET 118 HE3 MET 118 116.369 -15.101 -21.244 694 H GLU 119 H GLU 119 117.599 -18.357 -17.135 695 HA GLU 119 HA GLU 119 117.878 -19.925 -14.735 696 HB2 GLU 119 HB2 GLU 119 120.091 -20.402 -15.658 697 HG2 GLU 119 HG2 GLU 119 119.530 -18.019 -17.451 698 H ASN 120 H ASN 120 119.272 -16.770 -15.739 699 HA ASN 120 HA ASN 120 120.255 -16.439 -12.924 700 HB2 ASN 120 HB2 ASN 120 121.250 -15.348 -15.570 701 HD21 ASN 120 HD21 ASN 120 121.963 -17.420 -12.698 702 HD22 ASN 120 HD22 ASN 120 122.938 -18.516 -13.548 703 H VAL 121 H VAL 121 117.643 -15.508 -14.582 704 HA VAL 121 HA VAL 121 117.819 -12.642 -13.696 705 HB VAL 121 HB VAL 121 115.928 -13.888 -15.713 706 HG11 VAL 121 HG11 VAL 121 116.475 -11.143 -14.687 707 HG12 VAL 121 HG12 VAL 121 114.946 -11.880 -15.165 708 HG13 VAL 121 HG13 VAL 121 116.075 -11.315 -16.397 709 HG21 VAL 121 HG21 VAL 121 117.906 -14.121 -16.892 710 HG22 VAL 121 HG22 VAL 121 118.724 -12.863 -15.967 711 HG23 VAL 121 HG23 VAL 121 117.585 -12.422 -17.238 712 H ALA 122 H ALA 122 116.335 -11.939 -12.207 713 HA ALA 122 HA ALA 122 114.047 -13.753 -11.520 714 HB1 ALA 122 HB1 ALA 122 116.361 -13.686 -10.113 715 HB2 ALA 122 HB2 ALA 122 114.795 -14.017 -9.371 716 HB3 ALA 122 HB3 ALA 122 115.478 -12.393 -9.302 717 H LEU 123 H LEU 123 112.168 -12.679 -11.139 718 HA LEU 123 HA LEU 123 112.232 -9.683 -10.948 719 HB2 LEU 123 HB2 LEU 123 111.135 -10.803 -12.934 720 HG LEU 123 HG LEU 123 109.484 -9.193 -10.980 721 HD11 LEU 123 HD11 LEU 123 110.351 -7.377 -12.046 722 HD12 LEU 123 HD12 LEU 123 110.264 -8.144 -13.631 723 HD13 LEU 123 HD13 LEU 123 111.614 -8.499 -12.552 724 HD21 LEU 123 HD21 LEU 123 107.822 -10.313 -12.269 725 HD22 LEU 123 HD22 LEU 123 108.780 -10.198 -13.744 726 HD23 LEU 123 HD23 LEU 123 108.036 -8.753 -13.061 727 H ASP 124 H ASP 124 110.935 -8.739 -9.159 728 HA ASP 124 HA ASP 124 109.611 -10.726 -7.379 729 HB2 ASP 124 HB2 ASP 124 112.010 -10.454 -6.741 730 H PHE 125 H PHE 125 107.887 -9.854 -6.215 731 HA PHE 125 HA PHE 125 107.322 -6.933 -6.631 732 HB2 PHE 125 HB2 PHE 125 105.474 -9.337 -6.408 733 HD1 PHE 125 HD2 PHE 125 105.397 -6.406 -8.671 734 HD2 PHE 125 HD1 PHE 125 106.381 -10.568 -8.274 735 HE1 PHE 125 HE2 PHE 125 105.646 -6.581 -11.132 736 HE2 PHE 125 HE1 PHE 125 106.629 -10.744 -10.735 737 HZ PHE 125 HZ PHE 125 106.260 -8.751 -12.164 738 H SER 126 H SER 126 106.726 -5.792 -4.734 739 HA SER 126 HA SER 126 106.523 -7.407 -2.215 740 HB2 SER 126 HB2 SER 126 108.797 -6.440 -2.635 741 HG SER 126 HG SER 126 107.489 -5.124 -0.507 742 H TYR 127 H TYR 127 104.989 -6.682 -0.775 743 HA TYR 127 HA TYR 127 103.538 -4.142 -1.453 744 HB2 TYR 127 HB2 TYR 127 102.268 -6.236 -1.855 745 HD1 TYR 127 HD2 TYR 127 100.831 -4.267 -2.357 746 HD2 TYR 127 HD1 TYR 127 101.329 -5.751 1.643 747 HE1 TYR 127 HE2 TYR 127 98.846 -2.971 -1.630 748 HE2 TYR 127 HE1 TYR 127 99.344 -4.454 2.371 749 HH TYR 127 HH TYR 127 97.164 -3.531 1.037 750 H GLU 128 H GLU 128 104.227 -2.653 0.054 751 HA GLU 128 HA GLU 128 104.149 -3.444 2.933 752 HB2 GLU 128 HB2 GLU 128 106.457 -3.640 1.989 753 HG2 GLU 128 HG2 GLU 128 105.989 -1.374 3.951 754 H GLN 129 H GLN 129 103.473 -1.760 4.289 755 HA GLN 129 HA GLN 129 103.096 0.945 3.070 756 HB2 GLN 129 HB2 GLN 129 100.807 0.953 4.031 757 HG2 GLN 129 HG2 GLN 129 101.466 -1.917 4.768 758 HE21 GLN 129 HE21 GLN 129 99.594 -2.872 3.763 759 HE22 GLN 129 HE22 GLN 129 98.009 -2.449 4.197 760 H SER 130 H SER 130 103.120 2.659 4.660 761 HA SER 130 HA SER 130 103.992 1.808 7.403 762 HB2 SER 130 HB2 SER 130 105.821 2.622 5.904 763 HG SER 130 HG SER 130 106.242 3.033 7.974 764 H ARG 131 H ARG 131 102.995 2.905 9.098 765 HA ARG 131 HA ARG 131 101.325 5.294 8.418 766 HB2 ARG 131 HB2 ARG 131 100.548 2.814 9.978 767 HG2 ARG 131 HG2 ARG 131 99.618 4.007 7.355 768 HD2 ARG 131 HD2 ARG 131 98.035 2.041 7.334 769 HE ARG 131 HE ARG 131 97.685 4.513 8.449 770 HH11 ARG 131 HH21 ARG 131 95.919 1.711 8.290 771 HH12 ARG 131 HH22 ARG 131 94.853 2.077 9.605 772 HH21 ARG 131 HH11 ARG 131 96.658 4.849 10.644 773 HH22 ARG 131 HH12 ARG 131 95.270 3.855 10.937 774 H ILE 132 H ILE 132 101.428 6.912 9.968 775 HA ILE 132 HA ILE 132 102.570 6.206 12.638 776 HB ILE 132 HB ILE 132 104.305 7.124 11.113 777 HG12 ILE 132 HG12 ILE 132 104.899 9.126 12.610 778 HG21 ILE 132 HG21 ILE 132 104.018 9.005 9.865 779 HG22 ILE 132 HG22 ILE 132 103.141 9.841 11.148 780 HG23 ILE 132 HG23 ILE 132 102.300 8.690 10.110 781 HD11 ILE 132 HD11 ILE 132 104.465 6.297 13.362 782 HD12 ILE 132 HD12 ILE 132 104.672 7.406 14.718 783 HD13 ILE 132 HD13 ILE 132 105.922 7.282 13.480 784 H ARG 133 H ARG 133 99.990 6.341 12.721 785 HA ARG 133 HA ARG 133 98.150 7.413 13.660 786 HB2 ARG 133 HB2 ARG 133 100.384 9.283 14.492 787 HG2 ARG 133 HG2 ARG 133 98.951 7.011 15.902 788 HD2 ARG 133 HD2 ARG 133 100.635 7.457 17.707 789 HE ARG 133 HE ARG 133 99.148 9.957 17.526 790 HH11 ARG 133 HH11 ARG 133 99.032 8.010 19.824 791 HH12 ARG 133 HH12 ARG 133 97.430 7.372 19.666 792 HH21 ARG 133 HH21 ARG 133 97.018 8.500 16.412 793 HH22 ARG 133 HH22 ARG 133 96.288 7.650 17.733 794 H SER 134 H SER 134 100.204 10.083 12.407 795 HA SER 134 HA SER 134 97.764 11.382 11.351 796 HB2 SER 134 HB2 SER 134 99.179 13.320 11.237 797 HG SER 134 HG SER 134 101.113 12.961 10.558 798 H VAL 135 H VAL 135 100.486 9.502 10.139 799 HA VAL 135 HA VAL 135 99.626 10.292 7.365 800 HB VAL 135 HB VAL 135 102.413 9.672 8.392 801 HG11 VAL 135 HG11 VAL 135 101.810 9.123 5.954 802 HG12 VAL 135 HG12 VAL 135 103.191 10.190 6.208 803 HG13 VAL 135 HG13 VAL 135 101.633 10.862 5.728 804 HG21 VAL 135 HG21 VAL 135 102.109 11.808 9.208 805 HG22 VAL 135 HG22 VAL 135 100.845 12.186 8.037 806 HG23 VAL 135 HG23 VAL 135 102.540 12.223 7.549 807 H ASP 136 H ASP 136 99.160 8.615 6.020 808 HA ASP 136 HA ASP 136 100.072 5.856 6.765 809 HB2 ASP 136 HB2 ASP 136 97.719 6.272 7.415 810 H VAL 137 H VAL 137 101.493 5.318 5.039 811 HA VAL 137 HA VAL 137 100.673 6.157 2.292 812 HB VAL 137 HB VAL 137 103.417 5.458 3.388 813 HG11 VAL 137 HG11 VAL 137 102.329 6.387 0.779 814 HG12 VAL 137 HG12 VAL 137 103.690 5.319 1.116 815 HG13 VAL 137 HG13 VAL 137 103.875 7.065 1.287 816 HG21 VAL 137 HG21 VAL 137 102.942 8.282 2.753 817 HG22 VAL 137 HG22 VAL 137 103.693 7.564 4.178 818 HG23 VAL 137 HG23 VAL 137 101.941 7.716 4.090 819 H GLY 138 H GLY 138 100.728 4.536 0.674 820 HA2 GLY 138 HA2 GLY 138 101.465 1.775 1.549 821 H THR 139 H THR 139 103.193 1.219 0.284 822 HA THR 139 HA THR 139 103.046 1.831 -2.640 823 HB THR 139 HB THR 139 104.361 3.540 -1.381 824 HG1 THR 139 HG1 THR 139 106.285 3.236 -2.682 825 HG21 THR 139 HG21 THR 139 106.397 1.377 -0.863 826 HG22 THR 139 HG22 THR 139 105.153 1.763 0.326 827 HG23 THR 139 HG23 THR 139 106.311 2.998 -0.170 828 H TRP 140 H TRP 140 104.292 0.384 -3.967 829 HA TRP 140 HA TRP 140 105.260 -2.100 -2.590 830 HB2 TRP 140 HB2 TRP 140 104.301 -3.318 -4.546 831 HD1 TRP 140 HD1 TRP 140 105.084 -2.312 -6.904 832 HE1 TRP 140 HE1 TRP 140 103.887 -0.738 -8.558 833 HE3 TRP 140 HE3 TRP 140 101.433 -0.445 -3.860 834 HZ2 TRP 140 HZ2 TRP 140 101.671 1.072 -8.586 835 HZ3 TRP 140 HZ3 TRP 140 99.794 1.199 -4.724 836 HH2 TRP 140 HH2 TRP 140 99.909 1.961 -7.081 837 H ILE 141 H ILE 141 107.149 -3.035 -3.509 838 HA ILE 141 HA ILE 141 108.575 -1.308 -5.506 839 HB ILE 141 HB ILE 141 109.623 -3.241 -3.411 840 HG12 ILE 141 HG12 ILE 141 109.617 -0.206 -3.396 841 HG21 ILE 141 HG21 ILE 141 110.884 -2.248 -5.688 842 HG22 ILE 141 HG22 ILE 141 111.687 -2.898 -4.261 843 HG23 ILE 141 HG23 ILE 141 111.422 -1.161 -4.407 844 HD11 ILE 141 HD11 ILE 141 110.849 -2.331 -1.745 845 HD12 ILE 141 HD12 ILE 141 110.042 -1.053 -0.837 846 HD13 ILE 141 HD13 ILE 141 111.337 -0.650 -1.965 847 H ALA 142 H ALA 142 109.434 -2.286 -7.363 848 HA ALA 142 HA ALA 142 109.344 -5.261 -7.579 849 HB1 ALA 142 HB1 ALA 142 107.565 -5.212 -8.978 850 HB2 ALA 142 HB2 ALA 142 108.336 -3.986 -9.985 851 HB3 ALA 142 HB3 ALA 142 107.376 -3.503 -8.587 852 H GLY 143 H GLY 143 110.938 -6.059 -9.027 853 HA2 GLY 143 HA2 GLY 143 112.246 -4.453 -11.007 854 H VAL 144 H VAL 144 114.913 -5.647 -10.139 855 HA VAL 144 HA VAL 144 114.417 -8.394 -11.247 856 HB VAL 144 HB VAL 144 116.726 -8.139 -12.158 857 HG11 VAL 144 HG11 VAL 144 116.122 -6.093 -13.650 858 HG12 VAL 144 HG12 VAL 144 114.602 -6.088 -12.755 859 HG13 VAL 144 HG13 VAL 144 115.066 -7.505 -13.697 860 HG21 VAL 144 HG21 VAL 144 117.117 -6.312 -10.196 861 HG22 VAL 144 HG22 VAL 144 116.722 -5.229 -11.531 862 HG23 VAL 144 HG23 VAL 144 118.078 -6.346 -11.675 863 H GLY 145 H GLY 145 116.411 -9.887 -10.657 864 HA2 GLY 145 HA2 GLY 145 117.618 -9.381 -8.052 865 H TYR 146 H TYR 146 119.321 -10.760 -7.610 866 HA TYR 146 HA TYR 146 119.832 -13.006 -9.530 867 HB2 TYR 146 HB2 TYR 146 121.765 -10.918 -8.459 868 HD1 TYR 146 HD2 TYR 146 121.117 -12.387 -11.825 869 HD2 TYR 146 HD1 TYR 146 120.841 -8.909 -9.320 870 HE1 TYR 146 HE2 TYR 146 120.474 -11.021 -13.792 871 HE2 TYR 146 HE1 TYR 146 120.197 -7.543 -11.287 872 HH TYR 146 HH TYR 146 119.256 -7.816 -13.485 873 H ARG 147 H ARG 147 121.214 -14.714 -8.574 874 HA ARG 147 HA ARG 147 121.219 -14.653 -5.566 875 HB2 ARG 147 HB2 ARG 147 120.675 -16.911 -7.516 876 HG2 ARG 147 HG2 ARG 147 118.945 -15.442 -5.502 877 HD2 ARG 147 HD2 ARG 147 117.136 -16.957 -6.458 878 HE ARG 147 HE ARG 147 118.073 -17.488 -4.246 879 HH11 ARG 147 HH21 ARG 147 118.215 -19.904 -6.455 880 HH12 ARG 147 HH22 ARG 147 119.530 -20.773 -5.738 881 HH21 ARG 147 HH11 ARG 147 120.347 -18.238 -3.520 882 HH22 ARG 147 HH12 ARG 147 120.737 -19.830 -4.078 883 H PHE 148 H PHE 148 123.255 -14.758 -4.745 884 HA PHE 148 HA PHE 148 125.569 -15.205 -4.557 885 HB2 PHE 148 HB2 PHE 148 124.562 -17.488 -4.510 886 HD1 PHE 148 HD1 PHE 148 126.562 -17.428 -3.048 887 HD2 PHE 148 HD2 PHE 148 126.892 -17.901 -7.305 888 HE1 PHE 148 HE1 PHE 148 128.909 -18.180 -2.782 889 HE2 PHE 148 HE2 PHE 148 129.240 -18.654 -7.038 890 HZ PHE 148 HZ PHE 148 130.248 -18.794 -4.777 Start of MODEL 7 1 H THR 2 H THR 2 124.648 -17.583 3.430 2 HA THR 2 HA THR 2 126.413 -17.520 1.007 3 HB THR 2 HB THR 2 124.386 -18.012 -0.308 4 HG1 THR 2 HG1 THR 2 122.856 -17.085 1.038 5 HG21 THR 2 HG21 THR 2 124.199 -20.106 1.785 6 HG22 THR 2 HG22 THR 2 125.808 -19.809 1.128 7 HG23 THR 2 HG23 THR 2 124.488 -20.266 0.053 8 H SER 3 H SER 3 125.518 -15.787 -0.587 9 HA SER 3 HA SER 3 124.482 -13.444 0.985 10 HB2 SER 3 HB2 SER 3 126.401 -13.571 -1.367 11 HG SER 3 HG SER 3 127.941 -13.412 0.079 12 H THR 4 H THR 4 122.809 -12.232 -0.030 13 HA THR 4 HA THR 4 121.945 -13.164 -2.737 14 HB THR 4 HB THR 4 120.210 -12.786 -0.284 15 HG1 THR 4 HG1 THR 4 121.095 -15.095 -1.662 16 HG21 THR 4 HG21 THR 4 119.252 -14.200 -2.712 17 HG22 THR 4 HG22 THR 4 119.415 -12.448 -2.838 18 HG23 THR 4 HG23 THR 4 118.373 -13.150 -1.601 19 H VAL 5 H VAL 5 121.110 -11.539 -4.010 20 HA VAL 5 HA VAL 5 120.903 -8.799 -2.787 21 HB VAL 5 HB VAL 5 121.801 -7.979 -4.960 22 HG11 VAL 5 HG11 VAL 5 123.710 -10.120 -4.113 23 HG12 VAL 5 HG12 VAL 5 123.210 -8.931 -2.910 24 HG13 VAL 5 HG13 VAL 5 124.004 -8.404 -4.395 25 HG21 VAL 5 HG21 VAL 5 122.641 -9.561 -6.610 26 HG22 VAL 5 HG22 VAL 5 120.939 -9.909 -6.310 27 HG23 VAL 5 HG23 VAL 5 122.187 -10.923 -5.586 28 H THR 6 H THR 6 119.096 -7.592 -3.387 29 HA THR 6 HA THR 6 117.355 -8.471 -5.604 30 HB THR 6 HB THR 6 116.505 -8.508 -2.686 31 HG1 THR 6 HG1 THR 6 117.512 -10.369 -2.964 32 HG21 THR 6 HG21 THR 6 114.905 -7.927 -4.802 33 HG22 THR 6 HG22 THR 6 114.344 -8.774 -3.361 34 HG23 THR 6 HG23 THR 6 114.799 -9.687 -4.798 35 H GLY 7 H GLY 7 116.469 -6.591 -6.488 36 HA2 GLY 7 HA2 GLY 7 115.614 -4.392 -4.780 37 H GLY 8 H GLY 8 115.061 -2.420 -6.301 38 HA2 GLY 8 HA2 GLY 8 114.608 -2.773 -9.079 39 H TYR 9 H TYR 9 111.658 -1.731 -8.243 40 HA TYR 9 HA TYR 9 112.434 1.002 -7.356 41 HB2 TYR 9 HB2 TYR 9 111.443 2.010 -9.337 42 HD1 TYR 9 HD2 TYR 9 111.861 -1.400 -10.725 43 HD2 TYR 9 HD1 TYR 9 109.083 1.726 -9.742 44 HE1 TYR 9 HE2 TYR 9 110.087 -2.574 -12.000 45 HE2 TYR 9 HE1 TYR 9 107.310 0.551 -11.018 46 HH TYR 9 HH TYR 9 107.339 -1.178 -13.036 47 H ALA 10 H ALA 10 110.422 2.304 -6.757 48 HA ALA 10 HA ALA 10 107.995 0.584 -6.442 49 HB1 ALA 10 HB1 ALA 10 109.210 0.203 -4.427 50 HB2 ALA 10 HB2 ALA 10 107.975 1.391 -4.010 51 HB3 ALA 10 HB3 ALA 10 109.640 1.906 -4.279 52 H GLN 11 H GLN 11 106.092 1.724 -6.450 53 HA GLN 11 HA GLN 11 106.238 4.719 -6.527 54 HB2 GLN 11 HB2 GLN 11 104.473 4.581 -8.263 55 HG2 GLN 11 HG2 GLN 11 104.846 1.581 -7.981 56 HE21 GLN 11 HE21 GLN 11 101.923 3.115 -9.153 57 HE22 GLN 11 HE22 GLN 11 102.122 2.694 -10.785 58 H SER 12 H SER 12 104.543 5.741 -5.308 59 HA SER 12 HA SER 12 102.500 3.932 -4.086 60 HB2 SER 12 HB2 SER 12 104.098 5.804 -2.368 61 HG SER 12 HG SER 12 105.800 4.711 -2.878 62 H ASP 13 H ASP 13 100.639 4.997 -3.345 63 HA ASP 13 HA ASP 13 100.068 7.645 -4.451 64 HB2 ASP 13 HB2 ASP 13 98.453 5.702 -4.197 65 H ALA 14 H ALA 14 99.801 9.590 -3.111 66 HA ALA 14 HA ALA 14 100.944 9.291 -0.353 67 HB1 ALA 14 HB1 ALA 14 102.322 11.126 -0.775 68 HB2 ALA 14 HB2 ALA 14 101.280 11.738 -2.058 69 HB3 ALA 14 HB3 ALA 14 102.297 10.325 -2.345 70 H GLN 15 H GLN 15 99.031 9.456 0.832 71 HA GLN 15 HA GLN 15 97.004 11.486 0.228 72 HB2 GLN 15 HB2 GLN 15 97.501 9.580 2.540 73 HG2 GLN 15 HG2 GLN 15 95.510 9.516 0.249 74 HE21 GLN 15 HE21 GLN 15 94.344 7.355 0.235 75 HE22 GLN 15 HE22 GLN 15 94.054 6.576 1.715 76 H GLY 16 H GLY 16 97.458 13.598 0.690 77 HA2 GLY 16 HA2 GLY 16 97.713 15.312 2.432 78 H GLN 17 H GLN 17 99.930 13.626 0.395 79 HA GLN 17 HA GLN 17 101.845 15.922 0.432 80 HB2 GLN 17 HB2 GLN 17 102.012 13.092 -0.644 81 HG2 GLN 17 HG2 GLN 17 103.347 14.475 1.704 82 HE21 GLN 17 HE21 GLN 17 104.518 12.701 3.069 83 HE22 GLN 17 HE22 GLN 17 105.365 11.510 2.205 84 H MET 18 H MET 18 102.746 16.396 -1.874 85 HA MET 18 HA MET 18 100.697 17.407 -3.530 86 HB2 MET 18 HB2 MET 18 103.566 16.618 -4.095 87 HG2 MET 18 HG2 MET 18 102.196 19.219 -3.344 88 HE1 MET 18 HE1 MET 18 103.986 20.969 -5.972 89 HE2 MET 18 HE2 MET 18 102.500 20.304 -5.299 90 HE3 MET 18 HE3 MET 18 103.494 19.316 -6.366 91 H ASN 19 H ASN 19 102.622 14.362 -4.100 92 HA ASN 19 HA ASN 19 100.286 13.140 -5.370 93 HB2 ASN 19 HB2 ASN 19 101.282 13.038 -7.592 94 HD21 ASN 19 HD21 ASN 19 103.100 13.893 -9.054 95 HD22 ASN 19 HD22 ASN 19 104.668 13.965 -8.407 96 H LYS 20 H LYS 20 101.860 11.241 -6.898 97 HA LYS 20 HA LYS 20 102.752 9.504 -4.698 98 HB2 LYS 20 HB2 LYS 20 102.786 7.815 -6.454 99 HG2 LYS 20 HG2 LYS 20 102.511 10.162 -8.357 100 HD2 LYS 20 HD2 LYS 20 102.274 7.173 -8.762 101 HE2 LYS 20 HE2 LYS 20 102.543 9.305 -10.914 102 HZ1 LYS 20 HZ1 LYS 20 102.287 6.340 -10.833 103 HZ2 LYS 20 HZ2 LYS 20 102.634 7.217 -12.246 104 HZ3 LYS 20 HZ3 LYS 20 101.154 7.443 -11.444 105 H MET 21 H MET 21 104.869 8.280 -4.963 106 HA MET 21 HA MET 21 107.010 10.042 -6.118 107 HB2 MET 21 HB2 MET 21 106.899 8.473 -3.525 108 HG2 MET 21 HG2 MET 21 107.069 11.435 -4.163 109 HE1 MET 21 HE1 MET 21 106.340 12.356 -0.422 110 HE2 MET 21 HE2 MET 21 105.750 12.476 -2.078 111 HE3 MET 21 HE3 MET 21 107.286 13.221 -1.641 112 H GLY 22 H GLY 22 109.079 8.796 -6.478 113 HA2 GLY 22 HA2 GLY 22 108.719 5.875 -6.937 114 H GLY 23 H GLY 23 110.577 4.794 -6.342 115 HA2 GLY 23 HA2 GLY 23 113.177 6.205 -6.702 116 H PHE 24 H PHE 24 114.822 4.472 -5.380 117 HA PHE 24 HA PHE 24 114.328 1.841 -6.744 118 HB2 PHE 24 HB2 PHE 24 116.881 3.432 -6.310 119 HD1 PHE 24 HD2 PHE 24 115.652 1.502 -9.227 120 HD2 PHE 24 HD1 PHE 24 116.195 5.403 -7.513 121 HE1 PHE 24 HE2 PHE 24 115.133 2.538 -11.420 122 HE2 PHE 24 HE1 PHE 24 115.675 6.439 -9.705 123 HZ PHE 24 HZ PHE 24 115.144 5.005 -11.659 124 H ASN 25 H ASN 25 115.430 0.009 -5.626 125 HA ASN 25 HA ASN 25 116.176 0.525 -2.793 126 HB2 ASN 25 HB2 ASN 25 114.467 -1.038 -1.993 127 HD21 ASN 25 HD21 ASN 25 112.953 -2.722 -2.467 128 HD22 ASN 25 HD22 ASN 25 112.695 -3.318 -4.035 129 H LEU 26 H LEU 26 117.725 -0.836 -2.086 130 HA LEU 26 HA LEU 26 118.389 -3.265 -3.734 131 HB2 LEU 26 HB2 LEU 26 120.132 -1.552 -1.917 132 HG LEU 26 HG LEU 26 119.411 -0.320 -3.936 133 HD11 LEU 26 HD11 LEU 26 122.208 -1.178 -4.569 134 HD12 LEU 26 HD12 LEU 26 121.896 -0.461 -2.988 135 HD13 LEU 26 HD13 LEU 26 121.533 0.448 -4.457 136 HD21 LEU 26 HD21 LEU 26 120.370 -1.320 -6.149 137 HD22 LEU 26 HD22 LEU 26 118.855 -1.973 -5.524 138 HD23 LEU 26 HD23 LEU 26 120.363 -2.852 -5.273 139 H LYS 27 H LYS 27 118.834 -5.277 -2.421 140 HA LYS 27 HA LYS 27 118.145 -4.968 0.463 141 HB2 LYS 27 HB2 LYS 27 117.070 -6.991 -1.531 142 HG2 LYS 27 HG2 LYS 27 115.771 -4.633 -0.139 143 HD2 LYS 27 HD2 LYS 27 114.588 -6.841 -1.848 144 HE2 LYS 27 HE2 LYS 27 113.510 -4.159 -0.948 145 HZ1 LYS 27 HZ1 LYS 27 112.115 -5.985 -0.140 146 HZ2 LYS 27 HZ2 LYS 27 112.031 -6.632 -1.708 147 HZ3 LYS 27 HZ3 LYS 27 111.327 -5.123 -1.370 148 H TYR 28 H TYR 28 119.325 -6.365 1.797 149 HA TYR 28 HA TYR 28 121.211 -8.272 0.442 150 HB2 TYR 28 HB2 TYR 28 121.520 -6.633 2.988 151 HD1 TYR 28 HD1 TYR 28 123.737 -7.263 0.063 152 HD2 TYR 28 HD2 TYR 28 121.259 -4.425 2.126 153 HE1 TYR 28 HE1 TYR 28 124.586 -5.453 -1.406 154 HE2 TYR 28 HE2 TYR 28 122.108 -2.616 0.659 155 HH TYR 28 HH TYR 28 123.118 -2.445 -1.649 156 H ARG 29 H ARG 29 120.719 -10.392 1.004 157 HA ARG 29 HA ARG 29 119.274 -10.804 3.601 158 HB2 ARG 29 HB2 ARG 29 117.875 -11.066 1.590 159 HG2 ARG 29 HG2 ARG 29 118.545 -13.738 2.869 160 HD2 ARG 29 HD2 ARG 29 116.076 -14.134 2.442 161 HE ARG 29 HE ARG 29 118.253 -14.105 0.511 162 HH11 ARG 29 HH21 ARG 29 115.080 -13.687 -0.246 163 HH12 ARG 29 HH22 ARG 29 114.849 -15.213 -1.032 164 HH21 ARG 29 HH11 ARG 29 117.887 -16.513 0.020 165 HH22 ARG 29 HH12 ARG 29 116.438 -16.814 -0.882 166 H TYR 30 H TYR 30 119.878 -12.475 4.868 167 HA TYR 30 HA TYR 30 122.321 -14.031 4.089 168 HB2 TYR 30 HB2 TYR 30 122.550 -12.427 5.969 169 HD1 TYR 30 HD1 TYR 30 124.672 -13.715 5.554 170 HD2 TYR 30 HD2 TYR 30 121.497 -15.244 8.008 171 HE1 TYR 30 HE1 TYR 30 126.232 -15.371 6.541 172 HE2 TYR 30 HE2 TYR 30 123.056 -16.899 8.995 173 HH TYR 30 HH TYR 30 125.414 -17.237 9.317 174 H GLU 31 H GLU 31 122.084 -16.266 4.051 175 HA GLU 31 HA GLU 31 119.745 -17.497 5.434 176 HB2 GLU 31 HB2 GLU 31 120.508 -17.844 2.513 177 HG2 GLU 31 HG2 GLU 31 119.360 -15.701 2.971 178 H GLU 32 H GLU 32 120.092 -19.790 5.866 179 HA GLU 32 HA GLU 32 122.964 -20.559 5.845 180 HB2 GLU 32 HB2 GLU 32 120.497 -21.600 7.269 181 HG2 GLU 32 HG2 GLU 32 121.361 -19.379 8.005 182 H ASP 33 H ASP 33 122.953 -23.216 5.797 183 HA ASP 33 HA ASP 33 122.537 -23.950 3.056 184 HB2 ASP 33 HB2 ASP 33 122.918 -25.565 5.598 185 H ASN 34 H ASN 34 120.588 -24.492 5.983 186 HA ASN 34 HA ASN 34 118.517 -25.918 4.390 187 HB2 ASN 34 HB2 ASN 34 118.939 -25.410 7.350 188 HD21 ASN 34 HD21 ASN 34 119.577 -27.529 8.431 189 HD22 ASN 34 HD22 ASN 34 120.476 -28.656 7.535 190 H SER 35 H SER 35 119.094 -22.816 4.499 191 HA SER 35 HA SER 35 117.869 -20.813 4.789 192 HB2 SER 35 HB2 SER 35 116.485 -22.848 3.126 193 HG SER 35 HG SER 35 116.777 -20.834 1.735 194 HA PRO 36 HA PRO 36 114.810 -22.165 8.027 195 HB2 PRO 36 HB2 PRO 36 116.286 -21.975 10.326 196 HG2 PRO 36 HG2 PRO 36 118.426 -21.644 9.684 197 HD2 PRO 36 HD2 PRO 36 118.569 -20.911 7.554 198 H LEU 37 H LEU 37 117.314 -20.052 9.402 199 HA LEU 37 HA LEU 37 115.289 -17.931 9.876 200 HB2 LEU 37 HB2 LEU 37 118.213 -18.185 10.666 201 HG LEU 37 HG LEU 37 116.804 -19.989 11.608 202 HD11 LEU 37 HD11 LEU 37 117.937 -17.804 13.301 203 HD12 LEU 37 HD12 LEU 37 118.434 -19.491 13.164 204 HD13 LEU 37 HD13 LEU 37 117.008 -19.066 14.110 205 HD21 LEU 37 HD21 LEU 37 114.610 -19.035 11.558 206 HD22 LEU 37 HD22 LEU 37 115.121 -17.633 12.499 207 HD23 LEU 37 HD23 LEU 37 115.006 -19.217 13.267 208 H GLY 38 H GLY 38 115.046 -16.369 8.330 209 HA2 GLY 38 HA2 GLY 38 117.464 -15.618 6.722 210 H VAL 39 H VAL 39 117.976 -13.465 6.680 211 HA VAL 39 HA VAL 39 115.962 -11.507 7.750 212 HB VAL 39 HB VAL 39 118.948 -11.662 8.313 213 HG11 VAL 39 HG11 VAL 39 116.785 -9.816 9.372 214 HG12 VAL 39 HG12 VAL 39 118.105 -9.358 8.296 215 HG13 VAL 39 HG13 VAL 39 118.450 -9.861 9.951 216 HG21 VAL 39 HG21 VAL 39 117.592 -13.430 9.442 217 HG22 VAL 39 HG22 VAL 39 116.579 -12.169 10.144 218 HG23 VAL 39 HG23 VAL 39 118.282 -12.280 10.588 219 H ILE 40 H ILE 40 115.746 -9.680 6.354 220 HA ILE 40 HA ILE 40 117.843 -9.400 4.235 221 HB ILE 40 HB ILE 40 114.868 -8.784 4.196 222 HG12 ILE 40 HG12 ILE 40 116.353 -11.031 2.814 223 HG21 ILE 40 HG21 ILE 40 116.147 -7.378 2.655 224 HG22 ILE 40 HG22 ILE 40 115.243 -8.587 1.741 225 HG23 ILE 40 HG23 ILE 40 116.973 -8.797 2.012 226 HD11 ILE 40 HD11 ILE 40 113.389 -10.683 3.297 227 HD12 ILE 40 HD12 ILE 40 114.180 -11.821 2.205 228 HD13 ILE 40 HD13 ILE 40 114.189 -10.095 1.839 229 H GLY 41 H GLY 41 118.677 -7.331 3.936 230 HA2 GLY 41 HA2 GLY 41 117.560 -5.141 5.650 231 H SER 42 H SER 42 116.431 -3.685 4.394 232 HA SER 42 HA SER 42 117.340 -3.317 1.554 233 HB2 SER 42 HB2 SER 42 115.249 -4.569 1.797 234 HG SER 42 HG SER 42 113.934 -2.523 0.928 235 H PHE 43 H PHE 43 117.493 -1.245 0.766 236 HA PHE 43 HA PHE 43 116.777 1.015 2.617 237 HB2 PHE 43 HB2 PHE 43 119.040 0.707 0.606 238 HD1 PHE 43 HD2 PHE 43 118.959 2.089 4.048 239 HD2 PHE 43 HD1 PHE 43 120.067 -1.240 1.571 240 HE1 PHE 43 HE2 PHE 43 120.244 1.115 5.933 241 HE2 PHE 43 HE1 PHE 43 121.351 -2.215 3.455 242 HZ PHE 43 HZ PHE 43 121.440 -1.038 5.636 243 H THR 44 H THR 44 115.591 2.732 1.615 244 HA THR 44 HA THR 44 115.049 2.385 -1.322 245 HB THR 44 HB THR 44 113.087 3.106 0.877 246 HG1 THR 44 HG1 THR 44 113.515 0.706 -0.570 247 HG21 THR 44 HG21 THR 44 111.409 2.707 -0.917 248 HG22 THR 44 HG22 THR 44 112.725 2.492 -2.069 249 HG23 THR 44 HG23 THR 44 112.481 4.056 -1.290 250 H TYR 45 H TYR 45 115.045 4.313 -2.514 251 HA TYR 45 HA TYR 45 115.049 6.883 -0.996 252 HB2 TYR 45 HB2 TYR 45 117.373 6.082 -1.514 253 HD1 TYR 45 HD1 TYR 45 117.440 8.228 -0.259 254 HD2 TYR 45 HD2 TYR 45 116.766 8.101 -4.499 255 HE1 TYR 45 HE1 TYR 45 117.964 10.647 -0.414 256 HE2 TYR 45 HE2 TYR 45 117.289 10.521 -4.654 257 HH TYR 45 HH TYR 45 117.149 12.575 -2.433 258 H THR 46 H THR 46 113.183 7.799 -1.811 259 HA THR 46 HA THR 46 112.722 7.627 -4.776 260 HB THR 46 HB THR 46 110.337 7.638 -4.238 261 HG1 THR 46 HG1 THR 46 109.663 8.298 -2.374 262 HG21 THR 46 HG21 THR 46 110.652 5.411 -4.067 263 HG22 THR 46 HG22 THR 46 110.624 5.646 -2.320 264 HG23 THR 46 HG23 THR 46 112.162 5.615 -3.180 265 H GLU 47 H GLU 47 111.721 9.570 -5.734 266 HA GLU 47 HA GLU 47 112.244 12.025 -4.104 267 HB2 GLU 47 HB2 GLU 47 112.903 13.056 -6.219 268 HG2 GLU 47 HG2 GLU 47 112.106 10.401 -7.456 269 H LYS 48 H LYS 48 110.790 13.802 -4.469 270 HA LYS 48 HA LYS 48 108.024 12.957 -5.125 271 HB2 LYS 48 HB2 LYS 48 108.813 14.212 -3.035 272 HG2 LYS 48 HG2 LYS 48 106.696 15.510 -4.780 273 HD2 LYS 48 HD2 LYS 48 107.335 15.668 -1.825 274 HE2 LYS 48 HE2 LYS 48 104.928 17.091 -2.701 275 HZ1 LYS 48 HZ1 LYS 48 105.744 16.795 -0.452 276 HZ2 LYS 48 HZ2 LYS 48 105.644 15.105 -0.599 277 HZ3 LYS 48 HZ3 LYS 48 104.230 16.046 -0.600 278 H SER 49 H SER 49 106.982 13.673 -6.991 279 HA SER 49 HA SER 49 108.537 15.496 -8.791 280 HB2 SER 49 HB2 SER 49 108.062 13.174 -9.541 281 HG SER 49 HG SER 49 108.033 14.154 -11.373 282 H ARG 50 H ARG 50 107.564 17.361 -9.561 283 HA ARG 50 HA ARG 50 104.745 17.914 -8.683 284 HB2 ARG 50 HB2 ARG 50 107.186 19.720 -8.802 285 HG2 ARG 50 HG2 ARG 50 105.550 18.631 -6.489 286 HD2 ARG 50 HD2 ARG 50 107.822 20.648 -6.596 287 HE ARG 50 HE ARG 50 107.020 18.761 -4.474 288 HH11 ARG 50 HH11 ARG 50 107.392 21.966 -4.095 289 HH12 ARG 50 HH12 ARG 50 108.893 21.923 -3.234 290 HH21 ARG 50 HH21 ARG 50 109.483 18.572 -3.901 291 HH22 ARG 50 HH22 ARG 50 110.078 20.001 -3.123 292 H THR 51 H THR 51 103.421 18.826 -10.280 293 HA THR 51 HA THR 51 104.205 18.628 -13.044 294 HB THR 51 HB THR 51 101.986 19.678 -13.403 295 HG1 THR 51 HG1 THR 51 100.838 20.333 -11.533 296 HG21 THR 51 HG21 THR 51 100.690 18.088 -11.806 297 HG22 THR 51 HG22 THR 51 102.289 17.544 -11.302 298 HG23 THR 51 HG23 THR 51 101.791 17.376 -12.985 299 H ALA 52 H ALA 52 103.887 21.388 -10.812 300 HA ALA 52 HA ALA 52 104.505 23.423 -12.778 301 HB1 ALA 52 HB1 ALA 52 104.714 24.828 -10.751 302 HB2 ALA 52 HB2 ALA 52 104.736 23.375 -9.750 303 HB3 ALA 52 HB3 ALA 52 103.284 23.799 -10.658 304 H SER 53 H SER 53 106.424 21.449 -10.564 305 HA SER 53 HA SER 53 108.758 21.208 -10.302 306 HB2 SER 53 HB2 SER 53 108.526 22.152 -13.176 307 HG SER 53 HG SER 53 108.752 19.837 -13.480 308 H SER 54 H SER 54 107.430 24.005 -9.921 309 HA SER 54 HA SER 54 109.569 25.895 -10.588 310 HB2 SER 54 HB2 SER 54 108.056 27.483 -9.552 311 HG SER 54 HG SER 54 106.083 25.958 -8.728 312 H GLY 55 H GLY 55 108.840 23.766 -7.944 313 HA2 GLY 55 HA2 GLY 55 110.489 25.311 -6.036 314 H ASP 56 H ASP 56 112.001 24.480 -8.215 315 HA ASP 56 HA ASP 56 113.268 21.940 -8.037 316 HB2 ASP 56 HB2 ASP 56 114.277 24.678 -8.878 317 H TYR 57 H TYR 57 113.995 25.007 -6.380 318 HA TYR 57 HA TYR 57 116.361 24.060 -5.005 319 HB2 TYR 57 HB2 TYR 57 114.397 26.308 -4.439 320 HD1 TYR 57 HD1 TYR 57 118.053 26.225 -5.125 321 HD2 TYR 57 HD2 TYR 57 114.152 27.172 -6.652 322 HE1 TYR 57 HE1 TYR 57 119.091 27.353 -7.075 323 HE2 TYR 57 HE2 TYR 57 115.189 28.299 -8.602 324 HH TYR 57 HH TYR 57 118.531 27.998 -9.337 325 H ASN 58 H ASN 58 112.942 23.716 -4.443 326 HA ASN 58 HA ASN 58 113.309 22.956 -1.597 327 HB2 ASN 58 HB2 ASN 58 110.903 23.236 -3.426 328 HD21 ASN 58 HD21 ASN 58 109.629 25.246 -2.745 329 HD22 ASN 58 HD22 ASN 58 110.496 26.579 -2.153 330 H LYS 59 H LYS 59 114.450 21.253 -3.752 331 HA LYS 59 HA LYS 59 112.833 18.990 -4.352 332 HB2 LYS 59 HB2 LYS 59 115.000 17.934 -4.828 333 HG2 LYS 59 HG2 LYS 59 116.118 20.238 -3.201 334 HD2 LYS 59 HD2 LYS 59 117.449 18.238 -5.045 335 HE2 LYS 59 HE2 LYS 59 118.411 19.390 -2.524 336 HZ1 LYS 59 HZ1 LYS 59 120.451 20.237 -3.461 337 HZ2 LYS 59 HZ2 LYS 59 119.146 21.036 -4.199 338 HZ3 LYS 59 HZ3 LYS 59 119.969 19.804 -5.029 339 H ASN 60 H ASN 60 112.013 17.445 -3.017 340 HA ASN 60 HA ASN 60 113.015 17.250 -0.222 341 HB2 ASN 60 HB2 ASN 60 110.589 16.099 -1.644 342 HD21 ASN 60 HD21 ASN 60 108.760 17.519 -1.635 343 HD22 ASN 60 HD22 ASN 60 108.837 19.122 -1.085 344 H GLN 61 H GLN 61 113.363 15.043 0.698 345 HA GLN 61 HA GLN 61 114.127 13.020 -1.390 346 HB2 GLN 61 HB2 GLN 61 115.561 13.812 1.169 347 HG2 GLN 61 HG2 GLN 61 116.248 14.216 -1.760 348 HE21 GLN 61 HE21 GLN 61 117.886 16.558 -0.587 349 HE22 GLN 61 HE22 GLN 61 119.307 15.820 -0.022 350 H TYR 62 H TYR 62 113.841 10.785 -0.701 351 HA TYR 62 HA TYR 62 112.184 10.496 1.786 352 HB2 TYR 62 HB2 TYR 62 110.949 10.283 -0.353 353 HD1 TYR 62 HD2 TYR 62 109.409 9.966 1.575 354 HD2 TYR 62 HD1 TYR 62 111.854 6.768 0.077 355 HE1 TYR 62 HE2 TYR 62 108.013 8.324 2.803 356 HE2 TYR 62 HE1 TYR 62 110.459 5.125 1.305 357 HH TYR 62 HH TYR 62 108.955 5.051 3.206 358 H TYR 63 H TYR 63 113.412 9.507 3.258 359 HA TYR 63 HA TYR 63 115.434 7.453 2.442 360 HB2 TYR 63 HB2 TYR 63 115.946 9.405 3.991 361 HD1 TYR 63 HD1 TYR 63 118.046 8.302 3.291 362 HD2 TYR 63 HD2 TYR 63 115.537 6.626 6.349 363 HE1 TYR 63 HE1 TYR 63 119.901 6.816 3.999 364 HE2 TYR 63 HE2 TYR 63 117.392 5.141 7.057 365 HH TYR 63 HH TYR 63 119.819 5.043 6.928 366 H GLY 64 H GLY 64 115.186 5.244 3.043 367 HA2 GLY 64 HA2 GLY 64 112.977 4.584 4.896 368 H ILE 65 H ILE 65 113.863 3.228 6.315 369 HA ILE 65 HA ILE 65 115.953 1.284 5.378 370 HB ILE 65 HB ILE 65 116.705 2.951 7.046 371 HG12 ILE 65 HG12 ILE 65 116.320 0.319 8.483 372 HG21 ILE 65 HG21 ILE 65 115.230 2.044 9.347 373 HG22 ILE 65 HG22 ILE 65 114.095 2.572 8.108 374 HG23 ILE 65 HG23 ILE 65 115.344 3.672 8.683 375 HD11 ILE 65 HD11 ILE 65 117.643 2.531 9.270 376 HD12 ILE 65 HD12 ILE 65 118.910 1.779 8.300 377 HD13 ILE 65 HD13 ILE 65 118.205 0.906 9.661 378 H THR 66 H THR 66 115.398 -0.935 5.647 379 HA THR 66 HA THR 66 113.152 -1.579 7.453 380 HB THR 66 HB THR 66 113.141 -2.096 4.468 381 HG1 THR 66 HG1 THR 66 112.490 -0.094 4.549 382 HG21 THR 66 HG21 THR 66 111.966 -3.697 6.237 383 HG22 THR 66 HG22 THR 66 111.167 -3.259 4.728 384 HG23 THR 66 HG23 THR 66 110.746 -2.424 6.222 385 H ALA 67 H ALA 67 113.263 -3.704 8.224 386 HA ALA 67 HA ALA 67 114.984 -5.665 6.828 387 HB1 ALA 67 HB1 ALA 67 116.542 -5.785 8.535 388 HB2 ALA 67 HB2 ALA 67 115.365 -5.339 9.771 389 HB3 ALA 67 HB3 ALA 67 116.072 -4.097 8.737 390 H GLY 68 H GLY 68 114.357 -7.864 7.417 391 HA2 GLY 68 HA2 GLY 68 112.437 -8.320 9.556 392 HA PRO 69 HA PRO 69 113.708 -12.478 9.040 393 HB2 PRO 69 HB2 PRO 69 111.446 -13.933 9.530 394 HG2 PRO 69 HG2 PRO 69 109.834 -12.310 9.369 395 HD2 PRO 69 HD2 PRO 69 110.378 -10.105 9.153 396 H ALA 70 H ALA 70 113.190 -14.597 7.812 397 HA ALA 70 HA ALA 70 111.527 -14.231 5.373 398 HB1 ALA 70 HB1 ALA 70 114.197 -13.569 5.388 399 HB2 ALA 70 HB2 ALA 70 113.308 -14.075 3.951 400 HB3 ALA 70 HB3 ALA 70 114.253 -15.252 4.862 401 H TYR 71 H TYR 71 110.729 -16.226 4.625 402 HA TYR 71 HA TYR 71 111.769 -18.686 5.999 403 HB2 TYR 71 HB2 TYR 71 108.921 -17.883 5.324 404 HD1 TYR 71 HD1 TYR 71 110.623 -19.323 8.318 405 HD2 TYR 71 HD2 TYR 71 108.636 -15.917 6.615 406 HE1 TYR 71 HE1 TYR 71 110.599 -18.225 10.542 407 HE2 TYR 71 HE2 TYR 71 108.612 -14.819 8.838 408 HH TYR 71 HH TYR 71 108.718 -15.957 11.451 409 H ARG 72 H ARG 72 111.851 -20.561 4.724 410 HA ARG 72 HA ARG 72 111.478 -20.143 1.783 411 HB2 ARG 72 HB2 ARG 72 113.736 -20.719 2.631 412 HG2 ARG 72 HG2 ARG 72 112.395 -22.999 1.141 413 HD2 ARG 72 HD2 ARG 72 114.684 -23.341 0.197 414 HE ARG 72 HE ARG 72 114.539 -23.557 3.188 415 HH11 ARG 72 HH21 ARG 72 112.635 -25.274 1.623 416 HH12 ARG 72 HH22 ARG 72 113.537 -26.742 1.448 417 HH21 ARG 72 HH11 ARG 72 116.573 -25.287 2.277 418 HH22 ARG 72 HH12 ARG 72 115.767 -26.750 1.817 419 H ILE 73 H ILE 73 109.895 -21.317 0.759 420 HA ILE 73 HA ILE 73 108.636 -23.591 2.249 421 HB ILE 73 HB ILE 73 107.417 -21.569 0.332 422 HG12 ILE 73 HG12 ILE 73 107.036 -21.887 3.328 423 HG21 ILE 73 HG21 ILE 73 106.399 -23.892 0.377 424 HG22 ILE 73 HG22 ILE 73 105.301 -22.594 0.844 425 HG23 ILE 73 HG23 ILE 73 106.032 -23.619 2.080 426 HD11 ILE 73 HD11 ILE 73 105.618 -20.015 3.198 427 HD12 ILE 73 HD12 ILE 73 105.186 -20.930 1.755 428 HD13 ILE 73 HD13 ILE 73 106.249 -19.529 1.624 429 H ASN 74 H ASN 74 109.449 -25.377 1.223 430 HA ASN 74 HA ASN 74 109.986 -26.896 -0.509 431 HB2 ASN 74 HB2 ASN 74 107.473 -26.271 -0.783 432 HD21 ASN 74 HD21 ASN 74 106.729 -26.903 -3.505 433 HD22 ASN 74 HD22 ASN 74 107.437 -28.392 -3.908 434 H ASP 75 H ASP 75 111.704 -24.630 -0.305 435 HA ASP 75 HA ASP 75 113.314 -23.411 -1.535 436 HB2 ASP 75 HB2 ASP 75 112.644 -25.732 -3.371 437 H TRP 76 H TRP 76 113.670 -22.624 -4.028 438 HA TRP 76 HA TRP 76 112.924 -21.122 -5.675 439 HB2 TRP 76 HB2 TRP 76 110.562 -22.990 -5.342 440 HD1 TRP 76 HD1 TRP 76 111.905 -25.182 -5.577 441 HE1 TRP 76 HE1 TRP 76 113.473 -26.149 -7.380 442 HE3 TRP 76 HE3 TRP 76 112.531 -21.048 -8.508 443 HZ2 TRP 76 HZ2 TRP 76 114.814 -25.283 -9.754 444 HZ3 TRP 76 HZ3 TRP 76 113.957 -21.147 -10.533 445 HH2 TRP 76 HH2 TRP 76 115.098 -23.256 -11.159 446 H ALA 77 H ALA 77 109.668 -21.520 -4.316 447 HA ALA 77 HA ALA 77 109.203 -18.696 -4.156 448 HB1 ALA 77 HB1 ALA 77 107.149 -19.458 -2.951 449 HB2 ALA 77 HB2 ALA 77 107.842 -21.078 -2.860 450 HB3 ALA 77 HB3 ALA 77 107.447 -20.375 -4.428 451 H SER 78 H SER 78 109.343 -17.269 -2.436 452 HA SER 78 HA SER 78 110.222 -18.319 0.232 453 HB2 SER 78 HB2 SER 78 112.167 -17.594 -1.168 454 HG SER 78 HG SER 78 113.041 -16.336 0.428 455 H ILE 79 H ILE 79 109.537 -16.937 2.013 456 HA ILE 79 HA ILE 79 107.799 -14.619 1.225 457 HB ILE 79 HB ILE 79 106.451 -16.648 1.640 458 HG12 ILE 79 HG12 ILE 79 106.189 -14.845 4.055 459 HG21 ILE 79 HG21 ILE 79 107.705 -16.607 4.402 460 HG22 ILE 79 HG22 ILE 79 108.106 -17.766 3.134 461 HG23 ILE 79 HG23 ILE 79 106.482 -17.740 3.826 462 HD11 ILE 79 HD11 ILE 79 104.615 -16.723 3.879 463 HD12 ILE 79 HD12 ILE 79 104.202 -16.241 2.234 464 HD13 ILE 79 HD13 ILE 79 103.773 -15.200 3.592 465 H TYR 80 H TYR 80 108.076 -12.813 2.565 466 HA TYR 80 HA TYR 80 109.421 -13.202 5.188 467 HB2 TYR 80 HB2 TYR 80 111.197 -11.634 4.565 468 HD1 TYR 80 HD1 TYR 80 110.161 -12.664 1.163 469 HD2 TYR 80 HD2 TYR 80 110.667 -9.388 3.895 470 HE1 TYR 80 HE1 TYR 80 109.866 -11.061 -0.705 471 HE2 TYR 80 HE2 TYR 80 110.370 -7.784 2.027 472 HH TYR 80 HH TYR 80 109.071 -8.028 -0.417 473 H GLY 81 H GLY 81 109.312 -11.314 6.551 474 HA2 GLY 81 HA2 GLY 81 107.069 -9.471 5.832 475 H VAL 82 H VAL 82 107.397 -7.161 6.591 476 HA VAL 82 HA VAL 82 110.273 -6.461 6.934 477 HB VAL 82 HB VAL 82 110.033 -4.802 5.099 478 HG11 VAL 82 HG11 VAL 82 110.695 -7.337 4.848 479 HG12 VAL 82 HG12 VAL 82 110.432 -6.353 3.409 480 HG13 VAL 82 HG13 VAL 82 109.168 -7.445 3.973 481 HG21 VAL 82 HG21 VAL 82 107.314 -5.175 5.470 482 HG22 VAL 82 HG22 VAL 82 107.625 -6.060 3.979 483 HG23 VAL 82 HG23 VAL 82 108.048 -4.353 4.095 484 H VAL 83 H VAL 83 110.644 -4.540 7.989 485 HA VAL 83 HA VAL 83 108.334 -2.837 8.803 486 HB VAL 83 HB VAL 83 109.268 -2.871 11.132 487 HG11 VAL 83 HG11 VAL 83 108.427 -5.063 11.725 488 HG12 VAL 83 HG12 VAL 83 108.712 -5.662 10.091 489 HG13 VAL 83 HG13 VAL 83 107.460 -4.455 10.381 490 HG21 VAL 83 HG21 VAL 83 110.928 -5.251 10.326 491 HG22 VAL 83 HG22 VAL 83 111.082 -4.225 11.751 492 HG23 VAL 83 HG23 VAL 83 111.595 -3.626 10.175 493 H GLY 84 H GLY 84 109.114 -0.582 9.212 494 HA2 GLY 84 HA2 GLY 84 111.862 0.105 9.225 495 H VAL 85 H VAL 85 112.117 2.440 8.416 496 HA VAL 85 HA VAL 85 109.722 4.032 9.257 497 HB VAL 85 HB VAL 85 112.677 4.551 9.731 498 HG11 VAL 85 HG11 VAL 85 111.929 6.374 11.147 499 HG12 VAL 85 HG12 VAL 85 110.241 5.939 10.885 500 HG13 VAL 85 HG13 VAL 85 111.203 6.581 9.554 501 HG21 VAL 85 HG21 VAL 85 111.667 2.608 10.998 502 HG22 VAL 85 HG22 VAL 85 110.525 3.747 11.712 503 HG23 VAL 85 HG23 VAL 85 112.251 3.915 12.028 504 H GLY 86 H GLY 86 109.140 5.664 7.954 505 HA2 GLY 86 HA2 GLY 86 110.792 6.226 5.520 506 H TYR 87 H TYR 87 111.688 8.286 5.264 507 HA TYR 87 HA TYR 87 110.934 10.320 7.345 508 HB2 TYR 87 HB2 TYR 87 113.539 9.836 5.868 509 HD1 TYR 87 HD1 TYR 87 112.921 10.492 9.450 510 HD2 TYR 87 HD2 TYR 87 113.747 7.498 6.484 511 HE1 TYR 87 HE1 TYR 87 113.431 8.856 11.244 512 HE2 TYR 87 HE2 TYR 87 114.260 5.863 8.277 513 HH TYR 87 HH TYR 87 114.982 5.897 10.643 514 H GLY 88 H GLY 88 110.605 12.464 6.640 515 HA2 GLY 88 HA2 GLY 88 110.607 12.857 3.672 516 H LYS 89 H LYS 89 112.163 14.307 3.138 517 HA LYS 89 HA LYS 89 112.973 16.362 5.149 518 HB2 LYS 89 HB2 LYS 89 114.250 15.269 2.621 519 HG2 LYS 89 HG2 LYS 89 114.872 14.939 5.572 520 HD2 LYS 89 HD2 LYS 89 116.358 13.990 3.101 521 HE2 LYS 89 HE2 LYS 89 117.890 13.287 5.273 522 HZ1 LYS 89 HZ1 LYS 89 117.236 12.100 3.213 523 HZ2 LYS 89 HZ2 LYS 89 115.757 11.692 3.940 524 HZ3 LYS 89 HZ3 LYS 89 117.215 11.098 4.580 525 H PHE 90 H PHE 90 111.884 18.257 4.868 526 HA PHE 90 HA PHE 90 111.440 19.253 2.070 527 HB2 PHE 90 HB2 PHE 90 109.740 19.534 4.572 528 HD1 PHE 90 HD2 PHE 90 108.781 18.901 1.055 529 HD2 PHE 90 HD1 PHE 90 109.401 17.171 4.937 530 HE1 PHE 90 HE2 PHE 90 107.661 16.819 0.306 531 HE2 PHE 90 HE1 PHE 90 108.278 15.091 4.189 532 HZ PHE 90 HZ PHE 90 107.410 14.913 1.874 533 H GLN 91 H GLN 91 111.558 21.616 1.868 534 HA GLN 91 HA GLN 91 113.632 22.832 3.500 535 HB2 GLN 91 HB2 GLN 91 113.186 23.255 1.065 536 HG2 GLN 91 HG2 GLN 91 113.023 25.640 2.934 537 HE21 GLN 91 HE21 GLN 91 115.327 25.792 0.426 538 HE22 GLN 91 HE22 GLN 91 114.456 26.780 -0.643 539 H THR 92 H THR 92 113.377 24.376 5.148 540 HA THR 92 HA THR 92 110.569 25.068 5.934 541 HB THR 92 HB THR 92 111.567 23.175 7.236 542 HG1 THR 92 HG1 THR 92 110.298 24.021 8.651 543 HG21 THR 92 HG21 THR 92 113.922 23.892 7.120 544 HG22 THR 92 HG22 THR 92 113.414 23.667 8.795 545 HG23 THR 92 HG23 THR 92 113.546 25.293 8.125 546 H THR 93 H THR 93 110.492 26.993 7.401 547 HA THR 93 HA THR 93 111.828 29.264 6.378 548 HB THR 93 HB THR 93 110.726 28.812 9.171 549 HG1 THR 93 HG1 THR 93 109.072 28.309 7.915 550 HG21 THR 93 HG21 THR 93 111.961 30.932 8.868 551 HG22 THR 93 HG22 THR 93 110.234 31.220 9.081 552 HG23 THR 93 HG23 THR 93 110.953 31.312 7.472 553 H GLU 94 H GLU 94 112.743 27.089 9.019 554 HA GLU 94 HA GLU 94 114.747 26.884 10.242 555 HB2 GLU 94 HB2 GLU 94 115.567 26.703 7.897 556 HG2 GLU 94 HG2 GLU 94 117.351 28.254 9.799 557 H TYR 95 H TYR 95 114.606 28.102 12.104 558 HA TYR 95 HA TYR 95 114.340 30.938 12.259 559 HB2 TYR 95 HB2 TYR 95 115.020 28.649 14.031 560 HD1 TYR 95 HD1 TYR 95 112.546 28.891 12.725 561 HD2 TYR 95 HD2 TYR 95 113.954 31.153 16.094 562 HE1 TYR 95 HE1 TYR 95 110.203 29.353 13.393 563 HE2 TYR 95 HE2 TYR 95 111.612 31.615 16.763 564 HH TYR 95 HH TYR 95 109.383 31.705 15.704 565 HA PRO 96 HA PRO 96 118.447 32.271 11.330 566 HB2 PRO 96 HB2 PRO 96 118.501 34.637 12.711 567 HG2 PRO 96 HG2 PRO 96 116.594 34.387 13.982 568 HD2 PRO 96 HD2 PRO 96 115.036 32.751 13.548 569 H THR 97 H THR 97 117.355 31.824 14.619 570 HA THR 97 HA THR 97 120.215 31.608 15.508 571 HB THR 97 HB THR 97 117.764 32.446 17.089 572 HG1 THR 97 HG1 THR 97 118.871 34.508 16.976 573 HG21 THR 97 HG21 THR 97 119.688 33.304 18.614 574 HG22 THR 97 HG22 THR 97 120.693 32.161 17.723 575 HG23 THR 97 HG23 THR 97 119.303 31.582 18.640 576 H TYR 98 H TYR 98 120.742 29.791 16.733 577 HA TYR 98 HA TYR 98 120.566 27.561 17.485 578 HB2 TYR 98 HB2 TYR 98 119.288 28.952 19.157 579 HD1 TYR 98 HD1 TYR 98 120.649 27.135 20.221 580 HD2 TYR 98 HD2 TYR 98 116.784 26.391 18.499 581 HE1 TYR 98 HE1 TYR 98 120.515 24.986 21.451 582 HE2 TYR 98 HE2 TYR 98 116.651 24.242 19.730 583 HH TYR 98 HH TYR 98 117.947 23.415 22.128 584 H LYS 99 H LYS 99 120.325 27.259 14.915 585 HA LYS 99 HA LYS 99 117.772 26.490 13.831 586 HB2 LYS 99 HB2 LYS 99 119.815 27.142 12.559 587 HG2 LYS 99 HG2 LYS 99 118.730 24.365 11.999 588 HD2 LYS 99 HD2 LYS 99 120.264 26.303 10.239 589 HE2 LYS 99 HE2 LYS 99 118.183 24.827 9.353 590 HZ1 LYS 99 HZ1 LYS 99 119.329 22.879 10.382 591 HZ2 LYS 99 HZ2 LYS 99 120.560 23.041 9.222 592 HZ3 LYS 99 HZ3 LYS 99 118.975 22.672 8.737 593 H ASN 100 H ASN 100 116.686 24.549 13.983 594 HA ASN 100 HA ASN 100 118.038 22.306 15.446 595 HB2 ASN 100 HB2 ASN 100 115.124 23.096 15.105 596 HD21 ASN 100 HD21 ASN 100 114.224 23.849 17.251 597 HD22 ASN 100 HD22 ASN 100 115.266 24.602 18.359 598 H ASP 101 H ASP 101 118.586 20.619 14.113 599 HA ASP 101 HA ASP 101 117.346 20.369 11.439 600 HB2 ASP 101 HB2 ASP 101 119.803 20.205 11.884 601 H THR 102 H THR 102 115.394 19.291 11.410 602 HA THR 102 HA THR 102 115.267 16.632 12.761 603 HB THR 102 HB THR 102 114.277 18.455 14.181 604 HG1 THR 102 HG1 THR 102 113.457 16.426 14.445 605 HG21 THR 102 HG21 THR 102 112.363 19.670 13.492 606 HG22 THR 102 HG22 THR 102 112.093 18.616 12.104 607 HG23 THR 102 HG23 THR 102 113.453 19.739 12.107 608 H SER 103 H SER 103 113.744 15.174 11.743 609 HA SER 103 HA SER 103 112.678 16.093 9.092 610 HB2 SER 103 HB2 SER 103 114.054 13.482 9.798 611 HG SER 103 HG SER 103 115.613 14.374 8.290 612 H ASP 104 H ASP 104 110.661 15.136 8.493 613 HA ASP 104 HA ASP 104 109.035 14.120 10.711 614 HB2 ASP 104 HB2 ASP 104 108.276 15.709 8.922 615 H TYR 105 H TYR 105 108.844 11.952 11.205 616 HA TYR 105 HA TYR 105 109.332 9.988 9.009 617 HB2 TYR 105 HB2 TYR 105 110.702 8.702 10.536 618 HD1 TYR 105 HD2 TYR 105 110.689 11.873 12.462 619 HD2 TYR 105 HD1 TYR 105 109.712 7.691 12.479 620 HE1 TYR 105 HE2 TYR 105 110.309 11.972 14.911 621 HE2 TYR 105 HE1 TYR 105 109.332 7.790 14.928 622 HH TYR 105 HH TYR 105 109.085 10.740 16.630 623 H GLY 106 H GLY 106 108.530 7.743 9.676 624 HA2 GLY 106 HA2 GLY 106 106.412 7.603 11.686 625 H PHE 107 H PHE 107 105.204 5.265 11.143 626 HA PHE 107 HA PHE 107 107.509 3.395 10.781 627 HB2 PHE 107 HB2 PHE 107 106.248 3.505 12.934 628 HD1 PHE 107 HD2 PHE 107 108.188 1.957 13.116 629 HD2 PHE 107 HD1 PHE 107 104.469 0.737 11.344 630 HE1 PHE 107 HE2 PHE 107 108.869 -0.419 13.323 631 HE2 PHE 107 HE1 PHE 107 105.152 -1.639 11.551 632 HZ PHE 107 HZ PHE 107 107.351 -2.216 12.540 633 H SER 108 H SER 108 107.289 1.533 9.473 634 HA SER 108 HA SER 108 104.914 1.461 7.640 635 HB2 SER 108 HB2 SER 108 106.490 0.991 5.829 636 HG SER 108 HG SER 108 108.734 1.029 6.329 637 H TYR 109 H TYR 109 104.565 -0.733 6.693 638 HA TYR 109 HA TYR 109 105.937 -3.022 7.960 639 HB2 TYR 109 HB2 TYR 109 104.220 -2.249 9.592 640 HD1 TYR 109 HD1 TYR 109 105.450 -4.237 10.462 641 HD2 TYR 109 HD2 TYR 109 102.143 -4.614 7.747 642 HE1 TYR 109 HE1 TYR 109 105.244 -6.639 11.045 643 HE2 TYR 109 HE2 TYR 109 101.938 -7.015 8.329 644 HH TYR 109 HH TYR 109 102.529 -8.528 10.118 645 H GLY 110 H GLY 110 105.583 -4.977 6.714 646 HA2 GLY 110 HA2 GLY 110 103.501 -5.380 4.843 647 H ALA 111 H ALA 111 104.478 -6.841 2.878 648 HA ALA 111 HA ALA 111 106.783 -8.496 3.551 649 HB1 ALA 111 HB1 ALA 111 105.176 -9.236 5.263 650 HB2 ALA 111 HB2 ALA 111 105.405 -10.520 4.076 651 HB3 ALA 111 HB3 ALA 111 103.957 -9.516 4.021 652 H GLY 112 H GLY 112 107.065 -10.239 1.802 653 HA2 GLY 112 HA2 GLY 112 105.094 -10.305 -0.348 654 H LEU 113 H LEU 113 106.482 -11.507 -2.328 655 HA LEU 113 HA LEU 113 108.250 -13.560 -1.063 656 HB2 LEU 113 HB2 LEU 113 106.845 -15.332 -2.114 657 HG LEU 113 HG LEU 113 105.846 -13.259 -3.645 658 HD11 LEU 113 HD11 LEU 113 104.190 -14.972 -4.427 659 HD12 LEU 113 HD12 LEU 113 104.651 -15.983 -3.057 660 HD13 LEU 113 HD13 LEU 113 105.836 -15.597 -4.305 661 HD21 LEU 113 HD21 LEU 113 104.482 -12.754 -1.460 662 HD22 LEU 113 HD22 LEU 113 103.520 -14.148 -1.952 663 HD23 LEU 113 HD23 LEU 113 103.648 -12.744 -3.014 664 H GLN 114 H GLN 114 109.411 -14.894 -2.715 665 HA GLN 114 HA GLN 114 109.861 -13.349 -5.237 666 HB2 GLN 114 HB2 GLN 114 111.537 -15.394 -3.735 667 HG2 GLN 114 HG2 GLN 114 111.888 -12.390 -3.949 668 HE21 GLN 114 HE21 GLN 114 113.674 -11.677 -2.438 669 HE22 GLN 114 HE22 GLN 114 114.953 -12.747 -2.121 670 H PHE 115 H PHE 115 109.728 -14.474 -7.236 671 HA PHE 115 HA PHE 115 109.267 -17.402 -7.212 672 HB2 PHE 115 HB2 PHE 115 107.077 -17.183 -8.266 673 HD1 PHE 115 HD2 PHE 115 107.277 -13.761 -6.843 674 HD2 PHE 115 HD1 PHE 115 106.912 -16.119 -10.415 675 HE1 PHE 115 HE2 PHE 115 106.703 -11.721 -8.133 676 HE2 PHE 115 HE1 PHE 115 106.340 -14.081 -11.704 677 HZ PHE 115 HZ PHE 115 106.237 -11.883 -10.565 678 H ASN 116 H ASN 116 109.567 -18.330 -9.299 679 HA ASN 116 HA ASN 116 109.745 -17.097 -11.814 680 HB2 ASN 116 HB2 ASN 116 111.868 -16.267 -10.043 681 HD21 ASN 116 HD21 ASN 116 109.595 -15.156 -11.512 682 HD22 ASN 116 HD22 ASN 116 110.213 -14.042 -12.631 683 HA PRO 117 HA PRO 117 110.961 -21.326 -12.553 684 HB2 PRO 117 HB2 PRO 117 110.669 -21.304 -15.268 685 HG2 PRO 117 HG2 PRO 117 110.286 -19.147 -15.829 686 HD2 PRO 117 HD2 PRO 117 110.745 -17.669 -14.189 687 H MET 118 H MET 118 113.128 -19.585 -12.100 688 HA MET 118 HA MET 118 115.091 -20.494 -14.125 689 HB2 MET 118 HB2 MET 118 114.677 -17.675 -13.078 690 HG2 MET 118 HG2 MET 118 113.113 -18.344 -14.882 691 HE1 MET 118 HE1 MET 118 116.844 -18.963 -17.486 692 HE2 MET 118 HE2 MET 118 116.965 -18.839 -15.732 693 HE3 MET 118 HE3 MET 118 116.330 -17.484 -16.662 694 H GLU 119 H GLU 119 116.910 -21.188 -13.132 695 HA GLU 119 HA GLU 119 117.058 -21.596 -10.321 696 HB2 GLU 119 HB2 GLU 119 118.157 -22.922 -12.121 697 HG2 GLU 119 HG2 GLU 119 119.993 -21.753 -10.004 698 H ASN 120 H ASN 120 118.739 -19.109 -12.347 699 HA ASN 120 HA ASN 120 119.808 -17.933 -9.819 700 HB2 ASN 120 HB2 ASN 120 120.523 -17.606 -12.745 701 HD21 ASN 120 HD21 ASN 120 122.684 -18.682 -13.169 702 HD22 ASN 120 HD22 ASN 120 123.118 -20.039 -12.245 703 H VAL 121 H VAL 121 117.085 -17.417 -11.642 704 HA VAL 121 HA VAL 121 117.272 -14.439 -11.264 705 HB VAL 121 HB VAL 121 115.664 -16.043 -13.278 706 HG11 VAL 121 HG11 VAL 121 115.864 -13.141 -12.581 707 HG12 VAL 121 HG12 VAL 121 114.457 -14.076 -13.087 708 HG13 VAL 121 HG13 VAL 121 115.661 -13.581 -14.277 709 HG21 VAL 121 HG21 VAL 121 117.823 -16.222 -14.112 710 HG22 VAL 121 HG22 VAL 121 118.354 -14.727 -13.341 711 HG23 VAL 121 HG23 VAL 121 117.358 -14.664 -14.796 712 H ALA 122 H ALA 122 115.690 -13.499 -10.022 713 HA ALA 122 HA ALA 122 113.225 -15.057 -9.388 714 HB1 ALA 122 HB1 ALA 122 115.360 -15.259 -7.792 715 HB2 ALA 122 HB2 ALA 122 113.720 -15.231 -7.141 716 HB3 ALA 122 HB3 ALA 122 114.695 -13.762 -7.138 717 H LEU 123 H LEU 123 111.472 -13.747 -9.404 718 HA LEU 123 HA LEU 123 111.866 -10.780 -9.125 719 HB2 LEU 123 HB2 LEU 123 109.672 -12.387 -10.492 720 HG LEU 123 HG LEU 123 111.839 -12.597 -11.657 721 HD11 LEU 123 HD11 LEU 123 110.398 -10.564 -13.298 722 HD12 LEU 123 HD12 LEU 123 109.484 -11.981 -12.784 723 HD13 LEU 123 HD13 LEU 123 110.950 -12.178 -13.742 724 HD21 LEU 123 HD21 LEU 123 112.661 -10.317 -12.673 725 HD22 LEU 123 HD22 LEU 123 113.127 -10.740 -11.025 726 HD23 LEU 123 HD23 LEU 123 111.806 -9.606 -11.304 727 H ASP 124 H ASP 124 110.294 -9.659 -7.678 728 HA ASP 124 HA ASP 124 108.458 -11.464 -6.193 729 HB2 ASP 124 HB2 ASP 124 109.476 -10.739 -4.053 730 H PHE 125 H PHE 125 106.891 -10.365 -4.944 731 HA PHE 125 HA PHE 125 106.560 -7.436 -5.559 732 HB2 PHE 125 HB2 PHE 125 104.496 -9.655 -5.344 733 HD1 PHE 125 HD2 PHE 125 105.968 -6.984 -7.543 734 HD2 PHE 125 HD1 PHE 125 104.219 -10.898 -7.286 735 HE1 PHE 125 HE2 PHE 125 106.316 -7.300 -9.979 736 HE2 PHE 125 HE1 PHE 125 104.564 -11.212 -9.720 737 HZ PHE 125 HZ PHE 125 105.613 -9.413 -11.068 738 H SER 126 H SER 126 105.963 -6.144 -3.780 739 HA SER 126 HA SER 126 105.325 -7.547 -1.215 740 HB2 SER 126 HB2 SER 126 107.381 -5.356 -1.622 741 HG SER 126 HG SER 126 108.632 -6.944 -2.094 742 H TYR 127 H TYR 127 104.012 -6.334 0.193 743 HA TYR 127 HA TYR 127 102.946 -3.744 -0.899 744 HB2 TYR 127 HB2 TYR 127 101.631 -5.919 0.771 745 HD1 TYR 127 HD1 TYR 127 100.383 -4.069 -2.180 746 HD2 TYR 127 HD2 TYR 127 102.072 -7.749 -0.749 747 HE1 TYR 127 HE1 TYR 127 99.836 -5.161 -4.340 748 HE2 TYR 127 HE2 TYR 127 101.526 -8.841 -2.907 749 HH TYR 127 HH TYR 127 101.167 -7.937 -5.382 750 H GLU 128 H GLU 128 103.454 -2.017 0.434 751 HA GLU 128 HA GLU 128 103.803 -2.573 3.358 752 HB2 GLU 128 HB2 GLU 128 105.956 -2.436 2.108 753 HG2 GLU 128 HG2 GLU 128 105.350 -0.133 3.991 754 H GLN 129 H GLN 129 102.888 -1.059 4.702 755 HA GLN 129 HA GLN 129 101.725 1.409 3.445 756 HB2 GLN 129 HB2 GLN 129 100.112 -0.369 4.156 757 HG2 GLN 129 HG2 GLN 129 100.072 2.130 5.880 758 HE21 GLN 129 HE21 GLN 129 97.615 2.773 6.133 759 HE22 GLN 129 HE22 GLN 129 96.544 1.499 6.466 760 H SER 130 H SER 130 102.518 3.306 4.330 761 HA SER 130 HA SER 130 103.849 3.134 7.020 762 HB2 SER 130 HB2 SER 130 104.521 4.829 4.594 763 HG SER 130 HG SER 130 105.033 2.627 4.365 764 H ARG 131 H ARG 131 103.442 4.865 8.459 765 HA ARG 131 HA ARG 131 101.463 6.925 7.534 766 HB2 ARG 131 HB2 ARG 131 101.569 5.308 10.102 767 HG2 ARG 131 HG2 ARG 131 99.581 5.433 7.813 768 HD2 ARG 131 HD2 ARG 131 98.451 5.187 10.013 769 HE ARG 131 HE ARG 131 100.619 3.193 10.430 770 HH11 ARG 131 HH11 ARG 131 97.599 2.907 11.484 771 HH12 ARG 131 HH12 ARG 131 97.879 3.298 13.148 772 HH21 ARG 131 HH21 ARG 131 101.076 4.521 12.598 773 HH22 ARG 131 HH22 ARG 131 99.848 4.211 13.779 774 H ILE 132 H ILE 132 102.263 8.964 7.865 775 HA ILE 132 HA ILE 132 104.421 9.334 9.917 776 HB ILE 132 HB ILE 132 103.782 11.140 7.575 777 HG12 ILE 132 HG12 ILE 132 104.141 8.896 6.626 778 HG21 ILE 132 HG21 ILE 132 106.039 11.897 7.853 779 HG22 ILE 132 HG22 ILE 132 106.408 10.578 8.963 780 HG23 ILE 132 HG23 ILE 132 105.306 11.864 9.457 781 HD11 ILE 132 HD11 ILE 132 105.348 7.548 8.029 782 HD12 ILE 132 HD12 ILE 132 106.331 8.882 8.628 783 HD13 ILE 132 HD13 ILE 132 106.702 8.147 7.070 784 H ARG 133 H ARG 133 102.148 9.432 11.232 785 HA ARG 133 HA ARG 133 100.803 10.796 12.585 786 HB2 ARG 133 HB2 ARG 133 102.953 12.113 12.666 787 HG2 ARG 133 HG2 ARG 133 100.355 13.680 12.667 788 HD2 ARG 133 HD2 ARG 133 103.040 14.265 13.977 789 HE ARG 133 HE ARG 133 100.381 15.627 14.296 790 HH11 ARG 133 HH21 ARG 133 103.444 16.325 15.125 791 HH12 ARG 133 HH22 ARG 133 103.251 16.203 16.842 792 HH21 ARG 133 HH11 ARG 133 100.123 14.718 16.651 793 HH22 ARG 133 HH12 ARG 133 101.370 15.294 17.706 794 H SER 134 H SER 134 101.264 12.626 9.508 795 HA SER 134 HA SER 134 98.273 12.644 9.239 796 HB2 SER 134 HB2 SER 134 100.272 14.765 9.391 797 HG SER 134 HG SER 134 97.742 15.578 9.179 798 H VAL 135 H VAL 135 100.890 11.246 7.921 799 HA VAL 135 HA VAL 135 99.838 11.545 5.121 800 HB VAL 135 HB VAL 135 102.690 11.058 6.031 801 HG11 VAL 135 HG11 VAL 135 103.305 11.110 3.775 802 HG12 VAL 135 HG12 VAL 135 101.819 11.926 3.290 803 HG13 VAL 135 HG13 VAL 135 101.786 10.217 3.723 804 HG21 VAL 135 HG21 VAL 135 102.865 13.437 4.904 805 HG22 VAL 135 HG22 VAL 135 102.338 13.302 6.582 806 HG23 VAL 135 HG23 VAL 135 101.149 13.532 5.299 807 H ASP 136 H ASP 136 99.266 9.666 4.145 808 HA ASP 136 HA ASP 136 100.261 7.077 5.275 809 HB2 ASP 136 HB2 ASP 136 97.941 7.693 6.026 810 H VAL 137 H VAL 137 101.510 6.280 3.582 811 HA VAL 137 HA VAL 137 100.506 6.673 0.794 812 HB VAL 137 HB VAL 137 103.278 6.240 1.961 813 HG11 VAL 137 HG11 VAL 137 103.046 7.268 -0.783 814 HG12 VAL 137 HG12 VAL 137 102.442 5.623 -0.601 815 HG13 VAL 137 HG13 VAL 137 104.099 6.010 -0.138 816 HG21 VAL 137 HG21 VAL 137 103.525 8.501 2.011 817 HG22 VAL 137 HG22 VAL 137 101.762 8.534 2.005 818 HG23 VAL 137 HG23 VAL 137 102.651 8.723 0.494 819 H GLY 138 H GLY 138 100.428 4.855 -0.566 820 HA2 GLY 138 HA2 GLY 138 100.845 2.204 0.754 821 H THR 139 H THR 139 102.963 1.690 0.225 822 HA THR 139 HA THR 139 103.901 2.275 -2.544 823 HB THR 139 HB THR 139 105.387 1.473 -0.026 824 HG1 THR 139 HG1 THR 139 105.906 3.737 -0.042 825 HG21 THR 139 HG21 THR 139 106.185 2.084 -2.820 826 HG22 THR 139 HG22 THR 139 106.972 1.055 -1.622 827 HG23 THR 139 HG23 THR 139 107.173 2.806 -1.550 828 H TRP 140 H TRP 140 104.446 0.689 -3.940 829 HA TRP 140 HA TRP 140 104.295 -2.158 -3.005 830 HB2 TRP 140 HB2 TRP 140 103.770 -0.866 -5.708 831 HD1 TRP 140 HD1 TRP 140 101.878 -3.153 -3.222 832 HE1 TRP 140 HE1 TRP 140 99.541 -2.138 -2.823 833 HE3 TRP 140 HE3 TRP 140 102.254 1.067 -6.069 834 HZ2 TRP 140 HZ2 TRP 140 98.032 0.162 -3.611 835 HZ3 TRP 140 HZ3 TRP 140 100.355 2.651 -6.229 836 HH2 TRP 140 HH2 TRP 140 98.247 2.205 -5.004 837 H ILE 141 H ILE 141 106.176 -3.360 -3.323 838 HA ILE 141 HA ILE 141 108.384 -2.026 -4.859 839 HB ILE 141 HB ILE 141 108.467 -3.981 -2.537 840 HG12 ILE 141 HG12 ILE 141 109.085 -1.010 -2.603 841 HG21 ILE 141 HG21 ILE 141 110.533 -2.706 -4.278 842 HG22 ILE 141 HG22 ILE 141 110.524 -4.306 -3.535 843 HG23 ILE 141 HG23 ILE 141 110.901 -2.883 -2.562 844 HD11 ILE 141 HD11 ILE 141 109.693 -1.206 -0.391 845 HD12 ILE 141 HD12 ILE 141 110.127 -2.831 -0.920 846 HD13 ILE 141 HD13 ILE 141 108.591 -2.551 -0.099 847 H ALA 142 H ALA 142 109.218 -3.151 -6.584 848 HA ALA 142 HA ALA 142 108.818 -6.105 -6.713 849 HB1 ALA 142 HB1 ALA 142 107.841 -5.895 -8.942 850 HB2 ALA 142 HB2 ALA 142 108.080 -4.148 -8.914 851 HB3 ALA 142 HB3 ALA 142 106.912 -4.896 -7.824 852 H GLY 143 H GLY 143 110.548 -7.133 -7.824 853 HA2 GLY 143 HA2 GLY 143 112.277 -5.714 -9.640 854 H VAL 144 H VAL 144 114.690 -7.034 -8.604 855 HA VAL 144 HA VAL 144 114.086 -9.841 -9.489 856 HB VAL 144 HB VAL 144 116.364 -9.755 -10.484 857 HG11 VAL 144 HG11 VAL 144 114.943 -7.268 -11.393 858 HG12 VAL 144 HG12 VAL 144 114.163 -8.837 -11.588 859 HG13 VAL 144 HG13 VAL 144 115.717 -8.522 -12.360 860 HG21 VAL 144 HG21 VAL 144 117.666 -7.738 -10.451 861 HG22 VAL 144 HG22 VAL 144 117.195 -8.047 -8.780 862 HG23 VAL 144 HG23 VAL 144 116.347 -6.821 -9.723 863 H GLY 145 H GLY 145 116.004 -11.348 -8.805 864 HA2 GLY 145 HA2 GLY 145 117.276 -10.662 -6.251 865 H TYR 146 H TYR 146 119.089 -11.908 -5.890 866 HA TYR 146 HA TYR 146 119.513 -14.321 -7.619 867 HB2 TYR 146 HB2 TYR 146 121.410 -12.017 -7.058 868 HD1 TYR 146 HD1 TYR 146 120.801 -13.931 -10.160 869 HD2 TYR 146 HD2 TYR 146 120.002 -10.295 -8.018 870 HE1 TYR 146 HE1 TYR 146 119.867 -12.922 -12.224 871 HE2 TYR 146 HE2 TYR 146 119.069 -9.285 -10.082 872 HH TYR 146 HH TYR 146 117.962 -10.718 -12.491 873 H ARG 147 H ARG 147 121.090 -15.841 -6.675 874 HA ARG 147 HA ARG 147 121.616 -15.397 -3.749 875 HB2 ARG 147 HB2 ARG 147 119.632 -16.840 -4.195 876 HG2 ARG 147 HG2 ARG 147 122.064 -18.272 -3.076 877 HD2 ARG 147 HD2 ARG 147 119.086 -18.785 -2.711 878 HE ARG 147 HE ARG 147 121.477 -19.681 -1.165 879 HH11 ARG 147 HH21 ARG 147 119.100 -21.645 -1.651 880 HH12 ARG 147 HH22 ARG 147 118.241 -21.443 -0.161 881 HH21 ARG 147 HH11 ARG 147 119.934 -18.552 0.733 882 HH22 ARG 147 HH12 ARG 147 118.713 -19.693 1.189 883 H PHE 148 H PHE 148 123.792 -15.519 -3.394 884 HA PHE 148 HA PHE 148 125.440 -17.266 -5.194 885 HB2 PHE 148 HB2 PHE 148 126.066 -14.750 -3.616 886 HD1 PHE 148 HD1 PHE 148 127.043 -15.849 -7.022 887 HD2 PHE 148 HD2 PHE 148 124.439 -13.344 -4.698 888 HE1 PHE 148 HE1 PHE 148 126.339 -14.667 -9.085 889 HE2 PHE 148 HE2 PHE 148 123.736 -12.162 -6.762 890 HZ PHE 148 HZ PHE 148 124.685 -12.823 -8.955 Start of MODEL 8 1 H THR 2 H THR 2 125.136 -16.735 1.209 2 HA THR 2 HA THR 2 126.855 -16.236 -1.198 3 HB THR 2 HB THR 2 124.851 -16.720 -2.546 4 HG1 THR 2 HG1 THR 2 123.639 -17.332 -0.059 5 HG21 THR 2 HG21 THR 2 126.389 -18.582 -1.753 6 HG22 THR 2 HG22 THR 2 124.763 -19.090 -2.213 7 HG23 THR 2 HG23 THR 2 125.189 -18.930 -0.509 8 H SER 3 H SER 3 125.812 -14.398 -2.565 9 HA SER 3 HA SER 3 124.768 -12.293 -0.697 10 HB2 SER 3 HB2 SER 3 125.895 -10.735 -2.225 11 HG SER 3 HG SER 3 126.295 -11.345 -4.170 12 H THR 4 H THR 4 122.938 -11.085 -1.385 13 HA THR 4 HA THR 4 121.711 -11.880 -3.995 14 HB THR 4 HB THR 4 120.360 -11.736 -1.286 15 HG1 THR 4 HG1 THR 4 121.528 -13.583 -1.370 16 HG21 THR 4 HG21 THR 4 118.594 -11.290 -2.681 17 HG22 THR 4 HG22 THR 4 118.623 -13.044 -2.866 18 HG23 THR 4 HG23 THR 4 119.384 -12.015 -4.080 19 H VAL 5 H VAL 5 120.738 -10.189 -5.054 20 HA VAL 5 HA VAL 5 120.452 -7.582 -3.585 21 HB VAL 5 HB VAL 5 121.267 -6.506 -5.675 22 HG11 VAL 5 HG11 VAL 5 123.562 -7.007 -5.340 23 HG12 VAL 5 HG12 VAL 5 123.215 -8.673 -4.879 24 HG13 VAL 5 HG13 VAL 5 122.802 -7.352 -3.787 25 HG21 VAL 5 HG21 VAL 5 120.493 -8.325 -7.208 26 HG22 VAL 5 HG22 VAL 5 121.787 -9.352 -6.593 27 HG23 VAL 5 HG23 VAL 5 122.176 -7.878 -7.480 28 H THR 6 H THR 6 118.559 -6.427 -4.070 29 HA THR 6 HA THR 6 116.854 -7.228 -6.347 30 HB THR 6 HB THR 6 115.992 -7.531 -3.451 31 HG1 THR 6 HG1 THR 6 116.385 -9.532 -5.412 32 HG21 THR 6 HG21 THR 6 114.461 -8.682 -5.726 33 HG22 THR 6 HG22 THR 6 114.374 -6.933 -5.511 34 HG23 THR 6 HG23 THR 6 113.879 -8.008 -4.203 35 H GLY 7 H GLY 7 115.829 -5.352 -7.076 36 HA2 GLY 7 HA2 GLY 7 114.793 -3.377 -5.218 37 H GLY 8 H GLY 8 113.974 -1.402 -6.538 38 HA2 GLY 8 HA2 GLY 8 113.655 -1.606 -9.383 39 H TYR 9 H TYR 9 110.696 -0.724 -8.901 40 HA TYR 9 HA TYR 9 111.274 2.023 -7.831 41 HB2 TYR 9 HB2 TYR 9 109.764 1.234 -10.351 42 HD1 TYR 9 HD2 TYR 9 112.234 3.916 -9.611 43 HD2 TYR 9 HD1 TYR 9 111.524 0.149 -11.549 44 HE1 TYR 9 HE2 TYR 9 114.421 4.098 -10.767 45 HE2 TYR 9 HE1 TYR 9 113.711 0.331 -12.704 46 HH TYR 9 HH TYR 9 115.329 2.959 -13.170 47 H ALA 10 H ALA 10 109.247 3.113 -7.025 48 HA ALA 10 HA ALA 10 106.932 1.247 -6.723 49 HB1 ALA 10 HB1 ALA 10 106.996 1.825 -4.242 50 HB2 ALA 10 HB2 ALA 10 108.596 2.505 -4.537 51 HB3 ALA 10 HB3 ALA 10 108.303 0.789 -4.819 52 H GLN 11 H GLN 11 104.976 2.259 -6.563 53 HA GLN 11 HA GLN 11 104.929 5.261 -6.586 54 HB2 GLN 11 HB2 GLN 11 103.030 3.153 -7.694 55 HG2 GLN 11 HG2 GLN 11 104.822 5.166 -9.091 56 HE21 GLN 11 HE21 GLN 11 104.772 4.793 -11.504 57 HE22 GLN 11 HE22 GLN 11 103.359 4.176 -12.214 58 H SER 12 H SER 12 103.440 6.239 -5.039 59 HA SER 12 HA SER 12 101.952 4.322 -3.295 60 HB2 SER 12 HB2 SER 12 104.297 4.700 -2.493 61 HG SER 12 HG SER 12 102.003 5.318 -1.061 62 H ASP 13 H ASP 13 100.254 5.234 -2.104 63 HA ASP 13 HA ASP 13 99.362 7.955 -2.967 64 HB2 ASP 13 HB2 ASP 13 97.967 5.587 -1.653 65 H ALA 14 H ALA 14 98.810 9.488 -1.212 66 HA ALA 14 HA ALA 14 99.749 8.613 1.481 67 HB1 ALA 14 HB1 ALA 14 101.587 9.797 0.723 68 HB2 ALA 14 HB2 ALA 14 100.655 11.102 1.456 69 HB3 ALA 14 HB3 ALA 14 100.611 10.858 -0.291 70 H GLN 15 H GLN 15 98.079 8.827 2.823 71 HA GLN 15 HA GLN 15 95.777 10.508 2.382 72 HB2 GLN 15 HB2 GLN 15 95.884 8.410 3.763 73 HG2 GLN 15 HG2 GLN 15 95.050 10.893 5.295 74 HE21 GLN 15 HE21 GLN 15 92.966 10.227 6.623 75 HE22 GLN 15 HE22 GLN 15 93.044 8.729 7.418 76 H GLY 16 H GLY 16 95.882 12.688 2.488 77 HA2 GLY 16 HA2 GLY 16 96.134 14.697 3.910 78 H GLN 17 H GLN 17 98.027 13.041 1.596 79 HA GLN 17 HA GLN 17 99.315 15.598 0.694 80 HB2 GLN 17 HB2 GLN 17 100.068 12.693 0.240 81 HG2 GLN 17 HG2 GLN 17 101.354 14.887 1.897 82 HE21 GLN 17 HE21 GLN 17 103.127 13.745 3.346 83 HE22 GLN 17 HE22 GLN 17 104.123 12.625 2.550 84 H MET 18 H MET 18 99.262 15.962 -1.667 85 HA MET 18 HA MET 18 96.824 14.779 -2.907 86 HB2 MET 18 HB2 MET 18 98.531 17.218 -3.479 87 HG2 MET 18 HG2 MET 18 95.750 16.826 -2.335 88 HE1 MET 18 HE1 MET 18 98.313 19.712 -4.082 89 HE2 MET 18 HE2 MET 18 98.623 19.029 -2.488 90 HE3 MET 18 HE3 MET 18 98.020 20.680 -2.630 91 H ASN 19 H ASN 19 99.772 16.043 -4.449 92 HA ASN 19 HA ASN 19 99.710 14.330 -6.694 93 HB2 ASN 19 HB2 ASN 19 101.028 16.477 -6.215 94 HD21 ASN 19 HD21 ASN 19 103.073 16.831 -7.667 95 HD22 ASN 19 HD22 ASN 19 103.269 15.763 -8.971 96 H LYS 20 H LYS 20 100.283 12.233 -7.014 97 HA LYS 20 HA LYS 20 100.950 10.451 -4.871 98 HB2 LYS 20 HB2 LYS 20 101.179 8.827 -6.700 99 HG2 LYS 20 HG2 LYS 20 101.268 11.293 -8.467 100 HD2 LYS 20 HD2 LYS 20 100.956 8.348 -9.105 101 HE2 LYS 20 HE2 LYS 20 102.718 9.966 -10.432 102 HZ1 LYS 20 HZ1 LYS 20 99.996 10.272 -11.602 103 HZ2 LYS 20 HZ2 LYS 20 101.429 10.744 -12.382 104 HZ3 LYS 20 HZ3 LYS 20 100.953 11.506 -10.940 105 H MET 21 H MET 21 103.012 9.049 -4.924 106 HA MET 21 HA MET 21 105.394 10.741 -5.623 107 HB2 MET 21 HB2 MET 21 104.818 9.050 -3.172 108 HG2 MET 21 HG2 MET 21 105.126 12.039 -3.595 109 HE1 MET 21 HE1 MET 21 107.351 11.041 -2.251 110 HE2 MET 21 HE2 MET 21 107.427 11.642 -0.597 111 HE3 MET 21 HE3 MET 21 106.993 12.738 -1.907 112 H GLY 22 H GLY 22 107.423 9.439 -5.743 113 HA2 GLY 22 HA2 GLY 22 106.946 6.630 -6.679 114 H GLY 23 H GLY 23 109.373 5.532 -6.747 115 HA2 GLY 23 HA2 GLY 23 111.273 6.550 -4.852 116 H PHE 24 H PHE 24 113.103 5.275 -4.650 117 HA PHE 24 HA PHE 24 113.202 2.847 -6.411 118 HB2 PHE 24 HB2 PHE 24 114.584 4.845 -7.009 119 HD1 PHE 24 HD2 PHE 24 114.866 3.026 -8.693 120 HD2 PHE 24 HD1 PHE 24 117.056 3.064 -4.998 121 HE1 PHE 24 HE2 PHE 24 116.450 1.356 -9.615 122 HE2 PHE 24 HE1 PHE 24 118.641 1.394 -5.921 123 HZ PHE 24 HZ PHE 24 118.338 0.541 -8.229 124 H ASN 25 H ASN 25 113.720 0.896 -5.397 125 HA ASN 25 HA ASN 25 114.570 1.058 -2.521 126 HB2 ASN 25 HB2 ASN 25 112.810 -0.924 -3.992 127 HD21 ASN 25 HD21 ASN 25 110.518 -0.790 -3.014 128 HD22 ASN 25 HD22 ASN 25 109.959 0.738 -2.532 129 H LEU 26 H LEU 26 116.476 0.097 -2.050 130 HA LEU 26 HA LEU 26 117.556 -2.016 -3.907 131 HB2 LEU 26 HB2 LEU 26 118.732 0.205 -3.964 132 HG LEU 26 HG LEU 26 120.168 -2.176 -2.772 133 HD11 LEU 26 HD11 LEU 26 120.578 -2.795 -4.951 134 HD12 LEU 26 HD12 LEU 26 120.614 -1.129 -5.528 135 HD13 LEU 26 HD13 LEU 26 119.069 -1.919 -5.210 136 HD21 LEU 26 HD21 LEU 26 121.629 -0.430 -2.187 137 HD22 LEU 26 HD22 LEU 26 121.203 0.528 -3.605 138 HD23 LEU 26 HD23 LEU 26 122.217 -0.904 -3.781 139 H LYS 27 H LYS 27 118.029 -4.024 -2.754 140 HA LYS 27 HA LYS 27 118.114 -3.770 0.221 141 HB2 LYS 27 HB2 LYS 27 116.613 -5.832 -1.423 142 HG2 LYS 27 HG2 LYS 27 115.622 -3.363 0.030 143 HD2 LYS 27 HD2 LYS 27 114.126 -5.685 -1.223 144 HE2 LYS 27 HE2 LYS 27 112.531 -3.622 0.116 145 HZ1 LYS 27 HZ1 LYS 27 111.649 -5.406 -1.166 146 HZ2 LYS 27 HZ2 LYS 27 112.633 -5.034 -2.501 147 HZ3 LYS 27 HZ3 LYS 27 111.365 -3.994 -2.059 148 H TYR 28 H TYR 28 119.448 -5.279 1.245 149 HA TYR 28 HA TYR 28 121.080 -7.073 -0.532 150 HB2 TYR 28 HB2 TYR 28 121.739 -5.691 2.097 151 HD1 TYR 28 HD1 TYR 28 123.601 -6.047 -1.100 152 HD2 TYR 28 HD2 TYR 28 121.363 -3.418 1.454 153 HE1 TYR 28 HE1 TYR 28 124.292 -4.111 -2.488 154 HE2 TYR 28 HE2 TYR 28 122.053 -1.481 0.066 155 HH TYR 28 HH TYR 28 124.439 -1.269 -1.731 156 H ARG 29 H ARG 29 120.828 -9.272 -0.052 157 HA ARG 29 HA ARG 29 119.675 -9.942 2.635 158 HB2 ARG 29 HB2 ARG 29 118.029 -9.996 0.788 159 HG2 ARG 29 HG2 ARG 29 118.796 -12.751 1.804 160 HD2 ARG 29 HD2 ARG 29 116.306 -13.141 1.572 161 HE ARG 29 HE ARG 29 118.254 -13.489 -0.274 162 HH11 ARG 29 HH11 ARG 29 116.661 -11.129 -1.614 163 HH12 ARG 29 HH12 ARG 29 115.767 -12.028 -2.794 164 HH21 ARG 29 HH21 ARG 29 116.424 -15.105 -1.337 165 HH22 ARG 29 HH22 ARG 29 115.633 -14.279 -2.638 166 H TYR 30 H TYR 30 120.664 -11.515 3.719 167 HA TYR 30 HA TYR 30 122.657 -13.269 2.307 168 HB2 TYR 30 HB2 TYR 30 122.758 -11.983 5.058 169 HD1 TYR 30 HD1 TYR 30 125.294 -12.444 2.379 170 HD2 TYR 30 HD2 TYR 30 122.689 -9.686 4.394 171 HE1 TYR 30 HE1 TYR 30 126.408 -10.550 1.228 172 HE2 TYR 30 HE2 TYR 30 123.803 -7.793 3.244 173 HH TYR 30 HH TYR 30 126.151 -7.407 2.193 174 H GLU 31 H GLU 31 122.517 -15.476 2.839 175 HA GLU 31 HA GLU 31 120.755 -16.264 5.116 176 HB2 GLU 31 HB2 GLU 31 119.454 -16.109 2.983 177 HG2 GLU 31 HG2 GLU 31 119.908 -18.915 4.051 178 H GLU 32 H GLU 32 121.272 -18.366 5.960 179 HA GLU 32 HA GLU 32 123.950 -19.371 5.134 180 HB2 GLU 32 HB2 GLU 32 123.321 -18.659 7.500 181 HG2 GLU 32 HG2 GLU 32 124.196 -21.528 7.045 182 H ASP 33 H ASP 33 124.122 -21.330 4.122 183 HA ASP 33 HA ASP 33 121.946 -22.717 2.977 184 HB2 ASP 33 HB2 ASP 33 124.757 -23.585 3.713 185 H ASN 34 H ASN 34 123.298 -23.011 6.197 186 HA ASN 34 HA ASN 34 122.468 -25.653 6.860 187 HB2 ASN 34 HB2 ASN 34 122.741 -23.115 8.499 188 HD21 ASN 34 HD21 ASN 34 124.922 -23.216 9.691 189 HD22 ASN 34 HD22 ASN 34 126.222 -23.967 8.900 190 H SER 35 H SER 35 120.671 -22.560 7.071 191 HA SER 35 HA SER 35 118.151 -24.159 7.272 192 HB2 SER 35 HB2 SER 35 119.405 -22.354 9.229 193 HG SER 35 HG SER 35 118.706 -24.566 9.512 194 HA PRO 36 HA PRO 36 116.664 -21.044 4.513 195 HB2 PRO 36 HB2 PRO 36 113.989 -21.068 5.050 196 HG2 PRO 36 HG2 PRO 36 113.795 -22.246 6.976 197 HD2 PRO 36 HD2 PRO 36 115.715 -22.740 8.050 198 H LEU 37 H LEU 37 117.704 -19.870 6.944 199 HA LEU 37 HA LEU 37 115.712 -17.888 7.864 200 HB2 LEU 37 HB2 LEU 37 117.591 -17.220 9.360 201 HG LEU 37 HG LEU 37 119.179 -18.352 7.333 202 HD11 LEU 37 HD11 LEU 37 120.172 -17.766 10.122 203 HD12 LEU 37 HD12 LEU 37 119.590 -16.474 9.071 204 HD13 LEU 37 HD13 LEU 37 120.972 -17.454 8.581 205 HD21 LEU 37 HD21 LEU 37 120.486 -19.914 9.111 206 HD22 LEU 37 HD22 LEU 37 119.284 -20.550 7.991 207 HD23 LEU 37 HD23 LEU 37 118.831 -20.181 9.655 208 H GLY 38 H GLY 38 115.539 -16.977 5.586 209 HA2 GLY 38 HA2 GLY 38 117.853 -15.517 4.543 210 H VAL 39 H VAL 39 118.351 -13.391 4.953 211 HA VAL 39 HA VAL 39 116.292 -11.704 6.321 212 HB VAL 39 HB VAL 39 118.129 -10.888 7.795 213 HG11 VAL 39 HG11 VAL 39 116.661 -13.116 8.102 214 HG12 VAL 39 HG12 VAL 39 117.866 -12.614 9.287 215 HG13 VAL 39 HG13 VAL 39 118.266 -13.848 8.092 216 HG21 VAL 39 HG21 VAL 39 120.031 -12.980 7.478 217 HG22 VAL 39 HG22 VAL 39 120.267 -11.258 7.183 218 HG23 VAL 39 HG23 VAL 39 119.740 -12.310 5.874 219 H ILE 40 H ILE 40 116.079 -9.758 5.272 220 HA ILE 40 HA ILE 40 118.369 -8.835 3.577 221 HB ILE 40 HB ILE 40 116.629 -9.980 2.258 222 HG12 ILE 40 HG12 ILE 40 116.461 -6.980 1.846 223 HG21 ILE 40 HG21 ILE 40 114.353 -9.049 2.156 224 HG22 ILE 40 HG22 ILE 40 114.783 -7.845 3.370 225 HG23 ILE 40 HG23 ILE 40 114.741 -9.555 3.801 226 HD11 ILE 40 HD11 ILE 40 116.262 -7.607 -0.521 227 HD12 ILE 40 HD12 ILE 40 114.993 -8.389 0.421 228 HD13 ILE 40 HD13 ILE 40 116.402 -9.313 -0.096 229 H GLY 41 H GLY 41 118.684 -6.608 3.498 230 HA2 GLY 41 HA2 GLY 41 116.999 -4.971 5.347 231 H SER 42 H SER 42 116.175 -2.946 4.476 232 HA SER 42 HA SER 42 116.584 -2.591 1.530 233 HB2 SER 42 HB2 SER 42 114.580 -3.929 1.916 234 HG SER 42 HG SER 42 113.629 -1.330 1.452 235 H PHE 43 H PHE 43 116.584 -0.467 0.831 236 HA PHE 43 HA PHE 43 115.924 1.654 2.853 237 HB2 PHE 43 HB2 PHE 43 118.163 1.509 0.798 238 HD1 PHE 43 HD2 PHE 43 118.096 2.737 4.298 239 HD2 PHE 43 HD1 PHE 43 119.253 -0.452 1.663 240 HE1 PHE 43 HE2 PHE 43 119.435 1.719 6.120 241 HE2 PHE 43 HE1 PHE 43 120.592 -1.471 3.486 242 HZ PHE 43 HZ PHE 43 120.683 -0.385 5.714 243 H THR 44 H THR 44 114.578 3.300 1.989 244 HA THR 44 HA THR 44 114.143 3.219 -0.973 245 HB THR 44 HB THR 44 112.421 1.926 0.253 246 HG1 THR 44 HG1 THR 44 111.906 3.196 -1.625 247 HG21 THR 44 HG21 THR 44 110.850 3.170 1.736 248 HG22 THR 44 HG22 THR 44 111.911 4.575 1.633 249 HG23 THR 44 HG23 THR 44 112.485 3.091 2.391 250 H TYR 45 H TYR 45 113.686 5.209 -1.924 251 HA TYR 45 HA TYR 45 113.630 7.601 -0.133 252 HB2 TYR 45 HB2 TYR 45 115.126 7.119 -2.737 253 HD1 TYR 45 HD2 TYR 45 116.039 8.981 0.339 254 HD2 TYR 45 HD1 TYR 45 116.557 5.365 -1.921 255 HE1 TYR 45 HE2 TYR 45 117.928 8.334 1.808 256 HE2 TYR 45 HE1 TYR 45 118.446 4.717 -0.451 257 HH TYR 45 HH TYR 45 119.143 6.386 2.489 258 H THR 46 H THR 46 111.566 8.338 -0.409 259 HA THR 46 HA THR 46 110.401 8.303 -3.168 260 HB THR 46 HB THR 46 109.069 8.170 -0.443 261 HG1 THR 46 HG1 THR 46 109.323 6.181 -2.439 262 HG21 THR 46 HG21 THR 46 107.080 8.426 -1.472 263 HG22 THR 46 HG22 THR 46 107.526 7.313 -2.765 264 HG23 THR 46 HG23 THR 46 107.991 9.010 -2.865 265 H GLU 47 H GLU 47 109.501 10.242 -3.951 266 HA GLU 47 HA GLU 47 109.240 12.541 -2.088 267 HB2 GLU 47 HB2 GLU 47 110.712 13.898 -3.545 268 HG2 GLU 47 HG2 GLU 47 111.086 11.270 -5.017 269 H LYS 48 H LYS 48 108.485 14.522 -3.589 270 HA LYS 48 HA LYS 48 106.018 13.690 -4.875 271 HB2 LYS 48 HB2 LYS 48 107.518 16.325 -4.712 272 HG2 LYS 48 HG2 LYS 48 105.214 15.149 -3.124 273 HD2 LYS 48 HD2 LYS 48 106.506 17.894 -3.036 274 HE2 LYS 48 HE2 LYS 48 104.439 18.030 -1.285 275 HZ1 LYS 48 HZ1 LYS 48 106.241 17.819 0.346 276 HZ2 LYS 48 HZ2 LYS 48 106.753 18.684 -1.023 277 HZ3 LYS 48 HZ3 LYS 48 107.218 17.063 -0.816 278 H SER 49 H SER 49 105.488 14.003 -7.137 279 HA SER 49 HA SER 49 107.392 13.068 -9.022 280 HB2 SER 49 HB2 SER 49 104.918 14.773 -9.455 281 HG SER 49 HG SER 49 103.933 13.106 -8.702 282 H ARG 50 H ARG 50 108.432 14.230 -10.791 283 HA ARG 50 HA ARG 50 109.909 16.527 -10.071 284 HB2 ARG 50 HB2 ARG 50 110.481 16.569 -12.472 285 HG2 ARG 50 HG2 ARG 50 108.059 14.762 -12.698 286 HD2 ARG 50 HD2 ARG 50 110.263 15.329 -14.719 287 HE ARG 50 HE ARG 50 107.548 14.998 -15.239 288 HH11 ARG 50 HH21 ARG 50 108.707 12.067 -15.175 289 HH12 ARG 50 HH22 ARG 50 108.877 11.797 -16.878 290 HH21 ARG 50 HH11 ARG 50 108.504 15.142 -17.714 291 HH22 ARG 50 HH12 ARG 50 108.762 13.538 -18.315 292 H THR 51 H THR 51 109.677 18.747 -10.590 293 HA THR 51 HA THR 51 106.900 19.592 -11.351 294 HB THR 51 HB THR 51 107.381 21.561 -9.944 295 HG1 THR 51 HG1 THR 51 109.375 21.532 -8.773 296 HG21 THR 51 HG21 THR 51 107.452 18.798 -8.961 297 HG22 THR 51 HG22 THR 51 106.503 20.169 -8.392 298 HG23 THR 51 HG23 THR 51 108.162 19.953 -7.835 299 H ALA 52 H ALA 52 106.889 21.821 -12.420 300 HA ALA 52 HA ALA 52 108.404 21.844 -14.823 301 HB1 ALA 52 HB1 ALA 52 106.615 23.652 -13.293 302 HB2 ALA 52 HB2 ALA 52 106.536 23.165 -14.986 303 HB3 ALA 52 HB3 ALA 52 107.648 24.439 -14.486 304 H SER 53 H SER 53 109.092 23.234 -11.653 305 HA SER 53 HA SER 53 111.143 25.080 -12.333 306 HB2 SER 53 HB2 SER 53 110.018 24.740 -10.113 307 HG SER 53 HG SER 53 111.695 25.630 -9.230 308 H SER 54 H SER 54 111.247 21.564 -11.881 309 HA SER 54 HA SER 54 112.983 19.996 -12.217 310 HB2 SER 54 HB2 SER 54 113.855 20.195 -14.403 311 HG SER 54 HG SER 54 113.471 22.936 -14.588 312 H GLY 55 H GLY 55 113.614 21.906 -10.153 313 HA2 GLY 55 HA2 GLY 55 116.376 22.802 -10.614 314 H ASP 56 H ASP 56 117.908 22.214 -8.608 315 HA ASP 56 HA ASP 56 118.118 19.265 -8.634 316 HB2 ASP 56 HB2 ASP 56 120.367 19.761 -7.723 317 H TYR 57 H TYR 57 116.304 21.183 -6.777 318 HA TYR 57 HA TYR 57 117.056 19.853 -4.197 319 HB2 TYR 57 HB2 TYR 57 115.483 22.381 -4.799 320 HD1 TYR 57 HD1 TYR 57 118.554 20.963 -3.157 321 HD2 TYR 57 HD2 TYR 57 116.799 24.225 -5.336 322 HE1 TYR 57 HE1 TYR 57 120.754 22.107 -3.218 323 HE2 TYR 57 HE2 TYR 57 119.001 25.367 -5.396 324 HH TYR 57 HH TYR 57 121.668 24.319 -3.493 325 H ASN 58 H ASN 58 115.428 18.717 -3.076 326 HA ASN 58 HA ASN 58 112.860 18.303 -4.570 327 HB2 ASN 58 HB2 ASN 58 114.492 16.510 -2.744 328 HD21 ASN 58 HD21 ASN 58 115.340 14.605 -4.043 329 HD22 ASN 58 HD22 ASN 58 115.692 14.834 -5.688 330 H LYS 59 H LYS 59 113.803 20.189 -2.197 331 HA LYS 59 HA LYS 59 112.855 21.037 -0.221 332 HB2 LYS 59 HB2 LYS 59 111.041 21.340 -1.866 333 HG2 LYS 59 HG2 LYS 59 110.092 20.425 0.867 334 HD2 LYS 59 HD2 LYS 59 108.800 22.169 -1.252 335 HE2 LYS 59 HE2 LYS 59 106.930 22.117 0.629 336 HZ1 LYS 59 HZ1 LYS 59 108.041 24.215 1.414 337 HZ2 LYS 59 HZ2 LYS 59 107.927 24.061 -0.275 338 HZ3 LYS 59 HZ3 LYS 59 109.405 23.765 0.510 339 H ASN 60 H ASN 60 110.554 18.337 -0.226 340 HA ASN 60 HA ASN 60 111.789 17.391 2.322 341 HB2 ASN 60 HB2 ASN 60 109.386 18.228 2.130 342 HD21 ASN 60 HD21 ASN 60 108.295 15.061 2.368 343 HD22 ASN 60 HD22 ASN 60 108.650 14.779 4.004 344 H GLN 61 H GLN 61 112.390 15.218 2.549 345 HA GLN 61 HA GLN 61 112.168 13.494 0.099 346 HB2 GLN 61 HB2 GLN 61 114.363 13.749 2.185 347 HG2 GLN 61 HG2 GLN 61 114.315 14.422 -0.775 348 HE21 GLN 61 HE21 GLN 61 116.398 15.553 -1.399 349 HE22 GLN 61 HE22 GLN 61 117.828 15.141 -0.581 350 H TYR 62 H TYR 62 111.876 11.186 0.559 351 HA TYR 62 HA TYR 62 110.703 10.704 3.275 352 HB2 TYR 62 HB2 TYR 62 109.234 10.557 1.260 353 HD1 TYR 62 HD1 TYR 62 107.951 10.233 3.380 354 HD2 TYR 62 HD2 TYR 62 110.137 7.034 1.525 355 HE1 TYR 62 HE1 TYR 62 106.695 8.585 4.742 356 HE2 TYR 62 HE2 TYR 62 108.881 5.385 2.888 357 HH TYR 62 HH TYR 62 106.076 6.046 4.443 358 H TYR 63 H TYR 63 111.970 9.561 4.553 359 HA TYR 63 HA TYR 63 114.047 7.722 3.422 360 HB2 TYR 63 HB2 TYR 63 114.495 9.547 5.147 361 HD1 TYR 63 HD2 TYR 63 116.557 8.574 4.072 362 HD2 TYR 63 HD1 TYR 63 114.532 6.647 7.331 363 HE1 TYR 63 HE2 TYR 63 118.574 7.198 4.510 364 HE2 TYR 63 HE1 TYR 63 116.549 5.274 7.771 365 HH TYR 63 HH TYR 63 119.585 5.943 6.311 366 H GLY 64 H GLY 64 113.931 5.445 3.770 367 HA2 GLY 64 HA2 GLY 64 111.907 4.460 5.682 368 H ILE 65 H ILE 65 112.803 2.885 6.764 369 HA ILE 65 HA ILE 65 114.922 1.189 5.449 370 HB ILE 65 HB ILE 65 115.781 0.867 7.753 371 HG12 ILE 65 HG12 ILE 65 113.598 2.810 8.575 372 HG21 ILE 65 HG21 ILE 65 116.748 2.709 6.599 373 HG22 ILE 65 HG22 ILE 65 116.335 3.324 8.200 374 HG23 ILE 65 HG23 ILE 65 115.305 3.699 6.819 375 HD11 ILE 65 HD11 ILE 65 116.070 2.334 9.724 376 HD12 ILE 65 HD12 ILE 65 115.015 1.230 10.607 377 HD13 ILE 65 HD13 ILE 65 114.658 2.957 10.576 378 H THR 66 H THR 66 114.530 -1.069 5.426 379 HA THR 66 HA THR 66 112.397 -2.130 7.157 380 HB THR 66 HB THR 66 111.379 -3.086 4.912 381 HG1 THR 66 HG1 THR 66 111.950 -2.047 3.172 382 HG21 THR 66 HG21 THR 66 110.493 -1.340 6.655 383 HG22 THR 66 HG22 THR 66 109.726 -1.450 5.071 384 HG23 THR 66 HG23 THR 66 110.889 -0.166 5.400 385 H ALA 67 H ALA 67 112.576 -4.360 7.493 386 HA ALA 67 HA ALA 67 114.373 -5.965 5.776 387 HB1 ALA 67 HB1 ALA 67 116.049 -6.163 7.336 388 HB2 ALA 67 HB2 ALA 67 114.918 -6.134 8.689 389 HB3 ALA 67 HB3 ALA 67 115.409 -4.626 7.917 390 H GLY 68 H GLY 68 114.002 -8.286 6.133 391 HA2 GLY 68 HA2 GLY 68 112.207 -9.204 8.214 392 HA PRO 69 HA PRO 69 113.706 -13.142 7.032 393 HB2 PRO 69 HB2 PRO 69 111.534 -14.801 7.127 394 HG2 PRO 69 HG2 PRO 69 109.832 -13.256 7.176 395 HD2 PRO 69 HD2 PRO 69 110.235 -11.023 7.480 396 H ALA 70 H ALA 70 113.535 -14.950 5.365 397 HA ALA 70 HA ALA 70 111.854 -14.307 2.991 398 HB1 ALA 70 HB1 ALA 70 113.623 -13.693 1.660 399 HB2 ALA 70 HB2 ALA 70 114.737 -14.799 2.463 400 HB3 ALA 70 HB3 ALA 70 114.343 -13.250 3.208 401 H TYR 71 H TYR 71 111.347 -16.173 1.796 402 HA TYR 71 HA TYR 71 112.653 -18.723 2.704 403 HB2 TYR 71 HB2 TYR 71 109.814 -18.143 1.799 404 HD1 TYR 71 HD2 TYR 71 111.400 -20.017 4.617 405 HD2 TYR 71 HD1 TYR 71 109.033 -16.633 3.437 406 HE1 TYR 71 HE2 TYR 71 110.944 -19.505 6.999 407 HE2 TYR 71 HE1 TYR 71 108.577 -16.121 5.820 408 HH TYR 71 HH TYR 71 108.526 -17.507 8.019 409 H ARG 72 H ARG 72 113.579 -19.916 1.105 410 HA ARG 72 HA ARG 72 113.038 -19.139 -1.744 411 HB2 ARG 72 HB2 ARG 72 115.434 -20.405 -0.381 412 HG2 ARG 72 HG2 ARG 72 114.913 -17.678 -1.595 413 HD2 ARG 72 HD2 ARG 72 117.145 -18.468 -2.291 414 HE ARG 72 HE ARG 72 117.145 -19.585 0.408 415 HH11 ARG 72 HH21 ARG 72 119.672 -17.883 0.010 416 HH12 ARG 72 HH22 ARG 72 120.785 -19.085 -0.552 417 HH21 ARG 72 HH11 ARG 72 118.314 -21.406 -1.283 418 HH22 ARG 72 HH12 ARG 72 120.015 -21.081 -1.284 419 H ILE 73 H ILE 73 112.509 -20.772 -3.225 420 HA ILE 73 HA ILE 73 111.643 -22.846 -3.946 421 HB ILE 73 HB ILE 73 113.697 -23.767 -1.903 422 HG12 ILE 73 HG12 ILE 73 113.976 -23.309 -4.891 423 HG21 ILE 73 HG21 ILE 73 112.075 -25.153 -3.993 424 HG22 ILE 73 HG22 ILE 73 112.651 -25.754 -2.437 425 HG23 ILE 73 HG23 ILE 73 113.757 -25.650 -3.808 426 HD11 ILE 73 HD11 ILE 73 115.660 -24.808 -4.455 427 HD12 ILE 73 HD12 ILE 73 115.694 -24.426 -2.734 428 HD13 ILE 73 HD13 ILE 73 116.484 -23.355 -3.890 429 H ASN 74 H ASN 74 110.520 -21.506 -1.392 430 HA ASN 74 HA ASN 74 109.540 -23.829 0.153 431 HB2 ASN 74 HB2 ASN 74 110.267 -21.664 1.177 432 HD21 ASN 74 HD21 ASN 74 109.555 -23.549 2.659 433 HD22 ASN 74 HD22 ASN 74 108.075 -23.384 3.475 434 H ASP 75 H ASP 75 107.806 -24.924 -0.656 435 HA ASP 75 HA ASP 75 105.780 -25.375 -1.772 436 HB2 ASP 75 HB2 ASP 75 105.344 -22.597 -0.631 437 H TRP 76 H TRP 76 105.341 -21.952 -2.499 438 HA TRP 76 HA TRP 76 106.134 -22.482 -5.341 439 HB2 TRP 76 HB2 TRP 76 103.658 -21.152 -4.199 440 HD1 TRP 76 HD1 TRP 76 102.468 -23.253 -3.324 441 HE1 TRP 76 HE1 TRP 76 101.792 -25.518 -4.357 442 HE3 TRP 76 HE3 TRP 76 104.926 -22.955 -7.791 443 HZ2 TRP 76 HZ2 TRP 76 102.237 -27.005 -6.760 444 HZ3 TRP 76 HZ3 TRP 76 104.783 -24.807 -9.431 445 HH2 TRP 76 HH2 TRP 76 103.443 -26.830 -8.922 446 H ALA 77 H ALA 77 107.247 -20.788 -6.316 447 HA ALA 77 HA ALA 77 108.543 -18.807 -6.418 448 HB1 ALA 77 HB1 ALA 77 106.937 -16.911 -5.293 449 HB2 ALA 77 HB2 ALA 77 105.779 -18.220 -5.527 450 HB3 ALA 77 HB3 ALA 77 106.675 -17.579 -6.904 451 H SER 78 H SER 78 108.836 -16.642 -4.746 452 HA SER 78 HA SER 78 109.812 -17.883 -2.180 453 HB2 SER 78 HB2 SER 78 110.829 -15.464 -3.708 454 HG SER 78 HG SER 78 112.204 -16.783 -4.647 455 H ILE 79 H ILE 79 109.343 -16.718 -0.220 456 HA ILE 79 HA ILE 79 107.579 -14.305 -0.559 457 HB ILE 79 HB ILE 79 107.233 -16.651 1.336 458 HG12 ILE 79 HG12 ILE 79 105.561 -15.819 -1.056 459 HG21 ILE 79 HG21 ILE 79 106.172 -14.975 2.500 460 HG22 ILE 79 HG22 ILE 79 104.872 -15.357 1.372 461 HG23 ILE 79 HG23 ILE 79 105.934 -13.984 1.061 462 HD11 ILE 79 HD11 ILE 79 104.235 -16.954 0.611 463 HD12 ILE 79 HD12 ILE 79 105.485 -18.173 0.851 464 HD13 ILE 79 HD13 ILE 79 104.584 -18.123 -0.664 465 H TYR 80 H TYR 80 108.012 -12.625 0.860 466 HA TYR 80 HA TYR 80 109.715 -13.178 3.245 467 HB2 TYR 80 HB2 TYR 80 111.272 -11.428 2.579 468 HD1 TYR 80 HD2 TYR 80 109.735 -12.018 -0.743 469 HD2 TYR 80 HD1 TYR 80 110.514 -9.155 2.364 470 HE1 TYR 80 HE2 TYR 80 109.033 -10.183 -2.257 471 HE2 TYR 80 HE1 TYR 80 109.813 -7.321 0.849 472 HH TYR 80 HH TYR 80 109.711 -7.441 -2.253 473 H GLY 81 H GLY 81 109.594 -11.452 4.856 474 HA2 GLY 81 HA2 GLY 81 107.086 -9.847 4.605 475 H VAL 82 H VAL 82 107.188 -7.647 5.688 476 HA VAL 82 HA VAL 82 109.942 -6.482 5.658 477 HB VAL 82 HB VAL 82 107.490 -5.414 4.218 478 HG11 VAL 82 HG11 VAL 82 109.481 -3.902 5.210 479 HG12 VAL 82 HG12 VAL 82 108.712 -3.545 3.663 480 HG13 VAL 82 HG13 VAL 82 110.250 -4.409 3.706 481 HG21 VAL 82 HG21 VAL 82 108.275 -7.279 2.964 482 HG22 VAL 82 HG22 VAL 82 109.963 -6.884 3.284 483 HG23 VAL 82 HG23 VAL 82 109.013 -5.875 2.192 484 H VAL 83 H VAL 83 110.259 -5.096 7.330 485 HA VAL 83 HA VAL 83 107.946 -3.706 8.599 486 HB VAL 83 HB VAL 83 108.840 -4.419 10.830 487 HG11 VAL 83 HG11 VAL 83 108.452 -6.975 9.341 488 HG12 VAL 83 HG12 VAL 83 107.165 -5.774 9.239 489 HG13 VAL 83 HG13 VAL 83 107.664 -6.399 10.811 490 HG21 VAL 83 HG21 VAL 83 111.170 -4.921 9.653 491 HG22 VAL 83 HG22 VAL 83 110.471 -6.527 9.457 492 HG23 VAL 83 HG23 VAL 83 110.664 -5.841 11.069 493 H GLY 84 H GLY 84 108.687 -1.683 9.669 494 HA2 GLY 84 HA2 GLY 84 111.266 -0.898 10.206 495 H VAL 85 H VAL 85 111.445 1.608 9.061 496 HA VAL 85 HA VAL 85 108.921 2.953 9.967 497 HB VAL 85 HB VAL 85 110.392 4.595 11.107 498 HG11 VAL 85 HG11 VAL 85 110.760 1.663 11.768 499 HG12 VAL 85 HG12 VAL 85 109.585 2.783 12.458 500 HG13 VAL 85 HG13 VAL 85 111.299 2.962 12.833 501 HG21 VAL 85 HG21 VAL 85 112.338 4.055 9.476 502 HG22 VAL 85 HG22 VAL 85 112.682 2.707 10.561 503 HG23 VAL 85 HG23 VAL 85 112.743 4.363 11.164 504 H GLY 86 H GLY 86 108.703 5.147 9.288 505 HA2 GLY 86 HA2 GLY 86 110.239 5.997 6.879 506 H TYR 87 H TYR 87 110.503 8.256 6.777 507 HA TYR 87 HA TYR 87 108.647 9.949 8.339 508 HB2 TYR 87 HB2 TYR 87 110.362 10.823 9.795 509 HD1 TYR 87 HD2 TYR 87 112.002 12.013 8.209 510 HD2 TYR 87 HD1 TYR 87 112.420 7.909 9.406 511 HE1 TYR 87 HE2 TYR 87 114.400 12.074 7.581 512 HE2 TYR 87 HE1 TYR 87 114.820 7.974 8.787 513 HH TYR 87 HH TYR 87 116.537 10.701 8.368 514 H GLY 88 H GLY 88 109.101 12.299 7.968 515 HA2 GLY 88 HA2 GLY 88 110.441 12.715 5.325 516 H LYS 89 H LYS 89 111.823 14.461 5.153 517 HA LYS 89 HA LYS 89 112.152 16.231 7.548 518 HB2 LYS 89 HB2 LYS 89 113.778 14.324 7.485 519 HG2 LYS 89 HG2 LYS 89 114.933 17.080 6.953 520 HD2 LYS 89 HD2 LYS 89 116.126 14.608 8.248 521 HE2 LYS 89 HE2 LYS 89 117.550 17.246 7.892 522 HZ1 LYS 89 HZ1 LYS 89 118.866 16.189 9.636 523 HZ2 LYS 89 HZ2 LYS 89 118.696 15.142 8.309 524 HZ3 LYS 89 HZ3 LYS 89 117.770 14.897 9.713 525 H PHE 90 H PHE 90 112.591 18.386 7.010 526 HA PHE 90 HA PHE 90 112.499 19.072 4.108 527 HB2 PHE 90 HB2 PHE 90 112.127 20.673 6.662 528 HD1 PHE 90 HD2 PHE 90 110.109 20.487 3.558 529 HD2 PHE 90 HD1 PHE 90 110.463 19.239 7.653 530 HE1 PHE 90 HE2 PHE 90 107.780 19.636 3.501 531 HE2 PHE 90 HE1 PHE 90 108.135 18.387 7.596 532 HZ PHE 90 HZ PHE 90 106.793 18.585 5.519 533 H GLN 91 H GLN 91 114.307 19.895 3.102 534 HA GLN 91 HA GLN 91 116.770 20.260 4.705 535 HB2 GLN 91 HB2 GLN 91 117.855 20.145 2.521 536 HG2 GLN 91 HG2 GLN 91 115.046 20.210 1.369 537 HE21 GLN 91 HE21 GLN 91 117.901 21.332 -0.315 538 HE22 GLN 91 HE22 GLN 91 118.018 20.027 -1.395 539 H THR 92 H THR 92 114.395 22.291 4.432 540 HA THR 92 HA THR 92 115.460 24.578 3.008 541 HB THR 92 HB THR 92 113.600 25.737 4.110 542 HG1 THR 92 HG1 THR 92 113.265 23.380 5.639 543 HG21 THR 92 HG21 THR 92 113.334 23.667 2.385 544 HG22 THR 92 HG22 THR 92 111.965 24.603 2.986 545 HG23 THR 92 HG23 THR 92 112.375 23.060 3.736 546 H THR 93 H THR 93 116.236 26.575 4.039 547 HA THR 93 HA THR 93 118.350 26.227 5.898 548 HB THR 93 HB THR 93 116.697 28.709 5.325 549 HG1 THR 93 HG1 THR 93 118.356 28.987 3.701 550 HG21 THR 93 HG21 THR 93 118.184 29.164 7.127 551 HG22 THR 93 HG22 THR 93 118.991 29.783 5.687 552 HG23 THR 93 HG23 THR 93 119.488 28.240 6.382 553 H GLU 94 H GLU 94 114.975 27.242 6.428 554 HA GLU 94 HA GLU 94 113.700 27.411 8.405 555 HB2 GLU 94 HB2 GLU 94 114.460 25.014 8.400 556 HG2 GLU 94 HG2 GLU 94 114.260 26.334 11.125 557 H TYR 95 H TYR 95 113.811 28.187 10.706 558 HA TYR 95 HA TYR 95 115.463 30.472 11.039 559 HB2 TYR 95 HB2 TYR 95 113.533 28.864 12.559 560 HD1 TYR 95 HD1 TYR 95 112.908 30.599 10.451 561 HD2 TYR 95 HD2 TYR 95 113.998 31.663 14.467 562 HE1 TYR 95 HE1 TYR 95 111.729 32.767 10.197 563 HE2 TYR 95 HE2 TYR 95 112.819 33.831 14.213 564 HH TYR 95 HH TYR 95 112.202 35.322 11.872 565 HA PRO 96 HA PRO 96 119.307 29.024 12.587 566 HB2 PRO 96 HB2 PRO 96 119.750 30.570 14.816 567 HG2 PRO 96 HG2 PRO 96 117.616 31.445 15.051 568 HD2 PRO 96 HD2 PRO 96 116.062 31.409 13.329 569 H THR 97 H THR 97 116.495 28.850 14.591 570 HA THR 97 HA THR 97 117.797 26.701 16.221 571 HB THR 97 HB THR 97 117.423 28.862 17.438 572 HG1 THR 97 HG1 THR 97 116.327 27.879 19.170 573 HG21 THR 97 HG21 THR 97 115.140 29.598 17.901 574 HG22 THR 97 HG22 THR 97 114.492 28.266 16.944 575 HG23 THR 97 HG23 THR 97 115.404 29.553 16.157 576 H TYR 98 H TYR 98 116.314 24.958 16.826 577 HA TYR 98 HA TYR 98 113.726 24.931 15.332 578 HB2 TYR 98 HB2 TYR 98 114.309 22.695 14.486 579 HD1 TYR 98 HD1 TYR 98 117.659 24.038 15.432 580 HD2 TYR 98 HD2 TYR 98 114.871 20.791 15.792 581 HE1 TYR 98 HE1 TYR 98 119.396 22.669 16.554 582 HE2 TYR 98 HE2 TYR 98 116.605 19.426 16.920 583 HH TYR 98 HH TYR 98 119.472 19.620 16.778 584 H LYS 99 H LYS 99 112.104 23.630 16.288 585 HA LYS 99 HA LYS 99 112.491 23.045 19.160 586 HB2 LYS 99 HB2 LYS 99 110.105 22.945 17.284 587 HG2 LYS 99 HG2 LYS 99 111.041 25.009 19.304 588 HD2 LYS 99 HD2 LYS 99 108.526 24.842 17.616 589 HE2 LYS 99 HE2 LYS 99 109.616 27.116 19.321 590 HZ1 LYS 99 HZ1 LYS 99 107.471 28.111 18.618 591 HZ2 LYS 99 HZ2 LYS 99 107.268 26.745 19.606 592 HZ3 LYS 99 HZ3 LYS 99 107.029 26.626 17.928 593 H ASN 100 H ASN 100 113.148 21.325 16.430 594 HA ASN 100 HA ASN 100 113.408 19.031 15.971 595 HB2 ASN 100 HB2 ASN 100 114.363 19.333 18.348 596 HD21 ASN 100 HD21 ASN 100 112.976 16.424 19.221 597 HD22 ASN 100 HD22 ASN 100 113.958 15.369 18.324 598 H ASP 101 H ASP 101 110.750 20.223 15.745 599 HA ASP 101 HA ASP 101 109.094 17.767 16.215 600 HB2 ASP 101 HB2 ASP 101 108.399 20.692 16.623 601 H THR 102 H THR 102 110.429 19.704 13.880 602 HA THR 102 HA THR 102 108.138 20.077 12.111 603 HB THR 102 HB THR 102 109.910 20.804 10.548 604 HG1 THR 102 HG1 THR 102 111.490 19.315 10.991 605 HG21 THR 102 HG21 THR 102 109.143 22.311 12.396 606 HG22 THR 102 HG22 THR 102 110.800 22.628 11.881 607 HG23 THR 102 HG23 THR 102 110.495 21.736 13.370 608 H SER 103 H SER 103 110.570 17.581 12.619 609 HA SER 103 HA SER 103 109.986 16.193 10.096 610 HB2 SER 103 HB2 SER 103 111.560 15.445 12.581 611 HG SER 103 HG SER 103 113.303 15.985 11.078 612 H ASP 104 H ASP 104 108.908 14.155 9.949 613 HA ASP 104 HA ASP 104 107.361 13.288 12.368 614 HB2 ASP 104 HB2 ASP 104 106.382 13.741 9.528 615 H TYR 105 H TYR 105 107.342 11.033 12.602 616 HA TYR 105 HA TYR 105 108.262 9.402 10.266 617 HB2 TYR 105 HB2 TYR 105 109.766 8.223 11.767 618 HD1 TYR 105 HD2 TYR 105 109.203 11.178 13.928 619 HD2 TYR 105 HD1 TYR 105 108.826 6.914 13.563 620 HE1 TYR 105 HE2 TYR 105 108.710 11.013 16.353 621 HE2 TYR 105 HE1 TYR 105 108.333 6.750 15.988 622 HH TYR 105 HH TYR 105 108.886 8.221 18.078 623 H GLY 106 H GLY 106 107.793 7.004 10.676 624 HA2 GLY 106 HA2 GLY 106 105.718 6.318 12.602 625 H PHE 107 H PHE 107 104.793 3.970 11.699 626 HA PHE 107 HA PHE 107 107.280 2.433 11.026 627 HB2 PHE 107 HB2 PHE 107 104.751 1.714 12.543 628 HD1 PHE 107 HD1 PHE 107 108.302 0.997 13.285 629 HD2 PHE 107 HD2 PHE 107 104.932 3.515 14.151 630 HE1 PHE 107 HE1 PHE 107 109.493 1.912 15.259 631 HE2 PHE 107 HE2 PHE 107 106.122 4.430 16.125 632 HZ PHE 107 HZ PHE 107 108.403 3.629 16.678 633 H SER 108 H SER 108 107.040 0.598 9.580 634 HA SER 108 HA SER 108 104.563 0.655 7.889 635 HB2 SER 108 HB2 SER 108 106.032 0.457 5.945 636 HG SER 108 HG SER 108 108.014 -0.160 6.170 637 H TYR 109 H TYR 109 104.195 -1.402 6.717 638 HA TYR 109 HA TYR 109 105.706 -3.785 7.583 639 HB2 TYR 109 HB2 TYR 109 104.062 -3.257 9.400 640 HD1 TYR 109 HD1 TYR 109 105.412 -5.236 10.035 641 HD2 TYR 109 HD2 TYR 109 102.055 -5.553 7.375 642 HE1 TYR 109 HE1 TYR 109 105.385 -7.694 10.363 643 HE2 TYR 109 HE2 TYR 109 102.027 -8.012 7.703 644 HH TYR 109 HH TYR 109 103.737 -9.795 8.373 645 H GLY 110 H GLY 110 105.327 -5.564 6.115 646 HA2 GLY 110 HA2 GLY 110 103.134 -5.796 4.341 647 H ALA 111 H ALA 111 103.993 -6.997 2.177 648 HA ALA 111 HA ALA 111 106.384 -8.639 2.477 649 HB1 ALA 111 HB1 ALA 111 105.073 -10.760 2.850 650 HB2 ALA 111 HB2 ALA 111 103.631 -9.773 3.089 651 HB3 ALA 111 HB3 ALA 111 104.984 -9.644 4.213 652 H GLY 112 H GLY 112 106.549 -10.178 0.520 653 HA2 GLY 112 HA2 GLY 112 104.399 -9.887 -1.468 654 H LEU 113 H LEU 113 105.369 -11.046 -3.617 655 HA LEU 113 HA LEU 113 106.812 -13.509 -2.693 656 HB2 LEU 113 HB2 LEU 113 104.475 -13.211 -4.606 657 HG LEU 113 HG LEU 113 104.763 -14.006 -1.735 658 HD11 LEU 113 HD11 LEU 113 103.106 -12.237 -3.430 659 HD12 LEU 113 HD12 LEU 113 103.602 -12.043 -1.749 660 HD13 LEU 113 HD13 LEU 113 102.226 -13.070 -2.149 661 HD21 LEU 113 HD21 LEU 113 103.107 -15.399 -3.799 662 HD22 LEU 113 HD22 LEU 113 102.378 -15.104 -2.221 663 HD23 LEU 113 HD23 LEU 113 103.861 -16.048 -2.343 664 H GLN 114 H GLN 114 108.057 -14.625 -4.525 665 HA GLN 114 HA GLN 114 108.939 -12.641 -6.570 666 HB2 GLN 114 HB2 GLN 114 110.533 -13.630 -4.866 667 HG2 GLN 114 HG2 GLN 114 110.939 -14.321 -7.788 668 HE21 GLN 114 HE21 GLN 114 113.399 -13.007 -5.641 669 HE22 GLN 114 HE22 GLN 114 114.366 -14.401 -5.586 670 H PHE 115 H PHE 115 108.700 -13.272 -8.779 671 HA PHE 115 HA PHE 115 107.417 -15.944 -9.250 672 HB2 PHE 115 HB2 PHE 115 106.908 -13.236 -10.514 673 HD1 PHE 115 HD1 PHE 115 104.610 -15.958 -9.484 674 HD2 PHE 115 HD2 PHE 115 106.245 -12.112 -8.493 675 HE1 PHE 115 HE1 PHE 115 102.910 -15.696 -7.698 676 HE2 PHE 115 HE2 PHE 115 104.547 -11.849 -6.706 677 HZ PHE 115 HZ PHE 115 102.878 -13.641 -6.308 678 H ASN 116 H ASN 116 107.682 -16.731 -11.502 679 HA ASN 116 HA ASN 116 108.957 -17.240 -13.421 680 HB2 ASN 116 HB2 ASN 116 109.013 -14.483 -13.161 681 HD21 ASN 116 HD21 ASN 116 110.582 -17.179 -14.952 682 HD22 ASN 116 HD22 ASN 116 110.076 -16.657 -16.486 683 HA PRO 117 HA PRO 117 112.215 -18.761 -10.581 684 HB2 PRO 117 HB2 PRO 117 112.190 -21.322 -11.559 685 HG2 PRO 117 HG2 PRO 117 110.608 -21.083 -13.222 686 HD2 PRO 117 HD2 PRO 117 109.239 -19.237 -13.356 687 H MET 118 H MET 118 114.292 -18.374 -11.205 688 HA MET 118 HA MET 118 115.268 -19.312 -13.826 689 HB2 MET 118 HB2 MET 118 115.400 -16.469 -12.759 690 HG2 MET 118 HG2 MET 118 113.243 -17.075 -13.837 691 HE1 MET 118 HE1 MET 118 115.703 -16.342 -16.480 692 HE2 MET 118 HE2 MET 118 115.592 -17.608 -17.700 693 HE3 MET 118 HE3 MET 118 116.482 -17.907 -16.209 694 H GLU 119 H GLU 119 117.651 -19.220 -13.813 695 HA GLU 119 HA GLU 119 118.812 -20.290 -11.437 696 HB2 GLU 119 HB2 GLU 119 120.034 -18.997 -13.897 697 HG2 GLU 119 HG2 GLU 119 119.429 -21.883 -13.179 698 H ASN 120 H ASN 120 119.196 -17.026 -12.910 699 HA ASN 120 HA ASN 120 119.941 -16.012 -10.190 700 HB2 ASN 120 HB2 ASN 120 121.234 -15.481 -12.881 701 HD21 ASN 120 HD21 ASN 120 123.497 -16.333 -12.893 702 HD22 ASN 120 HD22 ASN 120 123.922 -17.615 -11.864 703 H VAL 121 H VAL 121 117.387 -15.833 -11.933 704 HA VAL 121 HA VAL 121 117.237 -12.836 -11.943 705 HB VAL 121 HB VAL 121 115.936 -14.803 -13.857 706 HG11 VAL 121 HG11 VAL 121 115.780 -11.837 -13.459 707 HG12 VAL 121 HG12 VAL 121 114.498 -12.977 -13.864 708 HG13 VAL 121 HG13 VAL 121 115.661 -12.484 -15.094 709 HG21 VAL 121 HG21 VAL 121 118.267 -12.890 -14.209 710 HG22 VAL 121 HG22 VAL 121 117.499 -13.787 -15.519 711 HG23 VAL 121 HG23 VAL 121 118.352 -14.652 -14.239 712 H ALA 122 H ALA 122 115.414 -11.995 -10.940 713 HA ALA 122 HA ALA 122 113.122 -13.767 -10.299 714 HB1 ALA 122 HB1 ALA 122 113.680 -12.748 -7.813 715 HB2 ALA 122 HB2 ALA 122 115.298 -13.007 -8.465 716 HB3 ALA 122 HB3 ALA 122 114.162 -14.352 -8.366 717 H LEU 123 H LEU 123 111.233 -12.612 -10.121 718 HA LEU 123 HA LEU 123 111.426 -9.618 -9.865 719 HB2 LEU 123 HB2 LEU 123 109.420 -11.314 -11.404 720 HG LEU 123 HG LEU 123 111.675 -11.383 -12.426 721 HD11 LEU 123 HD11 LEU 123 110.900 -10.982 -14.568 722 HD12 LEU 123 HD12 LEU 123 110.162 -9.443 -14.126 723 HD13 LEU 123 HD13 LEU 123 109.368 -10.957 -13.695 724 HD21 LEU 123 HD21 LEU 123 112.225 -8.914 -13.405 725 HD22 LEU 123 HD22 LEU 123 112.903 -9.516 -11.892 726 HD23 LEU 123 HD23 LEU 123 111.485 -8.467 -11.867 727 H ASP 124 H ASP 124 109.887 -8.712 -8.322 728 HA ASP 124 HA ASP 124 107.912 -10.618 -7.180 729 HB2 ASP 124 HB2 ASP 124 108.817 -10.202 -4.900 730 H PHE 125 H PHE 125 106.264 -9.647 -5.964 731 HA PHE 125 HA PHE 125 106.101 -6.649 -6.106 732 HB2 PHE 125 HB2 PHE 125 103.954 -8.762 -6.525 733 HD1 PHE 125 HD2 PHE 125 104.662 -5.622 -8.355 734 HD2 PHE 125 HD1 PHE 125 105.019 -9.902 -8.365 735 HE1 PHE 125 HE2 PHE 125 105.322 -5.561 -10.745 736 HE2 PHE 125 HE1 PHE 125 105.679 -9.842 -10.755 737 HZ PHE 125 HZ PHE 125 105.831 -7.671 -11.945 738 H SER 126 H SER 126 105.380 -5.684 -4.165 739 HA SER 126 HA SER 126 104.326 -7.484 -2.028 740 HB2 SER 126 HB2 SER 126 106.776 -7.363 -1.826 741 HG SER 126 HG SER 126 106.735 -6.201 0.295 742 H TYR 127 H TYR 127 103.047 -6.408 -0.479 743 HA TYR 127 HA TYR 127 102.230 -3.626 -1.210 744 HB2 TYR 127 HB2 TYR 127 100.526 -5.420 -1.253 745 HD1 TYR 127 HD1 TYR 127 99.525 -3.190 -1.821 746 HD2 TYR 127 HD2 TYR 127 100.042 -4.501 2.236 747 HE1 TYR 127 HE1 TYR 127 97.933 -1.449 -1.053 748 HE2 TYR 127 HE2 TYR 127 98.451 -2.762 3.002 749 HH TYR 127 HH TYR 127 96.335 -1.429 1.527 750 H GLU 128 H GLU 128 102.966 -2.038 0.138 751 HA GLU 128 HA GLU 128 103.416 -2.691 3.023 752 HB2 GLU 128 HB2 GLU 128 105.522 -2.806 1.684 753 HG2 GLU 128 HG2 GLU 128 105.279 -0.459 3.593 754 H GLN 129 H GLN 129 102.873 -1.005 4.419 755 HA GLN 129 HA GLN 129 102.150 1.638 3.227 756 HB2 GLN 129 HB2 GLN 129 100.025 1.556 4.474 757 HG2 GLN 129 HG2 GLN 129 101.062 -1.154 5.353 758 HE21 GLN 129 HE21 GLN 129 98.834 -0.621 7.514 759 HE22 GLN 129 HE22 GLN 129 97.429 -1.197 6.754 760 H SER 130 H SER 130 102.167 3.375 4.848 761 HA SER 130 HA SER 130 103.533 2.646 7.416 762 HB2 SER 130 HB2 SER 130 105.106 3.457 5.657 763 HG SER 130 HG SER 130 106.117 4.362 7.231 764 H ARG 131 H ARG 131 102.882 3.876 9.195 765 HA ARG 131 HA ARG 131 100.806 5.987 8.695 766 HB2 ARG 131 HB2 ARG 131 99.963 3.781 9.548 767 HG2 ARG 131 HG2 ARG 131 99.812 6.114 11.484 768 HD2 ARG 131 HD2 ARG 131 98.033 3.668 11.141 769 HE ARG 131 HE ARG 131 97.483 6.347 12.181 770 HH11 ARG 131 HH21 ARG 131 97.111 4.177 14.364 771 HH12 ARG 131 HH22 ARG 131 95.413 3.870 14.205 772 HH21 ARG 131 HH11 ARG 131 95.148 5.444 11.126 773 HH22 ARG 131 HH12 ARG 131 94.302 4.588 12.372 774 H ILE 132 H ILE 132 101.378 7.946 9.565 775 HA ILE 132 HA ILE 132 103.443 7.989 11.732 776 HB ILE 132 HB ILE 132 102.879 9.930 9.459 777 HG12 ILE 132 HG12 ILE 132 105.252 8.091 9.898 778 HG21 ILE 132 HG21 ILE 132 104.328 10.229 11.946 779 HG22 ILE 132 HG22 ILE 132 104.039 11.424 10.682 780 HG23 ILE 132 HG23 ILE 132 105.440 10.358 10.581 781 HD11 ILE 132 HD11 ILE 132 104.402 9.891 7.610 782 HD12 ILE 132 HD12 ILE 132 105.733 8.737 7.524 783 HD13 ILE 132 HD13 ILE 132 105.816 10.098 8.643 784 H ARG 133 H ARG 133 100.591 7.807 12.179 785 HA ARG 133 HA ARG 133 98.948 8.782 13.522 786 HB2 ARG 133 HB2 ARG 133 101.207 10.748 14.022 787 HG2 ARG 133 HG2 ARG 133 100.212 8.305 15.521 788 HD2 ARG 133 HD2 ARG 133 102.336 10.367 16.223 789 HE ARG 133 HE ARG 133 102.718 7.752 16.641 790 HH11 ARG 133 HH11 ARG 133 103.640 9.958 18.624 791 HH12 ARG 133 HH12 ARG 133 103.154 9.242 20.124 792 HH21 ARG 133 HH21 ARG 133 101.102 6.877 18.634 793 HH22 ARG 133 HH22 ARG 133 101.717 7.497 20.129 794 H SER 134 H SER 134 100.707 11.439 11.858 795 HA SER 134 HA SER 134 98.088 12.698 11.227 796 HB2 SER 134 HB2 SER 134 99.432 14.673 10.865 797 HG SER 134 HG SER 134 101.861 13.616 11.397 798 H VAL 135 H VAL 135 100.799 11.023 9.731 799 HA VAL 135 HA VAL 135 99.509 11.510 7.056 800 HB VAL 135 HB VAL 135 102.449 11.205 7.759 801 HG11 VAL 135 HG11 VAL 135 101.976 10.354 5.526 802 HG12 VAL 135 HG12 VAL 135 102.768 11.922 5.380 803 HG13 VAL 135 HG13 VAL 135 101.026 11.790 5.145 804 HG21 VAL 135 HG21 VAL 135 101.329 13.363 8.470 805 HG22 VAL 135 HG22 VAL 135 100.955 13.654 6.772 806 HG23 VAL 135 HG23 VAL 135 102.634 13.572 7.304 807 H ASP 136 H ASP 136 98.988 9.653 5.953 808 HA ASP 136 HA ASP 136 100.308 7.089 6.775 809 HB2 ASP 136 HB2 ASP 136 98.037 7.424 7.792 810 H VAL 137 H VAL 137 101.430 6.478 4.909 811 HA VAL 137 HA VAL 137 100.110 6.953 2.274 812 HB VAL 137 HB VAL 137 103.025 6.725 3.101 813 HG11 VAL 137 HG11 VAL 137 102.231 7.940 0.515 814 HG12 VAL 137 HG12 VAL 137 102.037 6.195 0.646 815 HG13 VAL 137 HG13 VAL 137 103.619 6.924 0.907 816 HG21 VAL 137 HG21 VAL 137 102.506 8.821 3.902 817 HG22 VAL 137 HG22 VAL 137 101.134 9.014 2.813 818 HG23 VAL 137 HG23 VAL 137 102.775 9.250 2.213 819 H GLY 138 H GLY 138 100.104 5.213 0.773 820 HA2 GLY 138 HA2 GLY 138 101.011 2.566 1.851 821 H THR 139 H THR 139 102.866 1.986 0.780 822 HA THR 139 HA THR 139 103.236 2.953 -2.026 823 HB THR 139 HB THR 139 105.238 1.891 -0.016 824 HG1 THR 139 HG1 THR 139 105.201 3.794 0.834 825 HG21 THR 139 HG21 THR 139 106.107 3.802 -2.058 826 HG22 THR 139 HG22 THR 139 105.497 2.295 -2.742 827 HG23 THR 139 HG23 THR 139 106.824 2.263 -1.581 828 H TRP 140 H TRP 140 103.624 1.540 -3.679 829 HA TRP 140 HA TRP 140 103.523 -1.399 -3.083 830 HB2 TRP 140 HB2 TRP 140 102.825 0.290 -5.514 831 HD1 TRP 140 HD1 TRP 140 101.300 1.433 -3.402 832 HE1 TRP 140 HE1 TRP 140 98.908 0.772 -2.702 833 HE3 TRP 140 HE3 TRP 140 101.049 -3.248 -5.427 834 HZ2 TRP 140 HZ2 TRP 140 97.124 -1.448 -2.969 835 HZ3 TRP 140 HZ3 TRP 140 98.995 -4.612 -5.192 836 HH2 TRP 140 HH2 TRP 140 97.033 -3.719 -3.966 837 H ILE 141 H ILE 141 105.345 -2.619 -3.743 838 HA ILE 141 HA ILE 141 107.439 -1.120 -5.290 839 HB ILE 141 HB ILE 141 109.072 -2.311 -3.877 840 HG12 ILE 141 HG12 ILE 141 106.644 -3.418 -2.431 841 HG21 ILE 141 HG21 ILE 141 108.263 -0.158 -3.073 842 HG22 ILE 141 HG22 ILE 141 108.464 -1.245 -1.699 843 HG23 ILE 141 HG23 ILE 141 106.853 -0.925 -2.344 844 HD11 ILE 141 HD11 ILE 141 108.184 -3.523 -0.759 845 HD12 ILE 141 HD12 ILE 141 109.534 -3.258 -1.862 846 HD13 ILE 141 HD13 ILE 141 108.850 -4.872 -1.678 847 H ALA 142 H ALA 142 108.601 -2.273 -6.852 848 HA ALA 142 HA ALA 142 108.153 -5.173 -7.222 849 HB1 ALA 142 HB1 ALA 142 106.227 -3.900 -8.282 850 HB2 ALA 142 HB2 ALA 142 107.149 -4.889 -9.414 851 HB3 ALA 142 HB3 ALA 142 107.405 -3.145 -9.355 852 H GLY 143 H GLY 143 110.000 -6.058 -8.268 853 HA2 GLY 143 HA2 GLY 143 111.682 -4.415 -9.975 854 H VAL 144 H VAL 144 114.130 -5.718 -9.262 855 HA VAL 144 HA VAL 144 113.567 -8.478 -10.291 856 HB VAL 144 HB VAL 144 115.773 -8.231 -11.416 857 HG11 VAL 144 HG11 VAL 144 113.504 -6.342 -11.855 858 HG12 VAL 144 HG12 VAL 144 114.144 -7.596 -12.917 859 HG13 VAL 144 HG13 VAL 144 114.987 -6.055 -12.765 860 HG21 VAL 144 HG21 VAL 144 117.015 -6.192 -11.309 861 HG22 VAL 144 HG22 VAL 144 116.621 -6.589 -9.636 862 HG23 VAL 144 HG23 VAL 144 115.700 -5.350 -10.488 863 H GLY 145 H GLY 145 115.642 -9.918 -9.847 864 HA2 GLY 145 HA2 GLY 145 116.980 -9.344 -7.296 865 H TYR 146 H TYR 146 118.894 -10.469 -7.105 866 HA TYR 146 HA TYR 146 119.445 -12.641 -9.100 867 HB2 TYR 146 HB2 TYR 146 121.198 -10.311 -8.250 868 HD1 TYR 146 HD2 TYR 146 120.750 -11.782 -11.599 869 HD2 TYR 146 HD1 TYR 146 119.583 -8.614 -8.943 870 HE1 TYR 146 HE2 TYR 146 119.725 -10.564 -13.501 871 HE2 TYR 146 HE1 TYR 146 118.561 -7.395 -10.846 872 HH TYR 146 HH TYR 146 117.565 -8.150 -13.187 873 H ARG 147 H ARG 147 120.971 -14.250 -8.323 874 HA ARG 147 HA ARG 147 121.564 -14.086 -5.380 875 HB2 ARG 147 HB2 ARG 147 119.645 -15.567 -5.988 876 HG2 ARG 147 HG2 ARG 147 122.165 -16.946 -5.007 877 HD2 ARG 147 HD2 ARG 147 120.407 -18.568 -5.733 878 HE ARG 147 HE ARG 147 118.691 -16.725 -4.157 879 HH11 ARG 147 HH21 ARG 147 117.978 -19.657 -3.743 880 HH12 ARG 147 HH22 ARG 147 116.782 -19.890 -4.975 881 HH21 ARG 147 HH11 ARG 147 117.626 -17.009 -6.709 882 HH22 ARG 147 HH12 ARG 147 116.584 -18.391 -6.654 883 H PHE 148 H PHE 148 123.749 -14.124 -5.072 884 HA PHE 148 HA PHE 148 125.423 -15.783 -6.932 885 HB2 PHE 148 HB2 PHE 148 125.541 -13.310 -7.313 886 HD1 PHE 148 HD1 PHE 148 126.942 -14.491 -8.982 887 HD2 PHE 148 HD2 PHE 148 128.338 -13.737 -4.990 888 HE1 PHE 148 HE1 PHE 148 129.263 -14.988 -9.700 889 HE2 PHE 148 HE2 PHE 148 130.659 -14.234 -5.708 890 HZ PHE 148 HZ PHE 148 131.121 -14.860 -8.063 Start of MODEL 9 1 H THR 2 H THR 2 124.270 -17.936 2.501 2 HA THR 2 HA THR 2 126.101 -17.562 0.153 3 HB THR 2 HB THR 2 124.086 -17.921 -1.241 4 HG1 THR 2 HG1 THR 2 122.192 -18.646 -0.153 5 HG21 THR 2 HG21 THR 2 125.196 -19.947 -0.996 6 HG22 THR 2 HG22 THR 2 123.607 -20.358 -0.351 7 HG23 THR 2 HG23 THR 2 124.938 -19.999 0.747 8 H SER 3 H SER 3 125.258 -15.687 -1.270 9 HA SER 3 HA SER 3 124.180 -13.507 0.496 10 HB2 SER 3 HB2 SER 3 126.049 -13.405 -1.895 11 HG SER 3 HG SER 3 127.624 -13.398 -0.480 12 H THR 4 H THR 4 122.503 -12.204 -0.396 13 HA THR 4 HA THR 4 121.571 -12.937 -3.143 14 HB THR 4 HB THR 4 119.881 -12.674 -0.643 15 HG1 THR 4 HG1 THR 4 120.428 -14.664 -0.369 16 HG21 THR 4 HG21 THR 4 118.363 -12.181 -2.292 17 HG22 THR 4 HG22 THR 4 118.316 -13.940 -2.418 18 HG23 THR 4 HG23 THR 4 119.299 -13.001 -3.542 19 H VAL 5 H VAL 5 120.744 -11.214 -4.295 20 HA VAL 5 HA VAL 5 120.491 -8.577 -2.881 21 HB VAL 5 HB VAL 5 122.622 -8.823 -4.149 22 HG11 VAL 5 HG11 VAL 5 122.718 -9.666 -6.248 23 HG12 VAL 5 HG12 VAL 5 121.356 -8.688 -6.793 24 HG13 VAL 5 HG13 VAL 5 121.067 -10.220 -5.969 25 HG21 VAL 5 HG21 VAL 5 121.596 -6.902 -5.960 26 HG22 VAL 5 HG22 VAL 5 122.369 -6.599 -4.405 27 HG23 VAL 5 HG23 VAL 5 120.617 -6.766 -4.499 28 H THR 6 H THR 6 118.697 -7.341 -3.530 29 HA THR 6 HA THR 6 117.165 -8.072 -5.947 30 HB THR 6 HB THR 6 116.046 -8.335 -3.134 31 HG1 THR 6 HG1 THR 6 116.784 -10.249 -5.086 32 HG21 THR 6 HG21 THR 6 114.638 -7.664 -5.326 33 HG22 THR 6 HG22 THR 6 113.983 -8.702 -4.060 34 HG23 THR 6 HG23 THR 6 114.652 -9.416 -5.527 35 H GLY 7 H GLY 7 116.208 -6.162 -6.739 36 HA2 GLY 7 HA2 GLY 7 115.183 -4.137 -4.929 37 H GLY 8 H GLY 8 114.588 -2.088 -6.292 38 HA2 GLY 8 HA2 GLY 8 114.386 -2.217 -9.130 39 H TYR 9 H TYR 9 111.352 -1.338 -8.521 40 HA TYR 9 HA TYR 9 112.095 1.475 -7.761 41 HB2 TYR 9 HB2 TYR 9 109.929 0.394 -9.598 42 HD1 TYR 9 HD1 TYR 9 112.230 3.228 -10.124 43 HD2 TYR 9 HD2 TYR 9 111.454 -0.909 -10.979 44 HE1 TYR 9 HE1 TYR 9 113.949 3.274 -11.911 45 HE2 TYR 9 HE2 TYR 9 113.173 -0.864 -12.764 46 HH TYR 9 HH TYR 9 114.222 0.924 -14.259 47 H ALA 10 H ALA 10 110.524 2.614 -6.398 48 HA ALA 10 HA ALA 10 108.531 0.779 -5.094 49 HB1 ALA 10 HB1 ALA 10 109.158 2.537 -3.144 50 HB2 ALA 10 HB2 ALA 10 110.664 2.580 -4.061 51 HB3 ALA 10 HB3 ALA 10 110.074 1.053 -3.409 52 H GLN 11 H GLN 11 106.514 1.505 -5.588 53 HA GLN 11 HA GLN 11 106.058 4.457 -5.884 54 HB2 GLN 11 HB2 GLN 11 104.468 2.056 -6.870 55 HG2 GLN 11 HG2 GLN 11 106.684 2.289 -7.972 56 HE21 GLN 11 HE21 GLN 11 108.338 3.732 -8.527 57 HE22 GLN 11 HE22 GLN 11 108.125 5.398 -8.775 58 H SER 12 H SER 12 104.426 5.391 -4.529 59 HA SER 12 HA SER 12 102.880 3.523 -2.799 60 HB2 SER 12 HB2 SER 12 105.090 4.021 -1.762 61 HG SER 12 HG SER 12 103.461 5.448 -0.112 62 H ASP 13 H ASP 13 100.953 4.375 -2.014 63 HA ASP 13 HA ASP 13 99.885 6.784 -3.271 64 HB2 ASP 13 HB2 ASP 13 98.920 4.947 -1.044 65 H ALA 14 H ALA 14 99.417 8.789 -2.079 66 HA ALA 14 HA ALA 14 100.901 8.985 0.520 67 HB1 ALA 14 HB1 ALA 14 100.744 11.360 -1.230 68 HB2 ALA 14 HB2 ALA 14 101.662 10.003 -1.885 69 HB3 ALA 14 HB3 ALA 14 102.116 10.707 -0.337 70 H GLN 15 H GLN 15 98.905 8.852 1.735 71 HA GLN 15 HA GLN 15 96.757 10.796 1.233 72 HB2 GLN 15 HB2 GLN 15 97.374 8.843 3.479 73 HG2 GLN 15 HG2 GLN 15 95.394 8.717 1.182 74 HE21 GLN 15 HE21 GLN 15 94.361 6.491 1.110 75 HE22 GLN 15 HE22 GLN 15 94.116 5.658 2.568 76 H GLY 16 H GLY 16 97.098 12.910 1.808 77 HA2 GLY 16 HA2 GLY 16 97.364 14.585 3.546 78 H GLN 17 H GLN 17 99.644 12.964 1.533 79 HA GLN 17 HA GLN 17 101.636 15.163 1.807 80 HB2 GLN 17 HB2 GLN 17 101.650 12.457 0.446 81 HG2 GLN 17 HG2 GLN 17 103.102 13.578 2.863 82 HE21 GLN 17 HE21 GLN 17 104.372 11.782 3.989 83 HE22 GLN 17 HE22 GLN 17 105.096 10.587 3.026 84 H MET 18 H MET 18 102.623 15.824 -0.408 85 HA MET 18 HA MET 18 100.698 17.205 -1.945 86 HB2 MET 18 HB2 MET 18 103.506 16.267 -2.590 87 HG2 MET 18 HG2 MET 18 102.362 18.820 -1.416 88 HE1 MET 18 HE1 MET 18 104.265 20.882 -3.591 89 HE2 MET 18 HE2 MET 18 102.754 20.057 -3.216 90 HE3 MET 18 HE3 MET 18 103.851 19.370 -4.410 91 H ASN 19 H ASN 19 102.402 14.135 -2.881 92 HA ASN 19 HA ASN 19 100.034 13.269 -4.382 93 HB2 ASN 19 HB2 ASN 19 101.560 15.089 -5.634 94 HD21 ASN 19 HD21 ASN 19 101.743 13.962 -8.336 95 HD22 ASN 19 HD22 ASN 19 100.175 13.492 -8.785 96 H LYS 20 H LYS 20 101.440 11.508 -6.154 97 HA LYS 20 HA LYS 20 102.179 9.365 -4.311 98 HB2 LYS 20 HB2 LYS 20 100.885 9.169 -6.476 99 HG2 LYS 20 HG2 LYS 20 103.458 7.572 -6.248 100 HD2 LYS 20 HD2 LYS 20 100.864 7.057 -7.734 101 HE2 LYS 20 HE2 LYS 20 102.430 4.923 -8.329 102 HZ1 LYS 20 HZ1 LYS 20 100.901 3.804 -6.891 103 HZ2 LYS 20 HZ2 LYS 20 100.096 5.165 -7.512 104 HZ3 LYS 20 HZ3 LYS 20 100.697 5.181 -5.923 105 H MET 21 H MET 21 104.291 8.215 -4.458 106 HA MET 21 HA MET 21 106.521 10.027 -5.333 107 HB2 MET 21 HB2 MET 21 106.277 8.271 -2.870 108 HG2 MET 21 HG2 MET 21 106.289 11.277 -3.279 109 HE1 MET 21 HE1 MET 21 108.772 11.680 -0.688 110 HE2 MET 21 HE2 MET 21 108.321 11.651 -2.390 111 HE3 MET 21 HE3 MET 21 108.971 10.198 -1.634 112 H GLY 22 H GLY 22 108.571 8.845 -5.740 113 HA2 GLY 22 HA2 GLY 22 108.300 5.945 -6.346 114 H GLY 23 H GLY 23 110.146 4.923 -5.642 115 HA2 GLY 23 HA2 GLY 23 112.719 6.420 -5.806 116 H PHE 24 H PHE 24 114.420 4.697 -4.645 117 HA PHE 24 HA PHE 24 114.067 2.162 -6.215 118 HB2 PHE 24 HB2 PHE 24 116.521 3.741 -5.372 119 HD1 PHE 24 HD1 PHE 24 115.842 2.062 -8.577 120 HD2 PHE 24 HD2 PHE 24 115.726 5.790 -6.446 121 HE1 PHE 24 HE1 PHE 24 115.530 3.275 -10.716 122 HE2 PHE 24 HE2 PHE 24 115.412 7.003 -8.587 123 HZ PHE 24 HZ PHE 24 115.314 5.745 -10.722 124 H ASN 25 H ASN 25 114.570 0.203 -5.150 125 HA ASN 25 HA ASN 25 115.206 0.404 -2.224 126 HB2 ASN 25 HB2 ASN 25 112.769 0.014 -2.856 127 HD21 ASN 25 HD21 ASN 25 111.500 -1.734 -1.442 128 HD22 ASN 25 HD22 ASN 25 112.273 -2.199 -0.003 129 H LEU 26 H LEU 26 116.933 -0.842 -1.668 130 HA LEU 26 HA LEU 26 117.727 -3.113 -3.478 131 HB2 LEU 26 HB2 LEU 26 119.161 -0.936 -3.141 132 HG LEU 26 HG LEU 26 121.259 -2.215 -3.207 133 HD11 LEU 26 HD11 LEU 26 120.160 -3.857 -1.366 134 HD12 LEU 26 HD12 LEU 26 121.515 -4.334 -2.388 135 HD13 LEU 26 HD13 LEU 26 119.875 -4.813 -2.820 136 HD21 LEU 26 HD21 LEU 26 120.810 -3.141 -5.252 137 HD22 LEU 26 HD22 LEU 26 119.252 -2.349 -5.020 138 HD23 LEU 26 HD23 LEU 26 119.434 -4.062 -4.649 139 H LYS 27 H LYS 27 118.039 -5.197 -2.334 140 HA LYS 27 HA LYS 27 117.606 -5.036 0.619 141 HB2 LYS 27 HB2 LYS 27 116.470 -7.006 -1.394 142 HG2 LYS 27 HG2 LYS 27 115.198 -4.705 0.111 143 HD2 LYS 27 HD2 LYS 27 113.952 -6.910 -1.556 144 HE2 LYS 27 HE2 LYS 27 113.147 -4.302 -1.572 145 HZ1 LYS 27 HZ1 LYS 27 111.678 -5.664 0.629 146 HZ2 LYS 27 HZ2 LYS 27 111.521 -4.045 0.139 147 HZ3 LYS 27 HZ3 LYS 27 112.948 -4.572 0.896 148 H TYR 28 H TYR 28 118.828 -6.535 1.812 149 HA TYR 28 HA TYR 28 120.693 -8.309 0.263 150 HB2 TYR 28 HB2 TYR 28 121.756 -6.304 1.307 151 HD1 TYR 28 HD2 TYR 28 123.450 -7.683 0.106 152 HD2 TYR 28 HD1 TYR 28 122.156 -8.635 4.091 153 HE1 TYR 28 HE2 TYR 28 125.414 -9.171 0.389 154 HE2 TYR 28 HE1 TYR 28 124.120 -10.123 4.373 155 HH TYR 28 HH TYR 28 125.728 -11.456 2.291 156 H ARG 29 H ARG 29 120.303 -10.463 0.765 157 HA ARG 29 HA ARG 29 119.022 -11.028 3.419 158 HB2 ARG 29 HB2 ARG 29 117.552 -11.265 1.428 159 HG2 ARG 29 HG2 ARG 29 118.326 -13.874 2.778 160 HD2 ARG 29 HD2 ARG 29 115.793 -13.022 1.325 161 HE ARG 29 HE ARG 29 115.792 -14.498 3.594 162 HH11 ARG 29 HH21 ARG 29 114.428 -14.867 0.579 163 HH12 ARG 29 HH22 ARG 29 114.051 -16.549 0.747 164 HH21 ARG 29 HH11 ARG 29 115.834 -16.928 3.696 165 HH22 ARG 29 HH12 ARG 29 114.847 -17.715 2.512 166 H TYR 30 H TYR 30 119.784 -12.706 4.595 167 HA TYR 30 HA TYR 30 122.213 -14.150 3.581 168 HB2 TYR 30 HB2 TYR 30 122.486 -12.549 5.492 169 HD1 TYR 30 HD2 TYR 30 124.677 -13.526 4.829 170 HD2 TYR 30 HD1 TYR 30 121.939 -15.623 7.390 171 HE1 TYR 30 HE2 TYR 30 126.498 -15.062 5.518 172 HE2 TYR 30 HE1 TYR 30 123.760 -17.158 8.079 173 HH TYR 30 HH TYR 30 125.903 -17.954 7.255 174 H GLU 31 H GLU 31 122.118 -16.402 3.611 175 HA GLU 31 HA GLU 31 119.840 -17.718 5.038 176 HB2 GLU 31 HB2 GLU 31 120.731 -18.156 2.164 177 HG2 GLU 31 HG2 GLU 31 118.215 -16.900 3.305 178 H GLU 32 H GLU 32 120.345 -19.948 5.650 179 HA GLU 32 HA GLU 32 123.256 -20.514 5.705 180 HB2 GLU 32 HB2 GLU 32 120.848 -21.752 7.082 181 HG2 GLU 32 HG2 GLU 32 122.958 -19.792 8.042 182 H ASP 33 H ASP 33 123.637 -23.054 5.598 183 HA ASP 33 HA ASP 33 123.183 -23.930 2.921 184 HB2 ASP 33 HB2 ASP 33 123.873 -25.404 5.483 185 H ASN 34 H ASN 34 121.414 -24.609 5.929 186 HA ASN 34 HA ASN 34 119.559 -26.453 4.550 187 HB2 ASN 34 HB2 ASN 34 119.786 -25.415 7.391 188 HD21 ASN 34 HD21 ASN 34 120.722 -27.180 8.821 189 HD22 ASN 34 HD22 ASN 34 121.829 -28.273 8.143 190 H SER 35 H SER 35 119.719 -23.222 4.356 191 HA SER 35 HA SER 35 118.192 -21.439 4.288 192 HB2 SER 35 HB2 SER 35 116.647 -21.928 2.585 193 HG SER 35 HG SER 35 115.352 -23.411 3.524 194 HA PRO 36 HA PRO 36 115.168 -22.783 7.558 195 HB2 PRO 36 HB2 PRO 36 116.578 -22.543 9.893 196 HG2 PRO 36 HG2 PRO 36 118.742 -22.209 9.356 197 HD2 PRO 36 HD2 PRO 36 118.773 -21.248 7.304 198 H LEU 37 H LEU 37 117.614 -20.595 8.882 199 HA LEU 37 HA LEU 37 115.540 -18.543 9.453 200 HB2 LEU 37 HB2 LEU 37 117.195 -19.321 11.153 201 HG LEU 37 HG LEU 37 117.263 -16.430 10.262 202 HD11 LEU 37 HD11 LEU 37 115.867 -17.835 12.560 203 HD12 LEU 37 HD12 LEU 37 115.100 -17.404 11.032 204 HD13 LEU 37 HD13 LEU 37 115.689 -16.139 12.110 205 HD21 LEU 37 HD21 LEU 37 119.292 -16.858 11.564 206 HD22 LEU 37 HD22 LEU 37 118.349 -17.678 12.808 207 HD23 LEU 37 HD23 LEU 37 118.146 -15.945 12.545 208 H GLY 38 H GLY 38 115.195 -16.945 7.972 209 HA2 GLY 38 HA2 GLY 38 117.532 -16.033 6.332 210 H VAL 39 H VAL 39 117.937 -13.851 6.395 211 HA VAL 39 HA VAL 39 115.849 -12.053 7.595 212 HB VAL 39 HB VAL 39 118.847 -12.085 8.107 213 HG11 VAL 39 HG11 VAL 39 118.594 -10.149 9.294 214 HG12 VAL 39 HG12 VAL 39 116.983 -10.589 9.863 215 HG13 VAL 39 HG13 VAL 39 117.194 -9.927 8.243 216 HG21 VAL 39 HG21 VAL 39 117.776 -12.560 10.515 217 HG22 VAL 39 HG22 VAL 39 118.140 -13.873 9.396 218 HG23 VAL 39 HG23 VAL 39 116.493 -13.260 9.528 219 H ILE 40 H ILE 40 115.566 -10.120 6.355 220 HA ILE 40 HA ILE 40 117.576 -9.670 4.182 221 HB ILE 40 HB ILE 40 114.593 -9.102 4.293 222 HG12 ILE 40 HG12 ILE 40 116.059 -11.215 2.695 223 HG21 ILE 40 HG21 ILE 40 116.425 -9.091 1.886 224 HG22 ILE 40 HG22 ILE 40 116.074 -7.634 2.816 225 HG23 ILE 40 HG23 ILE 40 114.770 -8.489 1.991 226 HD11 ILE 40 HD11 ILE 40 114.059 -10.832 1.578 227 HD12 ILE 40 HD12 ILE 40 113.213 -10.351 3.049 228 HD13 ILE 40 HD13 ILE 40 113.548 -12.055 2.742 229 H GLY 41 H GLY 41 118.349 -7.573 3.948 230 HA2 GLY 41 HA2 GLY 41 117.276 -5.491 5.820 231 H SER 42 H SER 42 116.328 -3.773 4.732 232 HA SER 42 HA SER 42 117.193 -3.301 1.897 233 HB2 SER 42 HB2 SER 42 114.819 -3.096 1.330 234 HG SER 42 HG SER 42 113.640 -2.503 2.951 235 H PHE 43 H PHE 43 117.197 -1.166 1.198 236 HA PHE 43 HA PHE 43 116.372 0.942 3.176 237 HB2 PHE 43 HB2 PHE 43 118.768 0.817 1.306 238 HD1 PHE 43 HD1 PHE 43 118.469 2.053 4.782 239 HD2 PHE 43 HD2 PHE 43 119.741 -1.179 2.256 240 HE1 PHE 43 HE1 PHE 43 119.660 1.025 6.699 241 HE2 PHE 43 HE2 PHE 43 120.933 -2.207 4.173 242 HZ PHE 43 HZ PHE 43 120.892 -1.105 6.394 243 H THR 44 H THR 44 115.141 2.647 2.215 244 HA THR 44 HA THR 44 114.860 2.522 -0.776 245 HB THR 44 HB THR 44 112.675 2.886 1.295 246 HG1 THR 44 HG1 THR 44 112.103 0.780 0.650 247 HG21 THR 44 HG21 THR 44 112.728 2.785 -1.716 248 HG22 THR 44 HG22 THR 44 111.948 3.970 -0.668 249 HG23 THR 44 HG23 THR 44 111.274 2.346 -0.818 250 H TYR 45 H TYR 45 114.678 4.539 -1.815 251 HA TYR 45 HA TYR 45 114.500 6.967 -0.084 252 HB2 TYR 45 HB2 TYR 45 116.849 6.469 -0.748 253 HD1 TYR 45 HD2 TYR 45 116.753 8.598 0.541 254 HD2 TYR 45 HD1 TYR 45 115.915 8.452 -3.669 255 HE1 TYR 45 HE2 TYR 45 117.022 11.059 0.401 256 HE2 TYR 45 HE1 TYR 45 116.186 10.912 -3.809 257 HH TYR 45 HH TYR 45 116.106 12.853 -2.391 258 H THR 46 H THR 46 112.499 7.743 -0.732 259 HA THR 46 HA THR 46 111.883 7.738 -3.673 260 HB THR 46 HB THR 46 109.940 7.679 -1.349 261 HG1 THR 46 HG1 THR 46 110.095 5.543 -1.348 262 HG21 THR 46 HG21 THR 46 109.356 6.421 -3.963 263 HG22 THR 46 HG22 THR 46 109.475 8.181 -3.976 264 HG23 THR 46 HG23 THR 46 108.313 7.382 -2.917 265 H GLU 47 H GLU 47 111.018 9.678 -4.546 266 HA GLU 47 HA GLU 47 110.498 11.948 -2.698 267 HB2 GLU 47 HB2 GLU 47 112.108 13.342 -3.964 268 HG2 GLU 47 HG2 GLU 47 112.680 10.736 -5.412 269 H LYS 48 H LYS 48 109.588 13.845 -3.984 270 HA LYS 48 HA LYS 48 107.730 12.825 -6.067 271 HB2 LYS 48 HB2 LYS 48 107.956 15.432 -4.524 272 HG2 LYS 48 HG2 LYS 48 106.132 13.026 -4.233 273 HD2 LYS 48 HD2 LYS 48 106.165 15.709 -2.818 274 HE2 LYS 48 HE2 LYS 48 104.051 14.484 -1.732 275 HZ1 LYS 48 HZ1 LYS 48 106.922 14.135 -1.016 276 HZ2 LYS 48 HZ2 LYS 48 105.628 13.960 0.071 277 HZ3 LYS 48 HZ3 LYS 48 105.951 15.472 -0.634 278 H SER 49 H SER 49 107.809 13.556 -8.209 279 HA SER 49 HA SER 49 109.980 15.519 -8.887 280 HB2 SER 49 HB2 SER 49 110.482 13.142 -9.441 281 HG SER 49 HG SER 49 111.236 14.836 -10.779 282 H ARG 50 H ARG 50 109.333 17.213 -10.169 283 HA ARG 50 HA ARG 50 106.806 16.991 -11.734 284 HB2 ARG 50 HB2 ARG 50 107.483 19.074 -9.632 285 HG2 ARG 50 HG2 ARG 50 105.292 16.989 -9.867 286 HD2 ARG 50 HD2 ARG 50 104.414 19.114 -8.934 287 HE ARG 50 HE ARG 50 106.604 20.010 -8.101 288 HH11 ARG 50 HH21 ARG 50 106.799 17.307 -6.432 289 HH12 ARG 50 HH22 ARG 50 106.705 17.975 -4.837 290 HH21 ARG 50 HH11 ARG 50 105.639 21.092 -5.918 291 HH22 ARG 50 HH12 ARG 50 106.049 20.118 -4.546 292 H THR 51 H THR 51 106.655 18.719 -13.381 293 HA THR 51 HA THR 51 109.344 19.847 -14.088 294 HB THR 51 HB THR 51 106.976 19.130 -15.847 295 HG1 THR 51 HG1 THR 51 107.744 17.194 -15.810 296 HG21 THR 51 HG21 THR 51 108.392 19.556 -17.693 297 HG22 THR 51 HG22 THR 51 109.840 19.570 -16.685 298 HG23 THR 51 HG23 THR 51 108.690 20.905 -16.597 299 H ALA 52 H ALA 52 109.472 22.059 -14.273 300 HA ALA 52 HA ALA 52 107.065 23.677 -14.835 301 HB1 ALA 52 HB1 ALA 52 108.554 23.602 -12.205 302 HB2 ALA 52 HB2 ALA 52 106.820 23.435 -12.480 303 HB3 ALA 52 HB3 ALA 52 107.598 25.005 -12.682 304 H SER 53 H SER 53 107.644 25.921 -15.313 305 HA SER 53 HA SER 53 110.096 26.260 -16.745 306 HB2 SER 53 HB2 SER 53 109.322 28.558 -16.946 307 HG SER 53 HG SER 53 107.295 28.161 -15.088 308 H SER 54 H SER 54 109.289 26.719 -13.370 309 HA SER 54 HA SER 54 111.850 28.169 -12.869 310 HB2 SER 54 HB2 SER 54 109.667 29.034 -12.008 311 HG SER 54 HG SER 54 110.528 28.710 -9.638 312 H GLY 55 H GLY 55 113.359 27.321 -11.334 313 HA2 GLY 55 HA2 GLY 55 113.281 24.375 -11.078 314 H ASP 56 H ASP 56 111.650 26.380 -9.373 315 HA ASP 56 HA ASP 56 112.733 26.043 -6.665 316 HB2 ASP 56 HB2 ASP 56 111.423 28.016 -7.484 317 H TYR 57 H TYR 57 112.626 24.009 -5.775 318 HA TYR 57 HA TYR 57 110.071 22.468 -6.106 319 HB2 TYR 57 HB2 TYR 57 112.943 21.497 -5.974 320 HD1 TYR 57 HD1 TYR 57 109.934 20.733 -8.054 321 HD2 TYR 57 HD2 TYR 57 113.896 22.386 -7.941 322 HE1 TYR 57 HE1 TYR 57 109.915 20.946 -10.524 323 HE2 TYR 57 HE2 TYR 57 113.878 22.599 -10.411 324 HH TYR 57 HH TYR 57 111.640 21.053 -12.372 325 H ASN 58 H ASN 58 109.393 21.286 -4.250 326 HA ASN 58 HA ASN 58 109.869 22.432 -1.682 327 HB2 ASN 58 HB2 ASN 58 108.858 19.693 -2.519 328 HD21 ASN 58 HD21 ASN 58 107.983 23.037 -1.468 329 HD22 ASN 58 HD22 ASN 58 106.527 23.085 -2.341 330 H LYS 59 H LYS 59 111.471 19.830 -3.416 331 HA LYS 59 HA LYS 59 113.469 18.665 -2.978 332 HB2 LYS 59 HB2 LYS 59 114.109 21.084 -2.435 333 HG2 LYS 59 HG2 LYS 59 115.497 18.830 -0.948 334 HD2 LYS 59 HD2 LYS 59 116.439 21.587 -1.792 335 HE2 LYS 59 HE2 LYS 59 117.986 19.216 -0.675 336 HZ1 LYS 59 HZ1 LYS 59 119.785 20.882 -0.666 337 HZ2 LYS 59 HZ2 LYS 59 118.517 21.315 0.378 338 HZ3 LYS 59 HZ3 LYS 59 118.676 22.078 -1.132 339 H ASN 60 H ASN 60 111.033 17.748 -1.735 340 HA ASN 60 HA ASN 60 111.660 17.018 1.048 341 HB2 ASN 60 HB2 ASN 60 109.466 16.199 -0.890 342 HD21 ASN 60 HD21 ASN 60 107.361 17.398 -0.224 343 HD22 ASN 60 HD22 ASN 60 107.518 19.009 0.289 344 H GLN 61 H GLN 61 112.024 14.770 1.718 345 HA GLN 61 HA GLN 61 112.774 12.896 -0.496 346 HB2 GLN 61 HB2 GLN 61 114.366 13.655 1.976 347 HG2 GLN 61 HG2 GLN 61 114.962 14.001 -0.980 348 HE21 GLN 61 HE21 GLN 61 117.015 15.229 -1.295 349 HE22 GLN 61 HE22 GLN 61 118.216 15.189 -0.097 350 H TYR 62 H TYR 62 112.740 10.616 0.203 351 HA TYR 62 HA TYR 62 111.162 10.185 2.720 352 HB2 TYR 62 HB2 TYR 62 109.883 9.979 0.575 353 HD1 TYR 62 HD2 TYR 62 108.391 9.680 2.547 354 HD2 TYR 62 HD1 TYR 62 110.832 6.483 1.040 355 HE1 TYR 62 HE2 TYR 62 107.037 8.043 3.827 356 HE2 TYR 62 HE1 TYR 62 109.479 4.847 2.321 357 HH TYR 62 HH TYR 62 106.540 5.402 3.484 358 H TYR 63 H TYR 63 112.380 9.091 4.124 359 HA TYR 63 HA TYR 63 114.399 7.102 3.113 360 HB2 TYR 63 HB2 TYR 63 114.159 8.647 5.715 361 HD1 TYR 63 HD1 TYR 63 116.987 7.847 3.433 362 HD2 TYR 63 HD2 TYR 63 114.283 10.867 4.854 363 HE1 TYR 63 HE1 TYR 63 118.307 9.584 2.253 364 HE2 TYR 63 HE2 TYR 63 115.603 12.604 3.674 365 HH TYR 63 HH TYR 63 118.705 11.993 2.388 366 H GLY 64 H GLY 64 114.202 4.927 3.785 367 HA2 GLY 64 HA2 GLY 64 112.306 4.330 5.967 368 H ILE 65 H ILE 65 113.159 2.781 7.176 369 HA ILE 65 HA ILE 65 115.230 0.973 5.965 370 HB ILE 65 HB ILE 65 115.962 2.456 7.823 371 HG12 ILE 65 HG12 ILE 65 115.742 -0.378 8.856 372 HG21 ILE 65 HG21 ILE 65 113.841 2.730 8.995 373 HG22 ILE 65 HG22 ILE 65 115.029 2.047 10.102 374 HG23 ILE 65 HG23 ILE 65 113.799 1.010 9.381 375 HD11 ILE 65 HD11 ILE 65 116.929 0.964 10.393 376 HD12 ILE 65 HD12 ILE 65 117.699 1.904 9.115 377 HD13 ILE 65 HD13 ILE 65 118.204 0.241 9.413 378 H THR 66 H THR 66 114.793 -1.273 6.034 379 HA THR 66 HA THR 66 112.559 -2.201 7.726 380 HB THR 66 HB THR 66 111.765 -3.307 5.412 381 HG1 THR 66 HG1 THR 66 112.719 -0.766 4.627 382 HG21 THR 66 HG21 THR 66 111.030 -0.437 5.904 383 HG22 THR 66 HG22 THR 66 110.620 -1.669 7.097 384 HG23 THR 66 HG23 THR 66 109.990 -1.787 5.453 385 H ALA 67 H ALA 67 112.803 -4.348 8.312 386 HA ALA 67 HA ALA 67 114.487 -6.171 6.741 387 HB1 ALA 67 HB1 ALA 67 116.245 -5.185 7.966 388 HB2 ALA 67 HB2 ALA 67 115.803 -6.552 8.990 389 HB3 ALA 67 HB3 ALA 67 115.231 -4.931 9.387 390 H GLY 68 H GLY 68 114.077 -8.407 7.435 391 HA2 GLY 68 HA2 GLY 68 112.497 -8.973 9.790 392 HA PRO 69 HA PRO 69 113.603 -13.117 8.928 393 HB2 PRO 69 HB2 PRO 69 111.329 -14.603 9.275 394 HG2 PRO 69 HG2 PRO 69 109.742 -12.937 9.247 395 HD2 PRO 69 HD2 PRO 69 110.309 -10.719 9.344 396 H ALA 70 H ALA 70 113.180 -15.060 7.481 397 HA ALA 70 HA ALA 70 111.414 -14.614 5.154 398 HB1 ALA 70 HB1 ALA 70 113.429 -14.761 3.619 399 HB2 ALA 70 HB2 ALA 70 114.444 -14.567 5.049 400 HB3 ALA 70 HB3 ALA 70 113.341 -13.277 4.569 401 H TYR 71 H TYR 71 110.992 -16.571 4.053 402 HA TYR 71 HA TYR 71 112.351 -19.008 5.169 403 HB2 TYR 71 HB2 TYR 71 109.495 -18.554 4.239 404 HD1 TYR 71 HD1 TYR 71 110.922 -20.325 7.174 405 HD2 TYR 71 HD2 TYR 71 108.911 -16.799 5.768 406 HE1 TYR 71 HE1 TYR 71 110.479 -19.644 9.517 407 HE2 TYR 71 HE2 TYR 71 108.468 -16.117 8.112 408 HH TYR 71 HH TYR 71 110.044 -17.313 10.702 409 H ARG 72 H ARG 72 113.056 -20.523 3.652 410 HA ARG 72 HA ARG 72 112.770 -19.734 0.778 411 HB2 ARG 72 HB2 ARG 72 115.033 -19.844 1.893 412 HG2 ARG 72 HG2 ARG 72 114.499 -21.830 -0.340 413 HD2 ARG 72 HD2 ARG 72 117.047 -20.424 0.548 414 HE ARG 72 HE ARG 72 116.476 -20.710 -2.025 415 HH11 ARG 72 HH21 ARG 72 116.586 -23.763 -1.487 416 HH12 ARG 72 HH22 ARG 72 118.168 -24.124 -2.093 417 HH21 ARG 72 HH11 ARG 72 119.186 -20.809 -2.159 418 HH22 ARG 72 HH12 ARG 72 119.640 -22.451 -2.473 419 H ILE 73 H ILE 73 111.533 -21.039 -0.484 420 HA ILE 73 HA ILE 73 111.044 -23.858 0.388 421 HB ILE 73 HB ILE 73 109.170 -21.926 -1.026 422 HG12 ILE 73 HG12 ILE 73 109.527 -21.216 1.293 423 HG21 ILE 73 HG21 ILE 73 107.484 -23.626 -0.711 424 HG22 ILE 73 HG22 ILE 73 108.589 -24.614 0.245 425 HG23 ILE 73 HG23 ILE 73 108.875 -24.388 -1.481 426 HD11 ILE 73 HD11 ILE 73 109.438 -24.131 1.748 427 HD12 ILE 73 HD12 ILE 73 108.531 -23.183 2.928 428 HD13 ILE 73 HD13 ILE 73 110.249 -22.871 2.678 429 H ASN 74 H ASN 74 112.096 -25.121 -1.075 430 HA ASN 74 HA ASN 74 112.867 -25.974 -3.144 431 HB2 ASN 74 HB2 ASN 74 110.306 -25.541 -3.470 432 HD21 ASN 74 HD21 ASN 74 109.886 -25.349 -6.346 433 HD22 ASN 74 HD22 ASN 74 110.783 -26.592 -7.076 434 H ASP 75 H ASP 75 113.650 -25.071 -5.425 435 HA ASP 75 HA ASP 75 115.715 -23.184 -5.001 436 HB2 ASP 75 HB2 ASP 75 114.243 -24.071 -7.498 437 H TRP 76 H TRP 76 112.400 -22.665 -6.207 438 HA TRP 76 HA TRP 76 112.943 -19.711 -6.183 439 HB2 TRP 76 HB2 TRP 76 111.059 -21.417 -7.838 440 HD1 TRP 76 HD1 TRP 76 114.167 -19.117 -7.893 441 HE1 TRP 76 HE1 TRP 76 115.667 -19.841 -9.860 442 HE3 TRP 76 HE3 TRP 76 111.235 -22.761 -9.943 443 HZ2 TRP 76 HZ2 TRP 76 115.628 -21.716 -12.018 444 HZ3 TRP 76 HZ3 TRP 76 111.989 -23.998 -11.953 445 HH2 TRP 76 HH2 TRP 76 114.181 -23.482 -12.992 446 H ALA 77 H ALA 77 110.749 -18.479 -5.917 447 HA ALA 77 HA ALA 77 108.803 -17.994 -4.671 448 HB1 ALA 77 HB1 ALA 77 108.647 -20.833 -3.729 449 HB2 ALA 77 HB2 ALA 77 108.409 -20.504 -5.443 450 HB3 ALA 77 HB3 ALA 77 107.351 -19.755 -4.248 451 H SER 78 H SER 78 109.882 -16.733 -3.124 452 HA SER 78 HA SER 78 110.561 -18.134 -0.549 453 HB2 SER 78 HB2 SER 78 111.851 -15.708 -1.842 454 HG SER 78 HG SER 78 112.425 -17.601 -2.879 455 H ILE 79 H ILE 79 109.874 -16.998 1.384 456 HA ILE 79 HA ILE 79 108.079 -14.639 0.868 457 HB ILE 79 HB ILE 79 107.808 -16.903 2.877 458 HG12 ILE 79 HG12 ILE 79 106.143 -16.299 0.413 459 HG21 ILE 79 HG21 ILE 79 106.138 -14.462 2.252 460 HG22 ILE 79 HG22 ILE 79 106.767 -14.982 3.816 461 HG23 ILE 79 HG23 ILE 79 105.454 -15.878 3.051 462 HD11 ILE 79 HD11 ILE 79 105.571 -17.786 2.710 463 HD12 ILE 79 HD12 ILE 79 106.075 -18.994 1.528 464 HD13 ILE 79 HD13 ILE 79 104.739 -17.903 1.159 465 H TYR 80 H TYR 80 108.427 -12.861 2.194 466 HA TYR 80 HA TYR 80 110.004 -13.216 4.690 467 HB2 TYR 80 HB2 TYR 80 111.679 -11.622 3.977 468 HD1 TYR 80 HD1 TYR 80 110.302 -12.332 0.610 469 HD2 TYR 80 HD2 TYR 80 111.036 -9.334 3.598 470 HE1 TYR 80 HE1 TYR 80 109.778 -10.557 -1.042 471 HE2 TYR 80 HE2 TYR 80 110.512 -7.559 1.947 472 HH TYR 80 HH TYR 80 110.360 -8.111 -1.354 473 H GLY 81 H GLY 81 110.044 -11.145 5.972 474 HA2 GLY 81 HA2 GLY 81 107.650 -9.441 5.397 475 H VAL 82 H VAL 82 107.833 -7.245 6.427 476 HA VAL 82 HA VAL 82 110.675 -6.432 6.885 477 HB VAL 82 HB VAL 82 110.218 -4.483 5.408 478 HG11 VAL 82 HG11 VAL 82 110.720 -5.659 3.498 479 HG12 VAL 82 HG12 VAL 82 109.421 -6.826 3.750 480 HG13 VAL 82 HG13 VAL 82 110.922 -6.966 4.665 481 HG21 VAL 82 HG21 VAL 82 107.741 -4.466 5.779 482 HG22 VAL 82 HG22 VAL 82 107.619 -5.926 4.797 483 HG23 VAL 82 HG23 VAL 82 108.178 -4.418 4.072 484 H VAL 83 H VAL 83 110.944 -4.863 8.437 485 HA VAL 83 HA VAL 83 108.577 -3.403 9.502 486 HB VAL 83 HB VAL 83 109.278 -4.066 11.806 487 HG11 VAL 83 HG11 VAL 83 107.603 -5.377 10.379 488 HG12 VAL 83 HG12 VAL 83 108.315 -6.244 11.740 489 HG13 VAL 83 HG13 VAL 83 108.905 -6.536 10.103 490 HG21 VAL 83 HG21 VAL 83 110.904 -6.347 10.967 491 HG22 VAL 83 HG22 VAL 83 111.229 -5.141 12.211 492 HG23 VAL 83 HG23 VAL 83 111.657 -4.813 10.533 493 H GLY 84 H GLY 84 109.247 -1.379 10.552 494 HA2 GLY 84 HA2 GLY 84 111.720 -0.548 11.342 495 H VAL 85 H VAL 85 111.996 1.808 9.675 496 HA VAL 85 HA VAL 85 109.488 3.281 10.424 497 HB VAL 85 HB VAL 85 111.231 3.475 12.134 498 HG11 VAL 85 HG11 VAL 85 113.258 3.143 10.966 499 HG12 VAL 85 HG12 VAL 85 113.304 4.841 11.433 500 HG13 VAL 85 HG13 VAL 85 112.883 4.393 9.781 501 HG21 VAL 85 HG21 VAL 85 109.824 5.408 11.918 502 HG22 VAL 85 HG22 VAL 85 110.691 5.958 10.484 503 HG23 VAL 85 HG23 VAL 85 111.475 6.009 12.063 504 H GLY 86 H GLY 86 108.866 4.924 9.206 505 HA2 GLY 86 HA2 GLY 86 110.351 5.483 6.652 506 H TYR 87 H TYR 87 110.914 7.639 6.195 507 HA TYR 87 HA TYR 87 110.033 9.676 8.223 508 HB2 TYR 87 HB2 TYR 87 112.645 9.271 6.747 509 HD1 TYR 87 HD2 TYR 87 111.723 10.402 10.172 510 HD2 TYR 87 HD1 TYR 87 113.351 7.241 7.763 511 HE1 TYR 87 HE2 TYR 87 112.401 9.189 12.225 512 HE2 TYR 87 HE1 TYR 87 114.032 6.029 9.817 513 HH TYR 87 HH TYR 87 114.287 7.396 12.758 514 H GLY 88 H GLY 88 109.379 11.684 7.431 515 HA2 GLY 88 HA2 GLY 88 109.397 12.031 4.459 516 H LYS 89 H LYS 89 110.749 13.713 4.022 517 HA LYS 89 HA LYS 89 111.064 15.884 6.047 518 HB2 LYS 89 HB2 LYS 89 113.009 14.570 5.129 519 HG2 LYS 89 HG2 LYS 89 114.325 16.666 4.438 520 HD2 LYS 89 HD2 LYS 89 112.675 16.836 6.977 521 HE2 LYS 89 HE2 LYS 89 114.358 18.717 6.103 522 HZ1 LYS 89 HZ1 LYS 89 116.095 16.683 7.410 523 HZ2 LYS 89 HZ2 LYS 89 116.592 18.166 6.747 524 HZ3 LYS 89 HZ3 LYS 89 116.022 16.928 5.734 525 H PHE 90 H PHE 90 109.910 17.729 5.683 526 HA PHE 90 HA PHE 90 109.213 18.446 2.852 527 HB2 PHE 90 HB2 PHE 90 107.746 18.913 5.469 528 HD1 PHE 90 HD1 PHE 90 106.499 17.893 2.137 529 HD2 PHE 90 HD2 PHE 90 107.576 16.581 6.082 530 HE1 PHE 90 HE1 PHE 90 105.440 15.694 1.694 531 HE2 PHE 90 HE2 PHE 90 106.517 14.383 5.641 532 HZ PHE 90 HZ PHE 90 105.449 13.939 3.447 533 H GLN 91 H GLN 91 109.498 20.641 2.261 534 HA GLN 91 HA GLN 91 111.571 22.147 3.489 535 HB2 GLN 91 HB2 GLN 91 110.688 22.300 1.140 536 HG2 GLN 91 HG2 GLN 91 110.717 24.904 2.701 537 HE21 GLN 91 HE21 GLN 91 111.768 26.643 1.152 538 HE22 GLN 91 HE22 GLN 91 111.222 26.630 -0.456 539 H THR 92 H THR 92 108.046 22.297 3.903 540 HA THR 92 HA THR 92 106.722 23.369 5.536 541 HB THR 92 HB THR 92 109.268 23.742 7.109 542 HG1 THR 92 HG1 THR 92 109.623 21.695 7.000 543 HG21 THR 92 HG21 THR 92 107.893 23.661 8.946 544 HG22 THR 92 HG22 THR 92 106.772 22.530 8.188 545 HG23 THR 92 HG23 THR 92 106.714 24.241 7.770 546 H THR 93 H THR 93 106.219 25.522 6.327 547 HA THR 93 HA THR 93 107.861 27.662 5.024 548 HB THR 93 HB THR 93 105.717 28.908 5.049 549 HG1 THR 93 HG1 THR 93 104.787 28.043 6.878 550 HG21 THR 93 HG21 THR 93 105.610 26.092 3.941 551 HG22 THR 93 HG22 THR 93 106.152 27.544 3.102 552 HG23 THR 93 HG23 THR 93 104.451 27.355 3.526 553 H GLU 94 H GLU 94 107.793 26.341 7.966 554 HA GLU 94 HA GLU 94 107.099 28.392 9.815 555 HB2 GLU 94 HB2 GLU 94 109.215 26.217 9.892 556 HG2 GLU 94 HG2 GLU 94 106.344 26.325 10.872 557 H TYR 95 H TYR 95 108.273 30.141 10.645 558 HA TYR 95 HA TYR 95 110.215 31.442 9.020 559 HB2 TYR 95 HB2 TYR 95 109.045 31.693 11.741 560 HD1 TYR 95 HD2 TYR 95 107.517 31.879 9.394 561 HD2 TYR 95 HD1 TYR 95 110.274 34.780 10.952 562 HE1 TYR 95 HE2 TYR 95 106.321 33.672 8.169 563 HE2 TYR 95 HE1 TYR 95 109.078 36.574 9.726 564 HH TYR 95 HH TYR 95 106.824 35.941 7.283 565 HA PRO 96 HA PRO 96 113.959 29.377 10.077 566 HB2 PRO 96 HB2 PRO 96 115.759 31.427 9.810 567 HG2 PRO 96 HG2 PRO 96 114.292 33.207 9.698 568 HD2 PRO 96 HD2 PRO 96 112.035 32.920 9.342 569 H THR 97 H THR 97 112.928 32.223 11.835 570 HA THR 97 HA THR 97 114.939 32.381 13.841 571 HB THR 97 HB THR 97 111.949 32.830 14.110 572 HG1 THR 97 HG1 THR 97 113.978 34.597 13.217 573 HG21 THR 97 HG21 THR 97 112.529 34.398 15.826 574 HG22 THR 97 HG22 THR 97 114.246 34.281 15.438 575 HG23 THR 97 HG23 THR 97 113.415 32.915 16.184 576 H TYR 98 H TYR 98 111.949 30.419 13.736 577 HA TYR 98 HA TYR 98 113.104 28.713 15.918 578 HB2 TYR 98 HB2 TYR 98 110.244 29.645 15.507 579 HD1 TYR 98 HD2 TYR 98 112.631 29.339 18.373 580 HD2 TYR 98 HD1 TYR 98 110.336 31.967 15.868 581 HE1 TYR 98 HE2 TYR 98 113.246 31.256 19.822 582 HE2 TYR 98 HE1 TYR 98 110.949 33.884 17.317 583 HH TYR 98 HH TYR 98 113.431 33.744 19.594 584 H LYS 99 H LYS 99 112.845 26.484 15.601 585 HA LYS 99 HA LYS 99 112.458 24.485 14.407 586 HB2 LYS 99 HB2 LYS 99 109.998 26.088 13.625 587 HG2 LYS 99 HG2 LYS 99 110.614 24.263 15.967 588 HD2 LYS 99 HD2 LYS 99 108.369 23.806 14.962 589 HE2 LYS 99 HE2 LYS 99 108.086 26.790 15.407 590 HZ1 LYS 99 HZ1 LYS 99 105.934 24.773 15.018 591 HZ2 LYS 99 HZ2 LYS 99 105.739 26.431 15.329 592 HZ3 LYS 99 HZ3 LYS 99 106.356 25.404 16.533 593 H ASN 100 H ASN 100 114.368 25.543 13.041 594 HA ASN 100 HA ASN 100 114.004 26.758 10.526 595 HB2 ASN 100 HB2 ASN 100 115.994 24.652 11.437 596 HD21 ASN 100 HD21 ASN 100 118.077 25.797 12.157 597 HD22 ASN 100 HD22 ASN 100 117.929 27.302 12.929 598 H ASP 101 H ASP 101 113.849 23.295 11.370 599 HA ASP 101 HA ASP 101 112.081 22.706 9.137 600 HB2 ASP 101 HB2 ASP 101 114.382 23.044 8.109 601 H THR 102 H THR 102 110.995 20.792 9.600 602 HA THR 102 HA THR 102 112.245 18.891 11.540 603 HB THR 102 HB THR 102 110.756 20.578 12.657 604 HG1 THR 102 HG1 THR 102 109.656 17.972 12.653 605 HG21 THR 102 HG21 THR 102 108.284 19.326 11.709 606 HG22 THR 102 HG22 THR 102 109.137 20.209 10.442 607 HG23 THR 102 HG23 THR 102 108.667 21.034 11.929 608 H SER 103 H SER 103 111.386 16.720 11.383 609 HA SER 103 HA SER 103 109.686 16.195 8.966 610 HB2 SER 103 HB2 SER 103 111.199 14.335 8.458 611 HG SER 103 HG SER 103 112.152 13.557 10.144 612 H ASP 104 H ASP 104 108.402 14.229 9.133 613 HA ASP 104 HA ASP 104 107.963 13.350 11.967 614 HB2 ASP 104 HB2 ASP 104 106.146 14.549 10.703 615 H TYR 105 H TYR 105 107.792 11.074 12.391 616 HA TYR 105 HA TYR 105 108.563 9.285 10.117 617 HB2 TYR 105 HB2 TYR 105 110.066 8.158 11.660 618 HD1 TYR 105 HD2 TYR 105 109.609 11.246 13.654 619 HD2 TYR 105 HD1 TYR 105 109.133 6.979 13.546 620 HE1 TYR 105 HE2 TYR 105 109.160 11.234 16.093 621 HE2 TYR 105 HE1 TYR 105 108.684 6.967 15.984 622 HH TYR 105 HH TYR 105 109.484 9.093 18.012 623 H GLY 106 H GLY 106 108.012 6.922 10.673 624 HA2 GLY 106 HA2 GLY 106 105.914 6.477 12.662 625 H PHE 107 H PHE 107 104.925 4.073 11.984 626 HA PHE 107 HA PHE 107 107.385 2.409 11.685 627 HB2 PHE 107 HB2 PHE 107 105.948 2.297 13.724 628 HD1 PHE 107 HD1 PHE 107 107.960 0.869 14.004 629 HD2 PHE 107 HD2 PHE 107 104.510 -0.480 11.827 630 HE1 PHE 107 HE1 PHE 107 108.784 -1.466 14.144 631 HE2 PHE 107 HE2 PHE 107 105.335 -2.815 11.969 632 HZ PHE 107 HZ PHE 107 107.471 -3.307 13.126 633 H SER 108 H SER 108 107.498 0.749 10.157 634 HA SER 108 HA SER 108 105.293 0.644 8.121 635 HB2 SER 108 HB2 SER 108 108.285 0.209 7.840 636 HG SER 108 HG SER 108 108.353 2.266 7.569 637 H TYR 109 H TYR 109 104.762 -1.461 7.304 638 HA TYR 109 HA TYR 109 106.131 -3.840 8.405 639 HB2 TYR 109 HB2 TYR 109 104.501 -3.051 10.135 640 HD1 TYR 109 HD1 TYR 109 105.719 -5.040 10.976 641 HD2 TYR 109 HD2 TYR 109 102.380 -5.403 8.298 642 HE1 TYR 109 HE1 TYR 109 105.535 -7.450 11.532 643 HE2 TYR 109 HE2 TYR 109 102.195 -7.813 8.854 644 HH TYR 109 HH TYR 109 103.201 -9.211 11.320 645 H GLY 110 H GLY 110 105.712 -5.707 7.082 646 HA2 GLY 110 HA2 GLY 110 103.547 -6.150 5.380 647 H ALA 111 H ALA 111 104.391 -7.354 3.213 648 HA ALA 111 HA ALA 111 106.901 -8.849 3.556 649 HB1 ALA 111 HB1 ALA 111 105.612 -11.029 3.736 650 HB2 ALA 111 HB2 ALA 111 104.153 -10.072 3.989 651 HB3 ALA 111 HB3 ALA 111 105.472 -9.993 5.157 652 H GLY 112 H GLY 112 107.179 -10.381 1.586 653 HA2 GLY 112 HA2 GLY 112 105.190 -9.946 -0.555 654 H LEU 113 H LEU 113 106.266 -11.075 -2.662 655 HA LEU 113 HA LEU 113 107.626 -13.606 -1.831 656 HB2 LEU 113 HB2 LEU 113 105.150 -13.881 -1.848 657 HG LEU 113 HG LEU 113 106.786 -15.246 -3.990 658 HD11 LEU 113 HD11 LEU 113 106.797 -15.463 -1.254 659 HD12 LEU 113 HD12 LEU 113 107.295 -16.744 -2.358 660 HD13 LEU 113 HD13 LEU 113 105.657 -16.732 -1.704 661 HD21 LEU 113 HD21 LEU 113 105.002 -16.774 -4.402 662 HD22 LEU 113 HD22 LEU 113 104.268 -15.173 -4.500 663 HD23 LEU 113 HD23 LEU 113 104.057 -16.153 -3.048 664 H GLN 114 H GLN 114 108.896 -14.542 -3.564 665 HA GLN 114 HA GLN 114 109.040 -12.898 -6.065 666 HB2 GLN 114 HB2 GLN 114 111.497 -13.271 -5.946 667 HG2 GLN 114 HG2 GLN 114 110.847 -14.574 -3.284 668 HE21 GLN 114 HE21 GLN 114 112.371 -13.304 -2.055 669 HE22 GLN 114 HE22 GLN 114 114.036 -13.315 -2.384 670 H PHE 115 H PHE 115 109.562 -14.123 -7.999 671 HA PHE 115 HA PHE 115 109.856 -17.055 -7.771 672 HB2 PHE 115 HB2 PHE 115 107.750 -17.465 -9.008 673 HD1 PHE 115 HD1 PHE 115 106.937 -14.196 -7.460 674 HD2 PHE 115 HD2 PHE 115 107.349 -16.394 -11.128 675 HE1 PHE 115 HE1 PHE 115 105.839 -12.345 -8.693 676 HE2 PHE 115 HE2 PHE 115 106.251 -14.543 -12.360 677 HZ PHE 115 HZ PHE 115 105.496 -12.519 -11.143 678 H ASN 116 H ASN 116 110.209 -18.045 -9.896 679 HA ASN 116 HA ASN 116 110.340 -16.694 -12.394 680 HB2 ASN 116 HB2 ASN 116 112.314 -15.849 -10.506 681 HD21 ASN 116 HD21 ASN 116 110.150 -14.755 -12.097 682 HD22 ASN 116 HD22 ASN 116 110.817 -13.631 -13.180 683 HA PRO 117 HA PRO 117 111.697 -20.858 -13.270 684 HB2 PRO 117 HB2 PRO 117 111.396 -20.749 -15.982 685 HG2 PRO 117 HG2 PRO 117 110.925 -18.591 -16.463 686 HD2 PRO 117 HD2 PRO 117 111.326 -17.157 -14.769 687 H MET 118 H MET 118 113.807 -19.131 -12.717 688 HA MET 118 HA MET 118 115.800 -19.861 -14.775 689 HB2 MET 118 HB2 MET 118 115.230 -17.084 -13.695 690 HG2 MET 118 HG2 MET 118 115.038 -18.319 -16.456 691 HE1 MET 118 HE1 MET 118 116.658 -16.329 -18.148 692 HE2 MET 118 HE2 MET 118 117.091 -17.145 -16.648 693 HE3 MET 118 HE3 MET 118 117.351 -15.409 -16.806 694 H GLU 119 H GLU 119 117.735 -20.328 -13.830 695 HA GLU 119 HA GLU 119 117.899 -20.871 -11.032 696 HB2 GLU 119 HB2 GLU 119 119.989 -20.639 -13.211 697 HG2 GLU 119 HG2 GLU 119 118.479 -22.990 -12.021 698 H ASN 120 H ASN 120 119.264 -18.115 -12.937 699 HA ASN 120 HA ASN 120 120.150 -16.944 -10.324 700 HB2 ASN 120 HB2 ASN 120 121.118 -16.603 -13.174 701 HD21 ASN 120 HD21 ASN 120 123.398 -17.510 -13.344 702 HD22 ASN 120 HD22 ASN 120 123.824 -18.823 -12.356 703 H VAL 121 H VAL 121 117.489 -16.611 -12.131 704 HA VAL 121 HA VAL 121 117.516 -13.614 -11.915 705 HB VAL 121 HB VAL 121 116.060 -15.370 -13.917 706 HG11 VAL 121 HG11 VAL 121 115.165 -13.438 -14.833 707 HG12 VAL 121 HG12 VAL 121 116.459 -12.419 -14.204 708 HG13 VAL 121 HG13 VAL 121 115.189 -12.995 -13.125 709 HG21 VAL 121 HG21 VAL 121 117.737 -13.930 -15.423 710 HG22 VAL 121 HG22 VAL 121 118.227 -15.472 -14.718 711 HG23 VAL 121 HG23 VAL 121 118.693 -13.959 -13.941 712 H ALA 122 H ALA 122 115.822 -12.748 -10.735 713 HA ALA 122 HA ALA 122 113.409 -14.396 -10.228 714 HB1 ALA 122 HB1 ALA 122 114.019 -13.721 -7.670 715 HB2 ALA 122 HB2 ALA 122 115.636 -13.914 -8.346 716 HB3 ALA 122 HB3 ALA 122 114.489 -15.251 -8.412 717 H LEU 123 H LEU 123 111.618 -13.196 -9.876 718 HA LEU 123 HA LEU 123 111.916 -10.219 -9.652 719 HB2 LEU 123 HB2 LEU 123 109.554 -11.977 -10.427 720 HG LEU 123 HG LEU 123 111.420 -12.113 -12.051 721 HD11 LEU 123 HD11 LEU 123 108.918 -10.592 -12.767 722 HD12 LEU 123 HD12 LEU 123 109.320 -12.276 -13.104 723 HD13 LEU 123 HD13 LEU 123 110.114 -10.984 -14.003 724 HD21 LEU 123 HD21 LEU 123 112.688 -10.167 -11.853 725 HD22 LEU 123 HD22 LEU 123 111.264 -9.129 -11.757 726 HD23 LEU 123 HD23 LEU 123 111.758 -9.807 -13.309 727 H ASP 124 H ASP 124 110.576 -9.132 -7.913 728 HA ASP 124 HA ASP 124 109.370 -11.022 -5.959 729 HB2 ASP 124 HB2 ASP 124 111.789 -10.629 -5.429 730 H PHE 125 H PHE 125 107.530 -10.141 -5.029 731 HA PHE 125 HA PHE 125 107.075 -7.195 -5.362 732 HB2 PHE 125 HB2 PHE 125 105.864 -8.717 -7.001 733 HD1 PHE 125 HD2 PHE 125 105.551 -6.319 -7.577 734 HD2 PHE 125 HD1 PHE 125 103.273 -8.221 -4.471 735 HE1 PHE 125 HE2 PHE 125 103.929 -4.444 -7.619 736 HE2 PHE 125 HE1 PHE 125 101.652 -6.344 -4.515 737 HZ PHE 125 HZ PHE 125 101.979 -4.457 -6.087 738 H SER 126 H SER 126 106.141 -6.218 -3.506 739 HA SER 126 HA SER 126 105.242 -8.010 -1.297 740 HB2 SER 126 HB2 SER 126 107.695 -7.591 -1.128 741 HG SER 126 HG SER 126 107.557 -7.278 0.980 742 H TYR 127 H TYR 127 103.982 -6.904 0.319 743 HA TYR 127 HA TYR 127 102.814 -4.310 -0.621 744 HB2 TYR 127 HB2 TYR 127 101.806 -6.478 1.257 745 HD1 TYR 127 HD2 TYR 127 100.030 -4.753 -1.475 746 HD2 TYR 127 HD1 TYR 127 102.154 -8.303 -0.317 747 HE1 TYR 127 HE2 TYR 127 99.203 -5.911 -3.507 748 HE2 TYR 127 HE1 TYR 127 101.326 -9.460 -2.347 749 HH TYR 127 HH TYR 127 100.375 -8.241 -4.897 750 H GLU 128 H GLU 128 103.585 -2.566 0.535 751 HA GLU 128 HA GLU 128 104.196 -2.971 3.443 752 HB2 GLU 128 HB2 GLU 128 106.217 -2.935 1.975 753 HG2 GLU 128 HG2 GLU 128 105.828 -0.527 3.782 754 H GLN 129 H GLN 129 103.602 -1.258 4.786 755 HA GLN 129 HA GLN 129 102.525 1.224 3.533 756 HB2 GLN 129 HB2 GLN 129 100.476 0.982 4.884 757 HG2 GLN 129 HG2 GLN 129 101.825 -1.569 5.813 758 HE21 GLN 129 HE21 GLN 129 99.643 -1.186 8.051 759 HE22 GLN 129 HE22 GLN 129 98.277 -1.934 7.375 760 H SER 130 H SER 130 102.498 3.034 5.056 761 HA SER 130 HA SER 130 103.839 2.545 7.679 762 HB2 SER 130 HB2 SER 130 105.524 3.061 5.909 763 HG SER 130 HG SER 130 105.330 5.347 7.506 764 H ARG 131 H ARG 131 103.129 3.966 9.281 765 HA ARG 131 HA ARG 131 101.319 6.197 8.415 766 HB2 ARG 131 HB2 ARG 131 101.004 4.160 10.644 767 HG2 ARG 131 HG2 ARG 131 99.424 4.741 8.119 768 HD2 ARG 131 HD2 ARG 131 97.935 4.166 10.025 769 HE ARG 131 HE ARG 131 99.631 2.902 11.371 770 HH11 ARG 131 HH21 ARG 131 97.005 1.307 10.336 771 HH12 ARG 131 HH22 ARG 131 97.696 -0.281 10.300 772 HH21 ARG 131 HH11 ARG 131 100.956 0.840 10.676 773 HH22 ARG 131 HH12 ARG 131 99.933 -0.545 10.491 774 H ILE 132 H ILE 132 101.815 8.144 9.391 775 HA ILE 132 HA ILE 132 103.601 8.076 11.783 776 HB ILE 132 HB ILE 132 104.821 9.945 10.829 777 HG12 ILE 132 HG12 ILE 132 102.859 9.887 8.519 778 HG21 ILE 132 HG21 ILE 132 106.007 8.546 9.523 779 HG22 ILE 132 HG22 ILE 132 104.771 8.611 8.271 780 HG23 ILE 132 HG23 ILE 132 104.658 7.416 9.556 781 HD11 ILE 132 HD11 ILE 132 105.404 11.336 9.123 782 HD12 ILE 132 HD12 ILE 132 104.140 12.216 8.262 783 HD13 ILE 132 HD13 ILE 132 104.801 10.729 7.581 784 H ARG 133 H ARG 133 100.891 8.072 12.107 785 HA ARG 133 HA ARG 133 99.158 9.193 13.211 786 HB2 ARG 133 HB2 ARG 133 101.416 11.167 13.667 787 HG2 ARG 133 HG2 ARG 133 100.346 8.841 15.296 788 HD2 ARG 133 HD2 ARG 133 102.455 10.942 15.916 789 HE ARG 133 HE ARG 133 101.919 8.548 17.607 790 HH11 ARG 133 HH11 ARG 133 103.439 7.802 15.129 791 HH12 ARG 133 HH12 ARG 133 105.082 8.008 15.638 792 HH21 ARG 133 HH21 ARG 133 104.262 9.906 18.422 793 HH22 ARG 133 HH22 ARG 133 105.547 9.198 17.501 794 H SER 134 H SER 134 101.045 11.729 11.492 795 HA SER 134 HA SER 134 98.525 13.057 10.703 796 HB2 SER 134 HB2 SER 134 101.457 13.726 10.311 797 HG SER 134 HG SER 134 101.306 14.714 12.171 798 H VAL 135 H VAL 135 100.954 10.963 9.327 799 HA VAL 135 HA VAL 135 99.537 11.240 6.689 800 HB VAL 135 HB VAL 135 102.538 11.055 7.062 801 HG11 VAL 135 HG11 VAL 135 102.493 11.683 4.620 802 HG12 VAL 135 HG12 VAL 135 100.753 11.399 4.647 803 HG13 VAL 135 HG13 VAL 135 101.869 10.072 4.971 804 HG21 VAL 135 HG21 VAL 135 102.472 13.421 6.195 805 HG22 VAL 135 HG22 VAL 135 101.776 13.235 7.805 806 HG23 VAL 135 HG23 VAL 135 100.720 13.389 6.401 807 H ASP 136 H ASP 136 99.119 9.341 5.655 808 HA ASP 136 HA ASP 136 100.433 6.842 6.649 809 HB2 ASP 136 HB2 ASP 136 97.494 7.405 6.108 810 H VAL 137 H VAL 137 101.544 6.113 4.848 811 HA VAL 137 HA VAL 137 100.198 6.374 2.184 812 HB VAL 137 HB VAL 137 102.528 6.555 1.320 813 HG11 VAL 137 HG11 VAL 137 102.461 8.548 3.535 814 HG12 VAL 137 HG12 VAL 137 101.064 8.503 2.459 815 HG13 VAL 137 HG13 VAL 137 102.673 8.799 1.802 816 HG21 VAL 137 HG21 VAL 137 103.362 6.670 4.231 817 HG22 VAL 137 HG22 VAL 137 104.409 6.655 2.811 818 HG23 VAL 137 HG23 VAL 137 103.502 5.208 3.253 819 H GLY 138 H GLY 138 100.373 4.575 0.769 820 HA2 GLY 138 HA2 GLY 138 101.332 2.041 2.057 821 H THR 139 H THR 139 103.029 1.052 0.983 822 HA THR 139 HA THR 139 103.568 1.987 -1.816 823 HB THR 139 HB THR 139 105.018 2.953 -0.012 824 HG1 THR 139 HG1 THR 139 106.355 1.179 -1.768 825 HG21 THR 139 HG21 THR 139 106.288 0.239 0.241 826 HG22 THR 139 HG22 THR 139 104.943 0.688 1.288 827 HG23 THR 139 HG23 THR 139 106.429 1.634 1.311 828 H TRP 140 H TRP 140 104.256 0.485 -3.284 829 HA TRP 140 HA TRP 140 104.481 -2.369 -2.384 830 HB2 TRP 140 HB2 TRP 140 103.270 -1.157 -4.899 831 HD1 TRP 140 HD1 TRP 140 102.650 -2.484 -1.388 832 HE1 TRP 140 HE1 TRP 140 100.148 -2.240 -0.826 833 HE3 TRP 140 HE3 TRP 140 100.847 -1.109 -5.965 834 HZ2 TRP 140 HZ2 TRP 140 97.703 -1.556 -2.141 835 HZ3 TRP 140 HZ3 TRP 140 98.429 -0.670 -6.281 836 HH2 TRP 140 HH2 TRP 140 96.856 -0.891 -4.376 837 H ILE 141 H ILE 141 106.298 -3.458 -3.264 838 HA ILE 141 HA ILE 141 108.031 -1.805 -5.073 839 HB ILE 141 HB ILE 141 109.919 -2.878 -3.886 840 HG12 ILE 141 HG12 ILE 141 107.784 -4.109 -2.116 841 HG21 ILE 141 HG21 ILE 141 109.563 -0.930 -2.750 842 HG22 ILE 141 HG22 ILE 141 109.027 -2.015 -1.467 843 HG23 ILE 141 HG23 ILE 141 107.844 -1.253 -2.530 844 HD11 ILE 141 HD11 ILE 141 109.942 -5.443 -1.453 845 HD12 ILE 141 HD12 ILE 141 109.693 -3.828 -0.790 846 HD13 ILE 141 HD13 ILE 141 110.791 -4.063 -2.150 847 H ALA 142 H ALA 142 109.160 -2.893 -6.722 848 HA ALA 142 HA ALA 142 108.729 -5.803 -7.102 849 HB1 ALA 142 HB1 ALA 142 107.730 -5.418 -9.318 850 HB2 ALA 142 HB2 ALA 142 107.884 -3.674 -9.099 851 HB3 ALA 142 HB3 ALA 142 106.773 -4.596 -8.085 852 H GLY 143 H GLY 143 110.516 -6.695 -8.235 853 HA2 GLY 143 HA2 GLY 143 112.148 -5.120 -10.015 854 H VAL 144 H VAL 144 114.626 -6.418 -9.077 855 HA VAL 144 HA VAL 144 114.081 -9.194 -10.088 856 HB VAL 144 HB VAL 144 116.349 -8.992 -11.104 857 HG11 VAL 144 HG11 VAL 144 114.043 -8.046 -12.073 858 HG12 VAL 144 HG12 VAL 144 115.564 -7.839 -12.941 859 HG13 VAL 144 HG13 VAL 144 114.917 -6.518 -11.967 860 HG21 VAL 144 HG21 VAL 144 116.277 -6.060 -10.417 861 HG22 VAL 144 HG22 VAL 144 117.649 -7.045 -10.924 862 HG23 VAL 144 HG23 VAL 144 116.999 -7.212 -9.293 863 H GLY 145 H GLY 145 116.177 -10.601 -9.544 864 HA2 GLY 145 HA2 GLY 145 117.404 -10.002 -6.963 865 H TYR 146 H TYR 146 119.219 -11.267 -6.578 866 HA TYR 146 HA TYR 146 119.771 -13.518 -8.477 867 HB2 TYR 146 HB2 TYR 146 121.566 -11.211 -7.656 868 HD1 TYR 146 HD2 TYR 146 121.159 -12.974 -10.889 869 HD2 TYR 146 HD1 TYR 146 120.205 -9.462 -8.606 870 HE1 TYR 146 HE2 TYR 146 120.310 -11.870 -12.942 871 HE2 TYR 146 HE1 TYR 146 119.356 -8.359 -10.658 872 HH TYR 146 HH TYR 146 118.834 -10.085 -13.591 873 H ARG 147 H ARG 147 121.301 -15.093 -7.591 874 HA ARG 147 HA ARG 147 121.769 -14.847 -4.638 875 HB2 ARG 147 HB2 ARG 147 121.005 -17.169 -4.391 876 HG2 ARG 147 HG2 ARG 147 120.625 -16.988 -7.392 877 HD2 ARG 147 HD2 ARG 147 119.555 -19.038 -5.414 878 HE ARG 147 HE ARG 147 119.192 -19.337 -8.326 879 HH11 ARG 147 HH21 ARG 147 119.677 -21.111 -5.634 880 HH12 ARG 147 HH22 ARG 147 120.981 -22.079 -6.235 881 HH21 ARG 147 HH11 ARG 147 121.471 -20.137 -9.065 882 HH22 ARG 147 HH12 ARG 147 121.997 -21.528 -8.177 883 H PHE 148 H PHE 148 123.904 -15.128 -4.191 884 HA PHE 148 HA PHE 148 125.462 -17.171 -5.693 885 HB2 PHE 148 HB2 PHE 148 127.191 -15.488 -6.231 886 HD1 PHE 148 HD2 PHE 148 124.256 -13.249 -5.874 887 HD2 PHE 148 HD1 PHE 148 128.211 -14.185 -4.485 888 HE1 PHE 148 HE2 PHE 148 124.332 -11.098 -4.643 889 HE2 PHE 148 HE1 PHE 148 128.288 -12.033 -3.255 890 HZ PHE 148 HZ PHE 148 126.349 -10.489 -3.334 Start of MODEL 10 1 H THR 2 H THR 2 124.764 -17.703 3.493 2 HA THR 2 HA THR 2 125.359 -18.254 0.606 3 HB THR 2 HB THR 2 122.667 -18.268 2.015 4 HG1 THR 2 HG1 THR 2 123.187 -20.225 2.499 5 HG21 THR 2 HG21 THR 2 122.206 -19.540 -0.271 6 HG22 THR 2 HG22 THR 2 123.576 -18.573 -0.816 7 HG23 THR 2 HG23 THR 2 122.135 -17.780 -0.181 8 H SER 3 H SER 3 124.813 -16.501 -0.806 9 HA SER 3 HA SER 3 124.042 -13.956 0.592 10 HB2 SER 3 HB2 SER 3 125.460 -12.866 -1.104 11 HG SER 3 HG SER 3 126.673 -14.311 -2.484 12 H THR 4 H THR 4 122.421 -12.695 -0.413 13 HA THR 4 HA THR 4 121.252 -13.773 -2.947 14 HB THR 4 HB THR 4 119.765 -12.939 -0.440 15 HG1 THR 4 HG1 THR 4 120.209 -14.892 0.144 16 HG21 THR 4 HG21 THR 4 118.578 -14.489 -2.709 17 HG22 THR 4 HG22 THR 4 118.761 -12.743 -2.879 18 HG23 THR 4 HG23 THR 4 117.790 -13.404 -1.563 19 H VAL 5 H VAL 5 120.553 -12.173 -4.355 20 HA VAL 5 HA VAL 5 120.797 -9.329 -3.424 21 HB VAL 5 HB VAL 5 121.154 -10.579 -6.175 22 HG11 VAL 5 HG11 VAL 5 122.141 -7.854 -5.466 23 HG12 VAL 5 HG12 VAL 5 120.408 -8.041 -5.733 24 HG13 VAL 5 HG13 VAL 5 121.549 -8.466 -7.010 25 HG21 VAL 5 HG21 VAL 5 123.542 -10.153 -5.833 26 HG22 VAL 5 HG22 VAL 5 122.936 -11.176 -4.531 27 HG23 VAL 5 HG23 VAL 5 123.213 -9.457 -4.246 28 H THR 6 H THR 6 118.973 -8.010 -3.782 29 HA THR 6 HA THR 6 116.839 -8.901 -5.616 30 HB THR 6 HB THR 6 116.364 -8.580 -2.635 31 HG1 THR 6 HG1 THR 6 116.318 -10.980 -4.128 32 HG21 THR 6 HG21 THR 6 114.146 -8.997 -3.055 33 HG22 THR 6 HG22 THR 6 114.493 -10.007 -4.459 34 HG23 THR 6 HG23 THR 6 114.561 -8.250 -4.599 35 H GLY 7 H GLY 7 115.880 -7.047 -6.475 36 HA2 GLY 7 HA2 GLY 7 115.503 -4.663 -4.849 37 H GLY 8 H GLY 8 114.625 -2.827 -6.327 38 HA2 GLY 8 HA2 GLY 8 113.632 -3.369 -8.940 39 H TYR 9 H TYR 9 110.994 -2.067 -8.382 40 HA TYR 9 HA TYR 9 111.875 0.607 -7.381 41 HB2 TYR 9 HB2 TYR 9 111.007 1.645 -9.415 42 HD1 TYR 9 HD2 TYR 9 111.377 -1.799 -10.735 43 HD2 TYR 9 HD1 TYR 9 108.664 1.439 -9.950 44 HE1 TYR 9 HE2 TYR 9 109.634 -2.931 -12.089 45 HE2 TYR 9 HE1 TYR 9 106.922 0.307 -11.304 46 HH TYR 9 HH TYR 9 106.569 -2.421 -11.934 47 H ALA 10 H ALA 10 109.962 2.025 -6.822 48 HA ALA 10 HA ALA 10 107.378 0.526 -6.653 49 HB1 ALA 10 HB1 ALA 10 109.231 0.618 -4.594 50 HB2 ALA 10 HB2 ALA 10 107.512 0.274 -4.404 51 HB3 ALA 10 HB3 ALA 10 108.113 1.915 -4.176 52 H GLN 11 H GLN 11 105.558 1.863 -6.545 53 HA GLN 11 HA GLN 11 106.020 4.769 -7.054 54 HB2 GLN 11 HB2 GLN 11 103.628 2.918 -7.388 55 HG2 GLN 11 HG2 GLN 11 105.471 4.219 -9.421 56 HE21 GLN 11 HE21 GLN 11 104.971 3.314 -11.663 57 HE22 GLN 11 HE22 GLN 11 103.361 2.930 -12.034 58 H SER 12 H SER 12 105.268 6.285 -5.504 59 HA SER 12 HA SER 12 103.987 5.079 -3.074 60 HB2 SER 12 HB2 SER 12 105.869 7.431 -3.362 61 HG SER 12 HG SER 12 107.114 5.717 -3.622 62 H ASP 13 H ASP 13 102.336 6.111 -2.085 63 HA ASP 13 HA ASP 13 101.326 8.724 -3.133 64 HB2 ASP 13 HB2 ASP 13 100.140 6.737 -4.173 65 H ALA 14 H ALA 14 100.553 10.006 -1.293 66 HA ALA 14 HA ALA 14 100.232 8.592 1.276 67 HB1 ALA 14 HB1 ALA 14 102.672 9.147 0.707 68 HB2 ALA 14 HB2 ALA 14 102.080 9.682 2.279 69 HB3 ALA 14 HB3 ALA 14 102.223 10.833 0.952 70 H GLN 15 H GLN 15 99.173 9.759 2.798 71 HA GLN 15 HA GLN 15 97.549 12.035 1.932 72 HB2 GLN 15 HB2 GLN 15 96.773 10.134 3.398 73 HG2 GLN 15 HG2 GLN 15 96.709 12.875 4.705 74 HE21 GLN 15 HE21 GLN 15 94.383 13.075 5.770 75 HE22 GLN 15 HE22 GLN 15 93.855 11.715 6.639 76 H GLY 16 H GLY 16 98.166 14.124 2.222 77 HA2 GLY 16 HA2 GLY 16 99.051 15.921 3.647 78 H GLN 17 H GLN 17 100.702 13.637 1.567 79 HA GLN 17 HA GLN 17 102.411 15.859 0.497 80 HB2 GLN 17 HB2 GLN 17 102.739 12.844 0.530 81 HG2 GLN 17 HG2 GLN 17 104.315 15.108 1.798 82 HE21 GLN 17 HE21 GLN 17 106.144 14.268 3.129 83 HE22 GLN 17 HE22 GLN 17 106.861 12.780 2.739 84 H MET 18 H MET 18 102.643 15.926 -1.856 85 HA MET 18 HA MET 18 100.350 14.652 -3.318 86 HB2 MET 18 HB2 MET 18 101.681 17.363 -3.604 87 HG2 MET 18 HG2 MET 18 98.897 16.494 -2.768 88 HE1 MET 18 HE1 MET 18 97.832 20.129 -1.719 89 HE2 MET 18 HE2 MET 18 98.307 18.588 -1.010 90 HE3 MET 18 HE3 MET 18 97.004 18.640 -2.195 91 H ASN 19 H ASN 19 100.843 14.567 -5.763 92 HA ASN 19 HA ASN 19 102.172 13.778 -7.537 93 HB2 ASN 19 HB2 ASN 19 104.406 15.051 -5.918 94 HD21 ASN 19 HD21 ASN 19 101.888 15.583 -8.445 95 HD22 ASN 19 HD22 ASN 19 101.782 17.259 -8.197 96 H LYS 20 H LYS 20 102.420 11.611 -7.650 97 HA LYS 20 HA LYS 20 103.310 9.935 -5.493 98 HB2 LYS 20 HB2 LYS 20 103.090 9.497 -8.489 99 HG2 LYS 20 HG2 LYS 20 101.189 8.979 -6.180 100 HD2 LYS 20 HD2 LYS 20 100.975 8.307 -9.131 101 HE2 LYS 20 HE2 LYS 20 98.777 7.203 -7.943 102 HZ1 LYS 20 HZ1 LYS 20 97.691 9.139 -9.007 103 HZ2 LYS 20 HZ2 LYS 20 98.925 8.476 -9.970 104 HZ3 LYS 20 HZ3 LYS 20 99.197 9.913 -9.105 105 H MET 21 H MET 21 105.271 8.506 -5.612 106 HA MET 21 HA MET 21 107.590 9.889 -6.924 107 HB2 MET 21 HB2 MET 21 107.331 8.596 -4.191 108 HG2 MET 21 HG2 MET 21 107.749 11.453 -5.122 109 HE1 MET 21 HE1 MET 21 110.626 11.196 -2.666 110 HE2 MET 21 HE2 MET 21 109.987 12.323 -3.860 111 HE3 MET 21 HE3 MET 21 110.096 10.608 -4.249 112 H GLY 22 H GLY 22 109.473 8.403 -7.214 113 HA2 GLY 22 HA2 GLY 22 108.818 5.509 -7.331 114 H GLY 23 H GLY 23 110.562 4.438 -6.456 115 HA2 GLY 23 HA2 GLY 23 113.263 5.636 -6.950 116 H PHE 24 H PHE 24 114.876 3.900 -5.726 117 HA PHE 24 HA PHE 24 114.196 1.236 -6.936 118 HB2 PHE 24 HB2 PHE 24 116.842 2.699 -6.622 119 HD1 PHE 24 HD1 PHE 24 115.419 0.753 -9.440 120 HD2 PHE 24 HD2 PHE 24 116.254 4.667 -7.879 121 HE1 PHE 24 HE1 PHE 24 114.904 1.746 -11.654 122 HE2 PHE 24 HE2 PHE 24 115.740 5.660 -10.093 123 HZ PHE 24 HZ PHE 24 115.065 4.200 -11.980 124 H ASN 25 H ASN 25 114.783 -0.610 -5.646 125 HA ASN 25 HA ASN 25 115.624 0.049 -2.843 126 HB2 ASN 25 HB2 ASN 25 113.178 -0.530 -3.314 127 HD21 ASN 25 HD21 ASN 25 112.003 -1.704 -1.484 128 HD22 ASN 25 HD22 ASN 25 112.861 -2.023 -0.056 129 H LEU 26 H LEU 26 117.290 -1.147 -2.059 130 HA LEU 26 HA LEU 26 118.264 -3.490 -3.671 131 HB2 LEU 26 HB2 LEU 26 119.737 -1.618 -1.776 132 HG LEU 26 HG LEU 26 118.977 -0.462 -3.829 133 HD11 LEU 26 HD11 LEU 26 121.009 0.445 -3.182 134 HD12 LEU 26 HD12 LEU 26 121.443 -0.154 -4.783 135 HD13 LEU 26 HD13 LEU 26 121.865 -1.087 -3.349 136 HD21 LEU 26 HD21 LEU 26 120.318 -2.837 -5.133 137 HD22 LEU 26 HD22 LEU 26 120.096 -1.318 -5.999 138 HD23 LEU 26 HD23 LEU 26 118.693 -2.211 -5.411 139 H LYS 27 H LYS 27 118.779 -5.457 -2.399 140 HA LYS 27 HA LYS 27 118.262 -5.281 0.510 141 HB2 LYS 27 HB2 LYS 27 116.748 -7.018 -1.461 142 HG2 LYS 27 HG2 LYS 27 115.914 -4.732 0.345 143 HD2 LYS 27 HD2 LYS 27 114.252 -6.659 -1.311 144 HE2 LYS 27 HE2 LYS 27 113.782 -3.890 -0.559 145 HZ1 LYS 27 HZ1 LYS 27 112.051 -6.029 0.583 146 HZ2 LYS 27 HZ2 LYS 27 111.626 -4.385 0.529 147 HZ3 LYS 27 HZ3 LYS 27 112.957 -4.891 1.455 148 H TYR 28 H TYR 28 119.528 -6.738 1.626 149 HA TYR 28 HA TYR 28 120.972 -8.842 0.039 150 HB2 TYR 28 HB2 TYR 28 121.841 -7.194 2.442 151 HD1 TYR 28 HD1 TYR 28 123.541 -8.190 -0.714 152 HD2 TYR 28 HD2 TYR 28 121.678 -5.008 1.490 153 HE1 TYR 28 HE1 TYR 28 124.361 -6.552 -2.386 154 HE2 TYR 28 HE2 TYR 28 122.499 -3.369 -0.181 155 HH TYR 28 HH TYR 28 123.619 -4.215 -3.184 156 H ARG 29 H ARG 29 120.610 -10.933 0.800 157 HA ARG 29 HA ARG 29 119.543 -11.206 3.585 158 HB2 ARG 29 HB2 ARG 29 117.757 -11.275 1.882 159 HG2 ARG 29 HG2 ARG 29 118.337 -14.023 3.030 160 HD2 ARG 29 HD2 ARG 29 115.814 -14.116 3.118 161 HE ARG 29 HE ARG 29 117.184 -13.876 0.458 162 HH11 ARG 29 HH11 ARG 29 117.609 -16.388 1.960 163 HH12 ARG 29 HH12 ARG 29 116.354 -17.416 1.354 164 HH21 ARG 29 HH21 ARG 29 114.504 -14.811 0.007 165 HH22 ARG 29 HH22 ARG 29 114.596 -16.523 0.249 166 H TYR 30 H TYR 30 120.295 -12.895 4.738 167 HA TYR 30 HA TYR 30 122.202 -14.798 3.408 168 HB2 TYR 30 HB2 TYR 30 122.164 -13.651 6.224 169 HD1 TYR 30 HD2 TYR 30 124.871 -14.094 3.713 170 HD2 TYR 30 HD1 TYR 30 122.270 -11.319 5.710 171 HE1 TYR 30 HE2 TYR 30 126.173 -12.201 2.778 172 HE2 TYR 30 HE1 TYR 30 123.572 -9.426 4.775 173 HH TYR 30 HH TYR 30 125.889 -9.843 2.283 174 H GLU 31 H GLU 31 121.680 -16.970 3.678 175 HA GLU 31 HA GLU 31 119.805 -17.722 5.878 176 HB2 GLU 31 HB2 GLU 31 118.556 -17.212 3.769 177 HG2 GLU 31 HG2 GLU 31 118.652 -20.126 4.614 178 H GLU 32 H GLU 32 120.194 -19.807 6.676 179 HA GLU 32 HA GLU 32 122.548 -21.231 5.509 180 HB2 GLU 32 HB2 GLU 32 121.182 -21.317 8.221 181 HG2 GLU 32 HG2 GLU 32 123.814 -20.128 7.292 182 H ASP 33 H ASP 33 122.194 -23.156 4.508 183 HA ASP 33 HA ASP 33 119.679 -24.198 3.838 184 HB2 ASP 33 HB2 ASP 33 120.964 -26.158 3.117 185 H ASN 34 H ASN 34 121.445 -24.660 6.832 186 HA ASN 34 HA ASN 34 120.315 -27.132 7.691 187 HB2 ASN 34 HB2 ASN 34 120.999 -26.347 9.918 188 HD21 ASN 34 HD21 ASN 34 121.711 -24.532 11.299 189 HD22 ASN 34 HD22 ASN 34 121.308 -22.932 10.900 190 H SER 35 H SER 35 119.033 -23.813 7.881 191 HA SER 35 HA SER 35 116.357 -24.961 8.519 192 HB2 SER 35 HB2 SER 35 117.585 -22.645 10.035 193 HG SER 35 HG SER 35 117.759 -24.316 11.705 194 HA PRO 36 HA PRO 36 115.137 -21.655 5.833 195 HB2 PRO 36 HB2 PRO 36 112.471 -21.559 6.407 196 HG2 PRO 36 HG2 PRO 36 112.194 -22.825 8.259 197 HD2 PRO 36 HD2 PRO 36 114.113 -23.316 9.336 198 H LEU 37 H LEU 37 116.134 -20.774 8.518 199 HA LEU 37 HA LEU 37 114.376 -18.376 8.943 200 HB2 LEU 37 HB2 LEU 37 114.582 -20.015 10.816 201 HG LEU 37 HG LEU 37 115.810 -17.268 11.164 202 HD11 LEU 37 HD11 LEU 37 113.554 -17.050 10.508 203 HD12 LEU 37 HD12 LEU 37 113.479 -16.976 12.268 204 HD13 LEU 37 HD13 LEU 37 113.057 -18.469 11.431 205 HD21 LEU 37 HD21 LEU 37 116.548 -18.692 13.019 206 HD22 LEU 37 HD22 LEU 37 114.895 -19.253 13.270 207 HD23 LEU 37 HD23 LEU 37 115.312 -17.569 13.586 208 H GLY 38 H GLY 38 115.564 -17.239 7.201 209 HA2 GLY 38 HA2 GLY 38 118.394 -16.585 7.882 210 H VAL 39 H VAL 39 118.790 -14.148 6.880 211 HA VAL 39 HA VAL 39 116.642 -12.368 7.959 212 HB VAL 39 HB VAL 39 118.454 -11.073 9.077 213 HG11 VAL 39 HG11 VAL 39 118.573 -14.002 9.838 214 HG12 VAL 39 HG12 VAL 39 117.212 -12.951 10.227 215 HG13 VAL 39 HG13 VAL 39 118.808 -12.613 10.898 216 HG21 VAL 39 HG21 VAL 39 120.206 -13.379 8.161 217 HG22 VAL 39 HG22 VAL 39 120.710 -12.072 9.231 218 HG23 VAL 39 HG23 VAL 39 120.292 -11.727 7.554 219 H ILE 40 H ILE 40 116.510 -10.351 6.831 220 HA ILE 40 HA ILE 40 118.446 -9.979 4.580 221 HB ILE 40 HB ILE 40 116.433 -11.131 3.779 222 HG12 ILE 40 HG12 ILE 40 116.314 -8.223 2.941 223 HG21 ILE 40 HG21 ILE 40 114.557 -10.705 4.977 224 HG22 ILE 40 HG22 ILE 40 114.366 -9.323 3.899 225 HG23 ILE 40 HG23 ILE 40 115.123 -9.113 5.475 226 HD11 ILE 40 HD11 ILE 40 115.661 -9.148 0.787 227 HD12 ILE 40 HD12 ILE 40 114.601 -9.812 2.029 228 HD13 ILE 40 HD13 ILE 40 115.913 -10.790 1.376 229 H GLY 41 H GLY 41 118.850 -7.836 4.011 230 HA2 GLY 41 HA2 GLY 41 117.621 -5.744 5.769 231 H SER 42 H SER 42 117.070 -3.724 4.663 232 HA SER 42 HA SER 42 117.197 -3.849 1.675 233 HB2 SER 42 HB2 SER 42 115.069 -4.798 2.469 234 HG SER 42 HG SER 42 113.781 -2.823 1.573 235 H PHE 43 H PHE 43 117.400 -1.860 0.676 236 HA PHE 43 HA PHE 43 117.223 0.607 2.370 237 HB2 PHE 43 HB2 PHE 43 119.569 -0.204 1.999 238 HD1 PHE 43 HD2 PHE 43 119.549 1.855 3.406 239 HD2 PHE 43 HD1 PHE 43 119.289 2.024 -0.878 240 HE1 PHE 43 HE2 PHE 43 120.131 4.265 3.465 241 HE2 PHE 43 HE1 PHE 43 119.872 4.434 -0.819 242 HZ PHE 43 HZ PHE 43 120.292 5.554 1.353 243 H THR 44 H THR 44 116.117 2.313 1.280 244 HA THR 44 HA THR 44 115.524 1.859 -1.622 245 HB THR 44 HB THR 44 113.700 1.092 -0.095 246 HG1 THR 44 HG1 THR 44 112.415 1.725 -1.603 247 HG21 THR 44 HG21 THR 44 114.288 3.056 1.555 248 HG22 THR 44 HG22 THR 44 112.619 2.509 1.404 249 HG23 THR 44 HG23 THR 44 113.148 3.968 0.566 250 H TYR 45 H TYR 45 115.257 3.738 -2.866 251 HA TYR 45 HA TYR 45 115.571 6.384 -1.518 252 HB2 TYR 45 HB2 TYR 45 117.800 5.465 -2.181 253 HD1 TYR 45 HD1 TYR 45 118.073 7.685 -1.102 254 HD2 TYR 45 HD2 TYR 45 116.997 7.298 -5.241 255 HE1 TYR 45 HE1 TYR 45 118.667 10.063 -1.477 256 HE2 TYR 45 HE2 TYR 45 117.590 9.677 -5.618 257 HH TYR 45 HH TYR 45 119.378 11.492 -3.429 258 H THR 46 H THR 46 113.761 7.468 -2.246 259 HA THR 46 HA THR 46 113.010 7.113 -5.138 260 HB THR 46 HB THR 46 110.695 7.351 -4.447 261 HG1 THR 46 HG1 THR 46 110.214 8.305 -2.664 262 HG21 THR 46 HG21 THR 46 110.779 5.150 -3.998 263 HG22 THR 46 HG22 THR 46 111.038 5.564 -2.304 264 HG23 THR 46 HG23 THR 46 112.418 5.286 -3.365 265 H GLU 47 H GLU 47 112.021 9.038 -6.142 266 HA GLU 47 HA GLU 47 112.559 11.615 -4.737 267 HB2 GLU 47 HB2 GLU 47 113.798 12.394 -6.730 268 HG2 GLU 47 HG2 GLU 47 113.313 9.561 -7.707 269 H LYS 48 H LYS 48 111.633 13.478 -6.119 270 HA LYS 48 HA LYS 48 109.216 12.566 -7.641 271 HB2 LYS 48 HB2 LYS 48 107.964 14.327 -6.481 272 HG2 LYS 48 HG2 LYS 48 110.617 14.907 -5.126 273 HD2 LYS 48 HD2 LYS 48 107.792 15.843 -4.569 274 HE2 LYS 48 HE2 LYS 48 110.245 17.014 -3.254 275 HZ1 LYS 48 HZ1 LYS 48 108.534 18.740 -2.868 276 HZ2 LYS 48 HZ2 LYS 48 108.077 17.223 -2.254 277 HZ3 LYS 48 HZ3 LYS 48 107.406 17.791 -3.708 278 H SER 49 H SER 49 108.492 14.091 -9.277 279 HA SER 49 HA SER 49 110.709 15.741 -10.375 280 HB2 SER 49 HB2 SER 49 108.043 14.810 -11.488 281 HG SER 49 HG SER 49 109.490 13.431 -12.692 282 H ARG 50 H ARG 50 110.265 17.945 -11.090 283 HA ARG 50 HA ARG 50 107.819 19.218 -9.944 284 HB2 ARG 50 HB2 ARG 50 109.244 20.910 -8.870 285 HG2 ARG 50 HG2 ARG 50 111.487 19.292 -10.113 286 HD2 ARG 50 HD2 ARG 50 111.593 21.430 -7.950 287 HE ARG 50 HE ARG 50 113.425 21.776 -9.565 288 HH11 ARG 50 HH21 ARG 50 113.638 18.842 -10.370 289 HH12 ARG 50 HH22 ARG 50 115.148 18.404 -9.641 290 HH21 ARG 50 HH11 ARG 50 115.254 21.181 -7.568 291 HH22 ARG 50 HH12 ARG 50 116.063 19.731 -8.056 292 H THR 51 H THR 51 107.452 21.400 -10.862 293 HA THR 51 HA THR 51 108.751 21.753 -13.547 294 HB THR 51 HB THR 51 105.927 22.410 -12.645 295 HG1 THR 51 HG1 THR 51 105.365 20.515 -13.446 296 HG21 THR 51 HG21 THR 51 105.508 23.141 -14.795 297 HG22 THR 51 HG22 THR 51 106.773 22.131 -15.497 298 HG23 THR 51 HG23 THR 51 107.201 23.615 -14.645 299 H ALA 52 H ALA 52 109.415 23.861 -14.059 300 HA ALA 52 HA ALA 52 110.018 25.714 -11.980 301 HB1 ALA 52 HB1 ALA 52 109.647 26.773 -14.718 302 HB2 ALA 52 HB2 ALA 52 110.658 25.332 -14.616 303 HB3 ALA 52 HB3 ALA 52 111.086 26.776 -13.699 304 H SER 53 H SER 53 108.931 27.552 -11.236 305 HA SER 53 HA SER 53 107.119 28.992 -10.791 306 HB2 SER 53 HB2 SER 53 107.319 28.614 -13.672 307 HG SER 53 HG SER 53 107.902 30.452 -12.348 308 H SER 54 H SER 54 105.238 28.587 -9.691 309 HA SER 54 HA SER 54 103.381 27.376 -8.868 310 HB2 SER 54 HB2 SER 54 103.310 27.237 -11.861 311 HG SER 54 HG SER 54 101.684 28.625 -11.553 312 H GLY 55 H GLY 55 105.385 25.931 -8.090 313 HA2 GLY 55 HA2 GLY 55 104.569 23.179 -8.323 314 H ASP 56 H ASP 56 106.799 21.845 -7.473 315 HA ASP 56 HA ASP 56 107.111 22.721 -4.756 316 HB2 ASP 56 HB2 ASP 56 108.659 20.780 -6.504 317 H TYR 57 H TYR 57 108.541 24.177 -3.910 318 HA TYR 57 HA TYR 57 110.452 25.538 -5.681 319 HB2 TYR 57 HB2 TYR 57 110.605 27.100 -3.844 320 HD1 TYR 57 HD1 TYR 57 107.839 25.191 -2.329 321 HD2 TYR 57 HD2 TYR 57 111.964 26.335 -1.960 322 HE1 TYR 57 HE1 TYR 57 107.845 24.416 0.026 323 HE2 TYR 57 HE2 TYR 57 111.968 25.560 0.395 324 HH TYR 57 HH TYR 57 109.279 25.039 2.162 325 H ASN 58 H ASN 58 110.564 22.918 -3.431 326 HA ASN 58 HA ASN 58 113.558 23.095 -3.399 327 HB2 ASN 58 HB2 ASN 58 113.467 22.240 -1.120 328 HD21 ASN 58 HD21 ASN 58 111.967 21.737 0.812 329 HD22 ASN 58 HD22 ASN 58 110.531 20.892 0.489 330 H LYS 59 H LYS 59 114.051 20.610 -2.255 331 HA LYS 59 HA LYS 59 112.669 18.587 -3.950 332 HB2 LYS 59 HB2 LYS 59 114.629 19.504 -5.187 333 HG2 LYS 59 HG2 LYS 59 114.996 16.683 -4.128 334 HD2 LYS 59 HD2 LYS 59 116.091 18.105 -6.572 335 HE2 LYS 59 HE2 LYS 59 116.943 15.334 -6.151 336 HZ1 LYS 59 HZ1 LYS 59 116.359 15.424 -8.562 337 HZ2 LYS 59 HZ2 LYS 59 117.406 16.667 -8.067 338 HZ3 LYS 59 HZ3 LYS 59 115.757 16.990 -8.320 339 H ASN 60 H ASN 60 112.052 17.058 -2.451 340 HA ASN 60 HA ASN 60 113.682 16.702 0.003 341 HB2 ASN 60 HB2 ASN 60 110.935 15.756 -0.863 342 HD21 ASN 60 HD21 ASN 60 109.227 17.006 0.376 343 HD22 ASN 60 HD22 ASN 60 109.559 18.607 0.833 344 H GLN 61 H GLN 61 114.502 14.669 0.629 345 HA GLN 61 HA GLN 61 114.711 12.644 -1.575 346 HB2 GLN 61 HB2 GLN 61 116.448 13.258 0.840 347 HG2 GLN 61 HG2 GLN 61 116.901 13.723 -2.125 348 HE21 GLN 61 HE21 GLN 61 118.969 15.018 -2.443 349 HE22 GLN 61 HE22 GLN 61 120.253 14.775 -1.358 350 H TYR 62 H TYR 62 114.225 10.453 -1.082 351 HA TYR 62 HA TYR 62 112.828 10.032 1.536 352 HB2 TYR 62 HB2 TYR 62 111.537 9.870 -0.590 353 HD1 TYR 62 HD2 TYR 62 110.048 9.556 1.378 354 HD2 TYR 62 HD1 TYR 62 112.424 6.346 -0.203 355 HE1 TYR 62 HE2 TYR 62 108.670 7.920 2.632 356 HE2 TYR 62 HE1 TYR 62 111.045 4.709 1.051 357 HH TYR 62 HH TYR 62 109.529 4.962 3.350 358 H TYR 63 H TYR 63 113.996 8.913 2.936 359 HA TYR 63 HA TYR 63 115.905 6.801 1.950 360 HB2 TYR 63 HB2 TYR 63 115.847 8.565 4.405 361 HD1 TYR 63 HD1 TYR 63 118.607 7.248 2.297 362 HD2 TYR 63 HD2 TYR 63 116.149 10.637 3.254 363 HE1 TYR 63 HE1 TYR 63 120.083 8.702 0.934 364 HE2 TYR 63 HE2 TYR 63 117.626 12.092 1.893 365 HH TYR 63 HH TYR 63 120.028 10.812 -0.217 366 H GLY 64 H GLY 64 115.548 4.705 2.628 367 HA2 GLY 64 HA2 GLY 64 113.795 4.243 4.969 368 H ILE 65 H ILE 65 114.611 2.671 6.158 369 HA ILE 65 HA ILE 65 116.353 0.593 4.849 370 HB ILE 65 HB ILE 65 117.650 2.199 6.205 371 HG12 ILE 65 HG12 ILE 65 117.371 -0.342 7.820 372 HG21 ILE 65 HG21 ILE 65 115.820 1.352 8.470 373 HG22 ILE 65 HG22 ILE 65 115.818 2.931 7.687 374 HG23 ILE 65 HG23 ILE 65 117.220 2.413 8.620 375 HD11 ILE 65 HD11 ILE 65 119.058 0.981 8.760 376 HD12 ILE 65 HD12 ILE 65 119.536 1.652 7.201 377 HD13 ILE 65 HD13 ILE 65 119.969 -0.007 7.617 378 H THR 66 H THR 66 115.696 -1.538 5.319 379 HA THR 66 HA THR 66 113.919 -1.972 7.638 380 HB THR 66 HB THR 66 112.431 -3.265 5.850 381 HG1 THR 66 HG1 THR 66 113.468 -1.130 4.313 382 HG21 THR 66 HG21 THR 66 112.402 -0.261 6.244 383 HG22 THR 66 HG22 THR 66 111.571 -1.461 7.232 384 HG23 THR 66 HG23 THR 66 111.070 -1.194 5.564 385 H ALA 67 H ALA 67 114.052 -4.131 8.413 386 HA ALA 67 HA ALA 67 115.492 -6.110 6.719 387 HB1 ALA 67 HB1 ALA 67 117.196 -6.376 8.280 388 HB2 ALA 67 HB2 ALA 67 116.182 -5.850 9.623 389 HB3 ALA 67 HB3 ALA 67 116.849 -4.661 8.503 390 H GLY 68 H GLY 68 114.923 -8.308 7.266 391 HA2 GLY 68 HA2 GLY 68 113.279 -8.931 9.571 392 HA PRO 69 HA PRO 69 114.522 -13.009 8.540 393 HB2 PRO 69 HB2 PRO 69 112.369 -14.546 9.239 394 HG2 PRO 69 HG2 PRO 69 110.745 -12.934 9.450 395 HD2 PRO 69 HD2 PRO 69 111.248 -10.703 9.401 396 H ALA 70 H ALA 70 113.713 -15.086 7.291 397 HA ALA 70 HA ALA 70 111.707 -14.551 5.187 398 HB1 ALA 70 HB1 ALA 70 113.316 -13.556 3.912 399 HB2 ALA 70 HB2 ALA 70 113.845 -15.211 3.607 400 HB3 ALA 70 HB3 ALA 70 114.628 -14.251 4.863 401 H TYR 71 H TYR 71 111.033 -16.484 4.142 402 HA TYR 71 HA TYR 71 112.284 -19.009 5.182 403 HB2 TYR 71 HB2 TYR 71 109.420 -18.318 4.443 404 HD1 TYR 71 HD1 TYR 71 110.949 -20.250 7.232 405 HD2 TYR 71 HD2 TYR 71 109.037 -16.590 6.049 406 HE1 TYR 71 HE1 TYR 71 110.730 -19.594 9.613 407 HE2 TYR 71 HE2 TYR 71 108.817 -15.935 8.429 408 HH TYR 71 HH TYR 71 109.432 -18.146 11.009 409 H ARG 72 H ARG 72 112.965 -20.455 3.617 410 HA ARG 72 HA ARG 72 113.090 -19.668 0.848 411 HB2 ARG 72 HB2 ARG 72 114.712 -21.103 2.102 412 HG2 ARG 72 HG2 ARG 72 113.424 -22.384 -0.329 413 HD2 ARG 72 HD2 ARG 72 116.187 -22.727 0.900 414 HE ARG 72 HE ARG 72 116.556 -22.920 -1.459 415 HH11 ARG 72 HH11 ARG 72 115.403 -25.759 -0.572 416 HH12 ARG 72 HH12 ARG 72 114.455 -26.105 -1.980 417 HH21 ARG 72 HH21 ARG 72 114.625 -22.870 -3.215 418 HH22 ARG 72 HH22 ARG 72 114.014 -24.469 -3.476 419 H ILE 73 H ILE 73 112.002 -20.598 -0.953 420 HA ILE 73 HA ILE 73 109.217 -21.187 -0.641 421 HB ILE 73 HB ILE 73 110.242 -20.195 -2.645 422 HG12 ILE 73 HG12 ILE 73 109.173 -22.919 -3.412 423 HG21 ILE 73 HG21 ILE 73 112.227 -22.050 -2.304 424 HG22 ILE 73 HG22 ILE 73 111.984 -21.118 -3.781 425 HG23 ILE 73 HG23 ILE 73 111.330 -22.751 -3.651 426 HD11 ILE 73 HD11 ILE 73 107.965 -21.297 -5.078 427 HD12 ILE 73 HD12 ILE 73 109.656 -21.711 -5.362 428 HD13 ILE 73 HD13 ILE 73 109.239 -20.165 -4.623 429 H ASN 74 H ASN 74 109.317 -22.954 0.964 430 HA ASN 74 HA ASN 74 110.579 -25.461 0.640 431 HB2 ASN 74 HB2 ASN 74 107.914 -24.682 1.865 432 HD21 ASN 74 HD21 ASN 74 108.210 -24.382 4.287 433 HD22 ASN 74 HD22 ASN 74 109.707 -23.820 4.858 434 H ASP 75 H ASP 75 107.562 -24.244 -0.771 435 HA ASP 75 HA ASP 75 107.623 -26.330 -2.827 436 HB2 ASP 75 HB2 ASP 75 106.691 -27.443 -0.784 437 H TRP 76 H TRP 76 105.706 -23.781 -1.216 438 HA TRP 76 HA TRP 76 104.269 -23.203 -3.745 439 HB2 TRP 76 HB2 TRP 76 104.114 -22.104 -0.921 440 HD1 TRP 76 HD1 TRP 76 102.616 -24.504 -3.535 441 HE1 TRP 76 HE1 TRP 76 101.203 -26.272 -2.299 442 HE3 TRP 76 HE3 TRP 76 102.877 -22.674 1.228 443 HZ2 TRP 76 HZ2 TRP 76 100.302 -26.834 0.356 444 HZ3 TRP 76 HZ3 TRP 76 101.732 -23.846 3.088 445 HH2 TRP 76 HH2 TRP 76 100.446 -25.921 2.659 446 H ALA 77 H ALA 77 105.754 -21.024 -1.314 447 HA ALA 77 HA ALA 77 107.462 -19.751 -3.346 448 HB1 ALA 77 HB1 ALA 77 104.892 -18.576 -2.294 449 HB2 ALA 77 HB2 ALA 77 105.458 -18.671 -3.963 450 HB3 ALA 77 HB3 ALA 77 106.199 -17.526 -2.844 451 H SER 78 H SER 78 108.562 -17.749 -2.308 452 HA SER 78 HA SER 78 109.302 -18.450 0.492 453 HB2 SER 78 HB2 SER 78 111.010 -18.152 -1.302 454 HG SER 78 HG SER 78 112.306 -17.241 0.083 455 H ILE 79 H ILE 79 108.963 -16.995 2.216 456 HA ILE 79 HA ILE 79 107.604 -14.403 1.549 457 HB ILE 79 HB ILE 79 105.985 -16.162 2.185 458 HG12 ILE 79 HG12 ILE 79 106.284 -14.281 4.529 459 HG21 ILE 79 HG21 ILE 79 107.558 -16.265 4.775 460 HG22 ILE 79 HG22 ILE 79 107.532 -17.531 3.547 461 HG23 ILE 79 HG23 ILE 79 106.064 -17.140 4.442 462 HD11 ILE 79 HD11 ILE 79 103.749 -14.751 3.032 463 HD12 ILE 79 HD12 ILE 79 104.007 -14.530 4.762 464 HD13 ILE 79 HD13 ILE 79 104.361 -16.085 4.009 465 H TYR 80 H TYR 80 108.165 -12.668 2.924 466 HA TYR 80 HA TYR 80 109.924 -13.260 5.253 467 HB2 TYR 80 HB2 TYR 80 111.617 -11.726 4.407 468 HD1 TYR 80 HD2 TYR 80 109.816 -12.356 1.220 469 HD2 TYR 80 HD1 TYR 80 111.128 -9.404 4.052 470 HE1 TYR 80 HE2 TYR 80 109.223 -10.558 -0.380 471 HE2 TYR 80 HE1 TYR 80 110.535 -7.606 2.450 472 HH TYR 80 HH TYR 80 110.324 -7.631 -0.344 473 H GLY 81 H GLY 81 110.008 -11.530 6.789 474 HA2 GLY 81 HA2 GLY 81 107.680 -9.682 6.630 475 H VAL 82 H VAL 82 108.069 -7.386 7.363 476 HA VAL 82 HA VAL 82 110.884 -6.506 6.834 477 HB VAL 82 HB VAL 82 108.324 -5.306 5.730 478 HG11 VAL 82 HG11 VAL 82 111.212 -4.672 5.067 479 HG12 VAL 82 HG12 VAL 82 110.226 -3.713 6.170 480 HG13 VAL 82 HG13 VAL 82 109.778 -3.839 4.468 481 HG21 VAL 82 HG21 VAL 82 108.564 -7.153 4.368 482 HG22 VAL 82 HG22 VAL 82 110.292 -7.295 4.691 483 HG23 VAL 82 HG23 VAL 82 109.704 -6.078 3.558 484 H VAL 83 H VAL 83 111.610 -5.047 8.260 485 HA VAL 83 HA VAL 83 109.707 -3.361 9.834 486 HB VAL 83 HB VAL 83 112.068 -4.971 10.891 487 HG11 VAL 83 HG11 VAL 83 111.231 -2.633 11.901 488 HG12 VAL 83 HG12 VAL 83 111.751 -3.961 12.940 489 HG13 VAL 83 HG13 VAL 83 110.032 -3.684 12.655 490 HG21 VAL 83 HG21 VAL 83 110.305 -6.239 12.121 491 HG22 VAL 83 HG22 VAL 83 110.156 -6.415 10.373 492 HG23 VAL 83 HG23 VAL 83 109.073 -5.331 11.245 493 H GLY 84 H GLY 84 110.685 -1.226 10.246 494 HA2 GLY 84 HA2 GLY 84 113.398 -0.629 10.090 495 H VAL 85 H VAL 85 113.543 1.680 8.751 496 HA VAL 85 HA VAL 85 111.360 3.401 9.867 497 HB VAL 85 HB VAL 85 113.156 4.903 10.689 498 HG11 VAL 85 HG11 VAL 85 114.081 3.296 12.418 499 HG12 VAL 85 HG12 VAL 85 113.289 1.997 11.534 500 HG13 VAL 85 HG13 VAL 85 112.325 3.281 12.264 501 HG21 VAL 85 HG21 VAL 85 115.467 4.293 10.532 502 HG22 VAL 85 HG22 VAL 85 114.808 4.106 8.907 503 HG23 VAL 85 HG23 VAL 85 115.070 2.687 9.922 504 H GLY 86 H GLY 86 111.770 5.748 9.097 505 HA2 GLY 86 HA2 GLY 86 112.793 5.854 6.296 506 H TYR 87 H TYR 87 113.592 7.938 5.709 507 HA TYR 87 HA TYR 87 113.433 10.004 7.886 508 HB2 TYR 87 HB2 TYR 87 115.772 9.215 6.122 509 HD1 TYR 87 HD1 TYR 87 115.576 10.096 9.715 510 HD2 TYR 87 HD2 TYR 87 115.970 6.930 6.840 511 HE1 TYR 87 HE1 TYR 87 116.195 8.524 11.531 512 HE2 TYR 87 HE2 TYR 87 116.588 5.358 8.655 513 HH TYR 87 HH TYR 87 115.991 5.765 11.724 514 H GLY 88 H GLY 88 112.771 11.990 7.163 515 HA2 GLY 88 HA2 GLY 88 112.610 12.380 4.202 516 H LYS 89 H LYS 89 113.860 13.982 3.336 517 HA LYS 89 HA LYS 89 114.959 16.057 5.211 518 HB2 LYS 89 HB2 LYS 89 116.558 14.229 4.530 519 HG2 LYS 89 HG2 LYS 89 117.127 17.019 3.473 520 HD2 LYS 89 HD2 LYS 89 118.974 14.731 4.222 521 HE2 LYS 89 HE2 LYS 89 120.146 17.186 3.086 522 HZ1 LYS 89 HZ1 LYS 89 121.743 16.578 4.792 523 HZ2 LYS 89 HZ2 LYS 89 121.261 15.187 3.943 524 HZ3 LYS 89 HZ3 LYS 89 120.636 15.498 5.492 525 H PHE 90 H PHE 90 114.648 18.141 4.485 526 HA PHE 90 HA PHE 90 113.957 18.538 1.596 527 HB2 PHE 90 HB2 PHE 90 112.197 20.098 2.368 528 HD1 PHE 90 HD1 PHE 90 112.515 18.001 5.407 529 HD2 PHE 90 HD2 PHE 90 112.779 21.967 3.778 530 HE1 PHE 90 HE1 PHE 90 112.598 18.937 7.701 531 HE2 PHE 90 HE2 PHE 90 112.862 22.903 6.074 532 HZ PHE 90 HZ PHE 90 112.773 21.388 8.035 533 H GLN 91 H GLN 91 114.231 20.878 0.944 534 HA GLN 91 HA GLN 91 116.625 22.038 2.308 535 HB2 GLN 91 HB2 GLN 91 115.429 22.366 -0.464 536 HG2 GLN 91 HG2 GLN 91 117.964 20.997 0.495 537 HE21 GLN 91 HE21 GLN 91 118.988 19.773 -1.377 538 HE22 GLN 91 HE22 GLN 91 118.839 20.413 -2.942 539 H THR 92 H THR 92 116.626 24.232 2.912 540 HA THR 92 HA THR 92 113.993 25.437 3.432 541 HB THR 92 HB THR 92 116.808 26.439 3.962 542 HG1 THR 92 HG1 THR 92 115.069 24.860 5.551 543 HG21 THR 92 HG21 THR 92 115.856 27.946 5.473 544 HG22 THR 92 HG22 THR 92 114.365 27.013 5.613 545 HG23 THR 92 HG23 THR 92 114.682 27.955 4.157 546 H THR 93 H THR 93 113.366 27.529 2.629 547 HA THR 93 HA THR 93 113.865 28.082 -0.109 548 HB THR 93 HB THR 93 113.030 29.993 2.100 549 HG1 THR 93 HG1 THR 93 111.024 29.172 1.842 550 HG21 THR 93 HG21 THR 93 113.265 30.240 -0.774 551 HG22 THR 93 HG22 THR 93 112.818 31.466 0.414 552 HG23 THR 93 HG23 THR 93 111.582 30.417 -0.280 553 H GLU 94 H GLU 94 115.298 29.501 -1.149 554 HA GLU 94 HA GLU 94 117.297 30.710 -1.475 555 HB2 GLU 94 HB2 GLU 94 116.516 31.668 1.302 556 HG2 GLU 94 HG2 GLU 94 115.908 32.740 -1.472 557 H TYR 95 H TYR 95 119.561 31.045 -0.449 558 HA TYR 95 HA TYR 95 120.664 28.535 0.315 559 HB2 TYR 95 HB2 TYR 95 121.521 31.122 -0.394 560 HD1 TYR 95 HD1 TYR 95 123.376 28.497 1.535 561 HD2 TYR 95 HD2 TYR 95 122.534 30.227 -2.306 562 HE1 TYR 95 HE1 TYR 95 125.074 27.018 0.496 563 HE2 TYR 95 HE2 TYR 95 124.232 28.747 -3.344 564 HH TYR 95 HH TYR 95 126.476 26.944 -1.495 565 HA PRO 96 HA PRO 96 119.337 28.797 4.625 566 HB2 PRO 96 HB2 PRO 96 120.235 26.313 5.348 567 HG2 PRO 96 HG2 PRO 96 121.343 25.719 3.416 568 HD2 PRO 96 HD2 PRO 96 121.093 26.889 1.452 569 H THR 97 H THR 97 122.508 28.212 3.317 570 HA THR 97 HA THR 97 124.680 28.451 4.208 571 HB THR 97 HB THR 97 124.907 30.570 5.426 572 HG1 THR 97 HG1 THR 97 123.168 31.565 6.298 573 HG21 THR 97 HG21 THR 97 124.302 31.855 3.641 574 HG22 THR 97 HG22 THR 97 122.650 31.236 3.625 575 HG23 THR 97 HG23 THR 97 123.953 30.289 2.908 576 H TYR 98 H TYR 98 122.832 26.577 5.694 577 HA TYR 98 HA TYR 98 124.353 26.556 8.273 578 HB2 TYR 98 HB2 TYR 98 122.030 27.529 8.462 579 HD1 TYR 98 HD2 TYR 98 123.573 27.523 10.538 580 HD2 TYR 98 HD1 TYR 98 121.032 24.233 9.461 581 HE1 TYR 98 HE2 TYR 98 123.715 26.655 12.856 582 HE2 TYR 98 HE1 TYR 98 121.173 23.364 11.780 583 HH TYR 98 HH TYR 98 123.460 24.362 13.977 584 H LYS 99 H LYS 99 125.166 24.530 8.733 585 HA LYS 99 HA LYS 99 125.255 22.435 6.850 586 HB2 LYS 99 HB2 LYS 99 125.511 22.421 9.874 587 HG2 LYS 99 HG2 LYS 99 127.528 22.699 7.624 588 HD2 LYS 99 HD2 LYS 99 127.891 22.497 10.630 589 HE2 LYS 99 HE2 LYS 99 129.901 23.128 8.433 590 HZ1 LYS 99 HZ1 LYS 99 130.770 21.626 10.048 591 HZ2 LYS 99 HZ2 LYS 99 130.089 22.500 11.335 592 HZ3 LYS 99 HZ3 LYS 99 131.375 23.161 10.442 593 H ASN 100 H ASN 100 123.031 22.833 9.612 594 HA ASN 100 HA ASN 100 121.063 21.671 10.195 595 HB2 ASN 100 HB2 ASN 100 120.435 22.890 8.154 596 HD21 ASN 100 HD21 ASN 100 118.622 22.301 9.758 597 HD22 ASN 100 HD22 ASN 100 117.494 21.130 9.272 598 H ASP 101 H ASP 101 121.371 19.690 7.276 599 HA ASP 101 HA ASP 101 121.590 17.359 7.028 600 HB2 ASP 101 HB2 ASP 101 123.506 17.941 9.310 601 H THR 102 H THR 102 119.308 18.047 8.516 602 HA THR 102 HA THR 102 119.258 15.882 10.599 603 HB THR 102 HB THR 102 117.674 17.326 11.820 604 HG1 THR 102 HG1 THR 102 116.816 18.995 10.888 605 HG21 THR 102 HG21 THR 102 119.719 19.357 11.303 606 HG22 THR 102 HG22 THR 102 120.400 17.749 11.549 607 HG23 THR 102 HG23 THR 102 119.369 18.469 12.786 608 H SER 103 H SER 103 117.475 14.489 10.507 609 HA SER 103 HA SER 103 115.372 15.055 8.450 610 HB2 SER 103 HB2 SER 103 116.928 12.486 8.887 611 HG SER 103 HG SER 103 117.475 13.077 6.610 612 H ASP 104 H ASP 104 113.330 14.027 8.909 613 HA ASP 104 HA ASP 104 112.844 13.520 11.775 614 HB2 ASP 104 HB2 ASP 104 111.110 13.549 9.281 615 H TYR 105 H TYR 105 112.733 11.434 12.683 616 HA TYR 105 HA TYR 105 113.309 9.112 11.025 617 HB2 TYR 105 HB2 TYR 105 114.309 9.476 13.198 618 HD1 TYR 105 HD2 TYR 105 111.220 7.763 14.275 619 HD2 TYR 105 HD1 TYR 105 115.205 7.280 12.747 620 HE1 TYR 105 HE2 TYR 105 111.131 5.346 14.813 621 HE2 TYR 105 HE1 TYR 105 115.118 4.862 13.291 622 HH TYR 105 HH TYR 105 113.805 3.411 14.990 623 H GLY 106 H GLY 106 111.803 7.694 10.215 624 HA2 GLY 106 HA2 GLY 106 109.006 7.850 11.271 625 H PHE 107 H PHE 107 108.030 5.539 10.003 626 HA PHE 107 HA PHE 107 109.770 3.309 10.973 627 HB2 PHE 107 HB2 PHE 107 108.205 4.085 12.770 628 HD1 PHE 107 HD1 PHE 107 109.657 2.255 13.610 629 HD2 PHE 107 HD2 PHE 107 106.154 1.463 11.254 630 HE1 PHE 107 HE1 PHE 107 109.720 -0.122 14.316 631 HE2 PHE 107 HE2 PHE 107 106.217 -0.914 11.959 632 HZ PHE 107 HZ PHE 107 107.999 -1.706 13.491 633 H SER 108 H SER 108 109.348 1.305 9.840 634 HA SER 108 HA SER 108 107.242 1.424 7.713 635 HB2 SER 108 HB2 SER 108 110.147 0.604 7.415 636 HG SER 108 HG SER 108 110.172 2.456 6.055 637 H TYR 109 H TYR 109 106.259 -0.573 7.286 638 HA TYR 109 HA TYR 109 107.410 -3.059 8.422 639 HB2 TYR 109 HB2 TYR 109 106.097 -1.917 10.222 640 HD1 TYR 109 HD2 TYR 109 107.145 -4.027 11.046 641 HD2 TYR 109 HD1 TYR 109 103.450 -4.026 8.857 642 HE1 TYR 109 HE2 TYR 109 106.690 -6.341 11.814 643 HE2 TYR 109 HE1 TYR 109 102.994 -6.340 9.625 644 HH TYR 109 HH TYR 109 103.627 -7.837 11.421 645 H GLY 110 H GLY 110 106.727 -4.887 7.209 646 HA2 GLY 110 HA2 GLY 110 104.302 -5.125 5.774 647 H ALA 111 H ALA 111 104.772 -6.667 3.683 648 HA ALA 111 HA ALA 111 107.056 -8.467 3.918 649 HB1 ALA 111 HB1 ALA 111 105.883 -9.155 5.923 650 HB2 ALA 111 HB2 ALA 111 105.601 -10.400 4.706 651 HB3 ALA 111 HB3 ALA 111 104.344 -9.214 5.062 652 H GLY 112 H GLY 112 106.831 -10.290 2.213 653 HA2 GLY 112 HA2 GLY 112 104.469 -10.105 0.480 654 H LEU 113 H LEU 113 105.212 -11.501 -1.667 655 HA LEU 113 HA LEU 113 106.533 -13.985 -0.588 656 HB2 LEU 113 HB2 LEU 113 104.873 -15.210 -1.997 657 HG LEU 113 HG LEU 113 104.593 -12.803 -3.313 658 HD11 LEU 113 HD11 LEU 113 103.960 -15.279 -3.883 659 HD12 LEU 113 HD12 LEU 113 103.091 -13.968 -4.680 660 HD13 LEU 113 HD13 LEU 113 102.356 -14.814 -3.319 661 HD21 LEU 113 HD21 LEU 113 102.338 -13.161 -1.337 662 HD22 LEU 113 HD22 LEU 113 102.075 -12.342 -2.878 663 HD23 LEU 113 HD23 LEU 113 103.239 -11.695 -1.722 664 H GLN 114 H GLN 114 107.556 -15.380 -2.382 665 HA GLN 114 HA GLN 114 108.430 -13.664 -4.680 666 HB2 GLN 114 HB2 GLN 114 109.875 -15.939 -3.273 667 HG2 GLN 114 HG2 GLN 114 110.302 -12.948 -2.989 668 HE21 GLN 114 HE21 GLN 114 111.930 -12.588 -1.112 669 HE22 GLN 114 HE22 GLN 114 113.236 -13.669 -1.011 670 H PHE 115 H PHE 115 107.948 -14.567 -6.692 671 HA PHE 115 HA PHE 115 107.266 -17.486 -6.794 672 HB2 PHE 115 HB2 PHE 115 105.286 -15.966 -6.798 673 HD1 PHE 115 HD1 PHE 115 104.577 -18.351 -6.881 674 HD2 PHE 115 HD2 PHE 115 105.806 -16.225 -10.406 675 HE1 PHE 115 HE1 PHE 115 103.552 -20.110 -8.300 676 HE2 PHE 115 HE2 PHE 115 104.782 -17.983 -11.824 677 HZ PHE 115 HZ PHE 115 103.656 -19.925 -10.772 678 H ASN 116 H ASN 116 108.436 -18.565 -8.335 679 HA ASN 116 HA ASN 116 109.057 -17.520 -10.948 680 HB2 ASN 116 HB2 ASN 116 110.688 -16.612 -8.807 681 HD21 ASN 116 HD21 ASN 116 109.840 -14.715 -9.996 682 HD22 ASN 116 HD22 ASN 116 110.556 -14.223 -11.453 683 HA PRO 117 HA PRO 117 109.869 -21.842 -11.347 684 HB2 PRO 117 HB2 PRO 117 111.014 -21.874 -13.836 685 HG2 PRO 117 HG2 PRO 117 111.354 -19.662 -14.277 686 HD2 PRO 117 HD2 PRO 117 110.807 -18.122 -12.706 687 H MET 118 H MET 118 112.638 -20.488 -13.148 688 HA MET 118 HA MET 118 114.618 -22.174 -12.280 689 HB2 MET 118 HB2 MET 118 114.654 -19.231 -12.985 690 HG2 MET 118 HG2 MET 118 115.196 -21.783 -14.525 691 HE1 MET 118 HE1 MET 118 117.758 -21.298 -15.798 692 HE2 MET 118 HE2 MET 118 117.469 -20.834 -14.123 693 HE3 MET 118 HE3 MET 118 118.281 -19.713 -15.212 694 H GLU 119 H GLU 119 115.259 -22.636 -10.351 695 HA GLU 119 HA GLU 119 114.615 -21.312 -7.926 696 HB2 GLU 119 HB2 GLU 119 116.818 -23.265 -8.642 697 HG2 GLU 119 HG2 GLU 119 114.010 -23.623 -7.547 698 H ASN 120 H ASN 120 117.044 -20.355 -10.217 699 HA ASN 120 HA ASN 120 118.775 -19.143 -8.141 700 HB2 ASN 120 HB2 ASN 120 118.840 -19.202 -11.175 701 HD21 ASN 120 HD21 ASN 120 120.513 -20.800 -11.943 702 HD22 ASN 120 HD22 ASN 120 120.864 -22.156 -10.986 703 H VAL 121 H VAL 121 115.931 -18.307 -9.734 704 HA VAL 121 HA VAL 121 116.521 -15.382 -9.409 705 HB VAL 121 HB VAL 121 115.065 -15.042 -11.397 706 HG11 VAL 121 HG11 VAL 121 117.657 -15.707 -11.392 707 HG12 VAL 121 HG12 VAL 121 116.767 -15.472 -12.897 708 HG13 VAL 121 HG13 VAL 121 117.042 -17.101 -12.279 709 HG21 VAL 121 HG21 VAL 121 114.362 -16.988 -12.717 710 HG22 VAL 121 HG22 VAL 121 113.702 -17.103 -11.085 711 HG23 VAL 121 HG23 VAL 121 115.104 -18.070 -11.539 712 H ALA 122 H ALA 122 114.568 -14.084 -8.946 713 HA ALA 122 HA ALA 122 112.152 -15.533 -8.051 714 HB1 ALA 122 HB1 ALA 122 113.264 -15.856 -6.056 715 HB2 ALA 122 HB2 ALA 122 112.602 -14.250 -5.746 716 HB3 ALA 122 HB3 ALA 122 114.277 -14.428 -6.272 717 H LEU 123 H LEU 123 110.356 -14.228 -8.122 718 HA LEU 123 HA LEU 123 110.756 -11.268 -8.463 719 HB2 LEU 123 HB2 LEU 123 110.018 -12.569 -10.500 720 HG LEU 123 HG LEU 123 108.158 -10.569 -9.210 721 HD11 LEU 123 HD11 LEU 123 109.582 -9.979 -11.727 722 HD12 LEU 123 HD12 LEU 123 110.641 -10.300 -10.354 723 HD13 LEU 123 HD13 LEU 123 109.442 -9.011 -10.260 724 HD21 LEU 123 HD21 LEU 123 107.993 -11.204 -12.133 725 HD22 LEU 123 HD22 LEU 123 106.758 -10.548 -11.059 726 HD23 LEU 123 HD23 LEU 123 107.154 -12.265 -11.002 727 H ASP 124 H ASP 124 109.600 -10.066 -6.853 728 HA ASP 124 HA ASP 124 107.397 -11.532 -5.463 729 HB2 ASP 124 HB2 ASP 124 108.460 -10.941 -3.300 730 H PHE 125 H PHE 125 105.992 -10.261 -4.219 731 HA PHE 125 HA PHE 125 106.060 -7.305 -4.767 732 HB2 PHE 125 HB2 PHE 125 103.715 -9.242 -4.651 733 HD1 PHE 125 HD2 PHE 125 104.411 -6.462 -6.989 734 HD2 PHE 125 HD1 PHE 125 104.503 -10.716 -6.401 735 HE1 PHE 125 HE2 PHE 125 104.786 -6.790 -9.418 736 HE2 PHE 125 HE1 PHE 125 104.878 -11.044 -8.831 737 HZ PHE 125 HZ PHE 125 105.020 -9.081 -10.339 738 H SER 126 H SER 126 105.832 -6.070 -2.884 739 HA SER 126 HA SER 126 104.829 -7.463 -0.430 740 HB2 SER 126 HB2 SER 126 107.314 -7.524 -0.581 741 HG SER 126 HG SER 126 107.355 -7.209 1.483 742 H TYR 127 H TYR 127 103.673 -6.139 0.959 743 HA TYR 127 HA TYR 127 103.228 -3.315 0.061 744 HB2 TYR 127 HB2 TYR 127 101.297 -4.882 0.026 745 HD1 TYR 127 HD1 TYR 127 100.645 -2.585 -0.736 746 HD2 TYR 127 HD2 TYR 127 100.810 -3.650 3.421 747 HE1 TYR 127 HE1 TYR 127 99.287 -0.589 -0.173 748 HE2 TYR 127 HE2 TYR 127 99.452 -1.653 3.985 749 HH TYR 127 HH TYR 127 97.642 -0.178 2.484 750 H GLU 128 H GLU 128 104.000 -1.750 1.421 751 HA GLU 128 HA GLU 128 104.281 -2.368 4.320 752 HB2 GLU 128 HB2 GLU 128 106.594 -1.495 4.244 753 HG2 GLU 128 HG2 GLU 128 106.042 -1.293 1.266 754 H GLN 129 H GLN 129 104.095 -0.517 5.653 755 HA GLN 129 HA GLN 129 103.236 1.980 4.232 756 HB2 GLN 129 HB2 GLN 129 102.568 0.824 6.960 757 HG2 GLN 129 HG2 GLN 129 100.880 1.196 4.464 758 HE21 GLN 129 HE21 GLN 129 98.718 0.023 4.790 759 HE22 GLN 129 HE22 GLN 129 98.038 0.026 6.346 760 H SER 130 H SER 130 104.373 3.847 4.661 761 HA SER 130 HA SER 130 106.333 3.812 6.931 762 HB2 SER 130 HB2 SER 130 106.658 4.930 4.126 763 HG SER 130 HG SER 130 108.461 3.164 4.569 764 H ARG 131 H ARG 131 106.442 5.796 8.095 765 HA ARG 131 HA ARG 131 104.918 8.096 7.001 766 HB2 ARG 131 HB2 ARG 131 103.551 8.211 9.052 767 HG2 ARG 131 HG2 ARG 131 105.129 5.730 9.787 768 HD2 ARG 131 HD2 ARG 131 102.598 6.872 11.035 769 HE ARG 131 HE ARG 131 104.776 5.548 12.284 770 HH11 ARG 131 HH11 ARG 131 102.219 3.669 11.579 771 HH12 ARG 131 HH12 ARG 131 101.603 3.509 13.190 772 HH21 ARG 131 HH21 ARG 131 103.624 6.005 14.498 773 HH22 ARG 131 HH22 ARG 131 102.398 4.830 14.842 774 H ILE 132 H ILE 132 105.618 10.112 7.777 775 HA ILE 132 HA ILE 132 107.894 10.048 9.735 776 HB ILE 132 HB ILE 132 107.413 11.924 7.393 777 HG12 ILE 132 HG12 ILE 132 107.838 9.651 6.561 778 HG21 ILE 132 HG21 ILE 132 110.103 11.506 8.581 779 HG22 ILE 132 HG22 ILE 132 108.939 12.385 9.572 780 HG23 ILE 132 HG23 ILE 132 109.358 12.980 7.966 781 HD11 ILE 132 HD11 ILE 132 109.103 8.231 7.761 782 HD12 ILE 132 HD12 ILE 132 109.581 9.536 8.847 783 HD13 ILE 132 HD13 ILE 132 110.520 9.213 7.390 784 H ARG 133 H ARG 133 106.438 10.579 11.526 785 HA ARG 133 HA ARG 133 105.392 12.042 12.993 786 HB2 ARG 133 HB2 ARG 133 106.591 14.027 11.039 787 HG2 ARG 133 HG2 ARG 133 107.506 12.894 13.701 788 HD2 ARG 133 HD2 ARG 133 108.683 15.082 11.944 789 HE ARG 133 HE ARG 133 110.361 13.397 12.906 790 HH11 ARG 133 HH11 ARG 133 111.204 16.170 13.583 791 HH12 ARG 133 HH12 ARG 133 111.455 16.078 15.294 792 HH21 ARG 133 HH21 ARG 133 109.680 13.122 15.662 793 HH22 ARG 133 HH22 ARG 133 110.590 14.352 16.471 794 H SER 134 H SER 134 104.844 13.670 9.830 795 HA SER 134 HA SER 134 101.902 13.449 10.402 796 HB2 SER 134 HB2 SER 134 101.670 15.712 9.698 797 HG SER 134 HG SER 134 102.865 16.324 8.115 798 H VAL 135 H VAL 135 103.922 11.925 8.579 799 HA VAL 135 HA VAL 135 102.353 12.328 6.041 800 HB VAL 135 HB VAL 135 105.260 11.544 6.427 801 HG11 VAL 135 HG11 VAL 135 103.796 12.268 3.875 802 HG12 VAL 135 HG12 VAL 135 104.064 10.605 4.396 803 HG13 VAL 135 HG13 VAL 135 105.440 11.645 4.027 804 HG21 VAL 135 HG21 VAL 135 105.374 13.857 5.089 805 HG22 VAL 135 HG22 VAL 135 105.311 13.819 6.851 806 HG23 VAL 135 HG23 VAL 135 103.845 14.130 5.922 807 H ASP 136 H ASP 136 101.387 10.506 5.236 808 HA ASP 136 HA ASP 136 102.295 7.835 6.269 809 HB2 ASP 136 HB2 ASP 136 100.185 8.718 7.326 810 H VAL 137 H VAL 137 103.200 6.858 4.381 811 HA VAL 137 HA VAL 137 101.833 7.417 1.792 812 HB VAL 137 HB VAL 137 104.618 6.362 2.364 813 HG11 VAL 137 HG11 VAL 137 104.978 6.453 0.124 814 HG12 VAL 137 HG12 VAL 137 104.038 7.931 -0.069 815 HG13 VAL 137 HG13 VAL 137 103.219 6.372 0.024 816 HG21 VAL 137 HG21 VAL 137 105.383 8.444 2.797 817 HG22 VAL 137 HG22 VAL 137 103.704 8.927 3.012 818 HG23 VAL 137 HG23 VAL 137 104.487 9.133 1.447 819 H GLY 138 H GLY 138 101.247 5.670 0.487 820 HA2 GLY 138 HA2 GLY 138 101.636 2.928 1.611 821 H THR 139 H THR 139 103.335 2.136 0.392 822 HA THR 139 HA THR 139 103.258 2.645 -2.567 823 HB THR 139 HB THR 139 105.597 2.244 -0.679 824 HG1 THR 139 HG1 THR 139 105.901 4.467 -1.068 825 HG21 THR 139 HG21 THR 139 106.966 2.188 -2.478 826 HG22 THR 139 HG22 THR 139 106.071 3.463 -3.304 827 HG23 THR 139 HG23 THR 139 105.519 1.791 -3.404 828 H TRP 140 H TRP 140 103.568 0.922 -3.932 829 HA TRP 140 HA TRP 140 103.713 -1.810 -2.712 830 HB2 TRP 140 HB2 TRP 140 102.766 -0.756 -5.405 831 HD1 TRP 140 HD1 TRP 140 101.074 0.888 -4.182 832 HE1 TRP 140 HE1 TRP 140 98.893 0.453 -2.877 833 HE3 TRP 140 HE3 TRP 140 101.524 -4.133 -3.363 834 HZ2 TRP 140 HZ2 TRP 140 97.522 -1.736 -1.649 835 HZ3 TRP 140 HZ3 TRP 140 99.766 -5.367 -2.126 836 HH2 TRP 140 HH2 TRP 140 97.767 -4.176 -1.269 837 H ILE 141 H ILE 141 105.541 -3.063 -3.211 838 HA ILE 141 HA ILE 141 107.465 -1.871 -5.185 839 HB ILE 141 HB ILE 141 109.216 -2.802 -3.715 840 HG12 ILE 141 HG12 ILE 141 106.926 -3.637 -1.905 841 HG21 ILE 141 HG21 ILE 141 108.242 -1.515 -1.524 842 HG22 ILE 141 HG22 ILE 141 107.166 -0.883 -2.769 843 HG23 ILE 141 HG23 ILE 141 108.910 -0.683 -2.928 844 HD11 ILE 141 HD11 ILE 141 109.466 -2.968 -1.202 845 HD12 ILE 141 HD12 ILE 141 109.687 -4.675 -1.583 846 HD13 ILE 141 HD13 ILE 141 108.517 -4.191 -0.357 847 H ALA 142 H ALA 142 108.620 -3.310 -6.533 848 HA ALA 142 HA ALA 142 108.025 -6.213 -6.416 849 HB1 ALA 142 HB1 ALA 142 107.590 -4.868 -9.045 850 HB2 ALA 142 HB2 ALA 142 106.348 -4.619 -7.818 851 HB3 ALA 142 HB3 ALA 142 106.750 -6.252 -8.345 852 H GLY 143 H GLY 143 109.810 -7.368 -7.247 853 HA2 GLY 143 HA2 GLY 143 111.638 -6.107 -9.145 854 H VAL 144 H VAL 144 113.935 -7.556 -8.408 855 HA VAL 144 HA VAL 144 113.066 -10.364 -9.008 856 HB VAL 144 HB VAL 144 115.206 -10.471 -10.283 857 HG11 VAL 144 HG11 VAL 144 113.892 -7.968 -11.248 858 HG12 VAL 144 HG12 VAL 144 112.891 -9.413 -11.101 859 HG13 VAL 144 HG13 VAL 144 114.316 -9.429 -12.140 860 HG21 VAL 144 HG21 VAL 144 115.418 -7.498 -9.732 861 HG22 VAL 144 HG22 VAL 144 116.590 -8.527 -10.557 862 HG23 VAL 144 HG23 VAL 144 116.326 -8.705 -8.822 863 H GLY 145 H GLY 145 114.929 -11.961 -8.419 864 HA2 GLY 145 HA2 GLY 145 116.514 -11.138 -6.072 865 H TYR 146 H TYR 146 118.354 -12.360 -5.839 866 HA TYR 146 HA TYR 146 118.608 -14.840 -7.514 867 HB2 TYR 146 HB2 TYR 146 120.639 -12.636 -7.004 868 HD1 TYR 146 HD2 TYR 146 119.367 -14.483 -9.998 869 HD2 TYR 146 HD1 TYR 146 119.672 -10.714 -7.961 870 HE1 TYR 146 HE2 TYR 146 118.393 -13.339 -11.971 871 HE2 TYR 146 HE1 TYR 146 118.699 -9.569 -9.934 872 HH TYR 146 HH TYR 146 117.123 -11.190 -12.407 873 H ARG 147 H ARG 147 119.846 -16.531 -6.509 874 HA ARG 147 HA ARG 147 120.702 -15.987 -3.679 875 HB2 ARG 147 HB2 ARG 147 118.507 -17.163 -3.912 876 HG2 ARG 147 HG2 ARG 147 120.809 -18.805 -2.809 877 HD2 ARG 147 HD2 ARG 147 118.720 -20.143 -3.107 878 HE ARG 147 HE ARG 147 117.477 -17.871 -1.591 879 HH11 ARG 147 HH11 ARG 147 116.719 -20.983 -2.389 880 HH12 ARG 147 HH12 ARG 147 115.334 -20.612 -3.360 881 HH21 ARG 147 HH21 ARG 147 115.956 -17.202 -3.419 882 HH22 ARG 147 HH22 ARG 147 114.901 -18.473 -3.942 883 H PHE 148 H PHE 148 122.846 -16.431 -3.432 884 HA PHE 148 HA PHE 148 124.116 -18.449 -5.257 885 HB2 PHE 148 HB2 PHE 148 124.835 -16.063 -5.432 886 HD1 PHE 148 HD1 PHE 148 126.022 -17.449 -7.117 887 HD2 PHE 148 HD2 PHE 148 127.321 -17.256 -3.028 888 HE1 PHE 148 HE1 PHE 148 128.208 -18.423 -7.766 889 HE2 PHE 148 HE2 PHE 148 129.507 -18.230 -3.677 890 HZ PHE 148 HZ PHE 148 129.950 -18.814 -6.046
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