NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
589329 | 2mwh | 25324 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 2 1H ALA 2 0.844 5.721 9.658 2 H2 ALA 2 2H ALA 2 0.512 7.292 9.139 3 H3 ALA 2 3H ALA 2 0.118 5.968 8.147 4 HA ALA 2 HA ALA 2 -1.085 6.603 10.770 5 HB1 ALA 2 3HB ALA 2 -2.239 6.746 7.987 6 HB2 ALA 2 1HB ALA 2 -1.806 8.123 9.001 7 HB3 ALA 2 2HB ALA 2 -3.116 7.046 9.486 8 H LEU 3 H LEU 3 -2.884 5.208 11.298 9 HA LEU 3 HA LEU 3 -2.281 2.458 10.561 10 HB2 LEU 3 2HB LEU 3 -2.538 3.323 12.962 11 HB3 LEU 3 3HB LEU 3 -4.247 3.450 12.632 12 HG LEU 3 HG LEU 3 -3.610 1.433 13.935 13 HD11 LEU 3 1HD1 LEU 3 -4.794 0.827 11.244 14 HD12 LEU 3 2HD1 LEU 3 -5.665 1.440 12.649 15 HD13 LEU 3 3HD1 LEU 3 -4.936 -0.166 12.696 16 HD21 LEU 3 3HD2 LEU 3 -2.486 -0.419 12.839 17 HD22 LEU 3 1HD2 LEU 3 -1.444 1.002 12.889 18 HD23 LEU 3 2HD2 LEU 3 -2.259 0.555 11.389 19 H TYR 4 H TYR 4 -3.531 1.278 9.253 20 HA TYR 4 HA TYR 4 -6.173 2.348 8.503 21 HB2 TYR 4 2HB TYR 4 -4.109 0.989 6.782 22 HB3 TYR 4 3HB TYR 4 -5.789 1.155 6.297 23 HD1 TYR 4 HD2 TYR 4 -6.694 3.315 5.689 24 HD2 TYR 4 HD1 TYR 4 -2.624 2.909 6.833 25 HE1 TYR 4 HE2 TYR 4 -6.217 5.527 4.742 26 HE2 TYR 4 HE1 TYR 4 -2.134 5.123 5.888 27 HH TYR 4 HH TYR 4 -3.190 6.611 4.065 28 H ASN 5 H ASN 5 -7.824 0.938 8.201 29 HA ASN 5 HA ASN 5 -7.471 -1.752 9.324 30 HB2 ASN 5 2HB ASN 5 -9.999 -0.190 8.682 31 HB3 ASN 5 3HB ASN 5 -9.959 -1.793 9.406 32 HD21 ASN 5 1HD2 ASN 5 -9.545 1.593 9.917 33 HD22 ASN 5 2HD2 ASN 5 -9.360 1.525 11.632 34 H VAL 6 H VAL 6 -7.869 -3.560 8.048 35 HA VAL 6 HA VAL 6 -8.194 -2.916 5.191 36 HB VAL 6 HB VAL 6 -6.520 -5.063 6.483 37 HG11 VAL 6 1HG1 VAL 6 -7.593 -6.018 4.517 38 HG12 VAL 6 2HG1 VAL 6 -5.876 -5.750 4.215 39 HG13 VAL 6 3HG1 VAL 6 -7.071 -4.642 3.545 40 HG21 VAL 6 3HG2 VAL 6 -4.684 -3.919 5.333 41 HG22 VAL 6 1HG2 VAL 6 -5.524 -2.849 6.454 42 HG23 VAL 6 2HG2 VAL 6 -5.823 -2.719 4.720 43 H GLU 7 H GLU 7 -9.824 -3.694 4.166 44 HA GLU 7 HA GLU 7 -11.094 -6.184 5.059 45 HB2 GLU 7 2HB GLU 7 -12.359 -3.734 3.795 46 HB3 GLU 7 3HB GLU 7 -13.191 -5.267 4.006 47 HG2 GLU 7 2HG GLU 7 -12.972 -5.084 6.416 48 HG3 GLU 7 3HG GLU 7 -12.068 -3.585 6.237 49 H ASN 8 H ASN 8 -11.373 -7.721 3.503 50 HA ASN 8 HA ASN 8 -10.418 -7.031 0.802 51 HB2 ASN 8 2HB ASN 8 -9.687 -9.440 2.464 52 HB3 ASN 8 3HB ASN 8 -9.432 -9.365 0.726 53 HD21 ASN 8 1HD2 ASN 8 -8.704 -6.547 0.744 54 HD22 ASN 8 2HD2 ASN 8 -7.119 -6.475 1.430 55 H GLN 9 H GLN 9 -11.290 -8.130 -0.907 56 HA GLN 9 HA GLN 9 -13.607 -9.881 -0.361 57 HB2 GLN 9 2HB GLN 9 -14.280 -7.589 -1.156 58 HB3 GLN 9 3HB GLN 9 -13.356 -7.876 -2.621 59 HG2 GLN 9 2HG GLN 9 -14.820 -9.812 -3.108 60 HG3 GLN 9 3HG GLN 9 -15.788 -9.389 -1.697 61 HE21 GLN 9 1HE2 GLN 9 -17.641 -8.950 -2.829 62 HE22 GLN 9 2HE2 GLN 9 -17.793 -7.590 -3.891 63 H TRP 10 H TRP 10 -13.197 -11.884 -1.226 64 HA TRP 10 HA TRP 10 -11.547 -11.949 -3.633 65 HB2 TRP 10 2HB TRP 10 -10.027 -13.599 -2.713 66 HB3 TRP 10 3HB TRP 10 -10.002 -12.127 -1.750 67 HD1 TRP 10 HD1 TRP 10 -11.123 -15.792 -1.594 68 HE1 TRP 10 HE1 TRP 10 -11.507 -16.437 0.863 69 HE3 TRP 10 HE3 TRP 10 -10.572 -11.188 0.559 70 HZ2 TRP 10 HZ2 TRP 10 -11.558 -15.179 3.379 71 HZ3 TRP 10 HZ3 TRP 10 -10.805 -11.002 3.004 72 HH2 TRP 10 HH2 TRP 10 -11.287 -12.953 4.380 73 H GLY 11 H GLY 11 -14.563 -12.982 -2.639 74 HA2 GLY 11 2HA GLY 11 -14.067 -15.606 -3.793 75 HA3 GLY 11 3HA GLY 11 -15.192 -15.314 -2.474 76 H GLY 12 H GLY 12 -14.960 -12.842 -4.826 77 HA2 GLY 12 2HA GLY 12 -16.217 -12.762 -6.899 78 HA3 GLY 12 3HA GLY 12 -17.377 -13.859 -6.163 79 H SER 13 H SER 13 -17.970 -11.399 -7.383 80 HA SER 13 HA SER 13 -18.383 -9.249 -5.699 81 HB2 SER 13 2HB SER 13 -20.210 -10.188 -7.916 82 HB3 SER 13 3HB SER 13 -20.164 -8.564 -7.231 83 HG SER 13 HG SER 13 -18.933 -8.878 -9.207 84 H SER 14 H SER 14 -20.300 -12.197 -5.957 85 HA SER 14 HA SER 14 -22.468 -11.333 -4.380 86 HB2 SER 14 2HB SER 14 -21.447 -14.149 -4.809 87 HB3 SER 14 3HB SER 14 -23.063 -13.691 -4.264 88 HG SER 14 HG SER 14 -23.122 -12.444 -6.323 89 H ALA 15 H ALA 15 -19.266 -12.057 -3.530 90 HA ALA 15 HA ALA 15 -19.963 -12.719 -0.771 91 HB1 ALA 15 3HB ALA 15 -17.579 -13.194 -0.485 92 HB2 ALA 15 1HB ALA 15 -17.267 -12.654 -2.135 93 HB3 ALA 15 2HB ALA 15 -18.243 -14.095 -1.849 94 HA PRO 16 HA PRO 16 -19.317 -8.487 0.387 95 HB2 PRO 16 2HB PRO 16 -19.303 -8.767 3.049 96 HB3 PRO 16 3HB PRO 16 -20.770 -9.053 2.103 97 HG2 PRO 16 2HG PRO 16 -18.804 -11.044 3.180 98 HG3 PRO 16 3HG PRO 16 -20.575 -11.090 3.242 99 HD2 PRO 16 2HD PRO 16 -19.121 -12.459 1.398 100 HD3 PRO 16 3HD PRO 16 -20.753 -11.841 1.075 101 H TRP 17 H TRP 17 -17.959 -7.418 2.342 102 HA TRP 17 HA TRP 17 -15.173 -7.995 1.691 103 HB2 TRP 17 2HB TRP 17 -16.470 -5.664 3.115 104 HB3 TRP 17 3HB TRP 17 -14.733 -5.835 2.901 105 HD1 TRP 17 HD1 TRP 17 -17.900 -4.887 1.037 106 HE1 TRP 17 HE1 TRP 17 -17.259 -3.911 -1.260 107 HE3 TRP 17 HE3 TRP 17 -12.914 -5.994 1.042 108 HZ2 TRP 17 HZ2 TRP 17 -14.954 -3.650 -2.858 109 HZ3 TRP 17 HZ3 TRP 17 -11.561 -5.348 -0.909 110 HH2 TRP 17 HH2 TRP 17 -12.561 -4.202 -2.817 111 H ASN 18 H ASN 18 -13.720 -8.744 3.125 112 HA ASN 18 HA ASN 18 -14.686 -9.270 5.859 113 HB2 ASN 18 2HB ASN 18 -12.898 -10.971 4.117 114 HB3 ASN 18 3HB ASN 18 -13.186 -11.274 5.826 115 HD21 ASN 18 1HD2 ASN 18 -13.789 -12.822 3.374 116 HD22 ASN 18 2HD2 ASN 18 -15.475 -13.182 3.476 117 H GLU 19 H GLU 19 -13.609 -8.265 7.375 118 HA GLU 19 HA GLU 19 -11.113 -6.922 6.869 119 HB2 GLU 19 2HB GLU 19 -12.855 -5.974 8.330 120 HB3 GLU 19 3HB GLU 19 -12.673 -7.336 9.420 121 HG2 GLU 19 2HG GLU 19 -10.355 -6.649 9.855 122 HG3 GLU 19 3HG GLU 19 -10.600 -5.245 8.817 123 H GLY 20 H GLY 20 -9.051 -7.682 7.353 124 HA2 GLY 20 2HA GLY 20 -8.935 -10.046 9.089 125 HA3 GLY 20 3HA GLY 20 -8.174 -10.076 7.510 126 H GLY 21 H GLY 21 -8.160 -7.194 9.548 127 HA2 GLY 21 2HA GLY 21 -6.206 -7.179 11.206 128 HA3 GLY 21 3HA GLY 21 -5.250 -7.549 9.784 129 H GLN 22 H GLN 22 -4.356 -5.476 10.963 130 HA GLN 22 HA GLN 22 -5.414 -3.134 9.517 131 HB2 GLN 22 2HB GLN 22 -4.125 -3.270 12.250 132 HB3 GLN 22 3HB GLN 22 -4.432 -1.774 11.383 133 HG2 GLN 22 2HG GLN 22 -6.811 -2.165 11.480 134 HG3 GLN 22 3HG GLN 22 -6.546 -3.731 12.250 135 HE21 GLN 22 1HE2 GLN 22 -7.946 -1.267 13.152 136 HE22 GLN 22 2HE2 GLN 22 -7.237 -0.885 14.684 137 H TRP 23 H TRP 23 -3.882 -1.743 8.624 138 HA TRP 23 HA TRP 23 -1.092 -2.728 8.563 139 HB2 TRP 23 2HB TRP 23 -2.709 -1.466 6.342 140 HB3 TRP 23 3HB TRP 23 -0.972 -1.689 6.274 141 HD1 TRP 23 HD1 TRP 23 -2.354 -4.706 7.841 142 HE1 TRP 23 HE1 TRP 23 -2.633 -6.581 6.103 143 HE3 TRP 23 HE3 TRP 23 -1.767 -1.959 3.586 144 HZ2 TRP 23 HZ2 TRP 23 -2.597 -6.858 3.307 145 HZ3 TRP 23 HZ3 TRP 23 -1.896 -3.106 1.415 146 HH2 TRP 23 HH2 TRP 23 -2.299 -5.499 1.284 147 H GLU 24 H GLU 24 0.423 -0.910 7.815 148 HA GLU 24 HA GLU 24 -0.563 1.676 8.790 149 HB2 GLU 24 2HB GLU 24 0.903 0.710 10.519 150 HB3 GLU 24 3HB GLU 24 2.199 0.575 9.333 151 HG2 GLU 24 2HG GLU 24 2.280 2.973 9.082 152 HG3 GLU 24 3HG GLU 24 0.904 3.161 10.164 153 H ILE 25 H ILE 25 -0.516 3.119 7.306 154 HA ILE 25 HA ILE 25 1.582 3.072 5.251 155 HB ILE 25 HB ILE 25 -1.394 3.366 4.728 156 HG12 ILE 25 2HG1 ILE 25 0.560 1.327 3.647 157 HG13 ILE 25 3HG1 ILE 25 -0.521 1.039 5.006 158 HG21 ILE 25 1HG2 ILE 25 -0.806 3.645 2.360 159 HG22 ILE 25 2HG2 ILE 25 0.903 3.663 2.793 160 HG23 ILE 25 3HG2 ILE 25 -0.162 4.951 3.355 161 HD11 ILE 25 3HD1 ILE 25 -1.363 1.682 2.188 162 HD12 ILE 25 1HD1 ILE 25 -2.446 1.373 3.548 163 HD13 ILE 25 2HD1 ILE 25 -1.393 0.090 2.947 164 H GLY 26 H GLY 26 2.199 5.122 4.521 165 HA2 GLY 26 2HA GLY 26 2.202 7.449 4.407 166 HA3 GLY 26 3HA GLY 26 0.693 7.462 5.309 167 H SER 27 H SER 27 3.588 5.833 6.292 168 HA SER 27 HA SER 27 3.600 7.091 8.850 169 HB2 SER 27 2HB SER 27 5.796 5.430 7.617 170 HB3 SER 27 3HB SER 27 5.486 5.693 9.334 171 HG SER 27 HG SER 27 4.623 3.717 8.776 172 H ARG 28 H ARG 28 4.097 8.793 6.358 173 HA ARG 28 HA ARG 28 6.745 9.864 6.915 174 HB2 ARG 28 2HB ARG 28 6.008 9.511 4.558 175 HB3 ARG 28 3HB ARG 28 4.712 10.668 4.812 176 HG2 ARG 28 2HG ARG 28 6.371 12.424 5.212 177 HG3 ARG 28 3HG ARG 28 7.662 11.253 4.942 178 HD2 ARG 28 2HD ARG 28 6.869 10.899 2.663 179 HD3 ARG 28 3HD ARG 28 5.561 12.052 2.931 180 HE ARG 28 HE ARG 28 8.290 12.975 3.329 181 HH11 ARG 28 1HH1 ARG 28 5.460 12.897 1.247 182 HH12 ARG 28 2HH1 ARG 28 5.924 14.299 0.350 183 HH21 ARG 28 1HH2 ARG 28 8.922 14.815 2.098 184 HH22 ARG 28 2HH2 ARG 28 7.890 15.390 0.828 185 H SER 29 H SER 29 4.008 10.028 8.414 186 HA SER 29 HA SER 29 3.179 11.327 10.039 187 HB2 SER 29 2HB SER 29 5.409 13.260 9.374 188 HB3 SER 29 3HB SER 29 4.396 13.299 10.818 189 HG SER 29 HG SER 29 6.293 12.247 11.314 190 H ASP 30 H ASP 30 4.233 13.993 7.918 191 HA ASP 30 HA ASP 30 1.530 15.066 8.079 192 HB2 ASP 30 2HB ASP 30 4.075 16.248 6.986 193 HB3 ASP 30 3HB ASP 30 2.519 17.067 6.943 194 H GLN 31 H GLN 31 2.824 12.905 6.028 195 HA GLN 31 HA GLN 31 1.270 14.030 3.830 196 HB2 GLN 31 2HB GLN 31 3.980 12.873 3.804 197 HB3 GLN 31 3HB GLN 31 2.939 12.522 2.426 198 HG2 GLN 31 2HG GLN 31 3.451 15.293 3.463 199 HG3 GLN 31 3HG GLN 31 4.390 14.534 2.174 200 HE21 GLN 31 1HE2 GLN 31 1.203 15.655 3.095 201 HE22 GLN 31 2HE2 GLN 31 0.590 15.802 1.485 202 H ASN 32 H ASN 32 -0.456 13.007 3.420 203 HA ASN 32 HA ASN 32 -0.702 10.187 4.037 204 HB2 ASN 32 2HB ASN 32 -2.517 11.692 4.720 205 HB3 ASN 32 3HB ASN 32 -2.739 12.200 3.051 206 HD21 ASN 32 1HD2 ASN 32 -3.127 9.611 5.333 207 HD22 ASN 32 2HD2 ASN 32 -4.232 8.672 4.388 208 H VAL 33 H VAL 33 -1.192 8.661 2.551 209 HA VAL 33 HA VAL 33 -0.342 9.206 -0.195 210 HB VAL 33 HB VAL 33 -0.788 6.559 1.189 211 HG11 VAL 33 1HG1 VAL 33 -0.995 6.400 -1.220 212 HG12 VAL 33 2HG1 VAL 33 0.489 5.620 -0.672 213 HG13 VAL 33 3HG1 VAL 33 0.556 7.213 -1.424 214 HG21 VAL 33 3HG2 VAL 33 1.019 7.851 2.222 215 HG22 VAL 33 1HG2 VAL 33 1.798 8.009 0.648 216 HG23 VAL 33 2HG2 VAL 33 1.623 6.419 1.394 217 H VAL 34 H VAL 34 -1.712 9.075 -1.914 218 HA VAL 34 HA VAL 34 -4.463 8.202 -1.332 219 HB VAL 34 HB VAL 34 -5.191 9.592 -3.259 220 HG11 VAL 34 1HG1 VAL 34 -4.954 11.752 -2.111 221 HG12 VAL 34 2HG1 VAL 34 -3.722 11.045 -1.067 222 HG13 VAL 34 3HG1 VAL 34 -5.380 10.449 -1.002 223 HG21 VAL 34 3HG2 VAL 34 -3.091 9.669 -4.499 224 HG22 VAL 34 1HG2 VAL 34 -2.346 10.605 -3.202 225 HG23 VAL 34 2HG2 VAL 34 -3.665 11.299 -4.146 226 H ALA 35 H ALA 35 -1.697 7.511 -3.274 227 HA ALA 35 HA ALA 35 -3.203 5.324 -4.483 228 HB1 ALA 35 3HB ALA 35 -2.535 5.784 -6.744 229 HB2 ALA 35 1HB ALA 35 -1.606 7.194 -6.229 230 HB3 ALA 35 2HB ALA 35 -3.364 7.201 -6.101 231 H ILE 36 H ILE 36 -1.954 3.538 -5.060 232 HA ILE 36 HA ILE 36 0.920 3.704 -4.651 233 HB ILE 36 HB ILE 36 -0.809 1.769 -3.075 234 HG12 ILE 36 2HG1 ILE 36 1.091 3.882 -2.047 235 HG13 ILE 36 3HG1 ILE 36 -0.655 4.093 -2.149 236 HG21 ILE 36 1HG2 ILE 36 1.207 0.689 -3.888 237 HG22 ILE 36 2HG2 ILE 36 1.293 0.926 -2.143 238 HG23 ILE 36 3HG2 ILE 36 2.192 1.991 -3.224 239 HD11 ILE 36 3HD1 ILE 36 0.050 3.509 0.106 240 HD12 ILE 36 1HD1 ILE 36 0.775 2.019 -0.498 241 HD13 ILE 36 2HD1 ILE 36 -0.970 2.248 -0.588 242 H ASN 37 H ASN 37 1.798 2.703 -6.321 243 HA ASN 37 HA ASN 37 0.572 0.220 -7.306 244 HB2 ASN 37 2HB ASN 37 1.830 2.461 -8.917 245 HB3 ASN 37 3HB ASN 37 1.555 0.851 -9.572 246 HD21 ASN 37 1HD2 ASN 37 -0.973 0.537 -8.107 247 HD22 ASN 37 2HD2 ASN 37 -2.123 1.509 -8.946 248 H VAL 38 H VAL 38 1.919 -1.393 -6.726 249 HA VAL 38 HA VAL 38 4.772 -1.052 -7.020 250 HB VAL 38 HB VAL 38 5.339 -1.686 -4.685 251 HG11 VAL 38 1HG1 VAL 38 4.985 0.520 -3.675 252 HG12 VAL 38 2HG1 VAL 38 3.836 0.908 -4.956 253 HG13 VAL 38 3HG1 VAL 38 5.532 0.629 -5.349 254 HG21 VAL 38 3HG2 VAL 38 2.437 -1.103 -4.131 255 HG22 VAL 38 1HG2 VAL 38 3.673 -1.385 -2.908 256 HG23 VAL 38 2HG2 VAL 38 3.222 -2.677 -4.021 257 H GLU 39 H GLU 39 5.945 -2.987 -6.838 258 HA GLU 39 HA GLU 39 4.500 -5.416 -6.241 259 HB2 GLU 39 2HB GLU 39 4.135 -5.038 -8.674 260 HB3 GLU 39 3HB GLU 39 5.875 -5.020 -8.910 261 HG2 GLU 39 2HG GLU 39 6.046 -7.322 -8.259 262 HG3 GLU 39 3HG GLU 39 4.343 -7.366 -7.810 263 H SER 40 H SER 40 5.915 -7.192 -5.849 264 HA SER 40 HA SER 40 8.390 -6.311 -4.672 265 HB2 SER 40 2HB SER 40 8.485 -8.691 -3.891 266 HB3 SER 40 3HB SER 40 7.031 -7.814 -3.407 267 HG SER 40 HG SER 40 7.112 -9.376 -5.757 268 H GLY 41 H GLY 41 10.358 -6.512 -5.519 269 HA2 GLY 41 2HA GLY 41 10.793 -7.723 -8.075 270 HA3 GLY 41 3HA GLY 41 12.041 -7.125 -6.982 271 H ASP 42 H ASP 42 11.513 -8.588 -4.760 272 HA ASP 42 HA ASP 42 12.256 -11.312 -5.575 273 HB2 ASP 42 2HB ASP 42 12.715 -9.820 -2.976 274 HB3 ASP 42 3HB ASP 42 13.128 -11.509 -3.227 275 H ASP 43 H ASP 43 11.768 -12.311 -2.901 276 HA ASP 43 HA ASP 43 9.041 -13.131 -3.148 277 HB2 ASP 43 2HB ASP 43 11.029 -13.550 -0.905 278 HB3 ASP 43 3HB ASP 43 9.513 -14.421 -1.107 279 H GLY 44 H GLY 44 9.143 -10.336 -2.828 280 HA2 GLY 44 2HA GLY 44 7.631 -8.909 -1.728 281 HA3 GLY 44 3HA GLY 44 7.539 -10.061 -0.405 282 H GLN 45 H GLN 45 10.705 -9.882 -0.907 283 HA GLN 45 HA GLN 45 11.164 -8.375 1.423 284 HB2 GLN 45 2HB GLN 45 13.074 -9.340 -0.678 285 HB3 GLN 45 3HB GLN 45 13.580 -8.536 0.800 286 HG2 GLN 45 2HG GLN 45 12.476 -10.310 2.100 287 HG3 GLN 45 3HG GLN 45 12.087 -11.133 0.589 288 HE21 GLN 45 1HE2 GLN 45 14.543 -10.278 2.831 289 HE22 GLN 45 2HE2 GLN 45 15.793 -11.253 2.162 290 H THR 46 H THR 46 11.436 -7.483 -1.971 291 HA THR 46 HA THR 46 11.824 -4.748 -1.034 292 HB THR 46 HB THR 46 13.958 -5.394 -1.954 293 HG1 THR 46 HG1 THR 46 13.502 -3.327 -2.536 294 HG21 THR 46 3HG2 THR 46 13.269 -7.301 -3.316 295 HG22 THR 46 1HG2 THR 46 14.224 -6.171 -4.273 296 HG23 THR 46 2HG2 THR 46 12.471 -6.218 -4.455 297 H LEU 47 H LEU 47 9.950 -3.739 -1.379 298 HA LEU 47 HA LEU 47 8.415 -4.356 -3.766 299 HB2 LEU 47 2HB LEU 47 7.813 -2.500 -1.457 300 HB3 LEU 47 3HB LEU 47 6.696 -2.979 -2.716 301 HG LEU 47 HG LEU 47 7.856 -4.805 -0.610 302 HD11 LEU 47 1HD1 LEU 47 6.252 -3.229 0.308 303 HD12 LEU 47 2HD1 LEU 47 5.579 -4.857 0.269 304 HD13 LEU 47 3HD1 LEU 47 5.085 -3.670 -0.938 305 HD21 LEU 47 3HD2 LEU 47 7.430 -5.968 -2.705 306 HD22 LEU 47 1HD2 LEU 47 5.787 -5.328 -2.737 307 HD23 LEU 47 2HD2 LEU 47 6.272 -6.450 -1.465 308 H ASN 48 H ASN 48 8.489 -3.060 -5.499 309 HA ASN 48 HA ASN 48 9.376 -0.308 -5.104 310 HB2 ASN 48 2HB ASN 48 10.772 -0.477 -7.196 311 HB3 ASN 48 3HB ASN 48 11.394 -1.374 -5.820 312 HD21 ASN 48 1HD2 ASN 48 12.571 -2.837 -6.967 313 HD22 ASN 48 2HD2 ASN 48 11.879 -4.025 -8.011 314 H GLY 49 H GLY 49 8.700 1.178 -6.691 315 HA2 GLY 49 2HA GLY 49 7.343 0.728 -9.010 316 HA3 GLY 49 3HA GLY 49 6.124 0.512 -7.765 317 H THR 50 H THR 50 4.896 2.248 -8.183 318 HA THR 50 HA THR 50 6.142 4.878 -7.814 319 HB THR 50 HB THR 50 3.968 4.211 -9.822 320 HG1 THR 50 HG1 THR 50 6.485 3.782 -10.061 321 HG21 THR 50 3HG2 THR 50 4.277 6.526 -10.576 322 HG22 THR 50 1HG2 THR 50 5.453 6.792 -9.289 323 HG23 THR 50 2HG2 THR 50 3.764 6.476 -8.889 324 H MET 51 H MET 51 5.124 6.129 -6.358 325 HA MET 51 HA MET 51 2.417 5.363 -5.505 326 HB2 MET 51 2HB MET 51 3.966 4.393 -3.902 327 HB3 MET 51 3HB MET 51 4.782 5.934 -3.709 328 HG2 MET 51 2HG MET 51 1.888 5.796 -3.073 329 HG3 MET 51 3HG MET 51 3.024 5.035 -1.962 330 HE1 MET 51 3HE MET 51 5.246 7.978 -0.814 331 HE2 MET 51 1HE MET 51 5.584 6.881 -2.151 332 HE3 MET 51 2HE MET 51 4.873 6.262 -0.660 333 H THR 52 H THR 52 1.123 7.083 -4.670 334 HA THR 52 HA THR 52 2.191 9.758 -5.297 335 HB THR 52 HB THR 52 -0.607 8.790 -5.901 336 HG1 THR 52 HG1 THR 52 1.679 8.419 -7.222 337 HG21 THR 52 3HG2 THR 52 0.832 11.341 -6.662 338 HG22 THR 52 1HG2 THR 52 -0.451 11.204 -5.458 339 HG23 THR 52 2HG2 THR 52 -0.800 10.887 -7.155 340 H TYR 53 H TYR 53 1.979 11.207 -3.726 341 HA TYR 53 HA TYR 53 0.388 10.629 -1.368 342 HB2 TYR 53 2HB TYR 53 2.429 12.743 -2.024 343 HB3 TYR 53 3HB TYR 53 1.410 12.871 -0.599 344 HD1 TYR 53 HD2 TYR 53 1.517 11.003 1.108 345 HD2 TYR 53 HD1 TYR 53 4.392 11.444 -1.989 346 HE1 TYR 53 HE2 TYR 53 3.090 9.616 2.386 347 HE2 TYR 53 HE1 TYR 53 5.979 10.058 -0.710 348 HH TYR 53 HH TYR 53 6.413 9.160 1.350 349 H ALA 54 H ALA 54 -0.937 12.367 -0.408 350 HA ALA 54 HA ALA 54 -2.937 13.224 -2.208 351 HB1 ALA 54 3HB ALA 54 -3.377 12.733 0.155 352 HB2 ALA 54 1HB ALA 54 -3.919 14.355 -0.280 353 HB3 ALA 54 2HB ALA 54 -2.421 14.136 0.623 354 H GLY 55 H GLY 55 -3.097 14.976 -3.418 355 HA2 GLY 55 2HA GLY 55 -2.869 17.159 -4.120 356 HA3 GLY 55 3HA GLY 55 -2.020 17.510 -2.622 357 H GLU 56 H GLU 56 -0.585 14.874 -4.041 358 HA GLU 56 HA GLU 56 1.417 16.594 -5.339 359 HB2 GLU 56 2HB GLU 56 1.847 14.114 -3.680 360 HB3 GLU 56 3HB GLU 56 3.106 14.905 -4.615 361 HG2 GLU 56 2HG GLU 56 1.575 16.095 -2.319 362 HG3 GLU 56 3HG GLU 56 3.241 15.519 -2.281 363 H GLY 57 H GLY 57 2.973 15.050 -6.650 364 HA2 GLY 57 2HA GLY 57 1.222 13.549 -8.461 365 HA3 GLY 57 3HA GLY 57 2.790 14.232 -8.879 366 HA PRO 58 HA PRO 58 3.123 9.662 -7.677 367 HB2 PRO 58 2HB PRO 58 4.016 8.763 -10.092 368 HB3 PRO 58 3HB PRO 58 2.310 8.794 -9.636 369 HG2 PRO 58 2HG PRO 58 3.860 10.738 -11.299 370 HG3 PRO 58 3HG PRO 58 2.235 10.079 -11.570 371 HD2 PRO 58 2HD PRO 58 2.638 12.541 -10.545 372 HD3 PRO 58 3HD PRO 58 1.263 11.527 -10.058 373 H ILE 59 H ILE 59 4.999 8.956 -6.864 374 HA ILE 59 HA ILE 59 7.524 9.929 -8.002 375 HB ILE 59 HB ILE 59 8.471 10.187 -5.740 376 HG12 ILE 59 2HG1 ILE 59 5.629 9.854 -4.751 377 HG13 ILE 59 3HG1 ILE 59 6.901 8.648 -4.586 378 HG21 ILE 59 1HG2 ILE 59 6.030 11.884 -6.235 379 HG22 ILE 59 2HG2 ILE 59 7.646 12.157 -6.887 380 HG23 ILE 59 3HG2 ILE 59 7.359 12.297 -5.152 381 HD11 ILE 59 3HD1 ILE 59 6.865 11.391 -3.355 382 HD12 ILE 59 1HD1 ILE 59 8.195 10.238 -3.231 383 HD13 ILE 59 2HD1 ILE 59 6.625 9.851 -2.529 384 H GLY 60 H GLY 60 9.411 8.647 -6.906 385 HA2 GLY 60 2HA GLY 60 8.894 5.884 -7.540 386 HA3 GLY 60 3HA GLY 60 10.434 6.571 -7.041 387 H PHE 61 H PHE 61 8.720 4.167 -6.200 388 HA PHE 61 HA PHE 61 8.887 4.691 -3.306 389 HB2 PHE 61 2HB PHE 61 6.537 4.600 -4.002 390 HB3 PHE 61 3HB PHE 61 6.809 3.039 -4.761 391 HD1 PHE 61 HD2 PHE 61 7.146 1.031 -3.383 392 HD2 PHE 61 HD1 PHE 61 6.272 4.808 -1.637 393 HE1 PHE 61 HE2 PHE 61 6.549 -0.086 -1.277 394 HE2 PHE 61 HE1 PHE 61 5.677 3.697 0.470 395 HZ PHE 61 HZ PHE 61 5.812 1.248 0.653 396 H ARG 62 H ARG 62 10.193 3.320 -2.226 397 HA ARG 62 HA ARG 62 10.458 0.580 -3.188 398 HB2 ARG 62 2HB ARG 62 12.384 1.654 -4.127 399 HB3 ARG 62 3HB ARG 62 12.734 2.479 -2.617 400 HG2 ARG 62 2HG ARG 62 13.275 0.343 -1.571 401 HG3 ARG 62 3HG ARG 62 12.913 -0.490 -3.086 402 HD2 ARG 62 2HD ARG 62 15.339 -0.086 -2.724 403 HD3 ARG 62 3HD ARG 62 14.709 0.639 -4.203 404 HE ARG 62 HE ARG 62 15.100 2.727 -3.339 405 HH11 ARG 62 1HH1 ARG 62 15.502 0.382 -0.762 406 HH12 ARG 62 2HH1 ARG 62 16.247 1.526 0.311 407 HH21 ARG 62 1HH2 ARG 62 16.149 4.183 -1.964 408 HH22 ARG 62 2HH2 ARG 62 16.632 3.685 -0.382 409 H ALA 63 H ALA 63 10.405 -0.867 -1.554 410 HA ALA 63 HA ALA 63 10.868 0.105 1.183 411 HB1 ALA 63 3HB ALA 63 8.911 -0.987 2.003 412 HB2 ALA 63 1HB ALA 63 8.586 -1.709 0.425 413 HB3 ALA 63 2HB ALA 63 8.430 0.032 0.648 414 H THR 64 H THR 64 11.874 -1.297 2.550 415 HA THR 64 HA THR 64 12.718 -3.885 1.407 416 HB THR 64 HB THR 64 14.140 -2.245 3.523 417 HG1 THR 64 HG1 THR 64 14.886 -1.110 1.915 418 HG21 THR 64 3HG2 THR 64 15.054 -4.590 1.843 419 HG22 THR 64 1HG2 THR 64 14.652 -4.648 3.559 420 HG23 THR 64 2HG2 THR 64 16.041 -3.711 3.011 421 H LEU 65 H LEU 65 12.066 -5.692 2.457 422 HA LEU 65 HA LEU 65 10.389 -5.533 4.735 423 HB2 LEU 65 2HB LEU 65 10.034 -7.208 3.054 424 HB3 LEU 65 3HB LEU 65 11.639 -7.863 3.307 425 HG LEU 65 HG LEU 65 10.938 -8.544 5.603 426 HD11 LEU 65 1HD1 LEU 65 8.202 -7.731 4.635 427 HD12 LEU 65 2HD1 LEU 65 9.119 -6.970 5.936 428 HD13 LEU 65 3HD1 LEU 65 8.547 -8.627 6.114 429 HD21 LEU 65 3HD2 LEU 65 10.951 -10.130 3.760 430 HD22 LEU 65 1HD2 LEU 65 9.314 -9.650 3.317 431 HD23 LEU 65 2HD2 LEU 65 9.610 -10.458 4.857 432 H LEU 66 H LEU 66 10.884 -5.503 6.787 433 HA LEU 66 HA LEU 66 13.548 -5.982 7.730 434 HB2 LEU 66 2HB LEU 66 10.990 -5.546 9.274 435 HB3 LEU 66 3HB LEU 66 12.592 -5.595 9.982 436 HG LEU 66 HG LEU 66 11.566 -3.527 8.036 437 HD11 LEU 66 1HD1 LEU 66 10.655 -3.298 10.283 438 HD12 LEU 66 2HD1 LEU 66 11.774 -1.991 9.905 439 HD13 LEU 66 3HD1 LEU 66 12.286 -3.316 10.951 440 HD21 LEU 66 3HD2 LEU 66 13.929 -3.950 7.649 441 HD22 LEU 66 1HD2 LEU 66 14.262 -3.770 9.372 442 HD23 LEU 66 2HD2 LEU 66 13.706 -2.388 8.430 443 H GLY 67 H GLY 67 10.676 -7.882 7.397 444 HA2 GLY 67 2HA GLY 67 11.105 -10.317 7.277 445 HA3 GLY 67 3HA GLY 67 12.069 -10.129 8.732 446 H ASN 68 H ASN 68 9.480 -8.159 9.080 447 HA ASN 68 HA ASN 68 7.762 -10.240 10.266 448 HB2 ASN 68 2HB ASN 68 7.481 -8.911 12.314 449 HB3 ASN 68 3HB ASN 68 9.167 -9.350 12.075 450 HD21 ASN 68 1HD2 ASN 68 8.037 -7.207 13.644 451 HD22 ASN 68 2HD2 ASN 68 8.700 -5.735 13.034 452 H ASN 69 H ASN 69 7.368 -8.893 7.839 453 HA ASN 69 HA ASN 69 5.773 -7.856 6.604 454 HB2 ASN 69 2HB ASN 69 4.230 -7.894 9.203 455 HB3 ASN 69 3HB ASN 69 3.566 -7.248 7.707 456 HD21 ASN 69 1HD2 ASN 69 2.549 -9.419 9.206 457 HD22 ASN 69 2HD2 ASN 69 2.613 -10.821 8.196 458 H SER 70 H SER 70 7.588 -6.408 8.769 459 HA SER 70 HA SER 70 6.489 -3.736 8.442 460 HB2 SER 70 2HB SER 70 7.412 -4.541 10.655 461 HB3 SER 70 3HB SER 70 9.000 -4.605 9.894 462 HG SER 70 HG SER 70 9.088 -2.468 9.846 463 H TYR 71 H TYR 71 7.198 -2.435 6.881 464 HA TYR 71 HA TYR 71 9.624 -3.254 5.434 465 HB2 TYR 71 2HB TYR 71 7.107 -1.957 4.385 466 HB3 TYR 71 3HB TYR 71 8.585 -2.139 3.453 467 HD1 TYR 71 HD1 TYR 71 5.739 -3.921 4.954 468 HD2 TYR 71 HD2 TYR 71 9.224 -4.263 2.544 469 HE1 TYR 71 HE1 TYR 71 5.002 -6.149 4.212 470 HE2 TYR 71 HE2 TYR 71 8.495 -6.480 1.796 471 HH TYR 71 HH TYR 71 5.548 -7.615 1.952 472 H GLU 72 H GLU 72 11.221 -1.843 5.360 473 HA GLU 72 HA GLU 72 10.848 0.826 6.393 474 HB2 GLU 72 2HB GLU 72 12.901 -0.447 6.891 475 HB3 GLU 72 3HB GLU 72 13.290 -0.501 5.176 476 HG2 GLU 72 2HG GLU 72 13.530 1.922 5.146 477 HG3 GLU 72 3HG GLU 72 13.091 1.997 6.851 478 H VAL 73 H VAL 73 10.152 2.410 5.169 479 HA VAL 73 HA VAL 73 10.146 2.014 2.271 480 HB VAL 73 HB VAL 73 8.379 3.647 4.080 481 HG11 VAL 73 1HG1 VAL 73 8.775 4.935 2.045 482 HG12 VAL 73 2HG1 VAL 73 7.127 4.313 2.090 483 HG13 VAL 73 3HG1 VAL 73 8.334 3.537 1.064 484 HG21 VAL 73 3HG2 VAL 73 7.923 1.260 3.998 485 HG22 VAL 73 1HG2 VAL 73 7.832 1.325 2.238 486 HG23 VAL 73 2HG2 VAL 73 6.633 2.173 3.217 487 H GLU 74 H GLU 74 11.052 3.305 0.900 488 HA GLU 74 HA GLU 74 12.118 5.892 1.751 489 HB2 GLU 74 2HB GLU 74 13.477 3.795 0.055 490 HB3 GLU 74 3HB GLU 74 14.037 5.455 0.206 491 HG2 GLU 74 2HG GLU 74 14.381 5.139 2.593 492 HG3 GLU 74 3HG GLU 74 13.788 3.485 2.469 493 H ASN 75 H ASN 75 12.074 7.499 0.102 494 HA ASN 75 HA ASN 75 10.362 6.790 -2.180 495 HB2 ASN 75 2HB ASN 75 10.197 9.261 -0.442 496 HB3 ASN 75 3HB ASN 75 9.321 9.050 -1.949 497 HD21 ASN 75 1HD2 ASN 75 8.829 6.189 -1.373 498 HD22 ASN 75 2HD2 ASN 75 7.585 6.175 -0.174 499 H GLN 76 H GLN 76 10.722 7.981 -4.072 500 HA GLN 76 HA GLN 76 13.228 9.525 -4.074 501 HB2 GLN 76 2HB GLN 76 13.487 7.310 -5.147 502 HB3 GLN 76 3HB GLN 76 12.205 7.724 -6.274 503 HG2 GLN 76 2HG GLN 76 13.563 9.567 -7.135 504 HG3 GLN 76 3HG GLN 76 14.852 9.130 -6.014 505 HE21 GLN 76 1HE2 GLN 76 16.322 8.697 -7.605 506 HE22 GLN 76 2HE2 GLN 76 16.208 7.318 -8.640 507 H TRP 77 H TRP 77 13.039 11.529 -4.761 508 HA TRP 77 HA TRP 77 11.042 12.230 -6.744 509 HB2 TRP 77 2HB TRP 77 10.283 14.204 -5.424 510 HB3 TRP 77 3HB TRP 77 9.835 12.677 -4.678 511 HD1 TRP 77 HD1 TRP 77 12.604 15.383 -4.287 512 HE1 TRP 77 HE1 TRP 77 13.208 15.556 -1.795 513 HE3 TRP 77 HE3 TRP 77 9.621 11.648 -2.470 514 HZ2 TRP 77 HZ2 TRP 77 12.508 14.284 0.623 515 HZ3 TRP 77 HZ3 TRP 77 9.644 11.200 -0.051 516 HH2 TRP 77 HH2 TRP 77 11.057 12.489 1.458 517 H GLY 78 H GLY 78 11.431 14.453 -7.572 518 HA2 GLY 78 2HA GLY 78 12.889 16.321 -7.858 519 HA3 GLY 78 3HA GLY 78 14.179 15.385 -7.122 520 H GLY 79 H GLY 79 13.086 13.119 -8.984 521 HA2 GLY 79 2HA GLY 79 13.090 13.120 -11.500 522 HA3 GLY 79 3HA GLY 79 14.568 14.061 -11.353 523 H ASP 80 H ASP 80 14.800 11.904 -12.837 524 HA ASP 80 HA ASP 80 15.354 9.476 -11.565 525 HB2 ASP 80 2HB ASP 80 16.595 8.933 -13.663 526 HB3 ASP 80 3HB ASP 80 14.971 9.555 -13.939 527 H SER 81 H SER 81 17.417 12.266 -12.180 528 HA SER 81 HA SER 81 19.798 10.912 -11.353 529 HB2 SER 81 2HB SER 81 20.836 13.160 -11.494 530 HB3 SER 81 3HB SER 81 19.952 12.717 -12.952 531 HG SER 81 HG SER 81 18.782 14.420 -12.661 532 H ALA 82 H ALA 82 17.215 12.045 -9.615 533 HA ALA 82 HA ALA 82 18.712 13.025 -7.342 534 HB1 ALA 82 3HB ALA 82 16.519 13.328 -6.304 535 HB2 ALA 82 1HB ALA 82 15.760 12.510 -7.671 536 HB3 ALA 82 2HB ALA 82 16.577 14.055 -7.910 537 HA PRO 83 HA PRO 83 18.992 9.067 -5.383 538 HB2 PRO 83 2HB PRO 83 19.611 9.808 -2.894 539 HB3 PRO 83 3HB PRO 83 20.718 10.103 -4.241 540 HG2 PRO 83 2HG PRO 83 18.822 11.998 -2.905 541 HG3 PRO 83 3HG PRO 83 20.503 12.266 -3.402 542 HD2 PRO 83 2HD PRO 83 18.327 13.071 -4.866 543 HD3 PRO 83 3HD PRO 83 19.916 12.709 -5.570 544 H TRP 84 H TRP 84 18.314 8.118 -3.088 545 HA TRP 84 HA TRP 84 15.419 8.432 -2.939 546 HB2 TRP 84 2HB TRP 84 17.287 6.319 -1.845 547 HB3 TRP 84 3HB TRP 84 15.555 6.347 -1.551 548 HD1 TRP 84 HD1 TRP 84 18.104 5.686 -4.329 549 HE1 TRP 84 HE1 TRP 84 16.936 4.392 -6.220 550 HE3 TRP 84 HE3 TRP 84 13.298 5.925 -2.619 551 HZ2 TRP 84 HZ2 TRP 84 14.322 3.582 -6.900 552 HZ3 TRP 84 HZ3 TRP 84 11.521 4.864 -3.948 553 HH2 TRP 84 HH2 TRP 84 12.024 3.717 -6.044 554 H HIS 85 H HIS 85 14.356 8.913 -1.024 555 HA HIS 85 HA HIS 85 16.059 9.791 1.213 556 HB2 HIS 85 2HB HIS 85 13.530 11.116 0.184 557 HB3 HIS 85 3HB HIS 85 14.410 11.598 1.626 558 HD1 HIS 85 HD1 HIS 85 16.606 12.933 1.285 559 HD2 HIS 85 HD2 HIS 85 14.676 11.906 -2.251 560 HE1 HIS 85 HE1 HIS 85 17.735 14.276 -0.513 561 H SER 86 H SER 86 15.293 9.264 3.254 562 HA SER 86 HA SER 86 13.661 6.992 3.457 563 HB2 SER 86 2HB SER 86 13.708 7.499 5.942 564 HB3 SER 86 3HB SER 86 15.284 7.374 5.165 565 HG SER 86 HG SER 86 15.567 9.514 5.327 566 H GLY 87 H GLY 87 11.524 6.674 3.763 567 HA2 GLY 87 2HA GLY 87 9.845 9.085 3.917 568 HA3 GLY 87 3HA GLY 87 9.344 7.536 3.250 569 H GLY 88 H GLY 88 10.112 5.775 5.182 570 HA2 GLY 88 2HA GLY 88 9.816 6.215 7.824 571 HA3 GLY 88 3HA GLY 88 8.157 6.329 7.249 572 H ASN 89 H ASN 89 8.114 4.427 8.846 573 HA ASN 89 HA ASN 89 8.811 1.956 7.403 574 HB2 ASN 89 2HB ASN 89 9.835 2.223 9.657 575 HB3 ASN 89 3HB ASN 89 8.217 2.294 10.347 576 HD21 ASN 89 1HD2 ASN 89 6.982 0.453 10.438 577 HD22 ASN 89 2HD2 ASN 89 7.651 -1.125 10.194 578 H TRP 90 H TRP 90 7.159 0.941 6.455 579 HA TRP 90 HA TRP 90 4.435 1.495 7.427 580 HB2 TRP 90 2HB TRP 90 5.386 0.569 4.701 581 HB3 TRP 90 3HB TRP 90 3.703 0.774 5.157 582 HD1 TRP 90 HD1 TRP 90 5.853 3.555 6.463 583 HE1 TRP 90 HE1 TRP 90 5.553 5.661 5.010 584 HE3 TRP 90 HE3 TRP 90 3.277 1.492 2.564 585 HZ2 TRP 90 HZ2 TRP 90 4.377 6.357 2.545 586 HZ3 TRP 90 HZ3 TRP 90 2.604 2.947 0.697 587 HH2 TRP 90 HH2 TRP 90 3.143 5.325 0.690 588 H ILE 91 H ILE 91 2.965 -0.236 7.612 589 HA ILE 91 HA ILE 91 4.246 -2.885 7.880 590 HB ILE 91 HB ILE 91 1.669 -1.897 9.145 591 HG12 ILE 91 2HG1 ILE 91 3.624 -0.795 10.140 592 HG13 ILE 91 3HG1 ILE 91 2.894 -1.923 11.277 593 HG21 ILE 91 1HG2 ILE 91 1.760 -3.965 10.469 594 HG22 ILE 91 2HG2 ILE 91 3.170 -4.482 9.545 595 HG23 ILE 91 3HG2 ILE 91 1.615 -4.288 8.740 596 HD11 ILE 91 3HD1 ILE 91 5.298 -2.051 11.385 597 HD12 ILE 91 1HD1 ILE 91 5.387 -2.375 9.655 598 HD13 ILE 91 2HD1 ILE 91 4.650 -3.557 10.734 599 H LEU 92 H LEU 92 3.828 -4.212 6.199 600 HA LEU 92 HA LEU 92 1.176 -4.044 4.939 601 HB2 LEU 92 2HB LEU 92 3.802 -4.433 3.503 602 HB3 LEU 92 3HB LEU 92 2.220 -4.499 2.754 603 HG LEU 92 HG LEU 92 3.445 -2.051 4.037 604 HD11 LEU 92 1HD1 LEU 92 3.608 -1.199 1.760 605 HD12 LEU 92 2HD1 LEU 92 3.011 -2.738 1.138 606 HD13 LEU 92 3HD1 LEU 92 4.564 -2.666 1.968 607 HD21 LEU 92 3HD2 LEU 92 0.869 -2.399 2.504 608 HD22 LEU 92 1HD2 LEU 92 1.547 -0.861 3.038 609 HD23 LEU 92 2HD2 LEU 92 1.021 -2.050 4.226 610 H GLY 93 H GLY 93 0.622 -5.779 6.337 611 HA2 GLY 93 2HA GLY 93 0.516 -8.245 5.136 612 HA3 GLY 93 3HA GLY 93 1.917 -8.308 6.198 613 H SER 94 H SER 94 -1.494 -8.358 5.983 614 HA SER 94 HA SER 94 -1.881 -8.148 8.857 615 HB2 SER 94 2HB SER 94 -4.271 -8.565 8.324 616 HB3 SER 94 3HB SER 94 -3.605 -7.209 7.417 617 HG SER 94 HG SER 94 -4.783 -9.392 6.494 618 H ARG 95 H ARG 95 -0.896 -10.470 6.747 619 HA ARG 95 HA ARG 95 -2.003 -12.666 8.327 620 HB2 ARG 95 2HB ARG 95 -0.706 -12.650 5.594 621 HB3 ARG 95 3HB ARG 95 -1.271 -14.098 6.428 622 HG2 ARG 95 2HG ARG 95 -3.544 -13.263 6.407 623 HG3 ARG 95 3HG ARG 95 -3.010 -11.761 5.658 624 HD2 ARG 95 2HD ARG 95 -2.239 -13.063 3.704 625 HD3 ARG 95 3HD ARG 95 -2.889 -14.523 4.453 626 HE ARG 95 HE ARG 95 -4.960 -12.697 4.392 627 HH11 ARG 95 1HH1 ARG 95 -2.957 -14.392 2.063 628 HH12 ARG 95 2HH1 ARG 95 -4.140 -14.275 0.793 629 HH21 ARG 95 1HH2 ARG 95 -6.522 -12.575 2.659 630 HH22 ARG 95 2HH2 ARG 95 -6.115 -13.274 1.128 631 H GLU 96 H GLU 96 -0.583 -14.272 9.105 632 HA GLU 96 HA GLU 96 1.893 -13.016 10.006 633 HB2 GLU 96 2HB GLU 96 1.899 -14.780 11.729 634 HB3 GLU 96 3HB GLU 96 0.431 -13.816 11.732 635 HG2 GLU 96 2HG GLU 96 -0.671 -15.623 10.418 636 HG3 GLU 96 3HG GLU 96 0.782 -16.597 10.651 637 H ASN 97 H ASN 97 0.860 -15.484 7.893 638 HA ASN 97 HA ASN 97 3.609 -16.515 7.728 639 HB2 ASN 97 2HB ASN 97 2.667 -18.621 6.905 640 HB3 ASN 97 3HB ASN 97 2.035 -18.231 8.499 641 HD21 ASN 97 1HD2 ASN 97 0.962 -19.970 6.425 642 HD22 ASN 97 2HD2 ASN 97 -0.618 -19.374 6.067 643 H GLN 98 H GLN 98 2.039 -14.271 6.310 644 HA GLN 98 HA GLN 98 3.019 -14.874 3.670 645 HB2 GLN 98 2HB GLN 98 0.739 -15.923 3.826 646 HB3 GLN 98 3HB GLN 98 0.081 -14.312 4.052 647 HG2 GLN 98 2HG GLN 98 0.859 -13.665 1.858 648 HG3 GLN 98 3HG GLN 98 1.598 -15.253 1.634 649 HE21 GLN 98 1HE2 GLN 98 0.346 -15.791 -0.127 650 HE22 GLN 98 2HE2 GLN 98 -1.348 -16.132 0.006 651 H ASN 99 H ASN 99 3.875 -13.070 2.903 652 HA ASN 99 HA ASN 99 3.257 -10.520 4.213 653 HB2 ASN 99 2HB ASN 99 5.583 -11.257 2.417 654 HB3 ASN 99 3HB ASN 99 5.395 -9.745 3.290 655 HD21 ASN 99 1HD2 ASN 99 7.236 -9.943 4.452 656 HD22 ASN 99 2HD2 ASN 99 7.478 -11.132 5.686 657 H VAL 100 H VAL 100 3.289 -8.529 2.848 658 HA VAL 100 HA VAL 100 1.595 -8.918 0.522 659 HB VAL 100 HB VAL 100 2.691 -6.399 1.789 660 HG11 VAL 100 1HG1 VAL 100 1.289 -5.132 0.246 661 HG12 VAL 100 2HG1 VAL 100 0.821 -6.623 -0.574 662 HG13 VAL 100 3HG1 VAL 100 2.494 -6.066 -0.641 663 HG21 VAL 100 3HG2 VAL 100 -0.085 -7.556 1.574 664 HG22 VAL 100 1HG2 VAL 100 0.330 -6.020 2.335 665 HG23 VAL 100 2HG2 VAL 100 0.927 -7.532 3.018 666 H VAL 101 H VAL 101 2.096 -8.774 -1.551 667 HA VAL 101 HA VAL 101 4.933 -8.262 -2.227 668 HB VAL 101 HB VAL 101 4.836 -9.834 -4.110 669 HG11 VAL 101 1HG1 VAL 101 4.118 -11.041 -1.451 670 HG12 VAL 101 2HG1 VAL 101 5.729 -10.557 -1.984 671 HG13 VAL 101 3HG1 VAL 101 4.894 -11.887 -2.789 672 HG21 VAL 101 3HG2 VAL 101 2.445 -9.795 -4.564 673 HG22 VAL 101 1HG2 VAL 101 2.126 -10.587 -3.021 674 HG23 VAL 101 2HG2 VAL 101 3.002 -11.445 -4.288 675 H ALA 102 H ALA 102 1.621 -7.773 -3.360 676 HA ALA 102 HA ALA 102 2.696 -5.598 -4.996 677 HB1 ALA 102 3HB ALA 102 2.408 -7.640 -6.454 678 HB2 ALA 102 1HB ALA 102 1.557 -6.190 -6.983 679 HB3 ALA 102 2HB ALA 102 0.673 -7.479 -6.183 680 H ILE 103 H ILE 103 1.437 -3.820 -5.123 681 HA ILE 103 HA ILE 103 -1.267 -3.994 -3.988 682 HB ILE 103 HB ILE 103 0.820 -1.918 -3.288 683 HG12 ILE 103 2HG1 ILE 103 0.993 -4.031 -2.019 684 HG13 ILE 103 3HG1 ILE 103 0.530 -2.680 -0.990 685 HG21 ILE 103 1HG2 ILE 103 -2.094 -1.984 -2.529 686 HG22 ILE 103 2HG2 ILE 103 -1.320 -0.834 -3.620 687 HG23 ILE 103 3HG2 ILE 103 -0.894 -0.849 -1.908 688 HD11 ILE 103 3HD1 ILE 103 -1.304 -4.809 -2.073 689 HD12 ILE 103 1HD1 ILE 103 -1.806 -3.434 -1.090 690 HD13 ILE 103 2HD1 ILE 103 -0.734 -4.656 -0.413 691 H ASN 104 H ASN 104 -2.711 -3.224 -5.333 692 HA ASN 104 HA ASN 104 -2.009 -0.933 -7.047 693 HB2 ASN 104 2HB ASN 104 -2.377 -2.964 -8.395 694 HB3 ASN 104 3HB ASN 104 -3.958 -3.177 -7.653 695 HD21 ASN 104 1HD2 ASN 104 -5.046 -3.038 -9.585 696 HD22 ASN 104 2HD2 ASN 104 -5.209 -1.564 -10.472 697 H VAL 105 H VAL 105 -2.792 0.658 -5.861 698 HA VAL 105 HA VAL 105 -5.659 0.614 -5.241 699 HB VAL 105 HB VAL 105 -5.367 1.611 -2.996 700 HG11 VAL 105 1HG1 VAL 105 -5.834 -0.752 -3.213 701 HG12 VAL 105 2HG1 VAL 105 -4.747 -0.466 -1.854 702 HG13 VAL 105 3HG1 VAL 105 -4.113 -1.100 -3.371 703 HG21 VAL 105 3HG2 VAL 105 -2.477 0.867 -3.374 704 HG22 VAL 105 1HG2 VAL 105 -3.200 1.425 -1.868 705 HG23 VAL 105 2HG2 VAL 105 -3.115 2.506 -3.259 706 H GLU 106 H GLU 106 -6.727 2.427 -5.433 707 HA GLU 106 HA GLU 106 -5.268 4.949 -5.668 708 HB2 GLU 106 2HB GLU 106 -5.666 4.043 -7.956 709 HB3 GLU 106 3HB GLU 106 -7.388 4.000 -7.609 710 HG2 GLU 106 2HG GLU 106 -7.360 6.444 -7.304 711 HG3 GLU 106 3HG GLU 106 -5.652 6.454 -7.739 712 H SER 107 H SER 107 -6.367 6.604 -4.727 713 HA SER 107 HA SER 107 -9.050 5.953 -3.706 714 HB2 SER 107 2HB SER 107 -7.384 6.048 -1.903 715 HB3 SER 107 3HB SER 107 -6.931 7.678 -2.400 716 HG SER 107 HG SER 107 -8.973 6.858 -0.835 717 H GLY 108 H GLY 108 -10.633 7.256 -4.305 718 HA2 GLY 108 2HA GLY 108 -10.019 9.675 -5.783 719 HA3 GLY 108 3HA GLY 108 -11.620 8.980 -5.531 720 H ASP 109 H ASP 109 -10.419 8.811 -2.611 721 HA ASP 109 HA ASP 109 -11.618 11.313 -1.765 722 HB2 ASP 109 2HB ASP 109 -12.191 9.013 -0.778 723 HB3 ASP 109 3HB ASP 109 -10.612 9.070 -0.003 724 H ASP 110 H ASP 110 -10.263 11.601 0.681 725 HA ASP 110 HA ASP 110 -7.774 12.811 -0.261 726 HB2 ASP 110 2HB ASP 110 -9.334 13.198 2.300 727 HB3 ASP 110 3HB ASP 110 -7.873 14.077 1.863 728 H GLY 111 H GLY 111 -8.262 9.910 0.456 729 HA2 GLY 111 2HA GLY 111 -6.498 8.443 1.106 730 HA3 GLY 111 3HA GLY 111 -5.929 9.681 2.212 731 H GLN 112 H GLN 112 -9.213 9.599 2.538 732 HA GLN 112 HA GLN 112 -9.114 8.457 5.113 733 HB2 GLN 112 2HB GLN 112 -10.834 10.089 4.405 734 HB3 GLN 112 3HB GLN 112 -11.533 8.870 3.349 735 HG2 GLN 112 2HG GLN 112 -11.985 7.466 5.326 736 HG3 GLN 112 3HG GLN 112 -11.369 8.761 6.351 737 HE21 GLN 112 1HE2 GLN 112 -12.569 10.644 6.583 738 HE22 GLN 112 2HE2 GLN 112 -14.240 10.721 6.144 739 H THR 113 H THR 113 -10.171 7.153 1.983 740 HA THR 113 HA THR 113 -9.898 4.492 3.152 741 HB THR 113 HB THR 113 -11.767 3.821 1.502 742 HG1 THR 113 HG1 THR 113 -13.042 6.192 1.777 743 HG21 THR 113 3HG2 THR 113 -12.075 3.760 3.916 744 HG22 THR 113 1HG2 THR 113 -13.529 4.386 3.140 745 HG23 THR 113 2HG2 THR 113 -12.410 5.491 3.938 746 H LEU 114 H LEU 114 -9.111 2.916 1.758 747 HA LEU 114 HA LEU 114 -7.963 3.930 -0.759 748 HB2 LEU 114 2HB LEU 114 -6.932 1.736 1.047 749 HB3 LEU 114 3HB LEU 114 -6.210 2.214 -0.475 750 HG LEU 114 HG LEU 114 -6.402 3.953 1.987 751 HD11 LEU 114 1HD1 LEU 114 -4.050 2.521 0.764 752 HD12 LEU 114 2HD1 LEU 114 -4.839 2.119 2.288 753 HD13 LEU 114 3HD1 LEU 114 -3.980 3.648 2.117 754 HD21 LEU 114 3HD2 LEU 114 -5.054 4.419 -0.674 755 HD22 LEU 114 1HD2 LEU 114 -4.889 5.451 0.748 756 HD23 LEU 114 2HD2 LEU 114 -6.456 5.283 -0.041 757 H ASN 115 H ASN 115 -8.652 2.982 -2.558 758 HA ASN 115 HA ASN 115 -10.127 0.449 -2.297 759 HB2 ASN 115 2HB ASN 115 -10.640 2.765 -4.172 760 HB3 ASN 115 3HB ASN 115 -11.486 1.223 -4.232 761 HD21 ASN 115 1HD2 ASN 115 -12.948 0.723 -2.633 762 HD22 ASN 115 2HD2 ASN 115 -13.594 1.907 -1.553 763 H GLY 116 H GLY 116 -9.586 -1.206 -3.649 764 HA2 GLY 116 2HA GLY 116 -8.757 -1.054 -6.236 765 HA3 GLY 116 3HA GLY 116 -7.275 -0.841 -5.323 766 H THR 117 H THR 117 -6.249 -2.630 -5.692 767 HA THR 117 HA THR 117 -7.405 -5.135 -4.776 768 HB THR 117 HB THR 117 -6.379 -6.342 -6.757 769 HG1 THR 117 HG1 THR 117 -6.244 -4.941 -8.678 770 HG21 THR 117 3HG2 THR 117 -8.662 -4.447 -7.339 771 HG22 THR 117 1HG2 THR 117 -8.797 -6.027 -6.570 772 HG23 THR 117 2HG2 THR 117 -8.285 -5.908 -8.251 773 H MET 118 H MET 118 -5.725 -6.800 -4.451 774 HA MET 118 HA MET 118 -3.032 -5.738 -4.143 775 HB2 MET 118 2HB MET 118 -2.880 -6.328 -1.802 776 HB3 MET 118 3HB MET 118 -4.141 -5.132 -2.053 777 HG2 MET 118 2HG MET 118 -5.853 -6.731 -1.757 778 HG3 MET 118 3HG MET 118 -4.714 -8.072 -1.867 779 HE1 MET 118 3HE MET 118 -2.288 -7.014 -0.106 780 HE2 MET 118 1HE MET 118 -2.945 -8.650 -0.107 781 HE3 MET 118 2HE MET 118 -2.715 -7.796 1.415 782 H THR 119 H THR 119 -1.482 -7.409 -3.484 783 HA THR 119 HA THR 119 -2.423 -10.139 -3.991 784 HB THR 119 HB THR 119 0.079 -8.969 -5.220 785 HG1 THR 119 HG1 THR 119 -2.539 -8.953 -6.026 786 HG21 THR 119 3HG2 THR 119 -1.339 -11.597 -5.676 787 HG22 THR 119 1HG2 THR 119 0.181 -11.382 -4.809 788 HG23 THR 119 2HG2 THR 119 0.095 -11.036 -6.536 789 H TYR 120 H TYR 120 -1.736 -11.502 -2.446 790 HA TYR 120 HA TYR 120 0.510 -10.768 -0.730 791 HB2 TYR 120 2HB TYR 120 -1.797 -12.628 -0.504 792 HB3 TYR 120 3HB TYR 120 -0.312 -13.119 0.295 793 HD1 TYR 120 HD2 TYR 120 0.760 -11.342 1.858 794 HD2 TYR 120 HD1 TYR 120 -3.304 -11.252 0.628 795 HE1 TYR 120 HE2 TYR 120 0.223 -9.937 3.789 796 HE2 TYR 120 HE1 TYR 120 -3.857 -9.838 2.570 797 HH TYR 120 HH TYR 120 -3.013 -9.236 4.731 798 H ALA 121 H ALA 121 2.100 -12.484 -0.186 799 HA ALA 121 HA ALA 121 3.402 -13.446 -2.466 800 HB1 ALA 121 3HB ALA 121 4.859 -14.660 -0.936 801 HB2 ALA 121 1HB ALA 121 3.702 -14.427 0.374 802 HB3 ALA 121 2HB ALA 121 4.533 -13.038 -0.326 803 H GLY 122 H GLY 122 2.921 -15.071 -3.776 804 HA2 GLY 122 2HA GLY 122 2.278 -17.168 -4.491 805 HA3 GLY 122 3HA GLY 122 2.168 -17.650 -2.807 806 H GLU 123 H GLU 123 0.370 -14.892 -3.891 807 HA GLU 123 HA GLU 123 -2.087 -16.504 -3.993 808 HB2 GLU 123 2HB GLU 123 -1.851 -15.377 -1.787 809 HB3 GLU 123 3HB GLU 123 -1.755 -13.830 -2.611 810 HG2 GLU 123 2HG GLU 123 -4.033 -14.177 -3.478 811 HG3 GLU 123 3HG GLU 123 -4.119 -15.695 -2.586 812 H GLY 124 H GLY 124 -3.828 -15.467 -5.193 813 HA2 GLY 124 2HA GLY 124 -2.808 -13.890 -7.416 814 HA3 GLY 124 3HA GLY 124 -4.403 -14.632 -7.308 815 HA PRO 125 HA PRO 125 -4.287 -9.927 -6.208 816 HB2 PRO 125 2HB PRO 125 -5.951 -9.764 -8.662 817 HB3 PRO 125 3HB PRO 125 -4.670 -8.686 -8.103 818 HG2 PRO 125 2HG PRO 125 -4.256 -10.355 -10.139 819 HG3 PRO 125 3HG PRO 125 -2.983 -10.032 -8.948 820 HD2 PRO 125 2HD PRO 125 -4.766 -12.416 -9.216 821 HD3 PRO 125 3HD PRO 125 -3.047 -12.335 -8.779 822 H ILE 126 H ILE 126 -5.808 -9.353 -4.810 823 HA ILE 126 HA ILE 126 -8.565 -10.314 -5.187 824 HB ILE 126 HB ILE 126 -8.791 -10.544 -2.741 825 HG12 ILE 126 2HG1 ILE 126 -5.795 -10.111 -2.648 826 HG13 ILE 126 3HG1 ILE 126 -6.992 -8.933 -2.126 827 HG21 ILE 126 1HG2 ILE 126 -6.544 -12.177 -3.917 828 HG22 ILE 126 2HG2 ILE 126 -8.269 -12.519 -4.048 829 HG23 ILE 126 3HG2 ILE 126 -7.472 -12.605 -2.478 830 HD11 ILE 126 3HD1 ILE 126 -6.029 -10.125 -0.240 831 HD12 ILE 126 1HD1 ILE 126 -6.559 -11.660 -0.925 832 HD13 ILE 126 2HD1 ILE 126 -7.750 -10.475 -0.393 833 H GLY 127 H GLY 127 -10.168 -8.983 -3.915 834 HA2 GLY 127 2HA GLY 127 -9.768 -6.232 -4.573 835 HA3 GLY 127 3HA GLY 127 -11.162 -6.915 -3.750 836 H PHE 128 H PHE 128 -9.202 -4.553 -3.354 837 HA PHE 128 HA PHE 128 -8.654 -5.067 -0.506 838 HB2 PHE 128 2HB PHE 128 -6.568 -4.836 -1.749 839 HB3 PHE 128 3HB PHE 128 -7.110 -3.305 -2.420 840 HD1 PHE 128 HD1 PHE 128 -6.067 -5.007 0.682 841 HD2 PHE 128 HD2 PHE 128 -6.885 -1.282 -1.201 842 HE1 PHE 128 HE1 PHE 128 -5.071 -3.824 2.592 843 HE2 PHE 128 HE2 PHE 128 -5.886 -0.093 0.706 844 HZ PHE 128 HZ PHE 128 -4.979 -1.365 2.607 845 H LYS 129 H LYS 129 -9.453 -3.719 0.951 846 HA LYS 129 HA LYS 129 -10.472 -1.109 0.144 847 HB2 LYS 129 2HB LYS 129 -12.380 -2.627 0.158 848 HB3 LYS 129 3HB LYS 129 -11.927 -3.223 1.744 849 HG2 LYS 129 2HG LYS 129 -12.358 -0.986 2.674 850 HG3 LYS 129 3HG LYS 129 -12.891 -0.452 1.076 851 HD2 LYS 129 2HD LYS 129 -14.645 -2.138 1.082 852 HD3 LYS 129 3HD LYS 129 -14.099 -2.718 2.655 853 HE2 LYS 129 2HE LYS 129 -14.507 -0.337 3.471 854 HE3 LYS 129 3HE LYS 129 -15.398 -0.105 1.966 855 HZ1 LYS 129 3HZ LYS 129 -16.824 -0.765 3.818 856 HZ2 LYS 129 1HZ LYS 129 -15.951 -2.207 3.981 857 HZ3 LYS 129 2HZ LYS 129 -16.855 -1.910 2.574 858 H GLY 130 H GLY 130 -9.223 0.217 1.353 859 HA2 GLY 130 2HA GLY 130 -8.604 -0.629 4.117 860 HA3 GLY 130 3HA GLY 130 -7.586 0.434 3.154 861 H THR 131 H THR 131 -8.976 0.761 5.821 862 HA THR 131 HA THR 131 -10.229 3.327 5.140 863 HB THR 131 HB THR 131 -11.171 1.451 7.328 864 HG1 THR 131 HG1 THR 131 -11.737 1.572 4.681 865 HG21 THR 131 3HG2 THR 131 -11.517 3.820 7.862 866 HG22 THR 131 1HG2 THR 131 -13.055 3.031 7.514 867 HG23 THR 131 2HG2 THR 131 -12.302 4.068 6.302 868 H LEU 132 H LEU 132 -9.415 5.017 6.232 869 HA LEU 132 HA LEU 132 -7.137 4.750 7.880 870 HB2 LEU 132 2HB LEU 132 -7.535 6.702 6.471 871 HB3 LEU 132 3HB LEU 132 -8.967 7.106 7.395 872 HG LEU 132 HG LEU 132 -7.539 7.535 9.371 873 HD11 LEU 132 1HD1 LEU 132 -5.678 6.079 8.840 874 HD12 LEU 132 2HD1 LEU 132 -5.121 7.737 9.071 875 HD13 LEU 132 3HD1 LEU 132 -5.273 7.077 7.443 876 HD21 LEU 132 3HD2 LEU 132 -6.583 9.634 8.552 877 HD22 LEU 132 1HD2 LEU 132 -8.204 9.365 7.910 878 HD23 LEU 132 2HD2 LEU 132 -6.793 9.081 6.890 879 H THR 133 H THR 133 -6.883 4.921 10.083 880 HA THR 133 HA THR 133 -9.301 4.561 11.653 881 HB THR 133 HB THR 133 -6.423 4.360 12.579 882 HG1 THR 133 HG1 THR 133 -6.631 2.812 11.043 883 HG21 THR 133 3HG2 THR 133 -8.995 3.223 13.698 884 HG22 THR 133 1HG2 THR 133 -8.117 4.601 14.358 885 HG23 THR 133 2HG2 THR 133 -7.382 2.999 14.375 Start of MODEL 2 1 H1 ALA 2 1H ALA 2 0.942 6.385 10.841 2 H2 ALA 2 2H ALA 2 0.699 7.710 9.827 3 H3 ALA 2 3H ALA 2 0.846 6.159 9.169 4 HA ALA 2 HA ALA 2 -1.344 7.152 10.893 5 HB1 ALA 2 3HB ALA 2 -1.433 7.976 8.585 6 HB2 ALA 2 1HB ALA 2 -2.749 6.852 8.918 7 HB3 ALA 2 2HB ALA 2 -1.347 6.321 7.990 8 H LEU 3 H LEU 3 -3.251 5.359 10.040 9 HA LEU 3 HA LEU 3 -2.248 2.684 10.383 10 HB2 LEU 3 2HB LEU 3 -2.504 3.850 12.719 11 HB3 LEU 3 3HB LEU 3 -4.218 3.659 12.448 12 HG LEU 3 HG LEU 3 -3.328 1.900 13.899 13 HD11 LEU 3 1HD1 LEU 3 -5.240 1.326 12.556 14 HD12 LEU 3 2HD1 LEU 3 -4.169 -0.067 12.720 15 HD13 LEU 3 3HD1 LEU 3 -4.194 0.851 11.216 16 HD21 LEU 3 3HD2 LEU 3 -1.054 1.823 13.041 17 HD22 LEU 3 1HD2 LEU 3 -1.629 1.104 11.537 18 HD23 LEU 3 2HD2 LEU 3 -1.777 0.215 13.052 19 H TYR 4 H TYR 4 -3.551 1.368 9.198 20 HA TYR 4 HA TYR 4 -6.246 2.373 8.579 21 HB2 TYR 4 2HB TYR 4 -4.207 1.150 6.749 22 HB3 TYR 4 3HB TYR 4 -5.920 1.153 6.355 23 HD1 TYR 4 HD1 TYR 4 -3.002 3.347 7.014 24 HD2 TYR 4 HD2 TYR 4 -6.978 3.079 5.536 25 HE1 TYR 4 HE1 TYR 4 -2.803 5.613 6.076 26 HE2 TYR 4 HE2 TYR 4 -6.792 5.334 4.599 27 HH TYR 4 HH TYR 4 -5.572 7.274 4.759 28 H ASN 5 H ASN 5 -7.881 0.962 8.335 29 HA ASN 5 HA ASN 5 -7.473 -1.756 9.367 30 HB2 ASN 5 2HB ASN 5 -9.258 -0.362 10.427 31 HB3 ASN 5 3HB ASN 5 -10.038 -0.204 8.857 32 HD21 ASN 5 1HD2 ASN 5 -9.362 -2.306 11.532 33 HD22 ASN 5 2HD2 ASN 5 -10.480 -3.549 11.090 34 H VAL 6 H VAL 6 -7.675 -3.474 7.961 35 HA VAL 6 HA VAL 6 -8.326 -2.692 5.203 36 HB VAL 6 HB VAL 6 -6.206 -4.605 6.181 37 HG11 VAL 6 1HG1 VAL 6 -5.697 -5.071 3.833 38 HG12 VAL 6 2HG1 VAL 6 -7.093 -4.112 3.338 39 HG13 VAL 6 3HG1 VAL 6 -7.326 -5.604 4.248 40 HG21 VAL 6 3HG2 VAL 6 -4.707 -3.111 4.928 41 HG22 VAL 6 1HG2 VAL 6 -5.571 -2.263 6.212 42 HG23 VAL 6 2HG2 VAL 6 -6.084 -2.081 4.533 43 H GLU 7 H GLU 7 -9.837 -3.717 4.204 44 HA GLU 7 HA GLU 7 -10.789 -6.299 5.228 45 HB2 GLU 7 2HB GLU 7 -12.288 -4.162 3.688 46 HB3 GLU 7 3HB GLU 7 -12.954 -5.706 4.204 47 HG2 GLU 7 2HG GLU 7 -12.727 -5.095 6.515 48 HG3 GLU 7 3HG GLU 7 -11.910 -3.595 6.072 49 H ASN 8 H ASN 8 -11.033 -7.958 3.760 50 HA ASN 8 HA ASN 8 -9.809 -7.474 1.110 51 HB2 ASN 8 2HB ASN 8 -9.751 -9.998 2.774 52 HB3 ASN 8 3HB ASN 8 -9.050 -9.826 1.174 53 HD21 ASN 8 1HD2 ASN 8 -8.201 -7.024 1.995 54 HD22 ASN 8 2HD2 ASN 8 -6.781 -7.287 2.940 55 H GLN 9 H GLN 9 -10.824 -8.263 -0.690 56 HA GLN 9 HA GLN 9 -13.260 -9.869 -0.269 57 HB2 GLN 9 2HB GLN 9 -13.966 -7.627 -0.802 58 HB3 GLN 9 3HB GLN 9 -12.875 -7.562 -2.177 59 HG2 GLN 9 2HG GLN 9 -14.177 -9.287 -3.303 60 HG3 GLN 9 3HG GLN 9 -15.260 -9.379 -1.912 61 HE21 GLN 9 1HE2 GLN 9 -16.825 -7.856 -1.650 62 HE22 GLN 9 2HE2 GLN 9 -17.154 -6.614 -2.805 63 H TRP 10 H TRP 10 -13.254 -11.730 -1.303 64 HA TRP 10 HA TRP 10 -11.897 -11.938 -3.886 65 HB2 TRP 10 2HB TRP 10 -11.108 -14.252 -3.197 66 HB3 TRP 10 3HB TRP 10 -10.288 -12.913 -2.401 67 HD1 TRP 10 HD1 TRP 10 -12.950 -15.615 -1.672 68 HE1 TRP 10 HE1 TRP 10 -12.994 -16.044 0.863 69 HE3 TRP 10 HE3 TRP 10 -9.677 -11.990 -0.176 70 HZ2 TRP 10 HZ2 TRP 10 -11.802 -14.994 3.188 71 HZ3 TRP 10 HZ3 TRP 10 -9.179 -11.777 2.220 72 HH2 TRP 10 HH2 TRP 10 -10.219 -13.234 3.866 73 H GLY 11 H GLY 11 -12.902 -13.308 -5.348 74 HA2 GLY 11 2HA GLY 11 -14.407 -15.086 -5.905 75 HA3 GLY 11 3HA GLY 11 -15.244 -14.805 -4.386 76 H GLY 12 H GLY 12 -14.457 -11.912 -5.860 77 HA2 GLY 12 2HA GLY 12 -15.660 -10.815 -7.663 78 HA3 GLY 12 3HA GLY 12 -17.065 -11.780 -7.227 79 H SER 13 H SER 13 -16.896 -8.906 -7.473 80 HA SER 13 HA SER 13 -16.761 -7.683 -4.960 81 HB2 SER 13 2HB SER 13 -18.177 -6.805 -7.473 82 HB3 SER 13 3HB SER 13 -17.935 -5.783 -6.053 83 HG SER 13 HG SER 13 -15.635 -6.337 -6.329 84 H SER 14 H SER 14 -19.211 -9.689 -6.220 85 HA SER 14 HA SER 14 -21.288 -8.597 -4.549 86 HB2 SER 14 2HB SER 14 -21.190 -11.172 -6.135 87 HB3 SER 14 3HB SER 14 -22.624 -10.481 -5.377 88 HG SER 14 HG SER 14 -22.470 -8.707 -6.763 89 H ALA 15 H ALA 15 -18.603 -10.490 -4.035 90 HA ALA 15 HA ALA 15 -19.738 -12.199 -1.995 91 HB1 ALA 15 3HB ALA 15 -17.426 -12.985 -1.698 92 HB2 ALA 15 1HB ALA 15 -16.864 -11.746 -2.821 93 HB3 ALA 15 2HB ALA 15 -17.912 -13.044 -3.391 94 HA PRO 16 HA PRO 16 -19.272 -9.396 1.343 95 HB2 PRO 16 2HB PRO 16 -18.657 -11.061 3.393 96 HB3 PRO 16 3HB PRO 16 -20.270 -10.974 2.676 97 HG2 PRO 16 2HG PRO 16 -18.074 -12.946 2.143 98 HG3 PRO 16 3HG PRO 16 -19.802 -13.246 2.417 99 HD2 PRO 16 2HD PRO 16 -18.755 -13.213 -0.060 100 HD3 PRO 16 3HD PRO 16 -20.383 -12.590 0.273 101 H TRP 17 H TRP 17 -17.803 -8.328 2.611 102 HA TRP 17 HA TRP 17 -15.027 -8.701 1.876 103 HB2 TRP 17 2HB TRP 17 -16.415 -6.602 3.568 104 HB3 TRP 17 3HB TRP 17 -14.679 -6.625 3.271 105 HD1 TRP 17 HD1 TRP 17 -18.008 -5.935 1.501 106 HE1 TRP 17 HE1 TRP 17 -17.522 -4.643 -0.677 107 HE3 TRP 17 HE3 TRP 17 -12.908 -6.196 1.510 108 HZ2 TRP 17 HZ2 TRP 17 -15.287 -3.851 -2.186 109 HZ3 TRP 17 HZ3 TRP 17 -11.668 -5.153 -0.338 110 HH2 TRP 17 HH2 TRP 17 -12.833 -3.999 -2.147 111 H ASN 18 H ASN 18 -13.496 -9.635 3.159 112 HA ASN 18 HA ASN 18 -14.371 -10.481 5.832 113 HB2 ASN 18 2HB ASN 18 -12.300 -11.664 3.945 114 HB3 ASN 18 3HB ASN 18 -12.508 -12.180 5.609 115 HD21 ASN 18 1HD2 ASN 18 -15.146 -11.362 3.424 116 HD22 ASN 18 2HD2 ASN 18 -15.791 -12.963 3.310 117 H GLU 19 H GLU 19 -13.174 -9.740 7.535 118 HA GLU 19 HA GLU 19 -11.508 -7.531 6.994 119 HB2 GLU 19 2HB GLU 19 -12.892 -7.706 8.994 120 HB3 GLU 19 3HB GLU 19 -11.875 -9.012 9.590 121 HG2 GLU 19 2HG GLU 19 -9.983 -7.493 9.737 122 HG3 GLU 19 3HG GLU 19 -10.962 -6.190 9.063 123 H GLY 20 H GLY 20 -9.459 -7.335 6.772 124 HA2 GLY 20 2HA GLY 20 -7.904 -9.827 6.656 125 HA3 GLY 20 3HA GLY 20 -7.554 -8.372 5.743 126 H GLY 21 H GLY 21 -8.246 -7.238 8.769 127 HA2 GLY 21 2HA GLY 21 -6.798 -7.296 10.690 128 HA3 GLY 21 3HA GLY 21 -5.446 -7.539 9.592 129 H GLN 22 H GLN 22 -4.386 -5.717 10.465 130 HA GLN 22 HA GLN 22 -5.437 -3.191 9.429 131 HB2 GLN 22 2HB GLN 22 -4.645 -2.029 11.458 132 HB3 GLN 22 3HB GLN 22 -5.905 -3.197 11.817 133 HG2 GLN 22 2HG GLN 22 -4.120 -4.796 12.515 134 HG3 GLN 22 3HG GLN 22 -2.952 -3.493 12.312 135 HE21 GLN 22 1HE2 GLN 22 -4.946 -1.517 13.255 136 HE22 GLN 22 2HE2 GLN 22 -5.002 -1.692 14.970 137 H TRP 23 H TRP 23 -3.956 -1.826 8.545 138 HA TRP 23 HA TRP 23 -1.181 -2.831 8.343 139 HB2 TRP 23 2HB TRP 23 -2.877 -1.411 6.287 140 HB3 TRP 23 3HB TRP 23 -1.139 -1.595 6.138 141 HD1 TRP 23 HD1 TRP 23 -2.734 -4.664 7.526 142 HE1 TRP 23 HE1 TRP 23 -2.908 -6.456 5.688 143 HE3 TRP 23 HE3 TRP 23 -1.592 -1.774 3.492 144 HZ2 TRP 23 HZ2 TRP 23 -2.588 -6.609 2.888 145 HZ3 TRP 23 HZ3 TRP 23 -1.544 -2.810 1.264 146 HH2 TRP 23 HH2 TRP 23 -2.032 -5.179 0.970 147 H GLU 24 H GLU 24 0.449 -1.184 7.965 148 HA GLU 24 HA GLU 24 -0.363 1.419 9.076 149 HB2 GLU 24 2HB GLU 24 1.286 0.189 10.480 150 HB3 GLU 24 3HB GLU 24 2.400 0.181 9.120 151 HG2 GLU 24 2HG GLU 24 2.501 2.609 9.154 152 HG3 GLU 24 3HG GLU 24 1.335 2.651 10.473 153 H ILE 25 H ILE 25 -0.663 2.763 7.478 154 HA ILE 25 HA ILE 25 1.224 2.750 5.219 155 HB ILE 25 HB ILE 25 -1.759 3.300 5.118 156 HG12 ILE 25 2HG1 ILE 25 -0.168 1.102 3.774 157 HG13 ILE 25 3HG1 ILE 25 -1.087 0.888 5.261 158 HG21 ILE 25 1HG2 ILE 25 -0.570 4.785 3.608 159 HG22 ILE 25 2HG2 ILE 25 -1.446 3.559 2.690 160 HG23 ILE 25 3HG2 ILE 25 0.298 3.416 2.912 161 HD11 ILE 25 3HD1 ILE 25 -2.316 0.075 3.322 162 HD12 ILE 25 1HD1 ILE 25 -2.225 1.673 2.584 163 HD13 ILE 25 2HD1 ILE 25 -3.143 1.439 4.070 164 H GLY 26 H GLY 26 2.145 4.663 4.790 165 HA2 GLY 26 2HA GLY 26 2.248 7.004 4.593 166 HA3 GLY 26 3HA GLY 26 0.821 7.127 5.610 167 H SER 27 H SER 27 4.037 7.685 5.465 168 HA SER 27 HA SER 27 4.358 7.475 8.379 169 HB2 SER 27 2HB SER 27 5.965 6.148 6.961 170 HB3 SER 27 3HB SER 27 6.569 7.674 6.321 171 HG SER 27 HG SER 27 7.073 8.247 8.515 172 H ARG 28 H ARG 28 3.196 9.630 6.517 173 HA ARG 28 HA ARG 28 4.732 11.857 7.638 174 HB2 ARG 28 2HB ARG 28 3.674 11.639 4.819 175 HB3 ARG 28 3HB ARG 28 4.120 13.170 5.550 176 HG2 ARG 28 2HG ARG 28 6.408 12.397 5.819 177 HG3 ARG 28 3HG ARG 28 5.966 10.824 5.155 178 HD2 ARG 28 2HD ARG 28 7.042 12.194 3.457 179 HD3 ARG 28 3HD ARG 28 5.360 11.891 3.036 180 HE ARG 28 HE ARG 28 5.429 14.326 4.395 181 HH11 ARG 28 1HH1 ARG 28 6.737 13.007 1.415 182 HH12 ARG 28 2HH1 ARG 28 6.676 14.517 0.573 183 HH21 ARG 28 1HH2 ARG 28 5.341 16.320 3.263 184 HH22 ARG 28 2HH2 ARG 28 5.896 16.383 1.615 185 H SER 29 H SER 29 3.558 13.464 8.502 186 HA SER 29 HA SER 29 0.702 12.995 8.752 187 HB2 SER 29 2HB SER 29 2.466 15.021 10.137 188 HB3 SER 29 3HB SER 29 0.812 14.592 10.581 189 HG SER 29 HG SER 29 1.974 13.343 11.894 190 H ASP 30 H ASP 30 2.943 15.149 7.218 191 HA ASP 30 HA ASP 30 1.080 17.301 6.859 192 HB2 ASP 30 2HB ASP 30 2.838 18.396 5.616 193 HB3 ASP 30 3HB ASP 30 3.534 17.669 7.062 194 H GLN 31 H GLN 31 2.327 14.650 4.902 195 HA GLN 31 HA GLN 31 0.223 15.208 2.936 196 HB2 GLN 31 2HB GLN 31 3.094 14.409 2.429 197 HB3 GLN 31 3HB GLN 31 1.836 14.274 1.213 198 HG2 GLN 31 2HG GLN 31 2.344 16.895 2.554 199 HG3 GLN 31 3HG GLN 31 3.390 16.348 1.249 200 HE21 GLN 31 1HE2 GLN 31 -0.004 15.541 1.305 201 HE22 GLN 31 2HE2 GLN 31 -0.461 16.558 -0.007 202 H ASN 32 H ASN 32 -1.148 13.543 2.797 203 HA ASN 32 HA ASN 32 -0.276 10.932 3.771 204 HB2 ASN 32 2HB ASN 32 -2.461 11.991 4.573 205 HB3 ASN 32 3HB ASN 32 -3.085 11.705 2.952 206 HD21 ASN 32 1HD2 ASN 32 -4.655 10.300 3.720 207 HD22 ASN 32 2HD2 ASN 32 -4.259 8.697 4.263 208 H VAL 33 H VAL 33 -1.268 9.040 2.497 209 HA VAL 33 HA VAL 33 -0.383 9.371 -0.271 210 HB VAL 33 HB VAL 33 -0.903 6.857 1.318 211 HG11 VAL 33 1HG1 VAL 33 0.379 7.258 -1.377 212 HG12 VAL 33 2HG1 VAL 33 -1.169 6.478 -1.053 213 HG13 VAL 33 3HG1 VAL 33 0.330 5.735 -0.491 214 HG21 VAL 33 3HG2 VAL 33 0.967 8.170 2.207 215 HG22 VAL 33 1HG2 VAL 33 1.715 8.177 0.610 216 HG23 VAL 33 2HG2 VAL 33 1.517 6.658 1.486 217 H VAL 34 H VAL 34 -1.773 9.232 -1.967 218 HA VAL 34 HA VAL 34 -4.518 8.370 -1.362 219 HB VAL 34 HB VAL 34 -5.246 9.695 -3.328 220 HG11 VAL 34 1HG1 VAL 34 -5.025 11.880 -2.240 221 HG12 VAL 34 2HG1 VAL 34 -3.777 11.211 -1.186 222 HG13 VAL 34 3HG1 VAL 34 -5.428 10.599 -1.097 223 HG21 VAL 34 3HG2 VAL 34 -3.728 11.376 -4.265 224 HG22 VAL 34 1HG2 VAL 34 -3.144 9.740 -4.569 225 HG23 VAL 34 2HG2 VAL 34 -2.404 10.718 -3.302 226 H ALA 35 H ALA 35 -1.746 7.661 -3.290 227 HA ALA 35 HA ALA 35 -3.242 5.446 -4.451 228 HB1 ALA 35 3HB ALA 35 -2.624 5.878 -6.726 229 HB2 ALA 35 1HB ALA 35 -1.665 7.280 -6.250 230 HB3 ALA 35 2HB ALA 35 -3.417 7.318 -6.087 231 H ILE 36 H ILE 36 -1.988 3.686 -5.084 232 HA ILE 36 HA ILE 36 0.889 3.831 -4.706 233 HB ILE 36 HB ILE 36 -0.813 1.906 -3.079 234 HG12 ILE 36 2HG1 ILE 36 1.114 4.026 -2.109 235 HG13 ILE 36 3HG1 ILE 36 -0.634 4.223 -2.151 236 HG21 ILE 36 1HG2 ILE 36 1.314 1.062 -2.188 237 HG22 ILE 36 2HG2 ILE 36 2.188 2.115 -3.299 238 HG23 ILE 36 3HG2 ILE 36 1.183 0.811 -3.929 239 HD11 ILE 36 3HD1 ILE 36 -0.879 2.371 -0.583 240 HD12 ILE 36 1HD1 ILE 36 0.140 3.650 0.079 241 HD13 ILE 36 2HD1 ILE 36 0.873 2.173 -0.546 242 H ASN 37 H ASN 37 1.817 2.681 -6.276 243 HA ASN 37 HA ASN 37 0.499 0.240 -7.243 244 HB2 ASN 37 2HB ASN 37 1.345 2.617 -8.810 245 HB3 ASN 37 3HB ASN 37 1.830 1.063 -9.475 246 HD21 ASN 37 1HD2 ASN 37 -1.103 1.375 -7.623 247 HD22 ASN 37 2HD2 ASN 37 -2.193 1.191 -8.957 248 H VAL 38 H VAL 38 1.842 -1.419 -6.805 249 HA VAL 38 HA VAL 38 4.698 -1.055 -7.115 250 HB VAL 38 HB VAL 38 5.242 -1.951 -4.834 251 HG11 VAL 38 1HG1 VAL 38 3.944 0.755 -4.975 252 HG12 VAL 38 2HG1 VAL 38 5.625 0.362 -5.348 253 HG13 VAL 38 3HG1 VAL 38 5.027 0.202 -3.698 254 HG21 VAL 38 3HG2 VAL 38 2.392 -1.175 -4.260 255 HG22 VAL 38 1HG2 VAL 38 3.594 -1.626 -3.050 256 HG23 VAL 38 2HG2 VAL 38 3.050 -2.811 -4.241 257 H GLU 39 H GLU 39 5.882 -2.908 -7.249 258 HA GLU 39 HA GLU 39 4.458 -5.463 -7.026 259 HB2 GLU 39 2HB GLU 39 4.639 -4.741 -9.401 260 HB3 GLU 39 3HB GLU 39 6.377 -4.605 -9.205 261 HG2 GLU 39 2HG GLU 39 6.475 -7.019 -8.713 262 HG3 GLU 39 3HG GLU 39 4.745 -7.124 -9.032 263 H SER 40 H SER 40 5.740 -7.100 -6.172 264 HA SER 40 HA SER 40 8.069 -6.331 -4.751 265 HB2 SER 40 2HB SER 40 8.163 -8.805 -4.226 266 HB3 SER 40 3HB SER 40 6.659 -7.995 -3.784 267 HG SER 40 HG SER 40 7.071 -9.432 -6.197 268 H GLY 41 H GLY 41 10.201 -6.885 -5.095 269 HA2 GLY 41 2HA GLY 41 10.895 -7.687 -7.824 270 HA3 GLY 41 3HA GLY 41 12.011 -7.077 -6.605 271 H ASP 42 H ASP 42 11.380 -8.647 -4.502 272 HA ASP 42 HA ASP 42 12.286 -11.307 -5.334 273 HB2 ASP 42 2HB ASP 42 12.352 -9.895 -2.654 274 HB3 ASP 42 3HB ASP 42 12.805 -11.580 -2.873 275 H ASP 43 H ASP 43 11.467 -12.641 -2.987 276 HA ASP 43 HA ASP 43 8.681 -13.059 -3.610 277 HB2 ASP 43 2HB ASP 43 8.880 -14.979 -2.047 278 HB3 ASP 43 3HB ASP 43 10.097 -15.015 -3.314 279 H GLY 44 H GLY 44 8.871 -10.581 -2.617 280 HA2 GLY 44 2HA GLY 44 7.406 -9.455 -1.114 281 HA3 GLY 44 3HA GLY 44 7.525 -10.824 -0.022 282 H GLN 45 H GLN 45 10.571 -10.606 -0.689 283 HA GLN 45 HA GLN 45 11.266 -9.282 1.699 284 HB2 GLN 45 2HB GLN 45 12.633 -11.072 0.720 285 HB3 GLN 45 3HB GLN 45 13.038 -10.033 -0.636 286 HG2 GLN 45 2HG GLN 45 14.868 -10.128 0.935 287 HG3 GLN 45 3HG GLN 45 14.189 -8.502 0.887 288 HE21 GLN 45 1HE2 GLN 45 14.990 -7.990 2.903 289 HE22 GLN 45 2HE2 GLN 45 14.326 -8.629 4.362 290 H THR 46 H THR 46 11.320 -8.214 -1.666 291 HA THR 46 HA THR 46 11.744 -5.477 -0.684 292 HB THR 46 HB THR 46 12.954 -4.977 -2.802 293 HG1 THR 46 HG1 THR 46 13.648 -7.559 -3.380 294 HG21 THR 46 3HG2 THR 46 14.209 -5.490 -0.741 295 HG22 THR 46 1HG2 THR 46 15.063 -6.037 -2.185 296 HG23 THR 46 2HG2 THR 46 14.200 -7.199 -1.178 297 H LEU 47 H LEU 47 10.509 -3.850 -1.674 298 HA LEU 47 HA LEU 47 8.578 -4.725 -3.705 299 HB2 LEU 47 2HB LEU 47 8.048 -2.855 -1.390 300 HB3 LEU 47 3HB LEU 47 6.905 -3.272 -2.648 301 HG LEU 47 HG LEU 47 8.004 -5.163 -0.563 302 HD11 LEU 47 1HD1 LEU 47 5.262 -3.946 -0.877 303 HD12 LEU 47 2HD1 LEU 47 6.454 -3.511 0.348 304 HD13 LEU 47 3HD1 LEU 47 5.745 -5.125 0.344 305 HD21 LEU 47 3HD2 LEU 47 6.326 -6.732 -1.428 306 HD22 LEU 47 1HD2 LEU 47 7.537 -6.322 -2.643 307 HD23 LEU 47 2HD2 LEU 47 5.934 -5.587 -2.715 308 H ASN 48 H ASN 48 8.430 -3.324 -5.439 309 HA ASN 48 HA ASN 48 9.582 -0.658 -5.093 310 HB2 ASN 48 2HB ASN 48 10.890 -0.805 -7.111 311 HB3 ASN 48 3HB ASN 48 11.319 -2.173 -6.091 312 HD21 ASN 48 1HD2 ASN 48 10.807 -4.235 -6.756 313 HD22 ASN 48 2HD2 ASN 48 10.242 -4.601 -8.352 314 H GLY 49 H GLY 49 8.719 0.935 -6.427 315 HA2 GLY 49 2HA GLY 49 7.223 0.646 -8.701 316 HA3 GLY 49 3HA GLY 49 6.072 0.419 -7.390 317 H THR 50 H THR 50 4.909 2.249 -7.668 318 HA THR 50 HA THR 50 6.322 4.733 -7.068 319 HB THR 50 HB THR 50 5.939 4.709 -9.501 320 HG1 THR 50 HG1 THR 50 5.725 6.677 -8.264 321 HG21 THR 50 3HG2 THR 50 3.005 4.488 -8.793 322 HG22 THR 50 1HG2 THR 50 3.978 3.234 -9.563 323 HG23 THR 50 2HG2 THR 50 3.658 4.749 -10.410 324 H MET 51 H MET 51 5.164 6.218 -5.861 325 HA MET 51 HA MET 51 2.490 5.420 -4.982 326 HB2 MET 51 2HB MET 51 4.041 4.629 -3.293 327 HB3 MET 51 3HB MET 51 4.834 6.191 -3.235 328 HG2 MET 51 2HG MET 51 1.940 6.052 -2.585 329 HG3 MET 51 3HG MET 51 3.100 5.437 -1.407 330 HE1 MET 51 3HE MET 51 5.615 7.353 -1.825 331 HE2 MET 51 1HE MET 51 4.949 6.838 -0.275 332 HE3 MET 51 2HE MET 51 5.257 8.547 -0.578 333 H THR 52 H THR 52 1.136 7.178 -4.355 334 HA THR 52 HA THR 52 2.170 9.818 -5.172 335 HB THR 52 HB THR 52 -0.596 8.743 -5.732 336 HG1 THR 52 HG1 THR 52 1.563 8.064 -6.932 337 HG21 THR 52 3HG2 THR 52 0.808 11.247 -6.682 338 HG22 THR 52 1HG2 THR 52 -0.502 11.176 -5.502 339 HG23 THR 52 2HG2 THR 52 -0.799 10.713 -7.176 340 H TYR 53 H TYR 53 1.898 11.377 -3.712 341 HA TYR 53 HA TYR 53 0.261 10.969 -1.351 342 HB2 TYR 53 2HB TYR 53 2.095 13.230 -2.172 343 HB3 TYR 53 3HB TYR 53 1.152 13.238 -0.694 344 HD1 TYR 53 HD2 TYR 53 1.631 11.444 1.037 345 HD2 TYR 53 HD1 TYR 53 4.181 12.189 -2.284 346 HE1 TYR 53 HE2 TYR 53 3.475 10.330 2.213 347 HE2 TYR 53 HE1 TYR 53 6.033 11.082 -1.114 348 HH TYR 53 HH TYR 53 6.723 10.482 1.073 349 H ALA 54 H ALA 54 -1.200 12.668 -0.606 350 HA ALA 54 HA ALA 54 -3.172 13.337 -2.511 351 HB1 ALA 54 3HB ALA 54 -4.240 14.571 -0.701 352 HB2 ALA 54 1HB ALA 54 -2.755 14.501 0.246 353 HB3 ALA 54 2HB ALA 54 -3.642 13.022 -0.116 354 H GLY 55 H GLY 55 -3.208 14.939 -3.946 355 HA2 GLY 55 2HA GLY 55 -2.994 17.078 -4.812 356 HA3 GLY 55 3HA GLY 55 -2.250 17.576 -3.300 357 H GLU 56 H GLU 56 -0.732 14.840 -4.428 358 HA GLU 56 HA GLU 56 1.382 16.438 -5.712 359 HB2 GLU 56 2HB GLU 56 1.609 14.075 -3.855 360 HB3 GLU 56 3HB GLU 56 2.955 14.693 -4.800 361 HG2 GLU 56 2HG GLU 56 1.413 16.284 -2.761 362 HG3 GLU 56 3HG GLU 56 2.958 15.487 -2.471 363 H GLY 57 H GLY 57 2.966 14.764 -6.842 364 HA2 GLY 57 2HA GLY 57 1.254 13.158 -8.610 365 HA3 GLY 57 3HA GLY 57 2.800 13.862 -9.066 366 HA PRO 58 HA PRO 58 3.192 9.339 -7.573 367 HB2 PRO 58 2HB PRO 58 4.106 8.940 -10.362 368 HB3 PRO 58 3HB PRO 58 3.009 7.952 -9.390 369 HG2 PRO 58 2HG PRO 58 2.104 9.468 -11.399 370 HG3 PRO 58 3HG PRO 58 1.168 9.249 -9.908 371 HD2 PRO 58 2HD PRO 58 2.825 11.576 -10.786 372 HD3 PRO 58 3HD PRO 58 1.261 11.557 -9.948 373 H ILE 59 H ILE 59 5.092 8.756 -6.744 374 HA ILE 59 HA ILE 59 7.577 9.759 -7.959 375 HB ILE 59 HB ILE 59 8.554 10.057 -5.716 376 HG12 ILE 59 2HG1 ILE 59 5.749 9.654 -4.655 377 HG13 ILE 59 3HG1 ILE 59 7.032 8.452 -4.549 378 HG21 ILE 59 1HG2 ILE 59 6.041 11.660 -6.168 379 HG22 ILE 59 2HG2 ILE 59 7.641 11.998 -6.832 380 HG23 ILE 59 3HG2 ILE 59 7.363 12.116 -5.094 381 HD11 ILE 59 3HD1 ILE 59 6.782 9.644 -2.464 382 HD12 ILE 59 1HD1 ILE 59 7.048 11.182 -3.287 383 HD13 ILE 59 2HD1 ILE 59 8.347 9.992 -3.196 384 H GLY 60 H GLY 60 9.505 8.507 -6.894 385 HA2 GLY 60 2HA GLY 60 8.975 5.728 -7.469 386 HA3 GLY 60 3HA GLY 60 10.538 6.428 -7.059 387 H PHE 61 H PHE 61 8.811 4.083 -6.046 388 HA PHE 61 HA PHE 61 9.197 4.729 -3.216 389 HB2 PHE 61 2HB PHE 61 6.861 4.935 -3.490 390 HB3 PHE 61 3HB PHE 61 6.771 3.534 -4.538 391 HD1 PHE 61 HD1 PHE 61 8.341 3.887 -1.169 392 HD2 PHE 61 HD2 PHE 61 5.291 2.127 -3.530 393 HE1 PHE 61 HE1 PHE 61 7.658 2.485 0.741 394 HE2 PHE 61 HE2 PHE 61 4.617 0.722 -1.624 395 HZ PHE 61 HZ PHE 61 5.802 0.909 0.510 396 H ARG 62 H ARG 62 10.452 3.359 -2.208 397 HA ARG 62 HA ARG 62 10.587 0.564 -3.128 398 HB2 ARG 62 2HB ARG 62 12.599 1.776 -3.898 399 HB3 ARG 62 3HB ARG 62 12.948 2.240 -2.239 400 HG2 ARG 62 2HG ARG 62 13.265 -0.098 -1.637 401 HG3 ARG 62 3HG ARG 62 12.869 -0.590 -3.284 402 HD2 ARG 62 2HD ARG 62 15.263 -0.591 -3.005 403 HD3 ARG 62 3HD ARG 62 14.804 0.715 -4.094 404 HE ARG 62 HE ARG 62 14.978 1.687 -1.448 405 HH11 ARG 62 1HH1 ARG 62 17.023 0.571 -4.069 406 HH12 ARG 62 2HH1 ARG 62 18.384 1.525 -3.594 407 HH21 ARG 62 1HH2 ARG 62 16.825 2.967 -0.796 408 HH22 ARG 62 2HH2 ARG 62 18.265 2.867 -1.755 409 H ALA 63 H ALA 63 10.347 -0.903 -1.569 410 HA ALA 63 HA ALA 63 10.742 -0.056 1.222 411 HB1 ALA 63 3HB ALA 63 8.725 -1.222 1.889 412 HB2 ALA 63 1HB ALA 63 8.432 -1.727 0.227 413 HB3 ALA 63 2HB ALA 63 8.336 -0.022 0.658 414 H THR 64 H THR 64 11.692 -1.526 2.530 415 HA THR 64 HA THR 64 12.334 -4.158 1.362 416 HB THR 64 HB THR 64 14.082 -2.492 3.200 417 HG1 THR 64 HG1 THR 64 15.381 -2.277 1.306 418 HG21 THR 64 3HG2 THR 64 15.793 -4.199 2.737 419 HG22 THR 64 1HG2 THR 64 14.625 -5.111 1.782 420 HG23 THR 64 2HG2 THR 64 14.381 -4.911 3.515 421 H LEU 65 H LEU 65 11.799 -5.900 2.554 422 HA LEU 65 HA LEU 65 10.205 -5.595 4.875 423 HB2 LEU 65 2HB LEU 65 9.881 -7.432 3.310 424 HB3 LEU 65 3HB LEU 65 11.477 -8.056 3.676 425 HG LEU 65 HG LEU 65 10.743 -8.555 5.977 426 HD11 LEU 65 1HD1 LEU 65 8.051 -7.613 4.996 427 HD12 LEU 65 2HD1 LEU 65 9.033 -6.869 6.259 428 HD13 LEU 65 3HD1 LEU 65 8.338 -8.471 6.510 429 HD21 LEU 65 3HD2 LEU 65 9.262 -10.429 5.404 430 HD22 LEU 65 1HD2 LEU 65 10.608 -10.279 4.274 431 HD23 LEU 65 2HD2 LEU 65 9.003 -9.721 3.809 432 H LEU 66 H LEU 66 10.817 -5.301 6.896 433 HA LEU 66 HA LEU 66 13.522 -5.503 7.726 434 HB2 LEU 66 2HB LEU 66 10.969 -5.076 9.264 435 HB3 LEU 66 3HB LEU 66 12.565 -5.008 9.988 436 HG LEU 66 HG LEU 66 11.578 -3.172 7.806 437 HD11 LEU 66 1HD1 LEU 66 10.389 -2.787 9.895 438 HD12 LEU 66 2HD1 LEU 66 11.506 -1.465 9.558 439 HD13 LEU 66 3HD1 LEU 66 11.921 -2.685 10.762 440 HD21 LEU 66 3HD2 LEU 66 13.602 -1.865 8.389 441 HD22 LEU 66 1HD2 LEU 66 13.976 -3.451 7.714 442 HD23 LEU 66 2HD2 LEU 66 14.106 -3.176 9.451 443 H GLY 67 H GLY 67 10.713 -7.595 7.943 444 HA2 GLY 67 2HA GLY 67 11.498 -10.012 8.057 445 HA3 GLY 67 3HA GLY 67 12.303 -9.508 9.531 446 H ASN 68 H ASN 68 9.714 -7.758 9.716 447 HA ASN 68 HA ASN 68 8.006 -9.887 10.829 448 HB2 ASN 68 2HB ASN 68 8.769 -7.380 12.344 449 HB3 ASN 68 3HB ASN 68 7.498 -8.486 12.845 450 HD21 ASN 68 1HD2 ASN 68 8.071 -10.580 13.553 451 HD22 ASN 68 2HD2 ASN 68 9.677 -10.948 14.071 452 H ASN 69 H ASN 69 7.427 -8.946 8.474 453 HA ASN 69 HA ASN 69 5.754 -8.155 7.168 454 HB2 ASN 69 2HB ASN 69 4.319 -7.803 9.810 455 HB3 ASN 69 3HB ASN 69 3.557 -7.609 8.236 456 HD21 ASN 69 1HD2 ASN 69 2.830 -9.456 10.284 457 HD22 ASN 69 2HD2 ASN 69 2.994 -11.039 9.613 458 H SER 70 H SER 70 7.523 -6.270 9.070 459 HA SER 70 HA SER 70 6.234 -3.773 8.284 460 HB2 SER 70 2HB SER 70 6.867 -4.055 10.688 461 HB3 SER 70 3HB SER 70 8.551 -4.212 10.195 462 HG SER 70 HG SER 70 6.878 -1.955 9.763 463 H TYR 71 H TYR 71 7.224 -2.380 6.924 464 HA TYR 71 HA TYR 71 9.708 -3.312 5.665 465 HB2 TYR 71 2HB TYR 71 7.334 -1.902 4.433 466 HB3 TYR 71 3HB TYR 71 8.871 -2.145 3.618 467 HD1 TYR 71 HD1 TYR 71 5.928 -3.908 5.029 468 HD2 TYR 71 HD2 TYR 71 9.375 -4.189 2.559 469 HE1 TYR 71 HE1 TYR 71 5.131 -6.072 4.171 470 HE2 TYR 71 HE2 TYR 71 8.593 -6.350 1.698 471 HH TYR 71 HH TYR 71 5.548 -7.415 1.918 472 H GLU 72 H GLU 72 11.301 -1.848 5.366 473 HA GLU 72 HA GLU 72 10.881 0.814 6.470 474 HB2 GLU 72 2HB GLU 72 12.927 -0.433 7.115 475 HB3 GLU 72 3HB GLU 72 13.413 -0.480 5.425 476 HG2 GLU 72 2HG GLU 72 13.657 1.900 5.369 477 HG3 GLU 72 3HG GLU 72 12.989 2.050 6.991 478 H VAL 73 H VAL 73 10.468 2.483 5.226 479 HA VAL 73 HA VAL 73 10.462 2.015 2.351 480 HB VAL 73 HB VAL 73 8.805 3.772 4.133 481 HG11 VAL 73 1HG1 VAL 73 9.192 5.137 2.237 482 HG12 VAL 73 2HG1 VAL 73 7.593 4.420 2.024 483 HG13 VAL 73 3HG1 VAL 73 8.979 3.785 1.132 484 HG21 VAL 73 3HG2 VAL 73 8.097 1.488 4.073 485 HG22 VAL 73 1HG2 VAL 73 8.187 1.452 2.315 486 HG23 VAL 73 2HG2 VAL 73 6.965 2.440 3.112 487 H GLU 74 H GLU 74 11.466 3.220 0.961 488 HA GLU 74 HA GLU 74 12.630 5.773 1.773 489 HB2 GLU 74 2HB GLU 74 13.963 3.602 0.129 490 HB3 GLU 74 3HB GLU 74 14.586 5.237 0.304 491 HG2 GLU 74 2HG GLU 74 14.842 4.891 2.706 492 HG3 GLU 74 3HG GLU 74 14.197 3.260 2.543 493 H ASN 75 H ASN 75 12.061 7.343 0.386 494 HA ASN 75 HA ASN 75 10.627 6.522 -2.047 495 HB2 ASN 75 2HB ASN 75 10.246 8.916 -0.261 496 HB3 ASN 75 3HB ASN 75 9.477 8.756 -1.835 497 HD21 ASN 75 1HD2 ASN 75 8.404 8.891 0.921 498 HD22 ASN 75 2HD2 ASN 75 7.380 7.506 1.071 499 H GLN 76 H GLN 76 10.922 7.613 -3.945 500 HA GLN 76 HA GLN 76 13.354 9.267 -4.105 501 HB2 GLN 76 2HB GLN 76 13.427 7.034 -5.217 502 HB3 GLN 76 3HB GLN 76 12.083 7.533 -6.227 503 HG2 GLN 76 2HG GLN 76 13.486 9.362 -7.116 504 HG3 GLN 76 3HG GLN 76 14.836 8.733 -6.169 505 HE21 GLN 76 1HE2 GLN 76 16.099 8.211 -7.883 506 HE22 GLN 76 2HE2 GLN 76 15.716 6.960 -9.015 507 H TRP 77 H TRP 77 12.949 11.350 -4.619 508 HA TRP 77 HA TRP 77 10.785 11.910 -6.478 509 HB2 TRP 77 2HB TRP 77 10.013 13.844 -5.096 510 HB3 TRP 77 3HB TRP 77 9.702 12.283 -4.354 511 HD1 TRP 77 HD1 TRP 77 12.396 15.080 -4.103 512 HE1 TRP 77 HE1 TRP 77 13.103 15.282 -1.646 513 HE3 TRP 77 HE3 TRP 77 9.585 11.287 -2.139 514 HZ2 TRP 77 HZ2 TRP 77 12.544 14.012 0.807 515 HZ3 TRP 77 HZ3 TRP 77 9.729 10.854 0.282 516 HH2 TRP 77 HH2 TRP 77 11.179 12.186 1.720 517 H GLY 78 H GLY 78 10.923 14.068 -7.428 518 HA2 GLY 78 2HA GLY 78 12.132 16.022 -7.973 519 HA3 GLY 78 3HA GLY 78 13.543 15.353 -7.156 520 H GLY 79 H GLY 79 12.538 12.815 -8.789 521 HA2 GLY 79 2HA GLY 79 12.661 12.891 -11.410 522 HA3 GLY 79 3HA GLY 79 14.318 13.351 -11.034 523 H ASP 80 H ASP 80 13.457 11.026 -12.450 524 HA ASP 80 HA ASP 80 13.593 8.756 -10.731 525 HB2 ASP 80 2HB ASP 80 13.884 9.031 -13.725 526 HB3 ASP 80 3HB ASP 80 13.920 7.482 -12.888 527 H SER 81 H SER 81 15.953 10.697 -12.372 528 HA SER 81 HA SER 81 18.119 8.874 -11.959 529 HB2 SER 81 2HB SER 81 18.308 11.829 -12.536 530 HB3 SER 81 3HB SER 81 19.472 10.565 -12.941 531 HG SER 81 HG SER 81 18.316 10.020 -14.632 532 H ALA 82 H ALA 82 16.433 10.959 -9.914 533 HA ALA 82 HA ALA 82 18.586 11.989 -8.346 534 HB1 ALA 82 3HB ALA 82 16.824 12.741 -6.818 535 HB2 ALA 82 1HB ALA 82 15.642 11.774 -7.701 536 HB3 ALA 82 2HB ALA 82 16.435 13.139 -8.490 537 HA PRO 83 HA PRO 83 19.325 8.614 -5.560 538 HB2 PRO 83 2HB PRO 83 19.864 9.931 -3.243 539 HB3 PRO 83 3HB PRO 83 20.990 9.896 -4.608 540 HG2 PRO 83 2HG PRO 83 19.031 12.023 -3.824 541 HG3 PRO 83 3HG PRO 83 20.726 12.193 -4.325 542 HD2 PRO 83 2HD PRO 83 18.695 12.645 -6.025 543 HD3 PRO 83 3HD PRO 83 20.222 11.923 -6.565 544 H TRP 84 H TRP 84 18.600 7.702 -3.387 545 HA TRP 84 HA TRP 84 15.724 8.033 -3.222 546 HB2 TRP 84 2HB TRP 84 17.601 6.028 -1.943 547 HB3 TRP 84 3HB TRP 84 15.852 6.029 -1.740 548 HD1 TRP 84 HD1 TRP 84 18.573 5.192 -4.275 549 HE1 TRP 84 HE1 TRP 84 17.543 3.810 -6.181 550 HE3 TRP 84 HE3 TRP 84 13.634 5.619 -3.007 551 HZ2 TRP 84 HZ2 TRP 84 14.972 3.007 -7.043 552 HZ3 TRP 84 HZ3 TRP 84 11.956 4.514 -4.429 553 HH2 TRP 84 HH2 TRP 84 12.611 3.237 -6.401 554 H HIS 85 H HIS 85 14.648 8.651 -1.364 555 HA HIS 85 HA HIS 85 16.332 9.820 0.756 556 HB2 HIS 85 2HB HIS 85 13.662 10.810 -0.290 557 HB3 HIS 85 3HB HIS 85 14.536 11.506 1.068 558 HD1 HIS 85 HD1 HIS 85 16.538 13.043 0.518 559 HD2 HIS 85 HD2 HIS 85 14.700 11.417 -2.840 560 HE1 HIS 85 HE1 HIS 85 17.481 14.293 -1.435 561 H SER 86 H SER 86 15.325 9.803 2.917 562 HA SER 86 HA SER 86 14.202 7.311 3.530 563 HB2 SER 86 2HB SER 86 14.252 9.840 5.195 564 HB3 SER 86 3HB SER 86 13.942 8.211 5.802 565 HG SER 86 HG SER 86 16.098 8.733 6.125 566 H GLY 87 H GLY 87 12.115 6.689 4.087 567 HA2 GLY 87 2HA GLY 87 10.004 8.628 3.415 568 HA3 GLY 87 3HA GLY 87 9.897 6.905 3.064 569 H GLY 88 H GLY 88 10.419 5.541 5.145 570 HA2 GLY 88 2HA GLY 88 10.195 6.197 7.719 571 HA3 GLY 88 3HA GLY 88 8.539 6.439 7.181 572 H ASN 89 H ASN 89 8.235 4.728 8.877 573 HA ASN 89 HA ASN 89 8.797 2.053 7.813 574 HB2 ASN 89 2HB ASN 89 8.037 2.986 10.579 575 HB3 ASN 89 3HB ASN 89 8.011 1.291 10.116 576 HD21 ASN 89 1HD2 ASN 89 10.339 1.515 8.383 577 HD22 ASN 89 2HD2 ASN 89 11.709 1.665 9.427 578 H TRP 90 H TRP 90 7.244 0.717 7.160 579 HA TRP 90 HA TRP 90 4.437 1.513 7.499 580 HB2 TRP 90 2HB TRP 90 5.767 0.585 4.924 581 HB3 TRP 90 3HB TRP 90 4.033 0.709 5.149 582 HD1 TRP 90 HD1 TRP 90 6.409 3.523 6.312 583 HE1 TRP 90 HE1 TRP 90 5.974 5.602 4.877 584 HE3 TRP 90 HE3 TRP 90 3.157 1.501 2.919 585 HZ2 TRP 90 HZ2 TRP 90 4.455 6.304 2.602 586 HZ3 TRP 90 HZ3 TRP 90 2.268 2.952 1.144 587 HH2 TRP 90 HH2 TRP 90 2.902 5.295 0.990 588 H ILE 91 H ILE 91 3.013 -0.324 7.517 589 HA ILE 91 HA ILE 91 4.420 -2.912 7.701 590 HB ILE 91 HB ILE 91 1.953 -2.037 9.230 591 HG12 ILE 91 2HG1 ILE 91 4.672 -2.904 10.239 592 HG13 ILE 91 3HG1 ILE 91 4.155 -1.228 10.087 593 HG21 ILE 91 1HG2 ILE 91 1.993 -4.263 10.266 594 HG22 ILE 91 2HG2 ILE 91 3.322 -4.730 9.205 595 HG23 ILE 91 3HG2 ILE 91 1.737 -4.372 8.524 596 HD11 ILE 91 3HD1 ILE 91 2.387 -1.623 11.720 597 HD12 ILE 91 1HD1 ILE 91 3.973 -2.021 12.380 598 HD13 ILE 91 2HD1 ILE 91 2.887 -3.308 11.858 599 H LEU 92 H LEU 92 3.993 -4.201 6.058 600 HA LEU 92 HA LEU 92 1.337 -4.035 4.807 601 HB2 LEU 92 2HB LEU 92 3.974 -4.402 3.375 602 HB3 LEU 92 3HB LEU 92 2.396 -4.449 2.622 603 HG LEU 92 HG LEU 92 3.630 -2.025 3.935 604 HD11 LEU 92 1HD1 LEU 92 3.226 -2.711 1.031 605 HD12 LEU 92 2HD1 LEU 92 4.769 -2.601 1.882 606 HD13 LEU 92 3HD1 LEU 92 3.784 -1.158 1.652 607 HD21 LEU 92 3HD2 LEU 92 1.202 -2.002 4.112 608 HD22 LEU 92 1HD2 LEU 92 1.057 -2.344 2.388 609 HD23 LEU 92 2HD2 LEU 92 1.743 -0.813 2.927 610 H GLY 93 H GLY 93 0.944 -5.770 6.304 611 HA2 GLY 93 2HA GLY 93 0.834 -8.267 5.227 612 HA3 GLY 93 3HA GLY 93 2.348 -8.233 6.132 613 H SER 94 H SER 94 -1.117 -8.027 6.341 614 HA SER 94 HA SER 94 -1.005 -7.924 9.241 615 HB2 SER 94 2HB SER 94 -3.511 -7.839 8.995 616 HB3 SER 94 3HB SER 94 -2.634 -6.490 8.273 617 HG SER 94 HG SER 94 -4.294 -8.222 7.118 618 H ARG 95 H ARG 95 -0.842 -10.201 6.888 619 HA ARG 95 HA ARG 95 -2.328 -12.226 8.352 620 HB2 ARG 95 2HB ARG 95 -0.996 -12.246 5.644 621 HB3 ARG 95 3HB ARG 95 -1.728 -13.670 6.370 622 HG2 ARG 95 2HG ARG 95 -3.893 -12.561 6.420 623 HG3 ARG 95 3HG ARG 95 -3.169 -11.096 5.757 624 HD2 ARG 95 2HD ARG 95 -2.576 -12.318 3.723 625 HD3 ARG 95 3HD ARG 95 -3.296 -13.780 4.394 626 HE ARG 95 HE ARG 95 -4.814 -11.336 3.745 627 HH11 ARG 95 1HH1 ARG 95 -4.581 -14.839 3.903 628 HH12 ARG 95 2HH1 ARG 95 -6.201 -15.090 3.359 629 HH21 ARG 95 1HH2 ARG 95 -6.974 -11.683 3.031 630 HH22 ARG 95 2HH2 ARG 95 -7.557 -13.306 2.859 631 H GLU 96 H GLU 96 -1.299 -14.199 8.970 632 HA GLU 96 HA GLU 96 1.114 -13.597 10.358 633 HB2 GLU 96 2HB GLU 96 -0.676 -14.992 11.320 634 HB3 GLU 96 3HB GLU 96 -0.347 -16.225 10.113 635 HG2 GLU 96 2HG GLU 96 1.881 -16.545 11.015 636 HG3 GLU 96 3HG GLU 96 1.602 -15.268 12.193 637 H ASN 97 H ASN 97 0.301 -15.670 7.615 638 HA ASN 97 HA ASN 97 3.177 -16.242 7.263 639 HB2 ASN 97 2HB ASN 97 0.757 -17.872 6.467 640 HB3 ASN 97 3HB ASN 97 2.390 -18.239 5.934 641 HD21 ASN 97 1HD2 ASN 97 0.549 -19.837 7.532 642 HD22 ASN 97 2HD2 ASN 97 1.365 -20.166 9.015 643 H GLN 98 H GLN 98 1.442 -13.941 6.190 644 HA GLN 98 HA GLN 98 2.251 -14.277 3.402 645 HB2 GLN 98 2HB GLN 98 -0.473 -14.396 4.282 646 HB3 GLN 98 3HB GLN 98 -0.244 -13.006 3.232 647 HG2 GLN 98 2HG GLN 98 0.696 -14.466 1.512 648 HG3 GLN 98 3HG GLN 98 0.452 -15.860 2.565 649 HE21 GLN 98 1HE2 GLN 98 -0.912 -16.800 1.013 650 HE22 GLN 98 2HE2 GLN 98 -2.536 -16.245 0.786 651 H ASN 99 H ASN 99 3.465 -12.615 2.899 652 HA ASN 99 HA ASN 99 2.890 -9.979 4.021 653 HB2 ASN 99 2HB ASN 99 5.315 -11.155 2.673 654 HB3 ASN 99 3HB ASN 99 5.111 -9.413 2.780 655 HD21 ASN 99 1HD2 ASN 99 5.768 -12.327 4.508 656 HD22 ASN 99 2HD2 ASN 99 6.183 -11.584 6.010 657 H VAL 100 H VAL 100 3.231 -8.158 2.507 658 HA VAL 100 HA VAL 100 1.463 -8.591 0.215 659 HB VAL 100 HB VAL 100 2.610 -5.999 1.267 660 HG11 VAL 100 1HG1 VAL 100 2.101 -5.833 -1.112 661 HG12 VAL 100 2HG1 VAL 100 0.938 -4.912 -0.162 662 HG13 VAL 100 3HG1 VAL 100 0.488 -6.485 -0.822 663 HG21 VAL 100 3HG2 VAL 100 -0.115 -7.248 1.546 664 HG22 VAL 100 1HG2 VAL 100 0.329 -5.637 2.104 665 HG23 VAL 100 2HG2 VAL 100 1.086 -7.057 2.824 666 H VAL 101 H VAL 101 1.968 -8.518 -1.834 667 HA VAL 101 HA VAL 101 4.791 -8.003 -2.536 668 HB VAL 101 HB VAL 101 4.634 -9.567 -4.441 669 HG11 VAL 101 1HG1 VAL 101 4.796 -11.599 -3.137 670 HG12 VAL 101 2HG1 VAL 101 4.007 -10.804 -1.775 671 HG13 VAL 101 3HG1 VAL 101 5.595 -10.261 -2.314 672 HG21 VAL 101 3HG2 VAL 101 2.215 -9.527 -4.773 673 HG22 VAL 101 1HG2 VAL 101 1.988 -10.346 -3.227 674 HG23 VAL 101 2HG2 VAL 101 2.805 -11.177 -4.553 675 H ALA 102 H ALA 102 1.470 -7.447 -3.540 676 HA ALA 102 HA ALA 102 2.512 -5.314 -5.241 677 HB1 ALA 102 3HB ALA 102 1.284 -5.896 -7.177 678 HB2 ALA 102 1HB ALA 102 0.430 -7.191 -6.340 679 HB3 ALA 102 2HB ALA 102 2.151 -7.349 -6.674 680 H ILE 103 H ILE 103 1.265 -3.512 -5.337 681 HA ILE 103 HA ILE 103 -1.404 -3.659 -4.103 682 HB ILE 103 HB ILE 103 0.677 -1.543 -3.471 683 HG12 ILE 103 2HG1 ILE 103 -0.684 -3.505 -1.617 684 HG13 ILE 103 3HG1 ILE 103 0.940 -3.721 -2.268 685 HG21 ILE 103 1HG2 ILE 103 -1.013 -0.582 -1.973 686 HG22 ILE 103 2HG2 ILE 103 -2.189 -1.756 -2.567 687 HG23 ILE 103 3HG2 ILE 103 -1.522 -0.545 -3.662 688 HD11 ILE 103 3HD1 ILE 103 0.991 -2.858 0.007 689 HD12 ILE 103 1HD1 ILE 103 0.034 -1.462 -0.492 690 HD13 ILE 103 2HD1 ILE 103 1.664 -1.687 -1.129 691 H ASN 104 H ASN 104 -2.900 -2.795 -5.335 692 HA ASN 104 HA ASN 104 -2.236 -0.469 -7.026 693 HB2 ASN 104 2HB ASN 104 -2.605 -2.436 -8.454 694 HB3 ASN 104 3HB ASN 104 -4.156 -2.727 -7.676 695 HD21 ASN 104 1HD2 ASN 104 -5.269 -2.574 -9.594 696 HD22 ASN 104 2HD2 ASN 104 -5.533 -1.079 -10.416 697 H VAL 105 H VAL 105 -3.023 1.101 -5.826 698 HA VAL 105 HA VAL 105 -5.883 1.031 -5.127 699 HB VAL 105 HB VAL 105 -5.528 1.994 -2.869 700 HG11 VAL 105 1HG1 VAL 105 -5.965 -0.372 -3.103 701 HG12 VAL 105 2HG1 VAL 105 -4.832 -0.086 -1.780 702 HG13 VAL 105 3HG1 VAL 105 -4.244 -0.688 -3.330 703 HG21 VAL 105 3HG2 VAL 105 -3.287 2.921 -3.220 704 HG22 VAL 105 1HG2 VAL 105 -2.637 1.288 -3.334 705 HG23 VAL 105 2HG2 VAL 105 -3.329 1.855 -1.815 706 H GLU 106 H GLU 106 -6.972 2.882 -5.240 707 HA GLU 106 HA GLU 106 -5.486 5.403 -5.487 708 HB2 GLU 106 2HB GLU 106 -5.894 4.518 -7.760 709 HB3 GLU 106 3HB GLU 106 -7.613 4.450 -7.409 710 HG2 GLU 106 2HG GLU 106 -7.649 6.881 -7.162 711 HG3 GLU 106 3HG GLU 106 -5.926 6.941 -7.539 712 H SER 107 H SER 107 -6.523 7.131 -4.544 713 HA SER 107 HA SER 107 -9.349 6.868 -3.879 714 HB2 SER 107 2HB SER 107 -8.194 6.022 -1.919 715 HB3 SER 107 3HB SER 107 -7.183 7.466 -1.858 716 HG SER 107 HG SER 107 -9.619 7.057 -0.828 717 H GLY 108 H GLY 108 -10.445 8.770 -3.856 718 HA2 GLY 108 2HA GLY 108 -8.891 11.199 -4.450 719 HA3 GLY 108 3HA GLY 108 -10.581 10.939 -4.879 720 H ASP 109 H ASP 109 -9.988 9.697 -1.870 721 HA ASP 109 HA ASP 109 -11.354 11.942 -0.581 722 HB2 ASP 109 2HB ASP 109 -10.908 9.092 0.325 723 HB3 ASP 109 3HB ASP 109 -11.730 10.324 1.275 724 H ASP 110 H ASP 110 -8.367 11.510 -1.206 725 HA ASP 110 HA ASP 110 -6.395 12.195 -0.355 726 HB2 ASP 110 2HB ASP 110 -8.210 13.487 1.671 727 HB3 ASP 110 3HB ASP 110 -6.466 13.706 1.685 728 H GLY 111 H GLY 111 -7.678 9.631 0.584 729 HA2 GLY 111 2HA GLY 111 -6.277 7.961 1.606 730 HA3 GLY 111 3HA GLY 111 -5.677 9.195 2.688 731 H GLN 112 H GLN 112 -8.991 9.577 2.497 732 HA GLN 112 HA GLN 112 -9.461 8.677 5.128 733 HB2 GLN 112 2HB GLN 112 -10.867 10.359 3.985 734 HB3 GLN 112 3HB GLN 112 -11.452 9.116 2.893 735 HG2 GLN 112 2HG GLN 112 -12.486 7.946 4.774 736 HG3 GLN 112 3HG GLN 112 -11.900 9.198 5.867 737 HE21 GLN 112 1HE2 GLN 112 -14.623 8.365 5.291 738 HE22 GLN 112 2HE2 GLN 112 -15.453 9.772 4.736 739 H THR 113 H THR 113 -10.354 7.258 2.010 740 HA THR 113 HA THR 113 -10.239 4.599 3.200 741 HB THR 113 HB THR 113 -12.160 4.017 1.598 742 HG1 THR 113 HG1 THR 113 -12.440 5.781 0.352 743 HG21 THR 113 3HG2 THR 113 -12.476 4.088 4.025 744 HG22 THR 113 1HG2 THR 113 -13.894 4.734 3.196 745 HG23 THR 113 2HG2 THR 113 -12.738 5.831 3.951 746 H LEU 114 H LEU 114 -9.103 3.191 1.965 747 HA LEU 114 HA LEU 114 -8.246 4.124 -0.691 748 HB2 LEU 114 2HB LEU 114 -6.913 2.386 1.365 749 HB3 LEU 114 3HB LEU 114 -6.470 2.246 -0.323 750 HG LEU 114 HG LEU 114 -4.885 3.638 0.883 751 HD11 LEU 114 1HD1 LEU 114 -5.283 4.109 -1.467 752 HD12 LEU 114 2HD1 LEU 114 -4.873 5.572 -0.574 753 HD13 LEU 114 3HD1 LEU 114 -6.547 5.258 -1.031 754 HD21 LEU 114 3HD2 LEU 114 -7.225 5.459 1.441 755 HD22 LEU 114 1HD2 LEU 114 -5.534 5.817 1.785 756 HD23 LEU 114 2HD2 LEU 114 -6.346 4.498 2.629 757 H ASN 115 H ASN 115 -9.027 3.107 -2.381 758 HA ASN 115 HA ASN 115 -10.102 0.402 -1.994 759 HB2 ASN 115 2HB ASN 115 -11.189 2.696 -3.616 760 HB3 ASN 115 3HB ASN 115 -11.677 1.032 -3.912 761 HD21 ASN 115 1HD2 ASN 115 -13.202 3.367 -2.965 762 HD22 ASN 115 2HD2 ASN 115 -13.925 2.879 -1.475 763 H GLY 116 H GLY 116 -9.693 -1.130 -3.533 764 HA2 GLY 116 2HA GLY 116 -8.961 -0.838 -6.139 765 HA3 GLY 116 3HA GLY 116 -7.455 -0.592 -5.267 766 H THR 117 H THR 117 -6.352 -2.340 -5.726 767 HA THR 117 HA THR 117 -7.462 -4.918 -4.906 768 HB THR 117 HB THR 117 -6.000 -5.863 -6.865 769 HG1 THR 117 HG1 THR 117 -6.743 -3.376 -8.020 770 HG21 THR 117 3HG2 THR 117 -7.951 -5.779 -8.366 771 HG22 THR 117 1HG2 THR 117 -8.670 -4.530 -7.351 772 HG23 THR 117 2HG2 THR 117 -8.418 -6.153 -6.706 773 H MET 118 H MET 118 -5.903 -6.470 -4.286 774 HA MET 118 HA MET 118 -3.231 -5.428 -3.655 775 HB2 MET 118 2HB MET 118 -3.490 -6.299 -1.344 776 HB3 MET 118 3HB MET 118 -4.587 -4.968 -1.701 777 HG2 MET 118 2HG MET 118 -6.358 -6.661 -2.183 778 HG3 MET 118 3HG MET 118 -5.253 -7.901 -1.592 779 HE1 MET 118 3HE MET 118 -4.826 -6.870 2.131 780 HE2 MET 118 1HE MET 118 -3.829 -6.285 0.802 781 HE3 MET 118 2HE MET 118 -4.332 -7.971 0.845 782 H THR 119 H THR 119 -1.657 -7.064 -3.445 783 HA THR 119 HA THR 119 -2.603 -9.807 -3.937 784 HB THR 119 HB THR 119 -0.187 -8.552 -5.251 785 HG1 THR 119 HG1 THR 119 -2.590 -8.059 -5.879 786 HG21 THR 119 3HG2 THR 119 -1.557 -11.203 -5.728 787 HG22 THR 119 1HG2 THR 119 -0.015 -10.982 -4.900 788 HG23 THR 119 2HG2 THR 119 -0.159 -10.583 -6.612 789 H TYR 120 H TYR 120 -1.859 -11.199 -2.453 790 HA TYR 120 HA TYR 120 0.448 -10.490 -0.819 791 HB2 TYR 120 2HB TYR 120 -1.658 -12.624 -0.568 792 HB3 TYR 120 3HB TYR 120 -0.198 -12.643 0.404 793 HD1 TYR 120 HD2 TYR 120 0.239 -10.736 1.976 794 HD2 TYR 120 HD1 TYR 120 -3.499 -11.260 0.011 795 HE1 TYR 120 HE2 TYR 120 -0.830 -9.291 3.646 796 HE2 TYR 120 HE1 TYR 120 -4.580 -9.819 1.688 797 HH TYR 120 HH TYR 120 -4.219 -9.029 3.966 798 H ALA 121 H ALA 121 1.990 -12.236 -0.323 799 HA ALA 121 HA ALA 121 3.411 -12.965 -2.574 800 HB1 ALA 121 3HB ALA 121 4.363 -12.790 -0.326 801 HB2 ALA 121 1HB ALA 121 4.810 -14.299 -1.122 802 HB3 ALA 121 2HB ALA 121 3.560 -14.294 0.122 803 H GLY 122 H GLY 122 0.912 -14.877 -0.962 804 HA2 GLY 122 2HA GLY 122 1.241 -16.836 -3.120 805 HA3 GLY 122 3HA GLY 122 1.213 -17.408 -1.457 806 H GLU 123 H GLU 123 -0.746 -14.715 -2.454 807 HA GLU 123 HA GLU 123 -3.117 -16.434 -2.062 808 HB2 GLU 123 2HB GLU 123 -2.668 -14.549 -0.409 809 HB3 GLU 123 3HB GLU 123 -3.022 -13.443 -1.727 810 HG2 GLU 123 2HG GLU 123 -5.002 -13.649 -0.442 811 HG3 GLU 123 3HG GLU 123 -5.260 -14.543 -1.940 812 H GLY 124 H GLY 124 -2.021 -13.519 -3.768 813 HA2 GLY 124 2HA GLY 124 -2.254 -13.463 -6.195 814 HA3 GLY 124 3HA GLY 124 -3.805 -14.264 -5.981 815 HA PRO 125 HA PRO 125 -4.356 -9.583 -6.082 816 HB2 PRO 125 2HB PRO 125 -5.917 -10.064 -8.520 817 HB3 PRO 125 3HB PRO 125 -4.583 -8.942 -8.259 818 HG2 PRO 125 2HG PRO 125 -4.311 -11.140 -9.795 819 HG3 PRO 125 3HG PRO 125 -2.978 -10.504 -8.815 820 HD2 PRO 125 2HD PRO 125 -4.815 -12.801 -8.246 821 HD3 PRO 125 3HD PRO 125 -3.055 -12.685 -8.020 822 H ILE 126 H ILE 126 -5.856 -9.221 -4.611 823 HA ILE 126 HA ILE 126 -8.598 -10.139 -5.113 824 HB ILE 126 HB ILE 126 -8.941 -10.389 -2.666 825 HG12 ILE 126 2HG1 ILE 126 -5.931 -10.111 -2.493 826 HG13 ILE 126 3HG1 ILE 126 -7.094 -8.916 -1.933 827 HG21 ILE 126 1HG2 ILE 126 -7.754 -12.532 -2.420 828 HG22 ILE 126 2HG2 ILE 126 -6.770 -12.130 -3.827 829 HG23 ILE 126 3HG2 ILE 126 -8.509 -12.360 -4.006 830 HD11 ILE 126 3HD1 ILE 126 -6.743 -11.701 -0.856 831 HD12 ILE 126 1HD1 ILE 126 -7.950 -10.538 -0.308 832 HD13 ILE 126 2HD1 ILE 126 -6.235 -10.199 -0.083 833 H GLY 127 H GLY 127 -10.204 -8.798 -3.797 834 HA2 GLY 127 2HA GLY 127 -9.764 -6.057 -4.476 835 HA3 GLY 127 3HA GLY 127 -11.164 -6.714 -3.639 836 H PHE 128 H PHE 128 -9.202 -4.357 -3.280 837 HA PHE 128 HA PHE 128 -8.525 -4.844 -0.461 838 HB2 PHE 128 2HB PHE 128 -6.572 -4.366 -1.832 839 HB3 PHE 128 3HB PHE 128 -7.332 -2.912 -2.460 840 HD1 PHE 128 HD2 PHE 128 -5.694 -4.429 0.449 841 HD2 PHE 128 HD1 PHE 128 -7.408 -0.884 -1.152 842 HE1 PHE 128 HE2 PHE 128 -4.677 -3.123 2.266 843 HE2 PHE 128 HE1 PHE 128 -6.394 0.429 0.663 844 HZ PHE 128 HZ PHE 128 -5.028 -0.687 2.376 845 H LYS 129 H LYS 129 -9.484 -3.657 1.063 846 HA LYS 129 HA LYS 129 -10.648 -1.069 0.349 847 HB2 LYS 129 2HB LYS 129 -12.476 -2.689 0.365 848 HB3 LYS 129 3HB LYS 129 -11.981 -3.256 1.951 849 HG2 LYS 129 2HG LYS 129 -12.531 -1.072 2.899 850 HG3 LYS 129 3HG LYS 129 -13.038 -0.511 1.304 851 HD2 LYS 129 2HD LYS 129 -14.748 -2.271 1.237 852 HD3 LYS 129 3HD LYS 129 -14.246 -2.811 2.840 853 HE2 LYS 129 2HE LYS 129 -15.350 -0.099 2.146 854 HE3 LYS 129 3HE LYS 129 -16.240 -1.396 2.937 855 HZ1 LYS 129 3HZ LYS 129 -15.486 0.142 4.584 856 HZ2 LYS 129 1HZ LYS 129 -13.892 0.062 4.036 857 HZ3 LYS 129 2HZ LYS 129 -14.600 -1.286 4.774 858 H GLY 130 H GLY 130 -9.376 0.280 1.533 859 HA2 GLY 130 2HA GLY 130 -8.789 -0.528 4.310 860 HA3 GLY 130 3HA GLY 130 -7.761 0.514 3.338 861 H THR 131 H THR 131 -9.355 0.768 5.948 862 HA THR 131 HA THR 131 -10.484 3.396 5.284 863 HB THR 131 HB THR 131 -11.722 1.388 7.193 864 HG1 THR 131 HG1 THR 131 -12.009 1.852 4.511 865 HG21 THR 131 3HG2 THR 131 -13.587 2.992 7.311 866 HG22 THR 131 1HG2 THR 131 -12.692 4.111 6.283 867 HG23 THR 131 2HG2 THR 131 -12.089 3.719 7.893 868 H LEU 132 H LEU 132 -10.002 4.996 6.704 869 HA LEU 132 HA LEU 132 -7.855 4.795 8.505 870 HB2 LEU 132 2HB LEU 132 -10.106 6.801 8.447 871 HB3 LEU 132 3HB LEU 132 -8.733 6.941 9.523 872 HG LEU 132 HG LEU 132 -8.531 6.924 6.511 873 HD11 LEU 132 1HD1 LEU 132 -8.474 9.231 8.456 874 HD12 LEU 132 2HD1 LEU 132 -9.753 8.885 7.292 875 HD13 LEU 132 3HD1 LEU 132 -8.143 9.334 6.726 876 HD21 LEU 132 3HD2 LEU 132 -6.541 7.580 8.683 877 HD22 LEU 132 1HD2 LEU 132 -6.269 7.772 6.951 878 HD23 LEU 132 2HD2 LEU 132 -6.515 6.164 7.634 879 H THR 133 H THR 133 -7.629 4.071 10.520 880 HA THR 133 HA THR 133 -9.883 2.971 11.923 881 HB THR 133 HB THR 133 -8.091 2.464 13.678 882 HG1 THR 133 HG1 THR 133 -6.678 4.148 12.740 883 HG21 THR 133 3HG2 THR 133 -7.690 1.399 10.879 884 HG22 THR 133 1HG2 THR 133 -8.882 0.816 12.040 885 HG23 THR 133 2HG2 THR 133 -7.162 0.621 12.369 Start of MODEL 3 1 H1 ALA 2 1H ALA 2 0.932 5.538 10.679 2 H2 ALA 2 2H ALA 2 0.804 7.027 9.882 3 H3 ALA 2 3H ALA 2 0.671 5.582 9.009 4 HA ALA 2 HA ALA 2 -1.207 6.456 11.102 5 HB1 ALA 2 3HB ALA 2 -1.468 6.501 8.095 6 HB2 ALA 2 1HB ALA 2 -1.362 7.902 9.159 7 HB3 ALA 2 2HB ALA 2 -2.767 6.840 9.238 8 H LEU 3 H LEU 3 -2.868 5.003 11.500 9 HA LEU 3 HA LEU 3 -2.227 2.280 10.682 10 HB2 LEU 3 2HB LEU 3 -2.483 2.954 13.113 11 HB3 LEU 3 3HB LEU 3 -4.180 3.220 12.793 12 HG LEU 3 HG LEU 3 -3.666 1.069 13.950 13 HD11 LEU 3 1HD1 LEU 3 -5.101 -0.354 12.558 14 HD12 LEU 3 2HD1 LEU 3 -4.982 0.831 11.257 15 HD13 LEU 3 3HD1 LEU 3 -5.749 1.268 12.782 16 HD21 LEU 3 3HD2 LEU 3 -2.424 0.304 11.317 17 HD22 LEU 3 1HD2 LEU 3 -2.711 -0.775 12.677 18 HD23 LEU 3 2HD2 LEU 3 -1.564 0.553 12.836 19 H TYR 4 H TYR 4 -3.426 1.235 9.241 20 HA TYR 4 HA TYR 4 -6.089 2.307 8.611 21 HB2 TYR 4 2HB TYR 4 -3.974 1.152 6.816 22 HB3 TYR 4 3HB TYR 4 -5.663 1.121 6.343 23 HD1 TYR 4 HD1 TYR 4 -2.909 3.439 7.325 24 HD2 TYR 4 HD2 TYR 4 -6.657 2.985 5.365 25 HE1 TYR 4 HE1 TYR 4 -2.714 5.727 6.430 26 HE2 TYR 4 HE2 TYR 4 -6.477 5.267 4.471 27 HH TYR 4 HH TYR 4 -5.373 7.280 4.779 28 H ASN 5 H ASN 5 -7.754 0.984 8.594 29 HA ASN 5 HA ASN 5 -7.378 -1.766 9.523 30 HB2 ASN 5 2HB ASN 5 -9.756 0.036 9.227 31 HB3 ASN 5 3HB ASN 5 -10.015 -1.701 9.239 32 HD21 ASN 5 1HD2 ASN 5 -7.420 -0.270 11.057 33 HD22 ASN 5 2HD2 ASN 5 -8.119 -0.506 12.615 34 H VAL 6 H VAL 6 -7.586 -3.533 8.249 35 HA VAL 6 HA VAL 6 -8.000 -2.885 5.412 36 HB VAL 6 HB VAL 6 -6.099 -4.848 6.672 37 HG11 VAL 6 1HG1 VAL 6 -5.448 -5.501 4.393 38 HG12 VAL 6 2HG1 VAL 6 -6.763 -4.524 3.739 39 HG13 VAL 6 3HG1 VAL 6 -7.123 -5.935 4.733 40 HG21 VAL 6 3HG2 VAL 6 -5.371 -2.530 6.579 41 HG22 VAL 6 1HG2 VAL 6 -5.706 -2.479 4.851 42 HG23 VAL 6 2HG2 VAL 6 -4.432 -3.525 5.470 43 H GLU 7 H GLU 7 -9.494 -3.832 4.337 44 HA GLU 7 HA GLU 7 -10.602 -6.378 5.275 45 HB2 GLU 7 2HB GLU 7 -12.075 -4.022 4.048 46 HB3 GLU 7 3HB GLU 7 -12.804 -5.585 4.407 47 HG2 GLU 7 2HG GLU 7 -12.365 -5.276 6.775 48 HG3 GLU 7 3HG GLU 7 -11.563 -3.747 6.448 49 H ASN 8 H ASN 8 -10.869 -7.924 3.703 50 HA ASN 8 HA ASN 8 -9.913 -7.205 0.999 51 HB2 ASN 8 2HB ASN 8 -9.250 -9.619 2.675 52 HB3 ASN 8 3HB ASN 8 -8.998 -9.590 0.937 53 HD21 ASN 8 1HD2 ASN 8 -8.182 -6.759 0.952 54 HD22 ASN 8 2HD2 ASN 8 -6.590 -6.744 1.624 55 H GLN 9 H GLN 9 -10.895 -8.166 -0.746 56 HA GLN 9 HA GLN 9 -13.192 -9.924 -0.155 57 HB2 GLN 9 2HB GLN 9 -13.914 -7.649 -0.800 58 HB3 GLN 9 3HB GLN 9 -13.034 -7.818 -2.315 59 HG2 GLN 9 2HG GLN 9 -14.477 -9.725 -2.907 60 HG3 GLN 9 3HG GLN 9 -15.382 -9.470 -1.416 61 HE21 GLN 9 1HE2 GLN 9 -16.342 -9.382 -4.125 62 HE22 GLN 9 2HE2 GLN 9 -16.979 -7.792 -4.359 63 H TRP 10 H TRP 10 -13.034 -11.868 -1.099 64 HA TRP 10 HA TRP 10 -11.626 -12.066 -3.664 65 HB2 TRP 10 2HB TRP 10 -10.666 -14.252 -2.898 66 HB3 TRP 10 3HB TRP 10 -10.032 -12.857 -2.035 67 HD1 TRP 10 HD1 TRP 10 -12.323 -15.909 -1.525 68 HE1 TRP 10 HE1 TRP 10 -12.567 -16.349 0.995 69 HE3 TRP 10 HE3 TRP 10 -9.897 -11.770 0.265 70 HZ2 TRP 10 HZ2 TRP 10 -11.825 -15.113 3.426 71 HZ3 TRP 10 HZ3 TRP 10 -9.710 -11.485 2.703 72 HH2 TRP 10 HH2 TRP 10 -10.652 -13.111 4.245 73 H GLY 11 H GLY 11 -12.528 -13.467 -5.142 74 HA2 GLY 11 2HA GLY 11 -13.785 -15.483 -5.629 75 HA3 GLY 11 3HA GLY 11 -14.740 -15.166 -4.189 76 H GLY 12 H GLY 12 -14.150 -12.328 -5.923 77 HA2 GLY 12 2HA GLY 12 -15.351 -11.361 -7.717 78 HA3 GLY 12 3HA GLY 12 -16.538 -12.650 -7.583 79 H SER 13 H SER 13 -17.444 -10.158 -7.863 80 HA SER 13 HA SER 13 -17.900 -8.623 -5.605 81 HB2 SER 13 2HB SER 13 -19.810 -9.006 -7.916 82 HB3 SER 13 3HB SER 13 -19.730 -7.619 -6.827 83 HG SER 13 HG SER 13 -18.086 -6.860 -7.909 84 H SER 14 H SER 14 -19.457 -11.613 -6.562 85 HA SER 14 HA SER 14 -21.721 -11.569 -4.995 86 HB2 SER 14 2HB SER 14 -19.963 -13.962 -5.547 87 HB3 SER 14 3HB SER 14 -21.692 -13.974 -5.198 88 HG SER 14 HG SER 14 -22.035 -13.637 -7.238 89 H ALA 15 H ALA 15 -18.401 -11.896 -4.009 90 HA ALA 15 HA ALA 15 -19.133 -12.903 -1.376 91 HB1 ALA 15 3HB ALA 15 -16.415 -12.219 -2.503 92 HB2 ALA 15 1HB ALA 15 -17.145 -13.825 -2.482 93 HB3 ALA 15 2HB ALA 15 -16.730 -13.026 -0.966 94 HA PRO 16 HA PRO 16 -19.122 -8.805 0.352 95 HB2 PRO 16 2HB PRO 16 -19.124 -9.400 2.956 96 HB3 PRO 16 3HB PRO 16 -20.505 -9.799 1.932 97 HG2 PRO 16 2HG PRO 16 -18.289 -11.575 2.887 98 HG3 PRO 16 3HG PRO 16 -20.029 -11.908 2.813 99 HD2 PRO 16 2HD PRO 16 -18.223 -12.754 0.925 100 HD3 PRO 16 3HD PRO 16 -19.943 -12.483 0.591 101 H TRP 17 H TRP 17 -17.926 -7.701 2.350 102 HA TRP 17 HA TRP 17 -15.088 -7.902 1.731 103 HB2 TRP 17 2HB TRP 17 -16.667 -5.901 3.356 104 HB3 TRP 17 3HB TRP 17 -14.915 -5.848 3.189 105 HD1 TRP 17 HD1 TRP 17 -18.108 -4.947 1.386 106 HE1 TRP 17 HE1 TRP 17 -17.539 -3.753 -0.827 107 HE3 TRP 17 HE3 TRP 17 -13.074 -5.807 1.277 108 HZ2 TRP 17 HZ2 TRP 17 -15.259 -3.249 -2.404 109 HZ3 TRP 17 HZ3 TRP 17 -11.768 -4.938 -0.620 110 HH2 TRP 17 HH2 TRP 17 -12.838 -3.687 -2.421 111 H ASN 18 H ASN 18 -13.626 -8.818 3.007 112 HA ASN 18 HA ASN 18 -14.534 -9.799 5.637 113 HB2 ASN 18 2HB ASN 18 -12.454 -10.991 3.795 114 HB3 ASN 18 3HB ASN 18 -12.939 -11.647 5.352 115 HD21 ASN 18 1HD2 ASN 18 -13.798 -11.190 2.044 116 HD22 ASN 18 2HD2 ASN 18 -15.155 -12.256 2.019 117 H GLU 19 H GLU 19 -13.708 -8.575 7.191 118 HA GLU 19 HA GLU 19 -11.225 -7.180 6.988 119 HB2 GLU 19 2HB GLU 19 -13.089 -6.379 8.364 120 HB3 GLU 19 3HB GLU 19 -12.977 -7.810 9.368 121 HG2 GLU 19 2HG GLU 19 -10.746 -7.113 10.102 122 HG3 GLU 19 3HG GLU 19 -10.883 -5.667 9.099 123 H GLY 20 H GLY 20 -9.200 -8.084 7.252 124 HA2 GLY 20 2HA GLY 20 -9.047 -10.401 9.044 125 HA3 GLY 20 3HA GLY 20 -8.334 -10.456 7.440 126 H GLY 21 H GLY 21 -8.290 -7.590 9.488 127 HA2 GLY 21 2HA GLY 21 -6.290 -7.554 11.072 128 HA3 GLY 21 3HA GLY 21 -5.370 -7.883 9.616 129 H GLN 22 H GLN 22 -4.295 -5.886 10.342 130 HA GLN 22 HA GLN 22 -5.448 -3.637 8.950 131 HB2 GLN 22 2HB GLN 22 -4.873 -2.138 10.932 132 HB3 GLN 22 3HB GLN 22 -6.317 -3.127 11.075 133 HG2 GLN 22 2HG GLN 22 -4.888 -4.791 12.327 134 HG3 GLN 22 3HG GLN 22 -3.652 -3.533 12.388 135 HE21 GLN 22 1HE2 GLN 22 -4.040 -1.689 13.591 136 HE22 GLN 22 2HE2 GLN 22 -5.270 -1.616 14.806 137 H TRP 23 H TRP 23 -3.886 -1.955 8.536 138 HA TRP 23 HA TRP 23 -1.090 -2.957 8.548 139 HB2 TRP 23 2HB TRP 23 -2.500 -1.595 6.238 140 HB3 TRP 23 3HB TRP 23 -0.792 -1.991 6.289 141 HD1 TRP 23 HD1 TRP 23 -2.484 -4.918 7.675 142 HE1 TRP 23 HE1 TRP 23 -2.891 -6.704 5.863 143 HE3 TRP 23 HE3 TRP 23 -1.551 -2.086 3.533 144 HZ2 TRP 23 HZ2 TRP 23 -2.795 -6.880 3.055 145 HZ3 TRP 23 HZ3 TRP 23 -1.723 -3.146 1.317 146 HH2 TRP 23 HH2 TRP 23 -2.331 -5.481 1.092 147 H GLU 24 H GLU 24 0.397 -1.083 7.758 148 HA GLU 24 HA GLU 24 -0.644 1.458 8.791 149 HB2 GLU 24 2HB GLU 24 0.958 0.588 10.429 150 HB3 GLU 24 3HB GLU 24 2.176 0.460 9.164 151 HG2 GLU 24 2HG GLU 24 2.192 2.848 8.858 152 HG3 GLU 24 3HG GLU 24 0.865 3.032 9.998 153 H ILE 25 H ILE 25 -0.808 2.846 7.281 154 HA ILE 25 HA ILE 25 1.137 2.850 5.075 155 HB ILE 25 HB ILE 25 -1.852 3.339 4.929 156 HG12 ILE 25 2HG1 ILE 25 -0.182 1.235 3.537 157 HG13 ILE 25 3HG1 ILE 25 -1.086 0.949 5.018 158 HG21 ILE 25 1HG2 ILE 25 -1.535 3.703 2.528 159 HG22 ILE 25 2HG2 ILE 25 0.211 3.561 2.734 160 HG23 ILE 25 3HG2 ILE 25 -0.658 4.904 3.481 161 HD11 ILE 25 3HD1 ILE 25 -3.162 1.453 3.838 162 HD12 ILE 25 1HD1 ILE 25 -2.283 0.132 3.071 163 HD13 ILE 25 2HD1 ILE 25 -2.250 1.745 2.359 164 H GLY 26 H GLY 26 2.073 4.801 4.703 165 HA2 GLY 26 2HA GLY 26 2.163 7.138 4.544 166 HA3 GLY 26 3HA GLY 26 0.664 7.233 5.458 167 H SER 27 H SER 27 3.847 5.836 6.056 168 HA SER 27 HA SER 27 3.922 6.437 8.796 169 HB2 SER 27 2HB SER 27 5.396 4.756 7.756 170 HB3 SER 27 3HB SER 27 6.266 6.039 6.919 171 HG SER 27 HG SER 27 6.266 6.670 9.493 172 H ARG 28 H ARG 28 5.106 8.250 6.000 173 HA ARG 28 HA ARG 28 6.508 10.273 7.141 174 HB2 ARG 28 2HB ARG 28 6.252 10.035 4.732 175 HB3 ARG 28 3HB ARG 28 4.560 10.508 4.841 176 HG2 ARG 28 2HG ARG 28 5.222 12.705 5.638 177 HG3 ARG 28 3HG ARG 28 6.915 12.232 5.544 178 HD2 ARG 28 2HD ARG 28 6.758 11.996 3.152 179 HD3 ARG 28 3HD ARG 28 5.019 12.302 3.202 180 HE ARG 28 HE ARG 28 6.072 14.482 4.404 181 HH11 ARG 28 1HH1 ARG 28 6.719 12.953 1.304 182 HH12 ARG 28 2HH1 ARG 28 7.077 14.447 0.509 183 HH21 ARG 28 1HH2 ARG 28 6.491 16.419 3.368 184 HH22 ARG 28 2HH2 ARG 28 6.946 16.457 1.693 185 H SER 29 H SER 29 2.973 10.151 6.863 186 HA SER 29 HA SER 29 1.336 11.012 8.162 187 HB2 SER 29 2HB SER 29 3.500 12.170 9.931 188 HB3 SER 29 3HB SER 29 1.803 11.938 10.350 189 HG SER 29 HG SER 29 3.674 9.893 9.704 190 H ASP 30 H ASP 30 3.929 13.423 7.490 191 HA ASP 30 HA ASP 30 2.087 15.626 7.686 192 HB2 ASP 30 2HB ASP 30 3.876 17.071 6.991 193 HB3 ASP 30 3HB ASP 30 4.557 15.867 8.078 194 H GLN 31 H GLN 31 2.360 13.334 5.453 195 HA GLN 31 HA GLN 31 0.796 14.854 3.553 196 HB2 GLN 31 2HB GLN 31 3.534 14.571 3.045 197 HB3 GLN 31 3HB GLN 31 2.752 13.397 2.001 198 HG2 GLN 31 2HG GLN 31 2.107 16.334 2.129 199 HG3 GLN 31 3HG GLN 31 3.055 15.537 0.873 200 HE21 GLN 31 1HE2 GLN 31 0.491 17.020 0.757 201 HE22 GLN 31 2HE2 GLN 31 -0.620 15.926 0.006 202 H ASN 32 H ASN 32 -0.923 13.664 3.086 203 HA ASN 32 HA ASN 32 -0.843 10.826 3.521 204 HB2 ASN 32 2HB ASN 32 -2.755 12.139 4.332 205 HB3 ASN 32 3HB ASN 32 -3.140 12.601 2.676 206 HD21 ASN 32 1HD2 ASN 32 -3.126 10.022 5.002 207 HD22 ASN 32 2HD2 ASN 32 -4.140 8.950 4.109 208 H VAL 33 H VAL 33 -1.348 9.271 2.052 209 HA VAL 33 HA VAL 33 -0.593 9.864 -0.707 210 HB VAL 33 HB VAL 33 -0.888 7.158 0.597 211 HG11 VAL 33 1HG1 VAL 33 0.637 6.418 -1.157 212 HG12 VAL 33 2HG1 VAL 33 0.668 8.054 -1.822 213 HG13 VAL 33 3HG1 VAL 33 -0.833 7.126 -1.829 214 HG21 VAL 33 3HG2 VAL 33 1.612 8.830 0.419 215 HG22 VAL 33 1HG2 VAL 33 1.497 7.187 1.049 216 HG23 VAL 33 2HG2 VAL 33 0.692 8.508 1.888 217 H VAL 34 H VAL 34 -2.043 9.682 -2.357 218 HA VAL 34 HA VAL 34 -4.726 8.731 -1.644 219 HB VAL 34 HB VAL 34 -5.519 9.886 -3.716 220 HG11 VAL 34 1HG1 VAL 34 -5.744 10.910 -1.522 221 HG12 VAL 34 2HG1 VAL 34 -5.425 12.128 -2.756 222 HG13 VAL 34 3HG1 VAL 34 -4.135 11.609 -1.673 223 HG21 VAL 34 3HG2 VAL 34 -4.077 11.561 -4.757 224 HG22 VAL 34 1HG2 VAL 34 -3.389 9.947 -4.926 225 HG23 VAL 34 2HG2 VAL 34 -2.736 11.062 -3.725 226 H ALA 35 H ALA 35 -2.029 8.020 -3.701 227 HA ALA 35 HA ALA 35 -3.512 5.670 -4.609 228 HB1 ALA 35 3HB ALA 35 -3.712 7.361 -6.410 229 HB2 ALA 35 1HB ALA 35 -2.863 5.902 -6.912 230 HB3 ALA 35 2HB ALA 35 -1.957 7.364 -6.558 231 H ILE 36 H ILE 36 -2.233 3.869 -5.163 232 HA ILE 36 HA ILE 36 0.609 4.051 -4.597 233 HB ILE 36 HB ILE 36 -1.239 2.259 -2.995 234 HG12 ILE 36 2HG1 ILE 36 0.715 4.345 -2.017 235 HG13 ILE 36 3HG1 ILE 36 -1.010 4.635 -2.221 236 HG21 ILE 36 1HG2 ILE 36 1.777 2.334 -3.042 237 HG22 ILE 36 2HG2 ILE 36 0.747 1.027 -3.634 238 HG23 ILE 36 3HG2 ILE 36 0.791 1.401 -1.910 239 HD11 ILE 36 3HD1 ILE 36 -1.508 2.964 -0.543 240 HD12 ILE 36 1HD1 ILE 36 -0.398 4.171 0.104 241 HD13 ILE 36 2HD1 ILE 36 0.206 2.585 -0.382 242 H ASN 37 H ASN 37 1.617 2.896 -6.088 243 HA ASN 37 HA ASN 37 0.422 0.375 -7.030 244 HB2 ASN 37 2HB ASN 37 1.491 2.670 -8.626 245 HB3 ASN 37 3HB ASN 37 1.871 1.053 -9.194 246 HD21 ASN 37 1HD2 ASN 37 -1.139 1.728 -7.556 247 HD22 ASN 37 2HD2 ASN 37 -2.145 1.598 -8.957 248 H VAL 38 H VAL 38 1.750 -1.255 -6.424 249 HA VAL 38 HA VAL 38 4.628 -0.837 -6.509 250 HB VAL 38 HB VAL 38 5.017 -1.662 -4.198 251 HG11 VAL 38 1HG1 VAL 38 3.397 0.874 -4.337 252 HG12 VAL 38 2HG1 VAL 38 5.125 0.724 -4.650 253 HG13 VAL 38 3HG1 VAL 38 4.496 0.420 -3.032 254 HG21 VAL 38 3HG2 VAL 38 2.901 -2.793 -3.817 255 HG22 VAL 38 1HG2 VAL 38 2.055 -1.246 -3.878 256 HG23 VAL 38 2HG2 VAL 38 3.183 -1.579 -2.563 257 H GLU 39 H GLU 39 5.827 -2.713 -6.723 258 HA GLU 39 HA GLU 39 4.406 -5.257 -6.500 259 HB2 GLU 39 2HB GLU 39 4.254 -4.473 -8.851 260 HB3 GLU 39 3HB GLU 39 6.005 -4.399 -8.919 261 HG2 GLU 39 2HG GLU 39 6.141 -6.801 -8.585 262 HG3 GLU 39 3HG GLU 39 4.389 -6.895 -8.452 263 H SER 40 H SER 40 5.771 -7.013 -6.056 264 HA SER 40 HA SER 40 8.263 -6.300 -4.789 265 HB2 SER 40 2HB SER 40 8.273 -8.757 -4.202 266 HB3 SER 40 3HB SER 40 6.861 -7.862 -3.638 267 HG SER 40 HG SER 40 6.975 -9.420 -6.015 268 H GLY 41 H GLY 41 10.305 -6.928 -5.368 269 HA2 GLY 41 2HA GLY 41 10.665 -7.890 -8.101 270 HA3 GLY 41 3HA GLY 41 11.930 -7.291 -7.030 271 H ASP 42 H ASP 42 10.729 -9.020 -4.890 272 HA ASP 42 HA ASP 42 11.633 -11.683 -5.755 273 HB2 ASP 42 2HB ASP 42 12.410 -10.261 -3.187 274 HB3 ASP 42 3HB ASP 42 12.732 -11.955 -3.518 275 H ASP 43 H ASP 43 11.327 -12.621 -2.976 276 HA ASP 43 HA ASP 43 8.518 -13.182 -2.977 277 HB2 ASP 43 2HB ASP 43 10.622 -13.742 -0.875 278 HB3 ASP 43 3HB ASP 43 9.021 -14.466 -0.945 279 H GLY 44 H GLY 44 9.071 -10.388 -2.732 280 HA2 GLY 44 2HA GLY 44 7.926 -8.707 -1.581 281 HA3 GLY 44 3HA GLY 44 7.645 -9.832 -0.263 282 H GLN 45 H GLN 45 10.858 -10.077 -1.029 283 HA GLN 45 HA GLN 45 11.699 -8.884 1.382 284 HB2 GLN 45 2HB GLN 45 12.958 -10.679 0.237 285 HB3 GLN 45 3HB GLN 45 13.395 -9.547 -1.036 286 HG2 GLN 45 2HG GLN 45 15.229 -9.820 0.513 287 HG3 GLN 45 3HG GLN 45 14.599 -8.177 0.608 288 HE21 GLN 45 1HE2 GLN 45 15.343 -7.819 2.678 289 HE22 GLN 45 2HE2 GLN 45 14.675 -8.598 4.063 290 H THR 46 H THR 46 11.922 -7.747 -1.965 291 HA THR 46 HA THR 46 12.111 -5.035 -0.890 292 HB THR 46 HB THR 46 14.327 -5.491 -1.718 293 HG1 THR 46 HG1 THR 46 13.747 -4.135 -3.958 294 HG21 THR 46 3HG2 THR 46 13.031 -6.358 -4.308 295 HG22 THR 46 1HG2 THR 46 13.833 -7.415 -3.147 296 HG23 THR 46 2HG2 THR 46 14.768 -6.204 -4.029 297 H LEU 47 H LEU 47 10.438 -3.822 -1.489 298 HA LEU 47 HA LEU 47 8.872 -4.610 -3.826 299 HB2 LEU 47 2HB LEU 47 8.247 -2.657 -1.611 300 HB3 LEU 47 3HB LEU 47 7.148 -3.174 -2.871 301 HG LEU 47 HG LEU 47 8.239 -4.922 -0.664 302 HD11 LEU 47 1HD1 LEU 47 6.646 -3.280 0.151 303 HD12 LEU 47 2HD1 LEU 47 5.941 -4.895 0.165 304 HD13 LEU 47 3HD1 LEU 47 5.498 -3.751 -1.101 305 HD21 LEU 47 3HD2 LEU 47 6.629 -6.571 -1.469 306 HD22 LEU 47 1HD2 LEU 47 7.826 -6.187 -2.705 307 HD23 LEU 47 2HD2 LEU 47 6.204 -5.507 -2.810 308 H ASN 48 H ASN 48 8.797 -3.329 -5.616 309 HA ASN 48 HA ASN 48 9.953 -0.633 -5.394 310 HB2 ASN 48 2HB ASN 48 10.108 -2.561 -7.732 311 HB3 ASN 48 3HB ASN 48 10.641 -0.886 -7.777 312 HD21 ASN 48 1HD2 ASN 48 11.689 -1.087 -5.006 313 HD22 ASN 48 2HD2 ASN 48 13.170 -1.965 -5.157 314 H GLY 49 H GLY 49 8.662 0.989 -6.122 315 HA2 GLY 49 2HA GLY 49 6.692 0.572 -8.126 316 HA3 GLY 49 3HA GLY 49 5.962 0.559 -6.531 317 H THR 50 H THR 50 4.797 2.361 -7.397 318 HA THR 50 HA THR 50 6.264 4.868 -6.986 319 HB THR 50 HB THR 50 4.154 4.304 -9.078 320 HG1 THR 50 HG1 THR 50 6.926 4.290 -9.042 321 HG21 THR 50 3HG2 THR 50 4.620 6.568 -9.874 322 HG22 THR 50 1HG2 THR 50 5.751 6.814 -8.545 323 HG23 THR 50 2HG2 THR 50 4.035 6.601 -8.208 324 H MET 51 H MET 51 5.341 6.214 -5.490 325 HA MET 51 HA MET 51 2.593 5.669 -4.585 326 HB2 MET 51 2HB MET 51 4.998 6.949 -3.312 327 HB3 MET 51 3HB MET 51 3.388 7.271 -2.701 328 HG2 MET 51 2HG MET 51 3.093 4.948 -2.144 329 HG3 MET 51 3HG MET 51 4.640 4.526 -2.865 330 HE1 MET 51 3HE MET 51 4.316 7.942 -0.994 331 HE2 MET 51 1HE MET 51 4.437 7.454 0.692 332 HE3 MET 51 2HE MET 51 3.024 6.996 -0.264 333 H THR 52 H THR 52 1.081 7.360 -4.534 334 HA THR 52 HA THR 52 1.978 9.910 -5.708 335 HB THR 52 HB THR 52 -0.721 8.617 -6.092 336 HG1 THR 52 HG1 THR 52 0.013 8.107 -8.154 337 HG21 THR 52 3HG2 THR 52 0.515 11.053 -7.380 338 HG22 THR 52 1HG2 THR 52 -0.784 11.066 -6.186 339 HG23 THR 52 2HG2 THR 52 -1.064 10.365 -7.777 340 H TYR 53 H TYR 53 1.721 11.584 -4.416 341 HA TYR 53 HA TYR 53 0.245 11.353 -1.945 342 HB2 TYR 53 2HB TYR 53 2.004 13.502 -3.104 343 HB3 TYR 53 3HB TYR 53 1.087 13.748 -1.626 344 HD1 TYR 53 HD2 TYR 53 1.403 11.332 -0.113 345 HD2 TYR 53 HD1 TYR 53 4.240 13.281 -2.619 346 HE1 TYR 53 HE2 TYR 53 3.237 10.342 1.203 347 HE2 TYR 53 HE1 TYR 53 6.073 12.301 -1.309 348 HH TYR 53 HH TYR 53 5.628 9.778 0.877 349 H ALA 54 H ALA 54 -1.209 13.060 -1.218 350 HA ALA 54 HA ALA 54 -3.371 13.406 -3.007 351 HB1 ALA 54 3HB ALA 54 -4.421 14.647 -1.223 352 HB2 ALA 54 1HB ALA 54 -2.871 14.846 -0.400 353 HB3 ALA 54 2HB ALA 54 -3.594 13.241 -0.544 354 H GLY 55 H GLY 55 -3.272 14.734 -4.770 355 HA2 GLY 55 2HA GLY 55 -3.401 16.787 -5.779 356 HA3 GLY 55 3HA GLY 55 -2.862 17.539 -4.290 357 H GLU 56 H GLU 56 -0.900 14.945 -5.354 358 HA GLU 56 HA GLU 56 0.887 16.775 -6.757 359 HB2 GLU 56 2HB GLU 56 1.649 15.116 -4.361 360 HB3 GLU 56 3HB GLU 56 2.827 15.828 -5.457 361 HG2 GLU 56 2HG GLU 56 1.962 18.044 -4.956 362 HG3 GLU 56 3HG GLU 56 0.762 17.340 -3.883 363 H GLY 57 H GLY 57 2.796 15.556 -7.709 364 HA2 GLY 57 2HA GLY 57 1.654 13.495 -9.347 365 HA3 GLY 57 3HA GLY 57 3.259 14.182 -9.503 366 HA PRO 58 HA PRO 58 3.241 9.811 -7.541 367 HB2 PRO 58 2HB PRO 58 4.259 8.921 -10.162 368 HB3 PRO 58 3HB PRO 58 2.975 8.232 -9.167 369 HG2 PRO 58 2HG PRO 58 2.417 9.522 -11.447 370 HG3 PRO 58 3HG PRO 58 1.360 9.638 -10.028 371 HD2 PRO 58 2HD PRO 58 3.408 11.577 -11.029 372 HD3 PRO 58 3HD PRO 58 1.765 11.886 -10.436 373 H ILE 59 H ILE 59 5.068 8.998 -6.637 374 HA ILE 59 HA ILE 59 7.679 9.925 -7.646 375 HB ILE 59 HB ILE 59 8.483 10.122 -5.334 376 HG12 ILE 59 2HG1 ILE 59 5.602 9.749 -4.491 377 HG13 ILE 59 3HG1 ILE 59 6.833 8.498 -4.367 378 HG21 ILE 59 1HG2 ILE 59 7.259 12.176 -4.724 379 HG22 ILE 59 2HG2 ILE 59 6.041 11.780 -5.937 380 HG23 ILE 59 3HG2 ILE 59 7.699 12.123 -6.429 381 HD11 ILE 59 3HD1 ILE 59 8.104 9.886 -2.841 382 HD12 ILE 59 1HD1 ILE 59 6.465 9.623 -2.244 383 HD13 ILE 59 2HD1 ILE 59 6.901 11.166 -2.986 384 H GLY 60 H GLY 60 9.512 8.606 -6.658 385 HA2 GLY 60 2HA GLY 60 8.998 5.845 -7.316 386 HA3 GLY 60 3HA GLY 60 10.546 6.533 -6.848 387 H PHE 61 H PHE 61 9.075 4.060 -6.006 388 HA PHE 61 HA PHE 61 9.190 4.511 -3.100 389 HB2 PHE 61 2HB PHE 61 6.856 4.318 -3.641 390 HB3 PHE 61 3HB PHE 61 7.147 2.937 -4.684 391 HD1 PHE 61 HD2 PHE 61 7.565 0.720 -3.714 392 HD2 PHE 61 HD1 PHE 61 6.679 4.078 -1.262 393 HE1 PHE 61 HE2 PHE 61 7.056 -0.788 -1.840 394 HE2 PHE 61 HE1 PHE 61 6.167 2.576 0.612 395 HZ PHE 61 HZ PHE 61 6.350 0.141 0.323 396 H ARG 62 H ARG 62 10.604 3.212 -2.107 397 HA ARG 62 HA ARG 62 11.041 0.515 -3.164 398 HB2 ARG 62 2HB ARG 62 12.921 1.950 -3.896 399 HB3 ARG 62 3HB ARG 62 13.241 2.374 -2.219 400 HG2 ARG 62 2HG ARG 62 13.755 0.023 -1.736 401 HG3 ARG 62 3HG ARG 62 13.450 -0.381 -3.426 402 HD2 ARG 62 2HD ARG 62 15.830 -0.151 -3.066 403 HD3 ARG 62 3HD ARG 62 15.261 1.162 -4.091 404 HE ARG 62 HE ARG 62 15.625 2.672 -2.351 405 HH11 ARG 62 1HH1 ARG 62 16.508 -0.594 -1.417 406 HH12 ARG 62 2HH1 ARG 62 17.328 -0.094 0.025 407 HH21 ARG 62 1HH2 ARG 62 16.732 3.328 -0.434 408 HH22 ARG 62 2HH2 ARG 62 17.431 2.127 0.589 409 H ALA 63 H ALA 63 10.843 -0.995 -1.603 410 HA ALA 63 HA ALA 63 11.197 -0.150 1.191 411 HB1 ALA 63 3HB ALA 63 8.794 -0.068 0.593 412 HB2 ALA 63 1HB ALA 63 9.163 -1.227 1.873 413 HB3 ALA 63 2HB ALA 63 8.867 -1.794 0.230 414 H THR 64 H THR 64 11.857 -1.730 2.611 415 HA THR 64 HA THR 64 12.531 -4.338 1.423 416 HB THR 64 HB THR 64 14.197 -2.788 3.421 417 HG1 THR 64 HG1 THR 64 14.019 -2.561 0.800 418 HG21 THR 64 3HG2 THR 64 15.863 -4.559 3.047 419 HG22 THR 64 1HG2 THR 64 14.733 -5.401 1.985 420 HG23 THR 64 2HG2 THR 64 14.366 -5.226 3.703 421 H LEU 65 H LEU 65 11.819 -6.059 2.502 422 HA LEU 65 HA LEU 65 10.158 -5.745 4.801 423 HB2 LEU 65 2HB LEU 65 9.624 -7.355 3.083 424 HB3 LEU 65 3HB LEU 65 11.145 -8.184 3.341 425 HG LEU 65 HG LEU 65 10.359 -8.744 5.649 426 HD11 LEU 65 1HD1 LEU 65 7.723 -7.716 4.601 427 HD12 LEU 65 2HD1 LEU 65 8.672 -7.012 5.910 428 HD13 LEU 65 3HD1 LEU 65 7.958 -8.613 6.103 429 HD21 LEU 65 3HD2 LEU 65 10.286 -10.375 3.883 430 HD22 LEU 65 1HD2 LEU 65 8.745 -9.739 3.312 431 HD23 LEU 65 2HD2 LEU 65 8.843 -10.524 4.886 432 H LEU 66 H LEU 66 10.644 -5.938 6.878 433 HA LEU 66 HA LEU 66 13.328 -6.660 7.692 434 HB2 LEU 66 2HB LEU 66 10.924 -5.952 9.379 435 HB3 LEU 66 3HB LEU 66 12.577 -6.076 9.941 436 HG LEU 66 HG LEU 66 11.548 -4.026 7.983 437 HD11 LEU 66 1HD1 LEU 66 12.364 -3.740 10.867 438 HD12 LEU 66 2HD1 LEU 66 10.719 -3.658 10.237 439 HD13 LEU 66 3HD1 LEU 66 11.898 -2.431 9.782 440 HD21 LEU 66 3HD2 LEU 66 13.753 -2.984 8.269 441 HD22 LEU 66 1HD2 LEU 66 13.867 -4.591 7.550 442 HD23 LEU 66 2HD2 LEU 66 14.262 -4.358 9.252 443 H GLY 67 H GLY 67 10.310 -8.196 7.324 444 HA2 GLY 67 2HA GLY 67 10.243 -10.625 7.246 445 HA3 GLY 67 3HA GLY 67 11.394 -10.647 8.571 446 H ASN 68 H ASN 68 9.534 -8.296 9.468 447 HA ASN 68 HA ASN 68 7.660 -10.040 10.949 448 HB2 ASN 68 2HB ASN 68 7.649 -8.350 12.736 449 HB3 ASN 68 3HB ASN 68 9.279 -8.925 12.415 450 HD21 ASN 68 1HD2 ASN 68 8.468 -6.486 13.698 451 HD22 ASN 68 2HD2 ASN 68 9.110 -5.186 12.759 452 H ASN 69 H ASN 69 7.121 -9.064 8.345 453 HA ASN 69 HA ASN 69 5.426 -8.192 7.099 454 HB2 ASN 69 2HB ASN 69 4.100 -7.853 9.804 455 HB3 ASN 69 3HB ASN 69 3.287 -7.551 8.270 456 HD21 ASN 69 1HD2 ASN 69 2.787 -9.522 10.422 457 HD22 ASN 69 2HD2 ASN 69 2.802 -11.060 9.638 458 H SER 70 H SER 70 7.444 -6.496 8.801 459 HA SER 70 HA SER 70 6.219 -3.896 8.265 460 HB2 SER 70 2HB SER 70 8.649 -4.461 9.968 461 HB3 SER 70 3HB SER 70 7.694 -2.978 9.908 462 HG SER 70 HG SER 70 6.498 -5.429 10.621 463 H TYR 71 H TYR 71 7.095 -2.593 6.795 464 HA TYR 71 HA TYR 71 9.568 -3.490 5.475 465 HB2 TYR 71 2HB TYR 71 7.158 -2.041 4.370 466 HB3 TYR 71 3HB TYR 71 8.670 -2.213 3.495 467 HD1 TYR 71 HD1 TYR 71 5.757 -4.038 4.849 468 HD2 TYR 71 HD2 TYR 71 9.228 -4.246 2.399 469 HE1 TYR 71 HE1 TYR 71 4.971 -6.184 3.924 470 HE2 TYR 71 HE2 TYR 71 8.451 -6.386 1.470 471 HH TYR 71 HH TYR 71 5.436 -7.470 1.599 472 H GLU 72 H GLU 72 11.225 -2.098 5.380 473 HA GLU 72 HA GLU 72 10.882 0.571 6.476 474 HB2 GLU 72 2HB GLU 72 12.898 -0.783 7.043 475 HB3 GLU 72 3HB GLU 72 13.349 -0.779 5.344 476 HG2 GLU 72 2HG GLU 72 13.630 1.627 5.397 477 HG3 GLU 72 3HG GLU 72 13.099 1.672 7.076 478 H VAL 73 H VAL 73 10.381 2.232 5.203 479 HA VAL 73 HA VAL 73 10.517 1.772 2.310 480 HB VAL 73 HB VAL 73 8.627 3.433 3.973 481 HG11 VAL 73 1HG1 VAL 73 7.488 4.010 1.877 482 HG12 VAL 73 2HG1 VAL 73 8.789 3.238 0.968 483 HG13 VAL 73 3HG1 VAL 73 9.123 4.669 1.942 484 HG21 VAL 73 3HG2 VAL 73 6.930 1.927 3.061 485 HG22 VAL 73 1HG2 VAL 73 8.170 1.039 3.943 486 HG23 VAL 73 2HG2 VAL 73 8.180 1.052 2.180 487 H GLU 74 H GLU 74 11.490 3.090 1.000 488 HA GLU 74 HA GLU 74 12.343 5.729 1.893 489 HB2 GLU 74 2HB GLU 74 14.071 3.696 0.457 490 HB3 GLU 74 3HB GLU 74 14.464 5.405 0.559 491 HG2 GLU 74 2HG GLU 74 14.524 5.213 3.018 492 HG3 GLU 74 3HG GLU 74 14.215 3.486 2.869 493 H ASN 75 H ASN 75 11.974 7.250 0.376 494 HA ASN 75 HA ASN 75 10.852 6.280 -2.173 495 HB2 ASN 75 2HB ASN 75 9.809 8.469 -0.395 496 HB3 ASN 75 3HB ASN 75 9.340 8.317 -2.088 497 HD21 ASN 75 1HD2 ASN 75 7.695 8.136 0.265 498 HD22 ASN 75 2HD2 ASN 75 6.962 6.566 0.223 499 H GLN 76 H GLN 76 10.815 7.811 -3.904 500 HA GLN 76 HA GLN 76 13.161 9.595 -3.819 501 HB2 GLN 76 2HB GLN 76 13.420 7.504 -5.167 502 HB3 GLN 76 3HB GLN 76 12.113 8.064 -6.197 503 HG2 GLN 76 2HG GLN 76 13.442 10.030 -6.799 504 HG3 GLN 76 3HG GLN 76 14.757 9.434 -5.789 505 HE21 GLN 76 1HE2 GLN 76 16.214 9.183 -7.393 506 HE22 GLN 76 2HE2 GLN 76 16.061 8.028 -8.674 507 H TRP 77 H TRP 77 12.546 11.652 -3.953 508 HA TRP 77 HA TRP 77 10.284 12.349 -5.674 509 HB2 TRP 77 2HB TRP 77 9.462 13.952 -3.912 510 HB3 TRP 77 3HB TRP 77 9.269 12.252 -3.512 511 HD1 TRP 77 HD1 TRP 77 11.897 15.035 -2.765 512 HE1 TRP 77 HE1 TRP 77 12.639 14.782 -0.320 513 HE3 TRP 77 HE3 TRP 77 9.168 10.900 -1.506 514 HZ2 TRP 77 HZ2 TRP 77 12.129 13.072 1.861 515 HZ3 TRP 77 HZ3 TRP 77 9.346 10.027 0.789 516 HH2 TRP 77 HH2 TRP 77 10.797 11.088 2.432 517 H GLY 78 H GLY 78 13.021 12.629 -6.213 518 HA2 GLY 78 2HA GLY 78 13.222 15.569 -6.284 519 HA3 GLY 78 3HA GLY 78 14.613 14.618 -5.788 520 H GLY 79 H GLY 79 13.270 12.690 -7.988 521 HA2 GLY 79 2HA GLY 79 13.271 13.130 -10.458 522 HA3 GLY 79 3HA GLY 79 14.850 13.864 -10.173 523 H ASP 80 H ASP 80 14.457 11.576 -11.931 524 HA ASP 80 HA ASP 80 14.824 9.132 -10.754 525 HB2 ASP 80 2HB ASP 80 15.965 10.096 -13.378 526 HB3 ASP 80 3HB ASP 80 15.669 8.425 -12.923 527 H SER 81 H SER 81 17.257 11.545 -11.622 528 HA SER 81 HA SER 81 19.446 9.795 -11.008 529 HB2 SER 81 2HB SER 81 20.739 12.007 -11.348 530 HB3 SER 81 3HB SER 81 19.911 11.284 -12.728 531 HG SER 81 HG SER 81 19.015 13.178 -12.867 532 H ALA 82 H ALA 82 17.369 11.502 -9.071 533 HA ALA 82 HA ALA 82 19.328 12.460 -7.179 534 HB1 ALA 82 3HB ALA 82 17.414 13.213 -5.869 535 HB2 ALA 82 1HB ALA 82 16.321 12.369 -6.965 536 HB3 ALA 82 2HB ALA 82 17.276 13.733 -7.548 537 HA PRO 83 HA PRO 83 19.528 8.810 -4.661 538 HB2 PRO 83 2HB PRO 83 19.718 10.556 -2.296 539 HB3 PRO 83 3HB PRO 83 20.910 9.434 -2.953 540 HG2 PRO 83 2HG PRO 83 21.226 12.096 -3.117 541 HG3 PRO 83 3HG PRO 83 21.788 11.004 -4.395 542 HD2 PRO 83 2HD PRO 83 19.334 12.715 -4.305 543 HD3 PRO 83 3HD PRO 83 20.449 12.396 -5.652 544 H TRP 84 H TRP 84 18.417 7.694 -2.880 545 HA TRP 84 HA TRP 84 15.623 8.379 -2.830 546 HB2 TRP 84 2HB TRP 84 17.175 6.078 -1.614 547 HB3 TRP 84 3HB TRP 84 15.427 6.254 -1.541 548 HD1 TRP 84 HD1 TRP 84 18.237 5.605 -4.095 549 HE1 TRP 84 HE1 TRP 84 17.205 4.404 -6.127 550 HE3 TRP 84 HE3 TRP 84 13.313 5.825 -2.760 551 HZ2 TRP 84 HZ2 TRP 84 14.650 3.653 -7.040 552 HZ3 TRP 84 HZ3 TRP 84 11.636 4.840 -4.267 553 HH2 TRP 84 HH2 TRP 84 12.290 3.779 -6.359 554 H HIS 85 H HIS 85 14.441 8.832 -0.965 555 HA HIS 85 HA HIS 85 16.047 9.675 1.360 556 HB2 HIS 85 2HB HIS 85 13.550 10.950 0.228 557 HB3 HIS 85 3HB HIS 85 14.270 11.391 1.770 558 HD1 HIS 85 HD1 HIS 85 16.429 12.808 1.707 559 HD2 HIS 85 HD2 HIS 85 14.908 11.872 -2.043 560 HE1 HIS 85 HE1 HIS 85 17.689 14.253 0.097 561 H SER 86 H SER 86 15.183 9.304 3.391 562 HA SER 86 HA SER 86 13.790 6.889 3.668 563 HB2 SER 86 2HB SER 86 14.106 9.017 5.783 564 HB3 SER 86 3HB SER 86 13.873 7.287 6.031 565 HG SER 86 HG SER 86 15.979 7.628 4.437 566 H GLY 87 H GLY 87 11.744 6.376 3.920 567 HA2 GLY 87 2HA GLY 87 9.751 8.548 3.810 568 HA3 GLY 87 3HA GLY 87 9.486 6.899 3.262 569 H GLY 88 H GLY 88 10.287 5.363 5.314 570 HA2 GLY 88 2HA GLY 88 10.034 5.810 7.898 571 HA3 GLY 88 3HA GLY 88 8.372 6.075 7.397 572 H ASN 89 H ASN 89 7.975 4.304 8.895 573 HA ASN 89 HA ASN 89 8.641 1.672 7.778 574 HB2 ASN 89 2HB ASN 89 7.711 2.483 10.541 575 HB3 ASN 89 3HB ASN 89 7.890 0.813 10.015 576 HD21 ASN 89 1HD2 ASN 89 9.927 -0.046 9.760 577 HD22 ASN 89 2HD2 ASN 89 11.346 0.734 10.354 578 H TRP 90 H TRP 90 7.098 0.484 6.837 579 HA TRP 90 HA TRP 90 4.296 1.271 7.244 580 HB2 TRP 90 2HB TRP 90 5.675 0.326 4.706 581 HB3 TRP 90 3HB TRP 90 3.928 0.398 4.886 582 HD1 TRP 90 HD1 TRP 90 6.311 3.198 6.085 583 HE1 TRP 90 HE1 TRP 90 5.787 5.332 4.760 584 HE3 TRP 90 HE3 TRP 90 2.918 1.296 2.743 585 HZ2 TRP 90 HZ2 TRP 90 4.154 6.115 2.596 586 HZ3 TRP 90 HZ3 TRP 90 1.934 2.803 1.091 587 HH2 TRP 90 HH2 TRP 90 2.536 5.159 1.013 588 H ILE 91 H ILE 91 2.825 -0.424 7.454 589 HA ILE 91 HA ILE 91 4.071 -3.075 7.887 590 HB ILE 91 HB ILE 91 1.423 -2.060 8.971 591 HG12 ILE 91 2HG1 ILE 91 3.291 -0.850 10.016 592 HG13 ILE 91 3HG1 ILE 91 2.530 -1.932 11.171 593 HG21 ILE 91 1HG2 ILE 91 1.515 -4.049 10.419 594 HG22 ILE 91 2HG2 ILE 91 2.972 -4.576 9.576 595 HG23 ILE 91 3HG2 ILE 91 1.442 -4.460 8.705 596 HD11 ILE 91 3HD1 ILE 91 4.348 -3.525 10.857 597 HD12 ILE 91 1HD1 ILE 91 4.938 -1.946 11.379 598 HD13 ILE 91 2HD1 ILE 91 5.097 -2.432 9.691 599 H LEU 92 H LEU 92 3.723 -4.427 6.160 600 HA LEU 92 HA LEU 92 1.092 -4.267 4.855 601 HB2 LEU 92 2HB LEU 92 3.743 -4.648 3.459 602 HB3 LEU 92 3HB LEU 92 2.167 -4.655 2.691 603 HG LEU 92 HG LEU 92 3.422 -2.273 4.058 604 HD11 LEU 92 1HD1 LEU 92 3.081 -2.898 1.132 605 HD12 LEU 92 2HD1 LEU 92 4.602 -2.870 2.020 606 HD13 LEU 92 3HD1 LEU 92 3.682 -1.381 1.797 607 HD21 LEU 92 3HD2 LEU 92 1.590 -1.017 2.991 608 HD22 LEU 92 1HD2 LEU 92 1.002 -2.195 4.166 609 HD23 LEU 92 2HD2 LEU 92 0.892 -2.541 2.440 610 H GLY 93 H GLY 93 0.488 -6.053 6.172 611 HA2 GLY 93 2HA GLY 93 0.464 -8.517 5.006 612 HA3 GLY 93 3HA GLY 93 1.879 -8.549 6.053 613 H SER 94 H SER 94 -1.576 -8.732 5.922 614 HA SER 94 HA SER 94 -1.761 -8.525 8.829 615 HB2 SER 94 2HB SER 94 -4.276 -8.643 8.196 616 HB3 SER 94 3HB SER 94 -3.384 -7.148 7.901 617 HG SER 94 HG SER 94 -4.731 -8.490 6.148 618 H ARG 95 H ARG 95 -1.578 -10.823 6.353 619 HA ARG 95 HA ARG 95 -3.171 -12.816 7.702 620 HB2 ARG 95 2HB ARG 95 -1.438 -12.949 5.239 621 HB3 ARG 95 3HB ARG 95 -2.268 -14.349 5.903 622 HG2 ARG 95 2HG ARG 95 -4.421 -13.223 5.577 623 HG3 ARG 95 3HG ARG 95 -3.581 -11.825 4.900 624 HD2 ARG 95 2HD ARG 95 -2.692 -13.220 3.111 625 HD3 ARG 95 3HD ARG 95 -3.495 -14.627 3.800 626 HE ARG 95 HE ARG 95 -5.322 -12.510 3.209 627 HH11 ARG 95 1HH1 ARG 95 -3.516 -15.157 1.762 628 HH12 ARG 95 2HH1 ARG 95 -4.634 -15.379 0.450 629 HH21 ARG 95 1HH2 ARG 95 -6.807 -12.822 1.429 630 HH22 ARG 95 2HH2 ARG 95 -6.475 -14.065 0.268 631 H GLU 96 H GLU 96 -0.169 -11.588 8.178 632 HA GLU 96 HA GLU 96 1.479 -12.106 9.647 633 HB2 GLU 96 2HB GLU 96 -0.220 -13.009 11.126 634 HB3 GLU 96 3HB GLU 96 -0.200 -14.542 10.260 635 HG2 GLU 96 2HG GLU 96 2.127 -14.882 10.957 636 HG3 GLU 96 3HG GLU 96 2.064 -13.367 11.857 637 H ASN 97 H ASN 97 0.438 -15.075 8.025 638 HA ASN 97 HA ASN 97 3.232 -15.918 7.801 639 HB2 ASN 97 2HB ASN 97 0.686 -17.433 7.205 640 HB3 ASN 97 3HB ASN 97 2.311 -18.106 7.185 641 HD21 ASN 97 1HD2 ASN 97 -0.361 -17.141 9.114 642 HD22 ASN 97 2HD2 ASN 97 0.258 -17.670 10.634 643 H GLN 98 H GLN 98 1.713 -13.863 6.103 644 HA GLN 98 HA GLN 98 2.786 -14.742 3.582 645 HB2 GLN 98 2HB GLN 98 0.491 -15.749 3.688 646 HB3 GLN 98 3HB GLN 98 -0.165 -14.122 3.759 647 HG2 GLN 98 2HG GLN 98 0.769 -13.637 1.574 648 HG3 GLN 98 3HG GLN 98 1.471 -15.248 1.503 649 HE21 GLN 98 1HE2 GLN 98 0.318 -15.845 -0.322 650 HE22 GLN 98 2HE2 GLN 98 -1.388 -16.144 -0.294 651 H ASN 99 H ASN 99 3.859 -13.061 2.904 652 HA ASN 99 HA ASN 99 3.432 -10.410 3.935 653 HB2 ASN 99 2HB ASN 99 5.360 -11.404 1.818 654 HB3 ASN 99 3HB ASN 99 5.417 -9.831 2.596 655 HD21 ASN 99 1HD2 ASN 99 7.341 -12.074 2.482 656 HD22 ASN 99 2HD2 ASN 99 7.713 -12.422 4.133 657 H VAL 100 H VAL 100 3.247 -8.511 2.591 658 HA VAL 100 HA VAL 100 1.462 -8.946 0.311 659 HB VAL 100 HB VAL 100 2.369 -6.367 1.604 660 HG11 VAL 100 1HG1 VAL 100 0.357 -6.818 -0.596 661 HG12 VAL 100 2HG1 VAL 100 1.907 -5.992 -0.753 662 HG13 VAL 100 3HG1 VAL 100 0.629 -5.289 0.241 663 HG21 VAL 100 3HG2 VAL 100 0.897 -7.708 2.992 664 HG22 VAL 100 1HG2 VAL 100 -0.259 -7.837 1.670 665 HG23 VAL 100 2HG2 VAL 100 0.061 -6.271 2.412 666 H VAL 101 H VAL 101 1.955 -8.630 -1.752 667 HA VAL 101 HA VAL 101 4.780 -7.958 -2.349 668 HB VAL 101 HB VAL 101 4.791 -9.474 -4.273 669 HG11 VAL 101 1HG1 VAL 101 4.059 -10.775 -1.656 670 HG12 VAL 101 2HG1 VAL 101 5.666 -10.243 -2.160 671 HG13 VAL 101 3HG1 VAL 101 4.872 -11.576 -3.002 672 HG21 VAL 101 3HG2 VAL 101 2.085 -10.347 -3.274 673 HG22 VAL 101 1HG2 VAL 101 3.019 -11.147 -4.541 674 HG23 VAL 101 2HG2 VAL 101 2.413 -9.505 -4.789 675 H ALA 102 H ALA 102 1.480 -7.453 -3.385 676 HA ALA 102 HA ALA 102 2.475 -5.249 -5.017 677 HB1 ALA 102 3HB ALA 102 1.247 -5.833 -6.987 678 HB2 ALA 102 1HB ALA 102 0.534 -7.235 -6.190 679 HB3 ALA 102 2HB ALA 102 2.262 -7.206 -6.546 680 H ILE 103 H ILE 103 1.175 -3.485 -5.006 681 HA ILE 103 HA ILE 103 -1.551 -3.803 -3.954 682 HB ILE 103 HB ILE 103 0.433 -1.686 -3.058 683 HG12 ILE 103 2HG1 ILE 103 -0.972 -3.795 -1.412 684 HG13 ILE 103 3HG1 ILE 103 0.671 -3.967 -2.019 685 HG21 ILE 103 1HG2 ILE 103 -2.472 -2.030 -2.338 686 HG22 ILE 103 2HG2 ILE 103 -1.775 -0.727 -3.296 687 HG23 ILE 103 3HG2 ILE 103 -1.358 -0.886 -1.591 688 HD11 ILE 103 3HD1 ILE 103 0.659 -3.257 0.299 689 HD12 ILE 103 1HD1 ILE 103 -0.296 -1.837 -0.124 690 HD13 ILE 103 2HD1 ILE 103 1.349 -2.009 -0.736 691 H ASN 104 H ASN 104 -2.997 -2.885 -5.240 692 HA ASN 104 HA ASN 104 -2.240 -0.512 -6.828 693 HB2 ASN 104 2HB ASN 104 -2.597 -2.632 -8.178 694 HB3 ASN 104 3HB ASN 104 -4.256 -2.643 -7.612 695 HD21 ASN 104 1HD2 ASN 104 -4.482 0.345 -7.850 696 HD22 ASN 104 2HD2 ASN 104 -4.610 0.639 -9.546 697 H VAL 105 H VAL 105 -3.108 1.046 -5.629 698 HA VAL 105 HA VAL 105 -5.994 0.920 -5.061 699 HB VAL 105 HB VAL 105 -5.714 1.902 -2.783 700 HG11 VAL 105 1HG1 VAL 105 -5.125 -0.221 -1.689 701 HG12 VAL 105 2HG1 VAL 105 -4.532 -0.828 -3.231 702 HG13 VAL 105 3HG1 VAL 105 -6.237 -0.434 -3.038 703 HG21 VAL 105 3HG2 VAL 105 -2.834 1.090 -3.143 704 HG22 VAL 105 1HG2 VAL 105 -3.566 1.656 -1.643 705 HG23 VAL 105 2HG2 VAL 105 -3.427 2.745 -3.024 706 H GLU 106 H GLU 106 -7.111 2.758 -5.182 707 HA GLU 106 HA GLU 106 -5.677 5.311 -5.286 708 HB2 GLU 106 2HB GLU 106 -5.903 4.514 -7.621 709 HB3 GLU 106 3HB GLU 106 -7.638 4.385 -7.399 710 HG2 GLU 106 2HG GLU 106 -7.803 6.781 -7.089 711 HG3 GLU 106 3HG GLU 106 -6.051 6.932 -7.224 712 H SER 107 H SER 107 -6.823 6.991 -4.398 713 HA SER 107 HA SER 107 -9.641 6.546 -3.757 714 HB2 SER 107 2HB SER 107 -8.498 5.782 -1.783 715 HB3 SER 107 3HB SER 107 -7.484 7.223 -1.752 716 HG SER 107 HG SER 107 -10.111 6.865 -0.927 717 H GLY 108 H GLY 108 -10.874 8.337 -3.714 718 HA2 GLY 108 2HA GLY 108 -9.534 10.908 -4.245 719 HA3 GLY 108 3HA GLY 108 -11.188 10.514 -4.707 720 H ASP 109 H ASP 109 -10.410 9.297 -1.692 721 HA ASP 109 HA ASP 109 -12.142 11.245 -0.366 722 HB2 ASP 109 2HB ASP 109 -10.923 8.704 0.754 723 HB3 ASP 109 3HB ASP 109 -12.226 9.650 1.462 724 H ASP 110 H ASP 110 -9.147 11.505 -1.129 725 HA ASP 110 HA ASP 110 -7.268 12.478 -0.324 726 HB2 ASP 110 2HB ASP 110 -9.202 13.415 1.802 727 HB3 ASP 110 3HB ASP 110 -7.503 13.865 1.828 728 H GLY 111 H GLY 111 -7.949 9.749 0.347 729 HA2 GLY 111 2HA GLY 111 -6.449 8.167 1.232 730 HA3 GLY 111 3HA GLY 111 -5.787 9.416 2.264 731 H GLN 112 H GLN 112 -9.129 9.483 2.511 732 HA GLN 112 HA GLN 112 -9.131 8.493 5.158 733 HB2 GLN 112 2HB GLN 112 -10.813 10.092 4.349 734 HB3 GLN 112 3HB GLN 112 -11.453 8.870 3.257 735 HG2 GLN 112 2HG GLN 112 -12.073 7.487 5.186 736 HG3 GLN 112 3HG GLN 112 -11.469 8.747 6.262 737 HE21 GLN 112 1HE2 GLN 112 -14.141 7.621 6.007 738 HE22 GLN 112 2HE2 GLN 112 -15.187 8.948 5.665 739 H THR 113 H THR 113 -10.266 7.105 2.118 740 HA THR 113 HA THR 113 -10.019 4.438 3.289 741 HB THR 113 HB THR 113 -12.064 3.879 1.751 742 HG1 THR 113 HG1 THR 113 -12.323 5.954 0.823 743 HG21 THR 113 3HG2 THR 113 -12.059 3.657 4.195 744 HG22 THR 113 1HG2 THR 113 -13.599 4.290 3.614 745 HG23 THR 113 2HG2 THR 113 -12.421 5.375 4.349 746 H LEU 114 H LEU 114 -8.613 3.310 2.143 747 HA LEU 114 HA LEU 114 -8.102 4.047 -0.643 748 HB2 LEU 114 2HB LEU 114 -6.575 2.466 1.404 749 HB3 LEU 114 3HB LEU 114 -6.227 2.252 -0.297 750 HG LEU 114 HG LEU 114 -4.637 3.781 0.754 751 HD11 LEU 114 1HD1 LEU 114 -4.799 5.634 -0.810 752 HD12 LEU 114 2HD1 LEU 114 -6.463 5.184 -1.177 753 HD13 LEU 114 3HD1 LEU 114 -5.144 4.091 -1.591 754 HD21 LEU 114 3HD2 LEU 114 -5.339 5.987 1.554 755 HD22 LEU 114 1HD2 LEU 114 -6.050 4.691 2.514 756 HD23 LEU 114 2HD2 LEU 114 -7.024 5.535 1.310 757 H ASN 115 H ASN 115 -8.961 2.922 -2.230 758 HA ASN 115 HA ASN 115 -9.832 0.170 -1.679 759 HB2 ASN 115 2HB ASN 115 -11.238 2.317 -3.279 760 HB3 ASN 115 3HB ASN 115 -11.682 0.613 -3.341 761 HD21 ASN 115 1HD2 ASN 115 -13.139 3.022 -2.411 762 HD22 ASN 115 2HD2 ASN 115 -13.637 2.646 -0.796 763 H GLY 116 H GLY 116 -9.627 -1.318 -3.339 764 HA2 GLY 116 2HA GLY 116 -9.126 -0.944 -5.979 765 HA3 GLY 116 3HA GLY 116 -7.551 -0.705 -5.241 766 H THR 117 H THR 117 -6.434 -2.421 -5.724 767 HA THR 117 HA THR 117 -7.489 -5.058 -5.016 768 HB THR 117 HB THR 117 -6.291 -5.987 -7.051 769 HG1 THR 117 HG1 THR 117 -6.192 -3.211 -7.634 770 HG21 THR 117 3HG2 THR 117 -8.742 -5.755 -6.975 771 HG22 THR 117 1HG2 THR 117 -8.111 -5.480 -8.601 772 HG23 THR 117 2HG2 THR 117 -8.595 -4.110 -7.601 773 H MET 118 H MET 118 -5.788 -6.631 -4.610 774 HA MET 118 HA MET 118 -3.092 -5.610 -4.357 775 HB2 MET 118 2HB MET 118 -2.869 -5.985 -2.018 776 HB3 MET 118 3HB MET 118 -4.241 -4.920 -2.257 777 HG2 MET 118 2HG MET 118 -5.778 -6.539 -1.673 778 HG3 MET 118 3HG MET 118 -4.668 -7.861 -2.033 779 HE1 MET 118 3HE MET 118 -1.987 -6.766 -0.527 780 HE2 MET 118 1HE MET 118 -2.584 -8.423 -0.657 781 HE3 MET 118 2HE MET 118 -2.195 -7.748 0.924 782 H THR 119 H THR 119 -1.555 -7.271 -3.815 783 HA THR 119 HA THR 119 -2.581 -9.998 -4.144 784 HB THR 119 HB THR 119 -0.142 -8.902 -5.572 785 HG1 THR 119 HG1 THR 119 -1.423 -8.674 -7.314 786 HG21 THR 119 3HG2 THR 119 -0.008 -11.296 -5.002 787 HG22 THR 119 1HG2 THR 119 -0.144 -11.048 -6.741 788 HG23 THR 119 2HG2 THR 119 -1.550 -11.567 -5.813 789 H TYR 120 H TYR 120 -1.765 -11.415 -2.733 790 HA TYR 120 HA TYR 120 0.410 -10.620 -0.948 791 HB2 TYR 120 2HB TYR 120 -1.579 -12.892 -0.865 792 HB3 TYR 120 3HB TYR 120 -0.215 -12.797 0.224 793 HD1 TYR 120 HD2 TYR 120 -0.167 -11.135 2.008 794 HD2 TYR 120 HD1 TYR 120 -3.504 -11.432 -0.614 795 HE1 TYR 120 HE2 TYR 120 -1.510 -9.807 3.578 796 HE2 TYR 120 HE1 TYR 120 -4.855 -10.110 0.959 797 HH TYR 120 HH TYR 120 -4.962 -9.274 3.065 798 H ALA 121 H ALA 121 2.011 -12.379 -0.376 799 HA ALA 121 HA ALA 121 3.397 -13.242 -2.674 800 HB1 ALA 121 3HB ALA 121 4.858 -14.443 -1.113 801 HB2 ALA 121 1HB ALA 121 3.685 -14.194 0.181 802 HB3 ALA 121 2HB ALA 121 4.513 -12.812 -0.538 803 H GLY 122 H GLY 122 2.918 -14.874 -4.004 804 HA2 GLY 122 2HA GLY 122 2.226 -16.939 -4.763 805 HA3 GLY 122 3HA GLY 122 2.294 -17.502 -3.098 806 H GLU 123 H GLU 123 0.377 -14.826 -4.290 807 HA GLU 123 HA GLU 123 -2.095 -16.347 -3.779 808 HB2 GLU 123 2HB GLU 123 -1.347 -14.832 -1.872 809 HB3 GLU 123 3HB GLU 123 -1.604 -13.477 -2.958 810 HG2 GLU 123 2HG GLU 123 -3.520 -13.583 -1.640 811 HG3 GLU 123 3HG GLU 123 -3.989 -14.315 -3.173 812 H GLY 124 H GLY 124 -3.979 -15.283 -4.818 813 HA2 GLY 124 2HA GLY 124 -3.228 -14.016 -7.346 814 HA3 GLY 124 3HA GLY 124 -4.800 -14.703 -6.957 815 HA PRO 125 HA PRO 125 -4.491 -9.959 -6.175 816 HB2 PRO 125 2HB PRO 125 -6.034 -9.162 -8.314 817 HB3 PRO 125 3HB PRO 125 -4.265 -9.183 -8.324 818 HG2 PRO 125 2HG PRO 125 -6.191 -11.197 -9.413 819 HG3 PRO 125 3HG PRO 125 -4.685 -10.581 -10.120 820 HD2 PRO 125 2HD PRO 125 -4.793 -12.976 -8.913 821 HD3 PRO 125 3HD PRO 125 -3.358 -11.936 -8.795 822 H ILE 126 H ILE 126 -5.997 -9.234 -4.835 823 HA ILE 126 HA ILE 126 -8.782 -10.096 -5.175 824 HB ILE 126 HB ILE 126 -9.025 -10.369 -2.737 825 HG12 ILE 126 2HG1 ILE 126 -6.011 -10.097 -2.646 826 HG13 ILE 126 3HG1 ILE 126 -7.150 -8.885 -2.074 827 HG21 ILE 126 1HG2 ILE 126 -6.882 -12.108 -3.952 828 HG22 ILE 126 2HG2 ILE 126 -8.626 -12.337 -4.091 829 HG23 ILE 126 3HG2 ILE 126 -7.835 -12.506 -2.523 830 HD11 ILE 126 3HD1 ILE 126 -6.385 -10.059 -0.183 831 HD12 ILE 126 1HD1 ILE 126 -6.655 -11.624 -0.951 832 HD13 ILE 126 2HD1 ILE 126 -8.026 -10.622 -0.490 833 H GLY 127 H GLY 127 -10.287 -8.747 -3.804 834 HA2 GLY 127 2HA GLY 127 -9.818 -5.990 -4.383 835 HA3 GLY 127 3HA GLY 127 -11.195 -6.651 -3.513 836 H PHE 128 H PHE 128 -9.372 -4.308 -3.072 837 HA PHE 128 HA PHE 128 -8.627 -4.952 -0.297 838 HB2 PHE 128 2HB PHE 128 -6.588 -4.665 -1.606 839 HB3 PHE 128 3HB PHE 128 -7.161 -3.117 -2.202 840 HD1 PHE 128 HD1 PHE 128 -5.930 -4.914 0.766 841 HD2 PHE 128 HD2 PHE 128 -6.964 -1.134 -0.887 842 HE1 PHE 128 HE1 PHE 128 -4.867 -3.785 2.672 843 HE2 PHE 128 HE2 PHE 128 -5.899 -0.002 1.016 844 HZ PHE 128 HZ PHE 128 -4.850 -1.330 2.803 845 H LYS 129 H LYS 129 -9.336 -3.637 1.257 846 HA LYS 129 HA LYS 129 -10.339 -0.992 0.575 847 HB2 LYS 129 2HB LYS 129 -12.303 -2.414 0.581 848 HB3 LYS 129 3HB LYS 129 -11.825 -3.128 2.110 849 HG2 LYS 129 2HG LYS 129 -12.182 -1.009 3.239 850 HG3 LYS 129 3HG LYS 129 -12.611 -0.251 1.705 851 HD2 LYS 129 2HD LYS 129 -14.507 -1.779 1.476 852 HD3 LYS 129 3HD LYS 129 -14.076 -2.549 3.004 853 HE2 LYS 129 2HE LYS 129 -14.781 0.360 2.690 854 HE3 LYS 129 3HE LYS 129 -15.916 -0.889 3.197 855 HZ1 LYS 129 3HZ LYS 129 -13.472 -0.012 4.642 856 HZ2 LYS 129 1HZ LYS 129 -14.375 -1.380 5.059 857 HZ3 LYS 129 2HZ LYS 129 -15.074 0.157 5.145 858 H GLY 130 H GLY 130 -9.268 0.389 1.862 859 HA2 GLY 130 2HA GLY 130 -8.581 -0.534 4.586 860 HA3 GLY 130 3HA GLY 130 -7.478 0.423 3.607 861 H THR 131 H THR 131 -9.001 0.825 6.237 862 HA THR 131 HA THR 131 -10.057 3.486 5.542 863 HB THR 131 HB THR 131 -11.070 1.649 7.731 864 HG1 THR 131 HG1 THR 131 -11.676 1.945 5.085 865 HG21 THR 131 3HG2 THR 131 -11.293 4.015 8.331 866 HG22 THR 131 1HG2 THR 131 -12.874 3.330 7.951 867 HG23 THR 131 2HG2 THR 131 -12.051 4.354 6.772 868 H LEU 132 H LEU 132 -9.169 5.159 6.575 869 HA LEU 132 HA LEU 132 -6.857 4.818 8.179 870 HB2 LEU 132 2HB LEU 132 -7.204 6.717 6.644 871 HB3 LEU 132 3HB LEU 132 -8.515 7.291 7.647 872 HG LEU 132 HG LEU 132 -6.241 8.484 7.786 873 HD11 LEU 132 1HD1 LEU 132 -7.556 7.563 10.329 874 HD12 LEU 132 2HD1 LEU 132 -8.064 8.924 9.330 875 HD13 LEU 132 3HD1 LEU 132 -6.505 8.968 10.155 876 HD21 LEU 132 3HD2 LEU 132 -5.632 6.070 9.484 877 HD22 LEU 132 1HD2 LEU 132 -4.668 7.544 9.408 878 HD23 LEU 132 2HD2 LEU 132 -4.828 6.523 7.978 879 H THR 133 H THR 133 -6.828 4.212 10.237 880 HA THR 133 HA THR 133 -8.986 4.953 12.020 881 HB THR 133 HB THR 133 -6.569 3.222 12.585 882 HG1 THR 133 HG1 THR 133 -8.620 2.801 10.930 883 HG21 THR 133 3HG2 THR 133 -7.808 4.004 14.567 884 HG22 THR 133 1HG2 THR 133 -8.013 2.270 14.326 885 HG23 THR 133 2HG2 THR 133 -9.305 3.379 13.871 Start of MODEL 4 1 H1 ALA 2 1H ALA 2 0.324 6.468 9.728 2 H2 ALA 2 2H ALA 2 -0.021 7.939 8.980 3 H3 ALA 2 3H ALA 2 -0.080 6.497 8.088 4 HA ALA 2 HA ALA 2 -1.875 7.227 10.314 5 HB1 ALA 2 3HB ALA 2 -2.342 8.490 8.278 6 HB2 ALA 2 1HB ALA 2 -3.617 7.315 8.599 7 HB3 ALA 2 2HB ALA 2 -2.407 6.988 7.357 8 H LEU 3 H LEU 3 -3.192 5.607 11.037 9 HA LEU 3 HA LEU 3 -2.404 2.924 10.258 10 HB2 LEU 3 2HB LEU 3 -2.623 3.771 12.662 11 HB3 LEU 3 3HB LEU 3 -4.353 3.713 12.427 12 HG LEU 3 HG LEU 3 -3.439 1.766 13.674 13 HD11 LEU 3 1HD1 LEU 3 -4.630 0.021 12.442 14 HD12 LEU 3 2HD1 LEU 3 -4.716 1.092 11.038 15 HD13 LEU 3 3HD1 LEU 3 -5.544 1.528 12.530 16 HD21 LEU 3 3HD2 LEU 3 -2.114 1.077 11.057 17 HD22 LEU 3 1HD2 LEU 3 -2.187 0.047 12.486 18 HD23 LEU 3 2HD2 LEU 3 -1.299 1.570 12.542 19 H TYR 4 H TYR 4 -3.556 1.640 9.004 20 HA TYR 4 HA TYR 4 -6.266 2.490 8.259 21 HB2 TYR 4 2HB TYR 4 -4.094 1.193 6.621 22 HB3 TYR 4 3HB TYR 4 -5.780 1.134 6.138 23 HD1 TYR 4 HD1 TYR 4 -2.959 3.438 6.824 24 HD2 TYR 4 HD2 TYR 4 -6.791 2.958 5.046 25 HE1 TYR 4 HE1 TYR 4 -2.708 5.611 5.703 26 HE2 TYR 4 HE2 TYR 4 -6.552 5.126 3.926 27 HH TYR 4 HH TYR 4 -3.586 6.804 3.790 28 H ASN 5 H ASN 5 -7.838 1.035 8.245 29 HA ASN 5 HA ASN 5 -7.300 -1.599 9.383 30 HB2 ASN 5 2HB ASN 5 -9.161 -0.152 10.288 31 HB3 ASN 5 3HB ASN 5 -9.952 -0.274 8.721 32 HD21 ASN 5 1HD2 ASN 5 -9.057 -1.931 11.622 33 HD22 ASN 5 2HD2 ASN 5 -10.076 -3.316 11.392 34 H VAL 6 H VAL 6 -7.671 -3.485 8.154 35 HA VAL 6 HA VAL 6 -8.021 -2.868 5.296 36 HB VAL 6 HB VAL 6 -6.224 -4.906 6.604 37 HG11 VAL 6 1HG1 VAL 6 -5.576 -5.607 4.339 38 HG12 VAL 6 2HG1 VAL 6 -6.857 -4.599 3.666 39 HG13 VAL 6 3HG1 VAL 6 -7.266 -5.977 4.686 40 HG21 VAL 6 3HG2 VAL 6 -5.692 -2.584 4.761 41 HG22 VAL 6 1HG2 VAL 6 -4.480 -3.689 5.409 42 HG23 VAL 6 2HG2 VAL 6 -5.380 -2.636 6.499 43 H GLU 7 H GLU 7 -9.560 -3.766 4.231 44 HA GLU 7 HA GLU 7 -10.836 -6.197 5.261 45 HB2 GLU 7 2HB GLU 7 -12.069 -3.917 3.692 46 HB3 GLU 7 3HB GLU 7 -12.898 -5.402 4.135 47 HG2 GLU 7 2HG GLU 7 -12.646 -4.864 6.486 48 HG3 GLU 7 3HG GLU 7 -11.775 -3.391 6.073 49 H ASN 8 H ASN 8 -10.978 -7.891 3.897 50 HA ASN 8 HA ASN 8 -9.800 -7.537 1.216 51 HB2 ASN 8 2HB ASN 8 -9.941 -10.024 2.923 52 HB3 ASN 8 3HB ASN 8 -9.173 -9.899 1.347 53 HD21 ASN 8 1HD2 ASN 8 -8.061 -7.229 1.975 54 HD22 ASN 8 2HD2 ASN 8 -6.756 -7.534 3.064 55 H GLN 9 H GLN 9 -10.971 -8.081 -0.529 56 HA GLN 9 HA GLN 9 -13.424 -9.666 -0.115 57 HB2 GLN 9 2HB GLN 9 -14.008 -7.414 -0.746 58 HB3 GLN 9 3HB GLN 9 -12.886 -7.451 -2.096 59 HG2 GLN 9 2HG GLN 9 -14.250 -9.140 -3.201 60 HG3 GLN 9 3HG GLN 9 -15.364 -9.150 -1.834 61 HE21 GLN 9 1HE2 GLN 9 -16.822 -7.506 -1.612 62 HE22 GLN 9 2HE2 GLN 9 -17.084 -6.310 -2.828 63 H TRP 10 H TRP 10 -13.182 -11.637 -0.879 64 HA TRP 10 HA TRP 10 -11.531 -12.015 -3.272 65 HB2 TRP 10 2HB TRP 10 -11.488 -14.478 -2.401 66 HB3 TRP 10 3HB TRP 10 -10.432 -13.277 -1.666 67 HD1 TRP 10 HD1 TRP 10 -13.844 -14.996 -0.962 68 HE1 TRP 10 HE1 TRP 10 -14.146 -15.142 1.590 69 HE3 TRP 10 HE3 TRP 10 -9.652 -12.476 0.493 70 HZ2 TRP 10 HZ2 TRP 10 -12.772 -14.306 3.916 71 HZ3 TRP 10 HZ3 TRP 10 -9.216 -12.193 2.891 72 HH2 TRP 10 HH2 TRP 10 -10.744 -13.079 4.569 73 H GLY 11 H GLY 11 -12.165 -14.245 -4.282 74 HA2 GLY 11 2HA GLY 11 -13.696 -15.343 -5.664 75 HA3 GLY 11 3HA GLY 11 -14.936 -14.855 -4.522 76 H GLY 12 H GLY 12 -15.589 -12.466 -4.708 77 HA2 GLY 12 2HA GLY 12 -15.281 -11.220 -7.272 78 HA3 GLY 12 3HA GLY 12 -16.842 -12.014 -7.106 79 H SER 13 H SER 13 -16.777 -9.345 -7.525 80 HA SER 13 HA SER 13 -16.679 -7.718 -5.252 81 HB2 SER 13 2HB SER 13 -16.624 -6.862 -7.572 82 HB3 SER 13 3HB SER 13 -18.326 -7.289 -7.754 83 HG SER 13 HG SER 13 -17.835 -5.783 -5.534 84 H SER 14 H SER 14 -19.135 -9.962 -6.222 85 HA SER 14 HA SER 14 -21.250 -8.713 -4.776 86 HB2 SER 14 2HB SER 14 -22.401 -10.928 -5.159 87 HB3 SER 14 3HB SER 14 -21.852 -10.104 -6.620 88 HG SER 14 HG SER 14 -20.893 -12.423 -5.389 89 H ALA 15 H ALA 15 -18.529 -10.307 -3.747 90 HA ALA 15 HA ALA 15 -19.737 -11.626 -1.467 91 HB1 ALA 15 3HB ALA 15 -17.472 -12.307 -0.907 92 HB2 ALA 15 1HB ALA 15 -16.819 -11.242 -2.154 93 HB3 ALA 15 2HB ALA 15 -17.801 -12.638 -2.607 94 HA PRO 16 HA PRO 16 -19.386 -8.174 1.284 95 HB2 PRO 16 2HB PRO 16 -19.018 -9.443 3.654 96 HB3 PRO 16 3HB PRO 16 -20.573 -9.445 2.811 97 HG2 PRO 16 2HG PRO 16 -18.435 -11.548 2.829 98 HG3 PRO 16 3HG PRO 16 -20.187 -11.739 3.035 99 HD2 PRO 16 2HD PRO 16 -18.984 -12.209 0.670 100 HD3 PRO 16 3HD PRO 16 -20.604 -11.491 0.761 101 H TRP 17 H TRP 17 -17.926 -7.136 2.769 102 HA TRP 17 HA TRP 17 -15.153 -7.628 2.029 103 HB2 TRP 17 2HB TRP 17 -16.465 -5.390 3.588 104 HB3 TRP 17 3HB TRP 17 -14.733 -5.488 3.285 105 HD1 TRP 17 HD1 TRP 17 -17.999 -4.526 1.634 106 HE1 TRP 17 HE1 TRP 17 -17.523 -3.542 -0.690 107 HE3 TRP 17 HE3 TRP 17 -13.030 -5.688 1.279 108 HZ2 TRP 17 HZ2 TRP 17 -15.311 -3.291 -2.455 109 HZ3 TRP 17 HZ3 TRP 17 -11.809 -5.040 -0.752 110 HH2 TRP 17 HH2 TRP 17 -12.931 -3.870 -2.581 111 H ASN 18 H ASN 18 -13.770 -8.684 3.298 112 HA ASN 18 HA ASN 18 -14.689 -9.313 6.013 113 HB2 ASN 18 2HB ASN 18 -13.030 -10.936 4.080 114 HB3 ASN 18 3HB ASN 18 -13.262 -11.368 5.771 115 HD21 ASN 18 1HD2 ASN 18 -14.070 -12.694 3.226 116 HD22 ASN 18 2HD2 ASN 18 -15.771 -12.959 3.376 117 H GLU 19 H GLU 19 -13.631 -8.258 7.490 118 HA GLU 19 HA GLU 19 -11.115 -6.997 7.047 119 HB2 GLU 19 2HB GLU 19 -12.868 -6.115 8.552 120 HB3 GLU 19 3HB GLU 19 -12.642 -7.501 9.601 121 HG2 GLU 19 2HG GLU 19 -10.357 -6.769 10.083 122 HG3 GLU 19 3HG GLU 19 -10.585 -5.378 9.024 123 H GLY 20 H GLY 20 -9.123 -7.933 7.234 124 HA2 GLY 20 2HA GLY 20 -8.879 -10.243 9.027 125 HA3 GLY 20 3HA GLY 20 -8.355 -10.375 7.355 126 H GLY 21 H GLY 21 -7.955 -7.365 9.069 127 HA2 GLY 21 2HA GLY 21 -5.668 -7.573 10.409 128 HA3 GLY 21 3HA GLY 21 -5.099 -7.631 8.751 129 H GLN 22 H GLN 22 -3.982 -5.702 9.692 130 HA GLN 22 HA GLN 22 -5.374 -3.366 8.756 131 HB2 GLN 22 2HB GLN 22 -4.847 -2.046 10.775 132 HB3 GLN 22 3HB GLN 22 -5.994 -3.333 11.110 133 HG2 GLN 22 2HG GLN 22 -4.136 -4.686 12.016 134 HG3 GLN 22 3HG GLN 22 -3.055 -3.315 11.759 135 HE21 GLN 22 1HE2 GLN 22 -3.430 -1.430 12.939 136 HE22 GLN 22 2HE2 GLN 22 -4.228 -1.478 14.475 137 H TRP 23 H TRP 23 -3.957 -1.726 8.120 138 HA TRP 23 HA TRP 23 -1.112 -2.506 8.054 139 HB2 TRP 23 2HB TRP 23 -2.759 -1.278 5.839 140 HB3 TRP 23 3HB TRP 23 -1.008 -1.410 5.802 141 HD1 TRP 23 HD1 TRP 23 -2.249 -4.512 7.297 142 HE1 TRP 23 HE1 TRP 23 -2.415 -6.395 5.569 143 HE3 TRP 23 HE3 TRP 23 -1.759 -1.724 3.052 144 HZ2 TRP 23 HZ2 TRP 23 -2.317 -6.665 2.749 145 HZ3 TRP 23 HZ3 TRP 23 -1.793 -2.868 0.884 146 HH2 TRP 23 HH2 TRP 23 -2.070 -5.282 0.734 147 H GLU 24 H GLU 24 0.368 -0.722 7.775 148 HA GLU 24 HA GLU 24 -0.818 1.807 8.664 149 HB2 GLU 24 2HB GLU 24 0.584 0.795 10.438 150 HB3 GLU 24 3HB GLU 24 1.960 0.820 9.339 151 HG2 GLU 24 2HG GLU 24 1.927 3.230 9.280 152 HG3 GLU 24 3HG GLU 24 0.457 3.268 10.248 153 H ILE 25 H ILE 25 -0.644 3.394 7.319 154 HA ILE 25 HA ILE 25 1.377 3.263 5.190 155 HB ILE 25 HB ILE 25 -1.568 3.877 4.848 156 HG12 ILE 25 2HG1 ILE 25 0.112 1.712 3.564 157 HG13 ILE 25 3HG1 ILE 25 -0.926 1.464 4.961 158 HG21 ILE 25 1HG2 ILE 25 -1.055 4.193 2.452 159 HG22 ILE 25 2HG2 ILE 25 0.667 4.087 2.837 160 HG23 ILE 25 3HG2 ILE 25 -0.303 5.412 3.483 161 HD11 ILE 25 3HD1 ILE 25 -1.849 2.345 2.236 162 HD12 ILE 25 1HD1 ILE 25 -2.870 2.048 3.641 163 HD13 ILE 25 2HD1 ILE 25 -1.983 0.715 2.902 164 H GLY 26 H GLY 26 2.326 5.183 4.758 165 HA2 GLY 26 2HA GLY 26 2.530 7.514 4.692 166 HA3 GLY 26 3HA GLY 26 1.056 7.639 5.644 167 H SER 27 H SER 27 4.321 6.514 5.878 168 HA SER 27 HA SER 27 4.621 6.661 8.675 169 HB2 SER 27 2HB SER 27 6.289 5.658 6.994 170 HB3 SER 27 3HB SER 27 6.889 7.302 6.784 171 HG SER 27 HG SER 27 6.674 6.785 9.392 172 H ARG 28 H ARG 28 5.059 9.064 6.159 173 HA ARG 28 HA ARG 28 5.602 11.197 8.022 174 HB2 ARG 28 2HB ARG 28 6.567 11.152 5.730 175 HB3 ARG 28 3HB ARG 28 4.947 11.226 5.062 176 HG2 ARG 28 2HG ARG 28 4.636 13.433 6.045 177 HG3 ARG 28 3HG ARG 28 6.270 13.367 6.718 178 HD2 ARG 28 2HD ARG 28 7.136 13.083 4.407 179 HD3 ARG 28 3HD ARG 28 5.496 13.320 3.807 180 HE ARG 28 HE ARG 28 6.411 15.459 5.493 181 HH11 ARG 28 1HH1 ARG 28 6.387 14.217 2.211 182 HH12 ARG 28 2HH1 ARG 28 6.681 15.760 1.483 183 HH21 ARG 28 1HH2 ARG 28 6.819 17.500 4.525 184 HH22 ARG 28 2HH2 ARG 28 6.947 17.633 2.809 185 H SER 29 H SER 29 3.970 11.989 9.194 186 HA SER 29 HA SER 29 1.248 11.310 8.559 187 HB2 SER 29 2HB SER 29 2.349 12.976 10.829 188 HB3 SER 29 3HB SER 29 0.709 12.327 10.715 189 HG SER 29 HG SER 29 2.749 10.490 10.387 190 H ASP 30 H ASP 30 3.276 13.873 7.802 191 HA ASP 30 HA ASP 30 1.370 15.997 7.749 192 HB2 ASP 30 2HB ASP 30 3.712 16.518 7.925 193 HB3 ASP 30 3HB ASP 30 4.069 15.654 6.436 194 H GLN 31 H GLN 31 2.384 13.520 5.563 195 HA GLN 31 HA GLN 31 0.489 14.521 3.554 196 HB2 GLN 31 2HB GLN 31 3.225 13.349 3.059 197 HB3 GLN 31 3HB GLN 31 2.020 13.551 1.795 198 HG2 GLN 31 2HG GLN 31 2.917 15.867 3.461 199 HG3 GLN 31 3HG GLN 31 3.858 15.324 2.074 200 HE21 GLN 31 1HE2 GLN 31 0.354 15.153 2.105 201 HE22 GLN 31 2HE2 GLN 31 0.100 16.414 0.956 202 H ASN 32 H ASN 32 -1.103 13.111 3.205 203 HA ASN 32 HA ASN 32 -0.658 10.323 3.927 204 HB2 ASN 32 2HB ASN 32 -2.680 11.558 4.804 205 HB3 ASN 32 3HB ASN 32 -3.283 11.614 3.150 206 HD21 ASN 32 1HD2 ASN 32 -5.099 10.390 3.789 207 HD22 ASN 32 2HD2 ASN 32 -4.971 8.681 4.045 208 H VAL 33 H VAL 33 -1.388 8.630 2.510 209 HA VAL 33 HA VAL 33 -0.641 9.217 -0.260 210 HB VAL 33 HB VAL 33 -0.893 6.559 1.149 211 HG11 VAL 33 1HG1 VAL 33 -1.204 6.347 -1.224 212 HG12 VAL 33 2HG1 VAL 33 0.369 5.690 -0.762 213 HG13 VAL 33 3HG1 VAL 33 0.260 7.274 -1.533 214 HG21 VAL 33 3HG2 VAL 33 0.883 7.980 2.080 215 HG22 VAL 33 1HG2 VAL 33 1.594 8.126 0.474 216 HG23 VAL 33 2HG2 VAL 33 1.522 6.553 1.268 217 H VAL 34 H VAL 34 -2.037 9.006 -1.950 218 HA VAL 34 HA VAL 34 -4.691 7.895 -1.331 219 HB VAL 34 HB VAL 34 -5.592 9.275 -3.169 220 HG11 VAL 34 1HG1 VAL 34 -5.741 10.048 -0.889 221 HG12 VAL 34 2HG1 VAL 34 -5.489 11.409 -1.986 222 HG13 VAL 34 3HG1 VAL 34 -4.147 10.791 -1.019 223 HG21 VAL 34 3HG2 VAL 34 -2.824 10.475 -3.219 224 HG22 VAL 34 1HG2 VAL 34 -4.229 11.123 -4.062 225 HG23 VAL 34 2HG2 VAL 34 -3.589 9.546 -4.509 226 H ALA 35 H ALA 35 -1.901 7.422 -3.238 227 HA ALA 35 HA ALA 35 -3.291 5.262 -4.604 228 HB1 ALA 35 3HB ALA 35 -1.712 7.307 -6.159 229 HB2 ALA 35 1HB ALA 35 -3.470 7.162 -6.149 230 HB3 ALA 35 2HB ALA 35 -2.478 5.861 -6.806 231 H ILE 36 H ILE 36 -2.032 3.515 -5.064 232 HA ILE 36 HA ILE 36 0.846 3.713 -4.662 233 HB ILE 36 HB ILE 36 -0.871 1.750 -3.109 234 HG12 ILE 36 2HG1 ILE 36 0.983 3.897 -2.066 235 HG13 ILE 36 3HG1 ILE 36 -0.769 4.041 -2.145 236 HG21 ILE 36 1HG2 ILE 36 1.268 0.961 -2.156 237 HG22 ILE 36 2HG2 ILE 36 2.126 1.997 -3.298 238 HG23 ILE 36 3HG2 ILE 36 1.134 0.665 -3.888 239 HD11 ILE 36 3HD1 ILE 36 0.769 2.028 -0.517 240 HD12 ILE 36 1HD1 ILE 36 -0.988 2.153 -0.612 241 HD13 ILE 36 2HD1 ILE 36 -0.050 3.467 0.092 242 H ASN 37 H ASN 37 1.743 2.722 -6.335 243 HA ASN 37 HA ASN 37 0.555 0.217 -7.294 244 HB2 ASN 37 2HB ASN 37 1.334 2.650 -8.813 245 HB3 ASN 37 3HB ASN 37 1.906 1.133 -9.487 246 HD21 ASN 37 1HD2 ASN 37 -1.081 1.267 -7.698 247 HD22 ASN 37 2HD2 ASN 37 -2.123 1.046 -9.065 248 H VAL 38 H VAL 38 1.925 -1.376 -6.752 249 HA VAL 38 HA VAL 38 4.768 -0.936 -7.022 250 HB VAL 38 HB VAL 38 5.297 -1.735 -4.710 251 HG11 VAL 38 1HG1 VAL 38 5.546 0.598 -5.223 252 HG12 VAL 38 2HG1 VAL 38 4.898 0.422 -3.595 253 HG13 VAL 38 3HG1 VAL 38 3.834 0.886 -4.921 254 HG21 VAL 38 3HG2 VAL 38 2.385 -1.152 -4.210 255 HG22 VAL 38 1HG2 VAL 38 3.586 -1.496 -2.965 256 HG23 VAL 38 2HG2 VAL 38 3.157 -2.736 -4.146 257 H GLU 39 H GLU 39 5.977 -2.759 -7.160 258 HA GLU 39 HA GLU 39 4.677 -5.341 -6.771 259 HB2 GLU 39 2HB GLU 39 4.485 -4.791 -9.163 260 HB3 GLU 39 3HB GLU 39 6.213 -4.504 -9.246 261 HG2 GLU 39 2HG GLU 39 6.658 -6.838 -8.787 262 HG3 GLU 39 3HG GLU 39 4.936 -7.154 -8.589 263 H SER 40 H SER 40 6.096 -6.908 -6.061 264 HA SER 40 HA SER 40 8.514 -5.863 -4.881 265 HB2 SER 40 2HB SER 40 8.652 -8.016 -3.752 266 HB3 SER 40 3HB SER 40 7.030 -7.342 -3.597 267 HG SER 40 HG SER 40 7.254 -8.878 -5.818 268 H GLY 41 H GLY 41 10.580 -6.744 -5.104 269 HA2 GLY 41 2HA GLY 41 11.079 -7.870 -7.754 270 HA3 GLY 41 3HA GLY 41 12.276 -7.128 -6.701 271 H ASP 42 H ASP 42 12.233 -8.407 -4.408 272 HA ASP 42 HA ASP 42 12.705 -11.216 -5.174 273 HB2 ASP 42 2HB ASP 42 14.709 -9.817 -4.532 274 HB3 ASP 42 3HB ASP 42 14.039 -9.739 -2.908 275 H ASP 43 H ASP 43 10.813 -12.174 -4.612 276 HA ASP 43 HA ASP 43 9.160 -13.087 -3.353 277 HB2 ASP 43 2HB ASP 43 11.591 -13.314 -1.642 278 HB3 ASP 43 3HB ASP 43 10.045 -13.899 -1.040 279 H GLY 44 H GLY 44 9.052 -10.231 -3.174 280 HA2 GLY 44 2HA GLY 44 7.579 -8.817 -2.081 281 HA3 GLY 44 3HA GLY 44 7.299 -10.080 -0.899 282 H GLN 45 H GLN 45 10.586 -9.709 -1.040 283 HA GLN 45 HA GLN 45 10.594 -8.273 1.451 284 HB2 GLN 45 2HB GLN 45 12.838 -9.342 -0.242 285 HB3 GLN 45 3HB GLN 45 13.096 -8.477 1.266 286 HG2 GLN 45 2HG GLN 45 11.802 -10.189 2.450 287 HG3 GLN 45 3HG GLN 45 11.598 -11.065 0.932 288 HE21 GLN 45 1HE2 GLN 45 13.770 -10.194 3.468 289 HE22 GLN 45 2HE2 GLN 45 15.051 -11.257 3.022 290 H THR 46 H THR 46 11.209 -7.508 -1.864 291 HA THR 46 HA THR 46 11.828 -4.759 -1.053 292 HB THR 46 HB THR 46 12.999 -4.683 -3.365 293 HG1 THR 46 HG1 THR 46 13.876 -6.773 -3.933 294 HG21 THR 46 3HG2 THR 46 14.205 -6.249 -1.072 295 HG22 THR 46 1HG2 THR 46 14.201 -4.493 -1.248 296 HG23 THR 46 2HG2 THR 46 15.111 -5.490 -2.382 297 H LEU 47 H LEU 47 9.925 -3.673 -1.372 298 HA LEU 47 HA LEU 47 8.318 -4.254 -3.721 299 HB2 LEU 47 2HB LEU 47 7.950 -2.205 -1.532 300 HB3 LEU 47 3HB LEU 47 6.794 -2.557 -2.798 301 HG LEU 47 HG LEU 47 7.648 -4.511 -0.660 302 HD11 LEU 47 1HD1 LEU 47 5.101 -2.928 -0.950 303 HD12 LEU 47 2HD1 LEU 47 6.366 -2.629 0.241 304 HD13 LEU 47 3HD1 LEU 47 5.444 -4.132 0.290 305 HD21 LEU 47 3HD2 LEU 47 5.763 -5.838 -1.483 306 HD22 LEU 47 1HD2 LEU 47 6.967 -5.591 -2.745 307 HD23 LEU 47 2HD2 LEU 47 5.475 -4.652 -2.751 308 H ASN 48 H ASN 48 8.402 -3.103 -5.594 309 HA ASN 48 HA ASN 48 9.805 -0.519 -5.540 310 HB2 ASN 48 2HB ASN 48 9.897 -2.618 -7.725 311 HB3 ASN 48 3HB ASN 48 10.733 -1.070 -7.734 312 HD21 ASN 48 1HD2 ASN 48 12.507 -0.788 -6.368 313 HD22 ASN 48 2HD2 ASN 48 13.380 -2.132 -5.726 314 H GLY 49 H GLY 49 8.733 1.110 -6.637 315 HA2 GLY 49 2HA GLY 49 7.053 0.762 -8.803 316 HA3 GLY 49 3HA GLY 49 6.034 0.604 -7.387 317 H THR 50 H THR 50 4.851 2.378 -7.946 318 HA THR 50 HA THR 50 6.183 4.967 -7.592 319 HB THR 50 HB THR 50 3.933 4.351 -9.536 320 HG1 THR 50 HG1 THR 50 6.458 3.868 -9.827 321 HG21 THR 50 3HG2 THR 50 5.528 6.890 -9.114 322 HG22 THR 50 1HG2 THR 50 3.852 6.638 -8.621 323 HG23 THR 50 2HG2 THR 50 4.275 6.642 -10.334 324 H MET 51 H MET 51 5.171 6.251 -6.099 325 HA MET 51 HA MET 51 2.468 5.472 -5.242 326 HB2 MET 51 2HB MET 51 4.069 4.571 -3.633 327 HB3 MET 51 3HB MET 51 4.804 6.152 -3.446 328 HG2 MET 51 2HG MET 51 1.915 5.870 -2.850 329 HG3 MET 51 3HG MET 51 3.078 5.196 -1.709 330 HE1 MET 51 3HE MET 51 5.544 7.241 -1.957 331 HE2 MET 51 1HE MET 51 4.889 6.546 -0.473 332 HE3 MET 51 2HE MET 51 5.118 8.287 -0.603 333 H THR 52 H THR 52 1.076 7.124 -4.716 334 HA THR 52 HA THR 52 2.118 9.835 -5.185 335 HB THR 52 HB THR 52 -0.567 8.778 -6.091 336 HG1 THR 52 HG1 THR 52 0.376 8.329 -7.952 337 HG21 THR 52 3HG2 THR 52 -0.562 11.185 -5.604 338 HG22 THR 52 1HG2 THR 52 -0.714 10.879 -7.335 339 HG23 THR 52 2HG2 THR 52 0.833 11.393 -6.659 340 H TYR 53 H TYR 53 1.675 11.270 -3.670 341 HA TYR 53 HA TYR 53 -0.032 10.605 -1.429 342 HB2 TYR 53 2HB TYR 53 1.779 12.958 -1.980 343 HB3 TYR 53 3HB TYR 53 0.747 12.872 -0.564 344 HD1 TYR 53 HD2 TYR 53 1.128 10.995 1.081 345 HD2 TYR 53 HD1 TYR 53 3.876 11.906 -2.025 346 HE1 TYR 53 HE2 TYR 53 2.886 9.787 2.297 347 HE2 TYR 53 HE1 TYR 53 5.646 10.700 -0.809 348 HH TYR 53 HH TYR 53 6.211 9.879 1.305 349 H ALA 54 H ALA 54 -1.546 12.250 -0.570 350 HA ALA 54 HA ALA 54 -3.622 12.783 -2.362 351 HB1 ALA 54 3HB ALA 54 -4.677 13.995 -0.551 352 HB2 ALA 54 1HB ALA 54 -3.139 14.133 0.295 353 HB3 ALA 54 2HB ALA 54 -3.886 12.553 0.087 354 H GLY 55 H GLY 55 -3.479 14.122 -4.051 355 HA2 GLY 55 2HA GLY 55 -3.453 16.123 -5.165 356 HA3 GLY 55 3HA GLY 55 -3.247 16.929 -3.618 357 H GLU 56 H GLU 56 -0.971 14.488 -4.403 358 HA GLU 56 HA GLU 56 1.002 16.578 -5.062 359 HB2 GLU 56 2HB GLU 56 1.401 14.002 -3.538 360 HB3 GLU 56 3HB GLU 56 2.686 15.110 -3.987 361 HG2 GLU 56 2HG GLU 56 0.388 15.765 -2.156 362 HG3 GLU 56 3HG GLU 56 2.022 15.344 -1.642 363 H GLY 57 H GLY 57 3.004 15.503 -6.135 364 HA2 GLY 57 2HA GLY 57 2.018 14.051 -8.443 365 HA3 GLY 57 3HA GLY 57 3.629 14.723 -8.242 366 HA PRO 58 HA PRO 58 3.383 10.024 -7.269 367 HB2 PRO 58 2HB PRO 58 4.300 9.027 -9.623 368 HB3 PRO 58 3HB PRO 58 2.580 9.269 -9.293 369 HG2 PRO 58 2HG PRO 58 4.481 11.027 -10.797 370 HG3 PRO 58 3HG PRO 58 2.835 10.528 -11.236 371 HD2 PRO 58 2HD PRO 58 3.340 12.941 -10.152 372 HD3 PRO 58 3HD PRO 58 1.854 12.044 -9.778 373 H ILE 59 H ILE 59 5.174 9.080 -6.454 374 HA ILE 59 HA ILE 59 7.788 10.030 -7.390 375 HB ILE 59 HB ILE 59 8.619 10.021 -5.067 376 HG12 ILE 59 2HG1 ILE 59 5.711 9.707 -4.302 377 HG13 ILE 59 3HG1 ILE 59 6.942 8.459 -4.144 378 HG21 ILE 59 1HG2 ILE 59 7.561 12.115 -4.349 379 HG22 ILE 59 2HG2 ILE 59 6.282 11.859 -5.542 380 HG23 ILE 59 3HG2 ILE 59 7.945 12.115 -6.072 381 HD11 ILE 59 3HD1 ILE 59 6.607 9.454 -2.008 382 HD12 ILE 59 1HD1 ILE 59 6.808 11.079 -2.673 383 HD13 ILE 59 2HD1 ILE 59 8.178 9.971 -2.612 384 H GLY 60 H GLY 60 9.581 8.585 -6.584 385 HA2 GLY 60 2HA GLY 60 8.948 5.884 -7.335 386 HA3 GLY 60 3HA GLY 60 10.526 6.487 -6.838 387 H PHE 61 H PHE 61 8.713 4.117 -6.091 388 HA PHE 61 HA PHE 61 8.899 4.533 -3.183 389 HB2 PHE 61 2HB PHE 61 6.563 4.407 -3.952 390 HB3 PHE 61 3HB PHE 61 6.890 2.856 -4.710 391 HD1 PHE 61 HD2 PHE 61 7.321 0.862 -3.306 392 HD2 PHE 61 HD1 PHE 61 6.134 4.579 -1.622 393 HE1 PHE 61 HE2 PHE 61 6.695 -0.293 -1.218 394 HE2 PHE 61 HE1 PHE 61 5.505 3.434 0.468 395 HZ PHE 61 HZ PHE 61 5.781 0.996 0.667 396 H ARG 62 H ARG 62 10.342 3.259 -2.219 397 HA ARG 62 HA ARG 62 10.596 0.509 -3.181 398 HB2 ARG 62 2HB ARG 62 12.573 1.788 -3.987 399 HB3 ARG 62 3HB ARG 62 12.944 2.222 -2.323 400 HG2 ARG 62 2HG ARG 62 13.269 -0.137 -1.772 401 HG3 ARG 62 3HG ARG 62 12.874 -0.581 -3.431 402 HD2 ARG 62 2HD ARG 62 15.257 -0.587 -3.207 403 HD3 ARG 62 3HD ARG 62 14.798 0.797 -4.194 404 HE ARG 62 HE ARG 62 15.015 1.535 -1.467 405 HH11 ARG 62 1HH1 ARG 62 16.943 0.779 -4.303 406 HH12 ARG 62 2HH1 ARG 62 18.324 1.663 -3.755 407 HH21 ARG 62 1HH2 ARG 62 16.854 2.672 -0.710 408 HH22 ARG 62 2HH2 ARG 62 18.268 2.764 -1.712 409 H ALA 63 H ALA 63 10.416 -0.933 -1.590 410 HA ALA 63 HA ALA 63 10.746 0.029 1.170 411 HB1 ALA 63 3HB ALA 63 8.331 -0.181 0.502 412 HB2 ALA 63 1HB ALA 63 8.807 -1.174 1.881 413 HB3 ALA 63 2HB ALA 63 8.619 -1.913 0.299 414 H THR 64 H THR 64 11.860 -1.269 2.495 415 HA THR 64 HA THR 64 12.647 -3.890 1.437 416 HB THR 64 HB THR 64 14.146 -2.177 3.438 417 HG1 THR 64 HG1 THR 64 15.098 -2.642 0.837 418 HG21 THR 64 3HG2 THR 64 15.984 -3.728 3.010 419 HG22 THR 64 1HG2 THR 64 14.974 -4.627 1.873 420 HG23 THR 64 2HG2 THR 64 14.567 -4.597 3.591 421 H LEU 65 H LEU 65 11.937 -5.557 2.500 422 HA LEU 65 HA LEU 65 10.241 -5.436 4.720 423 HB2 LEU 65 2HB LEU 65 10.157 -7.163 3.019 424 HB3 LEU 65 3HB LEU 65 11.757 -7.719 3.442 425 HG LEU 65 HG LEU 65 9.755 -9.117 4.169 426 HD11 LEU 65 1HD1 LEU 65 11.992 -9.533 4.982 427 HD12 LEU 65 2HD1 LEU 65 10.808 -9.754 6.270 428 HD13 LEU 65 3HD1 LEU 65 11.793 -8.292 6.217 429 HD21 LEU 65 3HD2 LEU 65 8.353 -7.345 5.015 430 HD22 LEU 65 1HD2 LEU 65 9.573 -6.915 6.212 431 HD23 LEU 65 2HD2 LEU 65 8.751 -8.473 6.310 432 H LEU 66 H LEU 66 10.634 -5.398 6.901 433 HA LEU 66 HA LEU 66 13.378 -5.670 7.817 434 HB2 LEU 66 2HB LEU 66 10.867 -4.703 9.180 435 HB3 LEU 66 3HB LEU 66 12.447 -4.761 9.933 436 HG LEU 66 HG LEU 66 11.732 -3.071 7.537 437 HD11 LEU 66 1HD1 LEU 66 11.867 -1.187 9.078 438 HD12 LEU 66 2HD1 LEU 66 12.147 -2.297 10.421 439 HD13 LEU 66 3HD1 LEU 66 10.605 -2.321 9.562 440 HD21 LEU 66 3HD2 LEU 66 14.073 -3.693 7.528 441 HD22 LEU 66 1HD2 LEU 66 14.234 -3.212 9.218 442 HD23 LEU 66 2HD2 LEU 66 13.908 -1.996 7.985 443 H GLY 67 H GLY 67 10.181 -7.065 8.266 444 HA2 GLY 67 2HA GLY 67 11.407 -9.390 9.580 445 HA3 GLY 67 3HA GLY 67 10.073 -8.572 10.389 446 H ASN 68 H ASN 68 7.958 -8.495 9.294 447 HA ASN 68 HA ASN 68 7.665 -10.119 6.944 448 HB2 ASN 68 2HB ASN 68 6.172 -10.617 9.553 449 HB3 ASN 68 3HB ASN 68 5.655 -11.251 7.997 450 HD21 ASN 68 1HD2 ASN 68 7.769 -11.622 10.661 451 HD22 ASN 68 2HD2 ASN 68 8.546 -13.074 10.142 452 H ASN 69 H ASN 69 5.564 -8.735 9.435 453 HA ASN 69 HA ASN 69 3.882 -7.361 7.624 454 HB2 ASN 69 2HB ASN 69 4.291 -7.178 10.599 455 HB3 ASN 69 3HB ASN 69 3.163 -6.126 9.755 456 HD21 ASN 69 1HD2 ASN 69 2.769 -8.200 11.785 457 HD22 ASN 69 2HD2 ASN 69 1.624 -9.303 11.106 458 H SER 70 H SER 70 6.687 -6.397 9.511 459 HA SER 70 HA SER 70 6.325 -3.595 8.968 460 HB2 SER 70 2HB SER 70 7.219 -4.440 11.117 461 HB3 SER 70 3HB SER 70 8.657 -5.002 10.267 462 HG SER 70 HG SER 70 8.385 -2.711 11.333 463 H TYR 71 H TYR 71 7.166 -2.418 7.427 464 HA TYR 71 HA TYR 71 9.456 -3.400 5.857 465 HB2 TYR 71 2HB TYR 71 6.928 -2.045 4.915 466 HB3 TYR 71 3HB TYR 71 8.393 -2.061 3.950 467 HD1 TYR 71 HD1 TYR 71 5.825 -4.265 5.499 468 HD2 TYR 71 HD2 TYR 71 8.902 -3.891 2.586 469 HE1 TYR 71 HE1 TYR 71 5.129 -6.397 4.491 470 HE2 TYR 71 HE2 TYR 71 8.226 -6.015 1.582 471 HH TYR 71 HH TYR 71 7.015 -7.914 1.960 472 H GLU 72 H GLU 72 10.974 -1.857 5.328 473 HA GLU 72 HA GLU 72 10.547 0.814 6.469 474 HB2 GLU 72 2HB GLU 72 12.532 -0.452 7.291 475 HB3 GLU 72 3HB GLU 72 13.144 -0.506 5.644 476 HG2 GLU 72 2HG GLU 72 13.383 1.885 5.600 477 HG3 GLU 72 3HG GLU 72 12.603 2.023 7.174 478 H VAL 73 H VAL 73 10.321 2.463 5.122 479 HA VAL 73 HA VAL 73 10.495 1.841 2.255 480 HB VAL 73 HB VAL 73 8.578 3.610 3.760 481 HG11 VAL 73 1HG1 VAL 73 9.191 4.740 1.686 482 HG12 VAL 73 2HG1 VAL 73 7.540 4.131 1.604 483 HG13 VAL 73 3HG1 VAL 73 8.838 3.272 0.772 484 HG21 VAL 73 3HG2 VAL 73 6.901 2.091 2.815 485 HG22 VAL 73 1HG2 VAL 73 8.070 1.239 3.822 486 HG23 VAL 73 2HG2 VAL 73 8.191 1.153 2.065 487 H GLU 74 H GLU 74 11.442 3.129 0.873 488 HA GLU 74 HA GLU 74 12.503 5.717 1.749 489 HB2 GLU 74 2HB GLU 74 13.880 3.618 0.062 490 HB3 GLU 74 3HB GLU 74 14.449 5.269 0.238 491 HG2 GLU 74 2HG GLU 74 14.786 4.937 2.610 492 HG3 GLU 74 3HG GLU 74 14.141 3.299 2.488 493 H ASN 75 H ASN 75 11.929 7.344 0.384 494 HA ASN 75 HA ASN 75 10.644 6.538 -2.117 495 HB2 ASN 75 2HB ASN 75 10.149 8.861 -0.280 496 HB3 ASN 75 3HB ASN 75 9.514 8.801 -1.919 497 HD21 ASN 75 1HD2 ASN 75 9.038 5.951 -1.890 498 HD22 ASN 75 2HD2 ASN 75 7.678 5.689 -0.862 499 H GLN 76 H GLN 76 10.894 7.799 -3.935 500 HA GLN 76 HA GLN 76 13.423 9.326 -4.015 501 HB2 GLN 76 2HB GLN 76 13.496 7.136 -5.169 502 HB3 GLN 76 3HB GLN 76 12.160 7.646 -6.183 503 HG2 GLN 76 2HG GLN 76 13.552 9.433 -7.099 504 HG3 GLN 76 3HG GLN 76 14.897 8.886 -6.098 505 HE21 GLN 76 1HE2 GLN 76 16.216 8.364 -7.786 506 HE22 GLN 76 2HE2 GLN 76 15.911 7.036 -8.853 507 H TRP 77 H TRP 77 13.157 11.425 -4.493 508 HA TRP 77 HA TRP 77 11.056 12.214 -6.341 509 HB2 TRP 77 2HB TRP 77 10.359 14.092 -4.836 510 HB3 TRP 77 3HB TRP 77 9.935 12.500 -4.222 511 HD1 TRP 77 HD1 TRP 77 12.802 15.089 -3.699 512 HE1 TRP 77 HE1 TRP 77 13.453 15.063 -1.208 513 HE3 TRP 77 HE3 TRP 77 9.673 11.389 -2.085 514 HZ2 TRP 77 HZ2 TRP 77 12.729 13.668 1.126 515 HZ3 TRP 77 HZ3 TRP 77 9.709 10.773 0.294 516 HH2 TRP 77 HH2 TRP 77 11.207 11.890 1.868 517 H GLY 78 H GLY 78 11.307 14.452 -7.086 518 HA2 GLY 78 2HA GLY 78 12.612 16.430 -7.339 519 HA3 GLY 78 3HA GLY 78 13.993 15.559 -6.685 520 H GLY 79 H GLY 79 12.946 13.328 -8.580 521 HA2 GLY 79 2HA GLY 79 12.906 13.626 -11.159 522 HA3 GLY 79 3HA GLY 79 14.533 14.234 -10.867 523 H ASP 80 H ASP 80 13.943 11.968 -12.466 524 HA ASP 80 HA ASP 80 14.209 9.533 -11.121 525 HB2 ASP 80 2HB ASP 80 15.195 10.215 -13.893 526 HB3 ASP 80 3HB ASP 80 14.840 8.603 -13.274 527 H SER 81 H SER 81 16.624 11.816 -12.224 528 HA SER 81 HA SER 81 18.870 10.130 -11.789 529 HB2 SER 81 2HB SER 81 18.893 13.143 -11.821 530 HB3 SER 81 3HB SER 81 20.194 12.040 -12.268 531 HG SER 81 HG SER 81 18.462 13.094 -13.879 532 H ALA 82 H ALA 82 16.833 11.733 -9.596 533 HA ALA 82 HA ALA 82 18.807 12.429 -7.635 534 HB1 ALA 82 3HB ALA 82 16.705 13.654 -7.756 535 HB2 ALA 82 1HB ALA 82 16.885 12.881 -6.179 536 HB3 ALA 82 2HB ALA 82 15.811 12.178 -7.389 537 HA PRO 83 HA PRO 83 19.195 8.477 -5.648 538 HB2 PRO 83 2HB PRO 83 19.948 9.256 -3.166 539 HB3 PRO 83 3HB PRO 83 21.018 9.400 -4.564 540 HG2 PRO 83 2HG PRO 83 19.304 11.492 -3.280 541 HG3 PRO 83 3HG PRO 83 20.993 11.607 -3.817 542 HD2 PRO 83 2HD PRO 83 18.934 12.555 -5.292 543 HD3 PRO 83 3HD PRO 83 20.398 11.873 -6.030 544 H TRP 84 H TRP 84 18.578 7.498 -3.346 545 HA TRP 84 HA TRP 84 15.706 7.912 -3.136 546 HB2 TRP 84 2HB TRP 84 17.520 5.741 -2.059 547 HB3 TRP 84 3HB TRP 84 15.788 5.823 -1.766 548 HD1 TRP 84 HD1 TRP 84 18.322 5.024 -4.515 549 HE1 TRP 84 HE1 TRP 84 17.095 3.833 -6.442 550 HE3 TRP 84 HE3 TRP 84 13.506 5.594 -2.886 551 HZ2 TRP 84 HZ2 TRP 84 14.444 3.225 -7.175 552 HZ3 TRP 84 HZ3 TRP 84 11.682 4.673 -4.262 553 HH2 TRP 84 HH2 TRP 84 12.145 3.514 -6.360 554 H HIS 85 H HIS 85 14.716 8.565 -1.271 555 HA HIS 85 HA HIS 85 16.512 9.482 0.881 556 HB2 HIS 85 2HB HIS 85 13.902 10.700 -0.053 557 HB3 HIS 85 3HB HIS 85 14.827 11.245 1.341 558 HD1 HIS 85 HD1 HIS 85 17.067 12.504 0.854 559 HD2 HIS 85 HD2 HIS 85 14.863 11.531 -2.527 560 HE1 HIS 85 HE1 HIS 85 18.078 13.840 -1.014 561 H SER 86 H SER 86 15.776 9.240 3.034 562 HA SER 86 HA SER 86 14.384 6.845 3.481 563 HB2 SER 86 2HB SER 86 14.491 7.636 5.907 564 HB3 SER 86 3HB SER 86 16.032 7.480 5.062 565 HG SER 86 HG SER 86 15.807 9.453 6.259 566 H GLY 87 H GLY 87 12.267 6.424 3.980 567 HA2 GLY 87 2HA GLY 87 10.469 8.752 3.922 568 HA3 GLY 87 3HA GLY 87 10.049 7.136 3.361 569 H GLY 88 H GLY 88 10.757 5.493 5.348 570 HA2 GLY 88 2HA GLY 88 10.555 5.920 7.941 571 HA3 GLY 88 3HA GLY 88 8.918 6.334 7.460 572 H ASN 89 H ASN 89 8.343 4.594 8.929 573 HA ASN 89 HA ASN 89 8.830 1.898 7.854 574 HB2 ASN 89 2HB ASN 89 7.775 2.743 10.554 575 HB3 ASN 89 3HB ASN 89 8.083 1.080 10.057 576 HD21 ASN 89 1HD2 ASN 89 10.250 0.410 9.801 577 HD22 ASN 89 2HD2 ASN 89 11.553 1.299 10.522 578 H TRP 90 H TRP 90 7.236 0.662 7.097 579 HA TRP 90 HA TRP 90 4.457 1.599 7.367 580 HB2 TRP 90 2HB TRP 90 5.796 0.509 4.874 581 HB3 TRP 90 3HB TRP 90 4.060 0.684 5.049 582 HD1 TRP 90 HD1 TRP 90 6.600 3.415 6.088 583 HE1 TRP 90 HE1 TRP 90 6.203 5.484 4.613 584 HE3 TRP 90 HE3 TRP 90 3.089 1.477 2.932 585 HZ2 TRP 90 HZ2 TRP 90 4.600 6.204 2.391 586 HZ3 TRP 90 HZ3 TRP 90 2.175 2.916 1.153 587 HH2 TRP 90 HH2 TRP 90 2.916 5.227 0.888 588 H ILE 91 H ILE 91 2.888 -0.077 7.408 589 HA ILE 91 HA ILE 91 4.013 -2.775 7.921 590 HB ILE 91 HB ILE 91 1.429 -1.585 8.977 591 HG12 ILE 91 2HG1 ILE 91 3.406 -0.612 10.074 592 HG13 ILE 91 3HG1 ILE 91 2.490 -1.622 11.186 593 HG21 ILE 91 1HG2 ILE 91 2.712 -4.256 9.528 594 HG22 ILE 91 2HG2 ILE 91 1.230 -3.979 8.613 595 HG23 ILE 91 3HG2 ILE 91 1.281 -3.630 10.343 596 HD11 ILE 91 3HD1 ILE 91 4.139 -3.442 10.761 597 HD12 ILE 91 1HD1 ILE 91 4.818 -2.009 11.532 598 HD13 ILE 91 2HD1 ILE 91 5.077 -2.291 9.813 599 H LEU 92 H LEU 92 3.687 -4.032 6.087 600 HA LEU 92 HA LEU 92 1.037 -3.874 4.832 601 HB2 LEU 92 2HB LEU 92 3.678 -4.029 3.360 602 HB3 LEU 92 3HB LEU 92 2.088 -4.044 2.627 603 HG LEU 92 HG LEU 92 3.268 -1.714 4.146 604 HD11 LEU 92 1HD1 LEU 92 2.880 -2.116 1.185 605 HD12 LEU 92 2HD1 LEU 92 4.423 -2.113 2.042 606 HD13 LEU 92 3HD1 LEU 92 3.455 -0.642 1.965 607 HD21 LEU 92 3HD2 LEU 92 1.367 -0.464 3.214 608 HD22 LEU 92 1HD2 LEU 92 0.844 -1.750 4.296 609 HD23 LEU 92 2HD2 LEU 92 0.718 -1.961 2.549 610 H GLY 93 H GLY 93 0.709 -5.775 6.179 611 HA2 GLY 93 2HA GLY 93 1.415 -8.211 4.745 612 HA3 GLY 93 3HA GLY 93 1.917 -8.120 6.424 613 H SER 94 H SER 94 0.348 -8.189 8.094 614 HA SER 94 HA SER 94 -1.556 -8.733 9.129 615 HB2 SER 94 2HB SER 94 -2.883 -8.425 6.432 616 HB3 SER 94 3HB SER 94 -3.743 -8.746 7.937 617 HG SER 94 HG SER 94 -1.993 -6.647 8.110 618 H ARG 95 H ARG 95 0.153 -10.564 7.302 619 HA ARG 95 HA ARG 95 -1.339 -12.934 8.088 620 HB2 ARG 95 2HB ARG 95 -0.235 -12.491 5.318 621 HB3 ARG 95 3HB ARG 95 -0.684 -14.080 5.936 622 HG2 ARG 95 2HG ARG 95 -2.982 -13.289 6.273 623 HG3 ARG 95 3HG ARG 95 -2.523 -11.710 5.644 624 HD2 ARG 95 2HD ARG 95 -1.962 -12.733 3.497 625 HD3 ARG 95 3HD ARG 95 -2.425 -14.314 4.127 626 HE ARG 95 HE ARG 95 -4.502 -12.356 4.353 627 HH11 ARG 95 1HH1 ARG 95 -2.998 -14.695 2.223 628 HH12 ARG 95 2HH1 ARG 95 -4.375 -14.881 1.204 629 HH21 ARG 95 1HH2 ARG 95 -6.370 -12.605 3.017 630 HH22 ARG 95 2HH2 ARG 95 -6.322 -13.701 1.681 631 H GLU 96 H GLU 96 -0.064 -14.728 8.544 632 HA GLU 96 HA GLU 96 2.345 -13.918 9.821 633 HB2 GLU 96 2HB GLU 96 0.760 -15.527 10.785 634 HB3 GLU 96 3HB GLU 96 1.164 -16.673 9.516 635 HG2 GLU 96 2HG GLU 96 3.427 -16.824 10.324 636 HG3 GLU 96 3HG GLU 96 3.100 -15.596 11.543 637 H ASN 97 H ASN 97 1.680 -16.096 7.092 638 HA ASN 97 HA ASN 97 4.564 -16.016 6.489 639 HB2 ASN 97 2HB ASN 97 4.263 -18.221 5.343 640 HB3 ASN 97 3HB ASN 97 3.992 -18.278 7.076 641 HD21 ASN 97 1HD2 ASN 97 1.975 -18.707 7.853 642 HD22 ASN 97 2HD2 ASN 97 0.676 -19.268 6.849 643 H GLN 98 H GLN 98 2.330 -14.274 5.661 644 HA GLN 98 HA GLN 98 2.932 -14.324 2.824 645 HB2 GLN 98 2HB GLN 98 0.147 -14.377 3.936 646 HB3 GLN 98 3HB GLN 98 0.485 -13.662 2.370 647 HG2 GLN 98 2HG GLN 98 1.362 -15.781 1.562 648 HG3 GLN 98 3HG GLN 98 1.089 -16.509 3.145 649 HE21 GLN 98 1HE2 GLN 98 0.003 -17.033 0.411 650 HE22 GLN 98 2HE2 GLN 98 -1.718 -17.023 0.601 651 H ASN 99 H ASN 99 3.762 -12.485 2.367 652 HA ASN 99 HA ASN 99 2.887 -10.091 3.817 653 HB2 ASN 99 2HB ASN 99 5.470 -10.665 2.340 654 HB3 ASN 99 3HB ASN 99 5.071 -9.133 3.109 655 HD21 ASN 99 1HD2 ASN 99 7.271 -11.001 3.618 656 HD22 ASN 99 2HD2 ASN 99 7.149 -11.422 5.291 657 H VAL 100 H VAL 100 3.335 -8.064 2.288 658 HA VAL 100 HA VAL 100 1.610 -8.559 0.011 659 HB VAL 100 HB VAL 100 1.715 -6.164 -0.448 660 HG11 VAL 100 1HG1 VAL 100 0.699 -5.364 1.610 661 HG12 VAL 100 2HG1 VAL 100 1.292 -6.797 2.453 662 HG13 VAL 100 3HG1 VAL 100 0.109 -6.959 1.155 663 HG21 VAL 100 3HG2 VAL 100 4.071 -5.814 0.149 664 HG22 VAL 100 1HG2 VAL 100 3.657 -6.006 1.853 665 HG23 VAL 100 2HG2 VAL 100 3.007 -4.648 0.931 666 H VAL 101 H VAL 101 2.139 -8.758 -2.047 667 HA VAL 101 HA VAL 101 4.972 -8.368 -2.762 668 HB VAL 101 HB VAL 101 4.760 -10.017 -4.564 669 HG11 VAL 101 1HG1 VAL 101 4.683 -12.016 -3.172 670 HG12 VAL 101 2HG1 VAL 101 3.958 -11.081 -1.868 671 HG13 VAL 101 3HG1 VAL 101 5.602 -10.723 -2.406 672 HG21 VAL 101 3HG2 VAL 101 2.388 -9.836 -5.030 673 HG22 VAL 101 1HG2 VAL 101 2.005 -10.524 -3.452 674 HG23 VAL 101 2HG2 VAL 101 2.820 -11.504 -4.677 675 H ALA 102 H ALA 102 1.670 -7.747 -3.715 676 HA ALA 102 HA ALA 102 2.688 -5.616 -5.418 677 HB1 ALA 102 3HB ALA 102 0.693 -7.593 -6.527 678 HB2 ALA 102 1HB ALA 102 2.412 -7.587 -6.918 679 HB3 ALA 102 2HB ALA 102 1.396 -6.209 -7.353 680 H ILE 103 H ILE 103 1.484 -3.823 -5.284 681 HA ILE 103 HA ILE 103 -1.225 -4.095 -4.178 682 HB ILE 103 HB ILE 103 0.833 -2.035 -3.343 683 HG12 ILE 103 2HG1 ILE 103 -0.558 -4.159 -1.700 684 HG13 ILE 103 3HG1 ILE 103 1.081 -4.297 -2.326 685 HG21 ILE 103 1HG2 ILE 103 -1.393 -1.050 -3.523 686 HG22 ILE 103 2HG2 ILE 103 -0.871 -1.161 -1.843 687 HG23 ILE 103 3HG2 ILE 103 -2.039 -2.316 -2.478 688 HD11 ILE 103 3HD1 ILE 103 1.077 -3.649 0.016 689 HD12 ILE 103 1HD1 ILE 103 0.108 -2.224 -0.363 690 HD13 ILE 103 2HD1 ILE 103 1.751 -2.363 -0.985 691 H ASN 104 H ASN 104 -2.674 -3.214 -5.438 692 HA ASN 104 HA ASN 104 -1.969 -0.819 -6.993 693 HB2 ASN 104 2HB ASN 104 -2.204 -2.634 -8.559 694 HB3 ASN 104 3HB ASN 104 -3.699 -3.169 -7.802 695 HD21 ASN 104 1HD2 ASN 104 -5.587 -2.274 -8.407 696 HD22 ASN 104 2HD2 ASN 104 -5.745 -1.065 -9.638 697 H VAL 105 H VAL 105 -2.848 0.726 -5.871 698 HA VAL 105 HA VAL 105 -5.713 0.607 -5.251 699 HB VAL 105 HB VAL 105 -5.454 1.476 -2.950 700 HG11 VAL 105 1HG1 VAL 105 -5.854 -0.904 -3.323 701 HG12 VAL 105 2HG1 VAL 105 -4.830 -0.649 -1.909 702 HG13 VAL 105 3HG1 VAL 105 -4.117 -1.180 -3.430 703 HG21 VAL 105 3HG2 VAL 105 -2.545 0.813 -3.342 704 HG22 VAL 105 1HG2 VAL 105 -3.292 1.261 -1.811 705 HG23 VAL 105 2HG2 VAL 105 -3.220 2.430 -3.132 706 H GLU 106 H GLU 106 -6.792 2.463 -5.292 707 HA GLU 106 HA GLU 106 -5.365 4.997 -5.313 708 HB2 GLU 106 2HB GLU 106 -7.149 4.054 -7.558 709 HB3 GLU 106 3HB GLU 106 -6.719 5.740 -7.307 710 HG2 GLU 106 2HG GLU 106 -4.370 5.212 -7.632 711 HG3 GLU 106 3HG GLU 106 -4.765 3.507 -7.830 712 H SER 107 H SER 107 -6.694 6.762 -4.741 713 HA SER 107 HA SER 107 -9.369 6.006 -3.772 714 HB2 SER 107 2HB SER 107 -7.837 6.093 -1.886 715 HB3 SER 107 3HB SER 107 -7.306 7.706 -2.355 716 HG SER 107 HG SER 107 -9.512 6.915 -0.966 717 H GLY 108 H GLY 108 -10.965 7.500 -3.961 718 HA2 GLY 108 2HA GLY 108 -10.386 9.828 -5.610 719 HA3 GLY 108 3HA GLY 108 -11.989 9.218 -5.194 720 H ASP 109 H ASP 109 -10.363 9.081 -2.435 721 HA ASP 109 HA ASP 109 -11.457 11.627 -1.494 722 HB2 ASP 109 2HB ASP 109 -10.491 9.215 0.066 723 HB3 ASP 109 3HB ASP 109 -11.258 10.642 0.753 724 H ASP 110 H ASP 110 -9.952 12.013 0.740 725 HA ASP 110 HA ASP 110 -7.365 12.746 -0.400 726 HB2 ASP 110 2HB ASP 110 -7.141 14.275 1.424 727 HB3 ASP 110 3HB ASP 110 -8.791 14.425 0.835 728 H GLY 111 H GLY 111 -8.159 9.986 0.412 729 HA2 GLY 111 2HA GLY 111 -6.584 8.332 1.097 730 HA3 GLY 111 3HA GLY 111 -5.900 9.495 2.215 731 H GLN 112 H GLN 112 -9.280 9.568 2.367 732 HA GLN 112 HA GLN 112 -9.322 8.534 4.994 733 HB2 GLN 112 2HB GLN 112 -11.586 9.009 3.060 734 HB3 GLN 112 3HB GLN 112 -11.808 8.605 4.758 735 HG2 GLN 112 2HG GLN 112 -10.643 10.655 5.399 736 HG3 GLN 112 3HG GLN 112 -10.413 11.047 3.695 737 HE21 GLN 112 1HE2 GLN 112 -11.808 12.542 5.759 738 HE22 GLN 112 2HE2 GLN 112 -13.426 12.743 5.191 739 H THR 113 H THR 113 -10.303 7.127 1.902 740 HA THR 113 HA THR 113 -9.933 4.499 3.108 741 HB THR 113 HB THR 113 -11.859 3.575 1.882 742 HG1 THR 113 HG1 THR 113 -12.272 6.289 1.109 743 HG21 THR 113 3HG2 THR 113 -13.660 4.520 3.259 744 HG22 THR 113 1HG2 THR 113 -12.622 5.879 3.683 745 HG23 THR 113 2HG2 THR 113 -12.196 4.244 4.198 746 H LEU 114 H LEU 114 -9.121 2.946 1.701 747 HA LEU 114 HA LEU 114 -8.255 3.980 -0.920 748 HB2 LEU 114 2HB LEU 114 -6.862 1.967 0.852 749 HB3 LEU 114 3HB LEU 114 -6.310 2.462 -0.734 750 HG LEU 114 HG LEU 114 -6.470 4.215 1.721 751 HD11 LEU 114 1HD1 LEU 114 -4.027 4.210 1.588 752 HD12 LEU 114 2HD1 LEU 114 -4.105 3.061 0.255 753 HD13 LEU 114 3HD1 LEU 114 -4.679 2.593 1.857 754 HD21 LEU 114 3HD2 LEU 114 -5.506 4.822 -1.072 755 HD22 LEU 114 1HD2 LEU 114 -5.254 5.860 0.332 756 HD23 LEU 114 2HD2 LEU 114 -6.890 5.536 -0.245 757 H ASN 115 H ASN 115 -8.870 2.840 -2.670 758 HA ASN 115 HA ASN 115 -10.072 0.181 -2.212 759 HB2 ASN 115 2HB ASN 115 -10.908 2.297 -4.210 760 HB3 ASN 115 3HB ASN 115 -11.591 0.683 -4.111 761 HD21 ASN 115 1HD2 ASN 115 -11.598 0.621 -1.205 762 HD22 ASN 115 2HD2 ASN 115 -12.871 1.681 -0.707 763 H GLY 116 H GLY 116 -9.521 -1.452 -3.637 764 HA2 GLY 116 2HA GLY 116 -8.678 -1.189 -6.234 765 HA3 GLY 116 3HA GLY 116 -7.221 -0.970 -5.285 766 H THR 117 H THR 117 -6.152 -2.715 -5.755 767 HA THR 117 HA THR 117 -7.318 -5.306 -5.043 768 HB THR 117 HB THR 117 -5.817 -6.212 -6.971 769 HG1 THR 117 HG1 THR 117 -5.160 -4.781 -8.431 770 HG21 THR 117 3HG2 THR 117 -8.396 -4.749 -7.569 771 HG22 THR 117 1HG2 THR 117 -8.263 -6.390 -6.933 772 HG23 THR 117 2HG2 THR 117 -7.683 -6.021 -8.557 773 H MET 118 H MET 118 -5.798 -6.837 -4.328 774 HA MET 118 HA MET 118 -3.114 -5.819 -3.696 775 HB2 MET 118 2HB MET 118 -3.373 -6.689 -1.389 776 HB3 MET 118 3HB MET 118 -4.470 -5.359 -1.748 777 HG2 MET 118 2HG MET 118 -6.217 -7.089 -2.259 778 HG3 MET 118 3HG MET 118 -5.113 -8.287 -1.588 779 HE1 MET 118 3HE MET 118 -4.827 -7.143 2.129 780 HE2 MET 118 1HE MET 118 -3.801 -6.530 0.837 781 HE3 MET 118 2HE MET 118 -4.240 -8.230 0.871 782 H THR 119 H THR 119 -1.535 -7.403 -3.592 783 HA THR 119 HA THR 119 -2.413 -10.159 -4.114 784 HB THR 119 HB THR 119 -0.021 -8.807 -5.352 785 HG1 THR 119 HG1 THR 119 -2.559 -8.500 -5.972 786 HG21 THR 119 3HG2 THR 119 0.153 -11.246 -5.124 787 HG22 THR 119 1HG2 THR 119 0.014 -10.772 -6.815 788 HG23 THR 119 2HG2 THR 119 -1.384 -11.437 -5.970 789 H TYR 120 H TYR 120 -1.605 -11.591 -2.744 790 HA TYR 120 HA TYR 120 0.547 -10.816 -0.910 791 HB2 TYR 120 2HB TYR 120 -1.609 -12.900 -0.809 792 HB3 TYR 120 3HB TYR 120 -0.186 -13.038 0.209 793 HD1 TYR 120 HD2 TYR 120 0.301 -11.207 1.841 794 HD2 TYR 120 HD1 TYR 120 -3.402 -11.509 -0.222 795 HE1 TYR 120 HE2 TYR 120 -0.736 -9.789 3.539 796 HE2 TYR 120 HE1 TYR 120 -4.470 -10.098 1.484 797 HH TYR 120 HH TYR 120 -2.588 -8.482 3.965 798 H ALA 121 H ALA 121 2.125 -12.414 -0.329 799 HA ALA 121 HA ALA 121 3.483 -13.543 -2.484 800 HB1 ALA 121 3HB ALA 121 4.861 -14.671 -0.811 801 HB2 ALA 121 1HB ALA 121 3.669 -14.292 0.433 802 HB3 ALA 121 2HB ALA 121 4.555 -12.991 -0.362 803 H GLY 122 H GLY 122 2.872 -15.156 -3.734 804 HA2 GLY 122 2HA GLY 122 2.363 -17.333 -4.321 805 HA3 GLY 122 3HA GLY 122 2.231 -17.714 -2.616 806 H GLU 123 H GLU 123 0.282 -15.070 -3.687 807 HA GLU 123 HA GLU 123 -1.983 -16.836 -4.180 808 HB2 GLU 123 2HB GLU 123 -1.968 -16.422 -1.748 809 HB3 GLU 123 3HB GLU 123 -2.010 -14.694 -2.049 810 HG2 GLU 123 2HG GLU 123 -4.219 -14.836 -2.960 811 HG3 GLU 123 3HG GLU 123 -4.175 -16.598 -2.918 812 H GLY 124 H GLY 124 -3.621 -15.935 -5.423 813 HA2 GLY 124 2HA GLY 124 -2.772 -13.917 -7.228 814 HA3 GLY 124 3HA GLY 124 -4.348 -14.683 -7.198 815 HA PRO 125 HA PRO 125 -4.323 -10.123 -5.680 816 HB2 PRO 125 2HB PRO 125 -5.823 -9.619 -8.172 817 HB3 PRO 125 3HB PRO 125 -4.475 -8.718 -7.473 818 HG2 PRO 125 2HG PRO 125 -4.160 -10.237 -9.665 819 HG3 PRO 125 3HG PRO 125 -2.882 -10.081 -8.446 820 HD2 PRO 125 2HD PRO 125 -4.815 -12.319 -8.892 821 HD3 PRO 125 3HD PRO 125 -3.090 -12.383 -8.475 822 H ILE 126 H ILE 126 -5.949 -9.459 -4.470 823 HA ILE 126 HA ILE 126 -8.691 -10.309 -5.100 824 HB ILE 126 HB ILE 126 -9.162 -10.592 -2.687 825 HG12 ILE 126 2HG1 ILE 126 -6.164 -10.382 -2.314 826 HG13 ILE 126 3HG1 ILE 126 -7.328 -9.150 -1.842 827 HG21 ILE 126 1HG2 ILE 126 -8.033 -12.749 -2.389 828 HG22 ILE 126 2HG2 ILE 126 -6.952 -12.354 -3.726 829 HG23 ILE 126 3HG2 ILE 126 -8.684 -12.549 -4.013 830 HD11 ILE 126 3HD1 ILE 126 -8.338 -10.716 -0.271 831 HD12 ILE 126 1HD1 ILE 126 -6.622 -10.477 0.059 832 HD13 ILE 126 2HD1 ILE 126 -7.170 -11.947 -0.745 833 H GLY 127 H GLY 127 -10.307 -8.938 -3.774 834 HA2 GLY 127 2HA GLY 127 -9.808 -6.211 -4.439 835 HA3 GLY 127 3HA GLY 127 -11.209 -6.837 -3.586 836 H PHE 128 H PHE 128 -9.252 -4.521 -3.229 837 HA PHE 128 HA PHE 128 -8.627 -5.031 -0.392 838 HB2 PHE 128 2HB PHE 128 -6.570 -4.782 -1.635 839 HB3 PHE 128 3HB PHE 128 -7.143 -3.293 -2.373 840 HD1 PHE 128 HD1 PHE 128 -5.980 -4.819 0.775 841 HD2 PHE 128 HD2 PHE 128 -6.996 -1.207 -1.226 842 HE1 PHE 128 HE1 PHE 128 -4.988 -3.522 2.613 843 HE2 PHE 128 HE2 PHE 128 -6.003 0.091 0.610 844 HZ PHE 128 HZ PHE 128 -5.002 -1.063 2.530 845 H LYS 129 H LYS 129 -9.453 -3.709 1.092 846 HA LYS 129 HA LYS 129 -10.358 -1.060 0.269 847 HB2 LYS 129 2HB LYS 129 -12.334 -2.492 0.325 848 HB3 LYS 129 3HB LYS 129 -11.916 -3.028 1.942 849 HG2 LYS 129 2HG LYS 129 -12.295 -0.780 2.804 850 HG3 LYS 129 3HG LYS 129 -12.664 -0.204 1.176 851 HD2 LYS 129 2HD LYS 129 -14.556 -1.759 1.066 852 HD3 LYS 129 3HD LYS 129 -14.191 -2.311 2.701 853 HE2 LYS 129 2HE LYS 129 -14.874 0.526 1.962 854 HE3 LYS 129 3HE LYS 129 -16.029 -0.647 2.592 855 HZ1 LYS 129 3HZ LYS 129 -13.701 0.557 3.984 856 HZ2 LYS 129 1HZ LYS 129 -14.457 -0.855 4.550 857 HZ3 LYS 129 2HZ LYS 129 -15.331 0.586 4.427 858 H GLY 130 H GLY 130 -9.095 0.254 1.386 859 HA2 GLY 130 2HA GLY 130 -8.356 -0.464 4.144 860 HA3 GLY 130 3HA GLY 130 -7.505 0.687 3.118 861 H THR 131 H THR 131 -9.088 0.705 5.815 862 HA THR 131 HA THR 131 -10.495 3.231 5.221 863 HB THR 131 HB THR 131 -11.385 1.162 7.251 864 HG1 THR 131 HG1 THR 131 -12.148 0.198 5.528 865 HG21 THR 131 3HG2 THR 131 -12.039 3.493 7.759 866 HG22 THR 131 1HG2 THR 131 -13.436 2.498 7.345 867 HG23 THR 131 2HG2 THR 131 -12.767 3.621 6.162 868 H LEU 132 H LEU 132 -9.876 4.919 6.529 869 HA LEU 132 HA LEU 132 -7.742 4.651 8.342 870 HB2 LEU 132 2HB LEU 132 -9.807 6.827 8.065 871 HB3 LEU 132 3HB LEU 132 -8.494 6.923 9.221 872 HG LEU 132 HG LEU 132 -8.145 6.722 6.227 873 HD11 LEU 132 1HD1 LEU 132 -7.798 9.086 8.063 874 HD12 LEU 132 2HD1 LEU 132 -9.144 8.850 6.951 875 HD13 LEU 132 3HD1 LEU 132 -7.507 9.052 6.325 876 HD21 LEU 132 3HD2 LEU 132 -6.176 7.185 8.466 877 HD22 LEU 132 1HD2 LEU 132 -5.806 7.290 6.743 878 HD23 LEU 132 2HD2 LEU 132 -6.287 5.750 7.442 879 H THR 133 H THR 133 -7.585 4.110 10.416 880 HA THR 133 HA THR 133 -9.992 3.232 11.785 881 HB THR 133 HB THR 133 -7.086 2.941 12.592 882 HG1 THR 133 HG1 THR 133 -8.372 1.805 10.642 883 HG21 THR 133 3HG2 THR 133 -7.937 1.190 14.105 884 HG22 THR 133 1HG2 THR 133 -9.586 1.557 13.594 885 HG23 THR 133 2HG2 THR 133 -8.652 2.756 14.484 Start of MODEL 5 1 H1 ALA 2 1H ALA 2 0.239 6.409 10.897 2 H2 ALA 2 2H ALA 2 0.078 7.897 10.120 3 H3 ALA 2 3H ALA 2 0.300 6.488 9.207 4 HA ALA 2 HA ALA 2 -2.039 7.170 10.873 5 HB1 ALA 2 3HB ALA 2 -3.261 7.254 8.773 6 HB2 ALA 2 1HB ALA 2 -1.776 6.913 7.884 7 HB3 ALA 2 2HB ALA 2 -1.939 8.421 8.784 8 H LEU 3 H LEU 3 -3.276 5.528 11.486 9 HA LEU 3 HA LEU 3 -2.529 2.851 10.643 10 HB2 LEU 3 2HB LEU 3 -2.840 3.502 13.069 11 HB3 LEU 3 3HB LEU 3 -4.548 3.675 12.739 12 HG LEU 3 HG LEU 3 -3.795 1.531 13.890 13 HD11 LEU 3 1HD1 LEU 3 -5.998 1.728 12.918 14 HD12 LEU 3 2HD1 LEU 3 -5.346 0.114 12.651 15 HD13 LEU 3 3HD1 LEU 3 -5.361 1.287 11.335 16 HD21 LEU 3 3HD2 LEU 3 -2.824 0.871 11.112 17 HD22 LEU 3 1HD2 LEU 3 -2.936 -0.256 12.464 18 HD23 LEU 3 2HD2 LEU 3 -1.812 1.104 12.536 19 H TYR 4 H TYR 4 -3.709 1.596 9.354 20 HA TYR 4 HA TYR 4 -6.337 2.597 8.505 21 HB2 TYR 4 2HB TYR 4 -4.160 1.388 6.809 22 HB3 TYR 4 3HB TYR 4 -5.834 1.473 6.273 23 HD1 TYR 4 HD1 TYR 4 -2.807 3.405 7.008 24 HD2 TYR 4 HD2 TYR 4 -6.840 3.591 5.687 25 HE1 TYR 4 HE1 TYR 4 -2.431 5.697 6.195 26 HE2 TYR 4 HE2 TYR 4 -6.480 5.880 4.874 27 HH TYR 4 HH TYR 4 -3.368 7.271 4.607 28 H ASN 5 H ASN 5 -7.925 1.151 8.082 29 HA ASN 5 HA ASN 5 -7.605 -1.475 9.357 30 HB2 ASN 5 2HB ASN 5 -9.473 0.199 9.992 31 HB3 ASN 5 3HB ASN 5 -10.185 -0.196 8.425 32 HD21 ASN 5 1HD2 ASN 5 -9.512 -1.290 11.626 33 HD22 ASN 5 2HD2 ASN 5 -10.462 -2.729 11.553 34 H VAL 6 H VAL 6 -7.891 -3.361 8.128 35 HA VAL 6 HA VAL 6 -8.169 -2.828 5.247 36 HB VAL 6 HB VAL 6 -6.422 -4.853 6.640 37 HG11 VAL 6 1HG1 VAL 6 -5.699 -5.581 4.418 38 HG12 VAL 6 2HG1 VAL 6 -6.900 -4.521 3.679 39 HG13 VAL 6 3HG1 VAL 6 -7.422 -5.887 4.666 40 HG21 VAL 6 3HG2 VAL 6 -5.779 -2.527 4.835 41 HG22 VAL 6 1HG2 VAL 6 -4.608 -3.660 5.508 42 HG23 VAL 6 2HG2 VAL 6 -5.523 -2.595 6.577 43 H GLU 7 H GLU 7 -9.738 -3.740 4.240 44 HA GLU 7 HA GLU 7 -10.945 -6.203 5.298 45 HB2 GLU 7 2HB GLU 7 -12.221 -4.033 3.606 46 HB3 GLU 7 3HB GLU 7 -12.996 -5.527 4.100 47 HG2 GLU 7 2HG GLU 7 -12.886 -4.851 6.418 48 HG3 GLU 7 3HG GLU 7 -12.038 -3.375 5.961 49 H ASN 8 H ASN 8 -11.159 -7.880 3.896 50 HA ASN 8 HA ASN 8 -9.942 -7.508 1.246 51 HB2 ASN 8 2HB ASN 8 -9.723 -9.801 3.177 52 HB3 ASN 8 3HB ASN 8 -9.330 -9.981 1.469 53 HD21 ASN 8 1HD2 ASN 8 -8.250 -7.263 1.274 54 HD22 ASN 8 2HD2 ASN 8 -6.718 -7.315 2.068 55 H GLN 9 H GLN 9 -10.914 -8.311 -0.497 56 HA GLN 9 HA GLN 9 -13.408 -9.847 -0.124 57 HB2 GLN 9 2HB GLN 9 -13.737 -7.407 -0.697 58 HB3 GLN 9 3HB GLN 9 -12.922 -7.727 -2.218 59 HG2 GLN 9 2HG GLN 9 -14.680 -9.357 -2.777 60 HG3 GLN 9 3HG GLN 9 -15.514 -8.929 -1.282 61 HE21 GLN 9 1HE2 GLN 9 -17.306 -8.031 -2.148 62 HE22 GLN 9 2HE2 GLN 9 -17.300 -6.598 -3.109 63 H TRP 10 H TRP 10 -13.331 -11.741 -1.216 64 HA TRP 10 HA TRP 10 -11.612 -11.858 -3.583 65 HB2 TRP 10 2HB TRP 10 -11.302 -14.340 -2.970 66 HB3 TRP 10 3HB TRP 10 -10.404 -13.152 -2.046 67 HD1 TRP 10 HD1 TRP 10 -13.160 -15.759 -1.702 68 HE1 TRP 10 HE1 TRP 10 -13.678 -16.102 0.791 69 HE3 TRP 10 HE3 TRP 10 -10.396 -11.917 0.231 70 HZ2 TRP 10 HZ2 TRP 10 -13.000 -14.893 3.266 71 HZ3 TRP 10 HZ3 TRP 10 -10.385 -11.578 2.660 72 HH2 TRP 10 HH2 TRP 10 -11.653 -13.017 4.149 73 H GLY 11 H GLY 11 -12.382 -12.750 -5.362 74 HA2 GLY 11 2HA GLY 11 -13.877 -14.349 -6.457 75 HA3 GLY 11 3HA GLY 11 -15.070 -13.967 -5.228 76 H GLY 12 H GLY 12 -15.868 -11.717 -5.186 77 HA2 GLY 12 2HA GLY 12 -15.540 -10.105 -7.553 78 HA3 GLY 12 3HA GLY 12 -17.096 -10.929 -7.478 79 H SER 13 H SER 13 -16.913 -8.149 -7.489 80 HA SER 13 HA SER 13 -16.882 -6.981 -4.942 81 HB2 SER 13 2HB SER 13 -18.415 -5.983 -7.341 82 HB3 SER 13 3HB SER 13 -17.808 -5.029 -5.989 83 HG SER 13 HG SER 13 -15.678 -5.622 -6.649 84 H SER 14 H SER 14 -19.290 -8.895 -6.446 85 HA SER 14 HA SER 14 -21.548 -7.870 -5.041 86 HB2 SER 14 2HB SER 14 -22.620 -10.020 -5.798 87 HB3 SER 14 3HB SER 14 -21.920 -9.046 -7.094 88 HG SER 14 HG SER 14 -21.434 -11.545 -6.627 89 H ALA 15 H ALA 15 -18.937 -9.874 -4.171 90 HA ALA 15 HA ALA 15 -20.284 -11.345 -2.088 91 HB1 ALA 15 3HB ALA 15 -17.335 -11.043 -2.685 92 HB2 ALA 15 1HB ALA 15 -18.383 -12.328 -3.285 93 HB3 ALA 15 2HB ALA 15 -18.045 -12.199 -1.560 94 HA PRO 16 HA PRO 16 -19.732 -8.386 1.165 95 HB2 PRO 16 2HB PRO 16 -19.446 -9.971 3.329 96 HB3 PRO 16 3HB PRO 16 -20.986 -9.807 2.478 97 HG2 PRO 16 2HG PRO 16 -18.926 -11.968 2.261 98 HG3 PRO 16 3HG PRO 16 -20.690 -12.115 2.380 99 HD2 PRO 16 2HD PRO 16 -19.365 -12.305 0.029 100 HD3 PRO 16 3HD PRO 16 -21.005 -11.636 0.148 101 H TRP 17 H TRP 17 -18.257 -7.532 2.660 102 HA TRP 17 HA TRP 17 -15.477 -8.110 1.995 103 HB2 TRP 17 2HB TRP 17 -16.770 -5.845 3.519 104 HB3 TRP 17 3HB TRP 17 -15.027 -6.035 3.385 105 HD1 TRP 17 HD1 TRP 17 -18.084 -4.952 1.397 106 HE1 TRP 17 HE1 TRP 17 -17.301 -3.854 -0.795 107 HE3 TRP 17 HE3 TRP 17 -13.110 -6.083 1.658 108 HZ2 TRP 17 HZ2 TRP 17 -14.879 -3.514 -2.228 109 HZ3 TRP 17 HZ3 TRP 17 -11.628 -5.339 -0.158 110 HH2 TRP 17 HH2 TRP 17 -12.500 -4.081 -2.058 111 H ASN 18 H ASN 18 -13.946 -8.875 3.431 112 HA ASN 18 HA ASN 18 -14.908 -9.546 6.127 113 HB2 ASN 18 2HB ASN 18 -13.209 -11.194 4.242 114 HB3 ASN 18 3HB ASN 18 -13.420 -11.571 5.950 115 HD21 ASN 18 1HD2 ASN 18 -14.181 -12.886 3.342 116 HD22 ASN 18 2HD2 ASN 18 -15.846 -13.297 3.549 117 H GLU 19 H GLU 19 -13.584 -8.850 7.712 118 HA GLU 19 HA GLU 19 -11.492 -7.083 7.121 119 HB2 GLU 19 2HB GLU 19 -12.783 -6.953 9.159 120 HB3 GLU 19 3HB GLU 19 -12.130 -8.495 9.705 121 HG2 GLU 19 2HG GLU 19 -9.880 -7.467 9.765 122 HG3 GLU 19 3HG GLU 19 -10.604 -5.925 9.308 123 H GLY 20 H GLY 20 -9.435 -7.322 6.749 124 HA2 GLY 20 2HA GLY 20 -8.290 -10.036 6.991 125 HA3 GLY 20 3HA GLY 20 -7.788 -8.845 5.801 126 H GLY 21 H GLY 21 -8.218 -7.155 8.588 127 HA2 GLY 21 2HA GLY 21 -6.597 -7.338 10.506 128 HA3 GLY 21 3HA GLY 21 -5.367 -7.451 9.254 129 H GLN 22 H GLN 22 -4.306 -5.620 9.960 130 HA GLN 22 HA GLN 22 -5.505 -3.129 9.061 131 HB2 GLN 22 2HB GLN 22 -4.767 -1.956 11.136 132 HB3 GLN 22 3HB GLN 22 -6.077 -3.093 11.409 133 HG2 GLN 22 2HG GLN 22 -4.329 -4.753 12.137 134 HG3 GLN 22 3HG GLN 22 -3.165 -3.433 12.083 135 HE21 GLN 22 1HE2 GLN 22 -5.232 -1.515 12.993 136 HE22 GLN 22 2HE2 GLN 22 -5.396 -1.804 14.689 137 H TRP 23 H TRP 23 -4.030 -1.744 8.199 138 HA TRP 23 HA TRP 23 -1.227 -2.651 8.236 139 HB2 TRP 23 2HB TRP 23 -2.809 -1.443 5.965 140 HB3 TRP 23 3HB TRP 23 -1.053 -1.550 5.955 141 HD1 TRP 23 HD1 TRP 23 -2.258 -4.597 7.547 142 HE1 TRP 23 HE1 TRP 23 -2.345 -6.550 5.900 143 HE3 TRP 23 HE3 TRP 23 -1.766 -1.979 3.184 144 HZ2 TRP 23 HZ2 TRP 23 -2.209 -6.942 3.112 145 HZ3 TRP 23 HZ3 TRP 23 -1.748 -3.234 1.060 146 HH2 TRP 23 HH2 TRP 23 -1.963 -5.655 1.031 147 H GLU 24 H GLU 24 0.403 -1.037 8.033 148 HA GLU 24 HA GLU 24 -0.558 1.564 9.020 149 HB2 GLU 24 2HB GLU 24 0.928 0.447 10.627 150 HB3 GLU 24 3HB GLU 24 2.181 0.331 9.397 151 HG2 GLU 24 2HG GLU 24 2.340 2.747 9.288 152 HG3 GLU 24 3HG GLU 24 1.040 2.907 10.466 153 H ILE 25 H ILE 25 -0.633 3.011 7.547 154 HA ILE 25 HA ILE 25 1.488 3.165 5.528 155 HB ILE 25 HB ILE 25 -1.491 3.487 5.034 156 HG12 ILE 25 2HG1 ILE 25 0.473 1.524 3.827 157 HG13 ILE 25 3HG1 ILE 25 -0.635 1.142 5.137 158 HG21 ILE 25 1HG2 ILE 25 0.803 3.907 3.116 159 HG22 ILE 25 2HG2 ILE 25 -0.228 5.169 3.789 160 HG23 ILE 25 3HG2 ILE 25 -0.911 3.959 2.702 161 HD11 ILE 25 3HD1 ILE 25 -2.527 1.618 3.658 162 HD12 ILE 25 1HD1 ILE 25 -1.487 0.340 3.022 163 HD13 ILE 25 2HD1 ILE 25 -1.400 1.966 2.346 164 H GLY 26 H GLY 26 2.201 5.197 5.132 165 HA2 GLY 26 2HA GLY 26 2.137 7.557 5.145 166 HA3 GLY 26 3HA GLY 26 0.687 7.479 6.134 167 H SER 27 H SER 27 3.973 7.979 6.099 168 HA SER 27 HA SER 27 4.178 7.690 9.023 169 HB2 SER 27 2HB SER 27 6.441 7.846 7.025 170 HB3 SER 27 3HB SER 27 6.554 7.424 8.734 171 HG SER 27 HG SER 27 5.396 5.543 8.318 172 H ARG 28 H ARG 28 3.204 9.958 7.165 173 HA ARG 28 HA ARG 28 4.753 12.061 8.438 174 HB2 ARG 28 2HB ARG 28 4.203 11.912 5.462 175 HB3 ARG 28 3HB ARG 28 4.792 13.346 6.290 176 HG2 ARG 28 2HG ARG 28 6.813 12.151 6.950 177 HG3 ARG 28 3HG ARG 28 6.215 10.693 6.156 178 HD2 ARG 28 2HD ARG 28 6.227 11.877 4.007 179 HD3 ARG 28 3HD ARG 28 6.860 13.315 4.810 180 HE ARG 28 HE ARG 28 8.288 10.816 4.303 181 HH11 ARG 28 1HH1 ARG 28 8.342 14.068 5.613 182 HH12 ARG 28 2HH1 ARG 28 10.064 14.120 5.747 183 HH21 ARG 28 1HH2 ARG 28 10.600 10.884 4.499 184 HH22 ARG 28 2HH2 ARG 28 11.337 12.317 5.120 185 H SER 29 H SER 29 3.461 13.529 9.285 186 HA SER 29 HA SER 29 0.619 13.343 8.949 187 HB2 SER 29 2HB SER 29 1.656 13.855 11.133 188 HB3 SER 29 3HB SER 29 2.290 15.362 10.477 189 HG SER 29 HG SER 29 -0.457 14.921 10.240 190 H ASP 30 H ASP 30 3.131 14.994 7.389 191 HA ASP 30 HA ASP 30 1.735 17.396 6.670 192 HB2 ASP 30 2HB ASP 30 4.240 16.122 5.549 193 HB3 ASP 30 3HB ASP 30 3.650 17.723 5.131 194 H GLN 31 H GLN 31 2.599 14.373 5.052 195 HA GLN 31 HA GLN 31 0.622 14.967 2.964 196 HB2 GLN 31 2HB GLN 31 3.418 13.886 2.623 197 HB3 GLN 31 3HB GLN 31 2.189 13.766 1.378 198 HG2 GLN 31 2HG GLN 31 3.149 16.360 2.566 199 HG3 GLN 31 3HG GLN 31 3.770 15.654 1.075 200 HE21 GLN 31 1HE2 GLN 31 1.174 14.647 0.263 201 HE22 GLN 31 2HE2 GLN 31 0.263 16.014 -0.275 202 H ASN 32 H ASN 32 -0.871 13.459 2.827 203 HA ASN 32 HA ASN 32 -0.290 10.807 3.911 204 HB2 ASN 32 2HB ASN 32 -2.264 12.090 4.809 205 HB3 ASN 32 3HB ASN 32 -3.004 11.959 3.216 206 HD21 ASN 32 1HD2 ASN 32 -4.728 10.825 4.175 207 HD22 ASN 32 2HD2 ASN 32 -4.572 9.154 4.615 208 H VAL 33 H VAL 33 -1.382 8.964 2.691 209 HA VAL 33 HA VAL 33 -0.478 9.236 -0.084 210 HB VAL 33 HB VAL 33 -1.090 6.732 1.495 211 HG11 VAL 33 1HG1 VAL 33 0.321 7.112 -1.139 212 HG12 VAL 33 2HG1 VAL 33 -1.262 6.373 -0.890 213 HG13 VAL 33 3HG1 VAL 33 0.189 5.591 -0.263 214 HG21 VAL 33 3HG2 VAL 33 0.762 7.921 2.509 215 HG22 VAL 33 1HG2 VAL 33 1.562 8.063 0.944 216 HG23 VAL 33 2HG2 VAL 33 1.350 6.479 1.684 217 H VAL 34 H VAL 34 -1.846 9.128 -1.784 218 HA VAL 34 HA VAL 34 -4.631 8.358 -1.213 219 HB VAL 34 HB VAL 34 -5.340 9.726 -3.101 220 HG11 VAL 34 1HG1 VAL 34 -4.834 11.932 -2.185 221 HG12 VAL 34 2HG1 VAL 34 -3.541 11.229 -1.219 222 HG13 VAL 34 3HG1 VAL 34 -5.215 10.767 -0.919 223 HG21 VAL 34 3HG2 VAL 34 -3.744 11.215 -4.260 224 HG22 VAL 34 1HG2 VAL 34 -3.392 9.507 -4.541 225 HG23 VAL 34 2HG2 VAL 34 -2.416 10.431 -3.402 226 H ALA 35 H ALA 35 -1.839 7.524 -3.043 227 HA ALA 35 HA ALA 35 -3.274 5.243 -4.104 228 HB1 ALA 35 3HB ALA 35 -2.749 5.592 -6.426 229 HB2 ALA 35 1HB ALA 35 -1.893 7.084 -6.051 230 HB3 ALA 35 2HB ALA 35 -3.636 6.991 -5.826 231 H ILE 36 H ILE 36 -1.942 3.547 -4.851 232 HA ILE 36 HA ILE 36 0.934 3.821 -4.494 233 HB ILE 36 HB ILE 36 -0.686 1.760 -2.954 234 HG12 ILE 36 2HG1 ILE 36 1.121 3.925 -1.866 235 HG13 ILE 36 3HG1 ILE 36 -0.632 4.048 -1.940 236 HG21 ILE 36 1HG2 ILE 36 1.461 0.983 -2.075 237 HG22 ILE 36 2HG2 ILE 36 2.303 2.134 -3.113 238 HG23 ILE 36 3HG2 ILE 36 1.380 0.813 -3.830 239 HD11 ILE 36 3HD1 ILE 36 0.940 2.009 -0.375 240 HD12 ILE 36 1HD1 ILE 36 -0.819 2.112 -0.461 241 HD13 ILE 36 2HD1 ILE 36 0.103 3.417 0.282 242 H ASN 37 H ASN 37 1.828 2.841 -6.210 243 HA ASN 37 HA ASN 37 0.540 0.414 -7.289 244 HB2 ASN 37 2HB ASN 37 2.004 2.590 -8.832 245 HB3 ASN 37 3HB ASN 37 1.489 1.060 -9.519 246 HD21 ASN 37 1HD2 ASN 37 -1.044 1.097 -7.987 247 HD22 ASN 37 2HD2 ASN 37 -2.044 2.257 -8.785 248 H VAL 38 H VAL 38 1.860 -1.279 -6.722 249 HA VAL 38 HA VAL 38 4.724 -0.932 -6.954 250 HB VAL 38 HB VAL 38 5.258 -1.628 -4.650 251 HG11 VAL 38 1HG1 VAL 38 3.612 0.883 -4.801 252 HG12 VAL 38 2HG1 VAL 38 5.332 0.727 -5.161 253 HG13 VAL 38 3HG1 VAL 38 4.748 0.478 -3.514 254 HG21 VAL 38 3HG2 VAL 38 2.316 -1.243 -4.128 255 HG22 VAL 38 1HG2 VAL 38 3.542 -1.530 -2.895 256 HG23 VAL 38 2HG2 VAL 38 3.187 -2.777 -4.091 257 H GLU 39 H GLU 39 5.881 -2.813 -7.014 258 HA GLU 39 HA GLU 39 4.530 -5.327 -6.500 259 HB2 GLU 39 2HB GLU 39 5.844 -4.643 -9.138 260 HB3 GLU 39 3HB GLU 39 5.478 -6.284 -8.634 261 HG2 GLU 39 2HG GLU 39 3.094 -5.707 -8.529 262 HG3 GLU 39 3HG GLU 39 3.483 -4.075 -9.067 263 H SER 40 H SER 40 5.967 -7.030 -6.059 264 HA SER 40 HA SER 40 8.323 -6.139 -4.751 265 HB2 SER 40 2HB SER 40 8.586 -8.611 -4.270 266 HB3 SER 40 3HB SER 40 7.079 -7.880 -3.718 267 HG SER 40 HG SER 40 7.413 -9.330 -6.139 268 H GLY 41 H GLY 41 10.431 -6.443 -5.244 269 HA2 GLY 41 2HA GLY 41 11.070 -7.224 -7.977 270 HA3 GLY 41 3HA GLY 41 12.190 -6.555 -6.790 271 H ASP 42 H ASP 42 11.751 -8.152 -4.679 272 HA ASP 42 HA ASP 42 12.654 -10.786 -5.589 273 HB2 ASP 42 2HB ASP 42 12.991 -9.351 -2.941 274 HB3 ASP 42 3HB ASP 42 13.442 -11.035 -3.198 275 H ASP 43 H ASP 43 12.064 -12.130 -3.155 276 HA ASP 43 HA ASP 43 9.310 -12.759 -3.664 277 HB2 ASP 43 2HB ASP 43 11.311 -13.832 -1.684 278 HB3 ASP 43 3HB ASP 43 9.646 -14.394 -1.747 279 H GLY 44 H GLY 44 9.278 -10.180 -2.879 280 HA2 GLY 44 2HA GLY 44 7.693 -9.023 -1.575 281 HA3 GLY 44 3HA GLY 44 7.674 -10.370 -0.444 282 H GLN 45 H GLN 45 10.796 -10.035 -0.852 283 HA GLN 45 HA GLN 45 11.197 -8.616 1.576 284 HB2 GLN 45 2HB GLN 45 13.167 -9.532 -0.513 285 HB3 GLN 45 3HB GLN 45 13.628 -8.789 1.011 286 HG2 GLN 45 2HG GLN 45 12.484 -10.624 2.202 287 HG3 GLN 45 3HG GLN 45 12.161 -11.386 0.645 288 HE21 GLN 45 1HE2 GLN 45 14.546 -10.582 2.997 289 HE22 GLN 45 2HE2 GLN 45 15.821 -11.542 2.356 290 H THR 46 H THR 46 11.449 -7.783 -1.803 291 HA THR 46 HA THR 46 11.938 -5.008 -1.009 292 HB THR 46 HB THR 46 12.993 -4.774 -3.313 293 HG1 THR 46 HG1 THR 46 13.888 -7.207 -3.674 294 HG21 THR 46 3HG2 THR 46 14.341 -4.846 -1.265 295 HG22 THR 46 1HG2 THR 46 15.163 -5.669 -2.591 296 HG23 THR 46 2HG2 THR 46 14.358 -6.608 -1.333 297 H LEU 47 H LEU 47 10.667 -3.473 -1.970 298 HA LEU 47 HA LEU 47 8.630 -4.402 -3.870 299 HB2 LEU 47 2HB LEU 47 8.235 -2.485 -1.568 300 HB3 LEU 47 3HB LEU 47 7.039 -2.862 -2.784 301 HG LEU 47 HG LEU 47 8.143 -4.850 -0.798 302 HD11 LEU 47 1HD1 LEU 47 5.520 -3.361 -0.840 303 HD12 LEU 47 2HD1 LEU 47 6.829 -3.145 0.325 304 HD13 LEU 47 3HD1 LEU 47 5.939 -4.668 0.268 305 HD21 LEU 47 3HD2 LEU 47 7.394 -5.894 -2.864 306 HD22 LEU 47 1HD2 LEU 47 5.858 -5.031 -2.765 307 HD23 LEU 47 2HD2 LEU 47 6.267 -6.246 -1.557 308 H ASN 48 H ASN 48 8.597 -3.170 -5.711 309 HA ASN 48 HA ASN 48 9.836 -0.511 -5.552 310 HB2 ASN 48 2HB ASN 48 10.078 -2.582 -7.757 311 HB3 ASN 48 3HB ASN 48 10.642 -0.924 -7.881 312 HD21 ASN 48 1HD2 ASN 48 12.043 -3.534 -8.001 313 HD22 ASN 48 2HD2 ASN 48 13.298 -3.438 -6.817 314 H GLY 49 H GLY 49 8.692 1.096 -6.551 315 HA2 GLY 49 2HA GLY 49 6.937 0.780 -8.686 316 HA3 GLY 49 3HA GLY 49 5.988 0.603 -7.222 317 H THR 50 H THR 50 4.806 2.457 -7.665 318 HA THR 50 HA THR 50 6.250 4.937 -7.091 319 HB THR 50 HB THR 50 4.638 6.103 -8.651 320 HG1 THR 50 HG1 THR 50 3.375 4.924 -9.968 321 HG21 THR 50 3HG2 THR 50 6.516 4.086 -9.904 322 HG22 THR 50 1HG2 THR 50 6.954 5.695 -9.328 323 HG23 THR 50 2HG2 THR 50 5.868 5.517 -10.705 324 H MET 51 H MET 51 5.124 6.442 -5.826 325 HA MET 51 HA MET 51 2.506 5.587 -4.789 326 HB2 MET 51 2HB MET 51 4.859 6.858 -3.439 327 HB3 MET 51 3HB MET 51 3.237 7.070 -2.808 328 HG2 MET 51 2HG MET 51 3.032 4.686 -2.475 329 HG3 MET 51 3HG MET 51 4.632 4.417 -3.167 330 HE1 MET 51 3HE MET 51 2.777 6.591 -0.523 331 HE2 MET 51 1HE MET 51 4.079 7.654 -1.056 332 HE3 MET 51 2HE MET 51 4.085 7.012 0.584 333 H THR 52 H THR 52 1.042 7.290 -4.236 334 HA THR 52 HA THR 52 1.763 9.937 -5.285 335 HB THR 52 HB THR 52 -0.953 8.649 -5.629 336 HG1 THR 52 HG1 THR 52 1.340 8.429 -7.081 337 HG21 THR 52 3HG2 THR 52 -1.347 10.545 -7.157 338 HG22 THR 52 1HG2 THR 52 0.240 11.193 -6.746 339 HG23 THR 52 2HG2 THR 52 -1.014 11.089 -5.514 340 H TYR 53 H TYR 53 1.462 11.497 -3.831 341 HA TYR 53 HA TYR 53 -0.070 10.932 -1.395 342 HB2 TYR 53 2HB TYR 53 1.966 13.074 -2.036 343 HB3 TYR 53 3HB TYR 53 1.000 13.079 -0.573 344 HD1 TYR 53 HD2 TYR 53 1.227 11.044 0.980 345 HD2 TYR 53 HD1 TYR 53 4.003 11.944 -2.110 346 HE1 TYR 53 HE2 TYR 53 2.927 9.688 2.122 347 HE2 TYR 53 HE1 TYR 53 5.713 10.599 -0.968 348 HH TYR 53 HH TYR 53 4.982 8.488 1.595 349 H ALA 54 H ALA 54 -1.389 12.706 -0.499 350 HA ALA 54 HA ALA 54 -3.276 13.665 -2.363 351 HB1 ALA 54 3HB ALA 54 -2.789 14.640 0.454 352 HB2 ALA 54 1HB ALA 54 -3.780 13.250 0.018 353 HB3 ALA 54 2HB ALA 54 -4.257 14.868 -0.494 354 H GLY 55 H GLY 55 -3.249 15.388 -3.635 355 HA2 GLY 55 2HA GLY 55 -2.782 17.490 -4.429 356 HA3 GLY 55 3HA GLY 55 -2.052 17.865 -2.880 357 H GLU 56 H GLU 56 -0.805 15.061 -4.318 358 HA GLU 56 HA GLU 56 1.472 16.542 -5.454 359 HB2 GLU 56 2HB GLU 56 1.546 14.082 -3.698 360 HB3 GLU 56 3HB GLU 56 2.926 14.673 -4.598 361 HG2 GLU 56 2HG GLU 56 1.474 16.206 -2.449 362 HG3 GLU 56 3HG GLU 56 2.975 15.312 -2.227 363 H GLY 57 H GLY 57 2.895 14.828 -6.692 364 HA2 GLY 57 2HA GLY 57 1.038 13.334 -8.430 365 HA3 GLY 57 3HA GLY 57 2.571 14.020 -8.960 366 HA PRO 58 HA PRO 58 3.055 9.450 -7.812 367 HB2 PRO 58 2HB PRO 58 4.176 9.327 -10.548 368 HB3 PRO 58 3HB PRO 58 3.024 8.249 -9.760 369 HG2 PRO 58 2HG PRO 58 2.247 9.935 -11.676 370 HG3 PRO 58 3HG PRO 58 1.211 9.585 -10.282 371 HD2 PRO 58 2HD PRO 58 2.937 11.976 -10.808 372 HD3 PRO 58 3HD PRO 58 1.297 11.900 -10.130 373 H ILE 59 H ILE 59 4.887 8.792 -6.927 374 HA ILE 59 HA ILE 59 7.444 9.964 -7.791 375 HB ILE 59 HB ILE 59 8.169 10.077 -5.438 376 HG12 ILE 59 2HG1 ILE 59 5.288 9.474 -4.749 377 HG13 ILE 59 3HG1 ILE 59 6.616 8.331 -4.591 378 HG21 ILE 59 1HG2 ILE 59 5.676 11.653 -6.057 379 HG22 ILE 59 2HG2 ILE 59 7.343 12.102 -6.426 380 HG23 ILE 59 3HG2 ILE 59 6.799 12.024 -4.750 381 HD11 ILE 59 3HD1 ILE 59 6.116 9.270 -2.460 382 HD12 ILE 59 1HD1 ILE 59 6.263 10.908 -3.100 383 HD13 ILE 59 2HD1 ILE 59 7.685 9.876 -2.993 384 H GLY 60 H GLY 60 9.310 8.642 -6.870 385 HA2 GLY 60 2HA GLY 60 8.829 5.882 -7.555 386 HA3 GLY 60 3HA GLY 60 10.372 6.585 -7.098 387 H PHE 61 H PHE 61 9.001 4.093 -6.242 388 HA PHE 61 HA PHE 61 9.113 4.558 -3.339 389 HB2 PHE 61 2HB PHE 61 6.795 4.329 -3.817 390 HB3 PHE 61 3HB PHE 61 7.078 2.988 -4.914 391 HD1 PHE 61 HD2 PHE 61 7.562 0.755 -4.046 392 HD2 PHE 61 HD1 PHE 61 6.669 3.987 -1.440 393 HE1 PHE 61 HE2 PHE 61 7.123 -0.838 -2.224 394 HE2 PHE 61 HE1 PHE 61 6.230 2.399 0.381 395 HZ PHE 61 HZ PHE 61 6.454 -0.016 -0.009 396 H ARG 62 H ARG 62 10.517 3.253 -2.313 397 HA ARG 62 HA ARG 62 10.928 0.550 -3.349 398 HB2 ARG 62 2HB ARG 62 12.844 1.954 -4.099 399 HB3 ARG 62 3HB ARG 62 13.162 2.386 -2.426 400 HG2 ARG 62 2HG ARG 62 13.631 0.048 -1.902 401 HG3 ARG 62 3HG ARG 62 13.286 -0.399 -3.571 402 HD2 ARG 62 2HD ARG 62 15.666 -0.255 -3.288 403 HD3 ARG 62 3HD ARG 62 15.138 1.085 -4.300 404 HE ARG 62 HE ARG 62 15.211 1.965 -1.636 405 HH11 ARG 62 1HH1 ARG 62 17.421 0.925 -4.146 406 HH12 ARG 62 2HH1 ARG 62 18.741 1.875 -3.566 407 HH21 ARG 62 1HH2 ARG 62 16.945 3.228 -0.855 408 HH22 ARG 62 2HH2 ARG 62 18.468 3.201 -1.688 409 H ALA 63 H ALA 63 10.800 -0.947 -1.746 410 HA ALA 63 HA ALA 63 11.161 -0.033 1.027 411 HB1 ALA 63 3HB ALA 63 9.176 -1.210 1.769 412 HB2 ALA 63 1HB ALA 63 8.843 -1.729 0.118 413 HB3 ALA 63 2HB ALA 63 8.748 -0.020 0.538 414 H THR 64 H THR 64 11.917 -1.557 2.476 415 HA THR 64 HA THR 64 12.588 -4.192 1.348 416 HB THR 64 HB THR 64 14.381 -2.516 3.133 417 HG1 THR 64 HG1 THR 64 13.994 -2.557 0.457 418 HG21 THR 64 3HG2 THR 64 14.659 -4.947 3.459 419 HG22 THR 64 1HG2 THR 64 16.063 -4.241 2.654 420 HG23 THR 64 2HG2 THR 64 14.874 -5.146 1.718 421 H LEU 65 H LEU 65 12.209 -5.934 2.652 422 HA LEU 65 HA LEU 65 10.521 -5.638 4.901 423 HB2 LEU 65 2HB LEU 65 10.393 -7.533 3.385 424 HB3 LEU 65 3HB LEU 65 12.007 -8.037 3.847 425 HG LEU 65 HG LEU 65 11.205 -8.488 6.125 426 HD11 LEU 65 1HD1 LEU 65 8.793 -8.513 6.553 427 HD12 LEU 65 2HD1 LEU 65 8.519 -7.761 4.981 428 HD13 LEU 65 3HD1 LEU 65 9.403 -6.891 6.234 429 HD21 LEU 65 3HD2 LEU 65 11.252 -10.284 4.478 430 HD22 LEU 65 1HD2 LEU 65 9.630 -9.848 3.940 431 HD23 LEU 65 2HD2 LEU 65 9.878 -10.474 5.570 432 H LEU 66 H LEU 66 10.960 -5.422 7.003 433 HA LEU 66 HA LEU 66 13.719 -5.596 7.904 434 HB2 LEU 66 2HB LEU 66 11.247 -4.323 8.925 435 HB3 LEU 66 3HB LEU 66 12.430 -4.824 10.115 436 HG LEU 66 HG LEU 66 12.668 -2.459 9.497 437 HD11 LEU 66 1HD1 LEU 66 14.982 -4.161 8.586 438 HD12 LEU 66 2HD1 LEU 66 14.612 -3.720 10.252 439 HD13 LEU 66 3HD1 LEU 66 15.063 -2.475 9.089 440 HD21 LEU 66 3HD2 LEU 66 13.265 -3.553 6.758 441 HD22 LEU 66 1HD2 LEU 66 13.561 -1.891 7.269 442 HD23 LEU 66 2HD2 LEU 66 11.911 -2.516 7.215 443 H GLY 67 H GLY 67 10.610 -7.174 8.548 444 HA2 GLY 67 2HA GLY 67 12.046 -9.319 9.859 445 HA3 GLY 67 3HA GLY 67 10.941 -8.434 10.891 446 H ASN 68 H ASN 68 8.588 -8.189 9.805 447 HA ASN 68 HA ASN 68 7.969 -10.688 8.475 448 HB2 ASN 68 2HB ASN 68 6.593 -9.623 10.957 449 HB3 ASN 68 3HB ASN 68 5.955 -10.913 9.945 450 HD21 ASN 68 1HD2 ASN 68 7.003 -12.903 9.922 451 HD22 ASN 68 2HD2 ASN 68 8.085 -13.377 11.182 452 H ASN 69 H ASN 69 5.904 -8.190 9.912 453 HA ASN 69 HA ASN 69 4.827 -7.672 7.239 454 HB2 ASN 69 2HB ASN 69 3.802 -6.931 9.990 455 HB3 ASN 69 3HB ASN 69 3.017 -6.479 8.482 456 HD21 ASN 69 1HD2 ASN 69 2.084 -8.114 10.725 457 HD22 ASN 69 2HD2 ASN 69 1.638 -9.635 10.043 458 H SER 70 H SER 70 7.129 -6.437 9.259 459 HA SER 70 HA SER 70 6.545 -3.636 8.838 460 HB2 SER 70 2HB SER 70 8.963 -4.854 10.172 461 HB3 SER 70 3HB SER 70 8.360 -3.203 10.335 462 HG SER 70 HG SER 70 6.998 -3.864 11.784 463 H TYR 71 H TYR 71 7.254 -2.507 7.202 464 HA TYR 71 HA TYR 71 9.656 -3.368 5.709 465 HB2 TYR 71 2HB TYR 71 7.070 -2.150 4.749 466 HB3 TYR 71 3HB TYR 71 8.537 -2.115 3.783 467 HD1 TYR 71 HD1 TYR 71 6.053 -4.381 5.355 468 HD2 TYR 71 HD2 TYR 71 9.163 -3.943 2.502 469 HE1 TYR 71 HE1 TYR 71 5.473 -6.573 4.395 470 HE2 TYR 71 HE2 TYR 71 8.598 -6.133 1.539 471 HH TYR 71 HH TYR 71 7.464 -8.047 1.915 472 H GLU 72 H GLU 72 11.123 -1.762 5.161 473 HA GLU 72 HA GLU 72 10.537 0.894 6.245 474 HB2 GLU 72 2HB GLU 72 12.681 -0.124 6.951 475 HB3 GLU 72 3HB GLU 72 13.182 -0.216 5.266 476 HG2 GLU 72 2HG GLU 72 13.147 2.196 5.097 477 HG3 GLU 72 3HG GLU 72 12.548 2.326 6.747 478 H VAL 73 H VAL 73 9.963 2.444 4.941 479 HA VAL 73 HA VAL 73 10.064 1.944 2.068 480 HB VAL 73 HB VAL 73 8.286 3.699 3.761 481 HG11 VAL 73 1HG1 VAL 73 8.704 4.860 1.686 482 HG12 VAL 73 2HG1 VAL 73 7.059 4.218 1.688 483 HG13 VAL 73 3HG1 VAL 73 8.326 3.409 0.762 484 HG21 VAL 73 3HG2 VAL 73 7.771 1.315 3.837 485 HG22 VAL 73 1HG2 VAL 73 7.676 1.275 2.076 486 HG23 VAL 73 2HG2 VAL 73 6.506 2.215 3.002 487 H GLU 74 H GLU 74 11.102 3.213 0.731 488 HA GLU 74 HA GLU 74 12.111 5.816 1.623 489 HB2 GLU 74 2HB GLU 74 13.559 3.714 -0.004 490 HB3 GLU 74 3HB GLU 74 14.102 5.375 0.157 491 HG2 GLU 74 2HG GLU 74 14.404 5.068 2.543 492 HG3 GLU 74 3HG GLU 74 13.796 3.417 2.424 493 H ASN 75 H ASN 75 11.462 7.396 0.249 494 HA ASN 75 HA ASN 75 10.373 6.503 -2.315 495 HB2 ASN 75 2HB ASN 75 9.460 8.714 -0.501 496 HB3 ASN 75 3HB ASN 75 8.963 8.605 -2.188 497 HD21 ASN 75 1HD2 ASN 75 7.313 8.431 0.192 498 HD22 ASN 75 2HD2 ASN 75 6.549 6.881 0.119 499 H GLN 76 H GLN 76 10.433 7.919 -4.061 500 HA GLN 76 HA GLN 76 12.897 9.554 -4.138 501 HB2 GLN 76 2HB GLN 76 13.034 7.438 -5.377 502 HB3 GLN 76 3HB GLN 76 11.592 7.863 -6.271 503 HG2 GLN 76 2HG GLN 76 12.836 9.830 -7.181 504 HG3 GLN 76 3HG GLN 76 14.290 9.165 -6.429 505 HE21 GLN 76 1HE2 GLN 76 15.173 7.266 -7.242 506 HE22 GLN 76 2HE2 GLN 76 14.732 6.624 -8.785 507 H TRP 77 H TRP 77 12.465 11.690 -4.530 508 HA TRP 77 HA TRP 77 9.999 12.276 -6.006 509 HB2 TRP 77 2HB TRP 77 10.955 14.724 -4.966 510 HB3 TRP 77 3HB TRP 77 9.515 13.840 -4.489 511 HD1 TRP 77 HD1 TRP 77 12.932 14.872 -3.283 512 HE1 TRP 77 HE1 TRP 77 13.227 14.137 -0.831 513 HE3 TRP 77 HE3 TRP 77 8.850 11.831 -2.843 514 HZ2 TRP 77 HZ2 TRP 77 11.914 12.483 1.031 515 HZ3 TRP 77 HZ3 TRP 77 8.437 10.714 -0.691 516 HH2 TRP 77 HH2 TRP 77 9.941 11.032 1.205 517 H GLY 78 H GLY 78 10.373 12.518 -8.030 518 HA2 GLY 78 2HA GLY 78 11.859 14.562 -9.164 519 HA3 GLY 78 3HA GLY 78 12.894 13.134 -9.153 520 H GLY 79 H GLY 79 12.806 13.218 -11.525 521 HA2 GLY 79 2HA GLY 79 10.198 12.518 -12.630 522 HA3 GLY 79 3HA GLY 79 11.625 13.002 -13.540 523 H ASP 80 H ASP 80 13.520 11.333 -12.384 524 HA ASP 80 HA ASP 80 12.810 8.621 -12.227 525 HB2 ASP 80 2HB ASP 80 12.269 9.010 -14.656 526 HB3 ASP 80 3HB ASP 80 13.969 9.389 -14.916 527 H SER 81 H SER 81 14.612 7.288 -11.867 528 HA SER 81 HA SER 81 16.672 6.789 -11.036 529 HB2 SER 81 2HB SER 81 17.137 6.967 -13.472 530 HB3 SER 81 3HB SER 81 17.577 8.657 -13.246 531 HG SER 81 HG SER 81 19.215 7.903 -11.794 532 H ALA 82 H ALA 82 15.376 9.006 -9.712 533 HA ALA 82 HA ALA 82 17.512 10.889 -9.092 534 HB1 ALA 82 3HB ALA 82 15.224 11.725 -9.458 535 HB2 ALA 82 1HB ALA 82 15.801 12.097 -7.833 536 HB3 ALA 82 2HB ALA 82 14.666 10.772 -8.083 537 HA PRO 83 HA PRO 83 18.817 9.086 -5.238 538 HB2 PRO 83 2HB PRO 83 18.234 11.589 -3.769 539 HB3 PRO 83 3HB PRO 83 19.774 10.745 -3.986 540 HG2 PRO 83 2HG PRO 83 19.255 13.039 -5.269 541 HG3 PRO 83 3HG PRO 83 20.179 11.732 -6.035 542 HD2 PRO 83 2HD PRO 83 17.322 12.515 -6.424 543 HD3 PRO 83 3HD PRO 83 18.529 12.009 -7.627 544 H TRP 84 H TRP 84 18.098 8.223 -3.239 545 HA TRP 84 HA TRP 84 15.180 8.236 -2.989 546 HB2 TRP 84 2HB TRP 84 17.265 6.283 -1.991 547 HB3 TRP 84 3HB TRP 84 15.543 6.146 -1.662 548 HD1 TRP 84 HD1 TRP 84 18.136 5.492 -4.344 549 HE1 TRP 84 HE1 TRP 84 17.029 4.251 -6.309 550 HE3 TRP 84 HE3 TRP 84 13.248 5.943 -2.928 551 HZ2 TRP 84 HZ2 TRP 84 14.425 3.557 -7.150 552 HZ3 TRP 84 HZ3 TRP 84 11.509 4.963 -4.370 553 HH2 TRP 84 HH2 TRP 84 12.085 3.798 -6.434 554 H HIS 85 H HIS 85 14.180 8.670 -1.068 555 HA HIS 85 HA HIS 85 15.873 9.547 1.184 556 HB2 HIS 85 2HB HIS 85 13.392 10.950 0.145 557 HB3 HIS 85 3HB HIS 85 14.255 11.384 1.614 558 HD1 HIS 85 HD1 HIS 85 16.368 12.820 1.351 559 HD2 HIS 85 HD2 HIS 85 14.713 11.629 -2.267 560 HE1 HIS 85 HE1 HIS 85 17.577 14.139 -0.407 561 H SER 86 H SER 86 15.097 9.001 3.224 562 HA SER 86 HA SER 86 13.447 6.747 3.388 563 HB2 SER 86 2HB SER 86 14.201 8.677 5.596 564 HB3 SER 86 3HB SER 86 13.585 7.039 5.812 565 HG SER 86 HG SER 86 15.645 6.597 5.832 566 H GLY 87 H GLY 87 11.317 6.457 3.670 567 HA2 GLY 87 2HA GLY 87 9.652 8.861 3.895 568 HA3 GLY 87 3HA GLY 87 9.145 7.317 3.214 569 H GLY 88 H GLY 88 10.030 5.566 5.165 570 HA2 GLY 88 2HA GLY 88 9.749 5.993 7.802 571 HA3 GLY 88 3HA GLY 88 8.079 6.102 7.263 572 H ASN 89 H ASN 89 7.995 4.236 8.854 573 HA ASN 89 HA ASN 89 8.707 1.719 7.504 574 HB2 ASN 89 2HB ASN 89 8.218 2.243 10.446 575 HB3 ASN 89 3HB ASN 89 8.494 0.654 9.750 576 HD21 ASN 89 1HD2 ASN 89 10.559 0.139 8.971 577 HD22 ASN 89 2HD2 ASN 89 11.954 1.037 9.452 578 H TRP 90 H TRP 90 7.098 0.555 6.711 579 HA TRP 90 HA TRP 90 4.362 1.186 7.599 580 HB2 TRP 90 2HB TRP 90 5.374 0.385 4.869 581 HB3 TRP 90 3HB TRP 90 3.669 0.388 5.303 582 HD1 TRP 90 HD1 TRP 90 5.280 3.269 6.922 583 HE1 TRP 90 HE1 TRP 90 4.847 5.418 5.618 584 HE3 TRP 90 HE3 TRP 90 3.494 1.220 2.577 585 HZ2 TRP 90 HZ2 TRP 90 3.852 6.158 3.069 586 HZ3 TRP 90 HZ3 TRP 90 2.822 2.723 0.775 587 HH2 TRP 90 HH2 TRP 90 2.998 5.128 1.010 588 H ILE 91 H ILE 91 2.843 -0.480 7.677 589 HA ILE 91 HA ILE 91 4.028 -3.172 7.971 590 HB ILE 91 HB ILE 91 1.472 -2.056 9.184 591 HG12 ILE 91 2HG1 ILE 91 4.058 -2.897 10.514 592 HG13 ILE 91 3HG1 ILE 91 3.566 -1.236 10.222 593 HG21 ILE 91 1HG2 ILE 91 2.714 -4.776 9.561 594 HG22 ILE 91 2HG2 ILE 91 1.258 -4.435 8.623 595 HG23 ILE 91 3HG2 ILE 91 1.267 -4.171 10.368 596 HD11 ILE 91 3HD1 ILE 91 2.075 -3.197 11.951 597 HD12 ILE 91 1HD1 ILE 91 1.685 -1.494 11.717 598 HD13 ILE 91 2HD1 ILE 91 3.177 -1.954 12.539 599 H LEU 92 H LEU 92 3.678 -4.424 6.227 600 HA LEU 92 HA LEU 92 1.095 -4.254 4.812 601 HB2 LEU 92 2HB LEU 92 3.804 -4.356 3.474 602 HB3 LEU 92 3HB LEU 92 2.254 -4.341 2.668 603 HG LEU 92 HG LEU 92 3.346 -2.055 4.316 604 HD11 LEU 92 1HD1 LEU 92 3.181 -2.407 1.324 605 HD12 LEU 92 2HD1 LEU 92 4.651 -2.375 2.299 606 HD13 LEU 92 3HD1 LEU 92 3.652 -0.928 2.165 607 HD21 LEU 92 3HD2 LEU 92 0.922 -2.089 4.308 608 HD22 LEU 92 1HD2 LEU 92 0.908 -2.265 2.551 609 HD23 LEU 92 2HD2 LEU 92 1.511 -0.779 3.283 610 H GLY 93 H GLY 93 0.806 -6.257 6.145 611 HA2 GLY 93 2HA GLY 93 1.593 -8.595 4.616 612 HA3 GLY 93 3HA GLY 93 2.194 -8.537 6.264 613 H SER 94 H SER 94 0.561 -8.369 8.025 614 HA SER 94 HA SER 94 -1.230 -9.079 9.131 615 HB2 SER 94 2HB SER 94 -2.633 -8.962 6.453 616 HB3 SER 94 3HB SER 94 -3.436 -9.208 8.006 617 HG SER 94 HG SER 94 -2.600 -7.179 8.665 618 H ARG 95 H ARG 95 0.564 -10.879 7.319 619 HA ARG 95 HA ARG 95 -0.895 -13.333 8.007 620 HB2 ARG 95 2HB ARG 95 0.929 -12.915 5.629 621 HB3 ARG 95 3HB ARG 95 0.151 -14.425 6.071 622 HG2 ARG 95 2HG ARG 95 -1.342 -11.922 5.328 623 HG3 ARG 95 3HG ARG 95 -0.916 -13.195 4.181 624 HD2 ARG 95 2HD ARG 95 -2.235 -14.790 5.433 625 HD3 ARG 95 3HD ARG 95 -2.591 -13.577 6.660 626 HE ARG 95 HE ARG 95 -3.637 -12.335 4.651 627 HH11 ARG 95 1HH1 ARG 95 -3.688 -15.800 5.154 628 HH12 ARG 95 2HH1 ARG 95 -5.144 -16.039 4.260 629 HH21 ARG 95 1HH2 ARG 95 -5.588 -12.644 3.484 630 HH22 ARG 95 2HH2 ARG 95 -6.227 -14.242 3.297 631 H GLU 96 H GLU 96 0.357 -14.894 8.986 632 HA GLU 96 HA GLU 96 2.573 -13.923 10.422 633 HB2 GLU 96 2HB GLU 96 2.708 -16.167 11.377 634 HB3 GLU 96 3HB GLU 96 1.061 -15.549 11.373 635 HG2 GLU 96 2HG GLU 96 0.586 -16.903 9.375 636 HG3 GLU 96 3HG GLU 96 2.217 -17.566 9.460 637 H ASN 97 H ASN 97 2.379 -16.073 7.604 638 HA ASN 97 HA ASN 97 5.321 -15.965 7.453 639 HB2 ASN 97 2HB ASN 97 3.526 -18.355 7.041 640 HB3 ASN 97 3HB ASN 97 5.175 -18.299 6.438 641 HD21 ASN 97 1HD2 ASN 97 3.911 -20.022 8.463 642 HD22 ASN 97 2HD2 ASN 97 4.874 -19.832 9.887 643 H GLN 98 H GLN 98 3.347 -14.305 6.110 644 HA GLN 98 HA GLN 98 4.261 -14.707 3.413 645 HB2 GLN 98 2HB GLN 98 2.190 -16.184 3.723 646 HB3 GLN 98 3HB GLN 98 1.281 -14.684 3.819 647 HG2 GLN 98 2HG GLN 98 2.060 -14.076 1.591 648 HG3 GLN 98 3HG GLN 98 2.966 -15.584 1.499 649 HE21 GLN 98 1HE2 GLN 98 1.913 -16.541 -0.126 650 HE22 GLN 98 2HE2 GLN 98 0.243 -16.997 -0.062 651 H ASN 99 H ASN 99 4.471 -12.773 2.430 652 HA ASN 99 HA ASN 99 3.195 -10.489 3.763 653 HB2 ASN 99 2HB ASN 99 5.856 -10.682 2.369 654 HB3 ASN 99 3HB ASN 99 5.140 -9.168 2.919 655 HD21 ASN 99 1HD2 ASN 99 7.608 -10.430 3.727 656 HD22 ASN 99 2HD2 ASN 99 7.484 -10.663 5.436 657 H VAL 100 H VAL 100 3.402 -8.491 2.224 658 HA VAL 100 HA VAL 100 1.707 -9.181 -0.046 659 HB VAL 100 HB VAL 100 1.409 -6.813 -0.439 660 HG11 VAL 100 1HG1 VAL 100 1.272 -7.489 2.478 661 HG12 VAL 100 2HG1 VAL 100 0.043 -7.827 1.260 662 HG13 VAL 100 3HG1 VAL 100 0.420 -6.159 1.694 663 HG21 VAL 100 3HG2 VAL 100 3.706 -6.079 0.006 664 HG22 VAL 100 1HG2 VAL 100 3.454 -6.354 1.731 665 HG23 VAL 100 2HG2 VAL 100 2.528 -5.110 0.886 666 H VAL 101 H VAL 101 2.155 -8.915 -2.175 667 HA VAL 101 HA VAL 101 4.961 -8.301 -2.853 668 HB VAL 101 HB VAL 101 4.898 -9.877 -4.755 669 HG11 VAL 101 1HG1 VAL 101 5.906 -10.491 -2.610 670 HG12 VAL 101 2HG1 VAL 101 5.241 -11.882 -3.461 671 HG13 VAL 101 3HG1 VAL 101 4.370 -11.186 -2.096 672 HG21 VAL 101 3HG2 VAL 101 3.183 -11.627 -4.829 673 HG22 VAL 101 1HG2 VAL 101 2.506 -10.024 -5.110 674 HG23 VAL 101 2HG2 VAL 101 2.296 -10.804 -3.542 675 H ALA 102 H ALA 102 1.612 -8.125 -3.935 676 HA ALA 102 HA ALA 102 2.510 -5.911 -5.644 677 HB1 ALA 102 3HB ALA 102 1.141 -6.544 -7.466 678 HB2 ALA 102 1HB ALA 102 0.362 -7.823 -6.536 679 HB3 ALA 102 2HB ALA 102 2.052 -7.979 -7.001 680 H ILE 103 H ILE 103 1.415 -4.123 -5.408 681 HA ILE 103 HA ILE 103 -1.277 -4.244 -4.237 682 HB ILE 103 HB ILE 103 0.919 -2.369 -3.319 683 HG12 ILE 103 2HG1 ILE 103 -0.667 -4.423 -1.758 684 HG13 ILE 103 3HG1 ILE 103 0.959 -4.688 -2.375 685 HG21 ILE 103 1HG2 ILE 103 -1.182 -1.169 -3.468 686 HG22 ILE 103 2HG2 ILE 103 -0.760 -1.439 -1.776 687 HG23 ILE 103 3HG2 ILE 103 -1.998 -2.433 -2.551 688 HD11 ILE 103 3HD1 ILE 103 1.788 -2.879 -0.966 689 HD12 ILE 103 1HD1 ILE 103 0.966 -4.114 -0.010 690 HD13 ILE 103 2HD1 ILE 103 0.152 -2.593 -0.371 691 H ASN 104 H ASN 104 -2.667 -3.267 -5.486 692 HA ASN 104 HA ASN 104 -1.809 -0.875 -6.964 693 HB2 ASN 104 2HB ASN 104 -2.073 -2.758 -8.518 694 HB3 ASN 104 3HB ASN 104 -3.710 -3.032 -7.926 695 HD21 ASN 104 1HD2 ASN 104 -5.345 -1.787 -8.677 696 HD22 ASN 104 2HD2 ASN 104 -5.158 -0.600 -9.922 697 H VAL 105 H VAL 105 -2.648 0.626 -5.838 698 HA VAL 105 HA VAL 105 -5.520 0.558 -5.181 699 HB VAL 105 HB VAL 105 -5.123 1.520 -2.900 700 HG11 VAL 105 1HG1 VAL 105 -5.738 -0.802 -3.169 701 HG12 VAL 105 2HG1 VAL 105 -4.548 -0.654 -1.875 702 HG13 VAL 105 3HG1 VAL 105 -4.055 -1.242 -3.462 703 HG21 VAL 105 3HG2 VAL 105 -2.936 1.183 -1.865 704 HG22 VAL 105 1HG2 VAL 105 -2.827 2.286 -3.237 705 HG23 VAL 105 2HG2 VAL 105 -2.298 0.612 -3.409 706 H GLU 106 H GLU 106 -6.614 2.377 -5.367 707 HA GLU 106 HA GLU 106 -5.186 4.920 -5.569 708 HB2 GLU 106 2HB GLU 106 -7.019 3.788 -7.689 709 HB3 GLU 106 3HB GLU 106 -6.556 5.481 -7.614 710 HG2 GLU 106 2HG GLU 106 -4.231 4.902 -7.960 711 HG3 GLU 106 3HG GLU 106 -4.627 3.183 -7.909 712 H SER 107 H SER 107 -6.377 6.660 -4.897 713 HA SER 107 HA SER 107 -9.211 6.246 -4.271 714 HB2 SER 107 2HB SER 107 -7.947 5.757 -2.209 715 HB3 SER 107 3HB SER 107 -7.184 7.343 -2.311 716 HG SER 107 HG SER 107 -9.240 6.918 -0.981 717 H GLY 108 H GLY 108 -10.447 8.121 -4.256 718 HA2 GLY 108 2HA GLY 108 -9.179 10.453 -5.489 719 HA3 GLY 108 3HA GLY 108 -10.912 10.143 -5.393 720 H ASP 109 H ASP 109 -9.660 9.359 -2.480 721 HA ASP 109 HA ASP 109 -10.637 11.825 -1.272 722 HB2 ASP 109 2HB ASP 109 -9.798 9.182 -0.060 723 HB3 ASP 109 3HB ASP 109 -10.340 10.566 0.884 724 H ASP 110 H ASP 110 -9.353 12.365 0.855 725 HA ASP 110 HA ASP 110 -6.646 13.027 0.019 726 HB2 ASP 110 2HB ASP 110 -6.619 14.524 1.917 727 HB3 ASP 110 3HB ASP 110 -8.155 14.727 1.092 728 H GLY 111 H GLY 111 -7.658 10.294 0.859 729 HA2 GLY 111 2HA GLY 111 -6.114 8.641 1.693 730 HA3 GLY 111 3HA GLY 111 -5.635 9.795 2.930 731 H GLN 112 H GLN 112 -8.947 9.934 2.495 732 HA GLN 112 HA GLN 112 -9.519 8.890 5.039 733 HB2 GLN 112 2HB GLN 112 -11.360 9.408 2.696 734 HB3 GLN 112 3HB GLN 112 -11.916 8.984 4.308 735 HG2 GLN 112 2HG GLN 112 -10.910 11.000 5.208 736 HG3 GLN 112 3HG GLN 112 -10.301 11.424 3.611 737 HE21 GLN 112 1HE2 GLN 112 -12.118 12.853 5.395 738 HE22 GLN 112 2HE2 GLN 112 -13.554 13.142 4.482 739 H THR 113 H THR 113 -10.095 7.469 1.775 740 HA THR 113 HA THR 113 -9.936 4.854 3.063 741 HB THR 113 HB THR 113 -11.551 4.017 1.385 742 HG1 THR 113 HG1 THR 113 -11.941 6.779 0.698 743 HG21 THR 113 3HG2 THR 113 -13.581 5.026 2.328 744 HG22 THR 113 1HG2 THR 113 -12.623 6.361 2.967 745 HG23 THR 113 2HG2 THR 113 -12.385 4.727 3.588 746 H LEU 114 H LEU 114 -9.072 3.203 1.688 747 HA LEU 114 HA LEU 114 -7.680 4.112 -0.736 748 HB2 LEU 114 2HB LEU 114 -6.127 4.125 1.233 749 HB3 LEU 114 3HB LEU 114 -6.444 2.419 1.444 750 HG LEU 114 HG LEU 114 -5.462 1.989 -0.785 751 HD11 LEU 114 1HD1 LEU 114 -5.872 4.162 -1.804 752 HD12 LEU 114 2HD1 LEU 114 -4.159 3.750 -1.876 753 HD13 LEU 114 3HD1 LEU 114 -4.737 4.915 -0.683 754 HD21 LEU 114 3HD2 LEU 114 -4.112 1.728 1.206 755 HD22 LEU 114 1HD2 LEU 114 -3.709 3.446 1.186 756 HD23 LEU 114 2HD2 LEU 114 -3.134 2.392 -0.107 757 H ASN 115 H ASN 115 -8.622 2.868 -2.285 758 HA ASN 115 HA ASN 115 -9.197 0.066 -1.575 759 HB2 ASN 115 2HB ASN 115 -10.812 1.916 -3.339 760 HB3 ASN 115 3HB ASN 115 -11.104 0.183 -3.186 761 HD21 ASN 115 1HD2 ASN 115 -12.844 2.411 -2.544 762 HD22 ASN 115 2HD2 ASN 115 -13.235 2.266 -0.871 763 H GLY 116 H GLY 116 -9.079 -1.505 -3.254 764 HA2 GLY 116 2HA GLY 116 -8.494 -1.167 -5.884 765 HA3 GLY 116 3HA GLY 116 -6.938 -0.975 -5.095 766 H THR 117 H THR 117 -5.879 -2.743 -5.560 767 HA THR 117 HA THR 117 -7.072 -5.331 -4.880 768 HB THR 117 HB THR 117 -5.792 -6.310 -6.838 769 HG1 THR 117 HG1 THR 117 -4.687 -5.005 -8.087 770 HG21 THR 117 3HG2 THR 117 -8.027 -4.361 -7.450 771 HG22 THR 117 1HG2 THR 117 -8.210 -6.039 -6.950 772 HG23 THR 117 2HG2 THR 117 -7.496 -5.663 -8.517 773 H MET 118 H MET 118 -5.549 -6.945 -4.289 774 HA MET 118 HA MET 118 -2.805 -6.066 -3.833 775 HB2 MET 118 2HB MET 118 -2.864 -6.824 -1.484 776 HB3 MET 118 3HB MET 118 -3.908 -5.435 -1.767 777 HG2 MET 118 2HG MET 118 -5.860 -6.855 -1.780 778 HG3 MET 118 3HG MET 118 -4.846 -8.290 -1.622 779 HE1 MET 118 3HE MET 118 -3.514 -8.134 1.966 780 HE2 MET 118 1HE MET 118 -2.702 -7.671 0.471 781 HE3 MET 118 2HE MET 118 -3.734 -9.101 0.509 782 H THR 119 H THR 119 -1.354 -7.750 -3.703 783 HA THR 119 HA THR 119 -2.481 -10.445 -4.048 784 HB THR 119 HB THR 119 -0.098 -9.338 -5.548 785 HG1 THR 119 HG1 THR 119 -2.649 -8.954 -6.004 786 HG21 THR 119 3HG2 THR 119 -0.278 -11.425 -6.857 787 HG22 THR 119 1HG2 THR 119 -1.584 -11.960 -5.801 788 HG23 THR 119 2HG2 THR 119 0.043 -11.753 -5.156 789 H TYR 120 H TYR 120 -1.711 -11.849 -2.626 790 HA TYR 120 HA TYR 120 0.528 -11.201 -0.916 791 HB2 TYR 120 2HB TYR 120 -1.264 -13.618 -1.112 792 HB3 TYR 120 3HB TYR 120 0.103 -13.536 -0.012 793 HD1 TYR 120 HD2 TYR 120 0.109 -11.612 1.697 794 HD2 TYR 120 HD1 TYR 120 -3.354 -12.831 -0.451 795 HE1 TYR 120 HE2 TYR 120 -1.311 -10.590 3.418 796 HE2 TYR 120 HE1 TYR 120 -4.783 -11.817 1.271 797 HH TYR 120 HH TYR 120 -3.606 -9.711 3.650 798 H ALA 121 H ALA 121 2.281 -12.809 -0.595 799 HA ALA 121 HA ALA 121 3.797 -13.151 -2.860 800 HB1 ALA 121 3HB ALA 121 3.951 -14.825 -0.363 801 HB2 ALA 121 1HB ALA 121 4.687 -13.240 -0.592 802 HB3 ALA 121 2HB ALA 121 5.231 -14.611 -1.555 803 H GLY 122 H GLY 122 1.332 -15.409 -1.677 804 HA2 GLY 122 2HA GLY 122 1.635 -16.890 -4.148 805 HA3 GLY 122 3HA GLY 122 2.048 -17.795 -2.705 806 H GLU 123 H GLU 123 -0.489 -15.494 -2.287 807 HA GLU 123 HA GLU 123 -2.356 -17.750 -2.229 808 HB2 GLU 123 2HB GLU 123 -2.119 -16.485 -0.130 809 HB3 GLU 123 3HB GLU 123 -2.654 -15.027 -0.948 810 HG2 GLU 123 2HG GLU 123 -4.841 -15.956 -1.305 811 HG3 GLU 123 3HG GLU 123 -4.320 -17.515 -0.682 812 H GLY 124 H GLY 124 -1.713 -14.799 -3.900 813 HA2 GLY 124 2HA GLY 124 -2.644 -14.733 -6.164 814 HA3 GLY 124 3HA GLY 124 -4.164 -15.276 -5.471 815 HA PRO 125 HA PRO 125 -4.217 -10.638 -5.579 816 HB2 PRO 125 2HB PRO 125 -5.772 -10.411 -7.895 817 HB3 PRO 125 3HB PRO 125 -4.025 -10.198 -7.799 818 HG2 PRO 125 2HG PRO 125 -5.411 -12.276 -9.148 819 HG3 PRO 125 3HG PRO 125 -3.666 -12.153 -8.885 820 HD2 PRO 125 2HD PRO 125 -5.705 -13.724 -7.394 821 HD3 PRO 125 3HD PRO 125 -3.980 -14.065 -7.658 822 H ILE 126 H ILE 126 -5.681 -9.930 -4.171 823 HA ILE 126 HA ILE 126 -8.504 -10.633 -4.590 824 HB ILE 126 HB ILE 126 -8.847 -10.687 -2.150 825 HG12 ILE 126 2HG1 ILE 126 -5.826 -10.563 -1.958 826 HG13 ILE 126 3HG1 ILE 126 -6.919 -9.249 -1.535 827 HG21 ILE 126 1HG2 ILE 126 -7.784 -12.856 -1.712 828 HG22 ILE 126 2HG2 ILE 126 -6.757 -12.631 -3.130 829 HG23 ILE 126 3HG2 ILE 126 -8.504 -12.782 -3.320 830 HD11 ILE 126 3HD1 ILE 126 -6.229 -10.346 0.468 831 HD12 ILE 126 1HD1 ILE 126 -6.679 -11.922 -0.183 832 HD13 ILE 126 2HD1 ILE 126 -7.926 -10.733 0.184 833 H GLY 127 H GLY 127 -10.002 -9.098 -3.526 834 HA2 GLY 127 2HA GLY 127 -9.347 -6.418 -4.219 835 HA3 GLY 127 3HA GLY 127 -10.817 -6.965 -3.428 836 H PHE 128 H PHE 128 -8.791 -4.739 -3.026 837 HA PHE 128 HA PHE 128 -8.267 -5.197 -0.164 838 HB2 PHE 128 2HB PHE 128 -6.171 -4.939 -1.341 839 HB3 PHE 128 3HB PHE 128 -6.755 -3.492 -2.156 840 HD1 PHE 128 HD1 PHE 128 -5.754 -4.868 1.131 841 HD2 PHE 128 HD2 PHE 128 -6.582 -1.371 -1.145 842 HE1 PHE 128 HE1 PHE 128 -4.848 -3.468 2.942 843 HE2 PHE 128 HE2 PHE 128 -5.670 0.026 0.654 844 HZ PHE 128 HZ PHE 128 -4.804 -1.019 2.702 845 H LYS 129 H LYS 129 -9.146 -3.813 1.271 846 HA LYS 129 HA LYS 129 -10.094 -1.238 0.303 847 HB2 LYS 129 2HB LYS 129 -12.038 -2.712 0.353 848 HB3 LYS 129 3HB LYS 129 -11.663 -3.170 2.007 849 HG2 LYS 129 2HG LYS 129 -11.992 -0.838 2.703 850 HG3 LYS 129 3HG LYS 129 -12.445 -0.437 1.047 851 HD2 LYS 129 2HD LYS 129 -14.307 -2.017 1.184 852 HD3 LYS 129 3HD LYS 129 -13.852 -2.398 2.849 853 HE2 LYS 129 2HE LYS 129 -14.169 -0.012 3.427 854 HE3 LYS 129 3HE LYS 129 -14.731 0.264 1.782 855 HZ1 LYS 129 3HZ LYS 129 -15.996 -1.543 3.752 856 HZ2 LYS 129 1HZ LYS 129 -16.535 -1.279 2.167 857 HZ3 LYS 129 2HZ LYS 129 -16.570 -0.022 3.296 858 H GLY 130 H GLY 130 -8.964 0.183 1.483 859 HA2 GLY 130 2HA GLY 130 -8.493 -0.480 4.307 860 HA3 GLY 130 3HA GLY 130 -7.431 0.524 3.323 861 H THR 131 H THR 131 -9.192 0.899 5.829 862 HA THR 131 HA THR 131 -10.319 3.449 4.915 863 HB THR 131 HB THR 131 -11.557 1.616 6.995 864 HG1 THR 131 HG1 THR 131 -12.146 0.713 5.107 865 HG21 THR 131 3HG2 THR 131 -13.425 3.197 6.963 866 HG22 THR 131 1HG2 THR 131 -12.580 4.194 5.778 867 HG23 THR 131 2HG2 THR 131 -11.937 4.028 7.410 868 H LEU 132 H LEU 132 -9.799 5.175 6.166 869 HA LEU 132 HA LEU 132 -7.703 5.027 8.017 870 HB2 LEU 132 2HB LEU 132 -8.283 7.076 6.809 871 HB3 LEU 132 3HB LEU 132 -9.796 7.175 7.684 872 HG LEU 132 HG LEU 132 -8.495 7.472 9.792 873 HD11 LEU 132 1HD1 LEU 132 -6.162 7.661 7.896 874 HD12 LEU 132 2HD1 LEU 132 -6.414 6.427 9.132 875 HD13 LEU 132 3HD1 LEU 132 -6.128 8.104 9.602 876 HD21 LEU 132 3HD2 LEU 132 -7.998 9.481 7.595 877 HD22 LEU 132 1HD2 LEU 132 -7.853 9.799 9.323 878 HD23 LEU 132 2HD2 LEU 132 -9.421 9.388 8.633 879 H THR 133 H THR 133 -7.648 4.492 10.096 880 HA THR 133 HA THR 133 -10.160 3.866 11.407 881 HB THR 133 HB THR 133 -7.341 3.291 12.343 882 HG1 THR 133 HG1 THR 133 -8.573 2.339 10.259 883 HG21 THR 133 3HG2 THR 133 -10.016 2.104 13.110 884 HG22 THR 133 1HG2 THR 133 -9.044 3.191 14.102 885 HG23 THR 133 2HG2 THR 133 -8.442 1.579 13.711 Start of MODEL 6 1 H1 ALA 2 1H ALA 2 0.479 5.308 11.313 2 H2 ALA 2 2H ALA 2 0.472 6.959 10.967 3 H3 ALA 2 3H ALA 2 0.468 5.836 9.703 4 HA ALA 2 HA ALA 2 -1.701 6.383 11.643 5 HB1 ALA 2 3HB ALA 2 -2.985 7.013 9.665 6 HB2 ALA 2 1HB ALA 2 -1.595 6.658 8.640 7 HB3 ALA 2 2HB ALA 2 -1.520 7.987 9.797 8 H LEU 3 H LEU 3 -3.267 4.882 11.873 9 HA LEU 3 HA LEU 3 -2.592 2.241 10.902 10 HB2 LEU 3 2HB LEU 3 -3.133 2.786 13.316 11 HB3 LEU 3 3HB LEU 3 -4.786 3.052 12.814 12 HG LEU 3 HG LEU 3 -4.304 0.835 13.908 13 HD11 LEU 3 1HD1 LEU 3 -5.442 0.754 11.124 14 HD12 LEU 3 2HD1 LEU 3 -6.316 1.137 12.608 15 HD13 LEU 3 3HD1 LEU 3 -5.671 -0.483 12.359 16 HD21 LEU 3 3HD2 LEU 3 -2.947 0.214 11.293 17 HD22 LEU 3 1HD2 LEU 3 -3.245 -0.911 12.617 18 HD23 LEU 3 2HD2 LEU 3 -2.131 0.438 12.839 19 H TYR 4 H TYR 4 -3.680 1.148 9.428 20 HA TYR 4 HA TYR 4 -6.147 2.327 8.364 21 HB2 TYR 4 2HB TYR 4 -3.815 1.094 6.988 22 HB3 TYR 4 3HB TYR 4 -5.409 0.863 6.287 23 HD1 TYR 4 HD1 TYR 4 -2.924 3.440 7.280 24 HD2 TYR 4 HD2 TYR 4 -6.467 2.577 5.091 25 HE1 TYR 4 HE1 TYR 4 -2.772 5.633 6.164 26 HE2 TYR 4 HE2 TYR 4 -6.326 4.753 3.976 27 HH TYR 4 HH TYR 4 -5.355 6.884 4.236 28 H ASN 5 H ASN 5 -7.861 1.133 8.206 29 HA ASN 5 HA ASN 5 -7.773 -1.614 9.216 30 HB2 ASN 5 2HB ASN 5 -9.468 0.013 10.132 31 HB3 ASN 5 3HB ASN 5 -10.185 0.102 8.530 32 HD21 ASN 5 1HD2 ASN 5 -11.241 -0.820 11.131 33 HD22 ASN 5 2HD2 ASN 5 -11.825 -2.421 10.843 34 H VAL 6 H VAL 6 -7.654 -3.214 7.762 35 HA VAL 6 HA VAL 6 -8.162 -2.474 4.989 36 HB VAL 6 HB VAL 6 -6.500 -4.739 6.092 37 HG11 VAL 6 1HG1 VAL 6 -5.734 -5.036 3.798 38 HG12 VAL 6 2HG1 VAL 6 -6.829 -3.760 3.262 39 HG13 VAL 6 3HG1 VAL 6 -7.478 -5.261 3.913 40 HG21 VAL 6 3HG2 VAL 6 -5.701 -2.113 4.847 41 HG22 VAL 6 1HG2 VAL 6 -4.596 -3.417 5.276 42 HG23 VAL 6 2HG2 VAL 6 -5.498 -2.576 6.535 43 H GLU 7 H GLU 7 -10.155 -2.934 4.482 44 HA GLU 7 HA GLU 7 -11.336 -5.496 5.220 45 HB2 GLU 7 2HB GLU 7 -12.436 -3.045 3.812 46 HB3 GLU 7 3HB GLU 7 -13.364 -4.511 4.101 47 HG2 GLU 7 2HG GLU 7 -13.192 -4.215 6.481 48 HG3 GLU 7 3HG GLU 7 -12.113 -2.841 6.268 49 H ASN 8 H ASN 8 -11.725 -7.089 3.674 50 HA ASN 8 HA ASN 8 -10.680 -6.510 0.993 51 HB2 ASN 8 2HB ASN 8 -9.927 -8.889 2.683 52 HB3 ASN 8 3HB ASN 8 -9.556 -8.720 0.971 53 HD21 ASN 8 1HD2 ASN 8 -8.690 -7.914 4.155 54 HD22 ASN 8 2HD2 ASN 8 -7.295 -6.971 3.770 55 H GLN 9 H GLN 9 -11.261 -7.920 -0.613 56 HA GLN 9 HA GLN 9 -13.535 -9.703 -0.070 57 HB2 GLN 9 2HB GLN 9 -14.302 -7.739 -1.332 58 HB3 GLN 9 3HB GLN 9 -13.013 -7.967 -2.506 59 HG2 GLN 9 2HG GLN 9 -14.011 -10.079 -3.201 60 HG3 GLN 9 3HG GLN 9 -15.298 -9.865 -2.013 61 HE21 GLN 9 1HE2 GLN 9 -16.926 -8.427 -2.409 62 HE22 GLN 9 2HE2 GLN 9 -17.161 -7.671 -3.946 63 H TRP 10 H TRP 10 -12.665 -11.712 -0.193 64 HA TRP 10 HA TRP 10 -10.644 -12.128 -2.278 65 HB2 TRP 10 2HB TRP 10 -9.310 -13.534 -0.801 66 HB3 TRP 10 3HB TRP 10 -9.484 -11.913 -0.153 67 HD1 TRP 10 HD1 TRP 10 -11.622 -15.148 0.319 68 HE1 TRP 10 HE1 TRP 10 -11.954 -15.519 2.835 69 HE3 TRP 10 HE3 TRP 10 -8.941 -11.163 2.093 70 HZ2 TRP 10 HZ2 TRP 10 -11.175 -14.306 5.257 71 HZ3 TRP 10 HZ3 TRP 10 -8.779 -10.849 4.529 72 HH2 TRP 10 HH2 TRP 10 -9.879 -12.386 6.077 73 H GLY 11 H GLY 11 -13.722 -13.179 -1.430 74 HA2 GLY 11 2HA GLY 11 -13.041 -15.888 -2.294 75 HA3 GLY 11 3HA GLY 11 -14.358 -15.488 -1.199 76 H GLY 12 H GLY 12 -13.741 -13.359 -3.811 77 HA2 GLY 12 2HA GLY 12 -14.710 -13.784 -6.056 78 HA3 GLY 12 3HA GLY 12 -16.096 -14.452 -5.205 79 H SER 13 H SER 13 -16.128 -12.338 -7.089 80 HA SER 13 HA SER 13 -16.260 -9.784 -6.000 81 HB2 SER 13 2HB SER 13 -17.804 -9.321 -7.955 82 HB3 SER 13 3HB SER 13 -16.243 -10.037 -8.359 83 HG SER 13 HG SER 13 -18.687 -10.977 -8.889 84 H SER 14 H SER 14 -18.679 -12.343 -5.933 85 HA SER 14 HA SER 14 -20.742 -10.638 -4.938 86 HB2 SER 14 2HB SER 14 -21.919 -12.868 -4.620 87 HB3 SER 14 3HB SER 14 -21.429 -12.471 -6.269 88 HG SER 14 HG SER 14 -20.912 -14.659 -5.463 89 H ALA 15 H ALA 15 -18.032 -11.944 -3.494 90 HA ALA 15 HA ALA 15 -19.205 -12.692 -0.973 91 HB1 ALA 15 3HB ALA 15 -17.163 -13.781 -1.794 92 HB2 ALA 15 1HB ALA 15 -16.911 -13.022 -0.223 93 HB3 ALA 15 2HB ALA 15 -16.305 -12.245 -1.685 94 HA PRO 16 HA PRO 16 -19.316 -8.671 0.858 95 HB2 PRO 16 2HB PRO 16 -19.351 -9.365 3.467 96 HB3 PRO 16 3HB PRO 16 -20.737 -9.631 2.404 97 HG2 PRO 16 2HG PRO 16 -18.615 -11.567 3.258 98 HG3 PRO 16 3HG PRO 16 -20.373 -11.796 3.199 99 HD2 PRO 16 2HD PRO 16 -18.744 -12.716 1.254 100 HD3 PRO 16 3HD PRO 16 -20.383 -12.124 0.911 101 H TRP 17 H TRP 17 -18.133 -7.289 2.406 102 HA TRP 17 HA TRP 17 -15.290 -7.694 2.067 103 HB2 TRP 17 2HB TRP 17 -16.857 -5.393 3.256 104 HB3 TRP 17 3HB TRP 17 -15.108 -5.419 3.094 105 HD1 TRP 17 HD1 TRP 17 -18.295 -5.005 1.062 106 HE1 TRP 17 HE1 TRP 17 -17.689 -4.143 -1.277 107 HE3 TRP 17 HE3 TRP 17 -13.217 -5.435 1.341 108 HZ2 TRP 17 HZ2 TRP 17 -15.350 -3.700 -2.815 109 HZ3 TRP 17 HZ3 TRP 17 -11.865 -4.775 -0.605 110 HH2 TRP 17 HH2 TRP 17 -12.911 -3.927 -2.639 111 H ASN 18 H ASN 18 -13.865 -8.131 3.603 112 HA ASN 18 HA ASN 18 -14.692 -8.177 6.401 113 HB2 ASN 18 2HB ASN 18 -13.635 -10.500 6.604 114 HB3 ASN 18 3HB ASN 18 -15.229 -10.417 5.873 115 HD21 ASN 18 1HD2 ASN 18 -15.464 -10.900 3.700 116 HD22 ASN 18 2HD2 ASN 18 -14.198 -11.613 2.774 117 H GLU 19 H GLU 19 -13.085 -7.721 7.796 118 HA GLU 19 HA GLU 19 -10.491 -7.090 6.640 119 HB2 GLU 19 2HB GLU 19 -10.050 -5.972 8.812 120 HB3 GLU 19 3HB GLU 19 -11.478 -5.344 8.003 121 HG2 GLU 19 2HG GLU 19 -12.924 -6.505 9.487 122 HG3 GLU 19 3HG GLU 19 -11.582 -7.411 10.176 123 H GLY 20 H GLY 20 -8.582 -8.068 7.280 124 HA2 GLY 20 2HA GLY 20 -8.847 -10.255 9.222 125 HA3 GLY 20 3HA GLY 20 -8.075 -10.518 7.659 126 H GLY 21 H GLY 21 -7.754 -7.505 9.339 127 HA2 GLY 21 2HA GLY 21 -5.679 -7.708 10.996 128 HA3 GLY 21 3HA GLY 21 -4.887 -7.890 9.437 129 H GLN 22 H GLN 22 -4.142 -5.842 10.976 130 HA GLN 22 HA GLN 22 -5.361 -3.528 9.651 131 HB2 GLN 22 2HB GLN 22 -4.662 -2.211 11.684 132 HB3 GLN 22 3HB GLN 22 -5.972 -3.353 11.943 133 HG2 GLN 22 2HG GLN 22 -4.292 -4.954 12.864 134 HG3 GLN 22 3HG GLN 22 -3.090 -3.671 12.743 135 HE21 GLN 22 1HE2 GLN 22 -5.017 -1.593 13.467 136 HE22 GLN 22 2HE2 GLN 22 -5.269 -1.752 15.167 137 H TRP 23 H TRP 23 -4.035 -2.161 8.627 138 HA TRP 23 HA TRP 23 -1.161 -2.874 8.601 139 HB2 TRP 23 2HB TRP 23 -2.925 -1.775 6.413 140 HB3 TRP 23 3HB TRP 23 -1.178 -1.862 6.296 141 HD1 TRP 23 HD1 TRP 23 -2.523 -4.910 7.951 142 HE1 TRP 23 HE1 TRP 23 -2.584 -6.854 6.274 143 HE3 TRP 23 HE3 TRP 23 -1.690 -2.296 3.642 144 HZ2 TRP 23 HZ2 TRP 23 -2.317 -7.232 3.497 145 HZ3 TRP 23 HZ3 TRP 23 -1.602 -3.534 1.509 146 HH2 TRP 23 HH2 TRP 23 -1.911 -5.946 1.448 147 H GLU 24 H GLU 24 0.213 -1.026 7.763 148 HA GLU 24 HA GLU 24 -0.914 1.561 8.514 149 HB2 GLU 24 2HB GLU 24 0.516 0.881 10.405 150 HB3 GLU 24 3HB GLU 24 1.878 0.691 9.305 151 HG2 GLU 24 2HG GLU 24 1.964 3.009 8.851 152 HG3 GLU 24 3HG GLU 24 0.399 3.284 9.606 153 H ILE 25 H ILE 25 -0.880 2.840 6.913 154 HA ILE 25 HA ILE 25 0.863 2.188 4.649 155 HB ILE 25 HB ILE 25 -1.871 3.459 4.696 156 HG12 ILE 25 2HG1 ILE 25 -0.883 0.896 3.425 157 HG13 ILE 25 3HG1 ILE 25 -1.695 0.983 4.983 158 HG21 ILE 25 1HG2 ILE 25 -1.736 3.501 2.242 159 HG22 ILE 25 2HG2 ILE 25 -0.042 3.015 2.348 160 HG23 ILE 25 3HG2 ILE 25 -0.553 4.571 2.997 161 HD11 ILE 25 3HD1 ILE 25 -3.690 1.867 3.884 162 HD12 ILE 25 1HD1 ILE 25 -3.220 0.295 3.234 163 HD13 ILE 25 2HD1 ILE 25 -2.866 1.767 2.327 164 H GLY 26 H GLY 26 -0.291 4.922 6.553 165 HA2 GLY 26 2HA GLY 26 1.615 6.604 5.085 166 HA3 GLY 26 3HA GLY 26 0.227 7.223 5.964 167 H SER 27 H SER 27 3.406 7.258 6.027 168 HA SER 27 HA SER 27 3.584 7.092 8.960 169 HB2 SER 27 2HB SER 27 6.022 6.707 8.611 170 HB3 SER 27 3HB SER 27 5.006 5.436 7.929 171 HG SER 27 HG SER 27 6.694 7.207 6.672 172 H ARG 28 H ARG 28 3.075 9.383 6.787 173 HA ARG 28 HA ARG 28 5.003 11.220 7.996 174 HB2 ARG 28 2HB ARG 28 5.606 10.824 5.669 175 HB3 ARG 28 3HB ARG 28 3.988 11.282 5.157 176 HG2 ARG 28 2HG ARG 28 4.346 13.536 5.996 177 HG3 ARG 28 3HG ARG 28 5.958 13.083 6.545 178 HD2 ARG 28 2HD ARG 28 6.651 12.664 4.269 179 HD3 ARG 28 3HD ARG 28 5.016 12.987 3.686 180 HE ARG 28 HE ARG 28 5.654 15.244 5.011 181 HH11 ARG 28 1HH1 ARG 28 7.291 13.447 2.485 182 HH12 ARG 28 2HH1 ARG 28 8.016 14.849 1.777 183 HH21 ARG 28 1HH2 ARG 28 6.601 17.101 4.057 184 HH22 ARG 28 2HH2 ARG 28 7.630 16.929 2.676 185 H SER 29 H SER 29 4.266 13.034 8.827 186 HA SER 29 HA SER 29 1.450 13.465 9.077 187 HB2 SER 29 2HB SER 29 2.973 13.932 10.951 188 HB3 SER 29 3HB SER 29 3.825 15.126 9.976 189 HG SER 29 HG SER 29 2.060 16.453 10.032 190 H ASP 30 H ASP 30 0.287 15.230 8.300 191 HA ASP 30 HA ASP 30 -0.396 16.857 6.829 192 HB2 ASP 30 2HB ASP 30 2.538 17.598 6.737 193 HB3 ASP 30 3HB ASP 30 1.193 18.621 6.255 194 H GLN 31 H GLN 31 0.612 14.224 5.846 195 HA GLN 31 HA GLN 31 0.459 14.725 3.065 196 HB2 GLN 31 2HB GLN 31 3.128 14.289 4.268 197 HB3 GLN 31 3HB GLN 31 2.766 13.333 2.837 198 HG2 GLN 31 2HG GLN 31 2.461 16.318 2.959 199 HG3 GLN 31 3HG GLN 31 3.924 15.502 2.405 200 HE21 GLN 31 1HE2 GLN 31 0.519 15.988 1.773 201 HE22 GLN 31 2HE2 GLN 31 0.564 15.552 0.103 202 H ASN 32 H ASN 32 -1.216 13.358 3.138 203 HA ASN 32 HA ASN 32 -0.740 10.662 4.122 204 HB2 ASN 32 2HB ASN 32 -2.820 11.983 4.755 205 HB3 ASN 32 3HB ASN 32 -3.347 11.776 3.089 206 HD21 ASN 32 1HD2 ASN 32 -5.147 10.615 3.813 207 HD22 ASN 32 2HD2 ASN 32 -4.997 8.971 4.341 208 H VAL 33 H VAL 33 -1.617 8.886 2.786 209 HA VAL 33 HA VAL 33 -0.548 9.166 0.078 210 HB VAL 33 HB VAL 33 -1.208 6.673 1.663 211 HG11 VAL 33 1HG1 VAL 33 -1.383 6.275 -0.720 212 HG12 VAL 33 2HG1 VAL 33 0.051 5.481 -0.070 213 HG13 VAL 33 3HG1 VAL 33 0.211 6.985 -0.976 214 HG21 VAL 33 3HG2 VAL 33 1.223 6.406 1.869 215 HG22 VAL 33 1HG2 VAL 33 0.659 7.892 2.637 216 HG23 VAL 33 2HG2 VAL 33 1.456 7.958 1.063 217 H VAL 34 H VAL 34 -1.835 9.097 -1.681 218 HA VAL 34 HA VAL 34 -4.628 8.281 -1.264 219 HB VAL 34 HB VAL 34 -5.225 9.652 -3.223 220 HG11 VAL 34 1HG1 VAL 34 -5.410 10.608 -1.011 221 HG12 VAL 34 2HG1 VAL 34 -4.904 11.843 -2.164 222 HG13 VAL 34 3HG1 VAL 34 -3.726 11.122 -1.067 223 HG21 VAL 34 3HG2 VAL 34 -3.602 11.244 -4.150 224 HG22 VAL 34 1HG2 VAL 34 -3.101 9.577 -4.423 225 HG23 VAL 34 2HG2 VAL 34 -2.335 10.530 -3.153 226 H ALA 35 H ALA 35 -1.756 7.367 -2.846 227 HA ALA 35 HA ALA 35 -3.192 5.194 -4.111 228 HB1 ALA 35 3HB ALA 35 -2.473 5.576 -6.358 229 HB2 ALA 35 1HB ALA 35 -1.521 6.977 -5.871 230 HB3 ALA 35 2HB ALA 35 -3.279 7.039 -5.791 231 H ILE 36 H ILE 36 -1.880 3.442 -4.749 232 HA ILE 36 HA ILE 36 0.972 3.561 -4.318 233 HB ILE 36 HB ILE 36 -0.732 1.624 -2.712 234 HG12 ILE 36 2HG1 ILE 36 1.157 3.744 -1.693 235 HG13 ILE 36 3HG1 ILE 36 -0.593 3.931 -1.754 236 HG21 ILE 36 1HG2 ILE 36 1.403 0.802 -1.819 237 HG22 ILE 36 2HG2 ILE 36 2.266 1.890 -2.905 238 HG23 ILE 36 3HG2 ILE 36 1.292 0.577 -3.565 239 HD11 ILE 36 3HD1 ILE 36 0.181 3.325 0.460 240 HD12 ILE 36 1HD1 ILE 36 0.906 1.852 -0.184 241 HD13 ILE 36 2HD1 ILE 36 -0.846 2.066 -0.222 242 H ASN 37 H ASN 37 1.724 2.523 -5.992 243 HA ASN 37 HA ASN 37 0.350 0.101 -6.921 244 HB2 ASN 37 2HB ASN 37 1.053 2.384 -8.783 245 HB3 ASN 37 3HB ASN 37 0.517 0.793 -9.306 246 HD21 ASN 37 1HD2 ASN 37 -0.421 3.853 -8.077 247 HD22 ASN 37 2HD2 ASN 37 -2.127 3.578 -8.092 248 H VAL 38 H VAL 38 2.461 -0.686 -5.655 249 HA VAL 38 HA VAL 38 4.608 -0.694 -7.590 250 HB VAL 38 HB VAL 38 6.046 -1.108 -5.692 251 HG11 VAL 38 1HG1 VAL 38 4.101 1.133 -5.185 252 HG12 VAL 38 2HG1 VAL 38 5.579 1.207 -6.145 253 HG13 VAL 38 3HG1 VAL 38 5.669 0.966 -4.403 254 HG21 VAL 38 3HG2 VAL 38 5.182 -1.180 -3.392 255 HG22 VAL 38 1HG2 VAL 38 4.548 -2.510 -4.363 256 HG23 VAL 38 2HG2 VAL 38 3.532 -1.113 -4.011 257 H GLU 39 H GLU 39 6.028 -2.643 -7.246 258 HA GLU 39 HA GLU 39 4.561 -5.103 -6.720 259 HB2 GLU 39 2HB GLU 39 4.309 -4.646 -9.163 260 HB3 GLU 39 3HB GLU 39 6.060 -4.689 -9.316 261 HG2 GLU 39 2HG GLU 39 6.095 -7.013 -8.628 262 HG3 GLU 39 3HG GLU 39 4.353 -6.981 -8.368 263 H SER 40 H SER 40 5.942 -6.908 -6.343 264 HA SER 40 HA SER 40 8.323 -6.179 -4.955 265 HB2 SER 40 2HB SER 40 8.426 -8.640 -4.488 266 HB3 SER 40 3HB SER 40 6.913 -7.862 -4.014 267 HG SER 40 HG SER 40 6.739 -8.683 -6.556 268 H GLY 41 H GLY 41 10.383 -7.087 -5.243 269 HA2 GLY 41 2HA GLY 41 11.008 -7.813 -8.028 270 HA3 GLY 41 3HA GLY 41 12.157 -7.151 -6.865 271 H ASP 42 H ASP 42 11.809 -8.611 -4.690 272 HA ASP 42 HA ASP 42 12.647 -11.298 -5.508 273 HB2 ASP 42 2HB ASP 42 13.052 -9.810 -2.898 274 HB3 ASP 42 3HB ASP 42 13.636 -11.436 -3.227 275 H ASP 43 H ASP 43 12.239 -12.235 -2.716 276 HA ASP 43 HA ASP 43 9.666 -13.433 -3.032 277 HB2 ASP 43 2HB ASP 43 11.493 -13.390 -0.625 278 HB3 ASP 43 3HB ASP 43 10.150 -14.495 -0.881 279 H GLY 44 H GLY 44 9.368 -10.599 -2.871 280 HA2 GLY 44 2HA GLY 44 7.723 -9.230 -1.937 281 HA3 GLY 44 3HA GLY 44 7.459 -10.448 -0.692 282 H GLN 45 H GLN 45 10.688 -9.979 -0.884 283 HA GLN 45 HA GLN 45 10.742 -8.415 1.519 284 HB2 GLN 45 2HB GLN 45 12.956 -9.587 -0.159 285 HB3 GLN 45 3HB GLN 45 13.236 -8.668 1.310 286 HG2 GLN 45 2HG GLN 45 11.982 -10.322 2.592 287 HG3 GLN 45 3HG GLN 45 11.697 -11.245 1.114 288 HE21 GLN 45 1HE2 GLN 45 14.003 -10.333 3.522 289 HE22 GLN 45 2HE2 GLN 45 15.243 -11.438 3.059 290 H THR 46 H THR 46 11.254 -7.897 -1.845 291 HA THR 46 HA THR 46 11.977 -5.117 -1.268 292 HB THR 46 HB THR 46 12.965 -5.143 -3.604 293 HG1 THR 46 HG1 THR 46 13.610 -7.625 -3.887 294 HG21 THR 46 3HG2 THR 46 14.382 -5.221 -1.613 295 HG22 THR 46 1HG2 THR 46 15.046 -6.254 -2.878 296 HG23 THR 46 2HG2 THR 46 14.179 -6.971 -1.521 297 H LEU 47 H LEU 47 10.717 -3.562 -2.090 298 HA LEU 47 HA LEU 47 8.631 -4.322 -4.018 299 HB2 LEU 47 2HB LEU 47 8.285 -2.473 -1.654 300 HB3 LEU 47 3HB LEU 47 7.081 -2.778 -2.886 301 HG LEU 47 HG LEU 47 8.115 -4.800 -0.893 302 HD11 LEU 47 1HD1 LEU 47 6.707 -3.094 0.123 303 HD12 LEU 47 2HD1 LEU 47 5.879 -4.650 0.070 304 HD13 LEU 47 3HD1 LEU 47 5.460 -3.388 -1.087 305 HD21 LEU 47 3HD2 LEU 47 5.966 -5.023 -2.999 306 HD22 LEU 47 1HD2 LEU 47 6.305 -6.224 -1.752 307 HD23 LEU 47 2HD2 LEU 47 7.514 -5.871 -2.984 308 H ASN 48 H ASN 48 8.486 -2.964 -5.738 309 HA ASN 48 HA ASN 48 9.570 -0.271 -5.466 310 HB2 ASN 48 2HB ASN 48 10.937 -0.440 -7.456 311 HB3 ASN 48 3HB ASN 48 11.427 -1.687 -6.318 312 HD21 ASN 48 1HD2 ASN 48 11.014 -3.841 -6.811 313 HD22 ASN 48 2HD2 ASN 48 10.584 -4.358 -8.401 314 H GLY 49 H GLY 49 8.703 1.213 -6.891 315 HA2 GLY 49 2HA GLY 49 7.345 0.889 -9.209 316 HA3 GLY 49 3HA GLY 49 6.142 0.450 -8.006 317 H THR 50 H THR 50 4.734 2.142 -7.972 318 HA THR 50 HA THR 50 5.936 4.760 -7.407 319 HB THR 50 HB THR 50 4.037 5.791 -8.728 320 HG1 THR 50 HG1 THR 50 3.912 3.222 -9.943 321 HG21 THR 50 3HG2 THR 50 6.324 5.758 -9.586 322 HG22 THR 50 1HG2 THR 50 5.171 5.508 -10.898 323 HG23 THR 50 2HG2 THR 50 6.070 4.140 -10.240 324 H MET 51 H MET 51 4.754 6.145 -6.077 325 HA MET 51 HA MET 51 2.217 5.220 -5.010 326 HB2 MET 51 2HB MET 51 3.998 4.354 -3.496 327 HB3 MET 51 3HB MET 51 4.601 5.989 -3.296 328 HG2 MET 51 2HG MET 51 1.766 5.393 -2.609 329 HG3 MET 51 3HG MET 51 3.045 4.891 -1.502 330 HE1 MET 51 3HE MET 51 4.624 8.199 -0.373 331 HE2 MET 51 1HE MET 51 5.197 7.103 -1.629 332 HE3 MET 51 2HE MET 51 4.514 6.458 -0.137 333 H THR 52 H THR 52 0.963 7.001 -4.172 334 HA THR 52 HA THR 52 2.081 9.624 -4.878 335 HB THR 52 HB THR 52 -0.706 8.668 -5.559 336 HG1 THR 52 HG1 THR 52 1.619 9.154 -7.115 337 HG21 THR 52 3HG2 THR 52 -0.627 11.068 -5.037 338 HG22 THR 52 1HG2 THR 52 -0.911 10.795 -6.755 339 HG23 THR 52 2HG2 THR 52 0.689 11.273 -6.191 340 H TYR 53 H TYR 53 1.918 11.087 -3.337 341 HA TYR 53 HA TYR 53 0.185 10.688 -1.035 342 HB2 TYR 53 2HB TYR 53 2.245 12.797 -1.702 343 HB3 TYR 53 3HB TYR 53 1.224 12.880 -0.278 344 HD1 TYR 53 HD2 TYR 53 1.361 10.830 1.334 345 HD2 TYR 53 HD1 TYR 53 4.312 11.777 -1.574 346 HE1 TYR 53 HE2 TYR 53 3.023 9.548 2.611 347 HE2 TYR 53 HE1 TYR 53 5.984 10.501 -0.303 348 HH TYR 53 HH TYR 53 6.315 9.776 2.094 349 H ALA 54 H ALA 54 -1.187 12.482 -0.305 350 HA ALA 54 HA ALA 54 -2.892 13.404 -2.369 351 HB1 ALA 54 3HB ALA 54 -3.678 12.989 -0.079 352 HB2 ALA 54 1HB ALA 54 -4.046 14.631 -0.604 353 HB3 ALA 54 2HB ALA 54 -2.698 14.338 0.494 354 H GLY 55 H GLY 55 -2.817 15.202 -3.558 355 HA2 GLY 55 2HA GLY 55 -2.403 17.465 -4.017 356 HA3 GLY 55 3HA GLY 55 -1.353 17.533 -2.613 357 H GLU 56 H GLU 56 -0.058 14.969 -3.741 358 HA GLU 56 HA GLU 56 1.737 16.423 -5.552 359 HB2 GLU 56 2HB GLU 56 2.286 14.049 -3.765 360 HB3 GLU 56 3HB GLU 56 3.445 14.726 -4.899 361 HG2 GLU 56 2HG GLU 56 2.235 16.177 -2.553 362 HG3 GLU 56 3HG GLU 56 3.851 15.480 -2.613 363 H GLY 57 H GLY 57 2.939 14.909 -7.094 364 HA2 GLY 57 2HA GLY 57 0.912 13.323 -8.483 365 HA3 GLY 57 3HA GLY 57 2.417 13.916 -9.169 366 HA PRO 58 HA PRO 58 2.968 9.384 -8.382 367 HB2 PRO 58 2HB PRO 58 4.606 9.014 -10.544 368 HB3 PRO 58 3HB PRO 58 2.844 8.885 -10.618 369 HG2 PRO 58 2HG PRO 58 4.610 11.183 -11.364 370 HG3 PRO 58 3HG PRO 58 3.194 10.535 -12.213 371 HD2 PRO 58 2HD PRO 58 3.051 12.751 -10.700 372 HD3 PRO 58 3HD PRO 58 1.702 11.597 -10.798 373 H ILE 59 H ILE 59 4.576 8.542 -7.241 374 HA ILE 59 HA ILE 59 7.201 9.848 -7.234 375 HB ILE 59 HB ILE 59 5.546 9.056 -4.830 376 HG12 ILE 59 2HG1 ILE 59 6.693 11.746 -5.591 377 HG13 ILE 59 3HG1 ILE 59 5.028 11.252 -5.866 378 HG21 ILE 59 1HG2 ILE 59 7.454 9.862 -3.457 379 HG22 ILE 59 2HG2 ILE 59 8.429 9.906 -4.931 380 HG23 ILE 59 3HG2 ILE 59 7.777 8.376 -4.350 381 HD11 ILE 59 3HD1 ILE 59 6.368 11.511 -3.184 382 HD12 ILE 59 1HD1 ILE 59 4.695 11.031 -3.467 383 HD13 ILE 59 2HD1 ILE 59 5.229 12.657 -3.896 384 H GLY 60 H GLY 60 8.929 8.451 -6.928 385 HA2 GLY 60 2HA GLY 60 8.446 5.690 -7.581 386 HA3 GLY 60 3HA GLY 60 10.015 6.435 -7.269 387 H PHE 61 H PHE 61 8.249 4.047 -6.229 388 HA PHE 61 HA PHE 61 8.681 4.575 -3.362 389 HB2 PHE 61 2HB PHE 61 6.325 4.298 -3.976 390 HB3 PHE 61 3HB PHE 61 6.688 2.749 -4.719 391 HD1 PHE 61 HD2 PHE 61 7.290 0.805 -3.285 392 HD2 PHE 61 HD1 PHE 61 6.004 4.515 -1.640 393 HE1 PHE 61 HE2 PHE 61 6.801 -0.315 -1.155 394 HE2 PHE 61 HE1 PHE 61 5.515 3.397 0.494 395 HZ PHE 61 HZ PHE 61 5.911 0.980 0.737 396 H ARG 62 H ARG 62 10.158 3.372 -2.363 397 HA ARG 62 HA ARG 62 10.660 0.657 -3.345 398 HB2 ARG 62 2HB ARG 62 12.478 1.958 -4.230 399 HB3 ARG 62 3HB ARG 62 12.736 2.747 -2.683 400 HG2 ARG 62 2HG ARG 62 13.498 0.658 -1.720 401 HG3 ARG 62 3HG ARG 62 13.183 -0.177 -3.243 402 HD2 ARG 62 2HD ARG 62 15.563 0.384 -2.980 403 HD3 ARG 62 3HD ARG 62 14.843 1.200 -4.366 404 HE ARG 62 HE ARG 62 15.187 3.213 -3.342 405 HH11 ARG 62 1HH1 ARG 62 15.704 0.672 -0.975 406 HH12 ARG 62 2HH1 ARG 62 16.377 1.758 0.201 407 HH21 ARG 62 1HH2 ARG 62 16.139 4.610 -1.792 408 HH22 ARG 62 2HH2 ARG 62 16.616 3.957 -0.255 409 H ALA 63 H ALA 63 10.645 -0.827 -1.761 410 HA ALA 63 HA ALA 63 11.065 0.057 1.002 411 HB1 ALA 63 3HB ALA 63 9.076 -1.015 1.801 412 HB2 ALA 63 1HB ALA 63 8.698 -1.615 0.185 413 HB3 ALA 63 2HB ALA 63 8.634 0.113 0.520 414 H THR 64 H THR 64 11.708 -1.524 2.439 415 HA THR 64 HA THR 64 12.445 -4.123 1.258 416 HB THR 64 HB THR 64 14.091 -2.592 3.294 417 HG1 THR 64 HG1 THR 64 14.978 -1.628 1.642 418 HG21 THR 64 3HG2 THR 64 14.672 -5.076 1.666 419 HG22 THR 64 1HG2 THR 64 14.368 -5.021 3.402 420 HG23 THR 64 2HG2 THR 64 15.817 -4.267 2.735 421 H LEU 65 H LEU 65 11.832 -5.870 2.412 422 HA LEU 65 HA LEU 65 10.193 -5.512 4.755 423 HB2 LEU 65 2HB LEU 65 9.664 -7.104 2.911 424 HB3 LEU 65 3HB LEU 65 11.087 -8.025 3.337 425 HG LEU 65 HG LEU 65 8.767 -8.883 4.068 426 HD11 LEU 65 1HD1 LEU 65 10.842 -9.905 4.778 427 HD12 LEU 65 2HD1 LEU 65 9.675 -9.870 6.099 428 HD13 LEU 65 3HD1 LEU 65 11.007 -8.713 6.068 429 HD21 LEU 65 3HD2 LEU 65 8.000 -8.088 6.243 430 HD22 LEU 65 1HD2 LEU 65 7.943 -6.807 5.035 431 HD23 LEU 65 2HD2 LEU 65 9.241 -6.835 6.228 432 H LEU 66 H LEU 66 11.109 -5.242 6.676 433 HA LEU 66 HA LEU 66 13.658 -6.470 7.318 434 HB2 LEU 66 2HB LEU 66 11.831 -4.729 8.975 435 HB3 LEU 66 3HB LEU 66 13.429 -5.261 9.459 436 HG LEU 66 HG LEU 66 12.816 -3.444 7.127 437 HD11 LEU 66 1HD1 LEU 66 12.452 -2.352 9.265 438 HD12 LEU 66 2HD1 LEU 66 13.901 -1.720 8.483 439 HD13 LEU 66 3HD1 LEU 66 14.046 -2.865 9.817 440 HD21 LEU 66 3HD2 LEU 66 15.450 -4.376 8.268 441 HD22 LEU 66 1HD2 LEU 66 15.250 -3.145 7.019 442 HD23 LEU 66 2HD2 LEU 66 14.779 -4.813 6.697 443 H GLY 67 H GLY 67 10.345 -7.126 7.699 444 HA2 GLY 67 2HA GLY 67 9.972 -9.538 8.280 445 HA3 GLY 67 3HA GLY 67 10.955 -9.202 9.700 446 H ASN 68 H ASN 68 8.481 -10.233 10.034 447 HA ASN 68 HA ASN 68 6.515 -9.959 11.171 448 HB2 ASN 68 2HB ASN 68 8.026 -7.550 12.192 449 HB3 ASN 68 3HB ASN 68 6.479 -8.074 12.849 450 HD21 ASN 68 1HD2 ASN 68 9.100 -7.895 14.107 451 HD22 ASN 68 2HD2 ASN 68 9.450 -9.481 14.700 452 H ASN 69 H ASN 69 6.537 -8.990 8.521 453 HA ASN 69 HA ASN 69 5.168 -7.907 7.042 454 HB2 ASN 69 2HB ASN 69 3.578 -7.157 9.514 455 HB3 ASN 69 3HB ASN 69 3.035 -6.927 7.862 456 HD21 ASN 69 1HD2 ASN 69 4.043 -9.483 6.890 457 HD22 ASN 69 2HD2 ASN 69 2.997 -10.678 7.573 458 H SER 70 H SER 70 7.263 -6.448 8.922 459 HA SER 70 HA SER 70 6.371 -3.707 8.477 460 HB2 SER 70 2HB SER 70 8.725 -4.748 10.062 461 HB3 SER 70 3HB SER 70 8.175 -3.071 9.998 462 HG SER 70 HG SER 70 6.356 -5.081 10.733 463 H TYR 71 H TYR 71 7.076 -2.562 6.862 464 HA TYR 71 HA TYR 71 9.501 -3.404 5.417 465 HB2 TYR 71 2HB TYR 71 7.002 -2.007 4.465 466 HB3 TYR 71 3HB TYR 71 8.467 -2.112 3.503 467 HD1 TYR 71 HD1 TYR 71 5.852 -4.177 5.156 468 HD2 TYR 71 HD2 TYR 71 8.888 -3.989 2.186 469 HE1 TYR 71 HE1 TYR 71 5.091 -6.331 4.246 470 HE2 TYR 71 HE2 TYR 71 8.138 -6.141 1.273 471 HH TYR 71 HH TYR 71 6.870 -7.964 1.692 472 H GLU 72 H GLU 72 11.094 -1.952 5.094 473 HA GLU 72 HA GLU 72 10.777 0.690 6.274 474 HB2 GLU 72 2HB GLU 72 12.804 -0.637 6.809 475 HB3 GLU 72 3HB GLU 72 13.234 -0.639 5.104 476 HG2 GLU 72 2HG GLU 72 13.530 1.742 5.124 477 HG3 GLU 72 3HG GLU 72 12.945 1.836 6.783 478 H VAL 73 H VAL 73 10.135 2.298 5.041 479 HA VAL 73 HA VAL 73 10.252 1.957 2.142 480 HB VAL 73 HB VAL 73 8.443 3.610 3.899 481 HG11 VAL 73 1HG1 VAL 73 8.889 4.836 1.845 482 HG12 VAL 73 2HG1 VAL 73 7.233 4.228 1.866 483 HG13 VAL 73 3HG1 VAL 73 8.459 3.417 0.890 484 HG21 VAL 73 3HG2 VAL 73 6.690 2.130 3.059 485 HG22 VAL 73 1HG2 VAL 73 7.956 1.225 3.888 486 HG23 VAL 73 2HG2 VAL 73 7.890 1.235 2.125 487 H GLU 74 H GLU 74 11.282 3.280 0.869 488 HA GLU 74 HA GLU 74 12.053 5.946 1.767 489 HB2 GLU 74 2HB GLU 74 13.865 3.956 0.363 490 HB3 GLU 74 3HB GLU 74 14.240 5.664 0.558 491 HG2 GLU 74 2HG GLU 74 14.190 5.389 2.999 492 HG3 GLU 74 3HG GLU 74 13.842 3.677 2.790 493 H ASN 75 H ASN 75 11.736 7.502 0.196 494 HA ASN 75 HA ASN 75 10.574 6.492 -2.317 495 HB2 ASN 75 2HB ASN 75 9.655 8.795 -0.603 496 HB3 ASN 75 3HB ASN 75 9.073 8.506 -2.238 497 HD21 ASN 75 1HD2 ASN 75 7.688 8.499 0.364 498 HD22 ASN 75 2HD2 ASN 75 6.915 6.959 0.474 499 H GLN 76 H GLN 76 10.668 7.807 -4.128 500 HA GLN 76 HA GLN 76 12.717 9.929 -4.166 501 HB2 GLN 76 2HB GLN 76 13.801 7.922 -4.981 502 HB3 GLN 76 3HB GLN 76 12.451 7.575 -6.046 503 HG2 GLN 76 2HG GLN 76 12.986 9.547 -7.375 504 HG3 GLN 76 3HG GLN 76 14.338 9.902 -6.296 505 HE21 GLN 76 1HE2 GLN 76 16.200 8.756 -6.479 506 HE22 GLN 76 2HE2 GLN 76 16.503 7.604 -7.735 507 H TRP 77 H TRP 77 11.975 11.738 -5.244 508 HA TRP 77 HA TRP 77 9.756 11.351 -7.099 509 HB2 TRP 77 2HB TRP 77 8.516 13.271 -6.087 510 HB3 TRP 77 3HB TRP 77 8.600 11.848 -5.064 511 HD1 TRP 77 HD1 TRP 77 10.030 15.401 -5.349 512 HE1 TRP 77 HE1 TRP 77 10.848 16.136 -3.026 513 HE3 TRP 77 HE3 TRP 77 9.382 11.000 -2.828 514 HZ2 TRP 77 HZ2 TRP 77 11.174 15.007 -0.467 515 HZ3 TRP 77 HZ3 TRP 77 9.970 10.916 -0.439 516 HH2 TRP 77 HH2 TRP 77 10.847 12.880 0.713 517 H GLY 78 H GLY 78 9.305 13.138 -8.466 518 HA2 GLY 78 2HA GLY 78 9.852 15.039 -9.688 519 HA3 GLY 78 3HA GLY 78 11.180 15.338 -8.579 520 H GLY 79 H GLY 79 11.182 12.174 -9.756 521 HA2 GLY 79 2HA GLY 79 12.066 11.622 -12.034 522 HA3 GLY 79 3HA GLY 79 13.236 12.904 -11.738 523 H ASP 80 H ASP 80 14.384 10.630 -12.338 524 HA ASP 80 HA ASP 80 14.841 9.067 -9.916 525 HB2 ASP 80 2HB ASP 80 15.983 7.490 -11.293 526 HB3 ASP 80 3HB ASP 80 14.570 8.001 -12.209 527 H SER 81 H SER 81 16.019 11.818 -11.293 528 HA SER 81 HA SER 81 18.795 11.506 -10.686 529 HB2 SER 81 2HB SER 81 17.208 14.020 -11.243 530 HB3 SER 81 3HB SER 81 18.966 13.878 -11.262 531 HG SER 81 HG SER 81 17.931 11.984 -12.830 532 H ALA 82 H ALA 82 16.064 12.117 -8.796 533 HA ALA 82 HA ALA 82 17.476 13.699 -6.805 534 HB1 ALA 82 3HB ALA 82 15.154 14.277 -7.333 535 HB2 ALA 82 1HB ALA 82 15.325 13.788 -5.646 536 HB3 ALA 82 2HB ALA 82 14.638 12.670 -6.826 537 HA PRO 83 HA PRO 83 18.776 10.015 -4.651 538 HB2 PRO 83 2HB PRO 83 19.361 11.225 -2.254 539 HB3 PRO 83 3HB PRO 83 20.448 11.239 -3.647 540 HG2 PRO 83 2HG PRO 83 18.539 13.347 -2.713 541 HG3 PRO 83 3HG PRO 83 20.196 13.526 -3.320 542 HD2 PRO 83 2HD PRO 83 18.063 14.040 -4.868 543 HD3 PRO 83 3HD PRO 83 19.539 13.314 -5.534 544 H TRP 84 H TRP 84 17.586 8.511 -3.596 545 HA TRP 84 HA TRP 84 15.037 8.779 -2.750 546 HB2 TRP 84 2HB TRP 84 17.117 6.867 -1.689 547 HB3 TRP 84 3HB TRP 84 15.382 6.695 -1.448 548 HD1 TRP 84 HD1 TRP 84 18.072 6.411 -4.152 549 HE1 TRP 84 HE1 TRP 84 17.116 5.085 -6.131 550 HE3 TRP 84 HE3 TRP 84 13.207 6.068 -2.626 551 HZ2 TRP 84 HZ2 TRP 84 14.635 4.033 -6.947 552 HZ3 TRP 84 HZ3 TRP 84 11.605 4.882 -4.069 553 HH2 TRP 84 HH2 TRP 84 12.306 3.887 -6.185 554 H HIS 85 H HIS 85 13.953 9.260 -0.971 555 HA HIS 85 HA HIS 85 15.469 10.315 1.327 556 HB2 HIS 85 2HB HIS 85 12.742 11.140 0.294 557 HB3 HIS 85 3HB HIS 85 13.481 11.748 1.766 558 HD1 HIS 85 HD1 HIS 85 15.569 13.347 1.453 559 HD2 HIS 85 HD2 HIS 85 13.548 12.357 -2.042 560 HE1 HIS 85 HE1 HIS 85 16.334 15.001 -0.254 561 H SER 86 H SER 86 14.757 9.760 3.365 562 HA SER 86 HA SER 86 13.661 7.244 3.766 563 HB2 SER 86 2HB SER 86 13.549 9.511 5.753 564 HB3 SER 86 3HB SER 86 13.672 7.784 6.091 565 HG SER 86 HG SER 86 15.675 8.988 6.250 566 H GLY 87 H GLY 87 11.567 6.542 4.556 567 HA2 GLY 87 2HA GLY 87 9.427 8.490 4.072 568 HA3 GLY 87 3HA GLY 87 9.343 6.829 3.485 569 H GLY 88 H GLY 88 10.088 5.253 5.408 570 HA2 GLY 88 2HA GLY 88 9.850 5.609 8.043 571 HA3 GLY 88 3HA GLY 88 8.169 5.755 7.549 572 H ASN 89 H ASN 89 7.986 3.877 9.033 573 HA ASN 89 HA ASN 89 8.672 1.366 7.656 574 HB2 ASN 89 2HB ASN 89 8.123 1.888 10.591 575 HB3 ASN 89 3HB ASN 89 8.294 0.281 9.898 576 HD21 ASN 89 1HD2 ASN 89 10.407 1.091 8.058 577 HD22 ASN 89 2HD2 ASN 89 11.827 1.302 9.021 578 H TRP 90 H TRP 90 7.025 0.418 6.667 579 HA TRP 90 HA TRP 90 4.308 1.115 7.546 580 HB2 TRP 90 2HB TRP 90 5.331 0.273 4.826 581 HB3 TRP 90 3HB TRP 90 3.632 0.485 5.219 582 HD1 TRP 90 HD1 TRP 90 5.767 3.118 6.797 583 HE1 TRP 90 HE1 TRP 90 5.541 5.325 5.509 584 HE3 TRP 90 HE3 TRP 90 3.327 1.388 2.659 585 HZ2 TRP 90 HZ2 TRP 90 4.496 6.222 3.056 586 HZ3 TRP 90 HZ3 TRP 90 2.734 2.994 0.898 587 HH2 TRP 90 HH2 TRP 90 3.307 5.356 1.088 588 H ILE 91 H ILE 91 2.731 -0.509 7.591 589 HA ILE 91 HA ILE 91 3.849 -3.227 7.875 590 HB ILE 91 HB ILE 91 1.261 -2.100 8.992 591 HG12 ILE 91 2HG1 ILE 91 3.783 -2.921 10.455 592 HG13 ILE 91 3HG1 ILE 91 3.349 -1.256 10.076 593 HG21 ILE 91 1HG2 ILE 91 1.084 -4.222 10.212 594 HG22 ILE 91 2HG2 ILE 91 2.531 -4.812 9.396 595 HG23 ILE 91 3HG2 ILE 91 1.069 -4.476 8.468 596 HD11 ILE 91 3HD1 ILE 91 1.775 -3.133 11.825 597 HD12 ILE 91 1HD1 ILE 91 1.355 -1.459 11.462 598 HD13 ILE 91 2HD1 ILE 91 2.816 -1.824 12.382 599 H LEU 92 H LEU 92 3.471 -4.527 6.202 600 HA LEU 92 HA LEU 92 1.019 -4.131 4.625 601 HB2 LEU 92 2HB LEU 92 3.780 -4.515 3.480 602 HB3 LEU 92 3HB LEU 92 2.293 -4.439 2.558 603 HG LEU 92 HG LEU 92 3.418 -2.166 4.198 604 HD11 LEU 92 1HD1 LEU 92 3.954 -1.143 2.050 605 HD12 LEU 92 2HD1 LEU 92 3.410 -2.599 1.218 606 HD13 LEU 92 3HD1 LEU 92 4.821 -2.661 2.273 607 HD21 LEU 92 3HD2 LEU 92 1.732 -0.816 3.026 608 HD22 LEU 92 1HD2 LEU 92 0.993 -2.069 4.023 609 HD23 LEU 92 2HD2 LEU 92 1.095 -2.280 2.277 610 H GLY 93 H GLY 93 0.258 -5.963 5.804 611 HA2 GLY 93 2HA GLY 93 0.126 -8.298 4.400 612 HA3 GLY 93 3HA GLY 93 1.457 -8.541 5.526 613 H SER 94 H SER 94 -1.785 -9.038 5.126 614 HA SER 94 HA SER 94 -2.482 -8.616 7.920 615 HB2 SER 94 2HB SER 94 -4.736 -9.384 7.257 616 HB3 SER 94 3HB SER 94 -4.173 -8.077 6.220 617 HG SER 94 HG SER 94 -4.854 -10.623 5.584 618 H ARG 95 H ARG 95 -0.804 -10.843 6.288 619 HA ARG 95 HA ARG 95 -1.764 -13.061 7.936 620 HB2 ARG 95 2HB ARG 95 -0.128 -13.113 5.386 621 HB3 ARG 95 3HB ARG 95 -0.613 -14.531 6.312 622 HG2 ARG 95 2HG ARG 95 -2.957 -14.044 5.867 623 HG3 ARG 95 3HG ARG 95 -2.498 -12.589 4.983 624 HD2 ARG 95 2HD ARG 95 -2.910 -14.219 3.337 625 HD3 ARG 95 3HD ARG 95 -1.154 -14.117 3.465 626 HE ARG 95 HE ARG 95 -1.329 -16.152 4.910 627 HH11 ARG 95 1HH1 ARG 95 -3.697 -15.470 2.383 628 HH12 ARG 95 2HH1 ARG 95 -4.268 -17.091 2.325 629 HH21 ARG 95 1HH2 ARG 95 -2.065 -18.306 4.789 630 HH22 ARG 95 2HH2 ARG 95 -3.336 -18.719 3.691 631 H GLU 96 H GLU 96 -0.264 -14.128 9.208 632 HA GLU 96 HA GLU 96 1.768 -12.339 10.189 633 HB2 GLU 96 2HB GLU 96 0.364 -13.631 11.740 634 HB3 GLU 96 3HB GLU 96 1.038 -15.124 11.110 635 HG2 GLU 96 2HG GLU 96 3.226 -14.526 11.949 636 HG3 GLU 96 3HG GLU 96 2.611 -12.973 12.508 637 H ASN 97 H ASN 97 1.674 -15.383 8.461 638 HA ASN 97 HA ASN 97 4.612 -15.341 8.302 639 HB2 ASN 97 2HB ASN 97 2.684 -17.651 8.023 640 HB3 ASN 97 3HB ASN 97 4.420 -17.767 7.747 641 HD21 ASN 97 1HD2 ASN 97 1.904 -17.535 10.087 642 HD22 ASN 97 2HD2 ASN 97 2.900 -17.754 11.486 643 H GLN 98 H GLN 98 2.857 -13.772 6.635 644 HA GLN 98 HA GLN 98 3.854 -14.563 4.073 645 HB2 GLN 98 2HB GLN 98 1.911 -16.020 4.180 646 HB3 GLN 98 3HB GLN 98 0.871 -14.659 4.545 647 HG2 GLN 98 2HG GLN 98 1.146 -13.771 2.349 648 HG3 GLN 98 3HG GLN 98 2.406 -14.951 1.976 649 HE21 GLN 98 1HE2 GLN 98 -0.280 -14.395 0.764 650 HE22 GLN 98 2HE2 GLN 98 -1.084 -15.916 0.766 651 H ASN 99 H ASN 99 4.298 -12.829 2.936 652 HA ASN 99 HA ASN 99 3.342 -10.241 3.959 653 HB2 ASN 99 2HB ASN 99 5.871 -10.993 2.490 654 HB3 ASN 99 3HB ASN 99 5.412 -9.337 2.862 655 HD21 ASN 99 1HD2 ASN 99 7.682 -11.061 3.703 656 HD22 ASN 99 2HD2 ASN 99 7.690 -10.983 5.428 657 H VAL 100 H VAL 100 3.447 -8.501 2.341 658 HA VAL 100 HA VAL 100 1.826 -9.297 0.005 659 HB VAL 100 HB VAL 100 1.471 -6.963 -0.513 660 HG11 VAL 100 1HG1 VAL 100 0.025 -7.949 1.142 661 HG12 VAL 100 2HG1 VAL 100 0.325 -6.254 1.530 662 HG13 VAL 100 3HG1 VAL 100 1.160 -7.524 2.424 663 HG21 VAL 100 3HG2 VAL 100 2.442 -5.164 0.762 664 HG22 VAL 100 1HG2 VAL 100 3.721 -6.156 0.070 665 HG23 VAL 100 2HG2 VAL 100 3.315 -6.310 1.782 666 H VAL 101 H VAL 101 2.323 -8.821 -2.169 667 HA VAL 101 HA VAL 101 5.166 -8.235 -2.638 668 HB VAL 101 HB VAL 101 5.220 -9.710 -4.583 669 HG11 VAL 101 1HG1 VAL 101 5.240 -11.832 -3.424 670 HG12 VAL 101 2HG1 VAL 101 4.305 -11.135 -2.102 671 HG13 VAL 101 3HG1 VAL 101 5.940 -10.560 -2.425 672 HG21 VAL 101 3HG2 VAL 101 2.442 -10.549 -3.761 673 HG22 VAL 101 1HG2 VAL 101 3.417 -11.318 -5.010 674 HG23 VAL 101 2HG2 VAL 101 2.872 -9.654 -5.219 675 H ALA 102 H ALA 102 1.872 -7.757 -3.694 676 HA ALA 102 HA ALA 102 2.881 -5.532 -5.288 677 HB1 ALA 102 3HB ALA 102 1.561 -6.028 -7.203 678 HB2 ALA 102 1HB ALA 102 0.775 -7.379 -6.386 679 HB3 ALA 102 2HB ALA 102 2.483 -7.478 -6.809 680 H ILE 103 H ILE 103 1.726 -3.757 -5.151 681 HA ILE 103 HA ILE 103 -0.943 -3.923 -3.925 682 HB ILE 103 HB ILE 103 1.170 -1.844 -3.273 683 HG12 ILE 103 2HG1 ILE 103 -0.129 -3.898 -1.468 684 HG13 ILE 103 3HG1 ILE 103 1.467 -4.084 -2.185 685 HG21 ILE 103 1HG2 ILE 103 -0.488 -0.948 -1.692 686 HG22 ILE 103 2HG2 ILE 103 -1.671 -2.118 -2.277 687 HG23 ILE 103 3HG2 ILE 103 -1.064 -0.865 -3.357 688 HD11 ILE 103 3HD1 ILE 103 2.244 -2.118 -0.977 689 HD12 ILE 103 1HD1 ILE 103 1.598 -3.334 0.124 690 HD13 ILE 103 2HD1 ILE 103 0.639 -1.910 -0.276 691 H ASN 104 H ASN 104 -2.411 -3.083 -5.196 692 HA ASN 104 HA ASN 104 -1.665 -0.916 -7.051 693 HB2 ASN 104 2HB ASN 104 -1.882 -3.076 -8.252 694 HB3 ASN 104 3HB ASN 104 -3.508 -3.261 -7.611 695 HD21 ASN 104 1HD2 ASN 104 -5.167 -2.049 -8.468 696 HD22 ASN 104 2HD2 ASN 104 -5.007 -1.156 -9.942 697 H VAL 105 H VAL 105 -2.565 0.694 -5.942 698 HA VAL 105 HA VAL 105 -5.476 0.652 -5.533 699 HB VAL 105 HB VAL 105 -5.408 1.460 -3.229 700 HG11 VAL 105 1HG1 VAL 105 -4.637 -0.596 -2.119 701 HG12 VAL 105 2HG1 VAL 105 -3.896 -1.107 -3.635 702 HG13 VAL 105 3HG1 VAL 105 -5.643 -0.909 -3.527 703 HG21 VAL 105 3HG2 VAL 105 -3.247 2.578 -3.255 704 HG22 VAL 105 1HG2 VAL 105 -2.435 1.019 -3.396 705 HG23 VAL 105 2HG2 VAL 105 -3.330 1.416 -1.930 706 H GLU 106 H GLU 106 -6.504 2.591 -5.497 707 HA GLU 106 HA GLU 106 -4.995 5.056 -5.323 708 HB2 GLU 106 2HB GLU 106 -4.946 4.537 -7.746 709 HB3 GLU 106 3HB GLU 106 -6.703 4.456 -7.756 710 HG2 GLU 106 2HG GLU 106 -6.846 6.801 -7.162 711 HG3 GLU 106 3HG GLU 106 -5.092 6.902 -7.048 712 H SER 107 H SER 107 -6.346 6.880 -4.950 713 HA SER 107 HA SER 107 -9.113 6.239 -4.203 714 HB2 SER 107 2HB SER 107 -7.785 6.085 -2.179 715 HB3 SER 107 3HB SER 107 -7.083 7.673 -2.484 716 HG SER 107 HG SER 107 -9.468 6.989 -1.365 717 H GLY 108 H GLY 108 -10.538 7.973 -4.269 718 HA2 GLY 108 2HA GLY 108 -9.593 10.341 -5.704 719 HA3 GLY 108 3HA GLY 108 -11.275 9.852 -5.494 720 H ASP 109 H ASP 109 -9.758 9.377 -2.635 721 HA ASP 109 HA ASP 109 -10.822 11.873 -1.508 722 HB2 ASP 109 2HB ASP 109 -10.106 9.210 -0.262 723 HB3 ASP 109 3HB ASP 109 -10.443 10.638 0.702 724 H ASP 110 H ASP 110 -9.443 12.221 0.708 725 HA ASP 110 HA ASP 110 -6.735 12.783 -0.195 726 HB2 ASP 110 2HB ASP 110 -6.589 14.095 1.920 727 HB3 ASP 110 3HB ASP 110 -7.915 14.607 0.883 728 H GLY 111 H GLY 111 -7.492 10.054 0.234 729 HA2 GLY 111 2HA GLY 111 -6.179 8.290 1.011 730 HA3 GLY 111 3HA GLY 111 -5.510 9.351 2.237 731 H GLN 112 H GLN 112 -8.869 9.631 2.138 732 HA GLN 112 HA GLN 112 -9.201 8.496 4.704 733 HB2 GLN 112 2HB GLN 112 -11.266 9.226 2.630 734 HB3 GLN 112 3HB GLN 112 -11.648 8.747 4.276 735 HG2 GLN 112 2HG GLN 112 -10.397 10.674 5.117 736 HG3 GLN 112 3HG GLN 112 -10.045 11.155 3.456 737 HE21 GLN 112 1HE2 GLN 112 -11.506 12.542 5.573 738 HE22 GLN 112 2HE2 GLN 112 -13.068 12.882 4.920 739 H THR 113 H THR 113 -10.246 7.349 1.514 740 HA THR 113 HA THR 113 -10.248 4.626 2.590 741 HB THR 113 HB THR 113 -12.132 4.117 1.008 742 HG1 THR 113 HG1 THR 113 -12.317 6.975 0.835 743 HG21 THR 113 3HG2 THR 113 -12.719 6.191 3.123 744 HG22 THR 113 1HG2 THR 113 -12.573 4.455 3.388 745 HG23 THR 113 2HG2 THR 113 -13.899 5.093 2.412 746 H LEU 114 H LEU 114 -9.065 3.246 1.411 747 HA LEU 114 HA LEU 114 -8.100 4.204 -1.195 748 HB2 LEU 114 2HB LEU 114 -6.864 2.194 0.682 749 HB3 LEU 114 3HB LEU 114 -6.192 2.683 -0.861 750 HG LEU 114 HG LEU 114 -6.535 4.451 1.565 751 HD11 LEU 114 1HD1 LEU 114 -4.775 2.810 1.845 752 HD12 LEU 114 2HD1 LEU 114 -4.094 4.424 1.638 753 HD13 LEU 114 3HD1 LEU 114 -4.071 3.277 0.299 754 HD21 LEU 114 3HD2 LEU 114 -6.781 5.761 -0.443 755 HD22 LEU 114 1HD2 LEU 114 -5.339 5.026 -1.144 756 HD23 LEU 114 2HD2 LEU 114 -5.200 6.074 0.268 757 H ASN 115 H ASN 115 -8.718 3.155 -2.946 758 HA ASN 115 HA ASN 115 -10.054 0.549 -2.631 759 HB2 ASN 115 2HB ASN 115 -10.351 2.628 -4.811 760 HB3 ASN 115 3HB ASN 115 -11.205 1.091 -4.742 761 HD21 ASN 115 1HD2 ASN 115 -12.888 0.855 -3.348 762 HD22 ASN 115 2HD2 ASN 115 -13.622 2.177 -2.514 763 H GLY 116 H GLY 116 -9.255 -1.199 -3.736 764 HA2 GLY 116 2HA GLY 116 -8.094 -1.131 -6.229 765 HA3 GLY 116 3HA GLY 116 -6.767 -0.894 -5.111 766 H THR 117 H THR 117 -5.742 -2.722 -5.465 767 HA THR 117 HA THR 117 -6.994 -5.195 -4.550 768 HB THR 117 HB THR 117 -5.860 -6.433 -6.452 769 HG1 THR 117 HG1 THR 117 -5.122 -5.287 -8.171 770 HG21 THR 117 3HG2 THR 117 -8.064 -4.495 -7.185 771 HG22 THR 117 1HG2 THR 117 -8.278 -6.083 -6.449 772 HG23 THR 117 2HG2 THR 117 -7.640 -5.949 -8.088 773 H MET 118 H MET 118 -5.371 -6.896 -4.115 774 HA MET 118 HA MET 118 -2.649 -5.905 -3.729 775 HB2 MET 118 2HB MET 118 -2.491 -6.527 -1.443 776 HB3 MET 118 3HB MET 118 -3.955 -5.562 -1.580 777 HG2 MET 118 2HG MET 118 -5.336 -7.492 -1.459 778 HG3 MET 118 3HG MET 118 -3.950 -8.568 -1.608 779 HE1 MET 118 3HE MET 118 -5.940 -6.140 0.671 780 HE2 MET 118 1HE MET 118 -4.386 -5.314 0.553 781 HE3 MET 118 2HE MET 118 -4.900 -6.012 2.090 782 H THR 119 H THR 119 -1.095 -7.526 -3.687 783 HA THR 119 HA THR 119 -2.077 -10.261 -4.168 784 HB THR 119 HB THR 119 0.299 -9.003 -5.567 785 HG1 THR 119 HG1 THR 119 -1.071 -8.958 -7.399 786 HG21 THR 119 3HG2 THR 119 0.440 -11.437 -5.290 787 HG22 THR 119 1HG2 THR 119 0.199 -11.007 -6.984 788 HG23 THR 119 2HG2 THR 119 -1.150 -11.616 -6.029 789 H TYR 120 H TYR 120 -1.127 -11.763 -2.918 790 HA TYR 120 HA TYR 120 1.040 -10.899 -1.157 791 HB2 TYR 120 2HB TYR 120 -0.990 -13.071 -1.002 792 HB3 TYR 120 3HB TYR 120 0.490 -13.193 -0.066 793 HD1 TYR 120 HD2 TYR 120 0.943 -11.629 1.727 794 HD2 TYR 120 HD1 TYR 120 -2.712 -11.480 -0.433 795 HE1 TYR 120 HE2 TYR 120 -0.026 -10.237 3.490 796 HE2 TYR 120 HE1 TYR 120 -3.696 -10.081 1.336 797 HH TYR 120 HH TYR 120 -3.342 -9.599 3.717 798 H ALA 121 H ALA 121 2.535 -12.737 -0.466 799 HA ALA 121 HA ALA 121 4.271 -13.307 -2.542 800 HB1 ALA 121 3HB ALA 121 5.463 -14.729 -0.976 801 HB2 ALA 121 1HB ALA 121 4.052 -14.771 0.083 802 HB3 ALA 121 2HB ALA 121 4.914 -13.254 -0.182 803 H GLY 122 H GLY 122 1.662 -15.357 -1.291 804 HA2 GLY 122 2HA GLY 122 2.049 -17.086 -3.619 805 HA3 GLY 122 3HA GLY 122 2.076 -17.837 -2.030 806 H GLU 123 H GLU 123 0.082 -15.238 -3.362 807 HA GLU 123 HA GLU 123 -2.278 -16.898 -3.259 808 HB2 GLU 123 2HB GLU 123 -1.922 -16.068 -0.926 809 HB3 GLU 123 3HB GLU 123 -2.028 -14.433 -1.539 810 HG2 GLU 123 2HG GLU 123 -4.325 -14.748 -2.141 811 HG3 GLU 123 3HG GLU 123 -4.239 -16.453 -1.694 812 H GLY 124 H GLY 124 -3.950 -16.048 -4.510 813 HA2 GLY 124 2HA GLY 124 -3.109 -14.360 -6.637 814 HA3 GLY 124 3HA GLY 124 -4.735 -14.972 -6.387 815 HA PRO 125 HA PRO 125 -4.218 -10.290 -5.419 816 HB2 PRO 125 2HB PRO 125 -5.552 -9.353 -7.631 817 HB3 PRO 125 3HB PRO 125 -3.793 -9.489 -7.529 818 HG2 PRO 125 2HG PRO 125 -5.766 -11.350 -8.791 819 HG3 PRO 125 3HG PRO 125 -4.185 -10.823 -9.390 820 HD2 PRO 125 2HD PRO 125 -4.528 -13.227 -8.248 821 HD3 PRO 125 3HD PRO 125 -3.034 -12.293 -8.020 822 H ILE 126 H ILE 126 -5.789 -9.404 -4.251 823 HA ILE 126 HA ILE 126 -8.562 -10.260 -4.713 824 HB ILE 126 HB ILE 126 -8.947 -10.330 -2.285 825 HG12 ILE 126 2HG1 ILE 126 -5.945 -10.026 -2.028 826 HG13 ILE 126 3HG1 ILE 126 -7.114 -8.764 -1.660 827 HG21 ILE 126 1HG2 ILE 126 -7.736 -12.423 -1.822 828 HG22 ILE 126 2HG2 ILE 126 -6.712 -12.123 -3.226 829 HG23 ILE 126 3HG2 ILE 126 -8.439 -12.400 -3.440 830 HD11 ILE 126 3HD1 ILE 126 -6.886 -11.421 -0.264 831 HD12 ILE 126 1HD1 ILE 126 -8.054 -10.154 0.112 832 HD13 ILE 126 2HD1 ILE 126 -6.330 -9.866 0.355 833 H GLY 127 H GLY 127 -10.154 -8.801 -3.584 834 HA2 GLY 127 2HA GLY 127 -9.606 -6.105 -4.388 835 HA3 GLY 127 3HA GLY 127 -11.079 -6.689 -3.630 836 H PHE 128 H PHE 128 -9.011 -4.408 -3.228 837 HA PHE 128 HA PHE 128 -8.630 -4.764 -0.334 838 HB2 PHE 128 2HB PHE 128 -6.488 -4.614 -1.329 839 HB3 PHE 128 3HB PHE 128 -6.987 -3.309 -2.394 840 HD1 PHE 128 HD1 PHE 128 -6.095 -4.159 1.081 841 HD2 PHE 128 HD2 PHE 128 -6.905 -1.046 -1.685 842 HE1 PHE 128 HE1 PHE 128 -5.207 -2.513 2.679 843 HE2 PHE 128 HE2 PHE 128 -6.019 0.602 -0.096 844 HZ PHE 128 HZ PHE 128 -5.169 -0.130 2.090 845 H LYS 129 H LYS 129 -9.592 -3.416 0.984 846 HA LYS 129 HA LYS 129 -10.393 -0.769 0.041 847 HB2 LYS 129 2HB LYS 129 -12.403 -2.124 0.050 848 HB3 LYS 129 3HB LYS 129 -12.050 -2.698 1.672 849 HG2 LYS 129 2HG LYS 129 -12.384 -0.453 2.551 850 HG3 LYS 129 3HG LYS 129 -12.703 0.142 0.920 851 HD2 LYS 129 2HD LYS 129 -14.636 -1.346 0.758 852 HD3 LYS 129 3HD LYS 129 -14.311 -1.950 2.385 853 HE2 LYS 129 2HE LYS 129 -14.891 0.923 1.704 854 HE3 LYS 129 3HE LYS 129 -16.097 -0.222 2.289 855 HZ1 LYS 129 3HZ LYS 129 -15.326 1.009 4.146 856 HZ2 LYS 129 1HZ LYS 129 -13.697 0.752 3.757 857 HZ3 LYS 129 2HZ LYS 129 -14.658 -0.542 4.274 858 H GLY 130 H GLY 130 -8.810 0.319 1.086 859 HA2 GLY 130 2HA GLY 130 -8.270 -0.273 3.905 860 HA3 GLY 130 3HA GLY 130 -7.354 0.829 2.881 861 H THR 131 H THR 131 -9.035 0.933 5.574 862 HA THR 131 HA THR 131 -10.286 3.492 4.872 863 HB THR 131 HB THR 131 -11.378 1.462 6.842 864 HG1 THR 131 HG1 THR 131 -11.486 0.974 4.492 865 HG21 THR 131 3HG2 THR 131 -13.368 2.909 6.841 866 HG22 THR 131 1HG2 THR 131 -12.562 4.021 5.736 867 HG23 THR 131 2HG2 THR 131 -11.944 3.802 7.371 868 H LEU 132 H LEU 132 -9.710 5.144 6.161 869 HA LEU 132 HA LEU 132 -7.644 4.995 8.046 870 HB2 LEU 132 2HB LEU 132 -9.810 7.068 7.756 871 HB3 LEU 132 3HB LEU 132 -8.495 7.226 8.898 872 HG LEU 132 HG LEU 132 -8.158 7.047 5.906 873 HD11 LEU 132 1HD1 LEU 132 -9.294 9.110 6.630 874 HD12 LEU 132 2HD1 LEU 132 -7.672 9.424 6.011 875 HD13 LEU 132 3HD1 LEU 132 -7.970 9.428 7.751 876 HD21 LEU 132 3HD2 LEU 132 -6.210 7.653 8.131 877 HD22 LEU 132 1HD2 LEU 132 -5.865 7.780 6.406 878 HD23 LEU 132 2HD2 LEU 132 -6.225 6.209 7.117 879 H THR 133 H THR 133 -7.504 4.607 10.176 880 HA THR 133 HA THR 133 -9.993 3.919 11.561 881 HB THR 133 HB THR 133 -7.185 3.009 12.220 882 HG1 THR 133 HG1 THR 133 -8.751 2.296 10.211 883 HG21 THR 133 3HG2 THR 133 -8.352 1.314 13.567 884 HG22 THR 133 1HG2 THR 133 -9.903 2.015 13.108 885 HG23 THR 133 2HG2 THR 133 -8.776 2.941 14.100 Start of MODEL 7 1 H1 ALA 2 1H ALA 2 0.646 7.557 8.772 2 H2 ALA 2 2H ALA 2 0.247 6.184 7.854 3 H3 ALA 2 3H ALA 2 1.029 6.013 9.344 4 HA ALA 2 HA ALA 2 -0.872 6.890 10.497 5 HB1 ALA 2 3HB ALA 2 -2.971 7.222 9.269 6 HB2 ALA 2 1HB ALA 2 -2.131 6.913 7.751 7 HB3 ALA 2 2HB ALA 2 -1.715 8.329 8.717 8 H LEU 3 H LEU 3 -2.690 5.469 11.069 9 HA LEU 3 HA LEU 3 -2.054 2.715 10.328 10 HB2 LEU 3 2HB LEU 3 -2.035 3.466 12.739 11 HB3 LEU 3 3HB LEU 3 -3.759 3.726 12.611 12 HG LEU 3 HG LEU 3 -3.013 1.602 13.764 13 HD11 LEU 3 1HD1 LEU 3 -4.751 0.210 12.740 14 HD12 LEU 3 2HD1 LEU 3 -4.841 1.334 11.386 15 HD13 LEU 3 3HD1 LEU 3 -5.290 1.864 13.006 16 HD21 LEU 3 3HD2 LEU 3 -2.368 0.749 10.942 17 HD22 LEU 3 1HD2 LEU 3 -2.363 -0.284 12.369 18 HD23 LEU 3 2HD2 LEU 3 -1.192 1.024 12.230 19 H TYR 4 H TYR 4 -3.458 1.461 9.250 20 HA TYR 4 HA TYR 4 -6.163 2.523 8.775 21 HB2 TYR 4 2HB TYR 4 -4.352 1.155 6.775 22 HB3 TYR 4 3HB TYR 4 -6.040 1.547 6.492 23 HD1 TYR 4 HD1 TYR 4 -2.657 2.920 6.864 24 HD2 TYR 4 HD2 TYR 4 -6.726 3.805 5.998 25 HE1 TYR 4 HE1 TYR 4 -1.992 5.115 5.984 26 HE2 TYR 4 HE2 TYR 4 -6.067 6.006 5.124 27 HH TYR 4 HH TYR 4 -4.201 7.609 5.323 28 H ASN 5 H ASN 5 -7.784 1.025 8.508 29 HA ASN 5 HA ASN 5 -7.204 -1.683 9.490 30 HB2 ASN 5 2HB ASN 5 -9.635 0.057 9.587 31 HB3 ASN 5 3HB ASN 5 -9.893 -1.677 9.441 32 HD21 ASN 5 1HD2 ASN 5 -8.716 0.883 11.497 33 HD22 ASN 5 2HD2 ASN 5 -8.625 -0.069 12.936 34 H VAL 6 H VAL 6 -7.620 -3.439 8.215 35 HA VAL 6 HA VAL 6 -8.212 -2.715 5.424 36 HB VAL 6 HB VAL 6 -6.233 -4.714 6.480 37 HG11 VAL 6 1HG1 VAL 6 -7.414 -5.732 4.587 38 HG12 VAL 6 2HG1 VAL 6 -5.750 -5.321 4.164 39 HG13 VAL 6 3HG1 VAL 6 -7.080 -4.299 3.612 40 HG21 VAL 6 3HG2 VAL 6 -5.983 -2.289 4.708 41 HG22 VAL 6 1HG2 VAL 6 -4.659 -3.347 5.195 42 HG23 VAL 6 2HG2 VAL 6 -5.513 -2.392 6.405 43 H GLU 7 H GLU 7 -9.723 -3.617 4.382 44 HA GLU 7 HA GLU 7 -10.937 -6.118 5.323 45 HB2 GLU 7 2HB GLU 7 -12.150 -3.861 3.702 46 HB3 GLU 7 3HB GLU 7 -12.977 -5.338 4.165 47 HG2 GLU 7 2HG GLU 7 -12.821 -4.714 6.512 48 HG3 GLU 7 3HG GLU 7 -11.934 -3.257 6.078 49 H ASN 8 H ASN 8 -10.994 -7.781 3.873 50 HA ASN 8 HA ASN 8 -9.890 -7.248 1.195 51 HB2 ASN 8 2HB ASN 8 -9.479 -9.599 3.035 52 HB3 ASN 8 3HB ASN 8 -9.135 -9.690 1.314 53 HD21 ASN 8 1HD2 ASN 8 -8.152 -6.991 1.079 54 HD22 ASN 8 2HD2 ASN 8 -6.611 -6.956 1.854 55 H GLN 9 H GLN 9 -10.960 -8.008 -0.528 56 HA GLN 9 HA GLN 9 -13.511 -9.385 0.013 57 HB2 GLN 9 2HB GLN 9 -13.650 -7.085 -0.921 58 HB3 GLN 9 3HB GLN 9 -12.788 -7.650 -2.344 59 HG2 GLN 9 2HG GLN 9 -14.624 -9.246 -2.776 60 HG3 GLN 9 3HG GLN 9 -15.497 -8.560 -1.406 61 HE21 GLN 9 1HE2 GLN 9 -17.198 -7.792 -2.567 62 HE22 GLN 9 2HE2 GLN 9 -17.071 -6.489 -3.701 63 H TRP 10 H TRP 10 -13.618 -11.422 -0.626 64 HA TRP 10 HA TRP 10 -12.508 -12.147 -3.220 65 HB2 TRP 10 2HB TRP 10 -11.777 -14.370 -2.278 66 HB3 TRP 10 3HB TRP 10 -10.822 -12.999 -1.738 67 HD1 TRP 10 HD1 TRP 10 -13.659 -15.307 -0.414 68 HE1 TRP 10 HE1 TRP 10 -13.411 -15.476 2.143 69 HE3 TRP 10 HE3 TRP 10 -9.799 -12.016 0.266 70 HZ2 TRP 10 HZ2 TRP 10 -11.803 -14.376 4.172 71 HZ3 TRP 10 HZ3 TRP 10 -8.968 -11.642 2.545 72 HH2 TRP 10 HH2 TRP 10 -9.945 -12.798 4.455 73 H GLY 11 H GLY 11 -13.766 -13.592 -4.380 74 HA2 GLY 11 2HA GLY 11 -15.471 -15.425 -4.105 75 HA3 GLY 11 3HA GLY 11 -16.329 -14.259 -3.100 76 H GLY 12 H GLY 12 -14.790 -12.549 -5.477 77 HA2 GLY 12 2HA GLY 12 -15.369 -11.800 -7.558 78 HA3 GLY 12 3HA GLY 12 -16.642 -13.002 -7.610 79 H SER 13 H SER 13 -17.878 -11.408 -8.575 80 HA SER 13 HA SER 13 -18.647 -8.940 -7.619 81 HB2 SER 13 2HB SER 13 -20.536 -10.878 -8.956 82 HB3 SER 13 3HB SER 13 -20.574 -9.114 -9.022 83 HG SER 13 HG SER 13 -19.519 -10.530 -10.800 84 H SER 14 H SER 14 -20.006 -8.152 -6.092 85 HA SER 14 HA SER 14 -21.408 -8.003 -4.342 86 HB2 SER 14 2HB SER 14 -22.550 -10.618 -5.331 87 HB3 SER 14 3HB SER 14 -23.330 -9.494 -4.218 88 HG SER 14 HG SER 14 -22.817 -7.951 -6.134 89 H ALA 15 H ALA 15 -18.860 -9.724 -4.181 90 HA ALA 15 HA ALA 15 -19.429 -11.476 -1.972 91 HB1 ALA 15 3HB ALA 15 -17.594 -11.969 -3.532 92 HB2 ALA 15 1HB ALA 15 -17.012 -11.810 -1.875 93 HB3 ALA 15 2HB ALA 15 -16.774 -10.494 -3.021 94 HA PRO 16 HA PRO 16 -19.201 -8.362 1.151 95 HB2 PRO 16 2HB PRO 16 -18.745 -9.911 3.315 96 HB3 PRO 16 3HB PRO 16 -20.306 -9.890 2.487 97 HG2 PRO 16 2HG PRO 16 -18.061 -11.857 2.220 98 HG3 PRO 16 3HG PRO 16 -19.799 -12.161 2.394 99 HD2 PRO 16 2HD PRO 16 -18.566 -12.243 -0.006 100 HD3 PRO 16 3HD PRO 16 -20.242 -11.688 0.177 101 H TRP 17 H TRP 17 -17.750 -7.395 2.604 102 HA TRP 17 HA TRP 17 -14.942 -7.852 1.919 103 HB2 TRP 17 2HB TRP 17 -16.285 -5.580 3.401 104 HB3 TRP 17 3HB TRP 17 -14.562 -5.678 3.083 105 HD1 TRP 17 HD1 TRP 17 -17.886 -4.971 1.351 106 HE1 TRP 17 HE1 TRP 17 -17.425 -3.908 -0.941 107 HE3 TRP 17 HE3 TRP 17 -12.810 -5.568 1.203 108 HZ2 TRP 17 HZ2 TRP 17 -15.190 -3.384 -2.599 109 HZ3 TRP 17 HZ3 TRP 17 -11.585 -4.749 -0.778 110 HH2 TRP 17 HH2 TRP 17 -12.756 -3.685 -2.631 111 H ASN 18 H ASN 18 -13.550 -8.770 3.320 112 HA ASN 18 HA ASN 18 -14.540 -9.270 6.055 113 HB2 ASN 18 2HB ASN 18 -12.768 -10.995 4.305 114 HB3 ASN 18 3HB ASN 18 -13.123 -11.327 5.997 115 HD21 ASN 18 1HD2 ASN 18 -13.694 -12.785 3.471 116 HD22 ASN 18 2HD2 ASN 18 -15.393 -13.103 3.508 117 H GLU 19 H GLU 19 -13.453 -8.136 7.524 118 HA GLU 19 HA GLU 19 -10.894 -6.975 6.999 119 HB2 GLU 19 2HB GLU 19 -10.977 -6.219 9.324 120 HB3 GLU 19 3HB GLU 19 -12.500 -5.895 8.516 121 HG2 GLU 19 2HG GLU 19 -13.523 -7.800 9.606 122 HG3 GLU 19 3HG GLU 19 -11.979 -8.232 10.337 123 H GLY 20 H GLY 20 -8.846 -7.752 7.498 124 HA2 GLY 20 2HA GLY 20 -8.753 -10.072 9.269 125 HA3 GLY 20 3HA GLY 20 -8.074 -10.190 7.658 126 H GLY 21 H GLY 21 -7.846 -7.194 9.482 127 HA2 GLY 21 2HA GLY 21 -5.688 -7.327 10.985 128 HA3 GLY 21 3HA GLY 21 -4.946 -7.551 9.413 129 H GLN 22 H GLN 22 -3.849 -5.584 10.441 130 HA GLN 22 HA GLN 22 -5.172 -3.169 9.434 131 HB2 GLN 22 2HB GLN 22 -4.200 -1.913 11.345 132 HB3 GLN 22 3HB GLN 22 -5.383 -3.112 11.852 133 HG2 GLN 22 2HG GLN 22 -3.559 -4.641 12.456 134 HG3 GLN 22 3HG GLN 22 -2.389 -3.417 11.980 135 HE21 GLN 22 1HE2 GLN 22 -4.024 -1.243 13.064 136 HE22 GLN 22 2HE2 GLN 22 -3.828 -1.320 14.777 137 H TRP 23 H TRP 23 -3.877 -1.830 8.254 138 HA TRP 23 HA TRP 23 -1.049 -2.630 7.963 139 HB2 TRP 23 2HB TRP 23 -2.925 -1.333 5.979 140 HB3 TRP 23 3HB TRP 23 -1.194 -1.452 5.737 141 HD1 TRP 23 HD1 TRP 23 -2.804 -4.502 7.256 142 HE1 TRP 23 HE1 TRP 23 -2.929 -6.359 5.490 143 HE3 TRP 23 HE3 TRP 23 -1.464 -1.796 3.129 144 HZ2 TRP 23 HZ2 TRP 23 -2.513 -6.643 2.723 145 HZ3 TRP 23 HZ3 TRP 23 -1.353 -2.956 0.945 146 HH2 TRP 23 HH2 TRP 23 -1.864 -5.314 0.762 147 H GLU 24 H GLU 24 0.494 -0.936 7.673 148 HA GLU 24 HA GLU 24 -0.537 1.658 8.600 149 HB2 GLU 24 2HB GLU 24 0.925 0.557 10.308 150 HB3 GLU 24 3HB GLU 24 2.245 0.604 9.144 151 HG2 GLU 24 2HG GLU 24 2.222 3.002 9.121 152 HG3 GLU 24 3HG GLU 24 0.778 3.042 10.124 153 H ILE 25 H ILE 25 -0.503 3.089 7.110 154 HA ILE 25 HA ILE 25 1.537 2.961 4.996 155 HB ILE 25 HB ILE 25 -1.423 3.506 4.663 156 HG12 ILE 25 2HG1 ILE 25 0.274 1.319 3.448 157 HG13 ILE 25 3HG1 ILE 25 -0.728 1.110 4.883 158 HG21 ILE 25 1HG2 ILE 25 -0.112 4.991 3.230 159 HG22 ILE 25 2HG2 ILE 25 -0.979 3.783 2.282 160 HG23 ILE 25 3HG2 ILE 25 0.750 3.598 2.575 161 HD11 ILE 25 3HD1 ILE 25 -1.723 1.856 2.140 162 HD12 ILE 25 1HD1 ILE 25 -2.714 1.609 3.578 163 HD13 ILE 25 2HD1 ILE 25 -1.821 0.259 2.881 164 H GLY 26 H GLY 26 2.483 4.862 4.521 165 HA2 GLY 26 2HA GLY 26 2.193 7.242 4.083 166 HA3 GLY 26 3HA GLY 26 1.204 7.316 5.535 167 H SER 27 H SER 27 3.229 9.048 5.188 168 HA SER 27 HA SER 27 5.097 8.239 7.282 169 HB2 SER 27 2HB SER 27 5.850 9.676 4.718 170 HB3 SER 27 3HB SER 27 6.933 9.403 6.082 171 HG SER 27 HG SER 27 7.222 7.436 5.452 172 H ARG 28 H ARG 28 4.141 10.967 5.218 173 HA ARG 28 HA ARG 28 4.358 12.864 7.363 174 HB2 ARG 28 2HB ARG 28 3.145 13.112 4.599 175 HB3 ARG 28 3HB ARG 28 3.443 14.450 5.697 176 HG2 ARG 28 2HG ARG 28 5.841 14.019 5.583 177 HG3 ARG 28 3HG ARG 28 5.547 12.656 4.502 178 HD2 ARG 28 2HD ARG 28 4.522 14.197 2.878 179 HD3 ARG 28 3HD ARG 28 4.886 15.548 3.952 180 HE ARG 28 HE ARG 28 6.777 14.012 2.348 181 HH11 ARG 28 1HH1 ARG 28 6.290 16.521 4.758 182 HH12 ARG 28 2HH1 ARG 28 7.845 17.232 4.519 183 HH21 ARG 28 1HH2 ARG 28 8.859 14.976 2.036 184 HH22 ARG 28 2HH2 ARG 28 9.296 16.359 2.975 185 H SER 29 H SER 29 2.701 13.651 8.612 186 HA SER 29 HA SER 29 0.205 12.162 8.527 187 HB2 SER 29 2HB SER 29 1.170 14.232 10.517 188 HB3 SER 29 3HB SER 29 -0.228 13.169 10.707 189 HG SER 29 HG SER 29 1.624 11.502 10.215 190 H ASP 30 H ASP 30 1.442 15.191 7.570 191 HA ASP 30 HA ASP 30 -1.200 16.423 7.474 192 HB2 ASP 30 2HB ASP 30 1.526 17.581 6.880 193 HB3 ASP 30 3HB ASP 30 0.015 18.478 6.805 194 H GLN 31 H GLN 31 0.453 14.362 5.519 195 HA GLN 31 HA GLN 31 -0.954 15.335 3.178 196 HB2 GLN 31 2HB GLN 31 1.891 15.415 3.534 197 HB3 GLN 31 3HB GLN 31 1.507 14.211 2.317 198 HG2 GLN 31 2HG GLN 31 0.523 17.050 2.248 199 HG3 GLN 31 3HG GLN 31 1.969 16.478 1.417 200 HE21 GLN 31 1HE2 GLN 31 -1.491 16.516 1.436 201 HE22 GLN 31 2HE2 GLN 31 -1.701 15.784 -0.113 202 H ASN 32 H ASN 32 -2.274 13.681 2.702 203 HA ASN 32 HA ASN 32 -1.491 10.997 3.547 204 HB2 ASN 32 2HB ASN 32 -3.782 12.150 4.049 205 HB3 ASN 32 3HB ASN 32 -4.183 11.662 2.404 206 HD21 ASN 32 1HD2 ASN 32 -4.291 9.424 1.913 207 HD22 ASN 32 2HD2 ASN 32 -4.518 8.256 3.163 208 H VAL 33 H VAL 33 -2.015 9.168 2.136 209 HA VAL 33 HA VAL 33 -1.146 9.690 -0.614 210 HB VAL 33 HB VAL 33 -1.272 7.086 0.925 211 HG11 VAL 33 1HG1 VAL 33 0.117 6.182 -0.870 212 HG12 VAL 33 2HG1 VAL 33 0.010 7.720 -1.726 213 HG13 VAL 33 3HG1 VAL 33 -1.439 6.747 -1.477 214 HG21 VAL 33 3HG2 VAL 33 0.363 8.564 1.912 215 HG22 VAL 33 1HG2 VAL 33 1.077 8.881 0.330 216 HG23 VAL 33 2HG2 VAL 33 1.182 7.269 1.040 217 H VAL 34 H VAL 34 -2.452 9.218 -2.357 218 HA VAL 34 HA VAL 34 -5.097 8.085 -1.709 219 HB VAL 34 HB VAL 34 -5.988 9.283 -3.701 220 HG11 VAL 34 1HG1 VAL 34 -4.743 10.940 -1.521 221 HG12 VAL 34 2HG1 VAL 34 -6.341 10.197 -1.511 222 HG13 VAL 34 3HG1 VAL 34 -5.987 11.518 -2.626 223 HG21 VAL 34 3HG2 VAL 34 -3.284 10.627 -3.672 224 HG22 VAL 34 1HG2 VAL 34 -4.671 11.155 -4.624 225 HG23 VAL 34 2HG2 VAL 34 -3.926 9.592 -4.949 226 H ALA 35 H ALA 35 -2.259 7.566 -3.569 227 HA ALA 35 HA ALA 35 -3.543 5.190 -4.658 228 HB1 ALA 35 3HB ALA 35 -3.791 6.921 -6.425 229 HB2 ALA 35 1HB ALA 35 -2.832 5.526 -6.925 230 HB3 ALA 35 2HB ALA 35 -2.033 7.034 -6.498 231 H ILE 36 H ILE 36 -2.181 3.494 -5.099 232 HA ILE 36 HA ILE 36 0.667 3.838 -4.622 233 HB ILE 36 HB ILE 36 -1.019 1.882 -3.019 234 HG12 ILE 36 2HG1 ILE 36 0.755 4.125 -2.033 235 HG13 ILE 36 3HG1 ILE 36 -0.998 4.233 -2.169 236 HG21 ILE 36 1HG2 ILE 36 1.090 1.147 -2.007 237 HG22 ILE 36 2HG2 ILE 36 1.981 2.226 -3.080 238 HG23 ILE 36 3HG2 ILE 36 1.076 0.866 -3.749 239 HD11 ILE 36 3HD1 ILE 36 -0.346 3.777 0.110 240 HD12 ILE 36 1HD1 ILE 36 0.540 2.343 -0.406 241 HD13 ILE 36 2HD1 ILE 36 -1.214 2.399 -0.562 242 H ASN 37 H ASN 37 1.701 2.730 -6.182 243 HA ASN 37 HA ASN 37 0.461 0.249 -7.151 244 HB2 ASN 37 2HB ASN 37 0.390 2.509 -8.629 245 HB3 ASN 37 3HB ASN 37 1.995 1.940 -9.066 246 HD21 ASN 37 1HD2 ASN 37 -0.799 -0.035 -8.291 247 HD22 ASN 37 2HD2 ASN 37 -0.987 -0.722 -9.860 248 H VAL 38 H VAL 38 1.900 -1.383 -6.722 249 HA VAL 38 HA VAL 38 4.743 -0.866 -7.018 250 HB VAL 38 HB VAL 38 5.324 -1.749 -4.747 251 HG11 VAL 38 1HG1 VAL 38 5.500 0.614 -5.142 252 HG12 VAL 38 2HG1 VAL 38 4.852 0.346 -3.523 253 HG13 VAL 38 3HG1 VAL 38 3.778 0.833 -4.833 254 HG21 VAL 38 3HG2 VAL 38 3.203 -2.830 -4.220 255 HG22 VAL 38 1HG2 VAL 38 2.414 -1.256 -4.174 256 HG23 VAL 38 2HG2 VAL 38 3.644 -1.660 -2.976 257 H GLU 39 H GLU 39 6.012 -2.682 -7.286 258 HA GLU 39 HA GLU 39 4.696 -5.303 -7.118 259 HB2 GLU 39 2HB GLU 39 4.796 -4.586 -9.470 260 HB3 GLU 39 3HB GLU 39 6.518 -4.281 -9.312 261 HG2 GLU 39 2HG GLU 39 6.892 -6.670 -8.896 262 HG3 GLU 39 3HG GLU 39 5.165 -6.962 -9.088 263 H SER 40 H SER 40 6.008 -6.949 -6.338 264 HA SER 40 HA SER 40 8.280 -6.221 -4.833 265 HB2 SER 40 2HB SER 40 8.466 -8.719 -4.481 266 HB3 SER 40 3HB SER 40 6.919 -7.997 -4.035 267 HG SER 40 HG SER 40 7.237 -8.977 -6.641 268 H GLY 41 H GLY 41 10.429 -6.722 -5.058 269 HA2 GLY 41 2HA GLY 41 11.331 -7.280 -7.797 270 HA3 GLY 41 3HA GLY 41 12.317 -6.604 -6.500 271 H ASP 42 H ASP 42 11.977 -8.268 -4.481 272 HA ASP 42 HA ASP 42 13.103 -10.807 -5.408 273 HB2 ASP 42 2HB ASP 42 12.995 -9.521 -2.661 274 HB3 ASP 42 3HB ASP 42 13.633 -11.134 -2.955 275 H ASP 43 H ASP 43 12.406 -12.471 -3.320 276 HA ASP 43 HA ASP 43 9.711 -13.125 -4.030 277 HB2 ASP 43 2HB ASP 43 11.604 -14.373 -2.036 278 HB3 ASP 43 3HB ASP 43 10.002 -15.011 -2.394 279 H GLY 44 H GLY 44 9.228 -10.798 -3.104 280 HA2 GLY 44 2HA GLY 44 7.559 -9.875 -1.749 281 HA3 GLY 44 3HA GLY 44 7.597 -11.325 -0.760 282 H GLN 45 H GLN 45 10.685 -10.074 -1.289 283 HA GLN 45 HA GLN 45 10.684 -9.014 1.427 284 HB2 GLN 45 2HB GLN 45 12.362 -10.732 0.890 285 HB3 GLN 45 3HB GLN 45 13.030 -9.684 -0.354 286 HG2 GLN 45 2HG GLN 45 13.695 -8.064 1.317 287 HG3 GLN 45 3HG GLN 45 12.934 -9.022 2.584 288 HE21 GLN 45 1HE2 GLN 45 14.804 -9.275 3.737 289 HE22 GLN 45 2HE2 GLN 45 16.108 -10.283 3.207 290 H THR 46 H THR 46 11.192 -7.994 -1.859 291 HA THR 46 HA THR 46 11.582 -5.263 -0.847 292 HB THR 46 HB THR 46 12.815 -4.821 -3.006 293 HG1 THR 46 HG1 THR 46 13.717 -7.227 -3.525 294 HG21 THR 46 3HG2 THR 46 14.030 -5.108 -0.908 295 HG22 THR 46 1HG2 THR 46 14.921 -5.845 -2.239 296 HG23 THR 46 2HG2 THR 46 14.011 -6.860 -1.122 297 H LEU 47 H LEU 47 10.565 -3.598 -1.961 298 HA LEU 47 HA LEU 47 8.601 -4.374 -3.990 299 HB2 LEU 47 2HB LEU 47 8.035 -2.625 -1.592 300 HB3 LEU 47 3HB LEU 47 6.942 -2.879 -2.931 301 HG LEU 47 HG LEU 47 7.837 -5.036 -1.008 302 HD11 LEU 47 1HD1 LEU 47 6.437 -3.380 0.094 303 HD12 LEU 47 2HD1 LEU 47 5.558 -4.892 -0.134 304 HD13 LEU 47 3HD1 LEU 47 5.244 -3.516 -1.196 305 HD21 LEU 47 3HD2 LEU 47 7.284 -5.936 -3.180 306 HD22 LEU 47 1HD2 LEU 47 5.780 -5.017 -3.213 307 HD23 LEU 47 2HD2 LEU 47 5.995 -6.315 -2.039 308 H ASN 48 H ASN 48 8.643 -3.069 -5.649 309 HA ASN 48 HA ASN 48 9.722 -0.340 -5.303 310 HB2 ASN 48 2HB ASN 48 10.219 -2.145 -7.689 311 HB3 ASN 48 3HB ASN 48 10.746 -0.476 -7.550 312 HD21 ASN 48 1HD2 ASN 48 11.370 -3.734 -6.760 313 HD22 ASN 48 2HD2 ASN 48 12.869 -3.486 -5.931 314 H GLY 49 H GLY 49 8.627 1.282 -6.379 315 HA2 GLY 49 2HA GLY 49 6.880 0.873 -8.517 316 HA3 GLY 49 3HA GLY 49 5.939 0.728 -7.046 317 H THR 50 H THR 50 4.737 2.498 -7.710 318 HA THR 50 HA THR 50 6.085 5.088 -7.387 319 HB THR 50 HB THR 50 3.820 4.460 -9.304 320 HG1 THR 50 HG1 THR 50 5.420 3.819 -10.539 321 HG21 THR 50 3HG2 THR 50 5.465 6.964 -8.909 322 HG22 THR 50 1HG2 THR 50 3.769 6.756 -8.467 323 HG23 THR 50 2HG2 THR 50 4.250 6.716 -10.164 324 H MET 51 H MET 51 5.159 6.370 -5.834 325 HA MET 51 HA MET 51 2.513 5.598 -4.793 326 HB2 MET 51 2HB MET 51 4.473 5.488 -3.236 327 HB3 MET 51 3HB MET 51 4.710 7.214 -3.476 328 HG2 MET 51 2HG MET 51 2.199 7.321 -2.699 329 HG3 MET 51 3HG MET 51 2.601 5.769 -1.964 330 HE1 MET 51 3HE MET 51 5.755 6.913 0.207 331 HE2 MET 51 1HE MET 51 5.812 6.492 -1.507 332 HE3 MET 51 2HE MET 51 4.851 5.521 -0.391 333 H THR 52 H THR 52 0.909 7.198 -4.649 334 HA THR 52 HA THR 52 1.704 9.880 -5.566 335 HB THR 52 HB THR 52 -0.903 8.503 -6.247 336 HG1 THR 52 HG1 THR 52 1.555 8.387 -7.381 337 HG21 THR 52 3HG2 THR 52 -1.205 10.416 -7.777 338 HG22 THR 52 1HG2 THR 52 0.294 11.123 -7.179 339 HG23 THR 52 2HG2 THR 52 -1.089 10.948 -6.099 340 H TYR 53 H TYR 53 1.315 11.402 -4.147 341 HA TYR 53 HA TYR 53 -0.362 10.938 -1.838 342 HB2 TYR 53 2HB TYR 53 1.458 13.193 -2.637 343 HB3 TYR 53 3HB TYR 53 0.436 13.277 -1.213 344 HD1 TYR 53 HD2 TYR 53 0.850 11.624 0.647 345 HD2 TYR 53 HD1 TYR 53 3.532 12.106 -2.619 346 HE1 TYR 53 HE2 TYR 53 2.639 10.572 1.966 347 HE2 TYR 53 HE1 TYR 53 5.326 11.067 -1.303 348 HH TYR 53 HH TYR 53 4.795 9.319 1.471 349 H ALA 54 H ALA 54 -1.845 12.685 -1.121 350 HA ALA 54 HA ALA 54 -3.800 13.173 -3.125 351 HB1 ALA 54 3HB ALA 54 -3.627 14.290 -0.329 352 HB2 ALA 54 1HB ALA 54 -4.374 12.757 -0.775 353 HB3 ALA 54 2HB ALA 54 -5.057 14.276 -1.361 354 H GLY 55 H GLY 55 -3.332 14.576 -4.708 355 HA2 GLY 55 2HA GLY 55 -3.459 16.752 -5.573 356 HA3 GLY 55 3HA GLY 55 -3.153 17.385 -3.966 357 H GLU 56 H GLU 56 -0.968 14.981 -4.739 358 HA GLU 56 HA GLU 56 1.032 16.956 -5.622 359 HB2 GLU 56 2HB GLU 56 1.368 14.639 -3.730 360 HB3 GLU 56 3HB GLU 56 2.695 15.598 -4.358 361 HG2 GLU 56 2HG GLU 56 0.440 16.656 -2.671 362 HG3 GLU 56 3HG GLU 56 2.032 16.215 -2.068 363 H GLY 57 H GLY 57 2.908 15.917 -6.729 364 HA2 GLY 57 2HA GLY 57 1.958 14.098 -8.732 365 HA3 GLY 57 3HA GLY 57 3.578 14.773 -8.615 366 HA PRO 58 HA PRO 58 3.372 10.263 -7.098 367 HB2 PRO 58 2HB PRO 58 4.226 8.945 -9.280 368 HB3 PRO 58 3HB PRO 58 2.519 9.335 -9.036 369 HG2 PRO 58 2HG PRO 58 4.563 10.764 -10.697 370 HG3 PRO 58 3HG PRO 58 2.900 10.313 -11.121 371 HD2 PRO 58 2HD PRO 58 3.569 12.808 -10.302 372 HD3 PRO 58 3HD PRO 58 1.985 12.079 -9.950 373 H ILE 59 H ILE 59 5.150 9.243 -6.282 374 HA ILE 59 HA ILE 59 7.792 10.169 -7.193 375 HB ILE 59 HB ILE 59 8.606 10.173 -4.883 376 HG12 ILE 59 2HG1 ILE 59 5.721 9.792 -4.050 377 HG13 ILE 59 3HG1 ILE 59 6.938 8.516 -4.018 378 HG21 ILE 59 1HG2 ILE 59 7.444 12.205 -4.106 379 HG22 ILE 59 2HG2 ILE 59 6.187 11.923 -5.311 380 HG23 ILE 59 3HG2 ILE 59 7.839 12.268 -5.823 381 HD11 ILE 59 3HD1 ILE 59 7.030 11.080 -2.447 382 HD12 ILE 59 1HD1 ILE 59 8.240 9.799 -2.412 383 HD13 ILE 59 2HD1 ILE 59 6.612 9.484 -1.816 384 H GLY 60 H GLY 60 9.574 8.703 -6.381 385 HA2 GLY 60 2HA GLY 60 8.886 5.996 -7.113 386 HA3 GLY 60 3HA GLY 60 10.488 6.598 -6.708 387 H PHE 61 H PHE 61 8.658 4.257 -5.847 388 HA PHE 61 HA PHE 61 8.915 4.643 -2.935 389 HB2 PHE 61 2HB PHE 61 6.585 4.473 -3.640 390 HB3 PHE 61 3HB PHE 61 6.926 2.972 -4.487 391 HD1 PHE 61 HD1 PHE 61 6.484 4.544 -1.217 392 HD2 PHE 61 HD2 PHE 61 7.130 0.892 -3.288 393 HE1 PHE 61 HE1 PHE 61 5.888 3.293 0.811 394 HE2 PHE 61 HE2 PHE 61 6.538 -0.369 -1.263 395 HZ PHE 61 HZ PHE 61 5.911 0.837 0.794 396 H ARG 62 H ARG 62 10.318 3.341 -1.922 397 HA ARG 62 HA ARG 62 10.916 0.686 -3.054 398 HB2 ARG 62 2HB ARG 62 12.809 2.152 -3.476 399 HB3 ARG 62 3HB ARG 62 12.831 2.669 -1.796 400 HG2 ARG 62 2HG ARG 62 13.310 0.271 -1.190 401 HG3 ARG 62 3HG ARG 62 13.541 -0.031 -2.914 402 HD2 ARG 62 2HD ARG 62 15.071 1.973 -1.251 403 HD3 ARG 62 3HD ARG 62 15.670 0.394 -1.758 404 HE ARG 62 HE ARG 62 15.343 2.772 -3.397 405 HH11 ARG 62 1HH1 ARG 62 16.104 -0.649 -3.244 406 HH12 ARG 62 2HH1 ARG 62 16.858 -0.696 -4.793 407 HH21 ARG 62 1HH2 ARG 62 16.368 2.713 -5.482 408 HH22 ARG 62 2HH2 ARG 62 17.000 1.214 -6.070 409 H ALA 63 H ALA 63 10.537 -0.916 -1.604 410 HA ALA 63 HA ALA 63 10.719 -0.235 1.255 411 HB1 ALA 63 3HB ALA 63 8.575 -2.016 0.116 412 HB2 ALA 63 1HB ALA 63 8.348 -0.309 0.494 413 HB3 ALA 63 2HB ALA 63 8.738 -1.452 1.776 414 H THR 64 H THR 64 11.638 -1.705 2.566 415 HA THR 64 HA THR 64 12.438 -4.287 1.387 416 HB THR 64 HB THR 64 13.987 -2.644 3.418 417 HG1 THR 64 HG1 THR 64 15.122 -3.125 0.951 418 HG21 THR 64 3HG2 THR 64 14.363 -5.062 3.635 419 HG22 THR 64 1HG2 THR 64 15.796 -4.261 2.985 420 HG23 THR 64 2HG2 THR 64 14.723 -5.165 1.912 421 H LEU 65 H LEU 65 11.758 -6.024 2.474 422 HA LEU 65 HA LEU 65 10.111 -5.748 4.785 423 HB2 LEU 65 2HB LEU 65 9.673 -7.354 2.951 424 HB3 LEU 65 3HB LEU 65 11.132 -8.217 3.362 425 HG LEU 65 HG LEU 65 8.877 -9.215 4.067 426 HD11 LEU 65 1HD1 LEU 65 9.786 -10.147 6.112 427 HD12 LEU 65 2HD1 LEU 65 11.027 -8.894 6.145 428 HD13 LEU 65 3HD1 LEU 65 11.006 -10.080 4.843 429 HD21 LEU 65 3HD2 LEU 65 7.998 -8.461 6.222 430 HD22 LEU 65 1HD2 LEU 65 7.886 -7.198 4.996 431 HD23 LEU 65 2HD2 LEU 65 9.148 -7.125 6.226 432 H LEU 66 H LEU 66 10.788 -5.639 6.782 433 HA LEU 66 HA LEU 66 13.449 -6.615 7.526 434 HB2 LEU 66 2HB LEU 66 11.407 -5.052 9.110 435 HB3 LEU 66 3HB LEU 66 13.026 -5.438 9.645 436 HG LEU 66 HG LEU 66 12.343 -3.660 7.308 437 HD11 LEU 66 1HD1 LEU 66 13.217 -1.872 8.763 438 HD12 LEU 66 2HD1 LEU 66 13.306 -3.038 10.085 439 HD13 LEU 66 3HD1 LEU 66 11.744 -2.614 9.388 440 HD21 LEU 66 3HD2 LEU 66 14.738 -3.096 7.350 441 HD22 LEU 66 1HD2 LEU 66 14.465 -4.798 6.976 442 HD23 LEU 66 2HD2 LEU 66 14.993 -4.326 8.588 443 H GLY 67 H GLY 67 10.100 -7.347 7.875 444 HA2 GLY 67 2HA GLY 67 9.888 -9.828 8.377 445 HA3 GLY 67 3HA GLY 67 10.707 -9.409 9.876 446 H ASN 68 H ASN 68 8.145 -10.611 9.698 447 HA ASN 68 HA ASN 68 6.033 -10.454 10.558 448 HB2 ASN 68 2HB ASN 68 7.377 -8.212 12.082 449 HB3 ASN 68 3HB ASN 68 5.728 -8.728 12.409 450 HD21 ASN 68 1HD2 ASN 68 8.166 -8.791 14.059 451 HD22 ASN 68 2HD2 ASN 68 8.341 -10.434 14.564 452 H ASN 69 H ASN 69 6.491 -9.136 8.083 453 HA ASN 69 HA ASN 69 5.387 -7.891 6.549 454 HB2 ASN 69 2HB ASN 69 3.382 -7.392 8.763 455 HB3 ASN 69 3HB ASN 69 3.158 -6.908 7.087 456 HD21 ASN 69 1HD2 ASN 69 2.901 -8.541 5.509 457 HD22 ASN 69 2HD2 ASN 69 2.355 -10.123 5.948 458 H SER 70 H SER 70 7.162 -6.652 8.872 459 HA SER 70 HA SER 70 6.461 -3.857 8.537 460 HB2 SER 70 2HB SER 70 8.813 -5.144 9.957 461 HB3 SER 70 3HB SER 70 8.415 -3.430 9.995 462 HG SER 70 HG SER 70 7.492 -4.187 11.779 463 H TYR 71 H TYR 71 7.181 -2.663 6.925 464 HA TYR 71 HA TYR 71 9.568 -3.563 5.451 465 HB2 TYR 71 2HB TYR 71 7.114 -2.097 4.486 466 HB3 TYR 71 3HB TYR 71 8.582 -2.258 3.538 467 HD1 TYR 71 HD1 TYR 71 5.839 -4.184 5.124 468 HD2 TYR 71 HD2 TYR 71 8.990 -4.200 2.270 469 HE1 TYR 71 HE1 TYR 71 5.008 -6.317 4.222 470 HE2 TYR 71 HE2 TYR 71 8.168 -6.333 1.367 471 HH TYR 71 HH TYR 71 6.817 -8.159 1.902 472 H GLU 72 H GLU 72 11.248 -2.226 5.402 473 HA GLU 72 HA GLU 72 10.998 0.444 6.493 474 HB2 GLU 72 2HB GLU 72 12.977 -1.034 6.987 475 HB3 GLU 72 3HB GLU 72 13.425 -0.928 5.294 476 HG2 GLU 72 2HG GLU 72 14.764 0.611 6.509 477 HG3 GLU 72 3HG GLU 72 13.600 1.543 5.566 478 H VAL 73 H VAL 73 10.491 2.102 5.228 479 HA VAL 73 HA VAL 73 10.625 1.688 2.340 480 HB VAL 73 HB VAL 73 8.812 3.408 4.029 481 HG11 VAL 73 1HG1 VAL 73 7.689 4.075 1.963 482 HG12 VAL 73 2HG1 VAL 73 8.909 3.220 1.023 483 HG13 VAL 73 3HG1 VAL 73 9.366 4.625 1.987 484 HG21 VAL 73 3HG2 VAL 73 8.271 1.026 3.975 485 HG22 VAL 73 1HG2 VAL 73 8.245 1.068 2.213 486 HG23 VAL 73 2HG2 VAL 73 7.048 1.979 3.134 487 H GLU 74 H GLU 74 11.689 2.935 1.064 488 HA GLU 74 HA GLU 74 12.761 5.511 1.973 489 HB2 GLU 74 2HB GLU 74 14.083 3.423 0.218 490 HB3 GLU 74 3HB GLU 74 14.687 5.061 0.415 491 HG2 GLU 74 2HG GLU 74 15.051 4.660 2.780 492 HG3 GLU 74 3HG GLU 74 14.388 3.039 2.626 493 H ASN 75 H ASN 75 12.650 7.166 0.350 494 HA ASN 75 HA ASN 75 11.124 6.414 -2.049 495 HB2 ASN 75 2HB ASN 75 10.357 8.564 -0.064 496 HB3 ASN 75 3HB ASN 75 9.690 8.461 -1.686 497 HD21 ASN 75 1HD2 ASN 75 8.458 8.254 0.985 498 HD22 ASN 75 2HD2 ASN 75 7.607 6.752 0.981 499 H GLN 76 H GLN 76 11.078 8.105 -3.665 500 HA GLN 76 HA GLN 76 13.236 10.079 -3.398 501 HB2 GLN 76 2HB GLN 76 13.911 9.729 -5.768 502 HB3 GLN 76 3HB GLN 76 14.239 8.341 -4.745 503 HG2 GLN 76 2HG GLN 76 12.544 7.077 -5.706 504 HG3 GLN 76 3HG GLN 76 11.743 8.490 -6.385 505 HE21 GLN 76 1HE2 GLN 76 15.188 8.151 -6.599 506 HE22 GLN 76 2HE2 GLN 76 15.254 7.823 -8.292 507 H TRP 77 H TRP 77 12.700 12.064 -4.001 508 HA TRP 77 HA TRP 77 10.317 12.432 -5.660 509 HB2 TRP 77 2HB TRP 77 9.741 14.380 -4.096 510 HB3 TRP 77 3HB TRP 77 9.423 12.755 -3.502 511 HD1 TRP 77 HD1 TRP 77 12.122 15.528 -3.124 512 HE1 TRP 77 HE1 TRP 77 13.121 15.350 -0.756 513 HE3 TRP 77 HE3 TRP 77 9.641 11.353 -1.508 514 HZ2 TRP 77 HZ2 TRP 77 12.878 13.669 1.500 515 HZ3 TRP 77 HZ3 TRP 77 10.077 10.533 0.768 516 HH2 TRP 77 HH2 TRP 77 11.659 11.662 2.240 517 H GLY 78 H GLY 78 10.238 14.402 -6.810 518 HA2 GLY 78 2HA GLY 78 11.136 16.492 -7.493 519 HA3 GLY 78 3HA GLY 78 12.663 16.048 -6.736 520 H GLY 79 H GLY 79 11.732 13.346 -8.265 521 HA2 GLY 79 2HA GLY 79 11.769 13.296 -10.852 522 HA3 GLY 79 3HA GLY 79 13.367 13.987 -10.611 523 H ASP 80 H ASP 80 13.016 11.628 -11.959 524 HA ASP 80 HA ASP 80 13.303 9.286 -10.410 525 HB2 ASP 80 2HB ASP 80 14.436 9.788 -13.169 526 HB3 ASP 80 3HB ASP 80 14.004 8.235 -12.464 527 H SER 81 H SER 81 15.544 11.690 -11.555 528 HA SER 81 HA SER 81 17.917 10.213 -10.949 529 HB2 SER 81 2HB SER 81 19.019 12.408 -11.502 530 HB3 SER 81 3HB SER 81 17.987 11.750 -12.771 531 HG SER 81 HG SER 81 17.271 13.776 -12.656 532 H ALA 82 H ALA 82 15.786 11.374 -8.860 533 HA ALA 82 HA ALA 82 17.561 12.830 -7.108 534 HB1 ALA 82 3HB ALA 82 15.632 12.949 -5.607 535 HB2 ALA 82 1HB ALA 82 14.733 11.865 -6.670 536 HB3 ALA 82 2HB ALA 82 15.206 13.466 -7.239 537 HA PRO 83 HA PRO 83 19.046 9.314 -4.878 538 HB2 PRO 83 2HB PRO 83 19.495 10.455 -2.440 539 HB3 PRO 83 3HB PRO 83 20.554 10.709 -3.831 540 HG2 PRO 83 2HG PRO 83 18.386 12.464 -2.754 541 HG3 PRO 83 3HG PRO 83 19.996 12.910 -3.351 542 HD2 PRO 83 2HD PRO 83 17.768 13.203 -4.852 543 HD3 PRO 83 3HD PRO 83 19.344 12.802 -5.561 544 H TRP 84 H TRP 84 18.640 8.195 -2.634 545 HA TRP 84 HA TRP 84 15.733 8.116 -2.378 546 HB2 TRP 84 2HB TRP 84 17.851 6.048 -1.779 547 HB3 TRP 84 3HB TRP 84 16.167 5.865 -1.294 548 HD1 TRP 84 HD1 TRP 84 18.440 5.700 -4.343 549 HE1 TRP 84 HE1 TRP 84 17.117 4.750 -6.334 550 HE3 TRP 84 HE3 TRP 84 13.762 5.702 -2.278 551 HZ2 TRP 84 HZ2 TRP 84 14.438 4.076 -6.943 552 HZ3 TRP 84 HZ3 TRP 84 11.876 4.889 -3.629 553 HH2 TRP 84 HH2 TRP 84 12.208 4.096 -5.914 554 H HIS 85 H HIS 85 14.792 8.695 -0.626 555 HA HIS 85 HA HIS 85 16.466 9.354 1.717 556 HB2 HIS 85 2HB HIS 85 13.958 10.743 0.753 557 HB3 HIS 85 3HB HIS 85 14.820 11.133 2.236 558 HD1 HIS 85 HD1 HIS 85 17.277 12.156 1.906 559 HD2 HIS 85 HD2 HIS 85 14.927 11.933 -1.519 560 HE1 HIS 85 HE1 HIS 85 18.382 13.659 0.229 561 H SER 86 H SER 86 15.618 8.977 3.757 562 HA SER 86 HA SER 86 14.156 6.616 4.058 563 HB2 SER 86 2HB SER 86 14.496 8.766 6.151 564 HB3 SER 86 3HB SER 86 14.266 7.036 6.415 565 HG SER 86 HG SER 86 16.362 6.947 6.397 566 H GLY 87 H GLY 87 12.044 6.191 4.150 567 HA2 GLY 87 2HA GLY 87 10.184 8.466 4.124 568 HA3 GLY 87 3HA GLY 87 9.849 6.868 3.475 569 H GLY 88 H GLY 88 10.436 5.160 5.420 570 HA2 GLY 88 2HA GLY 88 9.996 5.573 8.040 571 HA3 GLY 88 3HA GLY 88 8.372 5.751 7.385 572 H ASN 89 H ASN 89 8.188 3.852 8.964 573 HA ASN 89 HA ASN 89 8.872 1.370 7.550 574 HB2 ASN 89 2HB ASN 89 9.819 1.649 9.857 575 HB3 ASN 89 3HB ASN 89 8.171 1.699 10.474 576 HD21 ASN 89 1HD2 ASN 89 10.645 -0.281 9.040 577 HD22 ASN 89 2HD2 ASN 89 9.909 -1.804 9.411 578 H TRP 90 H TRP 90 7.221 0.595 6.438 579 HA TRP 90 HA TRP 90 4.480 1.202 7.303 580 HB2 TRP 90 2HB TRP 90 5.604 0.342 4.632 581 HB3 TRP 90 3HB TRP 90 3.883 0.456 4.964 582 HD1 TRP 90 HD1 TRP 90 6.016 3.259 6.405 583 HE1 TRP 90 HE1 TRP 90 5.608 5.409 5.051 584 HE3 TRP 90 HE3 TRP 90 3.312 1.285 2.534 585 HZ2 TRP 90 HZ2 TRP 90 4.312 6.167 2.659 586 HZ3 TRP 90 HZ3 TRP 90 2.527 2.799 0.762 587 HH2 TRP 90 HH2 TRP 90 3.014 5.180 0.826 588 H ILE 91 H ILE 91 2.918 -0.432 7.395 589 HA ILE 91 HA ILE 91 4.011 -3.173 7.642 590 HB ILE 91 HB ILE 91 1.410 -2.078 8.760 591 HG12 ILE 91 2HG1 ILE 91 3.329 -1.073 9.912 592 HG13 ILE 91 3HG1 ILE 91 2.486 -2.195 10.972 593 HG21 ILE 91 1HG2 ILE 91 2.774 -4.722 9.231 594 HG22 ILE 91 2HG2 ILE 91 1.307 -4.459 8.291 595 HG23 ILE 91 3HG2 ILE 91 1.305 -4.167 10.032 596 HD11 ILE 91 3HD1 ILE 91 5.069 -2.690 9.516 597 HD12 ILE 91 1HD1 ILE 91 4.219 -3.882 10.497 598 HD13 ILE 91 2HD1 ILE 91 4.865 -2.421 11.244 599 H LEU 92 H LEU 92 3.620 -4.402 5.866 600 HA LEU 92 HA LEU 92 1.117 -3.897 4.397 601 HB2 LEU 92 2HB LEU 92 3.804 -4.570 3.214 602 HB3 LEU 92 3HB LEU 92 2.313 -4.392 2.310 603 HG LEU 92 HG LEU 92 3.681 -2.184 3.859 604 HD11 LEU 92 1HD1 LEU 92 4.968 -2.833 1.912 605 HD12 LEU 92 2HD1 LEU 92 4.215 -1.259 1.664 606 HD13 LEU 92 3HD1 LEU 92 3.535 -2.693 0.895 607 HD21 LEU 92 3HD2 LEU 92 1.247 -1.906 3.748 608 HD22 LEU 92 1HD2 LEU 92 1.305 -2.100 1.997 609 HD23 LEU 92 2HD2 LEU 92 2.076 -0.710 2.753 610 H GLY 93 H GLY 93 0.024 -5.579 5.367 611 HA2 GLY 93 2HA GLY 93 -0.318 -7.907 4.135 612 HA3 GLY 93 3HA GLY 93 1.031 -8.286 5.199 613 H SER 94 H SER 94 -2.276 -8.386 4.939 614 HA SER 94 HA SER 94 -2.833 -7.866 7.740 615 HB2 SER 94 2HB SER 94 -5.172 -8.480 7.143 616 HB3 SER 94 3HB SER 94 -4.532 -7.200 6.111 617 HG SER 94 HG SER 94 -5.663 -8.892 4.961 618 H ARG 95 H ARG 95 -1.732 -10.399 5.841 619 HA ARG 95 HA ARG 95 -2.874 -12.436 7.544 620 HB2 ARG 95 2HB ARG 95 -1.193 -12.591 5.055 621 HB3 ARG 95 3HB ARG 95 -1.569 -14.007 6.031 622 HG2 ARG 95 2HG ARG 95 -3.946 -13.659 5.645 623 HG3 ARG 95 3HG ARG 95 -3.593 -12.210 4.700 624 HD2 ARG 95 2HD ARG 95 -2.386 -13.551 3.068 625 HD3 ARG 95 3HD ARG 95 -2.659 -15.001 4.029 626 HE ARG 95 HE ARG 95 -4.815 -13.456 2.734 627 HH11 ARG 95 1HH1 ARG 95 -3.443 -16.541 3.750 628 HH12 ARG 95 2HH1 ARG 95 -4.755 -17.466 3.117 629 HH21 ARG 95 1HH2 ARG 95 -6.566 -14.708 1.937 630 HH22 ARG 95 2HH2 ARG 95 -6.534 -16.432 2.101 631 H GLU 96 H GLU 96 -1.696 -13.745 8.819 632 HA GLU 96 HA GLU 96 0.409 -12.388 10.187 633 HB2 GLU 96 2HB GLU 96 0.439 -14.459 11.627 634 HB3 GLU 96 3HB GLU 96 -1.090 -13.599 11.541 635 HG2 GLU 96 2HG GLU 96 -1.866 -15.234 9.863 636 HG3 GLU 96 3HG GLU 96 -0.366 -16.130 10.087 637 H ASN 97 H ASN 97 0.316 -15.013 7.889 638 HA ASN 97 HA ASN 97 3.253 -15.177 8.048 639 HB2 ASN 97 2HB ASN 97 3.109 -17.528 7.395 640 HB3 ASN 97 3HB ASN 97 2.173 -17.239 8.858 641 HD21 ASN 97 1HD2 ASN 97 1.942 -19.399 6.980 642 HD22 ASN 97 2HD2 ASN 97 0.333 -19.350 6.347 643 H GLN 98 H GLN 98 1.721 -13.377 6.362 644 HA GLN 98 HA GLN 98 2.697 -14.268 3.774 645 HB2 GLN 98 2HB GLN 98 -0.138 -14.189 4.418 646 HB3 GLN 98 3HB GLN 98 0.257 -13.205 3.015 647 HG2 GLN 98 2HG GLN 98 1.195 -16.039 3.263 648 HG3 GLN 98 3HG GLN 98 -0.409 -15.644 2.648 649 HE21 GLN 98 1HE2 GLN 98 2.321 -13.561 2.035 650 HE22 GLN 98 2HE2 GLN 98 2.482 -13.952 0.368 651 H ASN 99 H ASN 99 3.904 -12.709 3.006 652 HA ASN 99 HA ASN 99 3.431 -9.955 3.739 653 HB2 ASN 99 2HB ASN 99 5.609 -11.295 2.118 654 HB3 ASN 99 3HB ASN 99 5.540 -9.566 2.427 655 HD21 ASN 99 1HD2 ASN 99 7.585 -11.464 3.152 656 HD22 ASN 99 2HD2 ASN 99 7.722 -11.423 4.874 657 H VAL 100 H VAL 100 3.401 -8.294 2.189 658 HA VAL 100 HA VAL 100 1.679 -8.945 -0.099 659 HB VAL 100 HB VAL 100 2.587 -6.244 0.919 660 HG11 VAL 100 1HG1 VAL 100 2.222 -6.158 -1.499 661 HG12 VAL 100 2HG1 VAL 100 0.946 -5.300 -0.634 662 HG13 VAL 100 3HG1 VAL 100 0.638 -6.907 -1.291 663 HG21 VAL 100 3HG2 VAL 100 0.243 -6.031 1.594 664 HG22 VAL 100 1HG2 VAL 100 1.031 -7.399 2.378 665 HG23 VAL 100 2HG2 VAL 100 -0.064 -7.672 1.022 666 H VAL 101 H VAL 101 2.186 -8.908 -2.167 667 HA VAL 101 HA VAL 101 4.994 -8.281 -2.863 668 HB VAL 101 HB VAL 101 4.891 -9.826 -4.765 669 HG11 VAL 101 1HG1 VAL 101 4.169 -11.092 -2.136 670 HG12 VAL 101 2HG1 VAL 101 5.780 -10.587 -2.649 671 HG13 VAL 101 3HG1 VAL 101 4.955 -11.900 -3.492 672 HG21 VAL 101 3HG2 VAL 101 3.047 -11.439 -4.960 673 HG22 VAL 101 1HG2 VAL 101 2.504 -9.783 -5.225 674 HG23 VAL 101 2HG2 VAL 101 2.175 -10.579 -3.689 675 H ALA 102 H ALA 102 1.674 -7.725 -3.802 676 HA ALA 102 HA ALA 102 2.663 -5.556 -5.485 677 HB1 ALA 102 3HB ALA 102 1.370 -6.132 -7.413 678 HB2 ALA 102 1HB ALA 102 0.619 -7.487 -6.575 679 HB3 ALA 102 2HB ALA 102 2.329 -7.544 -6.976 680 H ILE 103 H ILE 103 1.384 -3.770 -5.490 681 HA ILE 103 HA ILE 103 -1.284 -4.038 -4.303 682 HB ILE 103 HB ILE 103 0.720 -1.866 -3.635 683 HG12 ILE 103 2HG1 ILE 103 -0.605 -3.882 -1.816 684 HG13 ILE 103 3HG1 ILE 103 1.031 -4.039 -2.445 685 HG21 ILE 103 1HG2 ILE 103 -2.146 -2.155 -2.762 686 HG22 ILE 103 2HG2 ILE 103 -1.512 -0.938 -3.864 687 HG23 ILE 103 3HG2 ILE 103 -1.011 -0.944 -2.170 688 HD11 ILE 103 3HD1 ILE 103 1.679 -1.993 -1.286 689 HD12 ILE 103 1HD1 ILE 103 1.031 -3.192 -0.168 690 HD13 ILE 103 2HD1 ILE 103 0.036 -1.825 -0.664 691 H ASN 104 H ASN 104 -2.767 -3.277 -5.596 692 HA ASN 104 HA ASN 104 -2.139 -0.986 -7.339 693 HB2 ASN 104 2HB ASN 104 -2.419 -3.024 -8.680 694 HB3 ASN 104 3HB ASN 104 -3.977 -3.325 -7.921 695 HD21 ASN 104 1HD2 ASN 104 -5.072 -3.290 -9.854 696 HD22 ASN 104 2HD2 ASN 104 -5.342 -1.827 -10.743 697 H VAL 105 H VAL 105 -2.957 0.570 -6.104 698 HA VAL 105 HA VAL 105 -5.826 0.418 -5.499 699 HB VAL 105 HB VAL 105 -5.556 1.488 -3.261 700 HG11 VAL 105 1HG1 VAL 105 -4.239 -1.198 -3.610 701 HG12 VAL 105 2HG1 VAL 105 -5.964 -0.892 -3.435 702 HG13 VAL 105 3HG1 VAL 105 -4.870 -0.557 -2.094 703 HG21 VAL 105 3HG2 VAL 105 -3.358 1.343 -2.153 704 HG22 VAL 105 1HG2 VAL 105 -3.351 2.453 -3.526 705 HG23 VAL 105 2HG2 VAL 105 -2.643 0.847 -3.688 706 H GLU 106 H GLU 106 -7.007 2.167 -5.769 707 HA GLU 106 HA GLU 106 -5.692 4.766 -6.109 708 HB2 GLU 106 2HB GLU 106 -5.911 3.763 -8.357 709 HB3 GLU 106 3HB GLU 106 -7.635 3.548 -8.088 710 HG2 GLU 106 2HG GLU 106 -7.879 5.992 -7.902 711 HG3 GLU 106 3HG GLU 106 -6.162 6.169 -8.255 712 H SER 107 H SER 107 -6.873 6.420 -5.323 713 HA SER 107 HA SER 107 -9.741 6.111 -4.956 714 HB2 SER 107 2HB SER 107 -8.707 5.285 -2.842 715 HB3 SER 107 3HB SER 107 -7.967 6.872 -2.625 716 HG SER 107 HG SER 107 -9.756 7.336 -1.651 717 H GLY 108 H GLY 108 -10.866 8.048 -4.886 718 HA2 GLY 108 2HA GLY 108 -9.255 10.401 -5.634 719 HA3 GLY 108 3HA GLY 108 -10.903 10.107 -6.166 720 H ASP 109 H ASP 109 -10.263 9.356 -2.901 721 HA ASP 109 HA ASP 109 -11.862 11.642 -2.056 722 HB2 ASP 109 2HB ASP 109 -12.101 10.469 0.084 723 HB3 ASP 109 3HB ASP 109 -12.481 9.374 -1.234 724 H ASP 110 H ASP 110 -10.781 11.584 0.651 725 HA ASP 110 HA ASP 110 -8.496 13.329 0.223 726 HB2 ASP 110 2HB ASP 110 -10.357 14.022 1.727 727 HB3 ASP 110 3HB ASP 110 -10.003 12.655 2.771 728 H GLY 111 H GLY 111 -8.542 10.184 0.101 729 HA2 GLY 111 2HA GLY 111 -6.863 8.670 0.460 730 HA3 GLY 111 3HA GLY 111 -6.049 9.839 1.493 731 H GLN 112 H GLN 112 -9.235 9.578 2.339 732 HA GLN 112 HA GLN 112 -8.663 8.445 4.865 733 HB2 GLN 112 2HB GLN 112 -10.479 10.067 4.476 734 HB3 GLN 112 3HB GLN 112 -11.333 8.869 3.515 735 HG2 GLN 112 2HG GLN 112 -11.533 7.438 5.485 736 HG3 GLN 112 3HG GLN 112 -10.674 8.647 6.440 737 HE21 GLN 112 1HE2 GLN 112 -11.689 10.561 6.960 738 HE22 GLN 112 2HE2 GLN 112 -13.398 10.761 6.821 739 H THR 113 H THR 113 -10.087 7.193 1.890 740 HA THR 113 HA THR 113 -9.881 4.501 3.041 741 HB THR 113 HB THR 113 -11.767 3.896 1.477 742 HG1 THR 113 HG1 THR 113 -11.534 6.610 0.949 743 HG21 THR 113 3HG2 THR 113 -13.528 4.817 2.952 744 HG22 THR 113 1HG2 THR 113 -12.333 5.898 3.667 745 HG23 THR 113 2HG2 THR 113 -12.169 4.151 3.859 746 H LEU 114 H LEU 114 -8.698 3.104 1.914 747 HA LEU 114 HA LEU 114 -7.836 3.887 -0.790 748 HB2 LEU 114 2HB LEU 114 -6.479 2.193 1.312 749 HB3 LEU 114 3HB LEU 114 -5.963 2.200 -0.362 750 HG LEU 114 HG LEU 114 -4.486 3.620 0.841 751 HD11 LEU 114 1HD1 LEU 114 -4.777 5.773 -0.239 752 HD12 LEU 114 2HD1 LEU 114 -6.450 5.372 -0.618 753 HD13 LEU 114 3HD1 LEU 114 -5.136 4.450 -1.348 754 HD21 LEU 114 3HD2 LEU 114 -5.816 4.019 2.832 755 HD22 LEU 114 1HD2 LEU 114 -6.916 5.050 1.917 756 HD23 LEU 114 2HD2 LEU 114 -5.244 5.548 2.168 757 H ASN 115 H ASN 115 -8.887 2.829 -2.311 758 HA ASN 115 HA ASN 115 -9.757 0.073 -1.748 759 HB2 ASN 115 2HB ASN 115 -11.100 2.200 -3.425 760 HB3 ASN 115 3HB ASN 115 -11.581 0.509 -3.425 761 HD21 ASN 115 1HD2 ASN 115 -13.053 2.919 -2.636 762 HD22 ASN 115 2HD2 ASN 115 -13.554 2.649 -1.006 763 H GLY 116 H GLY 116 -9.544 -1.477 -3.349 764 HA2 GLY 116 2HA GLY 116 -9.068 -1.214 -5.995 765 HA3 GLY 116 3HA GLY 116 -7.486 -0.934 -5.289 766 H THR 117 H THR 117 -6.375 -2.646 -5.711 767 HA THR 117 HA THR 117 -7.386 -5.275 -4.900 768 HB THR 117 HB THR 117 -6.210 -6.237 -6.947 769 HG1 THR 117 HG1 THR 117 -5.748 -3.593 -7.315 770 HG21 THR 117 3HG2 THR 117 -8.661 -6.126 -6.780 771 HG22 THR 117 1HG2 THR 117 -8.118 -5.848 -8.435 772 HG23 THR 117 2HG2 THR 117 -8.627 -4.488 -7.438 773 H MET 118 H MET 118 -5.666 -6.837 -4.543 774 HA MET 118 HA MET 118 -2.979 -5.784 -4.320 775 HB2 MET 118 2HB MET 118 -2.744 -6.304 -1.970 776 HB3 MET 118 3HB MET 118 -4.028 -5.127 -2.196 777 HG2 MET 118 2HG MET 118 -5.707 -6.695 -1.751 778 HG3 MET 118 3HG MET 118 -4.612 -8.054 -1.975 779 HE1 MET 118 3HE MET 118 -2.364 -7.923 1.141 780 HE2 MET 118 1HE MET 118 -2.029 -7.049 -0.354 781 HE3 MET 118 2HE MET 118 -2.705 -8.674 -0.416 782 H THR 119 H THR 119 -1.409 -7.439 -3.929 783 HA THR 119 HA THR 119 -2.453 -10.170 -4.284 784 HB THR 119 HB THR 119 -0.019 -9.069 -5.713 785 HG1 THR 119 HG1 THR 119 -1.416 -9.285 -7.589 786 HG21 THR 119 3HG2 THR 119 -0.125 -11.160 -6.988 787 HG22 THR 119 1HG2 THR 119 -1.510 -11.680 -6.027 788 HG23 THR 119 2HG2 THR 119 0.070 -11.481 -5.265 789 H TYR 120 H TYR 120 -1.672 -11.583 -2.841 790 HA TYR 120 HA TYR 120 0.582 -10.870 -1.153 791 HB2 TYR 120 2HB TYR 120 -1.520 -13.005 -1.048 792 HB3 TYR 120 3HB TYR 120 -0.039 -13.187 -0.117 793 HD1 TYR 120 HD2 TYR 120 0.604 -11.130 1.338 794 HD2 TYR 120 HD1 TYR 120 -3.324 -11.934 -0.061 795 HE1 TYR 120 HE2 TYR 120 -0.302 -9.724 3.121 796 HE2 TYR 120 HE1 TYR 120 -4.247 -10.516 1.733 797 HH TYR 120 HH TYR 120 -3.646 -9.590 3.865 798 H ALA 121 H ALA 121 2.191 -12.575 -0.667 799 HA ALA 121 HA ALA 121 3.514 -13.391 -3.030 800 HB1 ALA 121 3HB ALA 121 4.649 -12.838 -0.906 801 HB2 ALA 121 1HB ALA 121 5.177 -14.372 -1.598 802 HB3 ALA 121 2HB ALA 121 4.067 -14.362 -0.232 803 H GLY 122 H GLY 122 0.981 -14.656 -3.245 804 HA2 GLY 122 2HA GLY 122 1.398 -16.940 -4.467 805 HA3 GLY 122 3HA GLY 122 1.625 -17.491 -2.818 806 H GLU 123 H GLU 123 -0.561 -15.591 -1.930 807 HA GLU 123 HA GLU 123 -2.643 -17.507 -2.048 808 HB2 GLU 123 2HB GLU 123 -2.709 -14.644 -1.105 809 HB3 GLU 123 3HB GLU 123 -4.021 -15.793 -0.886 810 HG2 GLU 123 2HG GLU 123 -1.239 -16.070 0.224 811 HG3 GLU 123 3HG GLU 123 -2.674 -15.585 1.128 812 H GLY 124 H GLY 124 -2.030 -14.616 -3.927 813 HA2 GLY 124 2HA GLY 124 -2.954 -14.628 -6.197 814 HA3 GLY 124 3HA GLY 124 -4.445 -15.253 -5.506 815 HA PRO 125 HA PRO 125 -4.372 -10.454 -5.737 816 HB2 PRO 125 2HB PRO 125 -6.176 -10.789 -8.048 817 HB3 PRO 125 3HB PRO 125 -4.771 -9.734 -7.875 818 HG2 PRO 125 2HG PRO 125 -4.697 -11.891 -9.460 819 HG3 PRO 125 3HG PRO 125 -3.281 -11.387 -8.517 820 HD2 PRO 125 2HD PRO 125 -5.259 -13.565 -7.942 821 HD3 PRO 125 3HD PRO 125 -3.487 -13.584 -7.796 822 H ILE 126 H ILE 126 -5.821 -9.618 -4.397 823 HA ILE 126 HA ILE 126 -8.613 -10.511 -4.508 824 HB ILE 126 HB ILE 126 -8.749 -10.488 -2.033 825 HG12 ILE 126 2HG1 ILE 126 -5.724 -10.344 -2.142 826 HG13 ILE 126 3HG1 ILE 126 -6.787 -9.041 -1.622 827 HG21 ILE 126 1HG2 ILE 126 -8.529 -12.610 -3.180 828 HG22 ILE 126 2HG2 ILE 126 -7.643 -12.653 -1.656 829 HG23 ILE 126 3HG2 ILE 126 -6.771 -12.456 -3.178 830 HD11 ILE 126 3HD1 ILE 126 -7.571 -10.455 0.227 831 HD12 ILE 126 1HD1 ILE 126 -5.835 -10.151 0.285 832 HD13 ILE 126 2HD1 ILE 126 -6.439 -11.709 -0.281 833 H GLY 127 H GLY 127 -10.115 -9.005 -3.427 834 HA2 GLY 127 2HA GLY 127 -9.574 -6.306 -4.158 835 HA3 GLY 127 3HA GLY 127 -10.982 -6.875 -3.277 836 H PHE 128 H PHE 128 -9.041 -4.545 -2.978 837 HA PHE 128 HA PHE 128 -8.374 -5.014 -0.152 838 HB2 PHE 128 2HB PHE 128 -6.346 -4.794 -1.479 839 HB3 PHE 128 3HB PHE 128 -6.934 -3.293 -2.181 840 HD1 PHE 128 HD1 PHE 128 -5.704 -4.871 0.910 841 HD2 PHE 128 HD2 PHE 128 -6.705 -1.224 -1.033 842 HE1 PHE 128 HE1 PHE 128 -4.632 -3.607 2.727 843 HE2 PHE 128 HE2 PHE 128 -5.635 0.044 0.783 844 HZ PHE 128 HZ PHE 128 -4.597 -1.150 2.665 845 H LYS 129 H LYS 129 -9.183 -3.644 1.309 846 HA LYS 129 HA LYS 129 -10.097 -1.004 0.475 847 HB2 LYS 129 2HB LYS 129 -12.084 -2.403 0.410 848 HB3 LYS 129 3HB LYS 129 -11.733 -3.029 2.009 849 HG2 LYS 129 2HG LYS 129 -12.148 -0.855 2.983 850 HG3 LYS 129 3HG LYS 129 -12.421 -0.168 1.378 851 HD2 LYS 129 2HD LYS 129 -14.318 -1.693 1.059 852 HD3 LYS 129 3HD LYS 129 -14.046 -2.359 2.671 853 HE2 LYS 129 2HE LYS 129 -14.663 0.532 2.100 854 HE3 LYS 129 3HE LYS 129 -15.866 -0.671 2.566 855 HZ1 LYS 129 3HZ LYS 129 -15.149 0.579 4.471 856 HZ2 LYS 129 1HZ LYS 129 -13.530 0.179 4.189 857 HZ3 LYS 129 2HZ LYS 129 -14.638 -1.026 4.624 858 H GLY 130 H GLY 130 -9.083 0.395 1.765 859 HA2 GLY 130 2HA GLY 130 -8.515 -0.437 4.551 860 HA3 GLY 130 3HA GLY 130 -7.385 0.513 3.591 861 H THR 131 H THR 131 -8.898 1.003 6.167 862 HA THR 131 HA THR 131 -9.972 3.621 5.379 863 HB THR 131 HB THR 131 -11.091 1.835 7.558 864 HG1 THR 131 HG1 THR 131 -11.795 2.366 4.884 865 HG21 THR 131 3HG2 THR 131 -12.856 3.527 7.730 866 HG22 THR 131 1HG2 THR 131 -12.055 4.501 6.497 867 HG23 THR 131 2HG2 THR 131 -11.280 4.248 8.059 868 H LEU 132 H LEU 132 -9.284 5.344 6.514 869 HA LEU 132 HA LEU 132 -6.985 5.267 8.088 870 HB2 LEU 132 2HB LEU 132 -7.871 7.232 6.812 871 HB3 LEU 132 3HB LEU 132 -9.110 7.428 8.026 872 HG LEU 132 HG LEU 132 -7.114 9.016 8.117 873 HD11 LEU 132 1HD1 LEU 132 -7.029 9.043 10.554 874 HD12 LEU 132 2HD1 LEU 132 -7.795 7.455 10.603 875 HD13 LEU 132 3HD1 LEU 132 -8.677 8.843 9.958 876 HD21 LEU 132 3HD2 LEU 132 -5.367 7.353 7.733 877 HD22 LEU 132 1HD2 LEU 132 -5.758 6.582 9.271 878 HD23 LEU 132 2HD2 LEU 132 -5.110 8.223 9.245 879 H THR 133 H THR 133 -6.598 5.246 10.288 880 HA THR 133 HA THR 133 -8.899 5.065 12.071 881 HB THR 133 HB THR 133 -6.539 3.179 12.147 882 HG1 THR 133 HG1 THR 133 -8.353 3.091 10.397 883 HG21 THR 133 3HG2 THR 133 -7.609 3.576 14.327 884 HG22 THR 133 1HG2 THR 133 -7.927 1.936 13.760 885 HG23 THR 133 2HG2 THR 133 -9.176 3.173 13.630 Start of MODEL 8 1 H1 ALA 2 1H ALA 2 0.547 7.454 9.623 2 H2 ALA 2 2H ALA 2 0.140 6.126 8.651 3 H3 ALA 2 3H ALA 2 0.956 5.886 10.109 4 HA ALA 2 HA ALA 2 -0.921 6.641 11.352 5 HB1 ALA 2 3HB ALA 2 -1.759 8.242 9.688 6 HB2 ALA 2 1HB ALA 2 -3.022 7.138 10.235 7 HB3 ALA 2 2HB ALA 2 -2.262 6.896 8.662 8 H LEU 3 H LEU 3 -2.788 5.213 11.779 9 HA LEU 3 HA LEU 3 -2.147 2.516 10.912 10 HB2 LEU 3 2HB LEU 3 -2.516 3.183 13.328 11 HB3 LEU 3 3HB LEU 3 -4.205 3.407 12.935 12 HG LEU 3 HG LEU 3 -3.599 1.245 14.093 13 HD11 LEU 3 1HD1 LEU 3 -4.985 1.042 11.420 14 HD12 LEU 3 2HD1 LEU 3 -5.724 1.519 12.945 15 HD13 LEU 3 3HD1 LEU 3 -5.108 -0.124 12.741 16 HD21 LEU 3 3HD2 LEU 3 -2.476 0.559 11.382 17 HD22 LEU 3 1HD2 LEU 3 -2.638 -0.539 12.753 18 HD23 LEU 3 2HD2 LEU 3 -1.526 0.828 12.842 19 H TYR 4 H TYR 4 -3.287 1.408 9.447 20 HA TYR 4 HA TYR 4 -5.945 2.427 8.700 21 HB2 TYR 4 2HB TYR 4 -3.768 1.267 6.971 22 HB3 TYR 4 3HB TYR 4 -5.446 1.320 6.450 23 HD1 TYR 4 HD1 TYR 4 -2.591 3.443 7.491 24 HD2 TYR 4 HD2 TYR 4 -6.371 3.279 5.555 25 HE1 TYR 4 HE1 TYR 4 -2.256 5.722 6.661 26 HE2 TYR 4 HE2 TYR 4 -6.053 5.573 4.727 27 HH TYR 4 HH TYR 4 -3.067 7.174 4.867 28 H ASN 5 H ASN 5 -7.554 0.995 8.406 29 HA ASN 5 HA ASN 5 -7.011 -1.741 9.326 30 HB2 ASN 5 2HB ASN 5 -9.450 -0.021 9.333 31 HB3 ASN 5 3HB ASN 5 -9.680 -1.761 9.180 32 HD21 ASN 5 1HD2 ASN 5 -8.612 0.832 11.269 33 HD22 ASN 5 2HD2 ASN 5 -8.514 -0.129 12.705 34 H VAL 6 H VAL 6 -7.333 -3.470 8.016 35 HA VAL 6 HA VAL 6 -7.814 -2.730 5.208 36 HB VAL 6 HB VAL 6 -6.012 -4.849 6.366 37 HG11 VAL 6 1HG1 VAL 6 -5.456 -5.491 4.077 38 HG12 VAL 6 2HG1 VAL 6 -6.694 -4.395 3.459 39 HG13 VAL 6 3HG1 VAL 6 -7.157 -5.795 4.424 40 HG21 VAL 6 3HG2 VAL 6 -5.500 -2.461 4.605 41 HG22 VAL 6 1HG2 VAL 6 -4.282 -3.611 5.150 42 HG23 VAL 6 2HG2 VAL 6 -5.114 -2.583 6.320 43 H GLU 7 H GLU 7 -9.435 -3.522 4.210 44 HA GLU 7 HA GLU 7 -10.668 -6.022 5.132 45 HB2 GLU 7 2HB GLU 7 -11.957 -3.577 3.873 46 HB3 GLU 7 3HB GLU 7 -12.791 -5.101 4.146 47 HG2 GLU 7 2HG GLU 7 -12.451 -4.876 6.544 48 HG3 GLU 7 3HG GLU 7 -11.556 -3.384 6.290 49 H ASN 8 H ASN 8 -10.912 -7.593 3.614 50 HA ASN 8 HA ASN 8 -9.972 -6.959 0.898 51 HB2 ASN 8 2HB ASN 8 -9.425 -9.376 2.617 52 HB3 ASN 8 3HB ASN 8 -9.151 -9.376 0.881 53 HD21 ASN 8 1HD2 ASN 8 -8.226 -6.636 0.780 54 HD22 ASN 8 2HD2 ASN 8 -6.652 -6.625 1.495 55 H GLN 9 H GLN 9 -11.074 -7.736 -0.808 56 HA GLN 9 HA GLN 9 -13.373 -9.525 -0.297 57 HB2 GLN 9 2HB GLN 9 -14.106 -7.141 -0.505 58 HB3 GLN 9 3HB GLN 9 -13.392 -7.093 -2.104 59 HG2 GLN 9 2HG GLN 9 -14.971 -8.874 -2.815 60 HG3 GLN 9 3HG GLN 9 -15.709 -8.799 -1.218 61 HE21 GLN 9 1HE2 GLN 9 -15.403 -7.263 -4.293 62 HE22 GLN 9 2HE2 GLN 9 -16.584 -6.034 -4.027 63 H TRP 10 H TRP 10 -13.369 -11.255 -1.632 64 HA TRP 10 HA TRP 10 -11.956 -10.967 -4.178 65 HB2 TRP 10 2HB TRP 10 -11.169 -13.371 -3.868 66 HB3 TRP 10 3HB TRP 10 -10.364 -12.146 -2.905 67 HD1 TRP 10 HD1 TRP 10 -12.484 -15.266 -2.609 68 HE1 TRP 10 HE1 TRP 10 -12.655 -15.950 -0.138 69 HE3 TRP 10 HE3 TRP 10 -10.411 -11.105 -0.464 70 HZ2 TRP 10 HZ2 TRP 10 -12.004 -14.873 2.398 71 HZ3 TRP 10 HZ3 TRP 10 -10.233 -11.021 1.988 72 HH2 TRP 10 HH2 TRP 10 -11.010 -12.850 3.383 73 H GLY 11 H GLY 11 -12.785 -11.980 -5.909 74 HA2 GLY 11 2HA GLY 11 -14.185 -13.785 -6.805 75 HA3 GLY 11 3HA GLY 11 -15.302 -13.455 -5.480 76 H GLY 12 H GLY 12 -16.319 -11.316 -5.458 77 HA2 GLY 12 2HA GLY 12 -16.296 -9.682 -7.780 78 HA3 GLY 12 3HA GLY 12 -17.683 -10.765 -7.788 79 H SER 13 H SER 13 -18.253 -8.188 -7.774 80 HA SER 13 HA SER 13 -18.411 -6.861 -5.346 81 HB2 SER 13 2HB SER 13 -18.851 -5.813 -7.553 82 HB3 SER 13 3HB SER 13 -20.378 -6.689 -7.643 83 HG SER 13 HG SER 13 -21.202 -5.439 -6.066 84 H SER 14 H SER 14 -20.352 -9.513 -6.523 85 HA SER 14 HA SER 14 -22.566 -9.222 -4.856 86 HB2 SER 14 2HB SER 14 -22.818 -11.709 -5.266 87 HB3 SER 14 3HB SER 14 -22.705 -10.704 -6.715 88 HG SER 14 HG SER 14 -20.993 -12.646 -5.774 89 H ALA 15 H ALA 15 -19.348 -10.143 -4.122 90 HA ALA 15 HA ALA 15 -20.114 -11.501 -1.662 91 HB1 ALA 15 3HB ALA 15 -18.310 -12.463 -3.033 92 HB2 ALA 15 1HB ALA 15 -17.736 -12.001 -1.432 93 HB3 ALA 15 2HB ALA 15 -17.367 -10.989 -2.828 94 HA PRO 16 HA PRO 16 -19.511 -7.796 0.714 95 HB2 PRO 16 2HB PRO 16 -19.297 -8.820 3.170 96 HB3 PRO 16 3HB PRO 16 -20.812 -8.908 2.270 97 HG2 PRO 16 2HG PRO 16 -18.729 -11.012 2.663 98 HG3 PRO 16 3HG PRO 16 -20.494 -11.163 2.733 99 HD2 PRO 16 2HD PRO 16 -18.995 -11.850 0.543 100 HD3 PRO 16 3HD PRO 16 -20.693 -11.342 0.457 101 H TRP 17 H TRP 17 -18.033 -6.899 2.424 102 HA TRP 17 HA TRP 17 -15.276 -7.443 1.672 103 HB2 TRP 17 2HB TRP 17 -16.545 -5.234 3.301 104 HB3 TRP 17 3HB TRP 17 -14.802 -5.415 3.176 105 HD1 TRP 17 HD1 TRP 17 -17.790 -4.070 1.287 106 HE1 TRP 17 HE1 TRP 17 -16.978 -2.946 -0.894 107 HE3 TRP 17 HE3 TRP 17 -12.922 -5.630 1.312 108 HZ2 TRP 17 HZ2 TRP 17 -14.601 -2.764 -2.402 109 HZ3 TRP 17 HZ3 TRP 17 -11.448 -4.944 -0.538 110 HH2 TRP 17 HH2 TRP 17 -12.279 -3.535 -2.354 111 H ASN 18 H ASN 18 -13.842 -8.465 2.922 112 HA ASN 18 HA ASN 18 -14.736 -9.282 5.610 113 HB2 ASN 18 2HB ASN 18 -12.930 -10.747 3.669 114 HB3 ASN 18 3HB ASN 18 -13.283 -11.288 5.305 115 HD21 ASN 18 1HD2 ASN 18 -14.473 -10.951 2.074 116 HD22 ASN 18 2HD2 ASN 18 -15.910 -11.884 2.287 117 H GLU 19 H GLU 19 -13.658 -8.377 7.200 118 HA GLU 19 HA GLU 19 -11.104 -7.133 6.719 119 HB2 GLU 19 2HB GLU 19 -11.314 -6.403 9.098 120 HB3 GLU 19 3HB GLU 19 -12.680 -5.937 8.105 121 HG2 GLU 19 2HG GLU 19 -13.923 -7.890 8.983 122 HG3 GLU 19 3HG GLU 19 -12.574 -8.199 10.074 123 H GLY 20 H GLY 20 -9.171 -8.003 7.060 124 HA2 GLY 20 2HA GLY 20 -9.047 -10.359 8.825 125 HA3 GLY 20 3HA GLY 20 -8.337 -10.389 7.220 126 H GLY 21 H GLY 21 -8.215 -7.528 9.256 127 HA2 GLY 21 2HA GLY 21 -6.190 -7.589 10.848 128 HA3 GLY 21 3HA GLY 21 -5.311 -7.872 9.355 129 H GLN 22 H GLN 22 -4.312 -5.858 10.394 130 HA GLN 22 HA GLN 22 -5.410 -3.553 9.002 131 HB2 GLN 22 2HB GLN 22 -4.959 -2.118 10.972 132 HB3 GLN 22 3HB GLN 22 -6.234 -3.279 11.286 133 HG2 GLN 22 2HG GLN 22 -4.497 -4.726 12.382 134 HG3 GLN 22 3HG GLN 22 -3.384 -3.366 12.235 135 HE21 GLN 22 1HE2 GLN 22 -3.897 -1.443 13.328 136 HE22 GLN 22 2HE2 GLN 22 -4.867 -1.460 14.757 137 H TRP 23 H TRP 23 -3.785 -1.908 8.615 138 HA TRP 23 HA TRP 23 -1.024 -2.957 8.715 139 HB2 TRP 23 2HB TRP 23 -2.400 -1.689 6.337 140 HB3 TRP 23 3HB TRP 23 -0.669 -1.963 6.433 141 HD1 TRP 23 HD1 TRP 23 -2.188 -4.933 7.907 142 HE1 TRP 23 HE1 TRP 23 -2.425 -6.821 6.182 143 HE3 TRP 23 HE3 TRP 23 -1.357 -2.233 3.660 144 HZ2 TRP 23 HZ2 TRP 23 -2.265 -7.128 3.386 145 HZ3 TRP 23 HZ3 TRP 23 -1.405 -3.410 1.491 146 HH2 TRP 23 HH2 TRP 23 -1.847 -5.793 1.367 147 H GLU 24 H GLU 24 0.549 -1.124 7.996 148 HA GLU 24 HA GLU 24 -0.438 1.417 9.118 149 HB2 GLU 24 2HB GLU 24 1.170 0.379 10.677 150 HB3 GLU 24 3HB GLU 24 2.377 0.336 9.395 151 HG2 GLU 24 2HG GLU 24 2.349 2.767 9.262 152 HG3 GLU 24 3HG GLU 24 1.122 2.833 10.522 153 H ILE 25 H ILE 25 -0.491 2.946 7.715 154 HA ILE 25 HA ILE 25 1.477 3.036 5.538 155 HB ILE 25 HB ILE 25 -1.519 3.432 5.237 156 HG12 ILE 25 2HG1 ILE 25 0.318 1.476 3.842 157 HG13 ILE 25 3HG1 ILE 25 -0.668 1.066 5.242 158 HG21 ILE 25 1HG2 ILE 25 0.678 3.900 3.220 159 HG22 ILE 25 2HG2 ILE 25 -0.385 5.116 3.926 160 HG23 ILE 25 3HG2 ILE 25 -1.047 3.880 2.857 161 HD11 ILE 25 3HD1 ILE 25 -1.687 0.339 3.140 162 HD12 ILE 25 1HD1 ILE 25 -1.715 2.013 2.581 163 HD13 ILE 25 2HD1 ILE 25 -2.685 1.529 3.973 164 H GLY 26 H GLY 26 2.190 5.076 5.045 165 HA2 GLY 26 2HA GLY 26 2.205 7.411 5.052 166 HA3 GLY 26 3HA GLY 26 0.770 7.387 6.066 167 H SER 27 H SER 27 4.109 6.430 6.202 168 HA SER 27 HA SER 27 4.454 6.640 8.991 169 HB2 SER 27 2HB SER 27 6.918 6.933 8.454 170 HB3 SER 27 3HB SER 27 6.158 5.502 7.756 171 HG SER 27 HG SER 27 7.448 7.448 6.507 172 H ARG 28 H ARG 28 4.801 9.043 6.449 173 HA ARG 28 HA ARG 28 5.230 11.141 8.424 174 HB2 ARG 28 2HB ARG 28 5.071 11.261 5.401 175 HB3 ARG 28 3HB ARG 28 5.470 12.621 6.449 176 HG2 ARG 28 2HG ARG 28 7.468 11.461 7.202 177 HG3 ARG 28 3HG ARG 28 7.071 10.085 6.169 178 HD2 ARG 28 2HD ARG 28 7.208 11.575 4.205 179 HD3 ARG 28 3HD ARG 28 7.674 12.901 5.270 180 HE ARG 28 HE ARG 28 9.302 10.593 4.522 181 HH11 ARG 28 1HH1 ARG 28 9.011 13.518 6.430 182 HH12 ARG 28 2HH1 ARG 28 10.707 13.643 6.731 183 HH21 ARG 28 1HH2 ARG 28 11.560 10.756 4.940 184 HH22 ARG 28 2HH2 ARG 28 12.143 12.075 5.894 185 H SER 29 H SER 29 3.452 11.808 9.423 186 HA SER 29 HA SER 29 0.854 11.340 8.366 187 HB2 SER 29 2HB SER 29 1.709 12.863 10.829 188 HB3 SER 29 3HB SER 29 0.058 12.359 10.454 189 HG SER 29 HG SER 29 1.905 10.966 11.699 190 H ASP 30 H ASP 30 2.982 13.840 7.745 191 HA ASP 30 HA ASP 30 1.059 15.969 7.669 192 HB2 ASP 30 2HB ASP 30 3.883 15.763 6.611 193 HB3 ASP 30 3HB ASP 30 2.880 17.187 6.376 194 H GLN 31 H GLN 31 1.902 13.381 5.604 195 HA GLN 31 HA GLN 31 0.276 14.572 3.495 196 HB2 GLN 31 2HB GLN 31 3.059 13.585 3.248 197 HB3 GLN 31 3HB GLN 31 1.953 13.202 1.933 198 HG2 GLN 31 2HG GLN 31 2.415 15.972 3.004 199 HG3 GLN 31 3HG GLN 31 3.235 15.286 1.595 200 HE21 GLN 31 1HE2 GLN 31 0.115 16.181 2.915 201 HE22 GLN 31 2HE2 GLN 31 -0.692 16.356 1.392 202 H ASN 32 H ASN 32 -1.452 13.394 3.204 203 HA ASN 32 HA ASN 32 -1.442 10.617 3.940 204 HB2 ASN 32 2HB ASN 32 -3.432 12.376 4.141 205 HB3 ASN 32 3HB ASN 32 -3.764 11.832 2.508 206 HD21 ASN 32 1HD2 ASN 32 -4.390 9.700 2.159 207 HD22 ASN 32 2HD2 ASN 32 -4.966 8.697 3.444 208 H VAL 33 H VAL 33 -1.717 8.928 2.614 209 HA VAL 33 HA VAL 33 -0.760 9.300 -0.117 210 HB VAL 33 HB VAL 33 -1.177 6.739 1.437 211 HG11 VAL 33 1HG1 VAL 33 0.259 5.721 -0.244 212 HG12 VAL 33 2HG1 VAL 33 0.381 7.260 -1.095 213 HG13 VAL 33 3HG1 VAL 33 -1.174 6.431 -0.987 214 HG21 VAL 33 3HG2 VAL 33 1.254 6.738 1.777 215 HG22 VAL 33 1HG2 VAL 33 0.474 8.118 2.550 216 HG23 VAL 33 2HG2 VAL 33 1.351 8.335 1.036 217 H VAL 34 H VAL 34 -2.087 9.061 -1.864 218 HA VAL 34 HA VAL 34 -4.785 8.005 -1.325 219 HB VAL 34 HB VAL 34 -5.555 9.255 -3.310 220 HG11 VAL 34 1HG1 VAL 34 -5.528 11.461 -2.272 221 HG12 VAL 34 2HG1 VAL 34 -4.226 10.934 -1.200 222 HG13 VAL 34 3HG1 VAL 34 -5.817 10.187 -1.089 223 HG21 VAL 34 3HG2 VAL 34 -3.444 9.420 -4.528 224 HG22 VAL 34 1HG2 VAL 34 -2.792 10.458 -3.261 225 HG23 VAL 34 2HG2 VAL 34 -4.134 11.022 -4.250 226 H ALA 35 H ALA 35 -1.931 7.481 -3.217 227 HA ALA 35 HA ALA 35 -3.281 5.165 -4.347 228 HB1 ALA 35 3HB ALA 35 -3.419 7.061 -6.008 229 HB2 ALA 35 1HB ALA 35 -2.696 5.561 -6.590 230 HB3 ALA 35 2HB ALA 35 -1.670 6.923 -6.168 231 H ILE 36 H ILE 36 -2.009 3.445 -4.813 232 HA ILE 36 HA ILE 36 0.864 3.657 -4.404 233 HB ILE 36 HB ILE 36 -0.878 1.733 -2.820 234 HG12 ILE 36 2HG1 ILE 36 1.007 3.860 -1.788 235 HG13 ILE 36 3HG1 ILE 36 -0.736 4.081 -1.938 236 HG21 ILE 36 1HG2 ILE 36 1.226 0.909 -1.853 237 HG22 ILE 36 2HG2 ILE 36 2.131 1.962 -2.940 238 HG23 ILE 36 3HG2 ILE 36 1.151 0.647 -3.593 239 HD11 ILE 36 3HD1 ILE 36 -1.090 2.257 -0.353 240 HD12 ILE 36 1HD1 ILE 36 -0.104 3.541 0.345 241 HD13 ILE 36 2HD1 ILE 36 0.652 2.044 -0.207 242 H ASN 37 H ASN 37 1.700 2.684 -6.119 243 HA ASN 37 HA ASN 37 0.449 0.197 -7.107 244 HB2 ASN 37 2HB ASN 37 1.485 2.580 -8.632 245 HB3 ASN 37 3HB ASN 37 1.616 0.981 -9.347 246 HD21 ASN 37 1HD2 ASN 37 -1.071 1.692 -7.270 247 HD22 ASN 37 2HD2 ASN 37 -2.263 1.794 -8.521 248 H VAL 38 H VAL 38 1.808 -1.453 -6.651 249 HA VAL 38 HA VAL 38 4.661 -1.061 -6.959 250 HB VAL 38 HB VAL 38 5.229 -1.873 -4.692 251 HG11 VAL 38 1HG1 VAL 38 3.768 0.720 -4.945 252 HG12 VAL 38 2HG1 VAL 38 5.513 0.423 -4.993 253 HG13 VAL 38 3HG1 VAL 38 4.618 0.242 -3.483 254 HG21 VAL 38 3HG2 VAL 38 3.127 -2.942 -4.109 255 HG22 VAL 38 1HG2 VAL 38 2.323 -1.373 -4.102 256 HG23 VAL 38 2HG2 VAL 38 3.562 -1.729 -2.900 257 H GLU 39 H GLU 39 5.862 -2.953 -7.014 258 HA GLU 39 HA GLU 39 4.513 -5.465 -6.496 259 HB2 GLU 39 2HB GLU 39 4.135 -4.956 -8.902 260 HB3 GLU 39 3HB GLU 39 5.877 -4.886 -9.131 261 HG2 GLU 39 2HG GLU 39 6.111 -7.194 -8.620 262 HG3 GLU 39 3HG GLU 39 4.426 -7.317 -8.118 263 H SER 40 H SER 40 5.982 -7.165 -6.088 264 HA SER 40 HA SER 40 8.427 -6.235 -4.926 265 HB2 SER 40 2HB SER 40 8.616 -8.623 -4.181 266 HB3 SER 40 3HB SER 40 7.128 -7.814 -3.690 267 HG SER 40 HG SER 40 7.473 -9.992 -5.270 268 H GLY 41 H GLY 41 10.495 -6.928 -5.364 269 HA2 GLY 41 2HA GLY 41 10.975 -7.943 -8.061 270 HA3 GLY 41 3HA GLY 41 12.184 -7.316 -6.939 271 H ASP 42 H ASP 42 10.602 -9.057 -4.924 272 HA ASP 42 HA ASP 42 11.726 -11.698 -5.569 273 HB2 ASP 42 2HB ASP 42 12.060 -10.306 -2.906 274 HB3 ASP 42 3HB ASP 42 12.634 -11.916 -3.306 275 H ASP 43 H ASP 43 11.121 -12.713 -2.939 276 HA ASP 43 HA ASP 43 8.285 -13.155 -3.217 277 HB2 ASP 43 2HB ASP 43 10.346 -14.149 -1.239 278 HB3 ASP 43 3HB ASP 43 8.639 -14.530 -1.082 279 H GLY 44 H GLY 44 8.734 -10.479 -2.747 280 HA2 GLY 44 2HA GLY 44 7.543 -8.902 -1.479 281 HA3 GLY 44 3HA GLY 44 7.339 -10.108 -0.220 282 H GLN 45 H GLN 45 10.523 -10.145 -1.111 283 HA GLN 45 HA GLN 45 11.434 -9.051 1.314 284 HB2 GLN 45 2HB GLN 45 12.706 -10.726 0.066 285 HB3 GLN 45 3HB GLN 45 12.980 -9.572 -1.234 286 HG2 GLN 45 2HG GLN 45 14.946 -9.814 0.179 287 HG3 GLN 45 3HG GLN 45 14.294 -8.180 0.248 288 HE21 GLN 45 1HE2 GLN 45 15.274 -7.774 2.210 289 HE22 GLN 45 2HE2 GLN 45 14.712 -8.465 3.694 290 H THR 46 H THR 46 11.530 -7.721 -1.987 291 HA THR 46 HA THR 46 11.596 -5.082 -0.742 292 HB THR 46 HB THR 46 13.879 -5.493 -1.499 293 HG1 THR 46 HG1 THR 46 13.125 -3.379 -1.782 294 HG21 THR 46 3HG2 THR 46 14.433 -5.887 -3.840 295 HG22 THR 46 1HG2 THR 46 12.718 -5.912 -4.257 296 HG23 THR 46 2HG2 THR 46 13.393 -7.176 -3.231 297 H LEU 47 H LEU 47 10.033 -3.755 -1.442 298 HA LEU 47 HA LEU 47 8.566 -4.513 -3.867 299 HB2 LEU 47 2HB LEU 47 7.714 -2.716 -1.598 300 HB3 LEU 47 3HB LEU 47 6.716 -3.286 -2.915 301 HG LEU 47 HG LEU 47 7.843 -4.986 -0.692 302 HD11 LEU 47 1HD1 LEU 47 6.071 -3.479 0.047 303 HD12 LEU 47 2HD1 LEU 47 5.542 -5.159 0.064 304 HD13 LEU 47 3HD1 LEU 47 5.023 -4.085 -1.235 305 HD21 LEU 47 3HD2 LEU 47 7.656 -6.231 -2.760 306 HD22 LEU 47 1HD2 LEU 47 5.988 -5.695 -2.955 307 HD23 LEU 47 2HD2 LEU 47 6.425 -6.746 -1.607 308 H ASN 48 H ASN 48 8.712 -3.178 -5.565 309 HA ASN 48 HA ASN 48 9.510 -0.387 -5.041 310 HB2 ASN 48 2HB ASN 48 10.281 -2.123 -7.392 311 HB3 ASN 48 3HB ASN 48 10.518 -0.381 -7.346 312 HD21 ASN 48 1HD2 ASN 48 11.670 -3.431 -6.353 313 HD22 ASN 48 2HD2 ASN 48 13.080 -2.882 -5.513 314 H GLY 49 H GLY 49 8.489 1.217 -6.267 315 HA2 GLY 49 2HA GLY 49 6.757 0.749 -8.381 316 HA3 GLY 49 3HA GLY 49 5.802 0.636 -6.915 317 H THR 50 H THR 50 4.605 2.408 -7.529 318 HA THR 50 HA THR 50 5.971 4.985 -7.242 319 HB THR 50 HB THR 50 3.770 4.288 -9.201 320 HG1 THR 50 HG1 THR 50 6.488 4.226 -9.325 321 HG21 THR 50 3HG2 THR 50 3.577 6.587 -8.367 322 HG22 THR 50 1HG2 THR 50 4.087 6.560 -10.054 323 HG23 THR 50 2HG2 THR 50 5.268 6.882 -8.784 324 H MET 51 H MET 51 5.062 6.297 -5.732 325 HA MET 51 HA MET 51 2.387 5.632 -4.705 326 HB2 MET 51 2HB MET 51 4.835 6.794 -3.456 327 HB3 MET 51 3HB MET 51 3.259 7.260 -2.838 328 HG2 MET 51 2HG MET 51 2.756 4.953 -2.319 329 HG3 MET 51 3HG MET 51 4.306 4.429 -2.972 330 HE1 MET 51 3HE MET 51 3.949 7.226 0.657 331 HE2 MET 51 1HE MET 51 2.584 6.721 -0.333 332 HE3 MET 51 2HE MET 51 3.816 7.795 -1.000 333 H THR 52 H THR 52 0.906 7.307 -4.323 334 HA THR 52 HA THR 52 1.655 9.956 -5.355 335 HB THR 52 HB THR 52 -1.028 8.647 -5.863 336 HG1 THR 52 HG1 THR 52 1.359 8.351 -7.114 337 HG21 THR 52 3HG2 THR 52 -1.072 11.100 -5.817 338 HG22 THR 52 1HG2 THR 52 -1.316 10.503 -7.458 339 HG23 THR 52 2HG2 THR 52 0.255 11.150 -6.973 340 H TYR 53 H TYR 53 1.200 11.548 -3.956 341 HA TYR 53 HA TYR 53 -0.376 10.940 -1.577 342 HB2 TYR 53 2HB TYR 53 1.445 13.253 -2.245 343 HB3 TYR 53 3HB TYR 53 0.464 13.192 -0.789 344 HD1 TYR 53 HD2 TYR 53 0.876 11.344 0.870 345 HD2 TYR 53 HD1 TYR 53 3.528 12.144 -2.355 346 HE1 TYR 53 HE2 TYR 53 2.662 10.114 2.038 347 HE2 TYR 53 HE1 TYR 53 5.317 10.927 -1.198 348 HH TYR 53 HH TYR 53 4.740 8.928 1.477 349 H ALA 54 H ALA 54 -1.841 12.640 -0.740 350 HA ALA 54 HA ALA 54 -3.909 13.122 -2.564 351 HB1 ALA 54 3HB ALA 54 -3.449 14.401 0.129 352 HB2 ALA 54 1HB ALA 54 -4.284 12.878 -0.164 353 HB3 ALA 54 2HB ALA 54 -4.968 14.391 -0.763 354 H GLY 55 H GLY 55 -3.563 14.430 -4.306 355 HA2 GLY 55 2HA GLY 55 -3.786 16.590 -5.206 356 HA3 GLY 55 3HA GLY 55 -3.124 17.256 -3.725 357 H GLU 56 H GLU 56 -1.109 14.836 -4.346 358 HA GLU 56 HA GLU 56 0.704 16.628 -5.788 359 HB2 GLU 56 2HB GLU 56 1.268 14.327 -3.930 360 HB3 GLU 56 3HB GLU 56 2.509 15.219 -4.803 361 HG2 GLU 56 2HG GLU 56 0.600 16.394 -2.800 362 HG3 GLU 56 3HG GLU 56 2.291 15.984 -2.496 363 H GLY 57 H GLY 57 2.547 15.137 -6.839 364 HA2 GLY 57 2HA GLY 57 1.085 13.496 -8.774 365 HA3 GLY 57 3HA GLY 57 2.672 14.210 -9.023 366 HA PRO 58 HA PRO 58 2.973 9.652 -7.738 367 HB2 PRO 58 2HB PRO 58 4.033 8.719 -10.066 368 HB3 PRO 58 3HB PRO 58 2.292 8.788 -9.760 369 HG2 PRO 58 2HG PRO 58 4.033 10.703 -11.274 370 HG3 PRO 58 3HG PRO 58 2.448 10.046 -11.724 371 HD2 PRO 58 2HD PRO 58 2.716 12.510 -10.674 372 HD3 PRO 58 3HD PRO 58 1.315 11.486 -10.318 373 H ILE 59 H ILE 59 4.815 8.939 -6.816 374 HA ILE 59 HA ILE 59 7.408 9.973 -7.765 375 HB ILE 59 HB ILE 59 8.220 10.152 -5.466 376 HG12 ILE 59 2HG1 ILE 59 5.370 9.634 -4.587 377 HG13 ILE 59 3HG1 ILE 59 6.661 8.442 -4.509 378 HG21 ILE 59 1HG2 ILE 59 7.348 12.157 -6.480 379 HG22 ILE 59 2HG2 ILE 59 6.950 12.139 -4.758 380 HG23 ILE 59 3HG2 ILE 59 5.716 11.747 -5.953 381 HD11 ILE 59 3HD1 ILE 59 6.551 11.064 -3.034 382 HD12 ILE 59 1HD1 ILE 59 7.900 9.930 -2.985 383 HD13 ILE 59 2HD1 ILE 59 6.329 9.450 -2.353 384 H GLY 60 H GLY 60 9.243 8.638 -6.806 385 HA2 GLY 60 2HA GLY 60 8.660 5.860 -7.339 386 HA3 GLY 60 3HA GLY 60 10.243 6.551 -6.996 387 H PHE 61 H PHE 61 8.637 4.202 -5.898 388 HA PHE 61 HA PHE 61 9.016 4.870 -3.065 389 HB2 PHE 61 2HB PHE 61 6.676 4.973 -3.334 390 HB3 PHE 61 3HB PHE 61 6.649 3.561 -4.376 391 HD1 PHE 61 HD1 PHE 61 7.753 4.391 -0.887 392 HD2 PHE 61 HD2 PHE 61 5.719 1.736 -3.480 393 HE1 PHE 61 HE1 PHE 61 7.138 2.976 1.037 394 HE2 PHE 61 HE2 PHE 61 5.105 0.316 -1.560 395 HZ PHE 61 HZ PHE 61 5.817 0.945 0.694 396 H ARG 62 H ARG 62 10.211 3.494 -1.970 397 HA ARG 62 HA ARG 62 10.643 0.757 -3.005 398 HB2 ARG 62 2HB ARG 62 12.620 2.109 -3.456 399 HB3 ARG 62 3HB ARG 62 12.665 2.647 -1.786 400 HG2 ARG 62 2HG ARG 62 13.064 0.292 -1.091 401 HG3 ARG 62 3HG ARG 62 13.153 -0.147 -2.799 402 HD2 ARG 62 2HD ARG 62 14.934 1.835 -1.375 403 HD3 ARG 62 3HD ARG 62 15.385 0.198 -1.844 404 HE ARG 62 HE ARG 62 15.042 2.493 -3.581 405 HH11 ARG 62 1HH1 ARG 62 15.727 -0.934 -3.249 406 HH12 ARG 62 2HH1 ARG 62 16.237 -1.136 -4.885 407 HH21 ARG 62 1HH2 ARG 62 15.745 2.220 -5.775 408 HH22 ARG 62 2HH2 ARG 62 16.261 0.670 -6.330 409 H ALA 63 H ALA 63 10.227 -0.793 -1.548 410 HA ALA 63 HA ALA 63 10.407 -0.091 1.304 411 HB1 ALA 63 3HB ALA 63 8.044 -0.224 0.521 412 HB2 ALA 63 1HB ALA 63 8.447 -1.378 1.792 413 HB3 ALA 63 2HB ALA 63 8.327 -1.919 0.122 414 H THR 64 H THR 64 11.555 -1.442 2.516 415 HA THR 64 HA THR 64 12.361 -4.002 1.311 416 HB THR 64 HB THR 64 13.952 -2.253 3.206 417 HG1 THR 64 HG1 THR 64 14.990 -1.580 1.422 418 HG21 THR 64 3HG2 THR 64 14.385 -4.649 3.540 419 HG22 THR 64 1HG2 THR 64 15.773 -3.849 2.804 420 HG23 THR 64 2HG2 THR 64 14.693 -4.832 1.813 421 H LEU 65 H LEU 65 11.808 -5.763 2.361 422 HA LEU 65 HA LEU 65 10.228 -5.685 4.711 423 HB2 LEU 65 2HB LEU 65 9.824 -7.286 2.939 424 HB3 LEU 65 3HB LEU 65 11.413 -7.988 3.172 425 HG LEU 65 HG LEU 65 10.711 -8.756 5.412 426 HD11 LEU 65 1HD1 LEU 65 9.009 -7.120 5.915 427 HD12 LEU 65 2HD1 LEU 65 8.316 -8.738 5.973 428 HD13 LEU 65 3HD1 LEU 65 8.014 -7.697 4.578 429 HD21 LEU 65 3HD2 LEU 65 9.217 -10.540 4.622 430 HD22 LEU 65 1HD2 LEU 65 10.573 -10.267 3.528 431 HD23 LEU 65 2HD2 LEU 65 8.969 -9.650 3.122 432 H LEU 66 H LEU 66 10.729 -5.948 6.721 433 HA LEU 66 HA LEU 66 13.470 -6.507 7.574 434 HB2 LEU 66 2HB LEU 66 10.981 -5.723 9.072 435 HB3 LEU 66 3HB LEU 66 12.373 -6.335 9.935 436 HG LEU 66 HG LEU 66 12.345 -3.929 10.033 437 HD11 LEU 66 1HD1 LEU 66 14.508 -5.052 9.906 438 HD12 LEU 66 2HD1 LEU 66 14.559 -3.431 9.212 439 HD13 LEU 66 3HD1 LEU 66 14.512 -4.843 8.155 440 HD21 LEU 66 3HD2 LEU 66 12.530 -2.526 8.046 441 HD22 LEU 66 1HD2 LEU 66 11.045 -3.473 8.009 442 HD23 LEU 66 2HD2 LEU 66 12.418 -3.953 7.014 443 H GLY 67 H GLY 67 10.611 -8.206 7.056 444 HA2 GLY 67 2HA GLY 67 10.717 -10.628 6.819 445 HA3 GLY 67 3HA GLY 67 11.865 -10.651 8.149 446 H ASN 68 H ASN 68 9.430 -8.540 8.773 447 HA ASN 68 HA ASN 68 7.699 -10.517 10.097 448 HB2 ASN 68 2HB ASN 68 7.676 -9.238 12.198 449 HB3 ASN 68 3HB ASN 68 9.303 -9.778 11.816 450 HD21 ASN 68 1HD2 ASN 68 8.485 -7.622 13.529 451 HD22 ASN 68 2HD2 ASN 68 9.194 -6.179 12.895 452 H ASN 69 H ASN 69 7.165 -9.140 7.748 453 HA ASN 69 HA ASN 69 5.535 -7.998 6.676 454 HB2 ASN 69 2HB ASN 69 4.299 -7.997 9.424 455 HB3 ASN 69 3HB ASN 69 3.521 -7.215 8.053 456 HD21 ASN 69 1HD2 ASN 69 2.768 -9.535 9.708 457 HD22 ASN 69 2HD2 ASN 69 2.498 -10.822 8.579 458 H SER 70 H SER 70 7.563 -6.624 8.818 459 HA SER 70 HA SER 70 6.600 -3.913 8.466 460 HB2 SER 70 2HB SER 70 9.123 -4.875 9.838 461 HB3 SER 70 3HB SER 70 8.397 -3.278 9.978 462 HG SER 70 HG SER 70 6.827 -5.511 10.632 463 H TYR 71 H TYR 71 7.393 -2.531 6.994 464 HA TYR 71 HA TYR 71 9.718 -3.406 5.392 465 HB2 TYR 71 2HB TYR 71 7.197 -2.014 4.469 466 HB3 TYR 71 3HB TYR 71 8.619 -2.256 3.472 467 HD1 TYR 71 HD1 TYR 71 5.897 -4.016 5.255 468 HD2 TYR 71 HD2 TYR 71 8.973 -4.303 2.333 469 HE1 TYR 71 HE1 TYR 71 4.996 -6.181 4.525 470 HE2 TYR 71 HE2 TYR 71 8.073 -6.466 1.594 471 HH TYR 71 HH TYR 71 6.700 -8.248 2.359 472 H GLU 72 H GLU 72 11.330 -1.920 5.188 473 HA GLU 72 HA GLU 72 10.867 0.729 6.302 474 HB2 GLU 72 2HB GLU 72 13.029 -0.427 6.785 475 HB3 GLU 72 3HB GLU 72 13.408 -0.364 5.064 476 HG2 GLU 72 2HG GLU 72 13.341 2.081 5.132 477 HG3 GLU 72 3HG GLU 72 12.946 2.020 6.845 478 H VAL 73 H VAL 73 10.317 2.396 5.153 479 HA VAL 73 HA VAL 73 10.162 2.121 2.260 480 HB VAL 73 HB VAL 73 8.781 3.901 4.248 481 HG11 VAL 73 1HG1 VAL 73 9.107 5.310 2.377 482 HG12 VAL 73 2HG1 VAL 73 7.450 4.709 2.261 483 HG13 VAL 73 3HG1 VAL 73 8.719 4.020 1.246 484 HG21 VAL 73 3HG2 VAL 73 7.824 1.714 2.408 485 HG22 VAL 73 1HG2 VAL 73 6.775 2.746 3.385 486 HG23 VAL 73 2HG2 VAL 73 7.925 1.664 4.167 487 H GLU 74 H GLU 74 11.375 3.195 0.944 488 HA GLU 74 HA GLU 74 12.599 5.758 1.714 489 HB2 GLU 74 2HB GLU 74 13.797 3.524 0.057 490 HB3 GLU 74 3HB GLU 74 14.499 5.129 0.208 491 HG2 GLU 74 2HG GLU 74 14.774 4.783 2.608 492 HG3 GLU 74 3HG GLU 74 14.055 3.184 2.463 493 H ASN 75 H ASN 75 11.868 7.389 0.408 494 HA ASN 75 HA ASN 75 10.575 6.604 -2.103 495 HB2 ASN 75 2HB ASN 75 10.047 8.923 -0.254 496 HB3 ASN 75 3HB ASN 75 9.368 8.822 -1.869 497 HD21 ASN 75 1HD2 ASN 75 7.928 8.911 0.590 498 HD22 ASN 75 2HD2 ASN 75 7.022 7.445 0.694 499 H GLN 76 H GLN 76 10.723 7.917 -3.920 500 HA GLN 76 HA GLN 76 13.082 9.687 -4.043 501 HB2 GLN 76 2HB GLN 76 13.472 7.432 -5.029 502 HB3 GLN 76 3HB GLN 76 12.135 7.717 -6.126 503 HG2 GLN 76 2HG GLN 76 13.363 9.606 -7.095 504 HG3 GLN 76 3HG GLN 76 14.725 9.239 -6.033 505 HE21 GLN 76 1HE2 GLN 76 16.150 8.711 -7.646 506 HE22 GLN 76 2HE2 GLN 76 15.955 7.318 -8.651 507 H TRP 77 H TRP 77 12.550 11.685 -4.853 508 HA TRP 77 HA TRP 77 10.124 11.846 -6.483 509 HB2 TRP 77 2HB TRP 77 9.708 14.118 -5.358 510 HB3 TRP 77 3HB TRP 77 9.291 12.660 -4.471 511 HD1 TRP 77 HD1 TRP 77 12.126 15.310 -4.579 512 HE1 TRP 77 HE1 TRP 77 13.105 15.501 -2.204 513 HE3 TRP 77 HE3 TRP 77 9.471 11.581 -2.294 514 HZ2 TRP 77 HZ2 TRP 77 12.802 14.243 0.303 515 HZ3 TRP 77 HZ3 TRP 77 9.875 11.143 0.095 516 HH2 TRP 77 HH2 TRP 77 11.503 12.450 1.360 517 H GLY 78 H GLY 78 13.294 12.245 -6.604 518 HA2 GLY 78 2HA GLY 78 13.383 14.772 -8.021 519 HA3 GLY 78 3HA GLY 78 14.728 13.664 -7.780 520 H GLY 79 H GLY 79 12.325 11.788 -8.816 521 HA2 GLY 79 2HA GLY 79 11.413 11.389 -10.996 522 HA3 GLY 79 3HA GLY 79 12.806 12.224 -11.685 523 H ASP 80 H ASP 80 13.160 10.262 -13.029 524 HA ASP 80 HA ASP 80 13.880 7.831 -11.890 525 HB2 ASP 80 2HB ASP 80 14.571 9.206 -14.465 526 HB3 ASP 80 3HB ASP 80 15.430 7.735 -14.021 527 H SER 81 H SER 81 15.584 10.802 -12.302 528 HA SER 81 HA SER 81 18.090 9.766 -11.335 529 HB2 SER 81 2HB SER 81 17.189 12.605 -11.885 530 HB3 SER 81 3HB SER 81 18.845 12.092 -11.548 531 HG SER 81 HG SER 81 18.168 10.572 -13.488 532 H ALA 82 H ALA 82 19.025 11.533 -9.609 533 HA ALA 82 HA ALA 82 19.085 12.338 -7.511 534 HB1 ALA 82 3HB ALA 82 16.077 12.073 -7.471 535 HB2 ALA 82 1HB ALA 82 16.974 13.502 -7.979 536 HB3 ALA 82 2HB ALA 82 17.056 12.956 -6.301 537 HA PRO 83 HA PRO 83 19.374 8.644 -5.123 538 HB2 PRO 83 2HB PRO 83 19.884 9.684 -2.692 539 HB3 PRO 83 3HB PRO 83 21.063 9.771 -4.006 540 HG2 PRO 83 2HG PRO 83 19.140 11.863 -3.056 541 HG3 PRO 83 3HG PRO 83 20.854 12.036 -3.455 542 HD2 PRO 83 2HD PRO 83 18.902 12.723 -5.181 543 HD3 PRO 83 3HD PRO 83 20.459 12.077 -5.731 544 H TRP 84 H TRP 84 18.432 7.611 -3.097 545 HA TRP 84 HA TRP 84 15.599 8.219 -3.013 546 HB2 TRP 84 2HB TRP 84 17.235 5.922 -1.922 547 HB3 TRP 84 3HB TRP 84 15.502 6.096 -1.661 548 HD1 TRP 84 HD1 TRP 84 18.036 5.403 -4.473 549 HE1 TRP 84 HE1 TRP 84 16.813 4.246 -6.403 550 HE3 TRP 84 HE3 TRP 84 13.256 5.745 -2.708 551 HZ2 TRP 84 HZ2 TRP 84 14.143 3.541 -7.088 552 HZ3 TRP 84 HZ3 TRP 84 11.427 4.804 -4.058 553 HH2 TRP 84 HH2 TRP 84 11.870 3.730 -6.203 554 H HIS 85 H HIS 85 14.493 8.726 -1.096 555 HA HIS 85 HA HIS 85 16.243 9.611 1.110 556 HB2 HIS 85 2HB HIS 85 13.643 10.819 0.133 557 HB3 HIS 85 3HB HIS 85 14.506 11.334 1.576 558 HD1 HIS 85 HD1 HIS 85 16.752 12.618 1.211 559 HD2 HIS 85 HD2 HIS 85 14.651 11.771 -2.277 560 HE1 HIS 85 HE1 HIS 85 17.791 14.059 -0.568 561 H SER 86 H SER 86 15.575 9.153 3.217 562 HA SER 86 HA SER 86 14.101 6.793 3.569 563 HB2 SER 86 2HB SER 86 14.762 8.873 5.669 564 HB3 SER 86 3HB SER 86 14.457 7.153 5.930 565 HG SER 86 HG SER 86 16.371 6.659 4.985 566 H GLY 87 H GLY 87 12.022 6.408 4.116 567 HA2 GLY 87 2HA GLY 87 10.226 8.757 4.235 568 HA3 GLY 87 3HA GLY 87 9.778 7.194 3.563 569 H GLY 88 H GLY 88 10.567 5.419 5.460 570 HA2 GLY 88 2HA GLY 88 10.323 5.785 8.112 571 HA3 GLY 88 3HA GLY 88 8.663 6.015 7.590 572 H ASN 89 H ASN 89 8.431 4.112 9.110 573 HA ASN 89 HA ASN 89 9.005 1.592 7.682 574 HB2 ASN 89 2HB ASN 89 8.481 2.054 10.633 575 HB3 ASN 89 3HB ASN 89 8.745 0.485 9.890 576 HD21 ASN 89 1HD2 ASN 89 10.800 -0.120 9.308 577 HD22 ASN 89 2HD2 ASN 89 12.209 0.766 9.775 578 H TRP 90 H TRP 90 7.294 0.669 6.712 579 HA TRP 90 HA TRP 90 4.604 1.293 7.730 580 HB2 TRP 90 2HB TRP 90 5.558 0.524 4.957 581 HB3 TRP 90 3HB TRP 90 3.861 0.639 5.399 582 HD1 TRP 90 HD1 TRP 90 6.083 3.373 6.812 583 HE1 TRP 90 HE1 TRP 90 5.649 5.565 5.550 584 HE3 TRP 90 HE3 TRP 90 3.190 1.559 2.985 585 HZ2 TRP 90 HZ2 TRP 90 4.248 6.421 3.251 586 HZ3 TRP 90 HZ3 TRP 90 2.339 3.128 1.320 587 HH2 TRP 90 HH2 TRP 90 2.852 5.502 1.442 588 H ILE 91 H ILE 91 3.035 -0.451 7.679 589 HA ILE 91 HA ILE 91 4.294 -3.129 7.887 590 HB ILE 91 HB ILE 91 1.691 -2.194 9.151 591 HG12 ILE 91 2HG1 ILE 91 3.636 -1.164 10.249 592 HG13 ILE 91 3HG1 ILE 91 2.862 -2.335 11.304 593 HG21 ILE 91 1HG2 ILE 91 3.194 -4.794 9.508 594 HG22 ILE 91 2HG2 ILE 91 1.721 -4.584 8.565 595 HG23 ILE 91 3HG2 ILE 91 1.693 -4.335 10.313 596 HD11 ILE 91 3HD1 ILE 91 4.593 -3.951 10.831 597 HD12 ILE 91 1HD1 ILE 91 5.298 -2.440 11.404 598 HD13 ILE 91 2HD1 ILE 91 5.345 -2.836 9.690 599 H LEU 92 H LEU 92 3.857 -4.417 6.141 600 HA LEU 92 HA LEU 92 1.230 -4.109 4.860 601 HB2 LEU 92 2HB LEU 92 3.842 -4.520 3.402 602 HB3 LEU 92 3HB LEU 92 2.256 -4.445 2.664 603 HG LEU 92 HG LEU 92 3.604 -2.153 4.103 604 HD11 LEU 92 1HD1 LEU 92 3.203 -2.642 1.157 605 HD12 LEU 92 2HD1 LEU 92 4.739 -2.723 2.018 606 HD13 LEU 92 3HD1 LEU 92 3.888 -1.187 1.883 607 HD21 LEU 92 3HD2 LEU 92 1.802 -0.798 3.114 608 HD22 LEU 92 1HD2 LEU 92 1.185 -2.007 4.236 609 HD23 LEU 92 2HD2 LEU 92 1.049 -2.269 2.498 610 H GLY 93 H GLY 93 0.583 -5.922 6.117 611 HA2 GLY 93 2HA GLY 93 0.398 -8.303 4.797 612 HA3 GLY 93 3HA GLY 93 1.812 -8.489 5.826 613 H SER 94 H SER 94 -1.482 -8.860 5.640 614 HA SER 94 HA SER 94 -2.015 -8.430 8.463 615 HB2 SER 94 2HB SER 94 -4.309 -9.192 7.900 616 HB3 SER 94 3HB SER 94 -3.768 -7.865 6.866 617 HG SER 94 HG SER 94 -4.772 -10.026 6.014 618 H ARG 95 H ARG 95 -0.718 -10.839 6.597 619 HA ARG 95 HA ARG 95 -1.474 -12.936 8.507 620 HB2 ARG 95 2HB ARG 95 -0.619 -13.123 5.616 621 HB3 ARG 95 3HB ARG 95 -0.764 -14.523 6.675 622 HG2 ARG 95 2HG ARG 95 -3.130 -14.109 6.963 623 HG3 ARG 95 3HG ARG 95 -3.020 -12.627 6.022 624 HD2 ARG 95 2HD ARG 95 -2.376 -13.914 4.053 625 HD3 ARG 95 3HD ARG 95 -2.444 -15.403 4.988 626 HE ARG 95 HE ARG 95 -4.922 -14.387 5.321 627 HH11 ARG 95 1HH1 ARG 95 -2.979 -14.941 2.450 628 HH12 ARG 95 2HH1 ARG 95 -4.328 -15.261 1.427 629 HH21 ARG 95 1HH2 ARG 95 -6.722 -14.855 3.970 630 HH22 ARG 95 2HH2 ARG 95 -6.477 -15.240 2.297 631 H GLU 96 H GLU 96 0.268 -14.484 9.031 632 HA GLU 96 HA GLU 96 2.481 -12.911 9.967 633 HB2 GLU 96 2HB GLU 96 3.212 -15.029 11.083 634 HB3 GLU 96 3HB GLU 96 1.576 -14.512 11.476 635 HG2 GLU 96 2HG GLU 96 0.703 -16.154 9.865 636 HG3 GLU 96 3HG GLU 96 2.351 -16.684 9.542 637 H ASN 97 H ASN 97 2.348 -15.785 7.838 638 HA ASN 97 HA ASN 97 5.092 -15.118 6.974 639 HB2 ASN 97 2HB ASN 97 3.721 -17.804 7.180 640 HB3 ASN 97 3HB ASN 97 5.248 -17.568 6.344 641 HD21 ASN 97 1HD2 ASN 97 4.671 -19.217 8.644 642 HD22 ASN 97 2HD2 ASN 97 5.700 -18.657 9.912 643 H GLN 98 H GLN 98 2.808 -13.911 5.798 644 HA GLN 98 HA GLN 98 2.621 -15.324 3.232 645 HB2 GLN 98 2HB GLN 98 0.550 -14.590 4.594 646 HB3 GLN 98 3HB GLN 98 0.935 -12.971 4.022 647 HG2 GLN 98 2HG GLN 98 -0.734 -13.939 2.602 648 HG3 GLN 98 3HG GLN 98 0.777 -13.786 1.708 649 HE21 GLN 98 1HE2 GLN 98 0.112 -15.370 0.239 650 HE22 GLN 98 2HE2 GLN 98 0.099 -17.043 0.655 651 H ASN 99 H ASN 99 2.764 -11.937 4.379 652 HA ASN 99 HA ASN 99 4.084 -10.159 3.790 653 HB2 ASN 99 2HB ASN 99 5.542 -12.163 2.041 654 HB3 ASN 99 3HB ASN 99 6.030 -10.482 2.226 655 HD21 ASN 99 1HD2 ASN 99 7.418 -12.977 2.875 656 HD22 ASN 99 2HD2 ASN 99 7.834 -12.885 4.548 657 H VAL 100 H VAL 100 3.644 -8.467 2.469 658 HA VAL 100 HA VAL 100 1.889 -9.033 0.216 659 HB VAL 100 HB VAL 100 2.818 -6.379 1.337 660 HG11 VAL 100 1HG1 VAL 100 2.428 -6.134 -1.057 661 HG12 VAL 100 2HG1 VAL 100 1.117 -5.371 -0.151 662 HG13 VAL 100 3HG1 VAL 100 0.871 -6.943 -0.905 663 HG21 VAL 100 3HG2 VAL 100 1.276 -7.605 2.746 664 HG22 VAL 100 1HG2 VAL 100 0.169 -7.809 1.391 665 HG23 VAL 100 2HG2 VAL 100 0.480 -6.199 2.042 666 H VAL 101 H VAL 101 2.296 -8.915 -1.859 667 HA VAL 101 HA VAL 101 5.074 -8.274 -2.636 668 HB VAL 101 HB VAL 101 4.909 -9.774 -4.576 669 HG11 VAL 101 1HG1 VAL 101 4.381 -11.053 -1.907 670 HG12 VAL 101 2HG1 VAL 101 5.946 -10.557 -2.552 671 HG13 VAL 101 3HG1 VAL 101 5.050 -11.871 -3.318 672 HG21 VAL 101 3HG2 VAL 101 2.479 -9.760 -4.872 673 HG22 VAL 101 1HG2 VAL 101 2.286 -10.646 -3.363 674 HG23 VAL 101 2HG2 VAL 101 3.098 -11.409 -4.728 675 H ALA 102 H ALA 102 1.724 -7.729 -3.522 676 HA ALA 102 HA ALA 102 2.696 -5.505 -5.145 677 HB1 ALA 102 3HB ALA 102 2.411 -7.492 -6.671 678 HB2 ALA 102 1HB ALA 102 1.500 -6.049 -7.117 679 HB3 ALA 102 2HB ALA 102 0.684 -7.396 -6.334 680 H ILE 103 H ILE 103 1.421 -3.747 -5.109 681 HA ILE 103 HA ILE 103 -1.289 -4.037 -4.003 682 HB ILE 103 HB ILE 103 0.713 -1.898 -3.218 683 HG12 ILE 103 2HG1 ILE 103 -0.667 -3.958 -1.481 684 HG13 ILE 103 3HG1 ILE 103 0.981 -4.112 -2.083 685 HG21 ILE 103 1HG2 ILE 103 -2.187 -2.189 -2.451 686 HG22 ILE 103 2HG2 ILE 103 -1.484 -0.928 -3.462 687 HG23 ILE 103 3HG2 ILE 103 -1.058 -1.026 -1.754 688 HD11 ILE 103 3HD1 ILE 103 0.971 -3.329 0.212 689 HD12 ILE 103 1HD1 ILE 103 -0.041 -1.956 -0.242 690 HD13 ILE 103 2HD1 ILE 103 1.605 -2.084 -0.860 691 H ASN 104 H ASN 104 -2.737 -3.188 -5.330 692 HA ASN 104 HA ASN 104 -1.976 -0.832 -6.914 693 HB2 ASN 104 2HB ASN 104 -2.209 -2.772 -8.390 694 HB3 ASN 104 3HB ASN 104 -3.812 -3.095 -7.744 695 HD21 ASN 104 1HD2 ASN 104 -4.736 -2.926 -9.785 696 HD22 ASN 104 2HD2 ASN 104 -4.951 -1.399 -10.569 697 H VAL 105 H VAL 105 -2.849 0.717 -5.835 698 HA VAL 105 HA VAL 105 -5.731 0.653 -5.255 699 HB VAL 105 HB VAL 105 -5.458 1.597 -2.976 700 HG11 VAL 105 1HG1 VAL 105 -4.285 -1.130 -3.474 701 HG12 VAL 105 2HG1 VAL 105 -5.975 -0.723 -3.164 702 HG13 VAL 105 3HG1 VAL 105 -4.774 -0.532 -1.889 703 HG21 VAL 105 3HG2 VAL 105 -2.564 0.850 -3.353 704 HG22 VAL 105 1HG2 VAL 105 -3.294 1.338 -1.826 705 HG23 VAL 105 2HG2 VAL 105 -3.203 2.480 -3.172 706 H GLU 106 H GLU 106 -6.772 2.539 -5.400 707 HA GLU 106 HA GLU 106 -5.242 5.019 -5.497 708 HB2 GLU 106 2HB GLU 106 -5.382 4.218 -7.832 709 HB3 GLU 106 3HB GLU 106 -7.129 4.144 -7.704 710 HG2 GLU 106 2HG GLU 106 -7.199 6.571 -7.354 711 HG3 GLU 106 3HG GLU 106 -5.445 6.632 -7.505 712 H SER 107 H SER 107 -6.435 6.801 -4.902 713 HA SER 107 HA SER 107 -9.296 6.592 -4.552 714 HB2 SER 107 2HB SER 107 -9.107 7.322 -2.123 715 HB3 SER 107 3HB SER 107 -8.653 5.646 -2.453 716 HG SER 107 HG SER 107 -6.429 6.619 -2.643 717 H GLY 108 H GLY 108 -10.299 8.631 -4.209 718 HA2 GLY 108 2HA GLY 108 -8.524 10.964 -4.531 719 HA3 GLY 108 3HA GLY 108 -9.961 10.768 -5.527 720 H ASP 109 H ASP 109 -10.244 9.579 -2.395 721 HA ASP 109 HA ASP 109 -12.024 11.770 -1.652 722 HB2 ASP 109 2HB ASP 109 -12.785 10.179 0.124 723 HB3 ASP 109 3HB ASP 109 -12.979 9.547 -1.510 724 H ASP 110 H ASP 110 -9.045 11.820 -1.556 725 HA ASP 110 HA ASP 110 -7.512 12.964 -0.332 726 HB2 ASP 110 2HB ASP 110 -9.758 13.136 1.636 727 HB3 ASP 110 3HB ASP 110 -8.127 13.549 2.152 728 H GLY 111 H GLY 111 -8.315 9.946 -0.086 729 HA2 GLY 111 2HA GLY 111 -6.768 8.263 0.468 730 HA3 GLY 111 3HA GLY 111 -5.933 9.410 1.480 731 H GLN 112 H GLN 112 -9.255 9.415 2.062 732 HA GLN 112 HA GLN 112 -8.841 8.321 4.658 733 HB2 GLN 112 2HB GLN 112 -11.379 9.121 3.230 734 HB3 GLN 112 3HB GLN 112 -11.309 8.616 4.917 735 HG2 GLN 112 2HG GLN 112 -9.816 10.469 5.425 736 HG3 GLN 112 3HG GLN 112 -9.858 10.975 3.738 737 HE21 GLN 112 1HE2 GLN 112 -10.609 12.407 6.148 738 HE22 GLN 112 2HE2 GLN 112 -12.256 12.879 5.932 739 H THR 113 H THR 113 -10.337 7.127 1.686 740 HA THR 113 HA THR 113 -10.092 4.433 2.811 741 HB THR 113 HB THR 113 -12.105 3.842 1.309 742 HG1 THR 113 HG1 THR 113 -11.949 6.523 0.905 743 HG21 THR 113 3HG2 THR 113 -12.529 5.568 3.758 744 HG22 THR 113 1HG2 THR 113 -12.258 3.825 3.742 745 HG23 THR 113 2HG2 THR 113 -13.732 4.491 3.045 746 H LEU 114 H LEU 114 -8.498 3.498 1.730 747 HA LEU 114 HA LEU 114 -8.024 4.188 -1.068 748 HB2 LEU 114 2HB LEU 114 -6.434 2.495 0.867 749 HB3 LEU 114 3HB LEU 114 -5.979 2.733 -0.805 750 HG LEU 114 HG LEU 114 -5.905 5.234 -0.239 751 HD11 LEU 114 1HD1 LEU 114 -5.802 4.105 2.551 752 HD12 LEU 114 2HD1 LEU 114 -7.074 5.130 1.884 753 HD13 LEU 114 3HD1 LEU 114 -5.446 5.775 2.097 754 HD21 LEU 114 3HD2 LEU 114 -3.915 3.970 -0.700 755 HD22 LEU 114 1HD2 LEU 114 -3.918 3.292 0.929 756 HD23 LEU 114 2HD2 LEU 114 -3.617 5.014 0.689 757 H ASN 115 H ASN 115 -9.050 3.071 -2.549 758 HA ASN 115 HA ASN 115 -9.792 0.295 -1.952 759 HB2 ASN 115 2HB ASN 115 -11.036 2.258 -3.890 760 HB3 ASN 115 3HB ASN 115 -11.524 0.576 -3.717 761 HD21 ASN 115 1HD2 ASN 115 -11.690 3.745 -2.409 762 HD22 ASN 115 2HD2 ASN 115 -12.816 3.396 -1.151 763 H GLY 116 H GLY 116 -9.366 -1.327 -3.403 764 HA2 GLY 116 2HA GLY 116 -8.651 -1.100 -6.040 765 HA3 GLY 116 3HA GLY 116 -7.154 -0.872 -5.150 766 H THR 117 H THR 117 -6.098 -2.646 -5.549 767 HA THR 117 HA THR 117 -7.220 -5.215 -4.724 768 HB THR 117 HB THR 117 -6.160 -6.297 -6.719 769 HG1 THR 117 HG1 THR 117 -5.755 -3.585 -7.388 770 HG21 THR 117 3HG2 THR 117 -7.939 -5.735 -8.297 771 HG22 THR 117 1HG2 THR 117 -8.302 -4.265 -7.390 772 HG23 THR 117 2HG2 THR 117 -8.587 -5.843 -6.661 773 H MET 118 H MET 118 -5.502 -6.828 -4.387 774 HA MET 118 HA MET 118 -2.802 -5.804 -4.211 775 HB2 MET 118 2HB MET 118 -2.540 -6.400 -1.869 776 HB3 MET 118 3HB MET 118 -3.761 -5.152 -2.067 777 HG2 MET 118 2HG MET 118 -5.520 -6.657 -1.675 778 HG3 MET 118 3HG MET 118 -4.462 -8.053 -1.864 779 HE1 MET 118 3HE MET 118 -1.906 -7.216 -0.244 780 HE2 MET 118 1HE MET 118 -2.688 -8.795 -0.169 781 HE3 MET 118 2HE MET 118 -2.281 -7.937 1.318 782 H THR 119 H THR 119 -1.257 -7.496 -3.637 783 HA THR 119 HA THR 119 -2.255 -10.211 -4.143 784 HB THR 119 HB THR 119 0.212 -9.052 -5.455 785 HG1 THR 119 HG1 THR 119 -2.421 -8.874 -6.132 786 HG21 THR 119 3HG2 THR 119 -1.307 -11.620 -5.948 787 HG22 THR 119 1HG2 THR 119 0.236 -11.493 -5.103 788 HG23 THR 119 2HG2 THR 119 0.127 -11.082 -6.818 789 H TYR 120 H TYR 120 -1.377 -11.702 -2.819 790 HA TYR 120 HA TYR 120 0.833 -10.932 -1.056 791 HB2 TYR 120 2HB TYR 120 -1.395 -12.911 -0.874 792 HB3 TYR 120 3HB TYR 120 0.108 -13.274 -0.042 793 HD1 TYR 120 HD2 TYR 120 1.023 -11.249 1.412 794 HD2 TYR 120 HD1 TYR 120 -3.043 -11.820 0.321 795 HE1 TYR 120 HE2 TYR 120 0.333 -9.885 3.329 796 HE2 TYR 120 HE1 TYR 120 -3.756 -10.461 2.249 797 HH TYR 120 HH TYR 120 -2.953 -9.670 4.357 798 H ALA 121 H ALA 121 2.523 -12.538 -0.644 799 HA ALA 121 HA ALA 121 3.658 -13.508 -3.023 800 HB1 ALA 121 3HB ALA 121 4.998 -12.950 -1.075 801 HB2 ALA 121 1HB ALA 121 5.309 -14.613 -1.574 802 HB3 ALA 121 2HB ALA 121 4.279 -14.284 -0.178 803 H GLY 122 H GLY 122 3.263 -15.259 -4.203 804 HA2 GLY 122 2HA GLY 122 2.620 -17.373 -4.816 805 HA3 GLY 122 3HA GLY 122 2.759 -17.837 -3.128 806 H GLU 123 H GLU 123 0.606 -15.282 -4.183 807 HA GLU 123 HA GLU 123 -1.686 -17.083 -3.974 808 HB2 GLU 123 2HB GLU 123 -1.175 -16.202 -1.708 809 HB3 GLU 123 3HB GLU 123 -1.367 -14.571 -2.329 810 HG2 GLU 123 2HG GLU 123 -3.706 -14.977 -2.771 811 HG3 GLU 123 3HG GLU 123 -3.529 -16.662 -2.274 812 H GLY 124 H GLY 124 -3.670 -16.134 -4.814 813 HA2 GLY 124 2HA GLY 124 -3.143 -14.501 -7.122 814 HA3 GLY 124 3HA GLY 124 -4.691 -15.186 -6.657 815 HA PRO 125 HA PRO 125 -4.266 -10.491 -5.733 816 HB2 PRO 125 2HB PRO 125 -6.123 -10.158 -8.002 817 HB3 PRO 125 3HB PRO 125 -4.650 -9.258 -7.623 818 HG2 PRO 125 2HG PRO 125 -4.739 -10.998 -9.665 819 HG3 PRO 125 3HG PRO 125 -3.283 -10.781 -8.670 820 HD2 PRO 125 2HD PRO 125 -5.339 -12.958 -8.584 821 HD3 PRO 125 3HD PRO 125 -3.571 -13.070 -8.441 822 H ILE 126 H ILE 126 -5.690 -9.542 -4.449 823 HA ILE 126 HA ILE 126 -8.491 -10.409 -4.489 824 HB ILE 126 HB ILE 126 -8.526 -10.367 -2.007 825 HG12 ILE 126 2HG1 ILE 126 -5.518 -10.156 -2.240 826 HG13 ILE 126 3HG1 ILE 126 -6.586 -8.871 -1.689 827 HG21 ILE 126 1HG2 ILE 126 -8.309 -12.512 -3.079 828 HG22 ILE 126 2HG2 ILE 126 -7.288 -12.488 -1.639 829 HG23 ILE 126 3HG2 ILE 126 -6.563 -12.306 -3.232 830 HD11 ILE 126 3HD1 ILE 126 -7.243 -10.246 0.223 831 HD12 ILE 126 1HD1 ILE 126 -5.499 -9.967 0.176 832 HD13 ILE 126 2HD1 ILE 126 -6.159 -11.522 -0.334 833 H GLY 127 H GLY 127 -9.958 -8.836 -3.512 834 HA2 GLY 127 2HA GLY 127 -9.322 -6.160 -4.255 835 HA3 GLY 127 3HA GLY 127 -10.777 -6.689 -3.430 836 H PHE 128 H PHE 128 -8.841 -4.409 -3.056 837 HA PHE 128 HA PHE 128 -8.196 -4.895 -0.221 838 HB2 PHE 128 2HB PHE 128 -6.156 -4.695 -1.566 839 HB3 PHE 128 3HB PHE 128 -6.719 -3.154 -2.205 840 HD1 PHE 128 HD1 PHE 128 -5.394 -4.879 0.743 841 HD2 PHE 128 HD2 PHE 128 -6.572 -1.144 -0.906 842 HE1 PHE 128 HE1 PHE 128 -4.296 -3.716 2.603 843 HE2 PHE 128 HE2 PHE 128 -5.476 0.026 0.961 844 HZ PHE 128 HZ PHE 128 -4.338 -1.254 2.714 845 H LYS 129 H LYS 129 -9.006 -3.540 1.222 846 HA LYS 129 HA LYS 129 -9.912 -0.896 0.365 847 HB2 LYS 129 2HB LYS 129 -11.899 -2.296 0.435 848 HB3 LYS 129 3HB LYS 129 -11.477 -2.856 2.044 849 HG2 LYS 129 2HG LYS 129 -11.829 -0.621 2.936 850 HG3 LYS 129 3HG LYS 129 -12.202 -0.030 1.313 851 HD2 LYS 129 2HD LYS 129 -14.113 -1.545 1.194 852 HD3 LYS 129 3HD LYS 129 -13.741 -2.157 2.806 853 HE2 LYS 129 2HE LYS 129 -14.395 0.720 2.177 854 HE3 LYS 129 3HE LYS 129 -15.572 -0.463 2.743 855 HZ1 LYS 129 3HZ LYS 129 -14.807 0.762 4.614 856 HZ2 LYS 129 1HZ LYS 129 -13.183 0.515 4.219 857 HZ3 LYS 129 2HZ LYS 129 -14.128 -0.789 4.720 858 H GLY 130 H GLY 130 -8.515 0.323 1.382 859 HA2 GLY 130 2HA GLY 130 -7.812 -0.312 4.166 860 HA3 GLY 130 3HA GLY 130 -6.927 0.789 3.111 861 H THR 131 H THR 131 -8.544 0.890 5.809 862 HA THR 131 HA THR 131 -9.904 3.402 5.117 863 HB THR 131 HB THR 131 -10.706 1.471 7.315 864 HG1 THR 131 HG1 THR 131 -11.026 0.864 4.986 865 HG21 THR 131 3HG2 THR 131 -12.751 2.846 7.411 866 HG22 THR 131 1HG2 THR 131 -12.089 3.914 6.174 867 HG23 THR 131 2HG2 THR 131 -11.321 3.813 7.761 868 H LEU 132 H LEU 132 -9.272 5.177 6.252 869 HA LEU 132 HA LEU 132 -6.937 5.058 7.844 870 HB2 LEU 132 2HB LEU 132 -7.548 6.943 6.348 871 HB3 LEU 132 3HB LEU 132 -8.910 7.306 7.384 872 HG LEU 132 HG LEU 132 -6.840 8.800 7.538 873 HD11 LEU 132 1HD1 LEU 132 -7.947 7.562 10.050 874 HD12 LEU 132 2HD1 LEU 132 -8.613 8.936 9.163 875 HD13 LEU 132 3HD1 LEU 132 -7.046 9.077 9.959 876 HD21 LEU 132 3HD2 LEU 132 -5.799 6.455 9.120 877 HD22 LEU 132 1HD2 LEU 132 -5.049 8.043 9.003 878 HD23 LEU 132 2HD2 LEU 132 -5.164 7.018 7.573 879 H THR 133 H THR 133 -6.669 5.102 10.049 880 HA THR 133 HA THR 133 -9.067 5.259 11.693 881 HB THR 133 HB THR 133 -6.806 3.268 12.080 882 HG1 THR 133 HG1 THR 133 -8.639 3.142 10.306 883 HG21 THR 133 3HG2 THR 133 -9.492 3.574 13.451 884 HG22 THR 133 1HG2 THR 133 -7.919 3.918 14.168 885 HG23 THR 133 2HG2 THR 133 -8.346 2.263 13.736 Start of MODEL 9 1 H1 ALA 2 1H ALA 2 0.188 7.669 9.781 2 H2 ALA 2 2H ALA 2 0.141 6.131 9.089 3 H3 ALA 2 3H ALA 2 0.463 6.300 10.738 4 HA ALA 2 HA ALA 2 -1.753 7.195 11.090 5 HB1 ALA 2 3HB ALA 2 -3.397 7.057 9.295 6 HB2 ALA 2 1HB ALA 2 -2.160 6.455 8.192 7 HB3 ALA 2 2HB ALA 2 -2.056 8.097 8.821 8 H LEU 3 H LEU 3 -3.805 5.443 10.092 9 HA LEU 3 HA LEU 3 -2.820 2.783 10.601 10 HB2 LEU 3 2HB LEU 3 -3.233 3.909 12.867 11 HB3 LEU 3 3HB LEU 3 -4.928 3.924 12.444 12 HG LEU 3 HG LEU 3 -4.220 2.079 14.001 13 HD11 LEU 3 1HD1 LEU 3 -6.294 1.906 12.758 14 HD12 LEU 3 2HD1 LEU 3 -5.524 0.329 12.916 15 HD13 LEU 3 3HD1 LEU 3 -5.434 1.203 11.389 16 HD21 LEU 3 3HD2 LEU 3 -3.060 0.156 13.106 17 HD22 LEU 3 1HD2 LEU 3 -2.058 1.597 12.938 18 HD23 LEU 3 2HD2 LEU 3 -2.906 0.941 11.536 19 H TYR 4 H TYR 4 -3.893 1.474 9.270 20 HA TYR 4 HA TYR 4 -6.536 2.356 8.325 21 HB2 TYR 4 2HB TYR 4 -4.274 1.064 6.840 22 HB3 TYR 4 3HB TYR 4 -5.924 0.995 6.242 23 HD1 TYR 4 HD1 TYR 4 -3.147 3.300 7.094 24 HD2 TYR 4 HD2 TYR 4 -6.891 2.824 5.139 25 HE1 TYR 4 HE1 TYR 4 -2.851 5.485 5.999 26 HE2 TYR 4 HE2 TYR 4 -6.607 4.997 4.038 27 HH TYR 4 HH TYR 4 -5.427 6.993 4.209 28 H ASN 5 H ASN 5 -8.138 0.953 8.186 29 HA ASN 5 HA ASN 5 -7.795 -1.670 9.417 30 HB2 ASN 5 2HB ASN 5 -10.246 -0.137 8.489 31 HB3 ASN 5 3HB ASN 5 -10.317 -1.784 9.104 32 HD21 ASN 5 1HD2 ASN 5 -9.840 1.556 9.907 33 HD22 ASN 5 2HD2 ASN 5 -9.930 1.364 11.619 34 H VAL 6 H VAL 6 -8.043 -3.589 8.274 35 HA VAL 6 HA VAL 6 -7.736 -3.212 5.393 36 HB VAL 6 HB VAL 6 -7.016 -5.571 7.131 37 HG11 VAL 6 1HG1 VAL 6 -5.897 -6.456 5.128 38 HG12 VAL 6 2HG1 VAL 6 -6.552 -5.126 4.181 39 HG13 VAL 6 3HG1 VAL 6 -7.638 -6.317 4.891 40 HG21 VAL 6 3HG2 VAL 6 -5.321 -3.524 5.727 41 HG22 VAL 6 1HG2 VAL 6 -4.724 -4.907 6.648 42 HG23 VAL 6 2HG2 VAL 6 -5.611 -3.617 7.462 43 H GLU 7 H GLU 7 -9.405 -3.485 4.206 44 HA GLU 7 HA GLU 7 -11.368 -5.563 4.886 45 HB2 GLU 7 2HB GLU 7 -11.628 -2.998 3.310 46 HB3 GLU 7 3HB GLU 7 -12.905 -4.203 3.434 47 HG2 GLU 7 2HG GLU 7 -13.101 -3.818 5.792 48 HG3 GLU 7 3HG GLU 7 -11.687 -2.767 5.781 49 H ASN 8 H ASN 8 -11.261 -7.286 3.589 50 HA ASN 8 HA ASN 8 -10.078 -6.971 0.904 51 HB2 ASN 8 2HB ASN 8 -9.840 -9.335 2.779 52 HB3 ASN 8 3HB ASN 8 -9.251 -9.301 1.125 53 HD21 ASN 8 1HD2 ASN 8 -8.403 -6.493 1.379 54 HD22 ASN 8 2HD2 ASN 8 -6.943 -6.543 2.293 55 H GLN 9 H GLN 9 -11.157 -7.813 -0.790 56 HA GLN 9 HA GLN 9 -13.584 -9.374 -0.181 57 HB2 GLN 9 2HB GLN 9 -14.042 -7.020 -0.885 58 HB3 GLN 9 3HB GLN 9 -13.262 -7.375 -2.421 59 HG2 GLN 9 2HG GLN 9 -14.956 -9.109 -2.851 60 HG3 GLN 9 3HG GLN 9 -15.753 -8.677 -1.338 61 HE21 GLN 9 1HE2 GLN 9 -17.637 -7.990 -2.222 62 HE22 GLN 9 2HE2 GLN 9 -17.769 -6.589 -3.225 63 H TRP 10 H TRP 10 -13.684 -11.292 -1.147 64 HA TRP 10 HA TRP 10 -12.423 -11.662 -3.748 65 HB2 TRP 10 2HB TRP 10 -11.576 -13.918 -2.963 66 HB3 TRP 10 3HB TRP 10 -10.727 -12.531 -2.296 67 HD1 TRP 10 HD1 TRP 10 -13.418 -15.120 -1.239 68 HE1 TRP 10 HE1 TRP 10 -13.271 -15.434 1.311 69 HE3 TRP 10 HE3 TRP 10 -9.869 -11.595 -0.178 70 HZ2 TRP 10 HZ2 TRP 10 -11.841 -14.350 3.481 71 HZ3 TRP 10 HZ3 TRP 10 -9.162 -11.305 2.161 72 HH2 TRP 10 HH2 TRP 10 -10.128 -12.650 3.953 73 H GLY 11 H GLY 11 -13.455 -13.220 -5.050 74 HA2 GLY 11 2HA GLY 11 -14.965 -15.051 -5.340 75 HA3 GLY 11 3HA GLY 11 -15.771 -14.576 -3.853 76 H GLY 12 H GLY 12 -15.105 -11.808 -5.503 77 HA2 GLY 12 2HA GLY 12 -16.297 -10.923 -7.435 78 HA3 GLY 12 3HA GLY 12 -17.672 -11.900 -6.942 79 H SER 13 H SER 13 -17.583 -9.082 -7.435 80 HA SER 13 HA SER 13 -17.566 -7.498 -5.162 81 HB2 SER 13 2HB SER 13 -17.774 -6.800 -7.600 82 HB3 SER 13 3HB SER 13 -19.499 -7.123 -7.448 83 HG SER 13 HG SER 13 -17.936 -5.114 -6.310 84 H SER 14 H SER 14 -19.846 -9.904 -6.063 85 HA SER 14 HA SER 14 -22.040 -8.884 -4.532 86 HB2 SER 14 2HB SER 14 -21.611 -11.702 -5.532 87 HB3 SER 14 3HB SER 14 -23.145 -10.930 -5.121 88 HG SER 14 HG SER 14 -22.847 -9.518 -6.867 89 H ALA 15 H ALA 15 -19.138 -10.363 -3.715 90 HA ALA 15 HA ALA 15 -20.161 -11.758 -1.373 91 HB1 ALA 15 3HB ALA 15 -17.339 -11.401 -2.395 92 HB2 ALA 15 1HB ALA 15 -18.367 -12.808 -2.655 93 HB3 ALA 15 2HB ALA 15 -17.811 -12.411 -1.028 94 HA PRO 16 HA PRO 16 -19.466 -8.353 1.353 95 HB2 PRO 16 2HB PRO 16 -19.012 -9.601 3.693 96 HB3 PRO 16 3HB PRO 16 -20.600 -9.637 2.912 97 HG2 PRO 16 2HG PRO 16 -18.421 -11.702 2.859 98 HG3 PRO 16 3HG PRO 16 -20.160 -11.925 3.146 99 HD2 PRO 16 2HD PRO 16 -19.019 -12.386 0.737 100 HD3 PRO 16 3HD PRO 16 -20.677 -11.774 0.895 101 H TRP 17 H TRP 17 -17.925 -7.315 2.674 102 HA TRP 17 HA TRP 17 -15.173 -7.875 1.892 103 HB2 TRP 17 2HB TRP 17 -16.413 -5.565 3.411 104 HB3 TRP 17 3HB TRP 17 -14.685 -5.709 3.113 105 HD1 TRP 17 HD1 TRP 17 -17.993 -5.107 1.246 106 HE1 TRP 17 HE1 TRP 17 -17.465 -3.994 -1.012 107 HE3 TRP 17 HE3 TRP 17 -12.891 -5.378 1.384 108 HZ2 TRP 17 HZ2 TRP 17 -15.168 -3.325 -2.542 109 HZ3 TRP 17 HZ3 TRP 17 -11.609 -4.493 -0.513 110 HH2 TRP 17 HH2 TRP 17 -12.724 -3.484 -2.433 111 H ASN 18 H ASN 18 -13.586 -8.637 3.265 112 HA ASN 18 HA ASN 18 -14.502 -9.376 5.956 113 HB2 ASN 18 2HB ASN 18 -12.537 -10.785 4.123 114 HB3 ASN 18 3HB ASN 18 -12.888 -11.271 5.778 115 HD21 ASN 18 1HD2 ASN 18 -14.006 -11.211 2.510 116 HD22 ASN 18 2HD2 ASN 18 -15.370 -12.248 2.730 117 H GLU 19 H GLU 19 -13.105 -8.987 7.652 118 HA GLU 19 HA GLU 19 -10.743 -7.383 6.967 119 HB2 GLU 19 2HB GLU 19 -11.120 -6.241 9.183 120 HB3 GLU 19 3HB GLU 19 -12.330 -5.911 7.953 121 HG2 GLU 19 2HG GLU 19 -13.800 -7.599 9.018 122 HG3 GLU 19 3HG GLU 19 -12.597 -7.785 10.293 123 H GLY 20 H GLY 20 -8.822 -8.228 7.585 124 HA2 GLY 20 2HA GLY 20 -8.861 -10.076 9.856 125 HA3 GLY 20 3HA GLY 20 -8.170 -10.582 8.328 126 H GLY 21 H GLY 21 -7.835 -7.308 9.625 127 HA2 GLY 21 2HA GLY 21 -5.550 -7.448 11.061 128 HA3 GLY 21 3HA GLY 21 -4.976 -7.565 9.405 129 H GLN 22 H GLN 22 -3.941 -5.564 10.576 130 HA GLN 22 HA GLN 22 -5.359 -3.239 9.525 131 HB2 GLN 22 2HB GLN 22 -4.624 -1.911 11.496 132 HB3 GLN 22 3HB GLN 22 -5.785 -3.161 11.913 133 HG2 GLN 22 2HG GLN 22 -3.910 -4.590 12.674 134 HG3 GLN 22 3HG GLN 22 -2.805 -3.256 12.345 135 HE21 GLN 22 1HE2 GLN 22 -4.756 -1.259 13.267 136 HE22 GLN 22 2HE2 GLN 22 -4.753 -1.365 14.989 137 H TRP 23 H TRP 23 -4.029 -1.814 8.478 138 HA TRP 23 HA TRP 23 -1.196 -2.609 8.330 139 HB2 TRP 23 2HB TRP 23 -3.004 -1.346 6.283 140 HB3 TRP 23 3HB TRP 23 -1.254 -1.320 6.115 141 HD1 TRP 23 HD1 TRP 23 -2.451 -4.515 7.602 142 HE1 TRP 23 HE1 TRP 23 -2.455 -6.371 5.841 143 HE3 TRP 23 HE3 TRP 23 -1.680 -1.661 3.422 144 HZ2 TRP 23 HZ2 TRP 23 -2.146 -6.604 3.050 145 HZ3 TRP 23 HZ3 TRP 23 -1.536 -2.815 1.228 146 HH2 TRP 23 HH2 TRP 23 -1.764 -5.212 1.070 147 H GLU 24 H GLU 24 0.404 -1.011 8.199 148 HA GLU 24 HA GLU 24 -0.509 1.553 9.311 149 HB2 GLU 24 2HB GLU 24 1.034 0.291 10.801 150 HB3 GLU 24 3HB GLU 24 2.254 0.332 9.532 151 HG2 GLU 24 2HG GLU 24 2.362 2.741 9.654 152 HG3 GLU 24 3HG GLU 24 1.061 2.769 10.841 153 H ILE 25 H ILE 25 -0.614 3.034 7.860 154 HA ILE 25 HA ILE 25 1.372 3.130 5.698 155 HB ILE 25 HB ILE 25 -1.608 3.624 5.441 156 HG12 ILE 25 2HG1 ILE 25 0.106 1.510 4.115 157 HG13 ILE 25 3HG1 ILE 25 -0.897 1.221 5.532 158 HG21 ILE 25 1HG2 ILE 25 -1.151 3.985 3.048 159 HG22 ILE 25 2HG2 ILE 25 0.579 3.870 3.371 160 HG23 ILE 25 3HG2 ILE 25 -0.362 5.188 4.063 161 HD11 ILE 25 3HD1 ILE 25 -2.009 0.458 3.519 162 HD12 ILE 25 1HD1 ILE 25 -1.866 2.067 2.813 163 HD13 ILE 25 2HD1 ILE 25 -2.885 1.814 4.230 164 H GLY 26 H GLY 26 2.203 5.105 5.321 165 HA2 GLY 26 2HA GLY 26 2.212 7.444 5.217 166 HA3 GLY 26 3HA GLY 26 0.783 7.479 6.237 167 H SER 27 H SER 27 4.184 7.383 6.102 168 HA SER 27 HA SER 27 4.467 7.460 9.009 169 HB2 SER 27 2HB SER 27 6.964 7.555 8.317 170 HB3 SER 27 3HB SER 27 6.082 6.045 8.084 171 HG SER 27 HG SER 27 7.263 7.636 6.258 172 H ARG 28 H ARG 28 3.482 9.608 6.988 173 HA ARG 28 HA ARG 28 5.064 11.806 8.103 174 HB2 ARG 28 2HB ARG 28 3.902 11.650 5.300 175 HB3 ARG 28 3HB ARG 28 4.683 13.060 5.998 176 HG2 ARG 28 2HG ARG 28 6.046 10.409 5.528 177 HG3 ARG 28 3HG ARG 28 6.116 11.782 4.425 178 HD2 ARG 28 2HD ARG 28 7.205 13.131 6.121 179 HD3 ARG 28 3HD ARG 28 7.051 11.828 7.299 180 HE ARG 28 HE ARG 28 8.483 11.047 4.942 181 HH11 ARG 28 1HH1 ARG 28 8.824 12.679 8.026 182 HH12 ARG 28 2HH1 ARG 28 10.499 12.298 8.197 183 HH21 ARG 28 1HH2 ARG 28 10.765 10.551 5.166 184 HH22 ARG 28 2HH2 ARG 28 11.597 11.108 6.579 185 H SER 29 H SER 29 3.812 13.056 9.308 186 HA SER 29 HA SER 29 1.049 12.608 9.585 187 HB2 SER 29 2HB SER 29 2.729 14.896 10.614 188 HB3 SER 29 3HB SER 29 1.112 14.476 11.173 189 HG SER 29 HG SER 29 1.875 12.685 12.118 190 H ASP 30 H ASP 30 2.887 15.048 7.835 191 HA ASP 30 HA ASP 30 0.601 16.720 7.359 192 HB2 ASP 30 2HB ASP 30 3.368 16.768 6.163 193 HB3 ASP 30 3HB ASP 30 2.116 17.951 5.806 194 H GLN 31 H GLN 31 2.327 14.254 5.526 195 HA GLN 31 HA GLN 31 0.358 14.634 3.409 196 HB2 GLN 31 2HB GLN 31 3.258 14.078 3.286 197 HB3 GLN 31 3HB GLN 31 2.229 13.351 2.053 198 HG2 GLN 31 2HG GLN 31 2.252 16.277 2.729 199 HG3 GLN 31 3HG GLN 31 3.179 15.542 1.417 200 HE21 GLN 31 1HE2 GLN 31 -0.050 16.190 2.607 201 HE22 GLN 31 2HE2 GLN 31 -0.839 15.996 1.078 202 H ASN 32 H ASN 32 -1.095 13.214 3.251 203 HA ASN 32 HA ASN 32 -0.603 10.501 4.177 204 HB2 ASN 32 2HB ASN 32 -2.719 11.920 4.757 205 HB3 ASN 32 3HB ASN 32 -3.234 11.521 3.124 206 HD21 ASN 32 1HD2 ASN 32 -3.769 9.382 2.623 207 HD22 ASN 32 2HD2 ASN 32 -4.040 8.191 3.850 208 H VAL 33 H VAL 33 -1.418 8.765 2.783 209 HA VAL 33 HA VAL 33 -0.427 9.158 0.063 210 HB VAL 33 HB VAL 33 -1.068 6.609 1.555 211 HG11 VAL 33 1HG1 VAL 33 -1.248 6.307 -0.841 212 HG12 VAL 33 2HG1 VAL 33 0.189 5.490 -0.226 213 HG13 VAL 33 3HG1 VAL 33 0.342 7.030 -1.071 214 HG21 VAL 33 3HG2 VAL 33 1.316 6.349 1.820 215 HG22 VAL 33 1HG2 VAL 33 0.794 7.871 2.533 216 HG23 VAL 33 2HG2 VAL 33 1.609 7.865 0.966 217 H VAL 34 H VAL 34 -1.728 9.121 -1.703 218 HA VAL 34 HA VAL 34 -4.498 8.230 -1.286 219 HB VAL 34 HB VAL 34 -5.175 9.654 -3.160 220 HG11 VAL 34 1HG1 VAL 34 -3.661 11.107 -1.004 221 HG12 VAL 34 2HG1 VAL 34 -5.316 10.503 -0.891 222 HG13 VAL 34 3HG1 VAL 34 -4.924 11.799 -2.021 223 HG21 VAL 34 3HG2 VAL 34 -2.309 10.604 -3.134 224 HG22 VAL 34 1HG2 VAL 34 -3.623 11.340 -4.051 225 HG23 VAL 34 2HG2 VAL 34 -3.099 9.699 -4.425 226 H ALA 35 H ALA 35 -1.650 7.383 -2.932 227 HA ALA 35 HA ALA 35 -3.171 5.314 -4.300 228 HB1 ALA 35 3HB ALA 35 -1.301 6.976 -5.972 229 HB2 ALA 35 1HB ALA 35 -3.042 7.269 -5.897 230 HB3 ALA 35 2HB ALA 35 -2.427 5.732 -6.497 231 H ILE 36 H ILE 36 -1.990 3.474 -4.838 232 HA ILE 36 HA ILE 36 0.847 3.462 -4.253 233 HB ILE 36 HB ILE 36 -1.077 1.611 -2.806 234 HG12 ILE 36 2HG1 ILE 36 0.879 3.606 -1.645 235 HG13 ILE 36 3HG1 ILE 36 -0.844 3.908 -1.822 236 HG21 ILE 36 1HG2 ILE 36 1.945 1.665 -2.788 237 HG22 ILE 36 2HG2 ILE 36 0.926 0.439 -3.537 238 HG23 ILE 36 3HG2 ILE 36 0.926 0.631 -1.785 239 HD11 ILE 36 3HD1 ILE 36 -0.279 3.253 0.450 240 HD12 ILE 36 1HD1 ILE 36 0.401 1.743 -0.143 241 HD13 ILE 36 2HD1 ILE 36 -1.324 2.055 -0.311 242 H ASN 37 H ASN 37 1.685 2.519 -5.987 243 HA ASN 37 HA ASN 37 0.466 0.035 -6.955 244 HB2 ASN 37 2HB ASN 37 1.411 2.383 -8.614 245 HB3 ASN 37 3HB ASN 37 1.286 0.760 -9.283 246 HD21 ASN 37 1HD2 ASN 37 -0.446 3.536 -8.169 247 HD22 ASN 37 2HD2 ASN 37 -2.004 3.036 -8.718 248 H VAL 38 H VAL 38 1.925 -1.554 -6.672 249 HA VAL 38 HA VAL 38 4.734 -1.011 -7.085 250 HB VAL 38 HB VAL 38 5.443 -1.865 -4.850 251 HG11 VAL 38 1HG1 VAL 38 3.836 0.682 -4.815 252 HG12 VAL 38 2HG1 VAL 38 5.531 0.507 -5.273 253 HG13 VAL 38 3HG1 VAL 38 5.032 0.220 -3.606 254 HG21 VAL 38 3HG2 VAL 38 2.568 -1.415 -4.076 255 HG22 VAL 38 1HG2 VAL 38 3.882 -1.850 -2.988 256 HG23 VAL 38 2HG2 VAL 38 3.351 -2.985 -4.231 257 H GLU 39 H GLU 39 6.009 -2.848 -7.274 258 HA GLU 39 HA GLU 39 4.672 -5.433 -6.997 259 HB2 GLU 39 2HB GLU 39 4.583 -4.716 -9.376 260 HB3 GLU 39 3HB GLU 39 6.329 -4.534 -9.373 261 HG2 GLU 39 2HG GLU 39 6.587 -6.924 -8.989 262 HG3 GLU 39 3HG GLU 39 4.834 -7.109 -8.943 263 H SER 40 H SER 40 6.062 -7.077 -6.329 264 HA SER 40 HA SER 40 8.415 -6.191 -4.980 265 HB2 SER 40 2HB SER 40 8.567 -8.610 -4.305 266 HB3 SER 40 3HB SER 40 7.051 -7.817 -3.882 267 HG SER 40 HG SER 40 7.537 -9.884 -5.647 268 H GLY 41 H GLY 41 10.538 -6.753 -5.346 269 HA2 GLY 41 2HA GLY 41 11.152 -7.709 -8.048 270 HA3 GLY 41 3HA GLY 41 12.291 -6.975 -6.921 271 H ASP 42 H ASP 42 10.920 -8.818 -4.888 272 HA ASP 42 HA ASP 42 12.110 -11.393 -5.596 273 HB2 ASP 42 2HB ASP 42 12.739 -9.820 -3.078 274 HB3 ASP 42 3HB ASP 42 13.079 -11.536 -3.259 275 H ASP 43 H ASP 43 11.717 -12.398 -2.893 276 HA ASP 43 HA ASP 43 8.962 -13.146 -3.070 277 HB2 ASP 43 2HB ASP 43 10.964 -13.613 -0.839 278 HB3 ASP 43 3HB ASP 43 9.412 -14.426 -1.009 279 H GLY 44 H GLY 44 9.182 -10.337 -2.760 280 HA2 GLY 44 2HA GLY 44 7.716 -8.847 -1.676 281 HA3 GLY 44 3HA GLY 44 7.561 -9.994 -0.356 282 H GLN 45 H GLN 45 10.738 -9.940 -0.808 283 HA GLN 45 HA GLN 45 11.241 -8.469 1.531 284 HB2 GLN 45 2HB GLN 45 13.128 -9.445 -0.598 285 HB3 GLN 45 3HB GLN 45 13.666 -8.653 0.877 286 HG2 GLN 45 2HG GLN 45 12.579 -10.416 2.193 287 HG3 GLN 45 3HG GLN 45 12.113 -11.221 0.694 288 HE21 GLN 45 1HE2 GLN 45 14.688 -10.452 2.847 289 HE22 GLN 45 2HE2 GLN 45 15.868 -11.484 2.139 290 H THR 46 H THR 46 11.590 -7.550 -1.854 291 HA THR 46 HA THR 46 11.814 -4.799 -0.891 292 HB THR 46 HB THR 46 14.024 -5.332 -1.693 293 HG1 THR 46 HG1 THR 46 13.245 -3.279 -2.295 294 HG21 THR 46 3HG2 THR 46 13.500 -7.268 -3.095 295 HG22 THR 46 1HG2 THR 46 14.457 -6.090 -3.993 296 HG23 THR 46 2HG2 THR 46 12.720 -6.215 -4.274 297 H LEU 47 H LEU 47 10.028 -3.733 -1.397 298 HA LEU 47 HA LEU 47 8.540 -4.454 -3.801 299 HB2 LEU 47 2HB LEU 47 7.850 -2.585 -1.529 300 HB3 LEU 47 3HB LEU 47 6.773 -3.087 -2.812 301 HG LEU 47 HG LEU 47 7.917 -4.921 -0.702 302 HD11 LEU 47 1HD1 LEU 47 5.144 -3.801 -1.014 303 HD12 LEU 47 2HD1 LEU 47 6.320 -3.320 0.210 304 HD13 LEU 47 3HD1 LEU 47 5.673 -4.961 0.204 305 HD21 LEU 47 3HD2 LEU 47 6.303 -6.539 -1.576 306 HD22 LEU 47 1HD2 LEU 47 7.489 -6.074 -2.799 307 HD23 LEU 47 2HD2 LEU 47 5.858 -5.404 -2.850 308 H ASN 48 H ASN 48 8.517 -3.170 -5.533 309 HA ASN 48 HA ASN 48 9.532 -0.418 -5.241 310 HB2 ASN 48 2HB ASN 48 10.294 -2.402 -7.397 311 HB3 ASN 48 3HB ASN 48 10.647 -0.682 -7.484 312 HD21 ASN 48 1HD2 ASN 48 11.442 -3.694 -5.979 313 HD22 ASN 48 2HD2 ASN 48 12.867 -3.162 -5.161 314 H GLY 49 H GLY 49 8.544 1.131 -6.511 315 HA2 GLY 49 2HA GLY 49 6.973 0.703 -8.742 316 HA3 GLY 49 3HA GLY 49 5.909 0.500 -7.363 317 H THR 50 H THR 50 4.669 2.254 -7.869 318 HA THR 50 HA THR 50 5.940 4.893 -7.564 319 HB THR 50 HB THR 50 3.591 4.235 -9.363 320 HG1 THR 50 HG1 THR 50 6.368 4.266 -9.806 321 HG21 THR 50 3HG2 THR 50 3.651 6.548 -8.559 322 HG22 THR 50 1HG2 THR 50 4.012 6.470 -10.282 323 HG23 THR 50 2HG2 THR 50 5.320 6.703 -9.117 324 H MET 51 H MET 51 4.966 6.180 -5.995 325 HA MET 51 HA MET 51 2.306 5.359 -5.039 326 HB2 MET 51 2HB MET 51 4.151 4.719 -3.474 327 HB3 MET 51 3HB MET 51 4.598 6.416 -3.370 328 HG2 MET 51 2HG MET 51 2.406 6.922 -2.400 329 HG3 MET 51 3HG MET 51 1.981 5.212 -2.491 330 HE1 MET 51 3HE MET 51 5.395 6.932 -1.464 331 HE2 MET 51 1HE MET 51 5.191 6.970 0.284 332 HE3 MET 51 2HE MET 51 4.131 7.932 -0.744 333 H THR 52 H THR 52 0.962 7.114 -4.307 334 HA THR 52 HA THR 52 1.932 9.777 -5.118 335 HB THR 52 HB THR 52 -0.885 8.749 -5.543 336 HG1 THR 52 HG1 THR 52 0.111 9.170 -7.858 337 HG21 THR 52 3HG2 THR 52 -1.145 10.763 -6.906 338 HG22 THR 52 1HG2 THR 52 0.505 11.250 -6.515 339 HG23 THR 52 2HG2 THR 52 -0.718 11.178 -5.246 340 H TYR 53 H TYR 53 1.676 11.345 -3.652 341 HA TYR 53 HA TYR 53 0.215 10.787 -1.198 342 HB2 TYR 53 2HB TYR 53 2.202 12.897 -1.986 343 HB3 TYR 53 3HB TYR 53 1.208 13.091 -0.547 344 HD1 TYR 53 HD2 TYR 53 1.334 11.291 1.231 345 HD2 TYR 53 HD1 TYR 53 4.169 11.612 -1.916 346 HE1 TYR 53 HE2 TYR 53 2.922 9.955 2.542 347 HE2 TYR 53 HE1 TYR 53 5.771 10.277 -0.610 348 HH TYR 53 HH TYR 53 6.231 9.523 1.529 349 H ALA 54 H ALA 54 -1.107 12.510 -0.232 350 HA ALA 54 HA ALA 54 -3.293 13.124 -1.867 351 HB1 ALA 54 3HB ALA 54 -3.419 12.821 0.571 352 HB2 ALA 54 1HB ALA 54 -4.187 14.318 0.040 353 HB3 ALA 54 2HB ALA 54 -2.592 14.360 0.789 354 H GLY 55 H GLY 55 -3.197 14.460 -3.538 355 HA2 GLY 55 2HA GLY 55 -3.397 16.603 -4.449 356 HA3 GLY 55 3HA GLY 55 -2.639 17.266 -3.012 357 H GLU 56 H GLU 56 -0.772 14.737 -3.932 358 HA GLU 56 HA GLU 56 1.029 16.540 -5.395 359 HB2 GLU 56 2HB GLU 56 1.655 14.080 -3.754 360 HB3 GLU 56 3HB GLU 56 2.840 15.041 -4.625 361 HG2 GLU 56 2HG GLU 56 1.128 15.984 -2.340 362 HG3 GLU 56 3HG GLU 56 2.839 15.570 -2.263 363 H GLY 57 H GLY 57 2.696 15.078 -6.688 364 HA2 GLY 57 2HA GLY 57 1.035 13.500 -8.507 365 HA3 GLY 57 3HA GLY 57 2.618 14.177 -8.874 366 HA PRO 58 HA PRO 58 2.935 9.615 -7.674 367 HB2 PRO 58 2HB PRO 58 3.980 8.756 -10.039 368 HB3 PRO 58 3HB PRO 58 2.243 8.791 -9.707 369 HG2 PRO 58 2HG PRO 58 3.922 10.763 -11.216 370 HG3 PRO 58 3HG PRO 58 2.324 10.107 -11.623 371 HD2 PRO 58 2HD PRO 58 2.627 12.544 -10.523 372 HD3 PRO 58 3HD PRO 58 1.227 11.513 -10.161 373 H ILE 59 H ILE 59 4.768 8.881 -6.788 374 HA ILE 59 HA ILE 59 7.359 9.906 -7.730 375 HB ILE 59 HB ILE 59 8.176 10.050 -5.414 376 HG12 ILE 59 2HG1 ILE 59 5.301 9.618 -4.581 377 HG13 ILE 59 3HG1 ILE 59 6.565 8.399 -4.461 378 HG21 ILE 59 1HG2 ILE 59 7.372 12.083 -6.449 379 HG22 ILE 59 2HG2 ILE 59 6.964 12.088 -4.733 380 HG23 ILE 59 3HG2 ILE 59 5.724 11.725 -5.932 381 HD11 ILE 59 3HD1 ILE 59 7.797 9.897 -2.935 382 HD12 ILE 59 1HD1 ILE 59 6.212 9.421 -2.326 383 HD13 ILE 59 2HD1 ILE 59 6.447 11.028 -3.010 384 H GLY 60 H GLY 60 9.196 8.548 -6.807 385 HA2 GLY 60 2HA GLY 60 8.628 5.797 -7.435 386 HA3 GLY 60 3HA GLY 60 10.194 6.461 -6.992 387 H PHE 61 H PHE 61 8.503 4.059 -6.100 388 HA PHE 61 HA PHE 61 8.725 4.569 -3.204 389 HB2 PHE 61 2HB PHE 61 6.375 4.402 -3.882 390 HB3 PHE 61 3HB PHE 61 6.694 2.850 -4.645 391 HD1 PHE 61 HD2 PHE 61 7.156 0.857 -3.241 392 HD2 PHE 61 HD1 PHE 61 6.058 4.593 -1.537 393 HE1 PHE 61 HE2 PHE 61 6.600 -0.277 -1.131 394 HE2 PHE 61 HE1 PHE 61 5.498 3.466 0.572 395 HZ PHE 61 HZ PHE 61 5.765 1.030 0.778 396 H ARG 62 H ARG 62 10.060 3.244 -2.153 397 HA ARG 62 HA ARG 62 10.440 0.520 -3.138 398 HB2 ARG 62 2HB ARG 62 12.338 1.659 -4.073 399 HB3 ARG 62 3HB ARG 62 12.662 2.475 -2.552 400 HG2 ARG 62 2HG ARG 62 13.287 0.376 -1.523 401 HG3 ARG 62 3HG ARG 62 12.892 -0.489 -3.012 402 HD2 ARG 62 2HD ARG 62 15.310 -0.092 -2.778 403 HD3 ARG 62 3HD ARG 62 14.638 0.702 -4.204 404 HE ARG 62 HE ARG 62 15.183 2.719 -3.305 405 HH11 ARG 62 1HH1 ARG 62 15.355 0.336 -0.731 406 HH12 ARG 62 2HH1 ARG 62 16.067 1.437 0.405 407 HH21 ARG 62 1HH2 ARG 62 16.209 4.132 -1.833 408 HH22 ARG 62 2HH2 ARG 62 16.576 3.591 -0.227 409 H ALA 63 H ALA 63 10.509 -0.966 -1.551 410 HA ALA 63 HA ALA 63 10.923 -0.035 1.205 411 HB1 ALA 63 3HB ALA 63 8.489 -0.177 0.715 412 HB2 ALA 63 1HB ALA 63 9.019 -1.253 2.007 413 HB3 ALA 63 2HB ALA 63 8.698 -1.903 0.401 414 H THR 64 H THR 64 11.899 -1.462 2.573 415 HA THR 64 HA THR 64 12.766 -4.035 1.415 416 HB THR 64 HB THR 64 14.374 -2.248 3.269 417 HG1 THR 64 HG1 THR 64 15.582 -2.585 0.942 418 HG21 THR 64 3HG2 THR 64 14.858 -4.652 3.520 419 HG22 THR 64 1HG2 THR 64 16.213 -3.793 2.788 420 HG23 THR 64 2HG2 THR 64 15.143 -4.769 1.785 421 H LEU 65 H LEU 65 12.403 -5.828 2.621 422 HA LEU 65 HA LEU 65 10.744 -5.670 4.913 423 HB2 LEU 65 2HB LEU 65 10.609 -7.454 3.257 424 HB3 LEU 65 3HB LEU 65 12.198 -8.027 3.728 425 HG LEU 65 HG LEU 65 11.306 -8.554 5.978 426 HD11 LEU 65 1HD1 LEU 65 9.498 -6.946 6.048 427 HD12 LEU 65 2HD1 LEU 65 8.886 -8.578 6.312 428 HD13 LEU 65 3HD1 LEU 65 8.666 -7.797 4.744 429 HD21 LEU 65 3HD2 LEU 65 11.424 -10.285 4.270 430 HD22 LEU 65 1HD2 LEU 65 9.833 -9.818 3.666 431 HD23 LEU 65 2HD2 LEU 65 9.998 -10.508 5.282 432 H LEU 66 H LEU 66 11.199 -5.513 6.935 433 HA LEU 66 HA LEU 66 13.864 -5.592 8.008 434 HB2 LEU 66 2HB LEU 66 11.156 -5.242 9.245 435 HB3 LEU 66 3HB LEU 66 12.548 -5.518 10.265 436 HG LEU 66 HG LEU 66 12.151 -3.182 10.216 437 HD11 LEU 66 1HD1 LEU 66 14.221 -2.295 9.350 438 HD12 LEU 66 2HD1 LEU 66 14.453 -3.727 8.354 439 HD13 LEU 66 3HD1 LEU 66 14.498 -3.858 10.113 440 HD21 LEU 66 3HD2 LEU 66 12.080 -1.867 8.156 441 HD22 LEU 66 1HD2 LEU 66 10.780 -3.063 8.211 442 HD23 LEU 66 2HD2 LEU 66 12.202 -3.351 7.209 443 H GLY 67 H GLY 67 11.211 -7.856 7.906 444 HA2 GLY 67 2HA GLY 67 12.060 -10.261 8.086 445 HA3 GLY 67 3HA GLY 67 12.705 -9.739 9.639 446 H ASN 68 H ASN 68 10.024 -8.114 9.093 447 HA ASN 68 HA ASN 68 8.171 -10.057 10.311 448 HB2 ASN 68 2HB ASN 68 7.302 -8.371 11.875 449 HB3 ASN 68 3HB ASN 68 9.029 -8.579 12.119 450 HD21 ASN 68 1HD2 ASN 68 7.364 -6.361 12.861 451 HD22 ASN 68 2HD2 ASN 68 7.984 -4.967 12.050 452 H ASN 69 H ASN 69 6.075 -7.885 10.487 453 HA ASN 69 HA ASN 69 5.333 -8.022 7.671 454 HB2 ASN 69 2HB ASN 69 3.765 -7.081 10.091 455 HB3 ASN 69 3HB ASN 69 3.130 -7.143 8.451 456 HD21 ASN 69 1HD2 ASN 69 2.054 -8.475 10.684 457 HD22 ASN 69 2HD2 ASN 69 2.166 -10.170 10.382 458 H SER 70 H SER 70 7.206 -6.034 9.326 459 HA SER 70 HA SER 70 6.119 -3.545 8.249 460 HB2 SER 70 2HB SER 70 8.375 -3.956 10.221 461 HB3 SER 70 3HB SER 70 7.668 -2.409 9.753 462 HG SER 70 HG SER 70 5.908 -2.838 10.915 463 H TYR 71 H TYR 71 7.271 -2.254 6.908 464 HA TYR 71 HA TYR 71 9.740 -3.349 5.746 465 HB2 TYR 71 2HB TYR 71 7.458 -1.961 4.328 466 HB3 TYR 71 3HB TYR 71 9.013 -2.321 3.597 467 HD1 TYR 71 HD1 TYR 71 5.854 -3.763 4.812 468 HD2 TYR 71 HD2 TYR 71 9.580 -4.540 2.914 469 HE1 TYR 71 HE1 TYR 71 5.023 -5.962 4.083 470 HE2 TYR 71 HE2 TYR 71 8.758 -6.732 2.184 471 HH TYR 71 HH TYR 71 5.611 -7.584 2.125 472 H GLU 72 H GLU 72 11.335 -1.895 5.249 473 HA GLU 72 HA GLU 72 11.083 0.768 6.380 474 HB2 GLU 72 2HB GLU 72 13.173 -0.567 6.687 475 HB3 GLU 72 3HB GLU 72 13.421 -0.540 4.950 476 HG2 GLU 72 2HG GLU 72 13.647 1.889 5.015 477 HG3 GLU 72 3HG GLU 72 13.373 1.870 6.757 478 H VAL 73 H VAL 73 10.168 2.286 5.168 479 HA VAL 73 HA VAL 73 10.110 1.916 2.280 480 HB VAL 73 HB VAL 73 8.473 3.679 4.107 481 HG11 VAL 73 1HG1 VAL 73 8.269 3.377 1.117 482 HG12 VAL 73 2HG1 VAL 73 8.820 4.815 1.979 483 HG13 VAL 73 3HG1 VAL 73 7.150 4.270 2.146 484 HG21 VAL 73 3HG2 VAL 73 7.781 1.230 2.487 485 HG22 VAL 73 1HG2 VAL 73 6.622 2.221 3.370 486 HG23 VAL 73 2HG2 VAL 73 7.876 1.344 4.241 487 H GLU 74 H GLU 74 11.155 3.116 0.930 488 HA GLU 74 HA GLU 74 12.204 5.726 1.751 489 HB2 GLU 74 2HB GLU 74 13.593 3.579 0.135 490 HB3 GLU 74 3HB GLU 74 14.182 5.226 0.304 491 HG2 GLU 74 2HG GLU 74 14.451 4.919 2.692 492 HG3 GLU 74 3HG GLU 74 13.770 3.296 2.581 493 H ASN 75 H ASN 75 11.511 7.309 0.435 494 HA ASN 75 HA ASN 75 10.219 6.532 -2.074 495 HB2 ASN 75 2HB ASN 75 9.900 8.977 -0.336 496 HB3 ASN 75 3HB ASN 75 9.112 8.766 -1.894 497 HD21 ASN 75 1HD2 ASN 75 8.647 5.923 -1.492 498 HD22 ASN 75 2HD2 ASN 75 7.375 5.802 -0.328 499 H GLN 76 H GLN 76 10.604 7.647 -3.971 500 HA GLN 76 HA GLN 76 13.107 9.185 -4.015 501 HB2 GLN 76 2HB GLN 76 13.212 6.992 -5.126 502 HB3 GLN 76 3HB GLN 76 11.854 7.446 -6.139 503 HG2 GLN 76 2HG GLN 76 13.216 9.250 -7.106 504 HG3 GLN 76 3HG GLN 76 14.577 8.712 -6.123 505 HE21 GLN 76 1HE2 GLN 76 15.854 8.190 -7.857 506 HE22 GLN 76 2HE2 GLN 76 15.528 6.841 -8.890 507 H TRP 77 H TRP 77 12.808 11.281 -4.459 508 HA TRP 77 HA TRP 77 10.856 11.991 -6.486 509 HB2 TRP 77 2HB TRP 77 10.010 13.905 -5.199 510 HB3 TRP 77 3HB TRP 77 9.674 12.388 -4.379 511 HD1 TRP 77 HD1 TRP 77 12.172 15.354 -4.141 512 HE1 TRP 77 HE1 TRP 77 12.820 15.653 -1.669 513 HE3 TRP 77 HE3 TRP 77 9.690 11.343 -2.157 514 HZ2 TRP 77 HZ2 TRP 77 12.342 14.363 0.798 515 HZ3 TRP 77 HZ3 TRP 77 9.837 10.955 0.272 516 HH2 TRP 77 HH2 TRP 77 11.135 12.431 1.711 517 H GLY 78 H GLY 78 11.243 14.007 -7.501 518 HA2 GLY 78 2HA GLY 78 13.046 15.898 -7.331 519 HA3 GLY 78 3HA GLY 78 14.106 14.528 -7.662 520 H GLY 79 H GLY 79 14.676 14.429 -9.843 521 HA2 GLY 79 2HA GLY 79 12.539 15.122 -11.720 522 HA3 GLY 79 3HA GLY 79 14.242 15.471 -11.988 523 H ASP 80 H ASP 80 13.494 12.570 -10.391 524 HA ASP 80 HA ASP 80 13.058 10.382 -11.056 525 HB2 ASP 80 2HB ASP 80 13.609 11.396 -13.847 526 HB3 ASP 80 3HB ASP 80 13.511 9.677 -13.489 527 H SER 81 H SER 81 15.826 12.038 -12.472 528 HA SER 81 HA SER 81 17.626 9.870 -12.020 529 HB2 SER 81 2HB SER 81 18.197 12.809 -12.486 530 HB3 SER 81 3HB SER 81 19.360 11.495 -12.646 531 HG SER 81 HG SER 81 18.065 10.649 -14.320 532 H ALA 82 H ALA 82 16.069 11.791 -9.918 533 HA ALA 82 HA ALA 82 18.030 12.654 -8.085 534 HB1 ALA 82 3HB ALA 82 16.178 13.109 -6.615 535 HB2 ALA 82 1HB ALA 82 15.128 12.053 -7.558 536 HB3 ALA 82 2HB ALA 82 15.734 13.548 -8.263 537 HA PRO 83 HA PRO 83 18.831 8.970 -5.747 538 HB2 PRO 83 2HB PRO 83 19.482 9.974 -3.343 539 HB3 PRO 83 3HB PRO 83 20.504 10.227 -4.764 540 HG2 PRO 83 2HG PRO 83 18.538 12.085 -3.490 541 HG3 PRO 83 3HG PRO 83 20.155 12.427 -4.131 542 HD2 PRO 83 2HD PRO 83 17.835 12.929 -5.496 543 HD3 PRO 83 3HD PRO 83 19.397 12.619 -6.279 544 H TRP 84 H TRP 84 18.384 8.205 -3.261 545 HA TRP 84 HA TRP 84 15.466 8.157 -3.093 546 HB2 TRP 84 2HB TRP 84 17.570 6.326 -1.929 547 HB3 TRP 84 3HB TRP 84 15.843 6.169 -1.633 548 HD1 TRP 84 HD1 TRP 84 18.481 5.531 -4.291 549 HE1 TRP 84 HE1 TRP 84 17.434 4.133 -6.182 550 HE3 TRP 84 HE3 TRP 84 13.592 5.717 -2.825 551 HZ2 TRP 84 HZ2 TRP 84 14.876 3.230 -6.951 552 HZ3 TRP 84 HZ3 TRP 84 11.904 4.562 -4.194 553 HH2 TRP 84 HH2 TRP 84 12.536 3.345 -6.214 554 H HIS 85 H HIS 85 14.394 8.504 -1.176 555 HA HIS 85 HA HIS 85 15.955 9.753 0.997 556 HB2 HIS 85 2HB HIS 85 13.289 10.734 -0.060 557 HB3 HIS 85 3HB HIS 85 14.182 11.430 1.286 558 HD1 HIS 85 HD1 HIS 85 16.548 12.545 0.617 559 HD2 HIS 85 HD2 HIS 85 13.943 11.727 -2.515 560 HE1 HIS 85 HE1 HIS 85 17.415 13.857 -1.336 561 H SER 86 H SER 86 15.146 9.427 3.093 562 HA SER 86 HA SER 86 13.842 6.964 3.511 563 HB2 SER 86 2HB SER 86 13.821 7.713 5.917 564 HB3 SER 86 3HB SER 86 15.404 7.752 5.142 565 HG SER 86 HG SER 86 15.475 9.798 5.542 566 H GLY 87 H GLY 87 11.727 6.435 3.906 567 HA2 GLY 87 2HA GLY 87 9.815 8.653 3.872 568 HA3 GLY 87 3HA GLY 87 9.487 7.002 3.354 569 H GLY 88 H GLY 88 10.346 5.447 5.362 570 HA2 GLY 88 2HA GLY 88 10.116 5.930 7.972 571 HA3 GLY 88 3HA GLY 88 8.441 6.114 7.477 572 H ASN 89 H ASN 89 8.199 4.275 9.053 573 HA ASN 89 HA ASN 89 8.838 1.693 7.766 574 HB2 ASN 89 2HB ASN 89 8.305 2.269 10.694 575 HB3 ASN 89 3HB ASN 89 8.637 0.683 10.007 576 HD21 ASN 89 1HD2 ASN 89 10.724 0.233 9.243 577 HD22 ASN 89 2HD2 ASN 89 12.089 1.160 9.756 578 H TRP 90 H TRP 90 7.174 0.673 6.893 579 HA TRP 90 HA TRP 90 4.456 1.316 7.872 580 HB2 TRP 90 2HB TRP 90 5.328 0.601 5.059 581 HB3 TRP 90 3HB TRP 90 3.664 0.811 5.568 582 HD1 TRP 90 HD1 TRP 90 5.904 3.412 7.070 583 HE1 TRP 90 HE1 TRP 90 5.644 5.641 5.817 584 HE3 TRP 90 HE3 TRP 90 3.210 1.768 3.031 585 HZ2 TRP 90 HZ2 TRP 90 4.444 6.573 3.442 586 HZ3 TRP 90 HZ3 TRP 90 2.555 3.399 1.336 587 HH2 TRP 90 HH2 TRP 90 3.161 5.746 1.540 588 H ILE 91 H ILE 91 2.887 -0.373 7.816 589 HA ILE 91 HA ILE 91 4.057 -3.095 7.880 590 HB ILE 91 HB ILE 91 1.520 -2.082 9.198 591 HG12 ILE 91 2HG1 ILE 91 4.086 -3.043 10.470 592 HG13 ILE 91 3HG1 ILE 91 3.658 -1.347 10.272 593 HG21 ILE 91 1HG2 ILE 91 2.781 -4.825 9.273 594 HG22 ILE 91 2HG2 ILE 91 1.260 -4.388 8.495 595 HG23 ILE 91 3HG2 ILE 91 1.404 -4.305 10.251 596 HD11 ILE 91 3HD1 ILE 91 1.713 -1.671 11.712 597 HD12 ILE 91 1HD1 ILE 91 3.207 -2.121 12.533 598 HD13 ILE 91 2HD1 ILE 91 2.134 -3.371 11.903 599 H LEU 92 H LEU 92 3.534 -4.393 6.208 600 HA LEU 92 HA LEU 92 1.045 -3.833 4.728 601 HB2 LEU 92 2HB LEU 92 3.739 -4.254 3.441 602 HB3 LEU 92 3HB LEU 92 2.219 -4.116 2.587 603 HG LEU 92 HG LEU 92 3.475 -1.917 4.243 604 HD11 LEU 92 1HD1 LEU 92 3.307 -2.267 1.256 605 HD12 LEU 92 2HD1 LEU 92 4.768 -2.364 2.238 606 HD13 LEU 92 3HD1 LEU 92 3.900 -0.835 2.093 607 HD21 LEU 92 3HD2 LEU 92 1.047 -1.754 4.202 608 HD22 LEU 92 1HD2 LEU 92 1.051 -1.913 2.442 609 HD23 LEU 92 2HD2 LEU 92 1.770 -0.493 3.202 610 H GLY 93 H GLY 93 0.171 -5.681 5.734 611 HA2 GLY 93 2HA GLY 93 -0.031 -7.968 4.290 612 HA3 GLY 93 3HA GLY 93 1.303 -8.296 5.390 613 H SER 94 H SER 94 -2.006 -8.616 5.025 614 HA SER 94 HA SER 94 -2.608 -8.217 7.841 615 HB2 SER 94 2HB SER 94 -4.944 -8.781 7.189 616 HB3 SER 94 3HB SER 94 -4.283 -7.440 6.257 617 HG SER 94 HG SER 94 -5.451 -9.254 5.128 618 H ARG 95 H ARG 95 -1.400 -10.666 5.948 619 HA ARG 95 HA ARG 95 -2.560 -12.719 7.659 620 HB2 ARG 95 2HB ARG 95 -1.144 -12.935 5.006 621 HB3 ARG 95 3HB ARG 95 -1.502 -14.340 6.007 622 HG2 ARG 95 2HG ARG 95 -3.896 -13.816 5.888 623 HG3 ARG 95 3HG ARG 95 -3.534 -12.404 4.899 624 HD2 ARG 95 2HD ARG 95 -2.643 -13.834 3.146 625 HD3 ARG 95 3HD ARG 95 -2.905 -15.258 4.150 626 HE ARG 95 HE ARG 95 -5.361 -13.994 3.920 627 HH11 ARG 95 1HH1 ARG 95 -3.065 -15.529 1.733 628 HH12 ARG 95 2HH1 ARG 95 -4.287 -16.050 0.616 629 HH21 ARG 95 1HH2 ARG 95 -6.960 -14.702 2.449 630 HH22 ARG 95 2HH2 ARG 95 -6.508 -15.596 1.034 631 H GLU 96 H GLU 96 -1.287 -14.225 8.714 632 HA GLU 96 HA GLU 96 0.845 -12.946 10.096 633 HB2 GLU 96 2HB GLU 96 0.946 -15.048 11.400 634 HB3 GLU 96 3HB GLU 96 -0.667 -14.359 11.304 635 HG2 GLU 96 2HG GLU 96 -1.258 -15.970 9.568 636 HG3 GLU 96 3HG GLU 96 0.364 -16.653 9.656 637 H ASN 97 H ASN 97 0.713 -15.479 7.673 638 HA ASN 97 HA ASN 97 3.655 -15.579 7.706 639 HB2 ASN 97 2HB ASN 97 3.525 -17.934 7.042 640 HB3 ASN 97 3HB ASN 97 2.688 -17.665 8.564 641 HD21 ASN 97 1HD2 ASN 97 2.372 -19.829 6.696 642 HD22 ASN 97 2HD2 ASN 97 0.718 -19.818 6.197 643 H GLN 98 H GLN 98 1.969 -13.824 6.127 644 HA GLN 98 HA GLN 98 3.009 -14.440 3.532 645 HB2 GLN 98 2HB GLN 98 0.874 -15.801 3.712 646 HB3 GLN 98 3HB GLN 98 0.003 -14.281 3.794 647 HG2 GLN 98 2HG GLN 98 0.786 -13.683 1.595 648 HG3 GLN 98 3HG GLN 98 1.745 -15.161 1.502 649 HE21 GLN 98 1HE2 GLN 98 0.671 -15.997 -0.271 650 HE22 GLN 98 2HE2 GLN 98 -0.971 -16.547 -0.206 651 H ASN 99 H ASN 99 3.531 -12.566 2.599 652 HA ASN 99 HA ASN 99 2.358 -10.110 3.730 653 HB2 ASN 99 2HB ASN 99 5.194 -10.649 2.878 654 HB3 ASN 99 3HB ASN 99 4.574 -9.020 3.096 655 HD21 ASN 99 1HD2 ASN 99 6.693 -10.234 4.522 656 HD22 ASN 99 2HD2 ASN 99 6.228 -10.292 6.183 657 H VAL 100 H VAL 100 3.056 -8.189 2.219 658 HA VAL 100 HA VAL 100 1.516 -8.755 -0.200 659 HB VAL 100 HB VAL 100 1.494 -6.384 -0.661 660 HG11 VAL 100 1HG1 VAL 100 -0.123 -7.224 0.901 661 HG12 VAL 100 2HG1 VAL 100 0.379 -5.594 1.353 662 HG13 VAL 100 3HG1 VAL 100 1.002 -6.987 2.237 663 HG21 VAL 100 3HG2 VAL 100 2.616 -4.771 0.748 664 HG22 VAL 100 1HG2 VAL 100 3.784 -5.869 0.020 665 HG23 VAL 100 2HG2 VAL 100 3.321 -6.071 1.712 666 H VAL 101 H VAL 101 2.151 -8.688 -2.244 667 HA VAL 101 HA VAL 101 5.018 -8.216 -2.771 668 HB VAL 101 HB VAL 101 4.959 -9.838 -4.629 669 HG11 VAL 101 1HG1 VAL 101 5.827 -10.522 -2.477 670 HG12 VAL 101 2HG1 VAL 101 4.991 -11.866 -3.255 671 HG13 VAL 101 3HG1 VAL 101 4.206 -10.977 -1.947 672 HG21 VAL 101 3HG2 VAL 101 2.577 -9.822 -5.122 673 HG22 VAL 101 1HG2 VAL 101 2.233 -10.567 -3.557 674 HG23 VAL 101 2HG2 VAL 101 3.127 -11.463 -4.784 675 H ALA 102 H ALA 102 1.743 -7.690 -3.772 676 HA ALA 102 HA ALA 102 2.728 -5.547 -5.470 677 HB1 ALA 102 3HB ALA 102 0.671 -7.440 -6.600 678 HB2 ALA 102 1HB ALA 102 2.398 -7.590 -6.931 679 HB3 ALA 102 2HB ALA 102 1.527 -6.142 -7.420 680 H ILE 103 H ILE 103 1.435 -3.808 -5.489 681 HA ILE 103 HA ILE 103 -1.233 -4.079 -4.279 682 HB ILE 103 HB ILE 103 0.756 -1.899 -3.575 683 HG12 ILE 103 2HG1 ILE 103 -0.481 -4.014 -1.795 684 HG13 ILE 103 3HG1 ILE 103 1.140 -4.118 -2.476 685 HG21 ILE 103 1HG2 ILE 103 -2.078 -2.313 -2.636 686 HG22 ILE 103 2HG2 ILE 103 -1.518 -1.044 -3.721 687 HG23 ILE 103 3HG2 ILE 103 -0.968 -1.075 -2.047 688 HD11 ILE 103 3HD1 ILE 103 1.777 -2.097 -1.254 689 HD12 ILE 103 1HD1 ILE 103 1.205 -3.363 -0.170 690 HD13 ILE 103 2HD1 ILE 103 0.154 -2.007 -0.567 691 H ASN 104 H ASN 104 -2.744 -3.221 -5.495 692 HA ASN 104 HA ASN 104 -2.059 -1.001 -7.311 693 HB2 ASN 104 2HB ASN 104 -2.286 -3.041 -8.621 694 HB3 ASN 104 3HB ASN 104 -3.828 -3.399 -7.856 695 HD21 ASN 104 1HD2 ASN 104 -5.645 -2.460 -8.604 696 HD22 ASN 104 2HD2 ASN 104 -5.711 -1.473 -10.022 697 H VAL 105 H VAL 105 -2.872 0.562 -6.050 698 HA VAL 105 HA VAL 105 -5.781 0.652 -5.719 699 HB VAL 105 HB VAL 105 -5.726 1.383 -3.350 700 HG11 VAL 105 1HG1 VAL 105 -4.614 -1.389 -3.648 701 HG12 VAL 105 2HG1 VAL 105 -6.267 -0.939 -4.071 702 HG13 VAL 105 3HG1 VAL 105 -5.710 -0.769 -2.409 703 HG21 VAL 105 3HG2 VAL 105 -3.776 0.835 -1.973 704 HG22 VAL 105 1HG2 VAL 105 -3.410 2.067 -3.181 705 HG23 VAL 105 2HG2 VAL 105 -2.878 0.403 -3.429 706 H GLU 106 H GLU 106 -6.729 2.576 -5.354 707 HA GLU 106 HA GLU 106 -5.084 4.986 -5.169 708 HB2 GLU 106 2HB GLU 106 -7.288 4.532 -7.206 709 HB3 GLU 106 3HB GLU 106 -6.626 6.113 -6.823 710 HG2 GLU 106 2HG GLU 106 -4.421 5.356 -7.588 711 HG3 GLU 106 3HG GLU 106 -5.113 3.789 -7.996 712 H SER 107 H SER 107 -6.479 6.883 -4.450 713 HA SER 107 HA SER 107 -8.566 5.853 -2.683 714 HB2 SER 107 2HB SER 107 -6.611 6.930 -1.589 715 HB3 SER 107 3HB SER 107 -6.950 8.408 -2.486 716 HG SER 107 HG SER 107 -8.803 7.152 -0.758 717 H GLY 108 H GLY 108 -7.739 8.647 -4.731 718 HA2 GLY 108 2HA GLY 108 -9.156 9.864 -6.113 719 HA3 GLY 108 3HA GLY 108 -10.517 8.921 -5.507 720 H ASP 109 H ASP 109 -9.237 9.569 -2.773 721 HA ASP 109 HA ASP 109 -10.500 12.202 -2.435 722 HB2 ASP 109 2HB ASP 109 -10.504 9.800 -0.588 723 HB3 ASP 109 3HB ASP 109 -10.962 11.411 -0.052 724 H ASP 110 H ASP 110 -9.630 12.181 0.398 725 HA ASP 110 HA ASP 110 -6.976 13.269 -0.048 726 HB2 ASP 110 2HB ASP 110 -7.218 14.129 2.265 727 HB3 ASP 110 3HB ASP 110 -8.559 14.609 1.233 728 H GLY 111 H GLY 111 -7.657 10.246 0.118 729 HA2 GLY 111 2HA GLY 111 -6.171 8.563 0.739 730 HA3 GLY 111 3HA GLY 111 -5.487 9.635 1.946 731 H GLN 112 H GLN 112 -8.847 9.678 2.084 732 HA GLN 112 HA GLN 112 -8.919 8.513 4.645 733 HB2 GLN 112 2HB GLN 112 -10.570 10.167 3.914 734 HB3 GLN 112 3HB GLN 112 -11.206 9.027 2.735 735 HG2 GLN 112 2HG GLN 112 -11.856 7.519 4.571 736 HG3 GLN 112 3HG GLN 112 -11.260 8.707 5.729 737 HE21 GLN 112 1HE2 GLN 112 -13.742 7.955 3.411 738 HE22 GLN 112 2HE2 GLN 112 -14.849 9.185 3.916 739 H THR 113 H THR 113 -9.903 7.246 1.477 740 HA THR 113 HA THR 113 -9.784 4.546 2.613 741 HB THR 113 HB THR 113 -11.672 3.967 1.006 742 HG1 THR 113 HG1 THR 113 -11.553 5.935 -0.205 743 HG21 THR 113 3HG2 THR 113 -12.305 5.872 3.262 744 HG22 THR 113 1HG2 THR 113 -12.025 4.141 3.431 745 HG23 THR 113 2HG2 THR 113 -13.429 4.725 2.538 746 H LEU 114 H LEU 114 -8.555 3.194 1.482 747 HA LEU 114 HA LEU 114 -7.727 3.947 -1.243 748 HB2 LEU 114 2HB LEU 114 -6.456 2.242 0.894 749 HB3 LEU 114 3HB LEU 114 -5.989 2.067 -0.782 750 HG LEU 114 HG LEU 114 -4.391 3.432 0.446 751 HD11 LEU 114 1HD1 LEU 114 -4.350 5.391 -1.025 752 HD12 LEU 114 2HD1 LEU 114 -5.977 4.994 -1.571 753 HD13 LEU 114 3HD1 LEU 114 -4.643 3.888 -1.893 754 HD21 LEU 114 3HD2 LEU 114 -5.839 4.364 2.147 755 HD22 LEU 114 1HD2 LEU 114 -6.701 5.313 0.932 756 HD23 LEU 114 2HD2 LEU 114 -5.005 5.658 1.285 757 H ASN 115 H ASN 115 -8.394 2.666 -2.933 758 HA ASN 115 HA ASN 115 -9.408 0.018 -2.220 759 HB2 ASN 115 2HB ASN 115 -11.369 0.341 -3.738 760 HB3 ASN 115 3HB ASN 115 -11.408 1.326 -2.284 761 HD21 ASN 115 1HD2 ASN 115 -12.736 2.872 -3.075 762 HD22 ASN 115 2HD2 ASN 115 -12.297 3.969 -4.336 763 H GLY 116 H GLY 116 -9.452 -1.527 -3.839 764 HA2 GLY 116 2HA GLY 116 -9.065 -1.443 -6.475 765 HA3 GLY 116 3HA GLY 116 -7.445 -1.089 -5.894 766 H THR 117 H THR 117 -6.246 -2.811 -6.075 767 HA THR 117 HA THR 117 -7.284 -5.392 -5.159 768 HB THR 117 HB THR 117 -5.957 -6.476 -7.052 769 HG1 THR 117 HG1 THR 117 -5.447 -5.184 -8.806 770 HG21 THR 117 3HG2 THR 117 -8.409 -6.381 -7.070 771 HG22 THR 117 1HG2 THR 117 -7.761 -6.171 -8.698 772 HG23 THR 117 2HG2 THR 117 -8.344 -4.772 -7.796 773 H MET 118 H MET 118 -5.644 -6.908 -4.546 774 HA MET 118 HA MET 118 -2.991 -5.781 -3.997 775 HB2 MET 118 2HB MET 118 -3.102 -6.437 -1.678 776 HB3 MET 118 3HB MET 118 -4.453 -5.370 -2.031 777 HG2 MET 118 2HG MET 118 -5.851 -7.441 -2.348 778 HG3 MET 118 3HG MET 118 -4.497 -8.352 -1.687 779 HE1 MET 118 3HE MET 118 -4.239 -6.692 1.882 780 HE2 MET 118 1HE MET 118 -3.488 -6.052 0.420 781 HE3 MET 118 2HE MET 118 -3.471 -7.788 0.731 782 H THR 119 H THR 119 -1.383 -7.368 -3.712 783 HA THR 119 HA THR 119 -2.253 -10.128 -4.252 784 HB THR 119 HB THR 119 0.174 -8.857 -5.523 785 HG1 THR 119 HG1 THR 119 -1.487 -9.404 -7.410 786 HG21 THR 119 3HG2 THR 119 -1.251 -11.476 -6.037 787 HG22 THR 119 1HG2 THR 119 0.309 -11.291 -5.230 788 HG23 THR 119 2HG2 THR 119 0.143 -10.870 -6.936 789 H TYR 120 H TYR 120 -1.398 -11.588 -2.943 790 HA TYR 120 HA TYR 120 0.772 -10.806 -1.144 791 HB2 TYR 120 2HB TYR 120 -1.426 -12.841 -0.958 792 HB3 TYR 120 3HB TYR 120 0.012 -12.992 0.034 793 HD1 TYR 120 HD2 TYR 120 0.549 -11.243 1.678 794 HD2 TYR 120 HD1 TYR 120 -3.129 -11.245 -0.440 795 HE1 TYR 120 HE2 TYR 120 -0.380 -9.705 3.331 796 HE2 TYR 120 HE1 TYR 120 -4.083 -9.698 1.219 797 HH TYR 120 HH TYR 120 -3.643 -9.059 3.633 798 H ALA 121 H ALA 121 2.370 -12.459 -0.586 799 HA ALA 121 HA ALA 121 3.681 -13.497 -2.834 800 HB1 ALA 121 3HB ALA 121 4.819 -12.966 -0.725 801 HB2 ALA 121 1HB ALA 121 5.166 -14.610 -1.249 802 HB3 ALA 121 2HB ALA 121 4.011 -14.327 0.052 803 H GLY 122 H GLY 122 3.305 -15.238 -4.035 804 HA2 GLY 122 2HA GLY 122 2.575 -17.314 -4.710 805 HA3 GLY 122 3HA GLY 122 2.624 -17.785 -3.019 806 H GLU 123 H GLU 123 0.672 -15.099 -4.013 807 HA GLU 123 HA GLU 123 -1.747 -16.743 -3.686 808 HB2 GLU 123 2HB GLU 123 -1.049 -15.317 -1.680 809 HB3 GLU 123 3HB GLU 123 -1.404 -13.923 -2.682 810 HG2 GLU 123 2HG GLU 123 -3.285 -14.286 -1.310 811 HG3 GLU 123 3HG GLU 123 -3.730 -14.823 -2.929 812 H GLY 124 H GLY 124 -3.684 -15.637 -4.614 813 HA2 GLY 124 2HA GLY 124 -2.974 -14.307 -7.116 814 HA3 GLY 124 3HA GLY 124 -4.542 -14.999 -6.712 815 HA PRO 125 HA PRO 125 -4.256 -10.292 -5.832 816 HB2 PRO 125 2HB PRO 125 -5.665 -9.389 -7.992 817 HB3 PRO 125 3HB PRO 125 -3.903 -9.489 -7.954 818 HG2 PRO 125 2HG PRO 125 -5.887 -11.376 -9.157 819 HG3 PRO 125 3HG PRO 125 -4.335 -10.815 -9.809 820 HD2 PRO 125 2HD PRO 125 -4.620 -13.235 -8.651 821 HD3 PRO 125 3HD PRO 125 -3.115 -12.299 -8.527 822 H ILE 126 H ILE 126 -5.822 -9.509 -4.599 823 HA ILE 126 HA ILE 126 -8.602 -10.325 -5.069 824 HB ILE 126 HB ILE 126 -8.984 -10.532 -2.628 825 HG12 ILE 126 2HG1 ILE 126 -5.970 -10.366 -2.378 826 HG13 ILE 126 3HG1 ILE 126 -7.089 -9.096 -1.902 827 HG21 ILE 126 1HG2 ILE 126 -6.849 -12.370 -3.704 828 HG22 ILE 126 2HG2 ILE 126 -8.596 -12.546 -3.899 829 HG23 ILE 126 3HG2 ILE 126 -7.866 -12.700 -2.301 830 HD11 ILE 126 3HD1 ILE 126 -6.949 -11.858 -0.713 831 HD12 ILE 126 1HD1 ILE 126 -8.051 -10.571 -0.219 832 HD13 ILE 126 2HD1 ILE 126 -6.313 -10.378 0.011 833 H GLY 127 H GLY 127 -10.151 -8.891 -3.783 834 HA2 GLY 127 2HA GLY 127 -9.590 -6.172 -4.456 835 HA3 GLY 127 3HA GLY 127 -11.003 -6.766 -3.602 836 H PHE 128 H PHE 128 -8.904 -4.529 -3.248 837 HA PHE 128 HA PHE 128 -8.528 -5.007 -0.369 838 HB2 PHE 128 2HB PHE 128 -6.348 -5.179 -1.398 839 HB3 PHE 128 3HB PHE 128 -6.572 -3.645 -2.230 840 HD1 PHE 128 HD1 PHE 128 -7.087 -4.689 1.330 841 HD2 PHE 128 HD2 PHE 128 -5.068 -2.116 -1.388 842 HE1 PHE 128 HE1 PHE 128 -6.039 -3.513 3.220 843 HE2 PHE 128 HE2 PHE 128 -4.026 -0.935 0.497 844 HZ PHE 128 HZ PHE 128 -4.512 -1.631 2.804 845 H LYS 129 H LYS 129 -9.146 -3.499 0.973 846 HA LYS 129 HA LYS 129 -9.693 -0.808 0.026 847 HB2 LYS 129 2HB LYS 129 -11.795 -1.999 -0.150 848 HB3 LYS 129 3HB LYS 129 -11.629 -2.613 1.480 849 HG2 LYS 129 2HG LYS 129 -11.862 -0.342 2.356 850 HG3 LYS 129 3HG LYS 129 -12.016 0.271 0.705 851 HD2 LYS 129 2HD LYS 129 -14.011 -1.130 0.384 852 HD3 LYS 129 3HD LYS 129 -13.861 -1.707 2.044 853 HE2 LYS 129 2HE LYS 129 -14.274 1.142 1.209 854 HE3 LYS 129 3HE LYS 129 -15.536 0.063 1.810 855 HZ1 LYS 129 3HZ LYS 129 -14.201 -0.142 3.891 856 HZ2 LYS 129 1HZ LYS 129 -14.794 1.416 3.614 857 HZ3 LYS 129 2HZ LYS 129 -13.170 1.064 3.321 858 H GLY 130 H GLY 130 -8.766 0.566 1.387 859 HA2 GLY 130 2HA GLY 130 -8.297 -0.299 4.176 860 HA3 GLY 130 3HA GLY 130 -7.190 0.735 3.276 861 H THR 131 H THR 131 -9.102 0.969 5.759 862 HA THR 131 HA THR 131 -10.195 3.585 4.965 863 HB THR 131 HB THR 131 -11.439 1.637 6.920 864 HG1 THR 131 HG1 THR 131 -12.348 0.765 5.218 865 HG21 THR 131 3HG2 THR 131 -11.933 3.998 7.396 866 HG22 THR 131 1HG2 THR 131 -13.374 3.156 6.832 867 HG23 THR 131 2HG2 THR 131 -12.491 4.221 5.740 868 H LEU 132 H LEU 132 -9.643 5.267 6.261 869 HA LEU 132 HA LEU 132 -7.725 5.010 8.320 870 HB2 LEU 132 2HB LEU 132 -9.614 7.259 7.645 871 HB3 LEU 132 3HB LEU 132 -8.444 7.373 8.940 872 HG LEU 132 HG LEU 132 -7.737 6.931 6.038 873 HD11 LEU 132 1HD1 LEU 132 -7.088 9.262 6.004 874 HD12 LEU 132 2HD1 LEU 132 -7.533 9.442 7.700 875 HD13 LEU 132 3HD1 LEU 132 -8.781 9.148 6.491 876 HD21 LEU 132 3HD2 LEU 132 -6.069 6.058 7.584 877 HD22 LEU 132 1HD2 LEU 132 -6.067 7.587 8.463 878 HD23 LEU 132 2HD2 LEU 132 -5.475 7.526 6.802 879 H THR 133 H THR 133 -7.866 4.716 10.435 880 HA THR 133 HA THR 133 -10.385 3.975 11.552 881 HB THR 133 HB THR 133 -8.226 2.829 12.162 882 HG1 THR 133 HG1 THR 133 -9.791 3.923 14.278 883 HG21 THR 133 3HG2 THR 133 -6.813 4.826 12.440 884 HG22 THR 133 1HG2 THR 133 -6.802 3.826 13.890 885 HG23 THR 133 2HG2 THR 133 -7.765 5.300 13.844 Start of MODEL 10 1 H1 ALA 2 1H ALA 2 0.150 7.503 9.438 2 H2 ALA 2 2H ALA 2 0.034 6.126 8.463 3 H3 ALA 2 3H ALA 2 0.399 5.971 10.108 4 HA ALA 2 HA ALA 2 -1.757 6.834 10.700 5 HB1 ALA 2 3HB ALA 2 -2.128 8.205 8.719 6 HB2 ALA 2 1HB ALA 2 -3.463 7.078 8.956 7 HB3 ALA 2 2HB ALA 2 -2.243 6.757 7.720 8 H LEU 3 H LEU 3 -3.328 5.319 11.195 9 HA LEU 3 HA LEU 3 -2.607 2.597 10.429 10 HB2 LEU 3 2HB LEU 3 -2.808 3.464 12.859 11 HB3 LEU 3 3HB LEU 3 -4.536 3.417 12.600 12 HG LEU 3 HG LEU 3 -3.714 1.459 13.838 13 HD11 LEU 3 1HD1 LEU 3 -4.760 -0.286 12.490 14 HD12 LEU 3 2HD1 LEU 3 -4.774 0.807 11.107 15 HD13 LEU 3 3HD1 LEU 3 -5.719 1.187 12.545 16 HD21 LEU 3 3HD2 LEU 3 -1.485 1.315 12.856 17 HD22 LEU 3 1HD2 LEU 3 -2.189 0.803 11.322 18 HD23 LEU 3 2HD2 LEU 3 -2.338 -0.225 12.747 19 H TYR 4 H TYR 4 -3.952 1.299 9.287 20 HA TYR 4 HA TYR 4 -6.599 2.379 8.559 21 HB2 TYR 4 2HB TYR 4 -4.616 0.968 6.757 22 HB3 TYR 4 3HB TYR 4 -6.283 1.302 6.318 23 HD1 TYR 4 HD1 TYR 4 -3.013 2.842 7.057 24 HD2 TYR 4 HD2 TYR 4 -6.955 3.470 5.591 25 HE1 TYR 4 HE1 TYR 4 -2.341 5.043 6.206 26 HE2 TYR 4 HE2 TYR 4 -6.291 5.673 4.737 27 HH TYR 4 HH TYR 4 -3.062 6.656 4.494 28 H ASN 5 H ASN 5 -8.239 0.932 8.250 29 HA ASN 5 HA ASN 5 -7.872 -1.768 9.374 30 HB2 ASN 5 2HB ASN 5 -10.427 -0.320 8.575 31 HB3 ASN 5 3HB ASN 5 -10.340 -1.883 9.376 32 HD21 ASN 5 1HD2 ASN 5 -9.735 -1.965 11.558 33 HD22 ASN 5 2HD2 ASN 5 -9.820 -0.565 12.565 34 H VAL 6 H VAL 6 -8.045 -3.565 8.004 35 HA VAL 6 HA VAL 6 -8.486 -2.824 5.196 36 HB VAL 6 HB VAL 6 -6.478 -4.760 6.327 37 HG11 VAL 6 1HG1 VAL 6 -7.217 -4.331 3.427 38 HG12 VAL 6 2HG1 VAL 6 -7.520 -5.792 4.373 39 HG13 VAL 6 3HG1 VAL 6 -5.865 -5.301 4.014 40 HG21 VAL 6 3HG2 VAL 6 -5.814 -2.426 6.320 41 HG22 VAL 6 1HG2 VAL 6 -6.210 -2.297 4.607 42 HG23 VAL 6 2HG2 VAL 6 -4.886 -3.337 5.129 43 H GLU 7 H GLU 7 -9.996 -3.758 4.162 44 HA GLU 7 HA GLU 7 -11.048 -6.347 5.042 45 HB2 GLU 7 2HB GLU 7 -12.416 -4.044 3.639 46 HB3 GLU 7 3HB GLU 7 -13.147 -5.626 3.873 47 HG2 GLU 7 2HG GLU 7 -13.069 -5.351 6.269 48 HG3 GLU 7 3HG GLU 7 -12.230 -3.811 6.092 49 H ASN 8 H ASN 8 -11.284 -7.921 3.543 50 HA ASN 8 HA ASN 8 -10.089 -7.345 0.913 51 HB2 ASN 8 2HB ASN 8 -9.834 -9.865 2.566 52 HB3 ASN 8 3HB ASN 8 -9.226 -9.670 0.932 53 HD21 ASN 8 1HD2 ASN 8 -8.466 -6.855 1.567 54 HD22 ASN 8 2HD2 ASN 8 -7.007 -7.002 2.478 55 H GLN 9 H GLN 9 -11.017 -8.193 -0.865 56 HA GLN 9 HA GLN 9 -13.390 -9.898 -0.468 57 HB2 GLN 9 2HB GLN 9 -13.913 -7.603 -1.320 58 HB3 GLN 9 3HB GLN 9 -12.924 -7.943 -2.732 59 HG2 GLN 9 2HG GLN 9 -14.420 -9.804 -3.307 60 HG3 GLN 9 3HG GLN 9 -15.433 -9.394 -1.925 61 HE21 GLN 9 1HE2 GLN 9 -17.237 -8.894 -3.087 62 HE22 GLN 9 2HE2 GLN 9 -17.342 -7.522 -4.136 63 H TRP 10 H TRP 10 -12.963 -11.903 -1.142 64 HA TRP 10 HA TRP 10 -11.242 -12.218 -3.493 65 HB2 TRP 10 2HB TRP 10 -10.194 -14.200 -2.468 66 HB3 TRP 10 3HB TRP 10 -9.889 -12.747 -1.528 67 HD1 TRP 10 HD1 TRP 10 -11.546 -16.160 -1.323 68 HE1 TRP 10 HE1 TRP 10 -12.278 -16.605 1.101 69 HE3 TRP 10 HE3 TRP 10 -10.741 -11.506 0.646 70 HZ2 TRP 10 HZ2 TRP 10 -12.493 -15.177 3.522 71 HZ3 TRP 10 HZ3 TRP 10 -11.241 -11.139 3.026 72 HH2 TRP 10 HH2 TRP 10 -12.095 -12.927 4.430 73 H GLY 11 H GLY 11 -11.883 -13.696 -4.966 74 HA2 GLY 11 2HA GLY 11 -12.983 -15.741 -5.575 75 HA3 GLY 11 3HA GLY 11 -14.076 -15.505 -4.218 76 H GLY 12 H GLY 12 -13.471 -12.651 -5.954 77 HA2 GLY 12 2HA GLY 12 -14.621 -11.770 -7.816 78 HA3 GLY 12 3HA GLY 12 -15.783 -13.076 -7.678 79 H SER 13 H SER 13 -16.597 -10.530 -8.069 80 HA SER 13 HA SER 13 -17.225 -8.958 -5.894 81 HB2 SER 13 2HB SER 13 -18.980 -9.410 -8.308 82 HB3 SER 13 3HB SER 13 -18.957 -7.983 -7.269 83 HG SER 13 HG SER 13 -16.849 -7.561 -7.964 84 H SER 14 H SER 14 -18.740 -11.974 -6.881 85 HA SER 14 HA SER 14 -21.090 -11.838 -5.442 86 HB2 SER 14 2HB SER 14 -20.880 -14.384 -5.435 87 HB3 SER 14 3HB SER 14 -20.818 -13.594 -7.012 88 HG SER 14 HG SER 14 -18.913 -15.076 -5.727 89 H ALA 15 H ALA 15 -17.869 -12.135 -4.246 90 HA ALA 15 HA ALA 15 -18.741 -13.224 -1.690 91 HB1 ALA 15 3HB ALA 15 -15.993 -12.394 -2.622 92 HB2 ALA 15 1HB ALA 15 -16.647 -14.030 -2.664 93 HB3 ALA 15 2HB ALA 15 -16.368 -13.230 -1.115 94 HA PRO 16 HA PRO 16 -19.102 -9.186 0.116 95 HB2 PRO 16 2HB PRO 16 -19.201 -9.850 2.708 96 HB3 PRO 16 3HB PRO 16 -20.514 -10.270 1.599 97 HG2 PRO 16 2HG PRO 16 -18.287 -11.981 2.635 98 HG3 PRO 16 3HG PRO 16 -20.005 -12.375 2.433 99 HD2 PRO 16 2HD PRO 16 -18.043 -13.093 0.648 100 HD3 PRO 16 3HD PRO 16 -19.747 -12.875 0.210 101 H TRP 17 H TRP 17 -18.047 -7.818 1.838 102 HA TRP 17 HA TRP 17 -15.160 -8.074 1.576 103 HB2 TRP 17 2HB TRP 17 -16.918 -5.878 2.678 104 HB3 TRP 17 3HB TRP 17 -15.159 -5.801 2.651 105 HD1 TRP 17 HD1 TRP 17 -18.214 -5.450 0.424 106 HE1 TRP 17 HE1 TRP 17 -17.481 -4.539 -1.869 107 HE3 TRP 17 HE3 TRP 17 -13.145 -5.816 0.987 108 HZ2 TRP 17 HZ2 TRP 17 -15.071 -4.035 -3.252 109 HZ3 TRP 17 HZ3 TRP 17 -11.698 -5.099 -0.869 110 HH2 TRP 17 HH2 TRP 17 -12.643 -4.228 -2.946 111 H ASN 18 H ASN 18 -13.920 -8.881 3.110 112 HA ASN 18 HA ASN 18 -15.012 -9.027 5.849 113 HB2 ASN 18 2HB ASN 18 -13.304 -11.094 4.438 114 HB3 ASN 18 3HB ASN 18 -13.788 -11.162 6.129 115 HD21 ASN 18 1HD2 ASN 18 -14.774 -11.580 2.847 116 HD22 ASN 18 2HD2 ASN 18 -16.308 -12.292 3.182 117 H GLU 19 H GLU 19 -13.829 -8.055 7.339 118 HA GLU 19 HA GLU 19 -11.324 -6.858 6.759 119 HB2 GLU 19 2HB GLU 19 -11.321 -6.202 9.116 120 HB3 GLU 19 3HB GLU 19 -12.900 -5.916 8.401 121 HG2 GLU 19 2HG GLU 19 -13.750 -7.957 9.427 122 HG3 GLU 19 3HG GLU 19 -12.165 -8.275 10.122 123 H GLY 20 H GLY 20 -9.194 -7.652 7.073 124 HA2 GLY 20 2HA GLY 20 -9.041 -10.153 8.589 125 HA3 GLY 20 3HA GLY 20 -8.322 -10.001 6.994 126 H GLY 21 H GLY 21 -8.258 -7.220 9.062 127 HA2 GLY 21 2HA GLY 21 -6.325 -7.380 10.807 128 HA3 GLY 21 3HA GLY 21 -5.366 -7.580 9.356 129 H GLN 22 H GLN 22 -4.338 -5.656 10.389 130 HA GLN 22 HA GLN 22 -5.598 -3.194 9.410 131 HB2 GLN 22 2HB GLN 22 -4.697 -2.021 11.412 132 HB3 GLN 22 3HB GLN 22 -5.935 -3.201 11.814 133 HG2 GLN 22 2HG GLN 22 -4.076 -4.805 12.360 134 HG3 GLN 22 3HG GLN 22 -2.954 -3.466 12.159 135 HE21 GLN 22 1HE2 GLN 22 -4.943 -1.592 13.331 136 HE22 GLN 22 2HE2 GLN 22 -4.873 -1.870 15.031 137 H TRP 23 H TRP 23 -4.243 -1.854 8.288 138 HA TRP 23 HA TRP 23 -1.396 -2.632 8.106 139 HB2 TRP 23 2HB TRP 23 -3.232 -1.263 6.143 140 HB3 TRP 23 3HB TRP 23 -1.489 -1.271 5.952 141 HD1 TRP 23 HD1 TRP 23 -3.071 -4.489 7.184 142 HE1 TRP 23 HE1 TRP 23 -2.998 -6.229 5.291 143 HE3 TRP 23 HE3 TRP 23 -1.530 -1.464 3.368 144 HZ2 TRP 23 HZ2 TRP 23 -2.364 -6.305 2.548 145 HZ3 TRP 23 HZ3 TRP 23 -1.209 -2.453 1.133 146 HH2 TRP 23 HH2 TRP 23 -1.620 -4.820 0.735 147 H GLU 24 H GLU 24 0.104 -0.800 7.642 148 HA GLU 24 HA GLU 24 -0.908 1.722 8.742 149 HB2 GLU 24 2HB GLU 24 0.435 0.629 10.487 150 HB3 GLU 24 3HB GLU 24 1.800 0.557 9.379 151 HG2 GLU 24 2HG GLU 24 1.951 2.946 9.312 152 HG3 GLU 24 3HG GLU 24 0.480 3.107 10.266 153 H ILE 25 H ILE 25 -0.762 3.256 7.354 154 HA ILE 25 HA ILE 25 1.421 3.258 5.393 155 HB ILE 25 HB ILE 25 -1.509 3.754 4.791 156 HG12 ILE 25 2HG1 ILE 25 0.382 1.700 3.630 157 HG13 ILE 25 3HG1 ILE 25 -0.752 1.368 4.937 158 HG21 ILE 25 1HG2 ILE 25 -0.809 4.176 2.476 159 HG22 ILE 25 2HG2 ILE 25 0.882 4.057 2.972 160 HG23 ILE 25 3HG2 ILE 25 -0.130 5.363 3.589 161 HD11 ILE 25 3HD1 ILE 25 -1.616 0.603 2.802 162 HD12 ILE 25 1HD1 ILE 25 -1.464 2.231 2.142 163 HD13 ILE 25 2HD1 ILE 25 -2.608 1.910 3.446 164 H GLY 26 H GLY 26 2.302 5.225 5.013 165 HA2 GLY 26 2HA GLY 26 2.365 7.576 4.920 166 HA3 GLY 26 3HA GLY 26 0.910 7.631 5.904 167 H SER 27 H SER 27 4.276 7.763 5.860 168 HA SER 27 HA SER 27 4.486 7.498 8.765 169 HB2 SER 27 2HB SER 27 7.003 7.629 8.167 170 HB3 SER 27 3HB SER 27 6.113 6.157 7.767 171 HG SER 27 HG SER 27 7.453 7.755 6.141 172 H ARG 28 H ARG 28 3.541 9.866 6.978 173 HA ARG 28 HA ARG 28 5.126 11.890 8.369 174 HB2 ARG 28 2HB ARG 28 4.344 11.926 5.451 175 HB3 ARG 28 3HB ARG 28 4.894 13.348 6.324 176 HG2 ARG 28 2HG ARG 28 7.038 12.280 6.760 177 HG3 ARG 28 3HG ARG 28 6.489 10.820 5.938 178 HD2 ARG 28 2HD ARG 28 6.257 12.075 3.853 179 HD3 ARG 28 3HD ARG 28 6.771 13.545 4.680 180 HE ARG 28 HE ARG 28 8.493 11.183 4.272 181 HH11 ARG 28 1HH1 ARG 28 8.077 14.670 4.485 182 HH12 ARG 28 2HH1 ARG 28 9.759 15.013 4.298 183 HH21 ARG 28 1HH2 ARG 28 10.753 11.654 3.996 184 HH22 ARG 28 2HH2 ARG 28 11.270 13.302 3.992 185 H SER 29 H SER 29 3.929 13.350 9.399 186 HA SER 29 HA SER 29 1.125 13.028 9.600 187 HB2 SER 29 2HB SER 29 2.789 15.376 10.531 188 HB3 SER 29 3HB SER 29 1.199 14.904 11.129 189 HG SER 29 HG SER 29 2.431 12.785 11.540 190 H ASP 30 H ASP 30 3.137 15.241 7.768 191 HA ASP 30 HA ASP 30 1.039 17.086 7.190 192 HB2 ASP 30 2HB ASP 30 3.774 16.755 5.968 193 HB3 ASP 30 3HB ASP 30 2.670 18.078 5.606 194 H GLN 31 H GLN 31 2.577 14.446 5.406 195 HA GLN 31 HA GLN 31 0.503 14.769 3.363 196 HB2 GLN 31 2HB GLN 31 3.426 14.377 3.047 197 HB3 GLN 31 3HB GLN 31 2.347 13.650 1.857 198 HG2 GLN 31 2HG GLN 31 2.176 16.539 2.632 199 HG3 GLN 31 3HG GLN 31 3.226 15.961 1.333 200 HE21 GLN 31 1HE2 GLN 31 -0.113 16.185 2.418 201 HE22 GLN 31 2HE2 GLN 31 -0.821 16.020 0.845 202 H ASN 32 H ASN 32 -0.806 13.208 3.138 203 HA ASN 32 HA ASN 32 -0.036 10.541 4.045 204 HB2 ASN 32 2HB ASN 32 -2.054 11.648 5.082 205 HB3 ASN 32 3HB ASN 32 -2.826 11.596 3.504 206 HD21 ASN 32 1HD2 ASN 32 -4.474 10.328 4.409 207 HD22 ASN 32 2HD2 ASN 32 -4.238 8.636 4.713 208 H VAL 33 H VAL 33 -1.337 8.831 2.732 209 HA VAL 33 HA VAL 33 -0.563 9.247 -0.079 210 HB VAL 33 HB VAL 33 -0.828 6.661 1.459 211 HG11 VAL 33 1HG1 VAL 33 -1.272 6.365 -0.912 212 HG12 VAL 33 2HG1 VAL 33 0.268 5.634 -0.468 213 HG13 VAL 33 3HG1 VAL 33 0.239 7.185 -1.311 214 HG21 VAL 33 3HG2 VAL 33 1.638 8.169 0.593 215 HG22 VAL 33 1HG2 VAL 33 1.618 6.589 1.377 216 HG23 VAL 33 2HG2 VAL 33 1.044 8.014 2.247 217 H VAL 34 H VAL 34 -2.005 9.024 -1.711 218 HA VAL 34 HA VAL 34 -4.677 7.989 -1.034 219 HB VAL 34 HB VAL 34 -5.570 9.346 -2.910 220 HG11 VAL 34 1HG1 VAL 34 -5.431 11.513 -1.772 221 HG12 VAL 34 2HG1 VAL 34 -4.089 10.910 -0.801 222 HG13 VAL 34 3HG1 VAL 34 -5.691 10.191 -0.635 223 HG21 VAL 34 3HG2 VAL 34 -2.793 10.532 -2.986 224 HG22 VAL 34 1HG2 VAL 34 -4.195 11.139 -3.865 225 HG23 VAL 34 2HG2 VAL 34 -3.537 9.547 -4.243 226 H ALA 35 H ALA 35 -1.915 7.492 -3.051 227 HA ALA 35 HA ALA 35 -3.350 5.257 -4.262 228 HB1 ALA 35 3HB ALA 35 -2.842 5.751 -6.501 229 HB2 ALA 35 1HB ALA 35 -1.718 7.034 -6.060 230 HB3 ALA 35 2HB ALA 35 -3.449 7.262 -5.829 231 H ILE 36 H ILE 36 -2.045 3.530 -4.941 232 HA ILE 36 HA ILE 36 0.803 3.713 -4.454 233 HB ILE 36 HB ILE 36 -0.899 1.707 -2.927 234 HG12 ILE 36 2HG1 ILE 36 0.913 3.865 -1.830 235 HG13 ILE 36 3HG1 ILE 36 -0.835 4.027 -1.954 236 HG21 ILE 36 1HG2 ILE 36 1.233 0.939 -1.964 237 HG22 ILE 36 2HG2 ILE 36 2.095 2.044 -3.032 238 HG23 ILE 36 3HG2 ILE 36 1.167 0.705 -3.711 239 HD11 ILE 36 3HD1 ILE 36 0.645 1.988 -0.301 240 HD12 ILE 36 1HD1 ILE 36 -1.107 2.132 -0.430 241 HD13 ILE 36 2HD1 ILE 36 -0.164 3.431 0.300 242 H ASN 37 H ASN 37 1.779 2.623 -6.024 243 HA ASN 37 HA ASN 37 0.525 0.209 -7.107 244 HB2 ASN 37 2HB ASN 37 1.466 2.614 -8.661 245 HB3 ASN 37 3HB ASN 37 1.483 1.016 -9.396 246 HD21 ASN 37 1HD2 ASN 37 -0.539 3.585 -8.159 247 HD22 ASN 37 2HD2 ASN 37 -2.011 3.021 -8.856 248 H VAL 38 H VAL 38 1.965 -1.417 -6.786 249 HA VAL 38 HA VAL 38 4.775 -0.967 -7.137 250 HB VAL 38 HB VAL 38 5.474 -1.689 -4.857 251 HG11 VAL 38 1HG1 VAL 38 5.139 0.461 -3.731 252 HG12 VAL 38 2HG1 VAL 38 3.913 0.882 -4.927 253 HG13 VAL 38 3HG1 VAL 38 5.590 0.658 -5.426 254 HG21 VAL 38 3HG2 VAL 38 3.896 -1.502 -2.990 255 HG22 VAL 38 1HG2 VAL 38 3.403 -2.748 -4.138 256 HG23 VAL 38 2HG2 VAL 38 2.594 -1.179 -4.132 257 H GLU 39 H GLU 39 6.036 -2.896 -6.956 258 HA GLU 39 HA GLU 39 4.573 -5.378 -6.605 259 HB2 GLU 39 2HB GLU 39 4.437 -4.871 -9.033 260 HB3 GLU 39 3HB GLU 39 6.193 -4.810 -9.098 261 HG2 GLU 39 2HG GLU 39 6.357 -7.138 -8.559 262 HG3 GLU 39 3HG GLU 39 4.621 -7.240 -8.275 263 H SER 40 H SER 40 5.916 -7.160 -6.134 264 HA SER 40 HA SER 40 8.260 -6.411 -4.675 265 HB2 SER 40 2HB SER 40 8.301 -8.844 -4.098 266 HB3 SER 40 3HB SER 40 6.793 -8.017 -3.698 267 HG SER 40 HG SER 40 7.006 -9.210 -6.215 268 H GLY 41 H GLY 41 10.315 -7.235 -4.900 269 HA2 GLY 41 2HA GLY 41 10.951 -8.329 -7.560 270 HA3 GLY 41 3HA GLY 41 12.043 -7.308 -6.624 271 H ASP 42 H ASP 42 12.539 -8.204 -4.386 272 HA ASP 42 HA ASP 42 13.478 -10.924 -4.761 273 HB2 ASP 42 2HB ASP 42 14.073 -8.889 -2.614 274 HB3 ASP 42 3HB ASP 42 14.771 -10.503 -2.661 275 H ASP 43 H ASP 43 11.391 -11.921 -4.572 276 HA ASP 43 HA ASP 43 9.804 -13.160 -3.479 277 HB2 ASP 43 2HB ASP 43 12.054 -13.230 -1.471 278 HB3 ASP 43 3HB ASP 43 10.591 -14.192 -1.298 279 H GLY 44 H GLY 44 9.526 -10.288 -3.044 280 HA2 GLY 44 2HA GLY 44 7.792 -9.159 -1.916 281 HA3 GLY 44 3HA GLY 44 7.721 -10.481 -0.768 282 H GLN 45 H GLN 45 10.822 -10.077 -0.654 283 HA GLN 45 HA GLN 45 10.794 -8.503 1.718 284 HB2 GLN 45 2HB GLN 45 13.074 -9.528 0.039 285 HB3 GLN 45 3HB GLN 45 13.284 -8.701 1.575 286 HG2 GLN 45 2HG GLN 45 12.014 -10.467 2.690 287 HG3 GLN 45 3HG GLN 45 11.829 -11.296 1.144 288 HE21 GLN 45 1HE2 GLN 45 13.960 -10.492 3.718 289 HE22 GLN 45 2HE2 GLN 45 15.272 -11.500 3.236 290 H THR 46 H THR 46 11.421 -7.878 -1.617 291 HA THR 46 HA THR 46 12.064 -5.092 -0.973 292 HB THR 46 HB THR 46 12.925 -6.639 -3.440 293 HG1 THR 46 HG1 THR 46 14.913 -6.814 -2.476 294 HG21 THR 46 3HG2 THR 46 13.679 -3.900 -2.398 295 HG22 THR 46 1HG2 THR 46 12.708 -4.241 -3.829 296 HG23 THR 46 2HG2 THR 46 14.412 -4.690 -3.793 297 H LEU 47 H LEU 47 10.724 -3.597 -1.878 298 HA LEU 47 HA LEU 47 8.774 -4.528 -3.871 299 HB2 LEU 47 2HB LEU 47 8.216 -2.637 -1.578 300 HB3 LEU 47 3HB LEU 47 7.077 -3.103 -2.820 301 HG LEU 47 HG LEU 47 8.215 -4.926 -0.695 302 HD11 LEU 47 1HD1 LEU 47 5.457 -3.762 -1.047 303 HD12 LEU 47 2HD1 LEU 47 6.631 -3.297 0.183 304 HD13 LEU 47 3HD1 LEU 47 5.941 -4.921 0.191 305 HD21 LEU 47 3HD2 LEU 47 6.165 -5.445 -2.850 306 HD22 LEU 47 1HD2 LEU 47 6.555 -6.539 -1.521 307 HD23 LEU 47 2HD2 LEU 47 7.775 -6.158 -2.733 308 H ASN 48 H ASN 48 8.600 -3.159 -5.623 309 HA ASN 48 HA ASN 48 9.616 -0.446 -5.286 310 HB2 ASN 48 2HB ASN 48 10.791 -0.603 -7.499 311 HB3 ASN 48 3HB ASN 48 11.518 -1.570 -6.228 312 HD21 ASN 48 1HD2 ASN 48 12.544 -2.923 -7.685 313 HD22 ASN 48 2HD2 ASN 48 11.694 -4.085 -8.641 314 H GLY 49 H GLY 49 8.720 1.095 -6.621 315 HA2 GLY 49 2HA GLY 49 7.250 0.762 -8.922 316 HA3 GLY 49 3HA GLY 49 6.109 0.490 -7.616 317 H THR 50 H THR 50 4.876 2.283 -7.954 318 HA THR 50 HA THR 50 6.173 4.847 -7.342 319 HB THR 50 HB THR 50 4.420 5.903 -8.868 320 HG1 THR 50 HG1 THR 50 4.346 3.334 -10.077 321 HG21 THR 50 3HG2 THR 50 6.535 4.146 -10.131 322 HG22 THR 50 1HG2 THR 50 6.779 5.777 -9.508 323 HG23 THR 50 2HG2 THR 50 5.744 5.514 -10.912 324 H MET 51 H MET 51 5.034 6.212 -5.930 325 HA MET 51 HA MET 51 2.384 5.302 -5.090 326 HB2 MET 51 2HB MET 51 4.006 4.501 -3.450 327 HB3 MET 51 3HB MET 51 4.709 6.103 -3.317 328 HG2 MET 51 2HG MET 51 1.832 5.723 -2.661 329 HG3 MET 51 3HG MET 51 3.052 5.180 -1.513 330 HE1 MET 51 3HE MET 51 5.383 7.377 -1.931 331 HE2 MET 51 1HE MET 51 4.809 6.700 -0.407 332 HE3 MET 51 2HE MET 51 4.918 8.444 -0.604 333 H THR 52 H THR 52 1.008 7.002 -4.317 334 HA THR 52 HA THR 52 1.917 9.690 -5.116 335 HB THR 52 HB THR 52 -0.811 8.486 -5.548 336 HG1 THR 52 HG1 THR 52 1.126 9.241 -7.491 337 HG21 THR 52 3HG2 THR 52 -0.914 10.893 -5.162 338 HG22 THR 52 1HG2 THR 52 -1.259 10.519 -6.852 339 HG23 THR 52 2HG2 THR 52 0.322 11.151 -6.394 340 H TYR 53 H TYR 53 1.752 11.171 -3.593 341 HA TYR 53 HA TYR 53 0.302 10.709 -1.140 342 HB2 TYR 53 2HB TYR 53 2.058 12.956 -2.107 343 HB3 TYR 53 3HB TYR 53 1.150 13.071 -0.609 344 HD1 TYR 53 HD2 TYR 53 1.579 11.253 1.154 345 HD2 TYR 53 HD1 TYR 53 4.187 11.980 -2.128 346 HE1 TYR 53 HE2 TYR 53 3.405 10.165 2.376 347 HE2 TYR 53 HE1 TYR 53 6.026 10.887 -0.907 348 HH TYR 53 HH TYR 53 5.490 9.077 1.962 349 H ALA 54 H ALA 54 -1.149 12.325 -0.254 350 HA ALA 54 HA ALA 54 -3.319 12.899 -1.956 351 HB1 ALA 54 3HB ALA 54 -4.281 14.048 -0.037 352 HB2 ALA 54 1HB ALA 54 -2.713 14.048 0.770 353 HB3 ALA 54 2HB ALA 54 -3.547 12.525 0.462 354 H GLY 55 H GLY 55 -3.341 14.392 -3.500 355 HA2 GLY 55 2HA GLY 55 -3.441 16.602 -4.260 356 HA3 GLY 55 3HA GLY 55 -2.521 17.102 -2.849 357 H GLU 56 H GLU 56 -1.086 14.426 -4.257 358 HA GLU 56 HA GLU 56 0.656 16.106 -5.930 359 HB2 GLU 56 2HB GLU 56 1.485 13.968 -3.978 360 HB3 GLU 56 3HB GLU 56 2.556 14.601 -5.218 361 HG2 GLU 56 2HG GLU 56 1.283 16.169 -2.990 362 HG3 GLU 56 3HG GLU 56 2.967 15.655 -3.083 363 H GLY 57 H GLY 57 2.295 14.319 -7.011 364 HA2 GLY 57 2HA GLY 57 0.484 12.512 -8.470 365 HA3 GLY 57 3HA GLY 57 1.909 13.271 -9.169 366 HA PRO 58 HA PRO 58 3.028 9.035 -7.609 367 HB2 PRO 58 2HB PRO 58 3.896 7.960 -9.908 368 HB3 PRO 58 3HB PRO 58 2.177 8.019 -9.503 369 HG2 PRO 58 2HG PRO 58 3.759 9.833 -11.287 370 HG3 PRO 58 3HG PRO 58 2.164 9.110 -11.567 371 HD2 PRO 58 2HD PRO 58 2.514 11.675 -10.694 372 HD3 PRO 58 3HD PRO 58 1.087 10.696 -10.296 373 H ILE 59 H ILE 59 4.965 8.566 -6.830 374 HA ILE 59 HA ILE 59 7.367 9.584 -8.173 375 HB ILE 59 HB ILE 59 8.443 9.997 -5.993 376 HG12 ILE 59 2HG1 ILE 59 5.700 9.561 -4.780 377 HG13 ILE 59 3HG1 ILE 59 7.049 8.441 -4.649 378 HG21 ILE 59 1HG2 ILE 59 7.280 12.072 -5.416 379 HG22 ILE 59 2HG2 ILE 59 5.886 11.548 -6.362 380 HG23 ILE 59 3HG2 ILE 59 7.426 11.864 -7.162 381 HD11 ILE 59 3HD1 ILE 59 6.937 11.240 -3.548 382 HD12 ILE 59 1HD1 ILE 59 8.341 10.179 -3.476 383 HD13 ILE 59 2HD1 ILE 59 6.860 9.734 -2.630 384 H GLY 60 H GLY 60 9.349 8.405 -7.018 385 HA2 GLY 60 2HA GLY 60 8.901 5.618 -7.651 386 HA3 GLY 60 3HA GLY 60 10.438 6.365 -7.229 387 H PHE 61 H PHE 61 8.914 3.924 -6.273 388 HA PHE 61 HA PHE 61 9.054 4.525 -3.390 389 HB2 PHE 61 2HB PHE 61 6.716 4.333 -4.118 390 HB3 PHE 61 3HB PHE 61 7.058 2.766 -4.832 391 HD1 PHE 61 HD2 PHE 61 7.493 0.815 -3.374 392 HD2 PHE 61 HD1 PHE 61 6.313 4.583 -1.793 393 HE1 PHE 61 HE2 PHE 61 6.863 -0.275 -1.266 394 HE2 PHE 61 HE1 PHE 61 5.679 3.498 0.322 395 HZ PHE 61 HZ PHE 61 5.953 1.063 0.585 396 H ARG 62 H ARG 62 10.444 3.254 -2.324 397 HA ARG 62 HA ARG 62 10.834 0.493 -3.255 398 HB2 ARG 62 2HB ARG 62 12.771 1.852 -4.034 399 HB3 ARG 62 3HB ARG 62 13.095 2.300 -2.368 400 HG2 ARG 62 2HG ARG 62 13.513 -0.050 -1.818 401 HG3 ARG 62 3HG ARG 62 13.184 -0.494 -3.491 402 HD2 ARG 62 2HD ARG 62 15.569 -0.368 -3.168 403 HD3 ARG 62 3HD ARG 62 15.058 0.963 -4.206 404 HE ARG 62 HE ARG 62 15.551 2.467 -2.511 405 HH11 ARG 62 1HH1 ARG 62 16.112 -0.835 -1.448 406 HH12 ARG 62 2HH1 ARG 62 16.944 -0.379 -0.009 407 HH21 ARG 62 1HH2 ARG 62 16.684 3.084 -0.597 408 HH22 ARG 62 2HH2 ARG 62 17.252 1.881 0.493 409 H ALA 63 H ALA 63 10.730 -0.962 -1.647 410 HA ALA 63 HA ALA 63 11.019 0.004 1.102 411 HB1 ALA 63 3HB ALA 63 9.002 -1.073 1.821 412 HB2 ALA 63 1HB ALA 63 8.731 -1.744 0.210 413 HB3 ALA 63 2HB ALA 63 8.618 -0.006 0.474 414 H THR 64 H THR 64 11.705 -1.503 2.591 415 HA THR 64 HA THR 64 12.437 -4.149 1.534 416 HB THR 64 HB THR 64 14.095 -2.416 3.389 417 HG1 THR 64 HG1 THR 64 13.971 -2.720 0.662 418 HG21 THR 64 3HG2 THR 64 14.331 -4.828 3.861 419 HG22 THR 64 1HG2 THR 64 15.802 -4.168 3.147 420 HG23 THR 64 2HG2 THR 64 14.692 -5.122 2.161 421 H LEU 65 H LEU 65 11.877 -5.856 2.783 422 HA LEU 65 HA LEU 65 10.123 -5.450 4.988 423 HB2 LEU 65 2HB LEU 65 9.820 -7.297 3.447 424 HB3 LEU 65 3HB LEU 65 11.390 -7.946 3.871 425 HG LEU 65 HG LEU 65 10.539 -8.341 6.189 426 HD11 LEU 65 1HD1 LEU 65 8.125 -8.320 6.554 427 HD12 LEU 65 2HD1 LEU 65 7.896 -7.593 4.963 428 HD13 LEU 65 3HD1 LEU 65 8.752 -6.706 6.223 429 HD21 LEU 65 3HD2 LEU 65 9.021 -9.676 3.950 430 HD22 LEU 65 1HD2 LEU 65 9.199 -10.296 5.593 431 HD23 LEU 65 2HD2 LEU 65 10.614 -10.139 4.551 432 H LEU 66 H LEU 66 10.604 -5.168 7.032 433 HA LEU 66 HA LEU 66 13.212 -5.386 8.111 434 HB2 LEU 66 2HB LEU 66 10.504 -4.969 9.326 435 HB3 LEU 66 3HB LEU 66 11.884 -5.274 10.355 436 HG LEU 66 HG LEU 66 11.457 -2.909 10.256 437 HD11 LEU 66 1HD1 LEU 66 13.778 -3.619 10.408 438 HD12 LEU 66 2HD1 LEU 66 13.621 -2.091 9.545 439 HD13 LEU 66 3HD1 LEU 66 13.912 -3.580 8.651 440 HD21 LEU 66 3HD2 LEU 66 11.814 -3.133 7.271 441 HD22 LEU 66 1HD2 LEU 66 11.606 -1.637 8.182 442 HD23 LEU 66 2HD2 LEU 66 10.296 -2.818 8.113 443 H GLY 67 H GLY 67 10.487 -7.581 8.008 444 HA2 GLY 67 2HA GLY 67 11.389 -9.971 8.151 445 HA3 GLY 67 3HA GLY 67 11.967 -9.462 9.728 446 H ASN 68 H ASN 68 9.218 -7.855 9.435 447 HA ASN 68 HA ASN 68 7.401 -10.024 10.195 448 HB2 ASN 68 2HB ASN 68 8.113 -7.793 12.105 449 HB3 ASN 68 3HB ASN 68 6.635 -8.730 12.258 450 HD21 ASN 68 1HD2 ASN 68 10.034 -8.674 12.705 451 HD22 ASN 68 2HD2 ASN 68 10.169 -10.215 13.484 452 H ASN 69 H ASN 69 6.887 -9.000 7.958 453 HA ASN 69 HA ASN 69 5.393 -7.923 6.626 454 HB2 ASN 69 2HB ASN 69 3.859 -7.732 9.224 455 HB3 ASN 69 3HB ASN 69 3.184 -7.302 7.656 456 HD21 ASN 69 1HD2 ASN 69 2.444 -9.394 9.588 457 HD22 ASN 69 2HD2 ASN 69 2.514 -10.883 8.708 458 H SER 70 H SER 70 7.244 -6.336 8.652 459 HA SER 70 HA SER 70 6.119 -3.680 8.223 460 HB2 SER 70 2HB SER 70 8.581 -4.444 9.803 461 HB3 SER 70 3HB SER 70 7.682 -2.927 9.883 462 HG SER 70 HG SER 70 6.261 -5.270 10.397 463 H TYR 71 H TYR 71 7.028 -2.280 6.808 464 HA TYR 71 HA TYR 71 9.475 -3.163 5.442 465 HB2 TYR 71 2HB TYR 71 6.989 -1.913 4.282 466 HB3 TYR 71 3HB TYR 71 8.521 -1.987 3.424 467 HD1 TYR 71 HD1 TYR 71 5.873 -4.098 4.956 468 HD2 TYR 71 HD2 TYR 71 9.151 -3.917 2.257 469 HE1 TYR 71 HE1 TYR 71 5.293 -6.333 4.111 470 HE2 TYR 71 HE2 TYR 71 8.586 -6.145 1.412 471 HH TYR 71 HH TYR 71 7.373 -8.013 1.828 472 H GLU 72 H GLU 72 11.056 -1.726 5.215 473 HA GLU 72 HA GLU 72 10.640 0.965 6.250 474 HB2 GLU 72 2HB GLU 72 12.664 -0.329 6.935 475 HB3 GLU 72 3HB GLU 72 13.173 -0.371 5.254 476 HG2 GLU 72 2HG GLU 72 13.435 2.023 5.228 477 HG3 GLU 72 3HG GLU 72 12.794 2.141 6.866 478 H VAL 73 H VAL 73 10.144 2.564 4.938 479 HA VAL 73 HA VAL 73 10.330 2.067 2.070 480 HB VAL 73 HB VAL 73 8.554 3.883 3.693 481 HG11 VAL 73 1HG1 VAL 73 7.421 4.441 1.595 482 HG12 VAL 73 2HG1 VAL 73 8.656 3.553 0.701 483 HG13 VAL 73 3HG1 VAL 73 9.094 5.000 1.611 484 HG21 VAL 73 3HG2 VAL 73 6.762 2.442 2.896 485 HG22 VAL 73 1HG2 VAL 73 7.980 1.506 3.760 486 HG23 VAL 73 2HG2 VAL 73 7.926 1.471 1.996 487 H GLU 74 H GLU 74 11.429 3.273 0.747 488 HA GLU 74 HA GLU 74 12.375 5.916 1.571 489 HB2 GLU 74 2HB GLU 74 13.961 3.776 0.116 490 HB3 GLU 74 3HB GLU 74 14.429 5.470 0.144 491 HG2 GLU 74 2HG GLU 74 14.582 5.348 2.610 492 HG3 GLU 74 3HG GLU 74 14.203 3.632 2.521 493 H ASN 75 H ASN 75 11.783 7.462 0.135 494 HA ASN 75 HA ASN 75 10.522 6.533 -2.342 495 HB2 ASN 75 2HB ASN 75 10.102 9.039 -0.717 496 HB3 ASN 75 3HB ASN 75 9.385 8.772 -2.301 497 HD21 ASN 75 1HD2 ASN 75 8.101 9.158 0.285 498 HD22 ASN 75 2HD2 ASN 75 7.119 7.763 0.534 499 H GLN 76 H GLN 76 10.967 7.438 -4.303 500 HA GLN 76 HA GLN 76 13.405 9.070 -4.466 501 HB2 GLN 76 2HB GLN 76 13.470 6.684 -5.220 502 HB3 GLN 76 3HB GLN 76 12.207 7.056 -6.371 503 HG2 GLN 76 2HG GLN 76 13.761 8.666 -7.448 504 HG3 GLN 76 3HG GLN 76 15.028 8.077 -6.365 505 HE21 GLN 76 1HE2 GLN 76 16.306 7.106 -7.916 506 HE22 GLN 76 2HE2 GLN 76 15.794 5.729 -8.830 507 H TRP 77 H TRP 77 12.965 11.110 -5.336 508 HA TRP 77 HA TRP 77 10.623 11.231 -7.076 509 HB2 TRP 77 2HB TRP 77 10.717 13.791 -6.592 510 HB3 TRP 77 3HB TRP 77 9.977 12.708 -5.428 511 HD1 TRP 77 HD1 TRP 77 13.123 14.840 -5.947 512 HE1 TRP 77 HE1 TRP 77 14.158 15.334 -3.652 513 HE3 TRP 77 HE3 TRP 77 10.134 11.856 -3.076 514 HZ2 TRP 77 HZ2 TRP 77 13.749 14.556 -0.960 515 HZ3 TRP 77 HZ3 TRP 77 10.519 11.792 -0.644 516 HH2 TRP 77 HH2 TRP 77 12.289 13.115 0.387 517 H GLY 78 H GLY 78 11.351 10.845 -8.999 518 HA2 GLY 78 2HA GLY 78 12.383 12.588 -10.711 519 HA3 GLY 78 3HA GLY 78 13.828 11.897 -9.963 520 H GLY 79 H GLY 79 14.358 10.835 -12.079 521 HA2 GLY 79 2HA GLY 79 12.543 8.772 -12.902 522 HA3 GLY 79 3HA GLY 79 14.129 9.139 -13.574 523 H ASP 80 H ASP 80 14.842 6.979 -13.554 524 HA ASP 80 HA ASP 80 14.790 5.525 -11.023 525 HB2 ASP 80 2HB ASP 80 15.798 4.714 -13.758 526 HB3 ASP 80 3HB ASP 80 15.834 3.678 -12.339 527 H SER 81 H SER 81 16.743 7.743 -12.459 528 HA SER 81 HA SER 81 19.239 6.583 -11.479 529 HB2 SER 81 2HB SER 81 19.158 7.497 -13.788 530 HB3 SER 81 3HB SER 81 18.800 9.087 -13.123 531 HG SER 81 HG SER 81 20.997 7.994 -11.960 532 H ALA 82 H ALA 82 16.816 8.484 -10.300 533 HA ALA 82 HA ALA 82 18.361 10.519 -8.993 534 HB1 ALA 82 3HB ALA 82 16.033 10.911 -9.631 535 HB2 ALA 82 1HB ALA 82 16.249 11.101 -7.890 536 HB3 ALA 82 2HB ALA 82 15.509 9.634 -8.534 537 HA PRO 83 HA PRO 83 19.552 8.254 -5.373 538 HB2 PRO 83 2HB PRO 83 19.584 10.236 -3.513 539 HB3 PRO 83 3HB PRO 83 20.822 10.082 -4.766 540 HG2 PRO 83 2HG PRO 83 18.404 11.855 -4.703 541 HG3 PRO 83 3HG PRO 83 20.072 12.252 -5.166 542 HD2 PRO 83 2HD PRO 83 18.166 11.752 -7.001 543 HD3 PRO 83 3HD PRO 83 19.858 11.271 -7.253 544 H TRP 84 H TRP 84 18.759 7.529 -3.294 545 HA TRP 84 HA TRP 84 15.846 7.663 -3.189 546 HB2 TRP 84 2HB TRP 84 17.819 5.783 -1.871 547 HB3 TRP 84 3HB TRP 84 16.075 5.705 -1.652 548 HD1 TRP 84 HD1 TRP 84 18.829 4.744 -4.067 549 HE1 TRP 84 HE1 TRP 84 17.829 3.374 -6.010 550 HE3 TRP 84 HE3 TRP 84 13.864 5.451 -3.076 551 HZ2 TRP 84 HZ2 TRP 84 15.268 2.691 -6.985 552 HZ3 TRP 84 HZ3 TRP 84 12.207 4.403 -4.560 553 HH2 TRP 84 HH2 TRP 84 12.896 3.056 -6.471 554 H HIS 85 H HIS 85 14.753 8.429 -1.465 555 HA HIS 85 HA HIS 85 16.345 9.599 0.739 556 HB2 HIS 85 2HB HIS 85 13.789 10.653 -0.504 557 HB3 HIS 85 3HB HIS 85 14.569 11.338 0.917 558 HD1 HIS 85 HD1 HIS 85 16.494 12.956 0.518 559 HD2 HIS 85 HD2 HIS 85 15.258 11.032 -2.952 560 HE1 HIS 85 HE1 HIS 85 17.700 14.106 -1.355 561 H SER 86 H SER 86 15.427 9.450 2.888 562 HA SER 86 HA SER 86 14.012 7.027 3.244 563 HB2 SER 86 2HB SER 86 14.117 7.773 5.697 564 HB3 SER 86 3HB SER 86 15.651 7.505 4.867 565 HG SER 86 HG SER 86 15.814 9.443 5.921 566 H GLY 87 H GLY 87 11.937 6.628 3.853 567 HA2 GLY 87 2HA GLY 87 10.154 8.964 3.921 568 HA3 GLY 87 3HA GLY 87 9.704 7.388 3.284 569 H GLY 88 H GLY 88 10.644 5.692 5.281 570 HA2 GLY 88 2HA GLY 88 10.385 6.071 7.889 571 HA3 GLY 88 3HA GLY 88 8.719 6.335 7.401 572 H ASN 89 H ASN 89 8.279 4.504 8.851 573 HA ASN 89 HA ASN 89 8.843 1.916 7.552 574 HB2 ASN 89 2HB ASN 89 8.393 2.521 10.490 575 HB3 ASN 89 3HB ASN 89 8.459 0.897 9.825 576 HD21 ASN 89 1HD2 ASN 89 10.432 0.066 9.138 577 HD22 ASN 89 2HD2 ASN 89 11.936 0.799 9.564 578 H TRP 90 H TRP 90 7.189 0.869 6.763 579 HA TRP 90 HA TRP 90 4.453 1.628 7.617 580 HB2 TRP 90 2HB TRP 90 5.379 0.804 4.850 581 HB3 TRP 90 3HB TRP 90 3.702 1.059 5.306 582 HD1 TRP 90 HD1 TRP 90 5.823 3.704 6.845 583 HE1 TRP 90 HE1 TRP 90 5.675 5.879 5.491 584 HE3 TRP 90 HE3 TRP 90 3.509 1.885 2.668 585 HZ2 TRP 90 HZ2 TRP 90 4.688 6.720 2.975 586 HZ3 TRP 90 HZ3 TRP 90 2.998 3.444 0.838 587 HH2 TRP 90 HH2 TRP 90 3.573 5.805 0.989 588 H ILE 91 H ILE 91 2.854 -0.049 7.591 589 HA ILE 91 HA ILE 91 4.019 -2.753 7.872 590 HB ILE 91 HB ILE 91 1.363 -1.732 8.921 591 HG12 ILE 91 2HG1 ILE 91 3.240 -0.660 10.094 592 HG13 ILE 91 3HG1 ILE 91 2.401 -1.785 11.154 593 HG21 ILE 91 1HG2 ILE 91 1.359 -4.126 8.471 594 HG22 ILE 91 2HG2 ILE 91 1.290 -3.812 10.204 595 HG23 ILE 91 3HG2 ILE 91 2.806 -4.324 9.459 596 HD11 ILE 91 3HD1 ILE 91 4.176 -3.432 10.768 597 HD12 ILE 91 1HD1 ILE 91 4.790 -1.928 11.455 598 HD13 ILE 91 2HD1 ILE 91 5.012 -2.269 9.738 599 H LEU 92 H LEU 92 3.713 -4.034 6.126 600 HA LEU 92 HA LEU 92 1.209 -3.762 4.598 601 HB2 LEU 92 2HB LEU 92 3.961 -4.226 3.432 602 HB3 LEU 92 3HB LEU 92 2.461 -4.142 2.530 603 HG LEU 92 HG LEU 92 3.717 -1.853 4.052 604 HD11 LEU 92 1HD1 LEU 92 5.013 -2.470 2.092 605 HD12 LEU 92 2HD1 LEU 92 4.200 -0.927 1.842 606 HD13 LEU 92 3HD1 LEU 92 3.563 -2.389 1.091 607 HD21 LEU 92 3HD2 LEU 92 1.288 -1.668 3.967 608 HD22 LEU 92 1HD2 LEU 92 1.318 -1.921 2.221 609 HD23 LEU 92 2HD2 LEU 92 2.041 -0.468 2.917 610 H GLY 93 H GLY 93 0.527 -5.578 5.938 611 HA2 GLY 93 2HA GLY 93 0.472 -8.005 4.692 612 HA3 GLY 93 3HA GLY 93 1.859 -8.110 5.768 613 H SER 94 H SER 94 -1.589 -8.010 5.542 614 HA SER 94 HA SER 94 -1.895 -7.964 8.437 615 HB2 SER 94 2HB SER 94 -4.340 -7.959 7.886 616 HB3 SER 94 3HB SER 94 -3.450 -6.582 7.238 617 HG SER 94 HG SER 94 -4.830 -8.544 5.958 618 H ARG 95 H ARG 95 -1.504 -10.244 6.010 619 HA ARG 95 HA ARG 95 -3.188 -12.204 7.283 620 HB2 ARG 95 2HB ARG 95 -1.624 -12.252 4.738 621 HB3 ARG 95 3HB ARG 95 -2.370 -13.702 5.400 622 HG2 ARG 95 2HG ARG 95 -4.555 -12.599 5.358 623 HG3 ARG 95 3HG ARG 95 -3.806 -11.151 4.685 624 HD2 ARG 95 2HD ARG 95 -3.144 -12.366 2.712 625 HD3 ARG 95 3HD ARG 95 -3.750 -13.870 3.402 626 HE ARG 95 HE ARG 95 -5.762 -11.837 3.200 627 HH11 ARG 95 1HH1 ARG 95 -4.010 -14.280 1.427 628 HH12 ARG 95 2HH1 ARG 95 -5.286 -14.628 0.328 629 HH21 ARG 95 1HH2 ARG 95 -7.518 -12.297 1.753 630 HH22 ARG 95 2HH2 ARG 95 -7.307 -13.496 0.527 631 H GLU 96 H GLU 96 -0.466 -11.182 8.385 632 HA GLU 96 HA GLU 96 0.900 -12.017 9.963 633 HB2 GLU 96 2HB GLU 96 -1.060 -13.277 10.704 634 HB3 GLU 96 3HB GLU 96 -0.666 -14.570 9.587 635 HG2 GLU 96 2HG GLU 96 1.411 -14.978 10.816 636 HG3 GLU 96 3HG GLU 96 0.970 -13.699 11.952 637 H ASN 97 H ASN 97 0.593 -15.067 8.169 638 HA ASN 97 HA ASN 97 3.515 -15.147 7.934 639 HB2 ASN 97 2HB ASN 97 1.403 -17.276 7.521 640 HB3 ASN 97 3HB ASN 97 3.110 -17.536 7.196 641 HD21 ASN 97 1HD2 ASN 97 0.666 -17.342 9.594 642 HD22 ASN 97 2HD2 ASN 97 1.664 -17.713 10.954 643 H GLN 98 H GLN 98 1.839 -13.451 6.248 644 HA GLN 98 HA GLN 98 2.834 -14.333 3.673 645 HB2 GLN 98 2HB GLN 98 0.479 -15.262 3.972 646 HB3 GLN 98 3HB GLN 98 -0.085 -13.601 3.972 647 HG2 GLN 98 2HG GLN 98 0.794 -13.303 1.714 648 HG3 GLN 98 3HG GLN 98 1.363 -14.969 1.717 649 HE21 GLN 98 1HE2 GLN 98 0.073 -15.544 -0.041 650 HE22 GLN 98 2HE2 GLN 98 -1.647 -15.712 0.089 651 H ASN 99 H ASN 99 3.890 -12.642 2.911 652 HA ASN 99 HA ASN 99 3.329 -9.961 3.907 653 HB2 ASN 99 2HB ASN 99 5.565 -10.992 2.137 654 HB3 ASN 99 3HB ASN 99 5.425 -9.338 2.711 655 HD21 ASN 99 1HD2 ASN 99 6.305 -12.571 3.484 656 HD22 ASN 99 2HD2 ASN 99 6.947 -12.249 5.053 657 H VAL 100 H VAL 100 3.225 -8.127 2.447 658 HA VAL 100 HA VAL 100 1.540 -8.730 0.155 659 HB VAL 100 HB VAL 100 2.535 -6.066 1.192 660 HG11 VAL 100 1HG1 VAL 100 0.462 -6.660 -0.925 661 HG12 VAL 100 2HG1 VAL 100 2.057 -5.959 -1.208 662 HG13 VAL 100 3HG1 VAL 100 0.853 -5.065 -0.281 663 HG21 VAL 100 3HG2 VAL 100 -0.142 -7.430 1.403 664 HG22 VAL 100 1HG2 VAL 100 0.237 -5.811 1.990 665 HG23 VAL 100 2HG2 VAL 100 1.024 -7.217 2.708 666 H VAL 101 H VAL 101 2.111 -8.797 -1.898 667 HA VAL 101 HA VAL 101 4.917 -8.141 -2.520 668 HB VAL 101 HB VAL 101 4.874 -9.772 -4.352 669 HG11 VAL 101 1HG1 VAL 101 4.066 -10.915 -1.688 670 HG12 VAL 101 2HG1 VAL 101 5.694 -10.453 -2.182 671 HG13 VAL 101 3HG1 VAL 101 4.876 -11.793 -2.984 672 HG21 VAL 101 3HG2 VAL 101 2.482 -9.719 -4.860 673 HG22 VAL 101 1HG2 VAL 101 2.133 -10.499 -3.320 674 HG23 VAL 101 2HG2 VAL 101 3.032 -11.368 -4.559 675 H ALA 102 H ALA 102 1.671 -7.347 -3.327 676 HA ALA 102 HA ALA 102 2.731 -5.302 -5.088 677 HB1 ALA 102 3HB ALA 102 1.600 -5.843 -7.067 678 HB2 ALA 102 1HB ALA 102 0.583 -7.041 -6.274 679 HB3 ALA 102 2HB ALA 102 2.291 -7.373 -6.529 680 H ILE 103 H ILE 103 1.374 -3.522 -5.348 681 HA ILE 103 HA ILE 103 -1.225 -3.682 -4.000 682 HB ILE 103 HB ILE 103 0.803 -1.478 -3.501 683 HG12 ILE 103 2HG1 ILE 103 -0.358 -3.484 -1.549 684 HG13 ILE 103 3HG1 ILE 103 1.235 -3.629 -2.281 685 HG21 ILE 103 1HG2 ILE 103 -1.475 -0.628 -3.608 686 HG22 ILE 103 2HG2 ILE 103 -0.873 -0.580 -1.952 687 HG23 ILE 103 3HG2 ILE 103 -2.001 -1.845 -2.445 688 HD11 ILE 103 3HD1 ILE 103 1.913 -1.528 -1.218 689 HD12 ILE 103 1HD1 ILE 103 1.392 -2.730 -0.040 690 HD13 ILE 103 2HD1 ILE 103 0.319 -1.402 -0.475 691 H ASN 104 H ASN 104 -2.701 -2.963 -5.309 692 HA ASN 104 HA ASN 104 -2.095 -0.703 -7.131 693 HB2 ASN 104 2HB ASN 104 -2.348 -2.805 -8.385 694 HB3 ASN 104 3HB ASN 104 -3.910 -3.080 -7.630 695 HD21 ASN 104 1HD2 ASN 104 -5.676 -1.941 -8.337 696 HD22 ASN 104 2HD2 ASN 104 -5.690 -1.034 -9.809 697 H VAL 105 H VAL 105 -2.958 0.922 -5.888 698 HA VAL 105 HA VAL 105 -5.852 0.784 -5.401 699 HB VAL 105 HB VAL 105 -5.672 1.744 -3.126 700 HG11 VAL 105 1HG1 VAL 105 -4.254 -0.887 -3.506 701 HG12 VAL 105 2HG1 VAL 105 -5.994 -0.639 -3.355 702 HG13 VAL 105 3HG1 VAL 105 -4.935 -0.308 -1.987 703 HG21 VAL 105 3HG2 VAL 105 -3.525 1.668 -1.942 704 HG22 VAL 105 1HG2 VAL 105 -3.482 2.784 -3.311 705 HG23 VAL 105 2HG2 VAL 105 -2.729 1.195 -3.442 706 H GLU 106 H GLU 106 -7.000 2.589 -5.641 707 HA GLU 106 HA GLU 106 -5.661 5.191 -5.667 708 HB2 GLU 106 2HB GLU 106 -7.292 4.140 -7.990 709 HB3 GLU 106 3HB GLU 106 -6.904 5.839 -7.769 710 HG2 GLU 106 2HG GLU 106 -4.515 5.303 -7.909 711 HG3 GLU 106 3HG GLU 106 -4.920 3.604 -8.147 712 H SER 107 H SER 107 -6.637 5.902 -4.088 713 HA SER 107 HA SER 107 -9.398 6.810 -4.114 714 HB2 SER 107 2HB SER 107 -8.840 4.501 -2.267 715 HB3 SER 107 3HB SER 107 -10.240 5.556 -2.091 716 HG SER 107 HG SER 107 -9.838 4.529 -4.626 717 H GLY 108 H GLY 108 -10.203 7.888 -2.151 718 HA2 GLY 108 2HA GLY 108 -9.744 8.670 0.066 719 HA3 GLY 108 3HA GLY 108 -8.032 8.628 -0.328 720 H ASP 109 H ASP 109 -10.316 10.642 0.398 721 HA ASP 109 HA ASP 109 -9.958 12.669 -1.645 722 HB2 ASP 109 2HB ASP 109 -11.121 12.941 1.150 723 HB3 ASP 109 3HB ASP 109 -11.267 14.099 -0.166 724 H ASP 110 H ASP 110 -9.100 12.077 1.683 725 HA ASP 110 HA ASP 110 -6.662 13.701 1.399 726 HB2 ASP 110 2HB ASP 110 -8.431 13.343 3.840 727 HB3 ASP 110 3HB ASP 110 -6.875 14.163 3.848 728 H GLY 111 H GLY 111 -7.233 10.762 0.963 729 HA2 GLY 111 2HA GLY 111 -6.057 8.848 1.387 730 HA3 GLY 111 3HA GLY 111 -5.151 9.706 2.625 731 H GLN 112 H GLN 112 -8.542 9.941 2.851 732 HA GLN 112 HA GLN 112 -8.620 8.778 5.413 733 HB2 GLN 112 2HB GLN 112 -10.847 9.496 3.516 734 HB3 GLN 112 3HB GLN 112 -11.093 8.986 5.180 735 HG2 GLN 112 2HG GLN 112 -9.881 10.916 5.986 736 HG3 GLN 112 3HG GLN 112 -9.529 11.410 4.330 737 HE21 GLN 112 1HE2 GLN 112 -10.988 12.792 6.476 738 HE22 GLN 112 2HE2 GLN 112 -12.544 13.144 5.820 739 H THR 113 H THR 113 -9.688 7.552 2.237 740 HA THR 113 HA THR 113 -9.705 4.879 3.405 741 HB THR 113 HB THR 113 -11.614 4.361 1.833 742 HG1 THR 113 HG1 THR 113 -12.839 6.368 1.278 743 HG21 THR 113 3HG2 THR 113 -12.038 4.691 4.209 744 HG22 THR 113 1HG2 THR 113 -13.353 5.384 3.259 745 HG23 THR 113 2HG2 THR 113 -12.127 6.435 3.970 746 H LEU 114 H LEU 114 -9.092 3.231 1.982 747 HA LEU 114 HA LEU 114 -7.972 4.097 -0.588 748 HB2 LEU 114 2HB LEU 114 -6.701 2.266 1.443 749 HB3 LEU 114 3HB LEU 114 -6.122 2.451 -0.203 750 HG LEU 114 HG LEU 114 -6.242 4.686 1.827 751 HD11 LEU 114 1HD1 LEU 114 -3.903 3.026 0.901 752 HD12 LEU 114 2HD1 LEU 114 -4.634 2.996 2.506 753 HD13 LEU 114 3HD1 LEU 114 -3.810 4.449 1.938 754 HD21 LEU 114 3HD2 LEU 114 -4.972 4.510 -0.904 755 HD22 LEU 114 1HD2 LEU 114 -4.810 5.863 0.215 756 HD23 LEU 114 2HD2 LEU 114 -6.387 5.470 -0.471 757 H ASN 115 H ASN 115 -8.530 2.828 -2.281 758 HA ASN 115 HA ASN 115 -9.607 0.165 -1.724 759 HB2 ASN 115 2HB ASN 115 -10.992 2.279 -3.397 760 HB3 ASN 115 3HB ASN 115 -11.453 0.581 -3.370 761 HD21 ASN 115 1HD2 ASN 115 -11.565 3.603 -1.738 762 HD22 ASN 115 2HD2 ASN 115 -12.612 3.118 -0.454 763 H GLY 116 H GLY 116 -9.473 -1.296 -3.429 764 HA2 GLY 116 2HA GLY 116 -8.878 -0.986 -6.033 765 HA3 GLY 116 3HA GLY 116 -7.314 -0.737 -5.268 766 H THR 117 H THR 117 -6.153 -2.471 -5.485 767 HA THR 117 HA THR 117 -7.287 -5.050 -4.739 768 HB THR 117 HB THR 117 -5.961 -6.126 -6.621 769 HG1 THR 117 HG1 THR 117 -5.630 -4.666 -8.443 770 HG21 THR 117 3HG2 THR 117 -8.263 -4.329 -7.395 771 HG22 THR 117 1HG2 THR 117 -8.396 -5.952 -6.716 772 HG23 THR 117 2HG2 THR 117 -7.692 -5.720 -8.317 773 H MET 118 H MET 118 -5.684 -6.625 -4.168 774 HA MET 118 HA MET 118 -3.039 -5.554 -3.498 775 HB2 MET 118 2HB MET 118 -3.227 -6.651 -1.241 776 HB3 MET 118 3HB MET 118 -4.258 -5.242 -1.461 777 HG2 MET 118 2HG MET 118 -6.178 -6.454 -1.383 778 HG3 MET 118 3HG MET 118 -5.432 -7.875 -2.103 779 HE1 MET 118 3HE MET 118 -4.134 -5.791 0.912 780 HE2 MET 118 1HE MET 118 -4.719 -6.710 2.301 781 HE3 MET 118 2HE MET 118 -5.858 -5.823 1.301 782 H THR 119 H THR 119 -1.419 -7.105 -3.476 783 HA THR 119 HA THR 119 -2.266 -9.848 -4.127 784 HB THR 119 HB THR 119 0.224 -8.510 -5.200 785 HG1 THR 119 HG1 THR 119 -1.098 -8.624 -7.234 786 HG21 THR 119 3HG2 THR 119 0.240 -10.419 -6.751 787 HG22 THR 119 1HG2 THR 119 -1.203 -11.064 -5.965 788 HG23 THR 119 2HG2 THR 119 0.312 -10.953 -5.070 789 H TYR 120 H TYR 120 -1.504 -11.336 -2.804 790 HA TYR 120 HA TYR 120 0.690 -10.655 -0.980 791 HB2 TYR 120 2HB TYR 120 -1.734 -12.371 -0.712 792 HB3 TYR 120 3HB TYR 120 -0.303 -12.792 0.210 793 HD1 TYR 120 HD1 TYR 120 -2.981 -10.309 -0.213 794 HD2 TYR 120 HD2 TYR 120 0.442 -11.418 2.043 795 HE1 TYR 120 HE1 TYR 120 -3.615 -8.719 1.553 796 HE2 TYR 120 HE2 TYR 120 -0.182 -9.841 3.797 797 HH TYR 120 HH TYR 120 -3.237 -8.336 3.923 798 H ALA 121 H ALA 121 2.230 -12.296 -0.451 799 HA ALA 121 HA ALA 121 3.366 -13.517 -2.693 800 HB1 ALA 121 3HB ALA 121 3.835 -14.205 0.206 801 HB2 ALA 121 1HB ALA 121 4.618 -12.899 -0.684 802 HB3 ALA 121 2HB ALA 121 4.907 -14.577 -1.145 803 H GLY 122 H GLY 122 3.019 -15.353 -3.724 804 HA2 GLY 122 2HA GLY 122 2.564 -17.601 -4.052 805 HA3 GLY 122 3HA GLY 122 2.130 -17.735 -2.359 806 H GLU 123 H GLU 123 0.479 -15.162 -3.781 807 HA GLU 123 HA GLU 123 -1.732 -16.823 -4.669 808 HB2 GLU 123 2HB GLU 123 -2.018 -16.546 -2.229 809 HB3 GLU 123 3HB GLU 123 -2.005 -14.803 -2.434 810 HG2 GLU 123 2HG GLU 123 -4.076 -14.880 -3.647 811 HG3 GLU 123 3HG GLU 123 -4.059 -16.644 -3.637 812 H GLY 124 H GLY 124 -3.531 -15.423 -5.575 813 HA2 GLY 124 2HA GLY 124 -2.282 -13.438 -7.294 814 HA3 GLY 124 3HA GLY 124 -3.889 -14.123 -7.482 815 HA PRO 125 HA PRO 125 -4.070 -9.800 -5.622 816 HB2 PRO 125 2HB PRO 125 -5.251 -8.518 -7.679 817 HB3 PRO 125 3HB PRO 125 -3.496 -8.713 -7.573 818 HG2 PRO 125 2HG PRO 125 -5.484 -10.299 -9.154 819 HG3 PRO 125 3HG PRO 125 -3.903 -9.674 -9.657 820 HD2 PRO 125 2HD PRO 125 -4.287 -12.253 -8.894 821 HD3 PRO 125 3HD PRO 125 -2.755 -11.393 -8.632 822 H ILE 126 H ILE 126 -5.778 -9.156 -4.507 823 HA ILE 126 HA ILE 126 -8.475 -10.037 -5.294 824 HB ILE 126 HB ILE 126 -9.034 -10.441 -2.931 825 HG12 ILE 126 2HG1 ILE 126 -6.077 -10.094 -2.405 826 HG13 ILE 126 3HG1 ILE 126 -7.320 -8.928 -1.968 827 HG21 ILE 126 1HG2 ILE 126 -6.679 -12.051 -3.909 828 HG22 ILE 126 2HG2 ILE 126 -8.379 -12.340 -4.284 829 HG23 ILE 126 3HG2 ILE 126 -7.792 -12.547 -2.636 830 HD11 ILE 126 3HD1 ILE 126 -8.351 -10.642 -0.531 831 HD12 ILE 126 1HD1 ILE 126 -6.710 -10.216 -0.046 832 HD13 ILE 126 2HD1 ILE 126 -7.012 -11.722 -0.912 833 H GLY 127 H GLY 127 -10.171 -8.776 -3.904 834 HA2 GLY 127 2HA GLY 127 -9.775 -6.014 -4.483 835 HA3 GLY 127 3HA GLY 127 -11.153 -6.710 -3.647 836 H PHE 128 H PHE 128 -9.138 -4.342 -3.269 837 HA PHE 128 HA PHE 128 -8.488 -4.822 -0.441 838 HB2 PHE 128 2HB PHE 128 -6.541 -4.345 -1.836 839 HB3 PHE 128 3HB PHE 128 -7.316 -2.906 -2.478 840 HD1 PHE 128 HD2 PHE 128 -7.588 -0.907 -1.031 841 HD2 PHE 128 HD1 PHE 128 -5.428 -4.328 0.254 842 HE1 PHE 128 HE2 PHE 128 -6.550 0.425 0.749 843 HE2 PHE 128 HE1 PHE 128 -4.382 -3.005 2.045 844 HZ PHE 128 HZ PHE 128 -4.943 -0.622 2.294 845 H LYS 129 H LYS 129 -9.535 -3.622 1.070 846 HA LYS 129 HA LYS 129 -10.661 -1.041 0.326 847 HB2 LYS 129 2HB LYS 129 -12.504 -2.597 0.100 848 HB3 LYS 129 3HB LYS 129 -12.142 -3.314 1.656 849 HG2 LYS 129 2HG LYS 129 -12.813 -1.288 2.783 850 HG3 LYS 129 3HG LYS 129 -13.081 -0.487 1.231 851 HD2 LYS 129 2HD LYS 129 -14.812 -2.126 0.684 852 HD3 LYS 129 3HD LYS 129 -14.532 -2.939 2.224 853 HE2 LYS 129 2HE LYS 129 -15.378 -0.063 1.979 854 HE3 LYS 129 3HE LYS 129 -16.507 -1.402 2.184 855 HZ1 LYS 129 3HZ LYS 129 -15.265 -1.976 4.243 856 HZ2 LYS 129 1HZ LYS 129 -16.068 -0.479 4.312 857 HZ3 LYS 129 2HZ LYS 129 -14.396 -0.533 4.072 858 H GLY 130 H GLY 130 -9.739 0.380 1.726 859 HA2 GLY 130 2HA GLY 130 -9.372 -0.520 4.508 860 HA3 GLY 130 3HA GLY 130 -8.077 0.292 3.644 861 H THR 131 H THR 131 -9.475 1.023 6.103 862 HA THR 131 HA THR 131 -10.153 3.772 5.338 863 HB THR 131 HB THR 131 -11.842 2.097 7.217 864 HG1 THR 131 HG1 THR 131 -11.938 2.553 4.531 865 HG21 THR 131 3HG2 THR 131 -13.339 4.072 7.253 866 HG22 THR 131 1HG2 THR 131 -12.152 4.971 6.308 867 HG23 THR 131 2HG2 THR 131 -11.757 4.432 7.941 868 H LEU 132 H LEU 132 -9.491 5.261 6.741 869 HA LEU 132 HA LEU 132 -7.493 4.845 8.665 870 HB2 LEU 132 2HB LEU 132 -9.469 7.118 8.493 871 HB3 LEU 132 3HB LEU 132 -8.162 7.089 9.660 872 HG LEU 132 HG LEU 132 -7.760 7.028 6.667 873 HD11 LEU 132 1HD1 LEU 132 -8.786 9.137 7.430 874 HD12 LEU 132 2HD1 LEU 132 -7.131 9.357 6.862 875 HD13 LEU 132 3HD1 LEU 132 -7.472 9.329 8.591 876 HD21 LEU 132 3HD2 LEU 132 -5.941 6.022 7.946 877 HD22 LEU 132 1HD2 LEU 132 -5.852 7.459 8.962 878 HD23 LEU 132 2HD2 LEU 132 -5.447 7.563 7.249 879 H THR 133 H THR 133 -7.401 4.370 10.799 880 HA THR 133 HA THR 133 -9.851 3.388 12.003 881 HB THR 133 HB THR 133 -7.011 3.181 13.042 882 HG1 THR 133 HG1 THR 133 -8.503 1.652 11.210 883 HG21 THR 133 3HG2 THR 133 -7.912 1.310 14.353 884 HG22 THR 133 1HG2 THR 133 -9.515 1.609 13.681 885 HG23 THR 133 2HG2 THR 133 -8.763 2.807 14.733 Start of MODEL 11 1 H1 ALA 2 1H ALA 2 0.295 5.909 8.522 2 H2 ALA 2 2H ALA 2 0.899 5.829 10.104 3 H3 ALA 2 3H ALA 2 0.576 7.330 9.397 4 HA ALA 2 HA ALA 2 -1.124 6.683 10.988 5 HB1 ALA 2 3HB ALA 2 -3.061 7.033 9.510 6 HB2 ALA 2 1HB ALA 2 -2.031 6.736 8.110 7 HB3 ALA 2 2HB ALA 2 -1.740 8.140 9.139 8 H LEU 3 H LEU 3 -2.834 5.247 11.544 9 HA LEU 3 HA LEU 3 -2.207 2.499 10.850 10 HB2 LEU 3 2HB LEU 3 -2.596 3.360 13.221 11 HB3 LEU 3 3HB LEU 3 -4.288 3.481 12.811 12 HG LEU 3 HG LEU 3 -3.596 1.433 14.135 13 HD11 LEU 3 1HD1 LEU 3 -5.730 1.477 13.038 14 HD12 LEU 3 2HD1 LEU 3 -5.010 -0.122 12.861 15 HD13 LEU 3 3HD1 LEU 3 -4.993 1.007 11.505 16 HD21 LEU 3 3HD2 LEU 3 -2.446 0.557 11.490 17 HD22 LEU 3 1HD2 LEU 3 -2.585 -0.424 12.949 18 HD23 LEU 3 2HD2 LEU 3 -1.509 0.977 12.924 19 H TYR 4 H TYR 4 -3.353 1.269 9.515 20 HA TYR 4 HA TYR 4 -5.947 2.264 8.548 21 HB2 TYR 4 2HB TYR 4 -3.694 0.882 7.126 22 HB3 TYR 4 3HB TYR 4 -5.335 0.808 6.505 23 HD1 TYR 4 HD1 TYR 4 -2.688 3.238 7.519 24 HD2 TYR 4 HD2 TYR 4 -6.124 2.482 5.138 25 HE1 TYR 4 HE1 TYR 4 -2.355 5.380 6.363 26 HE2 TYR 4 HE2 TYR 4 -5.810 4.614 3.980 27 HH TYR 4 HH TYR 4 -2.955 6.503 4.316 28 H ASN 5 H ASN 5 -7.612 0.894 8.408 29 HA ASN 5 HA ASN 5 -7.231 -1.812 9.477 30 HB2 ASN 5 2HB ASN 5 -9.461 0.107 9.542 31 HB3 ASN 5 3HB ASN 5 -9.953 -1.525 9.097 32 HD21 ASN 5 1HD2 ASN 5 -8.610 0.484 11.591 33 HD22 ASN 5 2HD2 ASN 5 -8.779 -0.661 12.881 34 H VAL 6 H VAL 6 -7.756 -3.587 8.245 35 HA VAL 6 HA VAL 6 -8.022 -2.936 5.391 36 HB VAL 6 HB VAL 6 -6.515 -5.185 6.725 37 HG11 VAL 6 1HG1 VAL 6 -6.955 -4.678 3.789 38 HG12 VAL 6 2HG1 VAL 6 -7.523 -6.064 4.721 39 HG13 VAL 6 3HG1 VAL 6 -5.795 -5.826 4.453 40 HG21 VAL 6 3HG2 VAL 6 -4.559 -4.138 5.664 41 HG22 VAL 6 1HG2 VAL 6 -5.361 -3.061 6.803 42 HG23 VAL 6 2HG2 VAL 6 -5.596 -2.842 5.071 43 H GLU 7 H GLU 7 -9.680 -3.674 4.357 44 HA GLU 7 HA GLU 7 -11.063 -6.093 5.303 45 HB2 GLU 7 2HB GLU 7 -12.233 -3.642 3.956 46 HB3 GLU 7 3HB GLU 7 -13.115 -5.126 4.268 47 HG2 GLU 7 2HG GLU 7 -12.862 -4.799 6.660 48 HG3 GLU 7 3HG GLU 7 -11.918 -3.337 6.365 49 H ASN 8 H ASN 8 -11.467 -7.611 3.722 50 HA ASN 8 HA ASN 8 -10.516 -6.947 1.012 51 HB2 ASN 8 2HB ASN 8 -9.834 -9.417 2.600 52 HB3 ASN 8 3HB ASN 8 -9.544 -9.251 0.875 53 HD21 ASN 8 1HD2 ASN 8 -8.052 -7.671 0.172 54 HD22 ASN 8 2HD2 ASN 8 -6.786 -7.136 1.223 55 H GLN 9 H GLN 9 -11.415 -8.018 -0.694 56 HA GLN 9 HA GLN 9 -13.757 -9.738 -0.141 57 HB2 GLN 9 2HB GLN 9 -14.476 -7.463 -0.891 58 HB3 GLN 9 3HB GLN 9 -13.525 -7.682 -2.357 59 HG2 GLN 9 2HG GLN 9 -14.926 -9.640 -2.925 60 HG3 GLN 9 3HG GLN 9 -15.922 -9.298 -1.511 61 HE21 GLN 9 1HE2 GLN 9 -16.718 -9.379 -4.277 62 HE22 GLN 9 2HE2 GLN 9 -17.341 -7.813 -4.659 63 H TRP 10 H TRP 10 -13.470 -11.727 -1.088 64 HA TRP 10 HA TRP 10 -11.913 -11.797 -3.553 65 HB2 TRP 10 2HB TRP 10 -10.358 -13.467 -2.751 66 HB3 TRP 10 3HB TRP 10 -10.273 -12.022 -1.752 67 HD1 TRP 10 HD1 TRP 10 -11.243 -15.711 -1.613 68 HE1 TRP 10 HE1 TRP 10 -11.552 -16.405 0.841 69 HE3 TRP 10 HE3 TRP 10 -10.943 -11.100 0.573 70 HZ2 TRP 10 HZ2 TRP 10 -11.655 -15.164 3.370 71 HZ3 TRP 10 HZ3 TRP 10 -11.156 -10.945 3.020 72 HH2 TRP 10 HH2 TRP 10 -11.504 -12.934 4.385 73 H GLY 11 H GLY 11 -14.919 -12.735 -2.515 74 HA2 GLY 11 2HA GLY 11 -14.520 -15.450 -3.441 75 HA3 GLY 11 3HA GLY 11 -15.778 -14.903 -2.344 76 H GLY 12 H GLY 12 -14.928 -12.829 -4.956 77 HA2 GLY 12 2HA GLY 12 -15.875 -12.902 -7.176 78 HA3 GLY 12 3HA GLY 12 -17.222 -13.819 -6.518 79 H SER 13 H SER 13 -17.846 -11.844 -8.048 80 HA SER 13 HA SER 13 -18.247 -9.318 -6.905 81 HB2 SER 13 2HB SER 13 -20.067 -10.632 -8.923 82 HB3 SER 13 3HB SER 13 -19.807 -8.906 -8.674 83 HG SER 13 HG SER 13 -18.349 -10.691 -10.119 84 H SER 14 H SER 14 -20.086 -8.323 -5.999 85 HA SER 14 HA SER 14 -21.816 -8.091 -4.549 86 HB2 SER 14 2HB SER 14 -22.697 -10.803 -5.580 87 HB3 SER 14 3HB SER 14 -23.695 -9.674 -4.665 88 HG SER 14 HG SER 14 -22.528 -8.568 -6.892 89 H ALA 15 H ALA 15 -19.303 -9.604 -3.832 90 HA ALA 15 HA ALA 15 -20.277 -11.246 -1.634 91 HB1 ALA 15 3HB ALA 15 -17.966 -11.976 -1.369 92 HB2 ALA 15 1HB ALA 15 -17.454 -10.831 -2.607 93 HB3 ALA 15 2HB ALA 15 -18.500 -12.183 -3.038 94 HA PRO 16 HA PRO 16 -19.532 -8.027 1.313 95 HB2 PRO 16 2HB PRO 16 -19.010 -10.075 3.341 96 HB3 PRO 16 3HB PRO 16 -20.371 -8.955 3.210 97 HG2 PRO 16 2HG PRO 16 -20.638 -11.609 2.788 98 HG3 PRO 16 3HG PRO 16 -21.611 -10.405 1.922 99 HD2 PRO 16 2HD PRO 16 -19.184 -11.894 1.012 100 HD3 PRO 16 3HD PRO 16 -20.691 -11.548 0.136 101 H TRP 17 H TRP 17 -17.943 -7.185 2.688 102 HA TRP 17 HA TRP 17 -15.230 -7.998 1.953 103 HB2 TRP 17 2HB TRP 17 -16.242 -5.548 3.416 104 HB3 TRP 17 3HB TRP 17 -14.545 -5.874 3.093 105 HD1 TRP 17 HD1 TRP 17 -17.805 -5.030 1.262 106 HE1 TRP 17 HE1 TRP 17 -17.218 -3.993 -1.020 107 HE3 TRP 17 HE3 TRP 17 -12.753 -5.692 1.359 108 HZ2 TRP 17 HZ2 TRP 17 -14.913 -3.523 -2.577 109 HZ3 TRP 17 HZ3 TRP 17 -11.424 -4.927 -0.566 110 HH2 TRP 17 HH2 TRP 17 -12.480 -3.865 -2.489 111 H ASN 18 H ASN 18 -13.845 -8.955 3.336 112 HA ASN 18 HA ASN 18 -14.839 -9.477 6.055 113 HB2 ASN 18 2HB ASN 18 -12.928 -11.090 4.340 114 HB3 ASN 18 3HB ASN 18 -13.408 -11.494 5.984 115 HD21 ASN 18 1HD2 ASN 18 -14.372 -11.380 2.660 116 HD22 ASN 18 2HD2 ASN 18 -15.814 -12.316 2.820 117 H GLU 19 H GLU 19 -13.407 -9.129 7.746 118 HA GLU 19 HA GLU 19 -11.470 -7.137 7.234 119 HB2 GLU 19 2HB GLU 19 -10.997 -7.290 9.653 120 HB3 GLU 19 3HB GLU 19 -12.689 -7.035 9.245 121 HG2 GLU 19 2HG GLU 19 -13.035 -9.495 9.546 122 HG3 GLU 19 3HG GLU 19 -11.393 -9.582 10.182 123 H GLY 20 H GLY 20 -9.501 -7.247 6.837 124 HA2 GLY 20 2HA GLY 20 -8.181 -9.888 6.693 125 HA3 GLY 20 3HA GLY 20 -7.706 -8.484 5.755 126 H GLY 21 H GLY 21 -7.968 -6.987 8.532 127 HA2 GLY 21 2HA GLY 21 -6.397 -7.468 10.483 128 HA3 GLY 21 3HA GLY 21 -5.172 -7.590 9.225 129 H GLN 22 H GLN 22 -3.980 -5.848 10.075 130 HA GLN 22 HA GLN 22 -5.111 -3.240 9.400 131 HB2 GLN 22 2HB GLN 22 -4.211 -2.233 11.457 132 HB3 GLN 22 3HB GLN 22 -5.449 -3.427 11.804 133 HG2 GLN 22 2HG GLN 22 -3.666 -5.061 12.323 134 HG3 GLN 22 3HG GLN 22 -2.471 -3.793 12.062 135 HE21 GLN 22 1HE2 GLN 22 -4.195 -1.750 13.265 136 HE22 GLN 22 2HE2 GLN 22 -4.137 -2.023 14.972 137 H TRP 23 H TRP 23 -3.751 -1.952 8.335 138 HA TRP 23 HA TRP 23 -0.901 -2.718 8.191 139 HB2 TRP 23 2HB TRP 23 -2.681 -1.423 6.116 140 HB3 TRP 23 3HB TRP 23 -0.933 -1.494 5.978 141 HD1 TRP 23 HD1 TRP 23 -1.904 -4.667 7.429 142 HE1 TRP 23 HE1 TRP 23 -2.114 -6.493 5.649 143 HE3 TRP 23 HE3 TRP 23 -1.926 -1.732 3.242 144 HZ2 TRP 23 HZ2 TRP 23 -2.251 -6.679 2.855 145 HZ3 TRP 23 HZ3 TRP 23 -2.091 -2.841 1.031 146 HH2 TRP 23 HH2 TRP 23 -2.250 -5.257 0.859 147 H GLU 24 H GLU 24 0.598 -0.923 7.846 148 HA GLU 24 HA GLU 24 -0.537 1.606 8.797 149 HB2 GLU 24 2HB GLU 24 0.899 0.690 10.565 150 HB3 GLU 24 3HB GLU 24 2.248 0.618 9.433 151 HG2 GLU 24 2HG GLU 24 2.321 2.997 9.242 152 HG3 GLU 24 3HG GLU 24 0.813 3.170 10.134 153 H ILE 25 H ILE 25 -0.462 3.151 7.468 154 HA ILE 25 HA ILE 25 1.553 3.232 5.331 155 HB ILE 25 HB ILE 25 -1.451 3.483 4.963 156 HG12 ILE 25 2HG1 ILE 25 0.492 1.543 3.698 157 HG13 ILE 25 3HG1 ILE 25 -0.545 1.166 5.070 158 HG21 ILE 25 1HG2 ILE 25 0.722 3.944 2.929 159 HG22 ILE 25 2HG2 ILE 25 -0.343 5.167 3.619 160 HG23 ILE 25 3HG2 ILE 25 -1.009 3.900 2.591 161 HD11 ILE 25 3HD1 ILE 25 -2.517 1.551 3.683 162 HD12 ILE 25 1HD1 ILE 25 -1.468 0.310 2.998 163 HD13 ILE 25 2HD1 ILE 25 -1.476 1.935 2.311 164 H GLY 26 H GLY 26 2.074 5.351 4.676 165 HA2 GLY 26 2HA GLY 26 1.954 7.677 4.648 166 HA3 GLY 26 3HA GLY 26 0.527 7.591 5.673 167 H SER 27 H SER 27 3.947 7.105 5.663 168 HA SER 27 HA SER 27 4.380 7.116 8.458 169 HB2 SER 27 2HB SER 27 6.324 8.030 6.331 170 HB3 SER 27 3HB SER 27 6.719 7.455 7.951 171 HG SER 27 HG SER 27 5.821 5.421 7.357 172 H ARG 28 H ARG 28 4.489 9.719 6.072 173 HA ARG 28 HA ARG 28 5.106 11.753 7.976 174 HB2 ARG 28 2HB ARG 28 4.161 11.887 5.116 175 HB3 ARG 28 3HB ARG 28 4.635 13.293 6.061 176 HG2 ARG 28 2HG ARG 28 6.877 12.411 6.291 177 HG3 ARG 28 3HG ARG 28 6.412 10.952 5.418 178 HD2 ARG 28 2HD ARG 28 5.926 12.293 3.437 179 HD3 ARG 28 3HD ARG 28 6.376 13.755 4.312 180 HE ARG 28 HE ARG 28 8.602 13.156 4.173 181 HH11 ARG 28 1HH1 ARG 28 6.571 10.668 2.778 182 HH12 ARG 28 2HH1 ARG 28 7.876 9.827 2.006 183 HH21 ARG 28 1HH2 ARG 28 10.348 12.060 3.168 184 HH22 ARG 28 2HH2 ARG 28 10.051 10.639 2.232 185 H SER 29 H SER 29 3.790 12.917 9.180 186 HA SER 29 HA SER 29 1.051 12.349 9.429 187 HB2 SER 29 2HB SER 29 2.539 14.765 10.470 188 HB3 SER 29 3HB SER 29 1.037 14.090 11.097 189 HG SER 29 HG SER 29 2.396 13.079 12.368 190 H ASP 30 H ASP 30 2.795 14.788 7.621 191 HA ASP 30 HA ASP 30 0.326 16.270 7.050 192 HB2 ASP 30 2HB ASP 30 3.204 16.964 6.421 193 HB3 ASP 30 3HB ASP 30 1.812 17.970 6.047 194 H GLN 31 H GLN 31 1.125 13.564 5.808 195 HA GLN 31 HA GLN 31 0.620 14.262 3.117 196 HB2 GLN 31 2HB GLN 31 3.400 13.580 3.915 197 HB3 GLN 31 3HB GLN 31 2.790 12.864 2.431 198 HG2 GLN 31 2HG GLN 31 2.698 15.808 3.002 199 HG3 GLN 31 3HG GLN 31 4.014 15.014 2.136 200 HE21 GLN 31 1HE2 GLN 31 0.595 15.760 2.069 201 HE22 GLN 31 2HE2 GLN 31 0.393 15.560 0.363 202 H ASN 32 H ASN 32 -1.015 12.908 2.968 203 HA ASN 32 HA ASN 32 -0.528 10.128 3.705 204 HB2 ASN 32 2HB ASN 32 -2.590 11.327 4.629 205 HB3 ASN 32 3HB ASN 32 -3.221 11.285 2.985 206 HD21 ASN 32 1HD2 ASN 32 -4.936 9.950 3.652 207 HD22 ASN 32 2HD2 ASN 32 -4.687 8.265 3.986 208 H VAL 33 H VAL 33 -1.418 8.524 2.290 209 HA VAL 33 HA VAL 33 -0.555 9.091 -0.442 210 HB VAL 33 HB VAL 33 -0.980 6.448 0.955 211 HG11 VAL 33 1HG1 VAL 33 -1.205 6.284 -1.459 212 HG12 VAL 33 2HG1 VAL 33 0.274 5.499 -0.906 213 HG13 VAL 33 3HG1 VAL 33 0.349 7.088 -1.667 214 HG21 VAL 33 3HG2 VAL 33 0.829 7.794 1.948 215 HG22 VAL 33 1HG2 VAL 33 1.599 7.896 0.365 216 HG23 VAL 33 2HG2 VAL 33 1.427 6.332 1.166 217 H VAL 34 H VAL 34 -1.934 8.938 -2.153 218 HA VAL 34 HA VAL 34 -4.681 8.061 -1.557 219 HB VAL 34 HB VAL 34 -5.430 9.438 -3.472 220 HG11 VAL 34 1HG1 VAL 34 -3.921 10.930 -1.344 221 HG12 VAL 34 2HG1 VAL 34 -5.562 10.302 -1.213 222 HG13 VAL 34 3HG1 VAL 34 -5.199 11.597 -2.353 223 HG21 VAL 34 3HG2 VAL 34 -3.396 9.524 -4.779 224 HG22 VAL 34 1HG2 VAL 34 -2.570 10.401 -3.491 225 HG23 VAL 34 2HG2 VAL 34 -3.896 11.163 -4.364 226 H ALA 35 H ALA 35 -1.897 7.383 -3.431 227 HA ALA 35 HA ALA 35 -3.331 5.169 -4.640 228 HB1 ALA 35 3HB ALA 35 -2.695 5.615 -6.899 229 HB2 ALA 35 1HB ALA 35 -1.756 7.023 -6.412 230 HB3 ALA 35 2HB ALA 35 -3.510 7.046 -6.276 231 H ILE 36 H ILE 36 -2.042 3.420 -5.183 232 HA ILE 36 HA ILE 36 0.828 3.647 -4.700 233 HB ILE 36 HB ILE 36 -0.941 1.658 -3.242 234 HG12 ILE 36 2HG1 ILE 36 0.916 3.737 -2.082 235 HG13 ILE 36 3HG1 ILE 36 -0.821 3.970 -2.261 236 HG21 ILE 36 1HG2 ILE 36 1.100 0.588 -3.994 237 HG22 ILE 36 2HG2 ILE 36 1.147 0.814 -2.246 238 HG23 ILE 36 3HG2 ILE 36 2.070 1.885 -3.297 239 HD11 ILE 36 3HD1 ILE 36 -1.227 2.106 -0.755 240 HD12 ILE 36 1HD1 ILE 36 -0.210 3.326 0.007 241 HD13 ILE 36 2HD1 ILE 36 0.509 1.839 -0.608 242 H ASN 37 H ASN 37 1.799 2.687 -6.410 243 HA ASN 37 HA ASN 37 0.629 0.190 -7.425 244 HB2 ASN 37 2HB ASN 37 1.610 2.610 -8.857 245 HB3 ASN 37 3HB ASN 37 2.088 1.058 -9.533 246 HD21 ASN 37 1HD2 ASN 37 -0.925 1.328 -7.843 247 HD22 ASN 37 2HD2 ASN 37 -1.943 1.238 -9.240 248 H VAL 38 H VAL 38 1.945 -1.423 -6.737 249 HA VAL 38 HA VAL 38 4.809 -1.090 -6.968 250 HB VAL 38 HB VAL 38 5.302 -1.789 -4.623 251 HG11 VAL 38 1HG1 VAL 38 3.839 0.835 -4.872 252 HG12 VAL 38 2HG1 VAL 38 5.536 0.541 -5.243 253 HG13 VAL 38 3HG1 VAL 38 4.959 0.396 -3.583 254 HG21 VAL 38 3HG2 VAL 38 3.153 -2.760 -4.044 255 HG22 VAL 38 1HG2 VAL 38 2.390 -1.175 -4.152 256 HG23 VAL 38 2HG2 VAL 38 3.584 -1.495 -2.896 257 H GLU 39 H GLU 39 5.957 -3.009 -6.920 258 HA GLU 39 HA GLU 39 4.556 -5.471 -6.318 259 HB2 GLU 39 2HB GLU 39 4.172 -5.032 -8.767 260 HB3 GLU 39 3HB GLU 39 5.913 -5.078 -8.996 261 HG2 GLU 39 2HG GLU 39 5.977 -7.397 -8.276 262 HG3 GLU 39 3HG GLU 39 4.248 -7.358 -7.942 263 H SER 40 H SER 40 6.025 -7.212 -5.929 264 HA SER 40 HA SER 40 8.594 -6.196 -4.994 265 HB2 SER 40 2HB SER 40 7.035 -7.612 -3.544 266 HB3 SER 40 3HB SER 40 7.490 -8.968 -4.570 267 HG SER 40 HG SER 40 9.375 -7.327 -3.248 268 H GLY 41 H GLY 41 10.548 -6.923 -5.638 269 HA2 GLY 41 2HA GLY 41 10.641 -8.385 -8.160 270 HA3 GLY 41 3HA GLY 41 12.006 -7.655 -7.323 271 H ASP 42 H ASP 42 10.788 -9.079 -4.862 272 HA ASP 42 HA ASP 42 11.887 -11.756 -5.384 273 HB2 ASP 42 2HB ASP 42 12.477 -9.932 -3.040 274 HB3 ASP 42 3HB ASP 42 12.777 -11.663 -2.992 275 H ASP 43 H ASP 43 11.459 -12.563 -2.628 276 HA ASP 43 HA ASP 43 8.697 -13.320 -2.817 277 HB2 ASP 43 2HB ASP 43 10.772 -13.811 -0.670 278 HB3 ASP 43 3HB ASP 43 9.163 -14.519 -0.670 279 H GLY 44 H GLY 44 8.952 -10.517 -2.565 280 HA2 GLY 44 2HA GLY 44 7.461 -9.032 -1.473 281 HA3 GLY 44 3HA GLY 44 7.425 -10.126 -0.100 282 H GLN 45 H GLN 45 10.532 -10.075 -0.766 283 HA GLN 45 HA GLN 45 11.159 -8.534 1.493 284 HB2 GLN 45 2HB GLN 45 12.924 -9.643 -0.659 285 HB3 GLN 45 3HB GLN 45 13.532 -8.841 0.783 286 HG2 GLN 45 2HG GLN 45 12.376 -10.518 2.163 287 HG3 GLN 45 3HG GLN 45 11.879 -11.344 0.686 288 HE21 GLN 45 1HE2 GLN 45 14.481 -10.561 2.788 289 HE22 GLN 45 2HE2 GLN 45 15.629 -11.656 2.125 290 H THR 46 H THR 46 11.390 -7.729 -1.940 291 HA THR 46 HA THR 46 11.822 -4.974 -1.043 292 HB THR 46 HB THR 46 13.932 -5.612 -1.980 293 HG1 THR 46 HG1 THR 46 12.695 -4.248 -4.138 294 HG21 THR 46 3HG2 THR 46 14.182 -6.482 -4.265 295 HG22 THR 46 1HG2 THR 46 12.427 -6.535 -4.437 296 HG23 THR 46 2HG2 THR 46 13.229 -7.577 -3.262 297 H LEU 47 H LEU 47 9.937 -3.943 -1.360 298 HA LEU 47 HA LEU 47 8.386 -4.500 -3.735 299 HB2 LEU 47 2HB LEU 47 7.887 -2.542 -1.488 300 HB3 LEU 47 3HB LEU 47 6.747 -3.013 -2.724 301 HG LEU 47 HG LEU 47 7.817 -4.796 -0.540 302 HD11 LEU 47 1HD1 LEU 47 6.256 -3.153 0.302 303 HD12 LEU 47 2HD1 LEU 47 5.502 -4.749 0.275 304 HD13 LEU 47 3HD1 LEU 47 5.101 -3.563 -0.966 305 HD21 LEU 47 3HD2 LEU 47 7.419 -6.089 -2.514 306 HD22 LEU 47 1HD2 LEU 47 5.841 -5.341 -2.748 307 HD23 LEU 47 2HD2 LEU 47 6.120 -6.396 -1.362 308 H ASN 48 H ASN 48 8.548 -3.287 -5.492 309 HA ASN 48 HA ASN 48 9.803 -0.635 -5.238 310 HB2 ASN 48 2HB ASN 48 10.151 -2.552 -7.560 311 HB3 ASN 48 3HB ASN 48 10.960 -1.006 -7.339 312 HD21 ASN 48 1HD2 ASN 48 12.526 -0.843 -5.674 313 HD22 ASN 48 2HD2 ASN 48 13.372 -2.230 -5.092 314 H GLY 49 H GLY 49 8.832 1.028 -6.440 315 HA2 GLY 49 2HA GLY 49 7.197 0.690 -8.639 316 HA3 GLY 49 3HA GLY 49 6.144 0.528 -7.249 317 H THR 50 H THR 50 4.977 2.313 -7.788 318 HA THR 50 HA THR 50 6.304 4.900 -7.415 319 HB THR 50 HB THR 50 4.105 4.318 -9.427 320 HG1 THR 50 HG1 THR 50 6.585 5.200 -10.310 321 HG21 THR 50 3HG2 THR 50 4.575 6.599 -10.225 322 HG22 THR 50 1HG2 THR 50 5.763 6.803 -8.937 323 HG23 THR 50 2HG2 THR 50 4.057 6.606 -8.537 324 H MET 51 H MET 51 5.245 6.214 -6.010 325 HA MET 51 HA MET 51 2.579 5.351 -5.057 326 HB2 MET 51 2HB MET 51 4.445 4.867 -3.451 327 HB3 MET 51 3HB MET 51 4.782 6.588 -3.389 328 HG2 MET 51 2HG MET 51 2.508 6.960 -2.492 329 HG3 MET 51 3HG MET 51 2.269 5.209 -2.483 330 HE1 MET 51 3HE MET 51 5.677 7.018 -1.616 331 HE2 MET 51 1HE MET 51 5.414 7.337 0.099 332 HE3 MET 51 2HE MET 51 4.416 8.142 -1.110 333 H THR 52 H THR 52 1.079 7.021 -4.597 334 HA THR 52 HA THR 52 1.975 9.731 -5.340 335 HB THR 52 HB THR 52 -0.719 8.519 -5.978 336 HG1 THR 52 HG1 THR 52 0.048 8.223 -8.023 337 HG21 THR 52 3HG2 THR 52 0.556 11.135 -6.803 338 HG22 THR 52 1HG2 THR 52 -0.797 10.943 -5.689 339 HG23 THR 52 2HG2 THR 52 -0.992 10.525 -7.392 340 H TYR 53 H TYR 53 1.613 11.239 -3.865 341 HA TYR 53 HA TYR 53 -0.037 10.674 -1.528 342 HB2 TYR 53 2HB TYR 53 1.921 12.862 -2.189 343 HB3 TYR 53 3HB TYR 53 0.865 12.957 -0.792 344 HD1 TYR 53 HD2 TYR 53 1.069 11.196 0.990 345 HD2 TYR 53 HD1 TYR 53 3.932 11.629 -2.116 346 HE1 TYR 53 HE2 TYR 53 2.698 9.957 2.335 347 HE2 TYR 53 HE1 TYR 53 5.575 10.395 -0.763 348 HH TYR 53 HH TYR 53 6.031 9.598 1.283 349 H ALA 54 H ALA 54 -1.478 12.368 -0.699 350 HA ALA 54 HA ALA 54 -3.374 13.177 -2.641 351 HB1 ALA 54 3HB ALA 54 -3.091 14.142 0.208 352 HB2 ALA 54 1HB ALA 54 -3.952 12.684 -0.287 353 HB3 ALA 54 2HB ALA 54 -4.531 14.267 -0.805 354 H GLY 55 H GLY 55 -3.571 15.008 -3.764 355 HA2 GLY 55 2HA GLY 55 -3.260 17.185 -4.459 356 HA3 GLY 55 3HA GLY 55 -2.496 17.514 -2.917 357 H GLU 56 H GLU 56 -0.935 14.916 -4.251 358 HA GLU 56 HA GLU 56 1.077 16.659 -5.507 359 HB2 GLU 56 2HB GLU 56 1.521 14.234 -3.761 360 HB3 GLU 56 3HB GLU 56 2.790 15.067 -4.649 361 HG2 GLU 56 2HG GLU 56 1.092 16.259 -2.468 362 HG3 GLU 56 3HG GLU 56 2.753 15.697 -2.292 363 H GLY 57 H GLY 57 2.745 15.042 -6.669 364 HA2 GLY 57 2HA GLY 57 1.080 13.452 -8.493 365 HA3 GLY 57 3HA GLY 57 2.620 14.191 -8.912 366 HA PRO 58 HA PRO 58 3.077 9.609 -7.659 367 HB2 PRO 58 2HB PRO 58 4.167 9.404 -10.403 368 HB3 PRO 58 3HB PRO 58 3.017 8.356 -9.573 369 HG2 PRO 58 2HG PRO 58 2.214 9.994 -11.528 370 HG3 PRO 58 3HG PRO 58 1.199 9.698 -10.101 371 HD2 PRO 58 2HD PRO 58 2.951 12.042 -10.731 372 HD3 PRO 58 3HD PRO 58 1.317 12.011 -10.042 373 H ILE 59 H ILE 59 4.925 8.996 -6.731 374 HA ILE 59 HA ILE 59 7.468 10.163 -7.653 375 HB ILE 59 HB ILE 59 8.224 10.388 -5.332 376 HG12 ILE 59 2HG1 ILE 59 5.384 9.705 -4.535 377 HG13 ILE 59 3HG1 ILE 59 6.748 8.597 -4.410 378 HG21 ILE 59 1HG2 ILE 59 7.243 12.333 -6.391 379 HG22 ILE 59 2HG2 ILE 59 6.824 12.310 -4.679 380 HG23 ILE 59 3HG2 ILE 59 5.631 11.826 -5.886 381 HD11 ILE 59 3HD1 ILE 59 6.351 11.178 -2.919 382 HD12 ILE 59 1HD1 ILE 59 7.839 10.229 -2.889 383 HD13 ILE 59 2HD1 ILE 59 6.342 9.536 -2.273 384 H GLY 60 H GLY 60 9.376 8.941 -6.695 385 HA2 GLY 60 2HA GLY 60 9.044 6.158 -7.304 386 HA3 GLY 60 3HA GLY 60 10.532 6.934 -6.778 387 H PHE 61 H PHE 61 8.884 4.435 -5.998 388 HA PHE 61 HA PHE 61 8.976 4.867 -3.078 389 HB2 PHE 61 2HB PHE 61 6.655 4.772 -3.871 390 HB3 PHE 61 3HB PHE 61 6.980 3.249 -4.678 391 HD1 PHE 61 HD2 PHE 61 7.250 1.185 -3.365 392 HD2 PHE 61 HD1 PHE 61 6.288 4.890 -1.525 393 HE1 PHE 61 HE2 PHE 61 6.538 -0.013 -1.340 394 HE2 PHE 61 HE1 PHE 61 5.570 3.702 0.500 395 HZ PHE 61 HZ PHE 61 5.692 1.247 0.595 396 H ARG 62 H ARG 62 10.365 3.496 -2.063 397 HA ARG 62 HA ARG 62 10.747 0.805 -3.175 398 HB2 ARG 62 2HB ARG 62 12.677 2.207 -3.851 399 HB3 ARG 62 3HB ARG 62 12.974 2.594 -2.162 400 HG2 ARG 62 2HG ARG 62 13.454 0.242 -1.702 401 HG3 ARG 62 3HG ARG 62 13.118 -0.159 -3.388 402 HD2 ARG 62 2HD ARG 62 15.489 -0.012 -3.112 403 HD3 ARG 62 3HD ARG 62 14.960 1.375 -4.060 404 HE ARG 62 HE ARG 62 15.127 1.970 -1.262 405 HH11 ARG 62 1HH1 ARG 62 17.018 1.677 -4.205 406 HH12 ARG 62 2HH1 ARG 62 18.323 2.643 -3.615 407 HH21 ARG 62 1HH2 ARG 62 16.855 3.225 -0.459 408 HH22 ARG 62 2HH2 ARG 62 18.230 3.533 -1.470 409 H ALA 63 H ALA 63 10.598 -0.776 -1.649 410 HA ALA 63 HA ALA 63 10.937 -0.005 1.173 411 HB1 ALA 63 3HB ALA 63 8.673 -1.721 0.169 412 HB2 ALA 63 1HB ALA 63 8.526 -0.008 0.561 413 HB3 ALA 63 2HB ALA 63 8.939 -1.171 1.821 414 H THR 64 H THR 64 11.835 -1.517 2.493 415 HA THR 64 HA THR 64 12.561 -4.118 1.288 416 HB THR 64 HB THR 64 14.214 -2.496 3.249 417 HG1 THR 64 HG1 THR 64 14.149 -2.646 0.450 418 HG21 THR 64 3HG2 THR 64 14.560 -4.926 3.434 419 HG22 THR 64 1HG2 THR 64 15.981 -4.135 2.751 420 HG23 THR 64 2HG2 THR 64 14.869 -5.011 1.699 421 H LEU 65 H LEU 65 12.019 -5.931 2.452 422 HA LEU 65 HA LEU 65 10.371 -5.680 4.742 423 HB2 LEU 65 2HB LEU 65 10.058 -7.447 3.119 424 HB3 LEU 65 3HB LEU 65 11.644 -8.099 3.467 425 HG LEU 65 HG LEU 65 10.856 -8.600 5.791 426 HD11 LEU 65 1HD1 LEU 65 8.180 -7.830 4.653 427 HD12 LEU 65 2HD1 LEU 65 9.038 -7.038 5.975 428 HD13 LEU 65 3HD1 LEU 65 8.430 -8.681 6.176 429 HD21 LEU 65 3HD2 LEU 65 10.949 -10.328 4.084 430 HD22 LEU 65 1HD2 LEU 65 9.333 -9.884 3.526 431 HD23 LEU 65 2HD2 LEU 65 9.554 -10.568 5.135 432 H LEU 66 H LEU 66 11.046 -5.228 6.697 433 HA LEU 66 HA LEU 66 13.673 -5.946 7.656 434 HB2 LEU 66 2HB LEU 66 11.316 -4.834 9.184 435 HB3 LEU 66 3HB LEU 66 12.982 -4.872 9.724 436 HG LEU 66 HG LEU 66 11.908 -3.224 7.426 437 HD11 LEU 66 1HD1 LEU 66 12.362 -1.321 8.889 438 HD12 LEU 66 2HD1 LEU 66 12.826 -2.430 10.179 439 HD13 LEU 66 3HD1 LEU 66 11.165 -2.410 9.592 440 HD21 LEU 66 3HD2 LEU 66 14.667 -3.381 8.633 441 HD22 LEU 66 1HD2 LEU 66 14.140 -2.181 7.456 442 HD23 LEU 66 2HD2 LEU 66 14.201 -3.880 7.007 443 H GLY 67 H GLY 67 10.410 -7.096 7.856 444 HA2 GLY 67 2HA GLY 67 10.231 -9.557 8.281 445 HA3 GLY 67 3HA GLY 67 11.249 -9.256 9.688 446 H ASN 68 H ASN 68 8.717 -10.449 9.961 447 HA ASN 68 HA ASN 68 6.839 -10.308 11.219 448 HB2 ASN 68 2HB ASN 68 8.243 -7.845 12.282 449 HB3 ASN 68 3HB ASN 68 6.690 -8.396 12.903 450 HD21 ASN 68 1HD2 ASN 68 9.251 -8.152 14.250 451 HD22 ASN 68 2HD2 ASN 68 9.622 -9.723 14.866 452 H ASN 69 H ASN 69 6.818 -9.323 8.590 453 HA ASN 69 HA ASN 69 5.446 -8.303 7.099 454 HB2 ASN 69 2HB ASN 69 3.719 -7.958 9.556 455 HB3 ASN 69 3HB ASN 69 3.193 -7.513 7.940 456 HD21 ASN 69 1HD2 ASN 69 2.117 -9.496 9.791 457 HD22 ASN 69 2HD2 ASN 69 2.141 -11.001 8.939 458 H SER 70 H SER 70 7.422 -6.728 8.814 459 HA SER 70 HA SER 70 6.285 -4.058 8.394 460 HB2 SER 70 2HB SER 70 8.626 -4.880 10.126 461 HB3 SER 70 3HB SER 70 7.946 -3.257 10.004 462 HG SER 70 HG SER 70 6.356 -5.473 10.756 463 H TYR 71 H TYR 71 7.150 -2.723 6.958 464 HA TYR 71 HA TYR 71 9.663 -3.504 5.625 465 HB2 TYR 71 2HB TYR 71 7.240 -2.103 4.468 466 HB3 TYR 71 3HB TYR 71 8.753 -2.358 3.612 467 HD1 TYR 71 HD1 TYR 71 5.734 -3.996 4.947 468 HD2 TYR 71 HD2 TYR 71 9.290 -4.490 2.675 469 HE1 TYR 71 HE1 TYR 71 4.891 -6.148 4.109 470 HE2 TYR 71 HE2 TYR 71 8.458 -6.640 1.834 471 HH TYR 71 HH TYR 71 5.382 -7.587 1.911 472 H GLU 72 H GLU 72 11.060 -1.802 5.027 473 HA GLU 72 HA GLU 72 10.448 0.759 6.317 474 HB2 GLU 72 2HB GLU 72 12.528 -0.459 7.064 475 HB3 GLU 72 3HB GLU 72 13.170 -0.229 5.443 476 HG2 GLU 72 2HG GLU 72 13.174 2.142 5.703 477 HG3 GLU 72 3HG GLU 72 12.312 2.027 7.232 478 H VAL 73 H VAL 73 10.175 2.506 5.073 479 HA VAL 73 HA VAL 73 10.320 2.048 2.181 480 HB VAL 73 HB VAL 73 8.403 3.664 3.851 481 HG11 VAL 73 1HG1 VAL 73 7.285 4.320 1.800 482 HG12 VAL 73 2HG1 VAL 73 8.511 3.499 0.838 483 HG13 VAL 73 3HG1 VAL 73 8.946 4.910 1.803 484 HG21 VAL 73 3HG2 VAL 73 7.993 1.267 3.769 485 HG22 VAL 73 1HG2 VAL 73 8.001 1.315 2.010 486 HG23 VAL 73 2HG2 VAL 73 6.738 2.155 2.907 487 H GLU 74 H GLU 74 11.210 3.452 0.847 488 HA GLU 74 HA GLU 74 12.171 6.039 1.854 489 HB2 GLU 74 2HB GLU 74 13.568 4.154 -0.053 490 HB3 GLU 74 3HB GLU 74 14.063 5.815 0.242 491 HG2 GLU 74 2HG GLU 74 14.474 5.271 2.588 492 HG3 GLU 74 3HG GLU 74 13.998 3.602 2.278 493 H ASN 75 H ASN 75 12.152 7.722 0.242 494 HA ASN 75 HA ASN 75 10.404 7.163 -2.060 495 HB2 ASN 75 2HB ASN 75 10.061 9.428 -0.076 496 HB3 ASN 75 3HB ASN 75 9.205 9.306 -1.604 497 HD21 ASN 75 1HD2 ASN 75 8.847 6.396 -1.349 498 HD22 ASN 75 2HD2 ASN 75 7.627 6.185 -0.148 499 H GLN 76 H GLN 76 10.559 8.737 -3.730 500 HA GLN 76 HA GLN 76 12.615 10.774 -3.477 501 HB2 GLN 76 2HB GLN 76 13.899 10.126 -5.417 502 HB3 GLN 76 3HB GLN 76 13.872 8.802 -4.267 503 HG2 GLN 76 2HG GLN 76 13.045 7.434 -5.776 504 HG3 GLN 76 3HG GLN 76 11.710 8.539 -6.116 505 HE21 GLN 76 1HE2 GLN 76 13.442 6.872 -7.851 506 HE22 GLN 76 2HE2 GLN 76 14.050 7.965 -9.047 507 H TRP 77 H TRP 77 12.392 12.490 -4.894 508 HA TRP 77 HA TRP 77 10.240 12.412 -6.852 509 HB2 TRP 77 2HB TRP 77 9.249 14.508 -5.835 510 HB3 TRP 77 3HB TRP 77 8.987 13.026 -4.918 511 HD1 TRP 77 HD1 TRP 77 10.991 16.315 -4.795 512 HE1 TRP 77 HE1 TRP 77 11.769 16.711 -2.368 513 HE3 TRP 77 HE3 TRP 77 9.513 11.881 -2.721 514 HZ2 TRP 77 HZ2 TRP 77 11.753 15.332 0.088 515 HZ3 TRP 77 HZ3 TRP 77 9.927 11.500 -0.330 516 HH2 TRP 77 HH2 TRP 77 11.028 13.193 1.048 517 H GLY 78 H GLY 78 10.083 14.531 -8.024 518 HA2 GLY 78 2HA GLY 78 10.977 16.430 -8.963 519 HA3 GLY 78 3HA GLY 78 12.285 16.349 -7.799 520 H GLY 79 H GLY 79 11.104 14.651 -10.745 521 HA2 GLY 79 2HA GLY 79 12.452 14.753 -12.711 522 HA3 GLY 79 3HA GLY 79 13.874 14.787 -11.690 523 H ASP 80 H ASP 80 12.853 12.591 -9.959 524 HA ASP 80 HA ASP 80 12.572 10.310 -9.871 525 HB2 ASP 80 2HB ASP 80 11.126 10.198 -11.790 526 HB3 ASP 80 3HB ASP 80 12.464 10.498 -12.892 527 H SER 81 H SER 81 14.967 11.739 -11.943 528 HA SER 81 HA SER 81 16.897 9.668 -11.470 529 HB2 SER 81 2HB SER 81 18.435 11.406 -12.562 530 HB3 SER 81 3HB SER 81 17.098 10.798 -13.545 531 HG SER 81 HG SER 81 16.663 12.848 -13.773 532 H ALA 82 H ALA 82 15.602 11.341 -9.268 533 HA ALA 82 HA ALA 82 17.844 12.751 -8.081 534 HB1 ALA 82 3HB ALA 82 15.601 13.759 -8.042 535 HB2 ALA 82 1HB ALA 82 16.215 13.475 -6.413 536 HB3 ALA 82 2HB ALA 82 15.007 12.389 -7.098 537 HA PRO 83 HA PRO 83 18.986 9.582 -5.172 538 HB2 PRO 83 2HB PRO 83 18.950 11.428 -2.899 539 HB3 PRO 83 3HB PRO 83 20.333 10.669 -3.688 540 HG2 PRO 83 2HG PRO 83 19.806 13.313 -3.873 541 HG3 PRO 83 3HG PRO 83 20.608 12.403 -5.164 542 HD2 PRO 83 2HD PRO 83 17.770 13.298 -4.950 543 HD3 PRO 83 3HD PRO 83 18.840 13.264 -6.369 544 H TRP 84 H TRP 84 18.363 8.536 -3.025 545 HA TRP 84 HA TRP 84 15.454 8.642 -2.837 546 HB2 TRP 84 2HB TRP 84 17.445 6.504 -2.040 547 HB3 TRP 84 3HB TRP 84 15.730 6.444 -1.635 548 HD1 TRP 84 HD1 TRP 84 18.092 6.119 -4.628 549 HE1 TRP 84 HE1 TRP 84 16.785 5.031 -6.565 550 HE3 TRP 84 HE3 TRP 84 13.426 6.130 -2.562 551 HZ2 TRP 84 HZ2 TRP 84 14.124 4.276 -7.133 552 HZ3 TRP 84 HZ3 TRP 84 11.556 5.209 -3.859 553 HH2 TRP 84 HH2 TRP 84 11.895 4.299 -6.097 554 H HIS 85 H HIS 85 14.448 9.078 -0.958 555 HA HIS 85 HA HIS 85 16.175 9.955 1.275 556 HB2 HIS 85 2HB HIS 85 13.510 11.140 0.459 557 HB3 HIS 85 3HB HIS 85 14.568 11.726 1.739 558 HD1 HIS 85 HD1 HIS 85 16.872 12.835 0.893 559 HD2 HIS 85 HD2 HIS 85 14.031 12.109 -2.048 560 HE1 HIS 85 HE1 HIS 85 17.609 14.169 -1.096 561 H SER 86 H SER 86 15.462 9.482 3.368 562 HA SER 86 HA SER 86 14.028 7.088 3.701 563 HB2 SER 86 2HB SER 86 14.433 9.199 5.828 564 HB3 SER 86 3HB SER 86 14.269 7.460 6.054 565 HG SER 86 HG SER 86 16.274 7.548 4.529 566 H GLY 87 H GLY 87 11.831 6.661 3.992 567 HA2 GLY 87 2HA GLY 87 10.098 9.024 4.124 568 HA3 GLY 87 3HA GLY 87 9.651 7.463 3.447 569 H GLY 88 H GLY 88 10.346 5.681 5.334 570 HA2 GLY 88 2HA GLY 88 10.078 6.004 7.974 571 HA3 GLY 88 3HA GLY 88 8.431 6.291 7.436 572 H ASN 89 H ASN 89 8.108 4.371 8.881 573 HA ASN 89 HA ASN 89 8.752 1.868 7.494 574 HB2 ASN 89 2HB ASN 89 7.899 2.359 10.352 575 HB3 ASN 89 3HB ASN 89 8.075 0.761 9.643 576 HD21 ASN 89 1HD2 ASN 89 10.145 0.014 9.100 577 HD22 ASN 89 2HD2 ASN 89 11.569 0.729 9.772 578 H TRP 90 H TRP 90 7.160 0.329 7.053 579 HA TRP 90 HA TRP 90 4.371 1.230 7.207 580 HB2 TRP 90 2HB TRP 90 5.873 0.365 4.728 581 HB3 TRP 90 3HB TRP 90 4.133 0.159 4.849 582 HD1 TRP 90 HD1 TRP 90 5.959 3.306 6.111 583 HE1 TRP 90 HE1 TRP 90 5.186 5.312 4.732 584 HE3 TRP 90 HE3 TRP 90 3.121 0.858 2.604 585 HZ2 TRP 90 HZ2 TRP 90 3.580 5.805 2.460 586 HZ3 TRP 90 HZ3 TRP 90 2.018 2.174 0.879 587 HH2 TRP 90 HH2 TRP 90 2.241 4.589 0.798 588 H ILE 91 H ILE 91 2.925 -0.439 7.504 589 HA ILE 91 HA ILE 91 4.139 -3.119 7.842 590 HB ILE 91 HB ILE 91 1.628 -2.003 9.142 591 HG12 ILE 91 2HG1 ILE 91 4.277 -2.751 10.401 592 HG13 ILE 91 3HG1 ILE 91 3.790 -1.104 10.017 593 HG21 ILE 91 1HG2 ILE 91 2.961 -4.691 9.500 594 HG22 ILE 91 2HG2 ILE 91 1.411 -4.394 8.717 595 HG23 ILE 91 3HG2 ILE 91 1.597 -4.089 10.443 596 HD11 ILE 91 3HD1 ILE 91 3.473 -1.608 12.372 597 HD12 ILE 91 1HD1 ILE 91 2.402 -2.947 11.954 598 HD13 ILE 91 2HD1 ILE 91 1.928 -1.288 11.582 599 H LEU 92 H LEU 92 3.653 -4.532 6.251 600 HA LEU 92 HA LEU 92 1.029 -4.310 4.929 601 HB2 LEU 92 2HB LEU 92 3.663 -4.629 3.481 602 HB3 LEU 92 3HB LEU 92 2.079 -4.617 2.737 603 HG LEU 92 HG LEU 92 3.337 -2.265 4.167 604 HD11 LEU 92 1HD1 LEU 92 3.013 -2.808 1.224 605 HD12 LEU 92 2HD1 LEU 92 4.528 -2.804 2.125 606 HD13 LEU 92 3HD1 LEU 92 3.609 -1.310 1.941 607 HD21 LEU 92 3HD2 LEU 92 0.823 -2.472 2.515 608 HD22 LEU 92 1HD2 LEU 92 1.511 -0.980 3.155 609 HD23 LEU 92 2HD2 LEU 92 0.908 -2.214 4.259 610 H GLY 93 H GLY 93 0.631 -6.169 6.369 611 HA2 GLY 93 2HA GLY 93 1.303 -8.642 4.975 612 HA3 GLY 93 3HA GLY 93 1.780 -8.535 6.664 613 H SER 94 H SER 94 -0.061 -7.851 8.181 614 HA SER 94 HA SER 94 -2.067 -8.202 9.131 615 HB2 SER 94 2HB SER 94 -2.921 -8.537 6.271 616 HB3 SER 94 3HB SER 94 -4.044 -8.855 7.594 617 HG SER 94 HG SER 94 -4.244 -6.728 6.979 618 H ARG 95 H ARG 95 -0.940 -10.684 6.930 619 HA ARG 95 HA ARG 95 -2.279 -12.651 8.607 620 HB2 ARG 95 2HB ARG 95 -1.065 -12.944 5.855 621 HB3 ARG 95 3HB ARG 95 -1.776 -14.267 6.775 622 HG2 ARG 95 2HG ARG 95 -3.923 -13.135 6.796 623 HG3 ARG 95 3HG ARG 95 -3.230 -11.765 5.940 624 HD2 ARG 95 2HD ARG 95 -4.431 -13.103 4.374 625 HD3 ARG 95 3HD ARG 95 -2.709 -13.287 4.052 626 HE ARG 95 HE ARG 95 -3.547 -15.339 5.776 627 HH11 ARG 95 1HH1 ARG 95 -3.986 -14.265 2.482 628 HH12 ARG 95 2HH1 ARG 95 -4.191 -15.839 1.810 629 HH21 ARG 95 1HH2 ARG 95 -3.845 -17.478 4.930 630 HH22 ARG 95 2HH2 ARG 95 -4.127 -17.683 3.240 631 H GLU 96 H GLU 96 -1.136 -14.558 9.237 632 HA GLU 96 HA GLU 96 1.085 -13.832 10.784 633 HB2 GLU 96 2HB GLU 96 -0.530 -15.496 11.463 634 HB3 GLU 96 3HB GLU 96 -0.032 -16.548 10.145 635 HG2 GLU 96 2HG GLU 96 2.188 -16.744 11.178 636 HG3 GLU 96 3HG GLU 96 1.638 -15.728 12.511 637 H ASN 97 H ASN 97 0.976 -16.109 8.017 638 HA ASN 97 HA ASN 97 3.904 -15.780 7.820 639 HB2 ASN 97 2HB ASN 97 2.264 -18.292 7.578 640 HB3 ASN 97 3HB ASN 97 3.850 -18.168 6.828 641 HD21 ASN 97 1HD2 ASN 97 2.109 -18.553 9.783 642 HD22 ASN 97 2HD2 ASN 97 3.483 -18.771 10.800 643 H GLN 98 H GLN 98 2.096 -14.173 6.410 644 HA GLN 98 HA GLN 98 2.863 -14.888 3.715 645 HB2 GLN 98 2HB GLN 98 0.627 -15.972 4.196 646 HB3 GLN 98 3HB GLN 98 -0.044 -14.356 4.311 647 HG2 GLN 98 2HG GLN 98 0.354 -13.924 2.026 648 HG3 GLN 98 3HG GLN 98 1.381 -15.352 1.866 649 HE21 GLN 98 1HE2 GLN 98 -1.024 -14.621 0.380 650 HE22 GLN 98 2HE2 GLN 98 -2.149 -15.913 0.602 651 H ASN 99 H ASN 99 3.732 -13.148 2.875 652 HA ASN 99 HA ASN 99 3.141 -10.513 4.040 653 HB2 ASN 99 2HB ASN 99 5.445 -11.415 2.296 654 HB3 ASN 99 3HB ASN 99 5.237 -9.781 2.909 655 HD21 ASN 99 1HD2 ASN 99 6.208 -12.989 3.605 656 HD22 ASN 99 2HD2 ASN 99 6.812 -12.696 5.199 657 H VAL 100 H VAL 100 3.198 -8.621 2.583 658 HA VAL 100 HA VAL 100 1.556 -9.131 0.222 659 HB VAL 100 HB VAL 100 2.403 -6.503 1.469 660 HG11 VAL 100 1HG1 VAL 100 0.718 -5.480 -0.007 661 HG12 VAL 100 2HG1 VAL 100 0.461 -7.043 -0.781 662 HG13 VAL 100 3HG1 VAL 100 2.020 -6.232 -0.930 663 HG21 VAL 100 3HG2 VAL 100 -0.219 -7.995 1.492 664 HG22 VAL 100 1HG2 VAL 100 0.048 -6.387 2.165 665 HG23 VAL 100 2HG2 VAL 100 0.876 -7.780 2.860 666 H VAL 101 H VAL 101 2.104 -8.743 -1.793 667 HA VAL 101 HA VAL 101 4.938 -8.070 -2.356 668 HB VAL 101 HB VAL 101 5.083 -9.592 -4.257 669 HG11 VAL 101 1HG1 VAL 101 5.292 -11.646 -3.030 670 HG12 VAL 101 2HG1 VAL 101 4.256 -11.018 -1.746 671 HG13 VAL 101 3HG1 VAL 101 5.836 -10.292 -2.040 672 HG21 VAL 101 3HG2 VAL 101 2.734 -9.698 -4.876 673 HG22 VAL 101 1HG2 VAL 101 2.369 -10.577 -3.392 674 HG23 VAL 101 2HG2 VAL 101 3.387 -11.315 -4.629 675 H ALA 102 H ALA 102 1.650 -7.740 -3.491 676 HA ALA 102 HA ALA 102 2.642 -5.564 -5.175 677 HB1 ALA 102 3HB ALA 102 2.300 -7.667 -6.568 678 HB2 ALA 102 1HB ALA 102 1.482 -6.203 -7.119 679 HB3 ALA 102 2HB ALA 102 0.576 -7.445 -6.270 680 H ILE 103 H ILE 103 1.378 -3.814 -5.252 681 HA ILE 103 HA ILE 103 -1.311 -4.000 -4.094 682 HB ILE 103 HB ILE 103 0.739 -1.899 -3.349 683 HG12 ILE 103 2HG1 ILE 103 -0.684 -3.908 -1.591 684 HG13 ILE 103 3HG1 ILE 103 0.961 -4.105 -2.191 685 HG21 ILE 103 1HG2 ILE 103 -2.164 -2.137 -2.581 686 HG22 ILE 103 2HG2 ILE 103 -1.438 -0.882 -3.585 687 HG23 ILE 103 3HG2 ILE 103 -1.020 -0.993 -1.877 688 HD11 ILE 103 3HD1 ILE 103 0.936 -3.306 0.104 689 HD12 ILE 103 1HD1 ILE 103 -0.015 -1.902 -0.387 690 HD13 ILE 103 2HD1 ILE 103 1.635 -2.097 -0.978 691 H ASN 104 H ASN 104 -2.771 -3.116 -5.347 692 HA ASN 104 HA ASN 104 -2.051 -0.793 -7.008 693 HB2 ASN 104 2HB ASN 104 -2.329 -2.766 -8.462 694 HB3 ASN 104 3HB ASN 104 -3.922 -3.057 -7.773 695 HD21 ASN 104 1HD2 ASN 104 -4.955 -2.870 -9.748 696 HD22 ASN 104 2HD2 ASN 104 -5.151 -1.351 -10.548 697 H VAL 105 H VAL 105 -2.929 0.753 -5.909 698 HA VAL 105 HA VAL 105 -5.810 0.656 -5.307 699 HB VAL 105 HB VAL 105 -5.553 1.578 -3.017 700 HG11 VAL 105 1HG1 VAL 105 -4.910 -0.552 -1.938 701 HG12 VAL 105 2HG1 VAL 105 -4.362 -1.140 -3.510 702 HG13 VAL 105 3HG1 VAL 105 -6.064 -0.748 -3.260 703 HG21 VAL 105 3HG2 VAL 105 -2.667 0.795 -3.335 704 HG22 VAL 105 1HG2 VAL 105 -3.424 1.383 -1.858 705 HG23 VAL 105 2HG2 VAL 105 -3.273 2.450 -3.256 706 H GLU 106 H GLU 106 -6.879 2.552 -5.205 707 HA GLU 106 HA GLU 106 -5.418 5.054 -5.149 708 HB2 GLU 106 2HB GLU 106 -5.570 4.406 -7.566 709 HB3 GLU 106 3HB GLU 106 -7.320 4.401 -7.413 710 HG2 GLU 106 2HG GLU 106 -7.340 6.763 -6.955 711 HG3 GLU 106 3HG GLU 106 -5.577 6.807 -6.936 712 H SER 107 H SER 107 -6.842 6.854 -4.696 713 HA SER 107 HA SER 107 -9.470 6.021 -3.675 714 HB2 SER 107 2HB SER 107 -7.900 6.079 -1.802 715 HB3 SER 107 3HB SER 107 -7.471 7.746 -2.197 716 HG SER 107 HG SER 107 -9.801 6.688 -1.072 717 H GLY 108 H GLY 108 -11.097 7.468 -3.837 718 HA2 GLY 108 2HA GLY 108 -10.654 9.823 -5.465 719 HA3 GLY 108 3HA GLY 108 -12.207 9.227 -4.877 720 H ASP 109 H ASP 109 -10.492 9.035 -2.242 721 HA ASP 109 HA ASP 109 -11.276 11.682 -1.260 722 HB2 ASP 109 2HB ASP 109 -10.515 9.140 0.210 723 HB3 ASP 109 3HB ASP 109 -10.835 10.668 1.004 724 H ASP 110 H ASP 110 -9.615 12.049 0.791 725 HA ASP 110 HA ASP 110 -7.060 12.452 -0.524 726 HB2 ASP 110 2HB ASP 110 -8.216 13.478 2.070 727 HB3 ASP 110 3HB ASP 110 -6.534 13.744 1.615 728 H GLY 111 H GLY 111 -7.667 9.798 -0.018 729 HA2 GLY 111 2HA GLY 111 -6.150 8.071 0.523 730 HA3 GLY 111 3HA GLY 111 -5.419 9.125 1.714 731 H GLN 112 H GLN 112 -8.630 9.455 2.213 732 HA GLN 112 HA GLN 112 -8.492 8.101 4.664 733 HB2 GLN 112 2HB GLN 112 -10.813 9.351 3.230 734 HB3 GLN 112 3HB GLN 112 -10.967 8.611 4.819 735 HG2 GLN 112 2HG GLN 112 -9.294 10.146 5.709 736 HG3 GLN 112 3HG GLN 112 -9.122 10.888 4.120 737 HE21 GLN 112 1HE2 GLN 112 -9.955 11.992 6.719 738 HE22 GLN 112 2HE2 GLN 112 -11.496 12.722 6.441 739 H THR 113 H THR 113 -10.157 7.171 1.617 740 HA THR 113 HA THR 113 -10.320 4.484 2.761 741 HB THR 113 HB THR 113 -12.319 4.118 1.293 742 HG1 THR 113 HG1 THR 113 -12.525 6.957 1.058 743 HG21 THR 113 3HG2 THR 113 -13.911 5.376 2.704 744 HG22 THR 113 1HG2 THR 113 -12.567 6.323 3.342 745 HG23 THR 113 2HG2 THR 113 -12.654 4.585 3.651 746 H LEU 114 H LEU 114 -8.726 3.382 1.807 747 HA LEU 114 HA LEU 114 -7.982 3.968 -0.951 748 HB2 LEU 114 2HB LEU 114 -6.751 2.098 1.074 749 HB3 LEU 114 3HB LEU 114 -6.122 2.384 -0.534 750 HG LEU 114 HG LEU 114 -6.322 4.464 1.649 751 HD11 LEU 114 1HD1 LEU 114 -4.654 2.777 2.161 752 HD12 LEU 114 2HD1 LEU 114 -3.880 4.297 1.712 753 HD13 LEU 114 3HD1 LEU 114 -3.947 2.964 0.557 754 HD21 LEU 114 3HD2 LEU 114 -4.898 5.800 0.113 755 HD22 LEU 114 1HD2 LEU 114 -6.508 5.486 -0.531 756 HD23 LEU 114 2HD2 LEU 114 -5.128 4.564 -1.122 757 H ASN 115 H ASN 115 -9.087 2.971 -2.482 758 HA ASN 115 HA ASN 115 -10.036 0.236 -1.974 759 HB2 ASN 115 2HB ASN 115 -11.055 2.352 -3.873 760 HB3 ASN 115 3HB ASN 115 -11.611 0.686 -3.893 761 HD21 ASN 115 1HD2 ASN 115 -11.771 3.735 -2.298 762 HD22 ASN 115 2HD2 ASN 115 -13.012 3.311 -1.173 763 H GLY 116 H GLY 116 -9.537 -1.397 -3.406 764 HA2 GLY 116 2HA GLY 116 -8.749 -1.180 -6.005 765 HA3 GLY 116 3HA GLY 116 -7.272 -0.911 -5.096 766 H THR 117 H THR 117 -6.179 -2.680 -5.551 767 HA THR 117 HA THR 117 -7.288 -5.238 -4.670 768 HB THR 117 HB THR 117 -6.162 -6.344 -6.645 769 HG1 THR 117 HG1 THR 117 -5.812 -3.631 -7.310 770 HG21 THR 117 3HG2 THR 117 -7.976 -5.816 -8.238 771 HG22 THR 117 1HG2 THR 117 -8.423 -4.428 -7.251 772 HG23 THR 117 2HG2 THR 117 -8.589 -6.059 -6.604 773 H MET 118 H MET 118 -5.627 -6.845 -4.237 774 HA MET 118 HA MET 118 -2.909 -5.837 -3.926 775 HB2 MET 118 2HB MET 118 -2.788 -6.525 -1.580 776 HB3 MET 118 3HB MET 118 -3.979 -5.252 -1.809 777 HG2 MET 118 2HG MET 118 -5.780 -6.815 -1.646 778 HG3 MET 118 3HG MET 118 -4.663 -8.170 -1.672 779 HE1 MET 118 3HE MET 118 -3.243 -8.971 0.249 780 HE2 MET 118 1HE MET 118 -2.988 -8.103 1.760 781 HE3 MET 118 2HE MET 118 -2.351 -7.452 0.252 782 H THR 119 H THR 119 -1.371 -7.485 -3.652 783 HA THR 119 HA THR 119 -2.400 -10.210 -4.083 784 HB THR 119 HB THR 119 0.028 -9.049 -5.467 785 HG1 THR 119 HG1 THR 119 -1.388 -9.280 -7.355 786 HG21 THR 119 3HG2 THR 119 0.150 -11.467 -5.069 787 HG22 THR 119 1HG2 THR 119 -0.048 -11.121 -6.787 788 HG23 THR 119 2HG2 THR 119 -1.423 -11.678 -5.835 789 H TYR 120 H TYR 120 -1.593 -11.678 -2.724 790 HA TYR 120 HA TYR 120 0.551 -10.956 -0.907 791 HB2 TYR 120 2HB TYR 120 -1.311 -13.306 -1.115 792 HB3 TYR 120 3HB TYR 120 0.102 -13.355 -0.069 793 HD1 TYR 120 HD2 TYR 120 0.305 -11.589 1.738 794 HD2 TYR 120 HD1 TYR 120 -3.315 -12.326 -0.371 795 HE1 TYR 120 HE2 TYR 120 -0.955 -10.527 3.557 796 HE2 TYR 120 HE1 TYR 120 -4.593 -11.265 1.447 797 HH TYR 120 HH TYR 120 -3.076 -9.474 3.960 798 H ALA 121 H ALA 121 2.192 -12.728 -0.444 799 HA ALA 121 HA ALA 121 3.932 -12.956 -2.567 800 HB1 ALA 121 3HB ALA 121 4.599 -13.168 -0.234 801 HB2 ALA 121 1HB ALA 121 5.212 -14.508 -1.205 802 HB3 ALA 121 2HB ALA 121 3.817 -14.748 -0.149 803 H GLY 122 H GLY 122 1.546 -15.385 -1.533 804 HA2 GLY 122 2HA GLY 122 1.845 -16.628 -4.144 805 HA3 GLY 122 3HA GLY 122 2.256 -17.635 -2.765 806 H GLU 123 H GLU 123 -0.309 -15.969 -4.458 807 HA GLU 123 HA GLU 123 -2.209 -17.924 -3.735 808 HB2 GLU 123 2HB GLU 123 -2.141 -16.700 -1.573 809 HB3 GLU 123 3HB GLU 123 -2.606 -15.227 -2.411 810 HG2 GLU 123 2HG GLU 123 -4.732 -16.157 -2.995 811 HG3 GLU 123 3HG GLU 123 -4.265 -17.725 -2.340 812 H GLY 124 H GLY 124 -2.477 -14.411 -4.269 813 HA2 GLY 124 2HA GLY 124 -2.766 -14.172 -6.903 814 HA3 GLY 124 3HA GLY 124 -4.308 -14.895 -6.464 815 HA PRO 125 HA PRO 125 -4.218 -10.147 -5.779 816 HB2 PRO 125 2HB PRO 125 -5.870 -10.025 -8.221 817 HB3 PRO 125 3HB PRO 125 -4.476 -9.036 -7.760 818 HG2 PRO 125 2HG PRO 125 -4.310 -10.862 -9.716 819 HG3 PRO 125 3HG PRO 125 -2.955 -10.555 -8.614 820 HD2 PRO 125 2HD PRO 125 -4.958 -12.783 -8.583 821 HD3 PRO 125 3HD PRO 125 -3.201 -12.842 -8.328 822 H ILE 126 H ILE 126 -5.818 -9.393 -4.534 823 HA ILE 126 HA ILE 126 -8.556 -10.368 -4.944 824 HB ILE 126 HB ILE 126 -8.892 -10.589 -2.507 825 HG12 ILE 126 2HG1 ILE 126 -5.896 -10.200 -2.281 826 HG13 ILE 126 3HG1 ILE 126 -7.110 -9.012 -1.814 827 HG21 ILE 126 1HG2 ILE 126 -6.621 -12.272 -3.566 828 HG22 ILE 126 2HG2 ILE 126 -8.343 -12.586 -3.782 829 HG23 ILE 126 3HG2 ILE 126 -7.622 -12.672 -2.173 830 HD11 ILE 126 3HD1 ILE 126 -6.738 -11.740 -0.586 831 HD12 ILE 126 1HD1 ILE 126 -7.969 -10.563 -0.126 832 HD13 ILE 126 2HD1 ILE 126 -6.262 -10.200 0.126 833 H GLY 127 H GLY 127 -10.162 -8.990 -3.647 834 HA2 GLY 127 2HA GLY 127 -9.673 -6.243 -4.312 835 HA3 GLY 127 3HA GLY 127 -11.104 -6.894 -3.526 836 H PHE 128 H PHE 128 -9.157 -4.570 -3.032 837 HA PHE 128 HA PHE 128 -8.669 -5.138 -0.181 838 HB2 PHE 128 2HB PHE 128 -6.526 -5.033 -1.251 839 HB3 PHE 128 3HB PHE 128 -6.962 -3.573 -2.123 840 HD1 PHE 128 HD1 PHE 128 -6.242 -4.924 1.243 841 HD2 PHE 128 HD2 PHE 128 -6.612 -1.450 -1.176 842 HE1 PHE 128 HE1 PHE 128 -5.285 -3.569 3.055 843 HE2 PHE 128 HE2 PHE 128 -5.646 -0.087 0.626 844 HZ PHE 128 HZ PHE 128 -4.983 -1.143 2.747 845 H LYS 129 H LYS 129 -9.362 -3.705 1.273 846 HA LYS 129 HA LYS 129 -10.252 -1.057 0.408 847 HB2 LYS 129 2HB LYS 129 -12.242 -2.439 0.576 848 HB3 LYS 129 3HB LYS 129 -11.754 -3.011 2.162 849 HG2 LYS 129 2HG LYS 129 -12.014 -0.735 3.050 850 HG3 LYS 129 3HG LYS 129 -12.542 -0.188 1.455 851 HD2 LYS 129 2HD LYS 129 -14.427 -1.753 1.549 852 HD3 LYS 129 3HD LYS 129 -13.903 -2.285 3.148 853 HE2 LYS 129 2HE LYS 129 -14.663 0.533 2.442 854 HE3 LYS 129 3HE LYS 129 -15.751 -0.629 3.192 855 HZ1 LYS 129 3HZ LYS 129 -14.789 0.793 4.856 856 HZ2 LYS 129 1HZ LYS 129 -13.216 0.413 4.364 857 HZ3 LYS 129 2HZ LYS 129 -14.187 -0.775 5.073 858 H GLY 130 H GLY 130 -8.665 0.133 1.414 859 HA2 GLY 130 2HA GLY 130 -8.048 -0.474 4.212 860 HA3 GLY 130 3HA GLY 130 -7.120 0.572 3.140 861 H THR 131 H THR 131 -8.671 0.828 5.838 862 HA THR 131 HA THR 131 -9.921 3.391 5.112 863 HB THR 131 HB THR 131 -11.006 1.418 7.140 864 HG1 THR 131 HG1 THR 131 -11.230 1.525 4.487 865 HG21 THR 131 3HG2 THR 131 -12.171 4.000 6.068 866 HG22 THR 131 1HG2 THR 131 -11.489 3.780 7.682 867 HG23 THR 131 2HG2 THR 131 -12.948 2.905 7.215 868 H LEU 132 H LEU 132 -9.438 5.113 6.414 869 HA LEU 132 HA LEU 132 -7.240 5.030 8.156 870 HB2 LEU 132 2HB LEU 132 -9.303 7.030 7.472 871 HB3 LEU 132 3HB LEU 132 -8.499 7.264 9.007 872 HG LEU 132 HG LEU 132 -7.538 8.530 7.054 873 HD11 LEU 132 1HD1 LEU 132 -5.209 8.079 7.698 874 HD12 LEU 132 2HD1 LEU 132 -5.746 6.634 8.558 875 HD13 LEU 132 3HD1 LEU 132 -6.280 8.227 9.091 876 HD21 LEU 132 3HD2 LEU 132 -6.201 7.412 5.463 877 HD22 LEU 132 1HD2 LEU 132 -7.759 6.590 5.473 878 HD23 LEU 132 2HD2 LEU 132 -6.379 5.869 6.297 879 H THR 133 H THR 133 -6.976 4.805 10.269 880 HA THR 133 HA THR 133 -9.367 4.445 11.929 881 HB THR 133 HB THR 133 -6.755 2.971 12.276 882 HG1 THR 133 HG1 THR 133 -8.419 2.617 10.343 883 HG21 THR 133 3HG2 THR 133 -8.093 1.520 13.729 884 HG22 THR 133 1HG2 THR 133 -9.522 2.498 13.403 885 HG23 THR 133 2HG2 THR 133 -8.160 3.193 14.287 Start of MODEL 12 1 H1 ALA 2 1H ALA 2 1.337 5.586 10.322 2 H2 ALA 2 2H ALA 2 1.175 7.156 9.724 3 H3 ALA 2 3H ALA 2 1.031 5.833 8.677 4 HA ALA 2 HA ALA 2 -0.797 6.515 10.892 5 HB1 ALA 2 3HB ALA 2 -1.202 6.622 7.906 6 HB2 ALA 2 1HB ALA 2 -1.026 8.011 8.977 7 HB3 ALA 2 2HB ALA 2 -2.429 6.954 9.130 8 H LEU 3 H LEU 3 -2.443 5.072 11.269 9 HA LEU 3 HA LEU 3 -1.917 2.382 10.263 10 HB2 LEU 3 2HB LEU 3 -1.902 2.764 12.719 11 HB3 LEU 3 3HB LEU 3 -3.573 3.269 12.630 12 HG LEU 3 HG LEU 3 -2.826 0.516 11.702 13 HD11 LEU 3 1HD1 LEU 3 -3.178 -0.309 13.988 14 HD12 LEU 3 2HD1 LEU 3 -3.244 1.355 14.568 15 HD13 LEU 3 3HD1 LEU 3 -1.753 0.723 13.871 16 HD21 LEU 3 3HD2 LEU 3 -5.108 1.315 11.331 17 HD22 LEU 3 1HD2 LEU 3 -5.265 1.685 13.050 18 HD23 LEU 3 2HD2 LEU 3 -5.086 0.011 12.519 19 H TYR 4 H TYR 4 -3.299 1.321 9.048 20 HA TYR 4 HA TYR 4 -5.941 2.505 8.567 21 HB2 TYR 4 2HB TYR 4 -4.066 1.180 6.598 22 HB3 TYR 4 3HB TYR 4 -5.761 1.503 6.252 23 HD1 TYR 4 HD1 TYR 4 -2.482 3.071 6.926 24 HD2 TYR 4 HD2 TYR 4 -6.487 3.687 5.633 25 HE1 TYR 4 HE1 TYR 4 -1.880 5.326 6.148 26 HE2 TYR 4 HE2 TYR 4 -5.899 5.941 4.853 27 HH TYR 4 HH TYR 4 -2.796 6.994 4.411 28 H ASN 5 H ASN 5 -7.621 1.127 8.419 29 HA ASN 5 HA ASN 5 -7.188 -1.570 9.483 30 HB2 ASN 5 2HB ASN 5 -9.689 0.050 8.966 31 HB3 ASN 5 3HB ASN 5 -9.730 -1.637 9.462 32 HD21 ASN 5 1HD2 ASN 5 -10.572 0.912 10.734 33 HD22 ASN 5 2HD2 ASN 5 -9.878 0.871 12.313 34 H VAL 6 H VAL 6 -7.395 -3.394 8.207 35 HA VAL 6 HA VAL 6 -7.880 -2.744 5.394 36 HB VAL 6 HB VAL 6 -5.884 -4.658 6.574 37 HG11 VAL 6 1HG1 VAL 6 -6.674 -4.351 3.669 38 HG12 VAL 6 2HG1 VAL 6 -6.954 -5.774 4.673 39 HG13 VAL 6 3HG1 VAL 6 -5.306 -5.293 4.269 40 HG21 VAL 6 3HG2 VAL 6 -5.649 -2.275 4.743 41 HG22 VAL 6 1HG2 VAL 6 -4.312 -3.282 5.299 42 HG23 VAL 6 2HG2 VAL 6 -5.232 -2.322 6.458 43 H GLU 7 H GLU 7 -9.283 -3.698 4.329 44 HA GLU 7 HA GLU 7 -10.585 -6.138 5.312 45 HB2 GLU 7 2HB GLU 7 -11.740 -3.784 3.789 46 HB3 GLU 7 3HB GLU 7 -12.632 -5.207 4.310 47 HG2 GLU 7 2HG GLU 7 -12.544 -4.594 6.555 48 HG3 GLU 7 3HG GLU 7 -11.211 -3.477 6.294 49 H ASN 8 H ASN 8 -10.662 -7.775 3.794 50 HA ASN 8 HA ASN 8 -9.679 -7.107 1.099 51 HB2 ASN 8 2HB ASN 8 -8.949 -9.463 2.827 52 HB3 ASN 8 3HB ASN 8 -8.703 -9.468 1.087 53 HD21 ASN 8 1HD2 ASN 8 -8.001 -6.654 0.947 54 HD22 ASN 8 2HD2 ASN 8 -6.420 -6.514 1.626 55 H GLN 9 H GLN 9 -10.527 -8.137 -0.632 56 HA GLN 9 HA GLN 9 -12.921 -9.800 -0.156 57 HB2 GLN 9 2HB GLN 9 -13.447 -7.498 -0.917 58 HB3 GLN 9 3HB GLN 9 -12.442 -7.747 -2.330 59 HG2 GLN 9 2HG GLN 9 -13.956 -9.399 -3.183 60 HG3 GLN 9 3HG GLN 9 -14.914 -9.334 -1.704 61 HE21 GLN 9 1HE2 GLN 9 -15.731 -8.791 -4.456 62 HE22 GLN 9 2HE2 GLN 9 -16.344 -7.180 -4.448 63 H TRP 10 H TRP 10 -12.423 -11.840 -0.784 64 HA TRP 10 HA TRP 10 -10.763 -12.169 -3.195 65 HB2 TRP 10 2HB TRP 10 -9.704 -14.147 -2.064 66 HB3 TRP 10 3HB TRP 10 -9.314 -12.593 -1.338 67 HD1 TRP 10 HD1 TRP 10 -11.958 -15.400 -0.694 68 HE1 TRP 10 HE1 TRP 10 -12.194 -15.686 1.846 69 HE3 TRP 10 HE3 TRP 10 -8.701 -11.768 0.853 70 HZ2 TRP 10 HZ2 TRP 10 -11.150 -14.544 4.194 71 HZ3 TRP 10 HZ3 TRP 10 -8.378 -11.439 3.270 72 HH2 TRP 10 HH2 TRP 10 -9.580 -12.800 4.904 73 H GLY 11 H GLY 11 -10.680 -14.781 -3.499 74 HA2 GLY 11 2HA GLY 11 -11.758 -16.685 -4.154 75 HA3 GLY 11 3HA GLY 11 -13.015 -16.268 -3.008 76 H GLY 12 H GLY 12 -14.754 -15.066 -3.707 77 HA2 GLY 12 2HA GLY 12 -15.513 -15.824 -6.426 78 HA3 GLY 12 3HA GLY 12 -16.599 -15.251 -5.175 79 H SER 13 H SER 13 -14.021 -13.196 -5.328 80 HA SER 13 HA SER 13 -13.820 -10.983 -5.898 81 HB2 SER 13 2HB SER 13 -13.498 -12.121 -8.117 82 HB3 SER 13 3HB SER 13 -15.198 -11.816 -8.464 83 HG SER 13 HG SER 13 -13.259 -10.237 -9.011 84 H SER 14 H SER 14 -16.837 -12.239 -5.434 85 HA SER 14 HA SER 14 -18.104 -9.574 -5.459 86 HB2 SER 14 2HB SER 14 -18.955 -11.159 -7.265 87 HB3 SER 14 3HB SER 14 -19.594 -12.162 -5.963 88 HG SER 14 HG SER 14 -20.902 -10.439 -5.333 89 H ALA 15 H ALA 15 -16.711 -11.417 -3.505 90 HA ALA 15 HA ALA 15 -18.710 -12.128 -1.572 91 HB1 ALA 15 3HB ALA 15 -16.783 -12.843 -0.218 92 HB2 ALA 15 1HB ALA 15 -15.690 -12.115 -1.394 93 HB3 ALA 15 2HB ALA 15 -16.690 -13.492 -1.854 94 HA PRO 16 HA PRO 16 -18.648 -8.392 0.830 95 HB2 PRO 16 2HB PRO 16 -18.320 -9.880 3.343 96 HB3 PRO 16 3HB PRO 16 -19.709 -8.950 2.772 97 HG2 PRO 16 2HG PRO 16 -19.749 -11.642 2.927 98 HG3 PRO 16 3HG PRO 16 -20.635 -10.755 1.673 99 HD2 PRO 16 2HD PRO 16 -18.019 -12.198 1.493 100 HD3 PRO 16 3HD PRO 16 -19.368 -12.155 0.336 101 H TRP 17 H TRP 17 -17.413 -7.239 2.580 102 HA TRP 17 HA TRP 17 -14.589 -7.555 2.002 103 HB2 TRP 17 2HB TRP 17 -16.122 -5.459 3.552 104 HB3 TRP 17 3HB TRP 17 -14.368 -5.460 3.412 105 HD1 TRP 17 HD1 TRP 17 -17.451 -4.315 1.650 106 HE1 TRP 17 HE1 TRP 17 -16.828 -3.275 -0.622 107 HE3 TRP 17 HE3 TRP 17 -12.581 -5.816 1.375 108 HZ2 TRP 17 HZ2 TRP 17 -14.568 -3.115 -2.309 109 HZ3 TRP 17 HZ3 TRP 17 -11.254 -5.187 -0.603 110 HH2 TRP 17 HH2 TRP 17 -12.233 -3.862 -2.407 111 H ASN 18 H ASN 18 -13.242 -8.678 3.251 112 HA ASN 18 HA ASN 18 -14.177 -9.462 5.918 113 HB2 ASN 18 2HB ASN 18 -12.215 -10.786 4.035 114 HB3 ASN 18 3HB ASN 18 -12.527 -11.332 5.676 115 HD21 ASN 18 1HD2 ASN 18 -12.919 -12.667 3.096 116 HD22 ASN 18 2HD2 ASN 18 -14.581 -13.132 3.051 117 H GLU 19 H GLU 19 -13.276 -8.330 7.495 118 HA GLU 19 HA GLU 19 -10.770 -6.969 7.156 119 HB2 GLU 19 2HB GLU 19 -11.147 -6.173 9.446 120 HB3 GLU 19 3HB GLU 19 -12.588 -5.954 8.468 121 HG2 GLU 19 2HG GLU 19 -13.538 -8.005 9.472 122 HG3 GLU 19 3HG GLU 19 -12.115 -8.127 10.499 123 H GLY 20 H GLY 20 -8.756 -7.761 7.678 124 HA2 GLY 20 2HA GLY 20 -8.668 -9.950 9.609 125 HA3 GLY 20 3HA GLY 20 -7.977 -10.189 8.013 126 H GLY 21 H GLY 21 -7.849 -7.173 9.833 127 HA2 GLY 21 2HA GLY 21 -5.783 -7.079 11.357 128 HA3 GLY 21 3HA GLY 21 -4.930 -7.487 9.882 129 H GLN 22 H GLN 22 -3.886 -5.414 10.683 130 HA GLN 22 HA GLN 22 -5.166 -3.160 9.297 131 HB2 GLN 22 2HB GLN 22 -3.637 -2.994 11.922 132 HB3 GLN 22 3HB GLN 22 -4.334 -1.643 11.025 133 HG2 GLN 22 2HG GLN 22 -6.531 -2.320 11.502 134 HG3 GLN 22 3HG GLN 22 -5.988 -3.867 12.155 135 HE21 GLN 22 1HE2 GLN 22 -7.525 -1.582 13.308 136 HE22 GLN 22 2HE2 GLN 22 -6.691 -1.181 14.770 137 H TRP 23 H TRP 23 -3.683 -1.749 8.302 138 HA TRP 23 HA TRP 23 -0.895 -2.727 8.140 139 HB2 TRP 23 2HB TRP 23 -2.542 -1.422 5.951 140 HB3 TRP 23 3HB TRP 23 -0.817 -1.721 5.844 141 HD1 TRP 23 HD1 TRP 23 -2.492 -4.654 7.401 142 HE1 TRP 23 HE1 TRP 23 -2.848 -6.512 5.652 143 HE3 TRP 23 HE3 TRP 23 -1.420 -2.005 3.166 144 HZ2 TRP 23 HZ2 TRP 23 -2.679 -6.808 2.845 145 HZ3 TRP 23 HZ3 TRP 23 -1.536 -3.147 0.993 146 HH2 TRP 23 HH2 TRP 23 -2.148 -5.481 0.840 147 H GLU 24 H GLU 24 0.707 -1.088 7.913 148 HA GLU 24 HA GLU 24 -0.302 1.569 8.701 149 HB2 GLU 24 2HB GLU 24 2.372 0.310 9.329 150 HB3 GLU 24 3HB GLU 24 1.987 1.999 9.633 151 HG2 GLU 24 2HG GLU 24 0.157 1.288 11.127 152 HG3 GLU 24 3HG GLU 24 0.629 -0.389 10.863 153 H ILE 25 H ILE 25 -0.258 2.968 7.152 154 HA ILE 25 HA ILE 25 1.719 2.640 4.994 155 HB ILE 25 HB ILE 25 -1.233 3.210 4.671 156 HG12 ILE 25 2HG1 ILE 25 0.352 0.812 3.730 157 HG13 ILE 25 3HG1 ILE 25 -0.633 0.832 5.191 158 HG21 ILE 25 1HG2 ILE 25 0.930 2.951 2.591 159 HG22 ILE 25 2HG2 ILE 25 0.083 4.430 3.037 160 HG23 ILE 25 3HG2 ILE 25 -0.794 3.110 2.260 161 HD11 ILE 25 3HD1 ILE 25 -2.605 1.349 3.793 162 HD12 ILE 25 1HD1 ILE 25 -1.866 -0.203 3.416 163 HD13 ILE 25 2HD1 ILE 25 -1.590 1.180 2.361 164 H GLY 26 H GLY 26 2.590 4.477 4.224 165 HA2 GLY 26 2HA GLY 26 2.542 6.701 3.483 166 HA3 GLY 26 3HA GLY 26 1.157 6.990 4.515 167 H SER 27 H SER 27 4.262 7.845 4.015 168 HA SER 27 HA SER 27 5.012 8.229 6.759 169 HB2 SER 27 2HB SER 27 6.855 9.575 5.510 170 HB3 SER 27 3HB SER 27 6.828 7.821 5.317 171 HG SER 27 HG SER 27 6.142 9.836 3.495 172 H ARG 28 H ARG 28 2.631 9.410 5.168 173 HA ARG 28 HA ARG 28 2.319 11.900 4.589 174 HB2 ARG 28 2HB ARG 28 0.405 10.554 4.957 175 HB3 ARG 28 3HB ARG 28 0.731 10.439 6.681 176 HG2 ARG 28 2HG ARG 28 0.229 12.813 6.942 177 HG3 ARG 28 3HG ARG 28 -0.070 12.944 5.210 178 HD2 ARG 28 2HD ARG 28 -2.162 12.737 6.459 179 HD3 ARG 28 3HD ARG 28 -1.913 11.361 5.390 180 HE ARG 28 HE ARG 28 -1.669 9.990 7.220 181 HH11 ARG 28 1HH1 ARG 28 -1.811 13.333 8.274 182 HH12 ARG 28 2HH1 ARG 28 -2.041 12.936 9.935 183 HH21 ARG 28 1HH2 ARG 28 -1.994 9.467 9.450 184 HH22 ARG 28 2HH2 ARG 28 -2.138 10.741 10.604 185 H SER 29 H SER 29 3.442 13.601 5.151 186 HA SER 29 HA SER 29 3.768 14.248 7.983 187 HB2 SER 29 2HB SER 29 5.042 15.596 5.594 188 HB3 SER 29 3HB SER 29 5.517 15.739 7.287 189 HG SER 29 HG SER 29 5.541 13.158 6.642 190 H ASP 30 H ASP 30 3.162 15.987 4.934 191 HA ASP 30 HA ASP 30 1.048 17.518 6.306 192 HB2 ASP 30 2HB ASP 30 3.042 18.507 4.257 193 HB3 ASP 30 3HB ASP 30 1.633 19.423 4.766 194 H GLN 31 H GLN 31 1.423 15.164 4.292 195 HA GLN 31 HA GLN 31 -0.942 15.808 2.764 196 HB2 GLN 31 2HB GLN 31 1.594 16.151 1.557 197 HB3 GLN 31 3HB GLN 31 0.860 14.729 0.826 198 HG2 GLN 31 2HG GLN 31 -0.435 17.439 1.058 199 HG3 GLN 31 3HG GLN 31 0.317 16.776 -0.399 200 HE21 GLN 31 1HE2 GLN 31 -2.501 17.543 0.327 201 HE22 GLN 31 2HE2 GLN 31 -3.428 16.148 -0.104 202 H ASN 32 H ASN 32 -2.174 14.099 2.303 203 HA ASN 32 HA ASN 32 -1.245 11.537 3.312 204 HB2 ASN 32 2HB ASN 32 -3.471 12.569 4.021 205 HB3 ASN 32 3HB ASN 32 -4.051 12.191 2.401 206 HD21 ASN 32 1HD2 ASN 32 -5.607 10.789 3.275 207 HD22 ASN 32 2HD2 ASN 32 -5.172 9.221 3.869 208 H VAL 33 H VAL 33 -2.033 9.606 2.152 209 HA VAL 33 HA VAL 33 -1.145 9.780 -0.630 210 HB VAL 33 HB VAL 33 -1.470 7.364 1.153 211 HG11 VAL 33 1HG1 VAL 33 -0.142 6.198 -0.552 212 HG12 VAL 33 2HG1 VAL 33 -0.201 7.642 -1.564 213 HG13 VAL 33 3HG1 VAL 33 -1.687 6.776 -1.177 214 HG21 VAL 33 3HG2 VAL 33 0.283 8.839 1.972 215 HG22 VAL 33 1HG2 VAL 33 1.028 8.867 0.376 216 HG23 VAL 33 2HG2 VAL 33 0.975 7.364 1.298 217 H VAL 34 H VAL 34 -2.517 9.428 -2.288 218 HA VAL 34 HA VAL 34 -5.149 8.304 -1.617 219 HB VAL 34 HB VAL 34 -6.054 9.486 -3.603 220 HG11 VAL 34 1HG1 VAL 34 -6.066 11.722 -2.547 221 HG12 VAL 34 2HG1 VAL 34 -4.797 11.170 -1.450 222 HG13 VAL 34 3HG1 VAL 34 -6.383 10.408 -1.414 223 HG21 VAL 34 3HG2 VAL 34 -3.979 9.781 -4.860 224 HG22 VAL 34 1HG2 VAL 34 -3.366 10.869 -3.612 225 HG23 VAL 34 2HG2 VAL 34 -4.764 11.336 -4.580 226 H ALA 35 H ALA 35 -2.317 7.813 -3.476 227 HA ALA 35 HA ALA 35 -3.603 5.462 -4.632 228 HB1 ALA 35 3HB ALA 35 -2.082 7.420 -6.350 229 HB2 ALA 35 1HB ALA 35 -3.826 7.169 -6.372 230 HB3 ALA 35 2HB ALA 35 -2.741 5.871 -6.870 231 H ILE 36 H ILE 36 -2.262 3.751 -5.009 232 HA ILE 36 HA ILE 36 0.600 4.056 -4.576 233 HB ILE 36 HB ILE 36 -1.095 2.134 -2.939 234 HG12 ILE 36 2HG1 ILE 36 0.743 4.330 -1.981 235 HG13 ILE 36 3HG1 ILE 36 -1.004 4.505 -2.113 236 HG21 ILE 36 1HG2 ILE 36 1.012 1.370 -1.955 237 HG22 ILE 36 2HG2 ILE 36 1.904 2.428 -3.050 238 HG23 ILE 36 3HG2 ILE 36 0.965 1.079 -3.694 239 HD11 ILE 36 3HD1 ILE 36 0.474 2.570 -0.341 240 HD12 ILE 36 1HD1 ILE 36 -1.279 2.679 -0.484 241 HD13 ILE 36 2HD1 ILE 36 -0.362 4.035 0.168 242 H ASN 37 H ASN 37 1.625 2.862 -6.114 243 HA ASN 37 HA ASN 37 0.345 0.373 -6.961 244 HB2 ASN 37 2HB ASN 37 0.022 2.458 -8.554 245 HB3 ASN 37 3HB ASN 37 1.689 2.097 -9.005 246 HD21 ASN 37 1HD2 ASN 37 -1.578 0.954 -8.964 247 HD22 ASN 37 2HD2 ASN 37 -1.383 -0.310 -10.119 248 H VAL 38 H VAL 38 1.788 -1.226 -6.627 249 HA VAL 38 HA VAL 38 4.608 -0.748 -7.058 250 HB VAL 38 HB VAL 38 5.330 -1.483 -4.797 251 HG11 VAL 38 1HG1 VAL 38 4.872 0.616 -3.596 252 HG12 VAL 38 2HG1 VAL 38 3.663 1.023 -4.811 253 HG13 VAL 38 3HG1 VAL 38 5.361 0.882 -5.268 254 HG21 VAL 38 3HG2 VAL 38 3.767 -1.450 -2.922 255 HG22 VAL 38 1HG2 VAL 38 3.290 -2.651 -4.122 256 HG23 VAL 38 2HG2 VAL 38 2.442 -1.108 -4.031 257 H GLU 39 H GLU 39 5.858 -2.650 -7.135 258 HA GLU 39 HA GLU 39 4.448 -5.182 -6.751 259 HB2 GLU 39 2HB GLU 39 4.306 -4.608 -9.150 260 HB3 GLU 39 3HB GLU 39 6.055 -4.443 -9.205 261 HG2 GLU 39 2HG GLU 39 6.297 -6.809 -8.651 262 HG3 GLU 39 3HG GLU 39 4.544 -6.969 -8.593 263 H SER 40 H SER 40 5.819 -6.880 -6.141 264 HA SER 40 HA SER 40 8.278 -6.033 -4.934 265 HB2 SER 40 2HB SER 40 6.726 -7.739 -3.904 266 HB3 SER 40 3HB SER 40 7.246 -8.862 -5.159 267 HG SER 40 HG SER 40 9.069 -7.515 -3.463 268 H GLY 41 H GLY 41 10.325 -6.455 -5.536 269 HA2 GLY 41 2HA GLY 41 10.716 -7.394 -8.266 270 HA3 GLY 41 3HA GLY 41 11.946 -6.682 -7.221 271 H ASP 42 H ASP 42 10.530 -8.763 -5.259 272 HA ASP 42 HA ASP 42 11.912 -11.168 -6.147 273 HB2 ASP 42 2HB ASP 42 12.503 -9.720 -3.561 274 HB3 ASP 42 3HB ASP 42 12.877 -11.420 -3.788 275 H ASP 43 H ASP 43 11.619 -12.383 -3.500 276 HA ASP 43 HA ASP 43 8.915 -13.298 -3.797 277 HB2 ASP 43 2HB ASP 43 11.115 -14.021 -1.854 278 HB3 ASP 43 3HB ASP 43 9.523 -14.760 -1.814 279 H GLY 44 H GLY 44 8.801 -10.607 -3.137 280 HA2 GLY 44 2HA GLY 44 7.282 -9.423 -1.809 281 HA3 GLY 44 3HA GLY 44 7.236 -10.778 -0.693 282 H GLN 45 H GLN 45 10.414 -10.311 -1.072 283 HA GLN 45 HA GLN 45 10.676 -9.021 1.442 284 HB2 GLN 45 2HB GLN 45 12.731 -9.845 -0.588 285 HB3 GLN 45 3HB GLN 45 13.158 -9.017 0.901 286 HG2 GLN 45 2HG GLN 45 12.118 -10.841 2.181 287 HG3 GLN 45 3HG GLN 45 11.782 -11.677 0.667 288 HE21 GLN 45 1HE2 GLN 45 14.222 -10.692 2.913 289 HE22 GLN 45 2HE2 GLN 45 15.499 -11.655 2.274 290 H THR 46 H THR 46 11.090 -7.865 -1.867 291 HA THR 46 HA THR 46 11.340 -5.190 -0.706 292 HB THR 46 HB THR 46 13.554 -5.765 -1.530 293 HG1 THR 46 HG1 THR 46 13.026 -4.143 -3.627 294 HG21 THR 46 3HG2 THR 46 13.964 -6.275 -3.897 295 HG22 THR 46 1HG2 THR 46 12.224 -6.288 -4.190 296 HG23 THR 46 2HG2 THR 46 12.952 -7.499 -3.136 297 H LEU 47 H LEU 47 9.761 -3.873 -1.303 298 HA LEU 47 HA LEU 47 8.253 -4.477 -3.735 299 HB2 LEU 47 2HB LEU 47 7.597 -2.696 -1.389 300 HB3 LEU 47 3HB LEU 47 6.561 -2.943 -2.777 301 HG LEU 47 HG LEU 47 7.366 -5.095 -0.818 302 HD11 LEU 47 1HD1 LEU 47 5.070 -4.961 -0.035 303 HD12 LEU 47 2HD1 LEU 47 4.762 -3.617 -1.138 304 HD13 LEU 47 3HD1 LEU 47 5.904 -3.426 0.192 305 HD21 LEU 47 3HD2 LEU 47 5.378 -5.101 -3.082 306 HD22 LEU 47 1HD2 LEU 47 5.634 -6.408 -1.928 307 HD23 LEU 47 2HD2 LEU 47 6.919 -5.955 -3.049 308 H ASN 48 H ASN 48 8.510 -3.276 -5.447 309 HA ASN 48 HA ASN 48 9.694 -0.589 -5.145 310 HB2 ASN 48 2HB ASN 48 10.081 -2.613 -7.359 311 HB3 ASN 48 3HB ASN 48 10.620 -0.939 -7.458 312 HD21 ASN 48 1HD2 ASN 48 12.128 -3.443 -7.532 313 HD22 ASN 48 2HD2 ASN 48 13.307 -3.321 -6.275 314 H GLY 49 H GLY 49 8.755 1.084 -6.292 315 HA2 GLY 49 2HA GLY 49 7.109 0.928 -8.488 316 HA3 GLY 49 3HA GLY 49 6.044 0.648 -7.123 317 H THR 50 H THR 50 4.864 2.492 -7.309 318 HA THR 50 HA THR 50 6.281 4.961 -6.647 319 HB THR 50 HB THR 50 4.722 6.197 -8.195 320 HG1 THR 50 HG1 THR 50 4.236 3.543 -9.112 321 HG21 THR 50 3HG2 THR 50 6.035 5.751 -10.223 322 HG22 THR 50 1HG2 THR 50 6.644 4.260 -9.504 323 HG23 THR 50 2HG2 THR 50 7.068 5.817 -8.794 324 H MET 51 H MET 51 5.007 6.510 -5.568 325 HA MET 51 HA MET 51 2.346 5.648 -4.697 326 HB2 MET 51 2HB MET 51 3.909 5.001 -2.930 327 HB3 MET 51 3HB MET 51 4.581 6.621 -2.903 328 HG2 MET 51 2HG MET 51 1.682 6.250 -2.356 329 HG3 MET 51 3HG MET 51 2.848 5.823 -1.108 330 HE1 MET 51 3HE MET 51 5.166 7.917 -1.497 331 HE2 MET 51 1HE MET 51 4.457 7.485 0.061 332 HE3 MET 51 2HE MET 51 4.641 9.181 -0.389 333 H THR 52 H THR 52 0.865 7.331 -4.463 334 HA THR 52 HA THR 52 1.907 9.987 -5.198 335 HB THR 52 HB THR 52 -0.675 8.767 -6.182 336 HG1 THR 52 HG1 THR 52 1.773 8.292 -6.976 337 HG21 THR 52 3HG2 THR 52 -0.685 10.694 -7.723 338 HG22 THR 52 1HG2 THR 52 0.763 11.320 -6.932 339 HG23 THR 52 2HG2 THR 52 -0.753 11.203 -6.036 340 H TYR 53 H TYR 53 1.322 11.606 -3.938 341 HA TYR 53 HA TYR 53 -0.608 11.246 -1.813 342 HB2 TYR 53 2HB TYR 53 1.131 13.615 -2.552 343 HB3 TYR 53 3HB TYR 53 0.070 13.557 -1.160 344 HD1 TYR 53 HD2 TYR 53 0.580 11.827 0.650 345 HD2 TYR 53 HD1 TYR 53 3.327 12.810 -2.449 346 HE1 TYR 53 HE2 TYR 53 2.422 10.934 2.009 347 HE2 TYR 53 HE1 TYR 53 5.178 11.925 -1.096 348 HH TYR 53 HH TYR 53 5.622 11.576 1.387 349 H ALA 54 H ALA 54 -2.193 13.064 -1.430 350 HA ALA 54 HA ALA 54 -3.946 13.260 -3.663 351 HB1 ALA 54 3HB ALA 54 -4.735 13.186 -1.335 352 HB2 ALA 54 1HB ALA 54 -5.368 14.588 -2.203 353 HB3 ALA 54 2HB ALA 54 -4.039 14.781 -1.059 354 H GLY 55 H GLY 55 -3.639 14.559 -5.382 355 HA2 GLY 55 2HA GLY 55 -3.477 16.543 -6.527 356 HA3 GLY 55 3HA GLY 55 -3.365 17.377 -4.986 357 H GLU 56 H GLU 56 -1.132 14.838 -5.425 358 HA GLU 56 HA GLU 56 0.961 16.795 -6.106 359 HB2 GLU 56 2HB GLU 56 1.126 14.460 -4.206 360 HB3 GLU 56 3HB GLU 56 2.495 15.442 -4.693 361 HG2 GLU 56 2HG GLU 56 0.080 16.419 -3.183 362 HG3 GLU 56 3HG GLU 56 1.668 16.082 -2.495 363 H GLY 57 H GLY 57 3.048 15.460 -6.711 364 HA2 GLY 57 2HA GLY 57 2.232 13.729 -8.911 365 HA3 GLY 57 3HA GLY 57 3.816 14.460 -8.699 366 HA PRO 58 HA PRO 58 3.510 9.985 -6.965 367 HB2 PRO 58 2HB PRO 58 4.472 8.573 -9.084 368 HB3 PRO 58 3HB PRO 58 2.745 8.866 -8.826 369 HG2 PRO 58 2HG PRO 58 4.664 10.318 -10.612 370 HG3 PRO 58 3HG PRO 58 3.018 9.760 -10.963 371 HD2 PRO 58 2HD PRO 58 3.543 12.328 -10.327 372 HD3 PRO 58 3HD PRO 58 2.040 11.525 -9.829 373 H ILE 59 H ILE 59 5.262 9.107 -6.013 374 HA ILE 59 HA ILE 59 7.906 9.940 -6.981 375 HB ILE 59 HB ILE 59 8.693 10.036 -4.641 376 HG12 ILE 59 2HG1 ILE 59 5.764 9.792 -3.905 377 HG13 ILE 59 3HG1 ILE 59 6.978 8.539 -3.668 378 HG21 ILE 59 1HG2 ILE 59 8.062 12.089 -5.757 379 HG22 ILE 59 2HG2 ILE 59 7.630 12.172 -4.049 380 HG23 ILE 59 3HG2 ILE 59 6.383 11.873 -5.260 381 HD11 ILE 59 3HD1 ILE 59 8.188 10.015 -2.138 382 HD12 ILE 59 1HD1 ILE 59 6.532 9.727 -1.606 383 HD13 ILE 59 2HD1 ILE 59 6.961 11.255 -2.375 384 H GLY 60 H GLY 60 9.674 8.523 -6.147 385 HA2 GLY 60 2HA GLY 60 9.031 5.830 -6.867 386 HA3 GLY 60 3HA GLY 60 10.606 6.425 -6.373 387 H PHE 61 H PHE 61 9.075 3.996 -5.663 388 HA PHE 61 HA PHE 61 9.151 4.328 -2.744 389 HB2 PHE 61 2HB PHE 61 6.824 4.263 -3.466 390 HB3 PHE 61 3HB PHE 61 7.123 2.800 -4.387 391 HD1 PHE 61 HD1 PHE 61 6.661 4.212 -1.051 392 HD2 PHE 61 HD2 PHE 61 7.274 0.654 -3.297 393 HE1 PHE 61 HE1 PHE 61 5.999 2.865 0.895 394 HE2 PHE 61 HE2 PHE 61 6.618 -0.697 -1.350 395 HZ PHE 61 HZ PHE 61 5.977 0.412 0.750 396 H ARG 62 H ARG 62 10.532 2.966 -1.810 397 HA ARG 62 HA ARG 62 10.851 0.272 -2.947 398 HB2 ARG 62 2HB ARG 62 12.844 1.780 -3.518 399 HB3 ARG 62 3HB ARG 62 13.197 1.807 -1.796 400 HG2 ARG 62 2HG ARG 62 13.472 -0.613 -1.791 401 HG3 ARG 62 3HG ARG 62 13.072 -0.674 -3.507 402 HD2 ARG 62 2HD ARG 62 15.433 -0.791 -3.365 403 HD3 ARG 62 3HD ARG 62 15.051 0.836 -3.903 404 HE ARG 62 HE ARG 62 15.554 1.628 -1.661 405 HH11 ARG 62 1HH1 ARG 62 16.585 -1.657 -2.419 406 HH12 ARG 62 2HH1 ARG 62 17.759 -1.711 -1.154 407 HH21 ARG 62 1HH2 ARG 62 17.118 1.553 -0.007 408 HH22 ARG 62 2HH2 ARG 62 18.081 0.122 0.218 409 H ALA 63 H ALA 63 10.579 -1.275 -1.433 410 HA ALA 63 HA ALA 63 10.877 -0.490 1.393 411 HB1 ALA 63 3HB ALA 63 8.805 -1.459 2.002 412 HB2 ALA 63 1HB ALA 63 8.586 -2.165 0.400 413 HB3 ALA 63 2HB ALA 63 8.487 -0.420 0.616 414 H THR 64 H THR 64 11.638 -2.036 2.768 415 HA THR 64 HA THR 64 12.248 -4.677 1.594 416 HB THR 64 HB THR 64 14.000 -3.151 3.539 417 HG1 THR 64 HG1 THR 64 13.805 -2.378 1.265 418 HG21 THR 64 3HG2 THR 64 14.212 -5.595 3.717 419 HG22 THR 64 1HG2 THR 64 15.662 -4.895 2.995 420 HG23 THR 64 2HG2 THR 64 14.472 -5.703 1.975 421 H LEU 65 H LEU 65 11.559 -6.389 2.750 422 HA LEU 65 HA LEU 65 9.965 -5.975 5.084 423 HB2 LEU 65 2HB LEU 65 9.313 -7.616 3.461 424 HB3 LEU 65 3HB LEU 65 10.833 -8.467 3.635 425 HG LEU 65 HG LEU 65 10.177 -8.986 6.000 426 HD11 LEU 65 1HD1 LEU 65 7.498 -7.952 5.092 427 HD12 LEU 65 2HD1 LEU 65 8.527 -7.242 6.335 428 HD13 LEU 65 3HD1 LEU 65 7.811 -8.831 6.589 429 HD21 LEU 65 3HD2 LEU 65 8.365 -10.009 3.822 430 HD22 LEU 65 1HD2 LEU 65 8.676 -10.795 5.370 431 HD23 LEU 65 2HD2 LEU 65 9.981 -10.613 4.198 432 H LEU 66 H LEU 66 10.520 -6.063 7.138 433 HA LEU 66 HA LEU 66 13.182 -6.806 7.960 434 HB2 LEU 66 2HB LEU 66 10.767 -5.754 9.396 435 HB3 LEU 66 3HB LEU 66 12.115 -6.402 10.308 436 HG LEU 66 HG LEU 66 13.596 -4.707 9.233 437 HD11 LEU 66 1HD1 LEU 66 12.302 -4.292 7.212 438 HD12 LEU 66 2HD1 LEU 66 12.591 -2.798 8.108 439 HD13 LEU 66 3HD1 LEU 66 11.012 -3.576 8.180 440 HD21 LEU 66 3HD2 LEU 66 12.690 -4.322 11.445 441 HD22 LEU 66 1HD2 LEU 66 11.214 -3.654 10.748 442 HD23 LEU 66 2HD2 LEU 66 12.750 -2.811 10.540 443 H GLY 67 H GLY 67 10.106 -8.354 7.798 444 HA2 GLY 67 2HA GLY 67 10.130 -10.811 7.830 445 HA3 GLY 67 3HA GLY 67 11.254 -10.711 9.179 446 H ASN 68 H ASN 68 9.291 -8.366 9.850 447 HA ASN 68 HA ASN 68 7.363 -10.052 11.341 448 HB2 ASN 68 2HB ASN 68 7.313 -8.308 13.091 449 HB3 ASN 68 3HB ASN 68 8.929 -8.964 12.867 450 HD21 ASN 68 1HD2 ASN 68 8.034 -6.426 13.991 451 HD22 ASN 68 2HD2 ASN 68 8.815 -5.190 13.071 452 H ASN 69 H ASN 69 7.059 -9.012 8.702 453 HA ASN 69 HA ASN 69 5.426 -8.201 7.361 454 HB2 ASN 69 2HB ASN 69 3.982 -7.489 9.932 455 HB3 ASN 69 3HB ASN 69 3.299 -7.278 8.323 456 HD21 ASN 69 1HD2 ASN 69 2.194 -8.870 10.382 457 HD22 ASN 69 2HD2 ASN 69 2.207 -10.512 9.854 458 H SER 70 H SER 70 7.202 -6.382 9.501 459 HA SER 70 HA SER 70 6.392 -3.796 8.578 460 HB2 SER 70 2HB SER 70 8.927 -4.526 10.051 461 HB3 SER 70 3HB SER 70 8.144 -2.946 9.973 462 HG SER 70 HG SER 70 6.462 -3.751 11.208 463 H TYR 71 H TYR 71 7.309 -2.599 7.049 464 HA TYR 71 HA TYR 71 9.583 -3.706 5.547 465 HB2 TYR 71 2HB TYR 71 7.108 -2.265 4.591 466 HB3 TYR 71 3HB TYR 71 8.563 -2.374 3.619 467 HD1 TYR 71 HD1 TYR 71 6.011 -4.490 5.331 468 HD2 TYR 71 HD2 TYR 71 8.890 -4.195 2.212 469 HE1 TYR 71 HE1 TYR 71 5.218 -6.620 4.402 470 HE2 TYR 71 HE2 TYR 71 8.112 -6.325 1.277 471 HH TYR 71 HH TYR 71 6.908 -8.246 1.830 472 H GLU 72 H GLU 72 11.302 -2.382 5.458 473 HA GLU 72 HA GLU 72 11.037 0.319 6.455 474 HB2 GLU 72 2HB GLU 72 13.024 -1.060 7.029 475 HB3 GLU 72 3HB GLU 72 13.474 -1.085 5.327 476 HG2 GLU 72 2HG GLU 72 13.892 1.256 5.324 477 HG3 GLU 72 3HG GLU 72 13.192 1.441 6.933 478 H VAL 73 H VAL 73 10.541 1.953 5.218 479 HA VAL 73 HA VAL 73 10.560 1.534 2.327 480 HB VAL 73 HB VAL 73 8.789 3.192 4.110 481 HG11 VAL 73 1HG1 VAL 73 7.585 3.882 2.101 482 HG12 VAL 73 2HG1 VAL 73 8.788 3.076 1.096 483 HG13 VAL 73 3HG1 VAL 73 9.248 4.464 2.082 484 HG21 VAL 73 3HG2 VAL 73 8.296 0.801 4.012 485 HG22 VAL 73 1HG2 VAL 73 8.199 0.891 2.256 486 HG23 VAL 73 2HG2 VAL 73 7.024 1.755 3.246 487 H GLU 74 H GLU 74 11.534 2.827 1.014 488 HA GLU 74 HA GLU 74 12.686 5.343 1.985 489 HB2 GLU 74 2HB GLU 74 13.775 3.358 -0.012 490 HB3 GLU 74 3HB GLU 74 14.425 4.973 0.208 491 HG2 GLU 74 2HG GLU 74 15.056 4.454 2.476 492 HG3 GLU 74 3HG GLU 74 14.300 2.865 2.346 493 H ASN 75 H ASN 75 11.785 7.033 1.002 494 HA ASN 75 HA ASN 75 10.306 6.638 -1.472 495 HB2 ASN 75 2HB ASN 75 10.465 9.005 0.413 496 HB3 ASN 75 3HB ASN 75 9.471 8.943 -1.032 497 HD21 ASN 75 1HD2 ASN 75 7.601 9.280 0.173 498 HD22 ASN 75 2HD2 ASN 75 6.913 8.050 1.173 499 H GLN 76 H GLN 76 10.824 7.646 -3.348 500 HA GLN 76 HA GLN 76 13.367 9.138 -3.382 501 HB2 GLN 76 2HB GLN 76 13.447 6.943 -4.524 502 HB3 GLN 76 3HB GLN 76 12.152 7.466 -5.587 503 HG2 GLN 76 2HG GLN 76 13.602 9.254 -6.442 504 HG3 GLN 76 3HG GLN 76 14.908 8.666 -5.415 505 HE21 GLN 76 1HE2 GLN 76 16.258 8.169 -7.109 506 HE22 GLN 76 2HE2 GLN 76 15.955 6.865 -8.202 507 H TRP 77 H TRP 77 13.140 11.222 -3.879 508 HA TRP 77 HA TRP 77 11.068 11.971 -5.783 509 HB2 TRP 77 2HB TRP 77 10.507 13.981 -4.399 510 HB3 TRP 77 3HB TRP 77 10.014 12.454 -3.678 511 HD1 TRP 77 HD1 TRP 77 12.985 14.958 -3.349 512 HE1 TRP 77 HE1 TRP 77 13.683 15.027 -0.874 513 HE3 TRP 77 HE3 TRP 77 9.786 11.424 -1.493 514 HZ2 TRP 77 HZ2 TRP 77 12.974 13.765 1.543 515 HZ3 TRP 77 HZ3 TRP 77 9.858 10.925 0.917 516 HH2 TRP 77 HH2 TRP 77 11.419 12.072 2.402 517 H GLY 78 H GLY 78 11.437 14.032 -6.791 518 HA2 GLY 78 2HA GLY 78 12.845 15.918 -7.212 519 HA3 GLY 78 3HA GLY 78 14.189 15.017 -6.518 520 H GLY 79 H GLY 79 12.953 12.663 -8.121 521 HA2 GLY 79 2HA GLY 79 12.777 12.549 -10.651 522 HA3 GLY 79 3HA GLY 79 14.347 13.345 -10.618 523 H ASP 80 H ASP 80 14.183 11.034 -11.946 524 HA ASP 80 HA ASP 80 14.670 8.682 -10.462 525 HB2 ASP 80 2HB ASP 80 15.552 7.792 -12.607 526 HB3 ASP 80 3HB ASP 80 13.987 8.576 -12.788 527 H SER 81 H SER 81 16.740 11.230 -11.618 528 HA SER 81 HA SER 81 19.181 9.837 -11.100 529 HB2 SER 81 2HB SER 81 18.686 12.764 -11.674 530 HB3 SER 81 3HB SER 81 20.254 11.956 -11.709 531 HG SER 81 HG SER 81 18.256 10.770 -13.243 532 H ALA 82 H ALA 82 16.974 11.135 -9.027 533 HA ALA 82 HA ALA 82 18.887 12.219 -7.119 534 HB1 ALA 82 3HB ALA 82 15.890 11.874 -6.932 535 HB2 ALA 82 1HB ALA 82 16.740 13.352 -7.380 536 HB3 ALA 82 2HB ALA 82 16.903 12.700 -5.747 537 HA PRO 83 HA PRO 83 19.414 8.376 -4.961 538 HB2 PRO 83 2HB PRO 83 20.028 9.297 -2.477 539 HB3 PRO 83 3HB PRO 83 21.155 9.388 -3.837 540 HG2 PRO 83 2HG PRO 83 19.359 11.509 -2.726 541 HG3 PRO 83 3HG PRO 83 21.052 11.632 -3.239 542 HD2 PRO 83 2HD PRO 83 19.007 12.455 -4.802 543 HD3 PRO 83 3HD PRO 83 20.497 11.768 -5.475 544 H TRP 84 H TRP 84 18.732 7.348 -2.735 545 HA TRP 84 HA TRP 84 15.851 7.620 -2.614 546 HB2 TRP 84 2HB TRP 84 17.768 5.638 -1.365 547 HB3 TRP 84 3HB TRP 84 16.028 5.605 -1.121 548 HD1 TRP 84 HD1 TRP 84 18.717 4.616 -3.581 549 HE1 TRP 84 HE1 TRP 84 17.658 3.329 -5.534 550 HE3 TRP 84 HE3 TRP 84 13.786 5.481 -2.538 551 HZ2 TRP 84 HZ2 TRP 84 15.070 2.750 -6.511 552 HZ3 TRP 84 HZ3 TRP 84 12.079 4.524 -4.032 553 HH2 TRP 84 HH2 TRP 84 12.708 3.187 -5.977 554 H HIS 85 H HIS 85 14.712 8.192 -0.764 555 HA HIS 85 HA HIS 85 16.340 9.344 1.383 556 HB2 HIS 85 2HB HIS 85 13.711 10.344 0.255 557 HB3 HIS 85 3HB HIS 85 14.502 11.005 1.678 558 HD1 HIS 85 HD1 HIS 85 16.606 12.479 1.285 559 HD2 HIS 85 HD2 HIS 85 14.811 11.107 -2.203 560 HE1 HIS 85 HE1 HIS 85 17.643 13.803 -0.574 561 H SER 86 H SER 86 15.554 9.047 3.481 562 HA SER 86 HA SER 86 14.206 6.611 3.928 563 HB2 SER 86 2HB SER 86 14.699 8.892 5.855 564 HB3 SER 86 3HB SER 86 14.262 7.241 6.301 565 HG SER 86 HG SER 86 16.306 6.961 4.738 566 H GLY 87 H GLY 87 12.099 6.114 4.147 567 HA2 GLY 87 2HA GLY 87 10.185 8.345 4.080 568 HA3 GLY 87 3HA GLY 87 9.881 6.725 3.465 569 H GLY 88 H GLY 88 10.483 5.042 5.389 570 HA2 GLY 88 2HA GLY 88 10.117 5.495 8.020 571 HA3 GLY 88 3HA GLY 88 8.478 5.645 7.399 572 H ASN 89 H ASN 89 8.387 3.784 9.041 573 HA ASN 89 HA ASN 89 9.007 1.259 7.663 574 HB2 ASN 89 2HB ASN 89 10.051 1.548 9.905 575 HB3 ASN 89 3HB ASN 89 8.443 1.696 10.608 576 HD21 ASN 89 1HD2 ASN 89 10.767 -0.438 9.182 577 HD22 ASN 89 2HD2 ASN 89 9.989 -1.912 9.626 578 H TRP 90 H TRP 90 7.309 0.417 6.651 579 HA TRP 90 HA TRP 90 4.605 1.098 7.594 580 HB2 TRP 90 2HB TRP 90 5.568 0.145 4.880 581 HB3 TRP 90 3HB TRP 90 3.897 0.499 5.288 582 HD1 TRP 90 HD1 TRP 90 6.338 3.031 6.660 583 HE1 TRP 90 HE1 TRP 90 6.247 5.180 5.259 584 HE3 TRP 90 HE3 TRP 90 3.491 1.339 2.764 585 HZ2 TRP 90 HZ2 TRP 90 5.118 6.053 2.820 586 HZ3 TRP 90 HZ3 TRP 90 2.948 2.895 0.940 587 HH2 TRP 90 HH2 TRP 90 3.742 5.204 0.969 588 H ILE 91 H ILE 91 3.007 -0.580 7.628 589 HA ILE 91 HA ILE 91 4.156 -3.302 7.908 590 HB ILE 91 HB ILE 91 1.498 -2.276 8.963 591 HG12 ILE 91 2HG1 ILE 91 3.358 -1.213 10.162 592 HG13 ILE 91 3HG1 ILE 91 2.510 -2.352 11.200 593 HG21 ILE 91 1HG2 ILE 91 2.929 -4.883 9.445 594 HG22 ILE 91 2HG2 ILE 91 1.447 -4.649 8.517 595 HG23 ILE 91 3HG2 ILE 91 1.450 -4.363 10.257 596 HD11 ILE 91 3HD1 ILE 91 4.295 -3.994 10.779 597 HD12 ILE 91 1HD1 ILE 91 4.878 -2.514 11.548 598 HD13 ILE 91 2HD1 ILE 91 5.144 -2.774 9.827 599 H LEU 92 H LEU 92 3.828 -4.532 6.063 600 HA LEU 92 HA LEU 92 1.268 -4.142 4.660 601 HB2 LEU 92 2HB LEU 92 3.968 -4.582 3.380 602 HB3 LEU 92 3HB LEU 92 2.442 -4.472 2.528 603 HG LEU 92 HG LEU 92 3.704 -2.234 4.120 604 HD11 LEU 92 1HD1 LEU 92 4.972 -2.718 2.114 605 HD12 LEU 92 2HD1 LEU 92 4.104 -1.193 1.946 606 HD13 LEU 92 3HD1 LEU 92 3.504 -2.640 1.144 607 HD21 LEU 92 3HD2 LEU 92 1.975 -0.836 3.080 608 HD22 LEU 92 1HD2 LEU 92 1.276 -2.089 4.107 609 HD23 LEU 92 2HD2 LEU 92 1.257 -2.273 2.353 610 H GLY 93 H GLY 93 0.521 -5.940 5.881 611 HA2 GLY 93 2HA GLY 93 0.268 -8.314 4.623 612 HA3 GLY 93 3HA GLY 93 1.713 -8.536 5.605 613 H SER 94 H SER 94 -1.701 -8.574 5.593 614 HA SER 94 HA SER 94 -1.760 -8.464 8.523 615 HB2 SER 94 2HB SER 94 -4.258 -8.196 8.158 616 HB3 SER 94 3HB SER 94 -3.242 -6.851 7.633 617 HG SER 94 HG SER 94 -4.991 -7.877 6.172 618 H ARG 95 H ARG 95 -1.900 -10.616 5.925 619 HA ARG 95 HA ARG 95 -3.598 -12.512 7.304 620 HB2 ARG 95 2HB ARG 95 -2.164 -12.704 4.647 621 HB3 ARG 95 3HB ARG 95 -3.159 -13.997 5.314 622 HG2 ARG 95 2HG ARG 95 -5.112 -12.556 5.304 623 HG3 ARG 95 3HG ARG 95 -4.138 -11.200 4.754 624 HD2 ARG 95 2HD ARG 95 -5.353 -12.072 2.885 625 HD3 ARG 95 3HD ARG 95 -3.652 -12.460 2.670 626 HE ARG 95 HE ARG 95 -4.970 -14.620 3.905 627 HH11 ARG 95 1HH1 ARG 95 -4.777 -12.969 0.805 628 HH12 ARG 95 2HH1 ARG 95 -5.098 -14.396 -0.125 629 HH21 ARG 95 1HH2 ARG 95 -5.464 -16.519 2.633 630 HH22 ARG 95 2HH2 ARG 95 -5.482 -16.381 0.909 631 H GLU 96 H GLU 96 -0.874 -11.579 8.147 632 HA GLU 96 HA GLU 96 0.726 -12.309 9.561 633 HB2 GLU 96 2HB GLU 96 -1.127 -13.464 10.644 634 HB3 GLU 96 3HB GLU 96 -0.888 -14.857 9.604 635 HG2 GLU 96 2HG GLU 96 0.047 -15.336 11.739 636 HG3 GLU 96 3HG GLU 96 1.368 -15.146 10.593 637 H ASN 97 H ASN 97 0.121 -15.372 7.848 638 HA ASN 97 HA ASN 97 3.014 -15.665 7.566 639 HB2 ASN 97 2HB ASN 97 0.766 -17.634 7.084 640 HB3 ASN 97 3HB ASN 97 2.475 -18.005 6.880 641 HD21 ASN 97 1HD2 ASN 97 -0.118 -17.657 9.077 642 HD22 ASN 97 2HD2 ASN 97 0.750 -18.059 10.517 643 H GLN 98 H GLN 98 1.531 -13.783 5.884 644 HA GLN 98 HA GLN 98 2.483 -14.721 3.319 645 HB2 GLN 98 2HB GLN 98 0.120 -15.554 3.538 646 HB3 GLN 98 3HB GLN 98 -0.399 -13.879 3.614 647 HG2 GLN 98 2HG GLN 98 0.503 -13.499 1.380 648 HG3 GLN 98 3HG GLN 98 1.009 -15.187 1.299 649 HE21 GLN 98 1HE2 GLN 98 -0.310 -15.690 -0.439 650 HE22 GLN 98 2HE2 GLN 98 -2.043 -15.762 -0.305 651 H ASN 99 H ASN 99 3.642 -13.082 2.571 652 HA ASN 99 HA ASN 99 3.318 -10.390 3.573 653 HB2 ASN 99 2HB ASN 99 5.279 -11.586 1.608 654 HB3 ASN 99 3HB ASN 99 5.373 -9.958 2.260 655 HD21 ASN 99 1HD2 ASN 99 7.164 -12.326 2.421 656 HD22 ASN 99 2HD2 ASN 99 7.454 -12.544 4.110 657 H VAL 100 H VAL 100 3.270 -8.510 2.160 658 HA VAL 100 HA VAL 100 1.448 -8.895 -0.088 659 HB VAL 100 HB VAL 100 2.662 -6.362 1.041 660 HG11 VAL 100 1HG1 VAL 100 0.576 -6.697 -1.116 661 HG12 VAL 100 2HG1 VAL 100 2.213 -6.085 -1.343 662 HG13 VAL 100 3HG1 VAL 100 1.051 -5.168 -0.380 663 HG21 VAL 100 3HG2 VAL 100 1.054 -7.440 2.506 664 HG22 VAL 100 1HG2 VAL 100 -0.118 -7.514 1.192 665 HG23 VAL 100 2HG2 VAL 100 0.385 -5.950 1.836 666 H VAL 101 H VAL 101 1.931 -8.851 -2.194 667 HA VAL 101 HA VAL 101 4.760 -8.335 -2.902 668 HB VAL 101 HB VAL 101 4.606 -9.885 -4.796 669 HG11 VAL 101 1HG1 VAL 101 5.516 -10.639 -2.680 670 HG12 VAL 101 2HG1 VAL 101 4.661 -11.949 -3.495 671 HG13 VAL 101 3HG1 VAL 101 3.906 -11.110 -2.139 672 HG21 VAL 101 3HG2 VAL 101 2.221 -9.814 -5.222 673 HG22 VAL 101 1HG2 VAL 101 1.899 -10.587 -3.668 674 HG23 VAL 101 2HG2 VAL 101 2.742 -11.474 -4.936 675 H ALA 102 H ALA 102 1.486 -7.552 -3.739 676 HA ALA 102 HA ALA 102 2.551 -5.461 -5.455 677 HB1 ALA 102 3HB ALA 102 1.283 -5.976 -7.406 678 HB2 ALA 102 1HB ALA 102 0.451 -7.301 -6.592 679 HB3 ALA 102 2HB ALA 102 2.167 -7.431 -6.960 680 H ILE 103 H ILE 103 1.212 -3.639 -5.620 681 HA ILE 103 HA ILE 103 -1.411 -3.852 -4.337 682 HB ILE 103 HB ILE 103 0.632 -1.703 -3.720 683 HG12 ILE 103 2HG1 ILE 103 -0.618 -3.749 -1.873 684 HG13 ILE 103 3HG1 ILE 103 1.001 -3.878 -2.554 685 HG21 ILE 103 1HG2 ILE 103 -1.611 -0.780 -3.848 686 HG22 ILE 103 2HG2 ILE 103 -1.051 -0.805 -2.177 687 HG23 ILE 103 3HG2 ILE 103 -2.200 -2.017 -2.741 688 HD11 ILE 103 3HD1 ILE 103 1.102 -3.066 -0.279 689 HD12 ILE 103 1HD1 ILE 103 0.027 -1.729 -0.685 690 HD13 ILE 103 2HD1 ILE 103 1.636 -1.812 -1.395 691 H ASN 104 H ASN 104 -2.918 -3.024 -5.617 692 HA ASN 104 HA ASN 104 -2.263 -0.717 -7.325 693 HB2 ASN 104 2HB ASN 104 -2.543 -2.653 -8.768 694 HB3 ASN 104 3HB ASN 104 -4.048 -3.083 -7.966 695 HD21 ASN 104 1HD2 ASN 104 -5.907 -2.095 -8.565 696 HD22 ASN 104 2HD2 ASN 104 -6.034 -0.991 -9.890 697 H VAL 105 H VAL 105 -3.068 0.822 -6.106 698 HA VAL 105 HA VAL 105 -5.917 0.663 -5.410 699 HB VAL 105 HB VAL 105 -5.565 1.573 -3.119 700 HG11 VAL 105 1HG1 VAL 105 -6.001 -0.786 -3.436 701 HG12 VAL 105 2HG1 VAL 105 -4.848 -0.558 -2.122 702 HG13 VAL 105 3HG1 VAL 105 -4.286 -1.092 -3.706 703 HG21 VAL 105 3HG2 VAL 105 -3.303 1.269 -2.118 704 HG22 VAL 105 1HG2 VAL 105 -3.384 2.550 -3.332 705 HG23 VAL 105 2HG2 VAL 105 -2.678 0.989 -3.744 706 H GLU 106 H GLU 106 -7.082 2.465 -5.364 707 HA GLU 106 HA GLU 106 -5.769 5.076 -5.579 708 HB2 GLU 106 2HB GLU 106 -6.193 4.303 -7.902 709 HB3 GLU 106 3HB GLU 106 -7.891 4.077 -7.508 710 HG2 GLU 106 2HG GLU 106 -8.062 6.499 -7.033 711 HG3 GLU 106 3HG GLU 106 -6.383 6.685 -7.536 712 H SER 107 H SER 107 -7.122 6.799 -4.852 713 HA SER 107 HA SER 107 -9.838 6.154 -4.066 714 HB2 SER 107 2HB SER 107 -9.444 7.035 -1.749 715 HB3 SER 107 3HB SER 107 -8.677 5.483 -2.085 716 HG SER 107 HG SER 107 -6.775 6.853 -2.647 717 H GLY 108 H GLY 108 -11.125 7.966 -3.649 718 HA2 GLY 108 2HA GLY 108 -9.907 10.546 -4.399 719 HA3 GLY 108 3HA GLY 108 -11.510 10.053 -4.933 720 H ASP 109 H ASP 109 -11.014 8.901 -1.893 721 HA ASP 109 HA ASP 109 -12.677 10.985 -0.713 722 HB2 ASP 109 2HB ASP 109 -11.930 8.191 0.119 723 HB3 ASP 109 3HB ASP 109 -12.684 9.307 1.253 724 H ASP 110 H ASP 110 -9.968 11.563 -1.320 725 HA ASP 110 HA ASP 110 -8.184 12.679 -0.477 726 HB2 ASP 110 2HB ASP 110 -10.030 13.012 1.893 727 HB3 ASP 110 3HB ASP 110 -8.514 13.884 1.679 728 H GLY 111 H GLY 111 -8.551 9.746 0.147 729 HA2 GLY 111 2HA GLY 111 -6.851 8.297 0.885 730 HA3 GLY 111 3HA GLY 111 -6.201 9.604 1.855 731 H GLN 112 H GLN 112 -9.432 9.622 2.490 732 HA GLN 112 HA GLN 112 -9.125 8.547 5.090 733 HB2 GLN 112 2HB GLN 112 -10.799 10.253 4.618 734 HB3 GLN 112 3HB GLN 112 -11.627 9.172 3.506 735 HG2 GLN 112 2HG GLN 112 -12.218 7.701 5.344 736 HG3 GLN 112 3HG GLN 112 -11.332 8.724 6.470 737 HE21 GLN 112 1HE2 GLN 112 -14.159 7.978 6.411 738 HE22 GLN 112 2HE2 GLN 112 -15.034 9.467 6.367 739 H THR 113 H THR 113 -10.601 7.299 2.152 740 HA THR 113 HA THR 113 -10.344 4.614 3.263 741 HB THR 113 HB THR 113 -12.364 4.066 1.747 742 HG1 THR 113 HG1 THR 113 -13.596 5.724 1.105 743 HG21 THR 113 3HG2 THR 113 -12.418 3.977 4.198 744 HG22 THR 113 1HG2 THR 113 -13.935 4.593 3.543 745 HG23 THR 113 2HG2 THR 113 -12.766 5.707 4.251 746 H LEU 114 H LEU 114 -9.177 3.329 2.073 747 HA LEU 114 HA LEU 114 -8.484 4.167 -0.660 748 HB2 LEU 114 2HB LEU 114 -6.658 4.217 1.024 749 HB3 LEU 114 3HB LEU 114 -6.909 2.513 1.315 750 HG LEU 114 HG LEU 114 -6.182 1.996 -0.950 751 HD11 LEU 114 1HD1 LEU 114 -6.904 4.003 -2.104 752 HD12 LEU 114 2HD1 LEU 114 -5.172 3.767 -2.345 753 HD13 LEU 114 3HD1 LEU 114 -5.746 4.975 -1.196 754 HD21 LEU 114 3HD2 LEU 114 -4.527 2.030 0.807 755 HD22 LEU 114 1HD2 LEU 114 -4.295 3.764 0.597 756 HD23 LEU 114 2HD2 LEU 114 -3.818 2.650 -0.681 757 H ASN 115 H ASN 115 -8.838 2.678 -2.326 758 HA ASN 115 HA ASN 115 -9.277 -0.075 -1.554 759 HB2 ASN 115 2HB ASN 115 -11.440 -0.301 -2.672 760 HB3 ASN 115 3HB ASN 115 -11.528 0.867 -1.367 761 HD21 ASN 115 1HD2 ASN 115 -13.300 1.932 -2.147 762 HD22 ASN 115 2HD2 ASN 115 -13.287 2.879 -3.589 763 H GLY 116 H GLY 116 -9.716 -1.471 -3.473 764 HA2 GLY 116 2HA GLY 116 -9.394 -1.125 -6.064 765 HA3 GLY 116 3HA GLY 116 -7.756 -0.784 -5.513 766 H THR 117 H THR 117 -6.575 -2.464 -6.012 767 HA THR 117 HA THR 117 -7.445 -5.101 -5.094 768 HB THR 117 HB THR 117 -6.303 -6.067 -7.141 769 HG1 THR 117 HG1 THR 117 -6.264 -4.594 -8.964 770 HG21 THR 117 3HG2 THR 117 -8.270 -5.778 -8.587 771 HG22 THR 117 1HG2 THR 117 -8.808 -4.429 -7.583 772 HG23 THR 117 2HG2 THR 117 -8.740 -6.059 -6.911 773 H MET 118 H MET 118 -5.666 -6.593 -4.804 774 HA MET 118 HA MET 118 -2.996 -5.543 -4.807 775 HB2 MET 118 2HB MET 118 -2.563 -5.781 -2.433 776 HB3 MET 118 3HB MET 118 -3.900 -4.673 -2.664 777 HG2 MET 118 2HG MET 118 -4.530 -5.977 -0.842 778 HG3 MET 118 3HG MET 118 -5.424 -6.660 -2.198 779 HE1 MET 118 3HE MET 118 -2.317 -7.204 0.240 780 HE2 MET 118 1HE MET 118 -1.626 -7.060 -1.379 781 HE3 MET 118 2HE MET 118 -1.584 -8.606 -0.534 782 H THR 119 H THR 119 -1.437 -7.265 -4.125 783 HA THR 119 HA THR 119 -2.619 -9.926 -4.488 784 HB THR 119 HB THR 119 -0.102 -8.982 -5.865 785 HG1 THR 119 HG1 THR 119 -2.541 -8.427 -6.507 786 HG21 THR 119 3HG2 THR 119 -0.316 -11.107 -7.106 787 HG22 THR 119 1HG2 THR 119 -1.691 -11.544 -6.088 788 HG23 THR 119 2HG2 THR 119 -0.084 -11.374 -5.378 789 H TYR 120 H TYR 120 -1.946 -11.386 -3.087 790 HA TYR 120 HA TYR 120 0.253 -10.758 -1.280 791 HB2 TYR 120 2HB TYR 120 -2.116 -12.559 -1.183 792 HB3 TYR 120 3HB TYR 120 -0.687 -13.048 -0.287 793 HD1 TYR 120 HD2 TYR 120 0.285 -11.347 1.372 794 HD2 TYR 120 HD1 TYR 120 -3.646 -11.059 -0.216 795 HE1 TYR 120 HE2 TYR 120 -0.354 -9.918 3.256 796 HE2 TYR 120 HE1 TYR 120 -4.303 -9.619 1.678 797 HH TYR 120 HH TYR 120 -3.648 -9.028 3.866 798 H ALA 121 H ALA 121 1.759 -12.510 -0.718 799 HA ALA 121 HA ALA 121 3.016 -13.518 -3.034 800 HB1 ALA 121 3HB ALA 121 3.468 -14.294 -0.158 801 HB2 ALA 121 1HB ALA 121 4.232 -12.941 -0.994 802 HB3 ALA 121 2HB ALA 121 4.572 -14.593 -1.503 803 H GLY 122 H GLY 122 2.707 -15.315 -4.155 804 HA2 GLY 122 2HA GLY 122 2.319 -17.543 -4.611 805 HA3 GLY 122 3HA GLY 122 2.043 -17.811 -2.898 806 H GLU 123 H GLU 123 0.240 -15.305 -4.399 807 HA GLU 123 HA GLU 123 -2.037 -17.031 -4.906 808 HB2 GLU 123 2HB GLU 123 -2.117 -16.483 -2.488 809 HB3 GLU 123 3HB GLU 123 -2.114 -14.775 -2.888 810 HG2 GLU 123 2HG GLU 123 -4.279 -14.982 -3.938 811 HG3 GLU 123 3HG GLU 123 -4.268 -16.729 -3.674 812 H GLY 124 H GLY 124 -3.812 -15.813 -5.959 813 HA2 GLY 124 2HA GLY 124 -2.738 -13.932 -7.854 814 HA3 GLY 124 3HA GLY 124 -4.375 -14.569 -7.827 815 HA PRO 125 HA PRO 125 -4.259 -10.108 -6.335 816 HB2 PRO 125 2HB PRO 125 -5.830 -9.024 -8.238 817 HB3 PRO 125 3HB PRO 125 -4.090 -9.237 -8.458 818 HG2 PRO 125 2HG PRO 125 -6.343 -10.957 -9.435 819 HG3 PRO 125 3HG PRO 125 -4.903 -10.395 -10.313 820 HD2 PRO 125 2HD PRO 125 -5.079 -12.878 -9.245 821 HD3 PRO 125 3HD PRO 125 -3.543 -11.995 -9.364 822 H ILE 126 H ILE 126 -5.750 -9.316 -4.970 823 HA ILE 126 HA ILE 126 -8.526 -10.239 -5.175 824 HB ILE 126 HB ILE 126 -8.658 -10.472 -2.723 825 HG12 ILE 126 2HG1 ILE 126 -5.648 -10.133 -2.744 826 HG13 ILE 126 3HG1 ILE 126 -6.790 -8.917 -2.179 827 HG21 ILE 126 1HG2 ILE 126 -7.374 -12.563 -2.509 828 HG22 ILE 126 2HG2 ILE 126 -6.514 -12.168 -3.999 829 HG23 ILE 126 3HG2 ILE 126 -8.253 -12.463 -4.034 830 HD11 ILE 126 3HD1 ILE 126 -5.810 -10.118 -0.321 831 HD12 ILE 126 1HD1 ILE 126 -6.368 -11.652 -0.990 832 HD13 ILE 126 2HD1 ILE 126 -7.537 -10.456 -0.428 833 H GLY 127 H GLY 127 -9.984 -8.861 -3.777 834 HA2 GLY 127 2HA GLY 127 -9.533 -6.111 -4.440 835 HA3 GLY 127 3HA GLY 127 -10.908 -6.753 -3.556 836 H PHE 128 H PHE 128 -9.099 -4.389 -3.151 837 HA PHE 128 HA PHE 128 -8.343 -4.975 -0.364 838 HB2 PHE 128 2HB PHE 128 -6.312 -4.639 -1.622 839 HB3 PHE 128 3HB PHE 128 -6.950 -3.172 -2.353 840 HD1 PHE 128 HD2 PHE 128 -5.693 -4.650 0.794 841 HD2 PHE 128 HD1 PHE 128 -6.844 -1.085 -1.226 842 HE1 PHE 128 HE2 PHE 128 -4.718 -3.301 2.608 843 HE2 PHE 128 HE1 PHE 128 -5.874 0.262 0.576 844 HZ PHE 128 HZ PHE 128 -4.811 -0.832 2.494 845 H LYS 129 H LYS 129 -9.087 -3.647 1.182 846 HA LYS 129 HA LYS 129 -10.084 -1.005 0.479 847 HB2 LYS 129 2HB LYS 129 -12.057 -2.441 0.460 848 HB3 LYS 129 3HB LYS 129 -11.628 -3.093 2.027 849 HG2 LYS 129 2HG LYS 129 -12.020 -0.915 3.054 850 HG3 LYS 129 3HG LYS 129 -12.404 -0.233 1.469 851 HD2 LYS 129 2HD LYS 129 -14.274 -1.813 1.257 852 HD3 LYS 129 3HD LYS 129 -13.898 -2.461 2.852 853 HE2 LYS 129 2HE LYS 129 -14.607 0.406 2.313 854 HE3 LYS 129 3HE LYS 129 -15.781 -0.813 2.800 855 HZ1 LYS 129 3HZ LYS 129 -13.449 0.151 4.382 856 HZ2 LYS 129 1HZ LYS 129 -14.419 -1.164 4.832 857 HZ3 LYS 129 2HZ LYS 129 -15.083 0.393 4.724 858 H GLY 130 H GLY 130 -9.248 0.429 1.867 859 HA2 GLY 130 2HA GLY 130 -8.487 -0.527 4.538 860 HA3 GLY 130 3HA GLY 130 -7.454 0.536 3.587 861 H THR 131 H THR 131 -9.085 0.733 6.188 862 HA THR 131 HA THR 131 -10.418 3.261 5.510 863 HB THR 131 HB THR 131 -11.077 1.370 7.790 864 HG1 THR 131 HG1 THR 131 -12.080 0.293 6.251 865 HG21 THR 131 3HG2 THR 131 -13.119 2.742 7.989 866 HG22 THR 131 1HG2 THR 131 -12.528 3.797 6.706 867 HG23 THR 131 2HG2 THR 131 -11.666 3.710 8.244 868 H LEU 132 H LEU 132 -9.572 5.044 6.488 869 HA LEU 132 HA LEU 132 -7.266 4.780 8.166 870 HB2 LEU 132 2HB LEU 132 -7.428 6.543 6.495 871 HB3 LEU 132 3HB LEU 132 -8.854 7.189 7.279 872 HG LEU 132 HG LEU 132 -7.481 7.771 9.254 873 HD11 LEU 132 1HD1 LEU 132 -5.735 6.094 9.006 874 HD12 LEU 132 2HD1 LEU 132 -5.050 7.718 9.096 875 HD13 LEU 132 3HD1 LEU 132 -5.165 6.894 7.538 876 HD21 LEU 132 3HD2 LEU 132 -6.306 9.651 8.213 877 HD22 LEU 132 1HD2 LEU 132 -7.916 9.433 7.529 878 HD23 LEU 132 2HD2 LEU 132 -6.500 8.896 6.630 879 H THR 133 H THR 133 -7.058 5.213 10.349 880 HA THR 133 HA THR 133 -9.556 5.432 11.817 881 HB THR 133 HB THR 133 -8.123 3.528 12.468 882 HG1 THR 133 HG1 THR 133 -8.729 5.623 14.187 883 HG21 THR 133 3HG2 THR 133 -5.948 3.915 13.548 884 HG22 THR 133 1HG2 THR 133 -6.072 5.635 13.178 885 HG23 THR 133 2HG2 THR 133 -5.938 4.460 11.869 Start of MODEL 13 1 H1 ALA 2 1H ALA 2 0.689 5.679 10.400 2 H2 ALA 2 2H ALA 2 0.448 7.175 9.645 3 H3 ALA 2 3H ALA 2 0.070 5.742 8.831 4 HA ALA 2 HA ALA 2 -1.264 6.662 11.285 5 HB1 ALA 2 3HB ALA 2 -2.201 6.723 8.418 6 HB2 ALA 2 1HB ALA 2 -1.813 8.123 9.417 7 HB3 ALA 2 2HB ALA 2 -3.194 7.104 9.823 8 H LEU 3 H LEU 3 -3.163 5.377 11.758 9 HA LEU 3 HA LEU 3 -2.645 2.577 11.213 10 HB2 LEU 3 2HB LEU 3 -3.011 3.492 13.535 11 HB3 LEU 3 3HB LEU 3 -4.669 3.811 13.090 12 HG LEU 3 HG LEU 3 -4.236 1.732 14.476 13 HD11 LEU 3 1HD1 LEU 3 -6.347 2.033 13.364 14 HD12 LEU 3 2HD1 LEU 3 -5.847 0.348 13.230 15 HD13 LEU 3 3HD1 LEU 3 -5.673 1.428 11.849 16 HD21 LEU 3 3HD2 LEU 3 -3.470 -0.264 13.327 17 HD22 LEU 3 1HD2 LEU 3 -2.224 0.980 13.292 18 HD23 LEU 3 2HD2 LEU 3 -3.194 0.664 11.855 19 H TYR 4 H TYR 4 -3.804 1.366 9.894 20 HA TYR 4 HA TYR 4 -6.384 2.401 8.922 21 HB2 TYR 4 2HB TYR 4 -4.127 1.192 7.344 22 HB3 TYR 4 3HB TYR 4 -5.779 1.146 6.752 23 HD1 TYR 4 HD1 TYR 4 -3.067 3.467 7.795 24 HD2 TYR 4 HD2 TYR 4 -6.709 2.985 5.655 25 HE1 TYR 4 HE1 TYR 4 -2.792 5.704 6.817 26 HE2 TYR 4 HE2 TYR 4 -6.442 5.219 4.684 27 HH TYR 4 HH TYR 4 -5.327 7.204 4.945 28 H ASN 5 H ASN 5 -7.961 0.919 8.490 29 HA ASN 5 HA ASN 5 -7.514 -1.770 9.598 30 HB2 ASN 5 2HB ASN 5 -10.053 -0.168 9.177 31 HB3 ASN 5 3HB ASN 5 -10.083 -1.894 9.518 32 HD21 ASN 5 1HD2 ASN 5 -11.212 -1.531 11.445 33 HD22 ASN 5 2HD2 ASN 5 -10.434 -0.888 12.847 34 H VAL 6 H VAL 6 -7.860 -3.569 8.283 35 HA VAL 6 HA VAL 6 -8.144 -2.848 5.446 36 HB VAL 6 HB VAL 6 -6.377 -4.933 6.721 37 HG11 VAL 6 1HG1 VAL 6 -7.369 -5.891 4.709 38 HG12 VAL 6 2HG1 VAL 6 -5.658 -5.544 4.459 39 HG13 VAL 6 3HG1 VAL 6 -6.887 -4.470 3.785 40 HG21 VAL 6 3HG2 VAL 6 -5.788 -2.507 5.035 41 HG22 VAL 6 1HG2 VAL 6 -4.591 -3.659 5.628 42 HG23 VAL 6 2HG2 VAL 6 -5.507 -2.675 6.768 43 H GLU 7 H GLU 7 -9.667 -3.721 4.336 44 HA GLU 7 HA GLU 7 -10.923 -6.212 5.248 45 HB2 GLU 7 2HB GLU 7 -12.129 -3.847 3.790 46 HB3 GLU 7 3HB GLU 7 -12.951 -5.379 4.065 47 HG2 GLU 7 2HG GLU 7 -12.866 -5.052 6.440 48 HG3 GLU 7 3HG GLU 7 -11.935 -3.570 6.237 49 H ASN 8 H ASN 8 -11.178 -7.794 3.719 50 HA ASN 8 HA ASN 8 -10.073 -7.209 1.059 51 HB2 ASN 8 2HB ASN 8 -9.392 -9.510 2.876 52 HB3 ASN 8 3HB ASN 8 -9.082 -9.556 1.145 53 HD21 ASN 8 1HD2 ASN 8 -8.381 -6.743 0.978 54 HD22 ASN 8 2HD2 ASN 8 -6.816 -6.601 1.694 55 H GLN 9 H GLN 9 -10.871 -8.349 -0.639 56 HA GLN 9 HA GLN 9 -13.241 -10.044 -0.149 57 HB2 GLN 9 2HB GLN 9 -13.875 -7.835 -1.060 58 HB3 GLN 9 3HB GLN 9 -12.765 -8.076 -2.401 59 HG2 GLN 9 2HG GLN 9 -14.092 -10.009 -3.122 60 HG3 GLN 9 3HG GLN 9 -15.227 -9.686 -1.810 61 HE21 GLN 9 1HE2 GLN 9 -15.635 -9.700 -4.689 62 HE22 GLN 9 2HE2 GLN 9 -16.263 -8.140 -5.090 63 H TRP 10 H TRP 10 -12.804 -12.110 -0.829 64 HA TRP 10 HA TRP 10 -11.020 -12.370 -3.143 65 HB2 TRP 10 2HB TRP 10 -9.740 -14.136 -2.006 66 HB3 TRP 10 3HB TRP 10 -9.603 -12.584 -1.191 67 HD1 TRP 10 HD1 TRP 10 -11.640 -15.877 -0.811 68 HE1 TRP 10 HE1 TRP 10 -12.036 -16.295 1.691 69 HE3 TRP 10 HE3 TRP 10 -9.468 -11.642 1.075 70 HZ2 TRP 10 HZ2 TRP 10 -11.489 -15.016 4.142 71 HZ3 TRP 10 HZ3 TRP 10 -9.444 -11.331 3.521 72 HH2 TRP 10 HH2 TRP 10 -10.434 -12.977 5.013 73 H GLY 11 H GLY 11 -14.169 -13.185 -2.336 74 HA2 GLY 11 2HA GLY 11 -13.822 -16.002 -2.808 75 HA3 GLY 11 3HA GLY 11 -15.274 -15.168 -2.287 76 H GLY 12 H GLY 12 -13.345 -14.119 -5.033 77 HA2 GLY 12 2HA GLY 12 -13.702 -14.349 -7.311 78 HA3 GLY 12 3HA GLY 12 -14.908 -15.570 -6.954 79 H SER 13 H SER 13 -14.538 -12.065 -6.461 80 HA SER 13 HA SER 13 -15.877 -10.271 -6.880 81 HB2 SER 13 2HB SER 13 -15.565 -11.089 -9.194 82 HB3 SER 13 3HB SER 13 -17.037 -12.042 -9.041 83 HG SER 13 HG SER 13 -16.706 -9.286 -9.320 84 H SER 14 H SER 14 -17.967 -9.301 -6.582 85 HA SER 14 HA SER 14 -20.021 -9.034 -5.717 86 HB2 SER 14 2HB SER 14 -20.427 -11.915 -6.561 87 HB3 SER 14 3HB SER 14 -21.710 -10.807 -6.074 88 HG SER 14 HG SER 14 -20.292 -10.959 -8.439 89 H ALA 15 H ALA 15 -17.753 -10.398 -4.167 90 HA ALA 15 HA ALA 15 -19.290 -11.646 -2.026 91 HB1 ALA 15 3HB ALA 15 -16.302 -11.444 -2.445 92 HB2 ALA 15 1HB ALA 15 -17.308 -12.846 -2.804 93 HB3 ALA 15 2HB ALA 15 -17.094 -12.319 -1.135 94 HA PRO 16 HA PRO 16 -18.984 -8.040 0.538 95 HB2 PRO 16 2HB PRO 16 -18.992 -9.125 3.002 96 HB3 PRO 16 3HB PRO 16 -20.423 -9.173 1.964 97 HG2 PRO 16 2HG PRO 16 -18.356 -11.296 2.426 98 HG3 PRO 16 3HG PRO 16 -20.124 -11.442 2.436 99 HD2 PRO 16 2HD PRO 16 -18.637 -12.124 0.291 100 HD3 PRO 16 3HD PRO 16 -20.261 -11.428 0.128 101 H TRP 17 H TRP 17 -17.586 -6.953 2.054 102 HA TRP 17 HA TRP 17 -14.811 -7.705 1.693 103 HB2 TRP 17 2HB TRP 17 -16.063 -5.292 3.032 104 HB3 TRP 17 3HB TRP 17 -14.343 -5.520 2.757 105 HD1 TRP 17 HD1 TRP 17 -17.514 -4.452 1.032 106 HE1 TRP 17 HE1 TRP 17 -16.972 -3.615 -1.328 107 HE3 TRP 17 HE3 TRP 17 -12.634 -5.913 0.772 108 HZ2 TRP 17 HZ2 TRP 17 -14.747 -3.571 -3.085 109 HZ3 TRP 17 HZ3 TRP 17 -11.367 -5.436 -1.282 110 HH2 TRP 17 HH2 TRP 17 -12.405 -4.289 -3.171 111 H ASN 18 H ASN 18 -13.587 -8.644 3.185 112 HA ASN 18 HA ASN 18 -14.749 -9.062 5.866 113 HB2 ASN 18 2HB ASN 18 -12.739 -10.787 4.404 114 HB3 ASN 18 3HB ASN 18 -13.469 -11.135 5.963 115 HD21 ASN 18 1HD2 ASN 18 -13.944 -11.035 2.535 116 HD22 ASN 18 2HD2 ASN 18 -15.432 -11.904 2.506 117 H GLU 19 H GLU 19 -13.758 -7.931 7.415 118 HA GLU 19 HA GLU 19 -11.136 -6.819 7.045 119 HB2 GLU 19 2HB GLU 19 -11.411 -5.990 9.369 120 HB3 GLU 19 3HB GLU 19 -12.767 -5.569 8.336 121 HG2 GLU 19 2HG GLU 19 -14.049 -7.447 9.304 122 HG3 GLU 19 3HG GLU 19 -12.693 -7.775 10.383 123 H GLY 20 H GLY 20 -9.165 -7.686 7.635 124 HA2 GLY 20 2HA GLY 20 -9.267 -9.968 9.476 125 HA3 GLY 20 3HA GLY 20 -8.465 -10.121 7.920 126 H GLY 21 H GLY 21 -8.300 -7.109 9.687 127 HA2 GLY 21 2HA GLY 21 -6.356 -7.256 11.463 128 HA3 GLY 21 3HA GLY 21 -5.431 -7.559 10.001 129 H GLN 22 H GLN 22 -4.506 -5.561 11.255 130 HA GLN 22 HA GLN 22 -5.541 -3.176 9.890 131 HB2 GLN 22 2HB GLN 22 -4.825 -1.852 11.874 132 HB3 GLN 22 3HB GLN 22 -6.150 -2.953 12.220 133 HG2 GLN 22 2HG GLN 22 -4.485 -4.553 13.159 134 HG3 GLN 22 3HG GLN 22 -3.247 -3.318 12.940 135 HE21 GLN 22 1HE2 GLN 22 -5.168 -1.178 13.624 136 HE22 GLN 22 2HE2 GLN 22 -5.336 -1.249 15.344 137 H TRP 23 H TRP 23 -4.018 -1.858 8.964 138 HA TRP 23 HA TRP 23 -1.229 -2.841 9.046 139 HB2 TRP 23 2HB TRP 23 -2.780 -1.619 6.759 140 HB3 TRP 23 3HB TRP 23 -1.039 -1.859 6.735 141 HD1 TRP 23 HD1 TRP 23 -2.471 -4.793 8.401 142 HE1 TRP 23 HE1 TRP 23 -2.736 -6.740 6.756 143 HE3 TRP 23 HE3 TRP 23 -1.809 -2.254 4.016 144 HZ2 TRP 23 HZ2 TRP 23 -2.669 -7.157 3.975 145 HZ3 TRP 23 HZ3 TRP 23 -1.921 -3.520 1.899 146 HH2 TRP 23 HH2 TRP 23 -2.341 -5.906 1.893 147 H GLU 24 H GLU 24 0.352 -1.095 8.239 148 HA GLU 24 HA GLU 24 -0.459 1.489 9.406 149 HB2 GLU 24 2HB GLU 24 1.208 0.375 10.857 150 HB3 GLU 24 3HB GLU 24 2.326 0.292 9.501 151 HG2 GLU 24 2HG GLU 24 2.414 2.725 9.400 152 HG3 GLU 24 3HG GLU 24 1.245 2.835 10.710 153 H ILE 25 H ILE 25 -0.727 2.876 7.877 154 HA ILE 25 HA ILE 25 1.194 3.018 5.654 155 HB ILE 25 HB ILE 25 -1.831 3.200 5.420 156 HG12 ILE 25 2HG1 ILE 25 0.067 1.219 4.141 157 HG13 ILE 25 3HG1 ILE 25 -0.860 0.889 5.597 158 HG21 ILE 25 1HG2 ILE 25 -0.738 4.824 3.950 159 HG22 ILE 25 2HG2 ILE 25 -1.469 3.524 3.013 160 HG23 ILE 25 3HG2 ILE 25 0.273 3.546 3.275 161 HD11 ILE 25 3HD1 ILE 25 -2.936 1.186 4.336 162 HD12 ILE 25 1HD1 ILE 25 -1.921 -0.074 3.637 163 HD13 ILE 25 2HD1 ILE 25 -1.998 1.517 2.879 164 H GLY 26 H GLY 26 1.672 5.128 4.994 165 HA2 GLY 26 2HA GLY 26 1.443 7.455 4.878 166 HA3 GLY 26 3HA GLY 26 0.042 7.341 5.933 167 H SER 27 H SER 27 3.524 6.963 5.934 168 HA SER 27 HA SER 27 3.910 7.095 8.710 169 HB2 SER 27 2HB SER 27 5.846 7.942 6.557 170 HB3 SER 27 3HB SER 27 6.242 7.435 8.200 171 HG SER 27 HG SER 27 5.589 5.384 7.732 172 H ARG 28 H ARG 28 4.112 9.640 6.222 173 HA ARG 28 HA ARG 28 4.418 11.668 8.258 174 HB2 ARG 28 2HB ARG 28 4.212 11.891 5.253 175 HB3 ARG 28 3HB ARG 28 4.468 13.255 6.332 176 HG2 ARG 28 2HG ARG 28 6.559 12.174 7.118 177 HG3 ARG 28 3HG ARG 28 6.310 10.918 5.905 178 HD2 ARG 28 2HD ARG 28 6.571 13.862 5.293 179 HD3 ARG 28 3HD ARG 28 7.886 12.696 5.198 180 HE ARG 28 HE ARG 28 5.559 12.858 3.415 181 HH11 ARG 28 1HH1 ARG 28 8.654 11.421 4.220 182 HH12 ARG 28 2HH1 ARG 28 8.918 10.760 2.650 183 HH21 ARG 28 1HH2 ARG 28 5.896 11.996 1.307 184 HH22 ARG 28 2HH2 ARG 28 7.324 11.087 0.975 185 H SER 29 H SER 29 2.892 12.989 9.021 186 HA SER 29 HA SER 29 0.153 12.441 8.290 187 HB2 SER 29 2HB SER 29 -0.298 14.020 10.236 188 HB3 SER 29 3HB SER 29 0.582 12.545 10.633 189 HG SER 29 HG SER 29 1.344 14.894 11.263 190 H ASP 30 H ASP 30 2.551 14.699 7.457 191 HA ASP 30 HA ASP 30 0.914 16.997 6.980 192 HB2 ASP 30 2HB ASP 30 3.586 16.285 5.734 193 HB3 ASP 30 3HB ASP 30 2.845 17.884 5.785 194 H GLN 31 H GLN 31 2.136 14.371 5.076 195 HA GLN 31 HA GLN 31 0.186 14.974 2.976 196 HB2 GLN 31 2HB GLN 31 3.119 14.417 2.603 197 HB3 GLN 31 3HB GLN 31 1.961 14.125 1.318 198 HG2 GLN 31 2HG GLN 31 2.331 16.782 2.682 199 HG3 GLN 31 3HG GLN 31 3.133 16.316 1.185 200 HE21 GLN 31 1HE2 GLN 31 0.917 14.864 0.102 201 HE22 GLN 31 2HE2 GLN 31 -0.289 16.019 -0.362 202 H ASN 32 H ASN 32 -1.063 13.318 2.572 203 HA ASN 32 HA ASN 32 -0.156 10.694 3.496 204 HB2 ASN 32 2HB ASN 32 -2.168 11.744 4.652 205 HB3 ASN 32 3HB ASN 32 -3.044 11.524 3.142 206 HD21 ASN 32 1HD2 ASN 32 -4.468 10.178 4.351 207 HD22 ASN 32 2HD2 ASN 32 -4.035 8.530 4.679 208 H VAL 33 H VAL 33 -1.546 8.893 2.266 209 HA VAL 33 HA VAL 33 -0.691 9.279 -0.514 210 HB VAL 33 HB VAL 33 -1.216 6.675 0.896 211 HG11 VAL 33 1HG1 VAL 33 0.384 7.343 -1.559 212 HG12 VAL 33 2HG1 VAL 33 -1.198 6.564 -1.519 213 HG13 VAL 33 3HG1 VAL 33 0.209 5.746 -0.839 214 HG21 VAL 33 3HG2 VAL 33 1.182 6.517 1.306 215 HG22 VAL 33 1HG2 VAL 33 0.483 7.902 2.139 216 HG23 VAL 33 2HG2 VAL 33 1.409 8.142 0.658 217 H VAL 34 H VAL 34 -2.104 9.090 -2.177 218 HA VAL 34 HA VAL 34 -4.816 8.137 -1.536 219 HB VAL 34 HB VAL 34 -5.676 9.491 -3.382 220 HG11 VAL 34 1HG1 VAL 34 -4.013 11.072 -1.427 221 HG12 VAL 34 2HG1 VAL 34 -5.645 10.458 -1.155 222 HG13 VAL 34 3HG1 VAL 34 -5.364 11.702 -2.371 223 HG21 VAL 34 3HG2 VAL 34 -2.837 10.491 -3.657 224 HG22 VAL 34 1HG2 VAL 34 -4.241 11.167 -4.482 225 HG23 VAL 34 2HG2 VAL 34 -3.726 9.517 -4.830 226 H ALA 35 H ALA 35 -2.022 7.503 -3.400 227 HA ALA 35 HA ALA 35 -3.442 5.273 -4.614 228 HB1 ALA 35 3HB ALA 35 -1.736 7.009 -6.379 229 HB2 ALA 35 1HB ALA 35 -3.491 7.186 -6.257 230 HB3 ALA 35 2HB ALA 35 -2.791 5.681 -6.843 231 H ILE 36 H ILE 36 -2.183 3.503 -5.081 232 HA ILE 36 HA ILE 36 0.669 3.672 -4.562 233 HB ILE 36 HB ILE 36 -1.112 1.751 -3.016 234 HG12 ILE 36 2HG1 ILE 36 0.702 3.917 -1.940 235 HG13 ILE 36 3HG1 ILE 36 -1.039 4.103 -2.133 236 HG21 ILE 36 1HG2 ILE 36 0.952 0.948 -1.986 237 HG22 ILE 36 2HG2 ILE 36 1.893 2.045 -2.998 238 HG23 ILE 36 3HG2 ILE 36 0.986 0.721 -3.733 239 HD11 ILE 36 3HD1 ILE 36 -1.417 2.303 -0.550 240 HD12 ILE 36 1HD1 ILE 36 -0.424 3.570 0.168 241 HD13 ILE 36 2HD1 ILE 36 0.323 2.072 -0.378 242 H ASN 37 H ASN 37 1.569 2.652 -6.211 243 HA ASN 37 HA ASN 37 0.374 0.146 -7.156 244 HB2 ASN 37 2HB ASN 37 1.213 2.533 -8.782 245 HB3 ASN 37 3HB ASN 37 1.367 0.923 -9.467 246 HD21 ASN 37 1HD2 ASN 37 -0.867 3.350 -8.335 247 HD22 ASN 37 2HD2 ASN 37 -2.287 2.639 -9.022 248 H VAL 38 H VAL 38 1.812 -1.440 -6.770 249 HA VAL 38 HA VAL 38 4.643 -0.917 -7.087 250 HB VAL 38 HB VAL 38 5.300 -1.587 -4.818 251 HG11 VAL 38 1HG1 VAL 38 3.430 0.771 -4.872 252 HG12 VAL 38 2HG1 VAL 38 5.164 0.774 -5.199 253 HG13 VAL 38 3HG1 VAL 38 4.573 0.427 -3.576 254 HG21 VAL 38 3HG2 VAL 38 3.369 -2.949 -4.237 255 HG22 VAL 38 1HG2 VAL 38 2.363 -1.507 -4.179 256 HG23 VAL 38 2HG2 VAL 38 3.658 -1.723 -3.003 257 H GLU 39 H GLU 39 5.919 -2.804 -7.132 258 HA GLU 39 HA GLU 39 4.569 -5.353 -6.739 259 HB2 GLU 39 2HB GLU 39 4.343 -4.782 -9.141 260 HB3 GLU 39 3HB GLU 39 6.087 -4.622 -9.253 261 HG2 GLU 39 2HG GLU 39 6.360 -6.980 -8.740 262 HG3 GLU 39 3HG GLU 39 4.616 -7.160 -8.559 263 H SER 40 H SER 40 5.998 -7.037 -6.237 264 HA SER 40 HA SER 40 8.337 -6.221 -4.859 265 HB2 SER 40 2HB SER 40 8.613 -8.718 -4.536 266 HB3 SER 40 3HB SER 40 7.084 -8.042 -3.970 267 HG SER 40 HG SER 40 7.350 -9.110 -6.572 268 H GLY 41 H GLY 41 10.467 -6.569 -5.296 269 HA2 GLY 41 2HA GLY 41 11.148 -6.986 -8.101 270 HA3 GLY 41 3HA GLY 41 12.245 -6.467 -6.821 271 H ASP 42 H ASP 42 12.337 -8.209 -5.004 272 HA ASP 42 HA ASP 42 13.138 -10.712 -6.281 273 HB2 ASP 42 2HB ASP 42 13.530 -9.753 -3.424 274 HB3 ASP 42 3HB ASP 42 14.210 -11.222 -4.113 275 H ASP 43 H ASP 43 12.781 -12.062 -3.596 276 HA ASP 43 HA ASP 43 10.143 -13.095 -4.118 277 HB2 ASP 43 2HB ASP 43 10.674 -14.719 -2.339 278 HB3 ASP 43 3HB ASP 43 11.971 -14.617 -3.521 279 H GLY 44 H GLY 44 9.996 -10.421 -3.355 280 HA2 GLY 44 2HA GLY 44 8.211 -9.434 -2.158 281 HA3 GLY 44 3HA GLY 44 8.305 -10.736 -0.986 282 H GLN 45 H GLN 45 11.342 -10.267 -0.923 283 HA GLN 45 HA GLN 45 11.282 -8.633 1.373 284 HB2 GLN 45 2HB GLN 45 13.624 -9.558 -0.272 285 HB3 GLN 45 3HB GLN 45 13.782 -8.661 1.229 286 HG2 GLN 45 2HG GLN 45 12.536 -10.470 2.376 287 HG3 GLN 45 3HG GLN 45 12.563 -11.386 0.867 288 HE21 GLN 45 1HE2 GLN 45 14.370 -10.253 3.563 289 HE22 GLN 45 2HE2 GLN 45 15.810 -11.150 3.257 290 H THR 46 H THR 46 11.793 -7.876 -1.957 291 HA THR 46 HA THR 46 12.300 -5.090 -1.200 292 HB THR 46 HB THR 46 13.291 -4.872 -3.518 293 HG1 THR 46 HG1 THR 46 14.103 -7.326 -3.939 294 HG21 THR 46 3HG2 THR 46 15.455 -5.872 -2.885 295 HG22 THR 46 1HG2 THR 46 14.653 -6.766 -1.596 296 HG23 THR 46 2HG2 THR 46 14.721 -5.002 -1.540 297 H LEU 47 H LEU 47 10.998 -3.534 -2.081 298 HA LEU 47 HA LEU 47 8.914 -4.424 -3.945 299 HB2 LEU 47 2HB LEU 47 8.493 -2.591 -1.581 300 HB3 LEU 47 3HB LEU 47 7.294 -2.985 -2.792 301 HG LEU 47 HG LEU 47 8.473 -4.914 -0.794 302 HD11 LEU 47 1HD1 LEU 47 5.744 -3.646 -0.976 303 HD12 LEU 47 2HD1 LEU 47 6.978 -3.308 0.239 304 HD13 LEU 47 3HD1 LEU 47 6.221 -4.900 0.168 305 HD21 LEU 47 3HD2 LEU 47 6.306 -5.302 -2.859 306 HD22 LEU 47 1HD2 LEU 47 6.764 -6.468 -1.617 307 HD23 LEU 47 2HD2 LEU 47 7.911 -6.031 -2.880 308 H ASN 48 H ASN 48 8.769 -3.130 -5.682 309 HA ASN 48 HA ASN 48 9.788 -0.384 -5.430 310 HB2 ASN 48 2HB ASN 48 10.311 -2.266 -7.750 311 HB3 ASN 48 3HB ASN 48 10.679 -0.551 -7.758 312 HD21 ASN 48 1HD2 ASN 48 11.691 -3.664 -6.801 313 HD22 ASN 48 2HD2 ASN 48 13.187 -3.201 -6.062 314 H GLY 49 H GLY 49 8.612 1.163 -6.473 315 HA2 GLY 49 2HA GLY 49 6.797 0.660 -8.556 316 HA3 GLY 49 3HA GLY 49 5.926 0.573 -7.036 317 H THR 50 H THR 50 4.705 2.336 -7.755 318 HA THR 50 HA THR 50 6.067 4.905 -7.356 319 HB THR 50 HB THR 50 3.909 4.330 -9.403 320 HG1 THR 50 HG1 THR 50 6.661 4.278 -9.471 321 HG21 THR 50 3HG2 THR 50 4.331 6.627 -10.154 322 HG22 THR 50 1HG2 THR 50 5.479 6.851 -8.835 323 HG23 THR 50 2HG2 THR 50 3.773 6.600 -8.480 324 H MET 51 H MET 51 5.075 6.235 -5.905 325 HA MET 51 HA MET 51 2.360 5.528 -5.011 326 HB2 MET 51 2HB MET 51 4.772 6.522 -3.554 327 HB3 MET 51 3HB MET 51 3.179 6.960 -2.970 328 HG2 MET 51 2HG MET 51 2.617 4.634 -2.670 329 HG3 MET 51 3HG MET 51 4.174 4.130 -3.312 330 HE1 MET 51 3HE MET 51 3.723 6.576 0.542 331 HE2 MET 51 1HE MET 51 2.428 6.272 -0.610 332 HE3 MET 51 2HE MET 51 3.766 7.334 -1.047 333 H THR 52 H THR 52 0.891 7.201 -4.670 334 HA THR 52 HA THR 52 1.761 9.866 -5.554 335 HB THR 52 HB THR 52 -0.952 8.645 -6.103 336 HG1 THR 52 HG1 THR 52 0.889 9.293 -8.127 337 HG21 THR 52 3HG2 THR 52 -0.967 11.094 -5.882 338 HG22 THR 52 1HG2 THR 52 -1.271 10.599 -7.545 339 HG23 THR 52 2HG2 THR 52 0.316 11.208 -7.086 340 H TYR 53 H TYR 53 1.415 11.401 -4.108 341 HA TYR 53 HA TYR 53 -0.169 10.804 -1.737 342 HB2 TYR 53 2HB TYR 53 1.905 12.897 -2.347 343 HB3 TYR 53 3HB TYR 53 0.900 12.975 -0.912 344 HD1 TYR 53 HD1 TYR 53 3.374 10.821 -2.675 345 HD2 TYR 53 HD2 TYR 53 1.494 11.801 1.010 346 HE1 TYR 53 HE1 TYR 53 4.972 9.388 -1.473 347 HE2 TYR 53 HE2 TYR 53 3.086 10.375 2.211 348 HH TYR 53 HH TYR 53 4.547 8.451 1.748 349 H ALA 54 H ALA 54 -1.425 12.608 -0.793 350 HA ALA 54 HA ALA 54 -3.414 13.457 -2.601 351 HB1 ALA 54 3HB ALA 54 -3.853 13.000 -0.230 352 HB2 ALA 54 1HB ALA 54 -4.399 14.610 -0.700 353 HB3 ALA 54 2HB ALA 54 -2.903 14.418 0.212 354 H GLY 55 H GLY 55 -2.589 14.708 -4.187 355 HA2 GLY 55 2HA GLY 55 -2.679 16.986 -4.968 356 HA3 GLY 55 3HA GLY 55 -2.077 17.504 -3.399 357 H GLU 56 H GLU 56 -0.368 14.833 -4.342 358 HA GLU 56 HA GLU 56 1.737 16.518 -5.515 359 HB2 GLU 56 2HB GLU 56 2.054 13.986 -3.900 360 HB3 GLU 56 3HB GLU 56 3.364 14.918 -4.607 361 HG2 GLU 56 2HG GLU 56 2.729 16.829 -3.185 362 HG3 GLU 56 3HG GLU 56 1.497 15.821 -2.427 363 H GLY 57 H GLY 57 3.277 15.209 -6.904 364 HA2 GLY 57 2HA GLY 57 1.660 13.671 -8.766 365 HA3 GLY 57 3HA GLY 57 3.292 14.273 -9.041 366 HA PRO 58 HA PRO 58 3.211 9.659 -7.848 367 HB2 PRO 58 2HB PRO 58 4.276 9.356 -10.595 368 HB3 PRO 58 3HB PRO 58 3.043 8.406 -9.759 369 HG2 PRO 58 2HG PRO 58 2.383 10.097 -11.715 370 HG3 PRO 58 3HG PRO 58 1.347 9.894 -10.287 371 HD2 PRO 58 2HD PRO 58 3.283 12.086 -10.929 372 HD3 PRO 58 3HD PRO 58 1.658 12.189 -10.221 373 H ILE 59 H ILE 59 5.020 8.956 -6.881 374 HA ILE 59 HA ILE 59 7.618 9.843 -7.923 375 HB ILE 59 HB ILE 59 8.470 10.106 -5.623 376 HG12 ILE 59 2HG1 ILE 59 5.577 9.902 -4.767 377 HG13 ILE 59 3HG1 ILE 59 6.783 8.641 -4.521 378 HG21 ILE 59 1HG2 ILE 59 7.369 12.255 -5.131 379 HG22 ILE 59 2HG2 ILE 59 6.115 11.861 -6.309 380 HG23 ILE 59 3HG2 ILE 59 7.785 12.077 -6.835 381 HD11 ILE 59 3HD1 ILE 59 8.074 10.155 -3.125 382 HD12 ILE 59 1HD1 ILE 59 6.439 9.944 -2.507 383 HD13 ILE 59 2HD1 ILE 59 6.869 11.420 -3.375 384 H GLY 60 H GLY 60 9.447 8.553 -6.874 385 HA2 GLY 60 2HA GLY 60 8.906 5.801 -7.507 386 HA3 GLY 60 3HA GLY 60 10.457 6.478 -7.034 387 H PHE 61 H PHE 61 8.904 4.051 -6.187 388 HA PHE 61 HA PHE 61 8.993 4.552 -3.290 389 HB2 PHE 61 2HB PHE 61 6.687 4.289 -3.821 390 HB3 PHE 61 3HB PHE 61 7.012 2.947 -4.905 391 HD1 PHE 61 HD1 PHE 61 6.632 3.967 -1.416 392 HD2 PHE 61 HD2 PHE 61 7.369 0.709 -4.044 393 HE1 PHE 61 HE1 PHE 61 6.169 2.389 0.410 394 HE2 PHE 61 HE2 PHE 61 6.908 -0.876 -2.218 395 HZ PHE 61 HZ PHE 61 6.303 -0.033 0.010 396 H ARG 62 H ARG 62 10.415 3.302 -2.241 397 HA ARG 62 HA ARG 62 10.867 0.585 -3.224 398 HB2 ARG 62 2HB ARG 62 12.790 1.949 -3.936 399 HB3 ARG 62 3HB ARG 62 13.038 2.462 -2.272 400 HG2 ARG 62 2HG ARG 62 13.470 0.131 -1.631 401 HG3 ARG 62 3HG ARG 62 13.254 -0.354 -3.309 402 HD2 ARG 62 2HD ARG 62 15.613 -0.165 -2.765 403 HD3 ARG 62 3HD ARG 62 15.149 1.045 -3.958 404 HE ARG 62 HE ARG 62 15.730 2.670 -2.483 405 HH11 ARG 62 1HH1 ARG 62 15.203 -0.265 -0.603 406 HH12 ARG 62 2HH1 ARG 62 15.878 0.393 0.842 407 HH21 ARG 62 1HH2 ARG 62 16.672 3.509 -0.575 408 HH22 ARG 62 2HH2 ARG 62 16.687 2.554 0.866 409 H ALA 63 H ALA 63 10.759 -0.915 -1.638 410 HA ALA 63 HA ALA 63 11.063 -0.004 1.128 411 HB1 ALA 63 3HB ALA 63 8.635 -0.064 0.414 412 HB2 ALA 63 1HB ALA 63 9.057 -0.966 1.871 413 HB3 ALA 63 2HB ALA 63 8.805 -1.820 0.348 414 H THR 64 H THR 64 11.806 -1.510 2.595 415 HA THR 64 HA THR 64 12.613 -4.116 1.484 416 HB THR 64 HB THR 64 14.093 -2.442 3.542 417 HG1 THR 64 HG1 THR 64 15.140 -3.077 1.007 418 HG21 THR 64 3HG2 THR 64 14.418 -4.861 3.855 419 HG22 THR 64 1HG2 THR 64 15.894 -4.098 3.254 420 HG23 THR 64 2HG2 THR 64 14.868 -5.023 2.158 421 H LEU 65 H LEU 65 11.950 -5.874 2.569 422 HA LEU 65 HA LEU 65 9.937 -6.014 4.335 423 HB2 LEU 65 2HB LEU 65 10.750 -7.927 3.141 424 HB3 LEU 65 3HB LEU 65 12.222 -7.949 4.090 425 HG LEU 65 HG LEU 65 10.833 -8.459 6.106 426 HD11 LEU 65 1HD1 LEU 65 8.706 -7.590 5.351 427 HD12 LEU 65 2HD1 LEU 65 8.562 -9.309 5.727 428 HD13 LEU 65 3HD1 LEU 65 8.656 -8.776 4.049 429 HD21 LEU 65 3HD2 LEU 65 12.027 -10.203 4.871 430 HD22 LEU 65 1HD2 LEU 65 10.630 -10.413 3.815 431 HD23 LEU 65 2HD2 LEU 65 10.504 -10.804 5.528 432 H LEU 66 H LEU 66 13.305 -6.220 5.565 433 HA LEU 66 HA LEU 66 14.124 -5.507 7.571 434 HB2 LEU 66 2HB LEU 66 12.533 -3.603 7.320 435 HB3 LEU 66 3HB LEU 66 11.291 -4.551 8.096 436 HG LEU 66 HG LEU 66 12.238 -2.793 9.475 437 HD11 LEU 66 1HD1 LEU 66 11.207 -4.639 10.602 438 HD12 LEU 66 2HD1 LEU 66 12.621 -4.124 11.522 439 HD13 LEU 66 3HD1 LEU 66 12.701 -5.576 10.525 440 HD21 LEU 66 3HD2 LEU 66 14.483 -3.063 10.467 441 HD22 LEU 66 1HD2 LEU 66 14.516 -2.757 8.731 442 HD23 LEU 66 2HD2 LEU 66 14.784 -4.387 9.347 443 H GLY 67 H GLY 67 10.825 -6.840 8.050 444 HA2 GLY 67 2HA GLY 67 12.004 -8.979 9.680 445 HA3 GLY 67 3HA GLY 67 10.739 -7.996 10.410 446 H ASN 68 H ASN 68 8.523 -8.208 9.573 447 HA ASN 68 HA ASN 68 7.968 -9.998 7.491 448 HB2 ASN 68 2HB ASN 68 6.717 -11.674 8.816 449 HB3 ASN 68 3HB ASN 68 8.426 -11.711 9.212 450 HD21 ASN 68 1HD2 ASN 68 9.085 -11.103 11.256 451 HD22 ASN 68 2HD2 ASN 68 7.989 -10.892 12.571 452 H ASN 69 H ASN 69 5.979 -9.501 6.697 453 HA ASN 69 HA ASN 69 4.182 -8.176 6.296 454 HB2 ASN 69 2HB ASN 69 3.828 -8.671 9.252 455 HB3 ASN 69 3HB ASN 69 2.647 -7.774 8.303 456 HD21 ASN 69 1HD2 ASN 69 2.330 -10.303 9.704 457 HD22 ASN 69 2HD2 ASN 69 1.847 -11.445 8.498 458 H SER 70 H SER 70 6.761 -6.912 7.056 459 HA SER 70 HA SER 70 5.712 -4.226 7.502 460 HB2 SER 70 2HB SER 70 8.166 -5.389 8.844 461 HB3 SER 70 3HB SER 70 7.590 -3.728 8.984 462 HG SER 70 HG SER 70 5.635 -5.503 9.578 463 H TYR 71 H TYR 71 6.978 -2.645 6.472 464 HA TYR 71 HA TYR 71 9.339 -3.478 5.001 465 HB2 TYR 71 2HB TYR 71 6.887 -2.335 3.635 466 HB3 TYR 71 3HB TYR 71 8.474 -2.430 2.898 467 HD1 TYR 71 HD2 TYR 71 9.462 -4.642 2.388 468 HD2 TYR 71 HD1 TYR 71 5.446 -4.226 3.715 469 HE1 TYR 71 HE2 TYR 71 8.965 -6.896 1.553 470 HE2 TYR 71 HE1 TYR 71 4.931 -6.486 2.878 471 HH TYR 71 HH TYR 71 5.946 -8.012 1.024 472 H GLU 72 H GLU 72 10.821 -1.913 5.231 473 HA GLU 72 HA GLU 72 9.915 0.676 6.137 474 HB2 GLU 72 2HB GLU 72 11.961 -0.283 7.126 475 HB3 GLU 72 3HB GLU 72 12.739 -0.245 5.547 476 HG2 GLU 72 2HG GLU 72 12.689 2.138 5.497 477 HG3 GLU 72 3HG GLU 72 11.681 2.202 6.934 478 H VAL 73 H VAL 73 9.682 2.400 4.962 479 HA VAL 73 HA VAL 73 9.917 2.027 2.071 480 HB VAL 73 HB VAL 73 8.074 3.758 3.714 481 HG11 VAL 73 1HG1 VAL 73 8.256 3.535 0.714 482 HG12 VAL 73 2HG1 VAL 73 8.677 4.948 1.678 483 HG13 VAL 73 3HG1 VAL 73 7.003 4.399 1.606 484 HG21 VAL 73 3HG2 VAL 73 6.316 2.333 2.805 485 HG22 VAL 73 1HG2 VAL 73 7.510 1.378 3.685 486 HG23 VAL 73 2HG2 VAL 73 7.524 1.397 1.922 487 H GLU 74 H GLU 74 11.083 3.272 0.881 488 HA GLU 74 HA GLU 74 11.937 5.904 1.809 489 HB2 GLU 74 2HB GLU 74 13.658 3.824 0.432 490 HB3 GLU 74 3HB GLU 74 14.104 5.518 0.574 491 HG2 GLU 74 2HG GLU 74 14.035 5.282 3.042 492 HG3 GLU 74 3HG GLU 74 13.711 3.565 2.829 493 H ASN 75 H ASN 75 11.465 7.429 0.336 494 HA ASN 75 HA ASN 75 10.503 6.447 -2.261 495 HB2 ASN 75 2HB ASN 75 9.512 8.760 -0.603 496 HB3 ASN 75 3HB ASN 75 9.115 8.578 -2.310 497 HD21 ASN 75 1HD2 ASN 75 7.278 8.560 -0.106 498 HD22 ASN 75 2HD2 ASN 75 6.512 7.015 -0.114 499 H GLN 76 H GLN 76 10.701 7.801 -4.070 500 HA GLN 76 HA GLN 76 13.208 9.370 -3.997 501 HB2 GLN 76 2HB GLN 76 13.414 7.140 -5.096 502 HB3 GLN 76 3HB GLN 76 12.198 7.639 -6.256 503 HG2 GLN 76 2HG GLN 76 13.678 9.426 -7.023 504 HG3 GLN 76 3HG GLN 76 14.902 8.893 -5.868 505 HE21 GLN 76 1HE2 GLN 76 16.417 8.348 -7.361 506 HE22 GLN 76 2HE2 GLN 76 16.244 7.019 -8.458 507 H TRP 77 H TRP 77 12.995 11.420 -4.629 508 HA TRP 77 HA TRP 77 11.047 12.111 -6.670 509 HB2 TRP 77 2HB TRP 77 10.271 14.095 -5.343 510 HB3 TRP 77 3HB TRP 77 9.773 12.552 -4.668 511 HD1 TRP 77 HD1 TRP 77 12.605 15.165 -4.069 512 HE1 TRP 77 HE1 TRP 77 13.066 15.268 -1.539 513 HE3 TRP 77 HE3 TRP 77 9.374 11.523 -2.506 514 HZ2 TRP 77 HZ2 TRP 77 12.166 13.977 0.815 515 HZ3 TRP 77 HZ3 TRP 77 9.232 11.020 -0.103 516 HH2 TRP 77 HH2 TRP 77 10.601 12.224 1.522 517 H GLY 78 H GLY 78 11.432 14.259 -7.587 518 HA2 GLY 78 2HA GLY 78 12.823 16.147 -7.939 519 HA3 GLY 78 3HA GLY 78 14.095 15.347 -7.028 520 H GLY 79 H GLY 79 13.229 12.889 -8.805 521 HA2 GLY 79 2HA GLY 79 13.515 12.829 -11.346 522 HA3 GLY 79 3HA GLY 79 15.044 13.619 -11.000 523 H ASP 80 H ASP 80 15.139 11.326 -12.368 524 HA ASP 80 HA ASP 80 15.345 8.999 -10.738 525 HB2 ASP 80 2HB ASP 80 16.415 7.930 -12.678 526 HB3 ASP 80 3HB ASP 80 14.948 8.783 -13.140 527 H SER 81 H SER 81 17.558 11.525 -11.635 528 HA SER 81 HA SER 81 19.930 10.180 -10.815 529 HB2 SER 81 2HB SER 81 19.923 12.106 -12.395 530 HB3 SER 81 3HB SER 81 19.446 13.159 -11.065 531 HG SER 81 HG SER 81 21.524 11.942 -10.149 532 H ALA 82 H ALA 82 17.373 11.582 -9.090 533 HA ALA 82 HA ALA 82 18.912 12.439 -6.814 534 HB1 ALA 82 3HB ALA 82 16.745 12.905 -5.793 535 HB2 ALA 82 1HB ALA 82 15.931 12.087 -7.125 536 HB3 ALA 82 2HB ALA 82 16.827 13.574 -7.425 537 HA PRO 83 HA PRO 83 19.051 8.522 -4.745 538 HB2 PRO 83 2HB PRO 83 19.448 9.381 -2.214 539 HB3 PRO 83 3HB PRO 83 20.706 9.498 -3.452 540 HG2 PRO 83 2HG PRO 83 18.805 11.600 -2.482 541 HG3 PRO 83 3HG PRO 83 20.550 11.728 -2.765 542 HD2 PRO 83 2HD PRO 83 18.738 12.611 -4.564 543 HD3 PRO 83 3HD PRO 83 20.291 11.908 -5.056 544 H TRP 84 H TRP 84 18.129 7.616 -2.515 545 HA TRP 84 HA TRP 84 15.254 8.077 -2.664 546 HB2 TRP 84 2HB TRP 84 16.854 5.864 -1.342 547 HB3 TRP 84 3HB TRP 84 15.099 5.976 -1.361 548 HD1 TRP 84 HD1 TRP 84 18.064 5.188 -3.633 549 HE1 TRP 84 HE1 TRP 84 17.194 3.979 -5.732 550 HE3 TRP 84 HE3 TRP 84 13.049 5.702 -2.837 551 HZ2 TRP 84 HZ2 TRP 84 14.711 3.333 -6.894 552 HZ3 TRP 84 HZ3 TRP 84 11.490 4.759 -4.491 553 HH2 TRP 84 HH2 TRP 84 12.305 3.599 -6.475 554 H HIS 85 H HIS 85 14.064 8.689 -0.847 555 HA HIS 85 HA HIS 85 15.697 9.623 1.416 556 HB2 HIS 85 2HB HIS 85 13.157 10.841 0.299 557 HB3 HIS 85 3HB HIS 85 14.033 11.425 1.709 558 HD1 HIS 85 HD1 HIS 85 16.536 12.340 1.176 559 HD2 HIS 85 HD2 HIS 85 14.012 11.854 -2.089 560 HE1 HIS 85 HE1 HIS 85 17.577 13.670 -0.676 561 H SER 86 H SER 86 14.907 9.267 3.489 562 HA SER 86 HA SER 86 13.428 6.885 3.803 563 HB2 SER 86 2HB SER 86 15.225 7.694 5.341 564 HB3 SER 86 3HB SER 86 14.117 8.942 5.907 565 HG SER 86 HG SER 86 14.323 6.801 7.074 566 H GLY 87 H GLY 87 11.296 6.514 4.137 567 HA2 GLY 87 2HA GLY 87 9.572 8.876 4.432 568 HA3 GLY 87 3HA GLY 87 9.102 7.365 3.663 569 H GLY 88 H GLY 88 9.900 5.467 5.463 570 HA2 GLY 88 2HA GLY 88 9.551 5.722 8.138 571 HA3 GLY 88 3HA GLY 88 7.901 5.844 7.543 572 H ASN 89 H ASN 89 7.843 3.831 9.016 573 HA ASN 89 HA ASN 89 8.615 1.473 7.415 574 HB2 ASN 89 2HB ASN 89 9.565 1.756 9.810 575 HB3 ASN 89 3HB ASN 89 7.933 1.340 10.336 576 HD21 ASN 89 1HD2 ASN 89 7.127 -0.728 9.946 577 HD22 ASN 89 2HD2 ASN 89 8.176 -2.042 9.550 578 H TRP 90 H TRP 90 6.986 0.557 6.407 579 HA TRP 90 HA TRP 90 4.267 1.051 7.373 580 HB2 TRP 90 2HB TRP 90 5.360 0.238 4.691 581 HB3 TRP 90 3HB TRP 90 3.648 0.086 5.071 582 HD1 TRP 90 HD1 TRP 90 5.206 3.098 6.615 583 HE1 TRP 90 HE1 TRP 90 4.517 5.205 5.348 584 HE3 TRP 90 HE3 TRP 90 3.114 0.901 2.482 585 HZ2 TRP 90 HZ2 TRP 90 3.227 5.862 2.904 586 HZ3 TRP 90 HZ3 TRP 90 2.177 2.343 0.746 587 HH2 TRP 90 HH2 TRP 90 2.233 4.761 0.947 588 H ILE 91 H ILE 91 2.778 -0.565 7.657 589 HA ILE 91 HA ILE 91 3.908 -3.278 7.885 590 HB ILE 91 HB ILE 91 1.510 -2.079 9.303 591 HG12 ILE 91 2HG1 ILE 91 4.181 -3.016 10.376 592 HG13 ILE 91 3HG1 ILE 91 3.695 -1.337 10.168 593 HG21 ILE 91 1HG2 ILE 91 1.381 -4.212 10.529 594 HG22 ILE 91 2HG2 ILE 91 2.643 -4.871 9.489 595 HG23 ILE 91 3HG2 ILE 91 1.083 -4.416 8.802 596 HD11 ILE 91 3HD1 ILE 91 2.407 -3.333 12.014 597 HD12 ILE 91 1HD1 ILE 91 1.932 -1.644 11.823 598 HD13 ILE 91 2HD1 ILE 91 3.519 -2.048 12.484 599 H LEU 92 H LEU 92 3.288 -4.673 6.418 600 HA LEU 92 HA LEU 92 0.768 -4.251 4.962 601 HB2 LEU 92 2HB LEU 92 3.441 -4.723 3.644 602 HB3 LEU 92 3HB LEU 92 1.903 -4.682 2.816 603 HG LEU 92 HG LEU 92 3.153 -2.334 4.255 604 HD11 LEU 92 1HD1 LEU 92 2.958 -2.959 1.314 605 HD12 LEU 92 2HD1 LEU 92 4.430 -2.951 2.286 606 HD13 LEU 92 3HD1 LEU 92 3.548 -1.449 2.012 607 HD21 LEU 92 3HD2 LEU 92 1.414 -1.033 3.118 608 HD22 LEU 92 1HD2 LEU 92 0.718 -2.224 4.214 609 HD23 LEU 92 2HD2 LEU 92 0.718 -2.523 2.480 610 H GLY 93 H GLY 93 0.037 -6.064 6.217 611 HA2 GLY 93 2HA GLY 93 -0.038 -8.433 4.790 612 HA3 GLY 93 3HA GLY 93 1.210 -8.636 6.011 613 H SER 94 H SER 94 -2.080 -8.918 5.340 614 HA SER 94 HA SER 94 -2.909 -8.737 8.127 615 HB2 SER 94 2HB SER 94 -5.172 -9.285 7.250 616 HB3 SER 94 3HB SER 94 -4.469 -7.897 6.421 617 HG SER 94 HG SER 94 -5.387 -9.319 4.920 618 H ARG 95 H ARG 95 -1.460 -10.931 6.156 619 HA ARG 95 HA ARG 95 -2.583 -13.237 7.564 620 HB2 ARG 95 2HB ARG 95 -1.057 -13.049 4.971 621 HB3 ARG 95 3HB ARG 95 -1.414 -14.575 5.773 622 HG2 ARG 95 2HG ARG 95 -3.797 -14.142 5.588 623 HG3 ARG 95 3HG ARG 95 -3.469 -12.584 4.827 624 HD2 ARG 95 2HD ARG 95 -2.398 -13.705 2.966 625 HD3 ARG 95 3HD ARG 95 -2.653 -15.269 3.739 626 HE ARG 95 HE ARG 95 -5.100 -13.861 3.408 627 HH11 ARG 95 1HH1 ARG 95 -2.716 -15.717 1.658 628 HH12 ARG 95 2HH1 ARG 95 -3.835 -16.321 0.478 629 HH21 ARG 95 1HH2 ARG 95 -6.615 -14.666 1.873 630 HH22 ARG 95 2HH2 ARG 95 -6.074 -15.739 0.629 631 H GLU 96 H GLU 96 -1.285 -14.681 8.590 632 HA GLU 96 HA GLU 96 0.902 -13.466 9.941 633 HB2 GLU 96 2HB GLU 96 1.007 -15.621 11.172 634 HB3 GLU 96 3HB GLU 96 -0.582 -14.868 11.177 635 HG2 GLU 96 2HG GLU 96 -1.233 -16.402 9.321 636 HG3 GLU 96 3HG GLU 96 0.314 -17.218 9.527 637 H ASN 97 H ASN 97 0.667 -15.864 7.381 638 HA ASN 97 HA ASN 97 3.600 -16.107 7.420 639 HB2 ASN 97 2HB ASN 97 3.343 -18.336 6.416 640 HB3 ASN 97 3HB ASN 97 2.539 -18.220 7.973 641 HD21 ASN 97 1HD2 ASN 97 2.083 -20.090 5.821 642 HD22 ASN 97 2HD2 ASN 97 0.419 -19.929 5.381 643 H GLN 98 H GLN 98 2.062 -14.075 5.978 644 HA GLN 98 HA GLN 98 3.255 -14.502 3.398 645 HB2 GLN 98 2HB GLN 98 0.285 -14.445 3.678 646 HB3 GLN 98 3HB GLN 98 1.023 -13.699 2.268 647 HG2 GLN 98 2HG GLN 98 2.117 -15.806 1.717 648 HG3 GLN 98 3HG GLN 98 1.386 -16.558 3.138 649 HE21 GLN 98 1HE2 GLN 98 1.155 -17.082 0.221 650 HE22 GLN 98 2HE2 GLN 98 -0.544 -17.058 -0.101 651 H ASN 99 H ASN 99 4.136 -12.792 2.674 652 HA ASN 99 HA ASN 99 3.549 -10.212 3.924 653 HB2 ASN 99 2HB ASN 99 5.886 -11.180 2.252 654 HB3 ASN 99 3HB ASN 99 5.710 -9.523 2.803 655 HD21 ASN 99 1HD2 ASN 99 7.832 -11.404 3.350 656 HD22 ASN 99 2HD2 ASN 99 7.912 -11.585 5.070 657 H VAL 100 H VAL 100 3.286 -8.311 2.614 658 HA VAL 100 HA VAL 100 1.743 -8.810 0.216 659 HB VAL 100 HB VAL 100 2.593 -6.212 1.509 660 HG11 VAL 100 1HG1 VAL 100 0.811 -6.612 -0.900 661 HG12 VAL 100 2HG1 VAL 100 2.412 -5.867 -0.910 662 HG13 VAL 100 3HG1 VAL 100 1.077 -5.084 -0.060 663 HG21 VAL 100 3HG2 VAL 100 -0.053 -7.629 1.271 664 HG22 VAL 100 1HG2 VAL 100 0.177 -6.037 1.991 665 HG23 VAL 100 2HG2 VAL 100 0.923 -7.452 2.730 666 H VAL 101 H VAL 101 2.277 -8.567 -1.840 667 HA VAL 101 HA VAL 101 5.078 -7.815 -2.430 668 HB VAL 101 HB VAL 101 5.262 -9.447 -4.223 669 HG11 VAL 101 1HG1 VAL 101 4.336 -10.663 -1.635 670 HG12 VAL 101 2HG1 VAL 101 5.968 -10.120 -2.026 671 HG13 VAL 101 3HG1 VAL 101 5.267 -11.492 -2.884 672 HG21 VAL 101 3HG2 VAL 101 2.926 -9.533 -4.930 673 HG22 VAL 101 1HG2 VAL 101 2.489 -10.348 -3.429 674 HG23 VAL 101 2HG2 VAL 101 3.541 -11.149 -4.594 675 H ALA 102 H ALA 102 1.760 -7.451 -3.402 676 HA ALA 102 HA ALA 102 2.647 -5.345 -5.217 677 HB1 ALA 102 3HB ALA 102 0.721 -7.443 -6.197 678 HB2 ALA 102 1HB ALA 102 2.437 -7.398 -6.601 679 HB3 ALA 102 2HB ALA 102 1.376 -6.082 -7.104 680 H ILE 103 H ILE 103 1.302 -3.647 -5.375 681 HA ILE 103 HA ILE 103 -1.385 -3.859 -4.185 682 HB ILE 103 HB ILE 103 0.612 -1.672 -3.542 683 HG12 ILE 103 2HG1 ILE 103 0.864 -3.764 -2.230 684 HG13 ILE 103 3HG1 ILE 103 0.396 -2.392 -1.233 685 HG21 ILE 103 1HG2 ILE 103 -1.151 -0.660 -2.178 686 HG22 ILE 103 2HG2 ILE 103 -2.289 -1.866 -2.776 687 HG23 ILE 103 3HG2 ILE 103 -1.579 -0.699 -3.888 688 HD11 ILE 103 3HD1 ILE 103 -1.918 -3.190 -1.238 689 HD12 ILE 103 1HD1 ILE 103 -0.814 -4.396 -0.583 690 HD13 ILE 103 2HD1 ILE 103 -1.439 -4.570 -2.222 691 H ASN 104 H ASN 104 -2.897 -3.034 -5.397 692 HA ASN 104 HA ASN 104 -2.272 -0.855 -7.305 693 HB2 ASN 104 2HB ASN 104 -2.613 -3.045 -8.473 694 HB3 ASN 104 3HB ASN 104 -4.219 -3.145 -7.759 695 HD21 ASN 104 1HD2 ASN 104 -5.856 -1.786 -8.535 696 HD22 ASN 104 2HD2 ASN 104 -5.704 -0.968 -10.049 697 H VAL 105 H VAL 105 -3.089 0.783 -6.065 698 HA VAL 105 HA VAL 105 -5.993 0.713 -5.537 699 HB VAL 105 HB VAL 105 -5.772 1.708 -3.279 700 HG11 VAL 105 1HG1 VAL 105 -6.164 -0.663 -3.469 701 HG12 VAL 105 2HG1 VAL 105 -5.094 -0.339 -2.106 702 HG13 VAL 105 3HG1 VAL 105 -4.432 -0.966 -3.612 703 HG21 VAL 105 3HG2 VAL 105 -2.847 1.097 -3.633 704 HG22 VAL 105 1HG2 VAL 105 -3.605 1.552 -2.105 705 HG23 VAL 105 2HG2 VAL 105 -3.579 2.693 -3.452 706 H GLU 106 H GLU 106 -7.101 2.573 -5.704 707 HA GLU 106 HA GLU 106 -5.660 5.113 -5.759 708 HB2 GLU 106 2HB GLU 106 -5.724 4.426 -8.123 709 HB3 GLU 106 3HB GLU 106 -7.475 4.267 -8.029 710 HG2 GLU 106 2HG GLU 106 -7.670 6.651 -7.556 711 HG3 GLU 106 3HG GLU 106 -5.919 6.816 -7.638 712 H SER 107 H SER 107 -6.589 5.526 -3.999 713 HA SER 107 HA SER 107 -9.248 6.761 -3.997 714 HB2 SER 107 2HB SER 107 -8.896 4.500 -2.040 715 HB3 SER 107 3HB SER 107 -10.344 5.455 -2.315 716 HG SER 107 HG SER 107 -9.905 4.535 -4.627 717 H GLY 108 H GLY 108 -9.763 7.985 -2.079 718 HA2 GLY 108 2HA GLY 108 -8.908 8.068 0.333 719 HA3 GLY 108 3HA GLY 108 -7.380 8.425 -0.448 720 H ASP 109 H ASP 109 -10.550 9.641 0.404 721 HA ASP 109 HA ASP 109 -10.026 12.263 -0.610 722 HB2 ASP 109 2HB ASP 109 -11.933 11.310 1.558 723 HB3 ASP 109 3HB ASP 109 -11.942 12.912 0.831 724 H ASP 110 H ASP 110 -8.198 13.139 0.143 725 HA ASP 110 HA ASP 110 -6.517 13.800 1.511 726 HB2 ASP 110 2HB ASP 110 -8.677 13.619 3.641 727 HB3 ASP 110 3HB ASP 110 -7.082 14.320 3.903 728 H GLY 111 H GLY 111 -7.167 10.956 0.996 729 HA2 GLY 111 2HA GLY 111 -6.047 8.989 1.415 730 HA3 GLY 111 3HA GLY 111 -5.190 9.791 2.717 731 H GLN 112 H GLN 112 -8.668 9.876 2.735 732 HA GLN 112 HA GLN 112 -8.795 8.653 5.275 733 HB2 GLN 112 2HB GLN 112 -10.456 10.278 4.505 734 HB3 GLN 112 3HB GLN 112 -11.031 9.131 3.305 735 HG2 GLN 112 2HG GLN 112 -11.695 7.601 5.113 736 HG3 GLN 112 3HG GLN 112 -11.159 8.792 6.295 737 HE21 GLN 112 1HE2 GLN 112 -13.780 7.650 5.922 738 HE22 GLN 112 2HE2 GLN 112 -14.853 8.968 5.605 739 H THR 113 H THR 113 -9.553 7.343 2.033 740 HA THR 113 HA THR 113 -9.594 4.668 3.233 741 HB THR 113 HB THR 113 -11.357 4.101 1.489 742 HG1 THR 113 HG1 THR 113 -12.584 6.323 1.156 743 HG21 THR 113 3HG2 THR 113 -11.895 4.354 3.880 744 HG22 THR 113 1HG2 THR 113 -13.212 4.929 2.857 745 HG23 THR 113 2HG2 THR 113 -12.132 6.085 3.638 746 H LEU 114 H LEU 114 -9.050 2.941 1.758 747 HA LEU 114 HA LEU 114 -7.702 3.781 -0.719 748 HB2 LEU 114 2HB LEU 114 -6.616 1.899 1.374 749 HB3 LEU 114 3HB LEU 114 -5.925 2.093 -0.225 750 HG LEU 114 HG LEU 114 -6.112 4.288 1.846 751 HD11 LEU 114 1HD1 LEU 114 -3.771 2.589 1.012 752 HD12 LEU 114 2HD1 LEU 114 -4.593 2.534 2.570 753 HD13 LEU 114 3HD1 LEU 114 -3.694 3.978 2.091 754 HD21 LEU 114 3HD2 LEU 114 -4.684 4.149 -0.812 755 HD22 LEU 114 1HD2 LEU 114 -4.550 5.469 0.352 756 HD23 LEU 114 2HD2 LEU 114 -6.094 5.139 -0.435 757 H ASN 115 H ASN 115 -8.891 2.830 -2.289 758 HA ASN 115 HA ASN 115 -9.786 0.061 -1.848 759 HB2 ASN 115 2HB ASN 115 -11.012 2.237 -3.551 760 HB3 ASN 115 3HB ASN 115 -11.514 0.552 -3.598 761 HD21 ASN 115 1HD2 ASN 115 -12.972 2.985 -2.864 762 HD22 ASN 115 2HD2 ASN 115 -13.595 2.695 -1.279 763 H GLY 116 H GLY 116 -9.436 -1.459 -3.390 764 HA2 GLY 116 2HA GLY 116 -8.838 -1.210 -6.026 765 HA3 GLY 116 3HA GLY 116 -7.294 -0.937 -5.234 766 H THR 117 H THR 117 -6.173 -2.690 -5.578 767 HA THR 117 HA THR 117 -7.247 -5.250 -4.668 768 HB THR 117 HB THR 117 -5.968 -6.289 -6.691 769 HG1 THR 117 HG1 THR 117 -6.619 -3.710 -7.726 770 HG21 THR 117 3HG2 THR 117 -8.368 -6.512 -6.394 771 HG22 THR 117 1HG2 THR 117 -8.014 -6.142 -8.086 772 HG23 THR 117 2HG2 THR 117 -8.624 -4.880 -7.016 773 H MET 118 H MET 118 -5.536 -6.859 -4.290 774 HA MET 118 HA MET 118 -2.851 -5.778 -3.961 775 HB2 MET 118 2HB MET 118 -2.741 -6.465 -1.611 776 HB3 MET 118 3HB MET 118 -3.918 -5.184 -1.869 777 HG2 MET 118 2HG MET 118 -5.731 -6.721 -1.706 778 HG3 MET 118 3HG MET 118 -4.635 -8.094 -1.695 779 HE1 MET 118 3HE MET 118 -3.062 -8.722 0.201 780 HE2 MET 118 1HE MET 118 -2.898 -7.850 1.719 781 HE3 MET 118 2HE MET 118 -2.307 -7.128 0.223 782 H THR 119 H THR 119 -1.279 -7.464 -3.386 783 HA THR 119 HA THR 119 -2.219 -10.201 -3.790 784 HB THR 119 HB THR 119 0.045 -9.041 -5.434 785 HG1 THR 119 HG1 THR 119 -2.657 -9.021 -5.787 786 HG21 THR 119 3HG2 THR 119 -0.126 -11.158 -6.677 787 HG22 THR 119 1HG2 THR 119 -1.382 -11.706 -5.563 788 HG23 THR 119 2HG2 THR 119 0.259 -11.442 -4.980 789 H TYR 120 H TYR 120 -1.111 -11.698 -2.645 790 HA TYR 120 HA TYR 120 1.166 -10.830 -1.004 791 HB2 TYR 120 2HB TYR 120 -0.794 -13.104 -0.762 792 HB3 TYR 120 3HB TYR 120 0.707 -13.083 0.148 793 HD1 TYR 120 HD2 TYR 120 1.116 -11.086 1.665 794 HD2 TYR 120 HD1 TYR 120 -2.697 -12.043 0.060 795 HE1 TYR 120 HE2 TYR 120 0.058 -9.773 3.431 796 HE2 TYR 120 HE1 TYR 120 -3.778 -10.725 1.834 797 HH TYR 120 HH TYR 120 -3.320 -9.857 4.032 798 H ALA 121 H ALA 121 2.886 -12.458 -0.648 799 HA ALA 121 HA ALA 121 3.939 -13.433 -3.080 800 HB1 ALA 121 3HB ALA 121 5.634 -14.535 -1.699 801 HB2 ALA 121 1HB ALA 121 4.653 -14.257 -0.263 802 HB3 ALA 121 2HB ALA 121 5.345 -12.891 -1.133 803 H GLY 122 H GLY 122 3.682 -15.314 -4.134 804 HA2 GLY 122 2HA GLY 122 2.859 -17.381 -4.691 805 HA3 GLY 122 3HA GLY 122 2.995 -17.780 -2.985 806 H GLU 123 H GLU 123 0.969 -15.165 -4.082 807 HA GLU 123 HA GLU 123 -1.427 -16.830 -3.753 808 HB2 GLU 123 2HB GLU 123 -0.915 -15.704 -1.586 809 HB3 GLU 123 3HB GLU 123 -0.988 -14.154 -2.406 810 HG2 GLU 123 2HG GLU 123 -3.026 -14.601 -1.158 811 HG3 GLU 123 3HG GLU 123 -3.347 -14.499 -2.890 812 H GLY 124 H GLY 124 -3.393 -15.721 -4.600 813 HA2 GLY 124 2HA GLY 124 -2.709 -14.310 -7.065 814 HA3 GLY 124 3HA GLY 124 -4.281 -14.981 -6.648 815 HA PRO 125 HA PRO 125 -4.139 -10.308 -5.897 816 HB2 PRO 125 2HB PRO 125 -5.694 -9.491 -7.961 817 HB3 PRO 125 3HB PRO 125 -3.943 -9.667 -8.112 818 HG2 PRO 125 2HG PRO 125 -6.112 -11.543 -8.961 819 HG3 PRO 125 3HG PRO 125 -4.645 -11.065 -9.831 820 HD2 PRO 125 2HD PRO 125 -4.851 -13.409 -8.475 821 HD3 PRO 125 3HD PRO 125 -3.315 -12.541 -8.653 822 H ILE 126 H ILE 126 -5.631 -9.525 -4.555 823 HA ILE 126 HA ILE 126 -8.399 -10.490 -4.766 824 HB ILE 126 HB ILE 126 -8.562 -10.579 -2.305 825 HG12 ILE 126 2HG1 ILE 126 -5.564 -10.173 -2.335 826 HG13 ILE 126 3HG1 ILE 126 -6.740 -8.968 -1.822 827 HG21 ILE 126 1HG2 ILE 126 -7.266 -12.640 -1.960 828 HG22 ILE 126 2HG2 ILE 126 -6.368 -12.312 -3.440 829 HG23 ILE 126 3HG2 ILE 126 -8.101 -12.635 -3.512 830 HD11 ILE 126 3HD1 ILE 126 -6.229 -11.630 -0.517 831 HD12 ILE 126 1HD1 ILE 126 -7.454 -10.470 -0.015 832 HD13 ILE 126 2HD1 ILE 126 -5.744 -10.048 0.091 833 H GLY 127 H GLY 127 -9.957 -9.056 -3.631 834 HA2 GLY 127 2HA GLY 127 -9.462 -6.329 -4.349 835 HA3 GLY 127 3HA GLY 127 -10.904 -6.951 -3.554 836 H PHE 128 H PHE 128 -8.875 -4.612 -3.126 837 HA PHE 128 HA PHE 128 -8.429 -5.108 -0.266 838 HB2 PHE 128 2HB PHE 128 -6.337 -4.841 -1.471 839 HB3 PHE 128 3HB PHE 128 -6.909 -3.347 -2.203 840 HD1 PHE 128 HD1 PHE 128 -5.917 -4.909 0.998 841 HD2 PHE 128 HD2 PHE 128 -6.675 -1.283 -1.089 842 HE1 PHE 128 HE1 PHE 128 -4.952 -3.634 2.866 843 HE2 PHE 128 HE2 PHE 128 -5.710 -0.003 0.775 844 HZ PHE 128 HZ PHE 128 -4.848 -1.179 2.757 845 H LYS 129 H LYS 129 -9.338 -3.772 1.148 846 HA LYS 129 HA LYS 129 -10.303 -1.155 0.301 847 HB2 LYS 129 2HB LYS 129 -12.225 -2.656 0.106 848 HB3 LYS 129 3HB LYS 129 -11.949 -3.252 1.731 849 HG2 LYS 129 2HG LYS 129 -12.504 -1.069 2.645 850 HG3 LYS 129 3HG LYS 129 -12.735 -0.437 1.011 851 HD2 LYS 129 2HD LYS 129 -14.519 -2.064 0.637 852 HD3 LYS 129 3HD LYS 129 -14.296 -2.688 2.268 853 HE2 LYS 129 2HE LYS 129 -15.104 0.120 1.552 854 HE3 LYS 129 3HE LYS 129 -16.203 -1.142 2.103 855 HZ1 LYS 129 3HZ LYS 129 -14.703 -1.256 4.142 856 HZ2 LYS 129 1HZ LYS 129 -15.713 0.101 3.993 857 HZ3 LYS 129 2HZ LYS 129 -14.075 0.230 3.625 858 H GLY 130 H GLY 130 -9.122 0.118 1.584 859 HA2 GLY 130 2HA GLY 130 -8.846 -0.672 4.415 860 HA3 GLY 130 3HA GLY 130 -7.614 0.216 3.529 861 H THR 131 H THR 131 -9.089 0.859 5.982 862 HA THR 131 HA THR 131 -9.978 3.519 5.114 863 HB THR 131 HB THR 131 -12.040 2.315 5.434 864 HG1 THR 131 HG1 THR 131 -12.123 3.593 7.864 865 HG21 THR 131 3HG2 THR 131 -12.631 1.276 7.588 866 HG22 THR 131 1HG2 THR 131 -10.999 1.593 8.174 867 HG23 THR 131 2HG2 THR 131 -11.253 0.481 6.827 868 H LEU 132 H LEU 132 -9.492 5.173 6.431 869 HA LEU 132 HA LEU 132 -7.441 4.831 8.382 870 HB2 LEU 132 2HB LEU 132 -7.555 6.820 6.975 871 HB3 LEU 132 3HB LEU 132 -9.112 7.240 7.658 872 HG LEU 132 HG LEU 132 -8.035 7.620 9.848 873 HD11 LEU 132 1HD1 LEU 132 -5.606 7.728 10.008 874 HD12 LEU 132 2HD1 LEU 132 -5.462 7.116 8.360 875 HD13 LEU 132 3HD1 LEU 132 -6.152 6.097 9.627 876 HD21 LEU 132 3HD2 LEU 132 -6.896 9.689 9.254 877 HD22 LEU 132 1HD2 LEU 132 -8.364 9.480 8.300 878 HD23 LEU 132 2HD2 LEU 132 -6.789 9.160 7.573 879 H THR 133 H THR 133 -7.546 4.835 10.570 880 HA THR 133 HA THR 133 -10.226 4.842 11.717 881 HB THR 133 HB THR 133 -7.713 3.386 12.569 882 HG1 THR 133 HG1 THR 133 -8.746 1.665 11.814 883 HG21 THR 133 3HG2 THR 133 -8.831 4.229 14.573 884 HG22 THR 133 1HG2 THR 133 -9.050 2.483 14.434 885 HG23 THR 133 2HG2 THR 133 -10.366 3.576 14.006 Start of MODEL 14 1 H1 ALA 2 1H ALA 2 0.239 6.227 9.150 2 H2 ALA 2 2H ALA 2 0.621 6.033 10.784 3 H3 ALA 2 3H ALA 2 0.292 7.575 10.176 4 HA ALA 2 HA ALA 2 -1.561 6.748 11.422 5 HB1 ALA 2 3HB ALA 2 -3.285 7.036 9.722 6 HB2 ALA 2 1HB ALA 2 -2.092 6.781 8.451 7 HB3 ALA 2 2HB ALA 2 -1.980 8.201 9.490 8 H LEU 3 H LEU 3 -3.044 5.117 11.859 9 HA LEU 3 HA LEU 3 -2.236 2.493 10.921 10 HB2 LEU 3 2HB LEU 3 -2.588 2.986 13.352 11 HB3 LEU 3 3HB LEU 3 -4.288 3.215 13.022 12 HG LEU 3 HG LEU 3 -2.988 0.593 12.343 13 HD11 LEU 3 1HD1 LEU 3 -2.345 1.080 14.652 14 HD12 LEU 3 2HD1 LEU 3 -3.533 -0.223 14.571 15 HD13 LEU 3 3HD1 LEU 3 -4.034 1.397 15.052 16 HD21 LEU 3 3HD2 LEU 3 -5.313 1.125 11.613 17 HD22 LEU 3 1HD2 LEU 3 -5.762 1.284 13.309 18 HD23 LEU 3 2HD2 LEU 3 -5.208 -0.269 12.685 19 H TYR 4 H TYR 4 -3.383 1.233 9.613 20 HA TYR 4 HA TYR 4 -5.947 2.290 8.638 21 HB2 TYR 4 2HB TYR 4 -3.675 1.028 7.140 22 HB3 TYR 4 3HB TYR 4 -5.312 0.967 6.499 23 HD1 TYR 4 HD1 TYR 4 -2.714 3.375 7.691 24 HD2 TYR 4 HD2 TYR 4 -6.118 2.739 5.219 25 HE1 TYR 4 HE1 TYR 4 -2.384 5.590 6.658 26 HE2 TYR 4 HE2 TYR 4 -5.795 4.949 4.193 27 HH TYR 4 HH TYR 4 -4.749 7.050 4.636 28 H ASN 5 H ASN 5 -7.610 0.968 8.489 29 HA ASN 5 HA ASN 5 -7.307 -1.748 9.549 30 HB2 ASN 5 2HB ASN 5 -9.006 -0.160 10.521 31 HB3 ASN 5 3HB ASN 5 -9.827 -0.186 8.968 32 HD21 ASN 5 1HD2 ASN 5 -11.649 -0.929 10.075 33 HD22 ASN 5 2HD2 ASN 5 -11.810 -2.583 10.536 34 H VAL 6 H VAL 6 -7.794 -3.543 8.249 35 HA VAL 6 HA VAL 6 -8.134 -2.789 5.433 36 HB VAL 6 HB VAL 6 -6.392 -4.939 6.619 37 HG11 VAL 6 1HG1 VAL 6 -7.454 -5.877 4.653 38 HG12 VAL 6 2HG1 VAL 6 -5.765 -5.502 4.296 39 HG13 VAL 6 3HG1 VAL 6 -7.048 -4.438 3.716 40 HG21 VAL 6 3HG2 VAL 6 -5.785 -2.525 4.922 41 HG22 VAL 6 1HG2 VAL 6 -4.609 -3.713 5.476 42 HG23 VAL 6 2HG2 VAL 6 -5.454 -2.698 6.645 43 H GLU 7 H GLU 7 -9.749 -3.547 4.423 44 HA GLU 7 HA GLU 7 -11.023 -6.050 5.269 45 HB2 GLU 7 2HB GLU 7 -12.220 -3.565 4.015 46 HB3 GLU 7 3HB GLU 7 -13.090 -5.078 4.217 47 HG2 GLU 7 2HG GLU 7 -12.927 -4.915 6.613 48 HG3 GLU 7 3HG GLU 7 -11.907 -3.486 6.481 49 H ASN 8 H ASN 8 -11.373 -7.561 3.636 50 HA ASN 8 HA ASN 8 -10.321 -6.800 0.999 51 HB2 ASN 8 2HB ASN 8 -9.539 -9.224 2.613 52 HB3 ASN 8 3HB ASN 8 -9.257 -9.100 0.886 53 HD21 ASN 8 1HD2 ASN 8 -8.629 -6.278 0.949 54 HD22 ASN 8 2HD2 ASN 8 -7.058 -6.161 1.658 55 H GLN 9 H GLN 9 -11.028 -7.940 -0.762 56 HA GLN 9 HA GLN 9 -13.368 -9.707 -0.402 57 HB2 GLN 9 2HB GLN 9 -14.016 -7.507 -1.347 58 HB3 GLN 9 3HB GLN 9 -12.812 -7.696 -2.606 59 HG2 GLN 9 2HG GLN 9 -14.028 -9.633 -3.476 60 HG3 GLN 9 3HG GLN 9 -15.243 -9.417 -2.216 61 HE21 GLN 9 1HE2 GLN 9 -15.496 -9.338 -5.132 62 HE22 GLN 9 2HE2 GLN 9 -16.186 -7.792 -5.494 63 H TRP 10 H TRP 10 -12.668 -11.747 -0.937 64 HA TRP 10 HA TRP 10 -10.768 -11.924 -3.168 65 HB2 TRP 10 2HB TRP 10 -9.366 -13.480 -1.945 66 HB3 TRP 10 3HB TRP 10 -9.503 -11.956 -1.081 67 HD1 TRP 10 HD1 TRP 10 -10.581 -15.634 -0.849 68 HE1 TRP 10 HE1 TRP 10 -11.300 -16.126 1.570 69 HE3 TRP 10 HE3 TRP 10 -10.392 -10.891 1.055 70 HZ2 TRP 10 HZ2 TRP 10 -11.721 -14.714 3.962 71 HZ3 TRP 10 HZ3 TRP 10 -10.967 -10.555 3.422 72 HH2 TRP 10 HH2 TRP 10 -11.615 -12.425 4.844 73 H GLY 11 H GLY 11 -13.843 -13.033 -2.347 74 HA2 GLY 11 2HA GLY 11 -13.170 -15.670 -3.400 75 HA3 GLY 11 3HA GLY 11 -14.417 -15.378 -2.203 76 H GLY 12 H GLY 12 -14.139 -13.018 -4.711 77 HA2 GLY 12 2HA GLY 12 -15.384 -13.931 -6.879 78 HA3 GLY 12 3HA GLY 12 -16.713 -13.919 -5.732 79 H SER 13 H SER 13 -17.744 -12.421 -7.141 80 HA SER 13 HA SER 13 -16.526 -9.754 -7.283 81 HB2 SER 13 2HB SER 13 -18.254 -9.363 -9.069 82 HB3 SER 13 3HB SER 13 -17.087 -10.627 -9.458 83 HG SER 13 HG SER 13 -19.218 -11.313 -9.916 84 H SER 14 H SER 14 -19.047 -11.593 -5.909 85 HA SER 14 HA SER 14 -20.510 -9.193 -5.066 86 HB2 SER 14 2HB SER 14 -22.338 -10.822 -4.524 87 HB3 SER 14 3HB SER 14 -21.909 -10.777 -6.237 88 HG SER 14 HG SER 14 -21.922 -12.898 -5.773 89 H ALA 15 H ALA 15 -18.145 -11.172 -4.043 90 HA ALA 15 HA ALA 15 -18.874 -12.041 -1.491 91 HB1 ALA 15 3HB ALA 15 -16.895 -12.866 -2.657 92 HB2 ALA 15 1HB ALA 15 -16.467 -12.234 -1.067 93 HB3 ALA 15 2HB ALA 15 -16.136 -11.283 -2.517 94 HA PRO 16 HA PRO 16 -19.037 -8.213 0.731 95 HB2 PRO 16 2HB PRO 16 -18.976 -9.217 3.245 96 HB3 PRO 16 3HB PRO 16 -20.409 -9.337 2.216 97 HG2 PRO 16 2HG PRO 16 -18.284 -11.383 2.744 98 HG3 PRO 16 3HG PRO 16 -20.047 -11.587 2.717 99 HD2 PRO 16 2HD PRO 16 -18.499 -12.274 0.619 100 HD3 PRO 16 3HD PRO 16 -20.137 -11.624 0.406 101 H TRP 17 H TRP 17 -17.757 -6.993 2.280 102 HA TRP 17 HA TRP 17 -14.938 -7.524 1.907 103 HB2 TRP 17 2HB TRP 17 -16.428 -5.197 3.139 104 HB3 TRP 17 3HB TRP 17 -14.676 -5.279 3.042 105 HD1 TRP 17 HD1 TRP 17 -17.730 -4.438 1.016 106 HE1 TRP 17 HE1 TRP 17 -17.018 -3.621 -1.319 107 HE3 TRP 17 HE3 TRP 17 -12.787 -5.679 1.211 108 HZ2 TRP 17 HZ2 TRP 17 -14.657 -3.513 -2.870 109 HZ3 TRP 17 HZ3 TRP 17 -11.364 -5.186 -0.738 110 HH2 TRP 17 HH2 TRP 17 -12.284 -4.126 -2.735 111 H ASN 18 H ASN 18 -13.716 -8.519 3.390 112 HA ASN 18 HA ASN 18 -14.779 -8.702 6.140 113 HB2 ASN 18 2HB ASN 18 -13.097 -10.738 4.656 114 HB3 ASN 18 3HB ASN 18 -13.633 -10.878 6.322 115 HD21 ASN 18 1HD2 ASN 18 -14.497 -11.158 3.003 116 HD22 ASN 18 2HD2 ASN 18 -16.044 -11.881 3.249 117 H GLU 19 H GLU 19 -13.483 -7.863 7.692 118 HA GLU 19 HA GLU 19 -10.831 -6.991 6.958 119 HB2 GLU 19 2HB GLU 19 -10.705 -6.023 9.201 120 HB3 GLU 19 3HB GLU 19 -12.199 -5.550 8.409 121 HG2 GLU 19 2HG GLU 19 -13.449 -7.137 9.727 122 HG3 GLU 19 3HG GLU 19 -11.962 -7.755 10.445 123 H GLY 20 H GLY 20 -8.929 -8.001 7.433 124 HA2 GLY 20 2HA GLY 20 -9.115 -10.304 9.229 125 HA3 GLY 20 3HA GLY 20 -8.367 -10.447 7.645 126 H GLY 21 H GLY 21 -8.018 -7.504 9.425 127 HA2 GLY 21 2HA GLY 21 -5.968 -7.758 11.074 128 HA3 GLY 21 3HA GLY 21 -5.155 -7.972 9.529 129 H GLN 22 H GLN 22 -4.189 -5.978 10.811 130 HA GLN 22 HA GLN 22 -5.390 -3.615 9.569 131 HB2 GLN 22 2HB GLN 22 -4.818 -2.294 11.577 132 HB3 GLN 22 3HB GLN 22 -5.984 -3.558 11.937 133 HG2 GLN 22 2HG GLN 22 -4.064 -4.955 12.761 134 HG3 GLN 22 3HG GLN 22 -3.044 -3.527 12.587 135 HE21 GLN 22 1HE2 GLN 22 -5.358 -1.812 13.386 136 HE22 GLN 22 2HE2 GLN 22 -5.436 -1.954 15.110 137 H TRP 23 H TRP 23 -3.959 -2.197 8.671 138 HA TRP 23 HA TRP 23 -1.139 -3.059 8.664 139 HB2 TRP 23 2HB TRP 23 -2.769 -1.715 6.504 140 HB3 TRP 23 3HB TRP 23 -1.026 -1.921 6.427 141 HD1 TRP 23 HD1 TRP 23 -2.422 -4.969 7.911 142 HE1 TRP 23 HE1 TRP 23 -2.663 -6.818 6.149 143 HE3 TRP 23 HE3 TRP 23 -1.768 -2.162 3.698 144 HZ2 TRP 23 HZ2 TRP 23 -2.579 -7.064 3.355 145 HZ3 TRP 23 HZ3 TRP 23 -1.859 -3.302 1.499 146 HH2 TRP 23 HH2 TRP 23 -2.255 -5.687 1.349 147 H GLU 24 H GLU 24 0.291 -1.155 7.875 148 HA GLU 24 HA GLU 24 -0.645 1.312 9.152 149 HB2 GLU 24 2HB GLU 24 0.857 0.161 10.724 150 HB3 GLU 24 3HB GLU 24 2.122 0.147 9.500 151 HG2 GLU 24 2HG GLU 24 2.274 2.533 9.539 152 HG3 GLU 24 3HG GLU 24 0.868 2.648 10.594 153 H ILE 25 H ILE 25 -0.681 2.847 7.763 154 HA ILE 25 HA ILE 25 1.314 2.914 5.615 155 HB ILE 25 HB ILE 25 -1.660 3.435 5.317 156 HG12 ILE 25 2HG1 ILE 25 0.074 1.341 3.980 157 HG13 ILE 25 3HG1 ILE 25 -0.950 1.030 5.374 158 HG21 ILE 25 1HG2 ILE 25 0.556 3.724 3.295 159 HG22 ILE 25 2HG2 ILE 25 -0.406 5.023 3.993 160 HG23 ILE 25 3HG2 ILE 25 -1.165 3.834 2.937 161 HD11 ILE 25 3HD1 ILE 25 -2.922 1.600 4.062 162 HD12 ILE 25 1HD1 ILE 25 -2.006 0.294 3.312 163 HD13 ILE 25 2HD1 ILE 25 -1.900 1.930 2.661 164 H GLY 26 H GLY 26 2.188 4.900 5.261 165 HA2 GLY 26 2HA GLY 26 2.320 7.235 5.321 166 HA3 GLY 26 3HA GLY 26 0.820 7.272 6.239 167 H SER 27 H SER 27 4.140 6.259 6.491 168 HA SER 27 HA SER 27 4.313 6.148 9.288 169 HB2 SER 27 2HB SER 27 6.044 5.221 7.762 170 HB3 SER 27 3HB SER 27 6.535 6.861 7.354 171 HG SER 27 HG SER 27 6.604 6.779 9.958 172 H ARG 28 H ARG 28 4.882 8.827 7.043 173 HA ARG 28 HA ARG 28 5.065 10.688 9.289 174 HB2 ARG 28 2HB ARG 28 5.528 11.073 6.323 175 HB3 ARG 28 3HB ARG 28 5.659 12.354 7.520 176 HG2 ARG 28 2HG ARG 28 7.482 11.150 8.613 177 HG3 ARG 28 3HG ARG 28 7.336 9.855 7.423 178 HD2 ARG 28 2HD ARG 28 7.886 11.442 5.639 179 HD3 ARG 28 3HD ARG 28 8.055 12.726 6.837 180 HE ARG 28 HE ARG 28 9.705 10.473 7.424 181 HH11 ARG 28 1HH1 ARG 28 9.528 13.373 5.417 182 HH12 ARG 28 2HH1 ARG 28 11.243 13.538 5.297 183 HH21 ARG 28 1HH2 ARG 28 11.980 10.707 7.254 184 HH22 ARG 28 2HH2 ARG 28 12.641 12.014 6.337 185 H SER 29 H SER 29 3.427 12.077 9.757 186 HA SER 29 HA SER 29 0.903 11.632 8.416 187 HB2 SER 29 2HB SER 29 0.177 13.292 10.329 188 HB3 SER 29 3HB SER 29 0.590 11.620 10.706 189 HG SER 29 HG SER 29 2.287 13.895 10.946 190 H ASP 30 H ASP 30 3.389 13.553 7.729 191 HA ASP 30 HA ASP 30 2.254 16.106 7.328 192 HB2 ASP 30 2HB ASP 30 4.608 14.725 6.043 193 HB3 ASP 30 3HB ASP 30 4.173 16.397 5.706 194 H GLN 31 H GLN 31 2.263 13.194 5.425 195 HA GLN 31 HA GLN 31 0.441 14.445 3.553 196 HB2 GLN 31 2HB GLN 31 3.165 13.634 2.805 197 HB3 GLN 31 3HB GLN 31 1.883 13.168 1.689 198 HG2 GLN 31 2HG GLN 31 2.345 15.960 2.703 199 HG3 GLN 31 3HG GLN 31 2.901 15.343 1.142 200 HE21 GLN 31 1HE2 GLN 31 0.095 16.132 3.074 201 HE22 GLN 31 2HE2 GLN 31 -1.023 16.228 1.763 202 H ASN 32 H ASN 32 -1.188 13.272 3.093 203 HA ASN 32 HA ASN 32 -1.148 10.447 3.721 204 HB2 ASN 32 2HB ASN 32 -3.402 12.316 2.934 205 HB3 ASN 32 3HB ASN 32 -3.609 10.591 3.203 206 HD21 ASN 32 1HD2 ASN 32 -4.875 12.772 4.608 207 HD22 ASN 32 2HD2 ASN 32 -4.422 12.614 6.267 208 H VAL 33 H VAL 33 -1.992 8.916 2.231 209 HA VAL 33 HA VAL 33 -1.078 9.460 -0.511 210 HB VAL 33 HB VAL 33 -0.857 6.968 -0.706 211 HG11 VAL 33 1HG1 VAL 33 1.080 8.345 -0.234 212 HG12 VAL 33 2HG1 VAL 33 1.178 6.834 0.670 213 HG13 VAL 33 3HG1 VAL 33 0.704 8.322 1.490 214 HG21 VAL 33 3HG2 VAL 33 -1.377 7.043 2.265 215 HG22 VAL 33 1HG2 VAL 33 -0.841 5.637 1.346 216 HG23 VAL 33 2HG2 VAL 33 -2.433 6.328 1.044 217 H VAL 34 H VAL 34 -2.349 9.155 -2.272 218 HA VAL 34 HA VAL 34 -5.061 8.123 -1.786 219 HB VAL 34 HB VAL 34 -5.783 9.380 -3.791 220 HG11 VAL 34 1HG1 VAL 34 -4.461 11.046 -1.657 221 HG12 VAL 34 2HG1 VAL 34 -6.081 10.356 -1.594 222 HG13 VAL 34 3HG1 VAL 34 -5.702 11.609 -2.775 223 HG21 VAL 34 3HG2 VAL 34 -4.319 11.102 -4.744 224 HG22 VAL 34 1HG2 VAL 34 -3.645 9.487 -4.969 225 HG23 VAL 34 2HG2 VAL 34 -2.996 10.547 -3.717 226 H ALA 35 H ALA 35 -2.153 7.587 -3.578 227 HA ALA 35 HA ALA 35 -3.443 5.243 -4.720 228 HB1 ALA 35 3HB ALA 35 -1.781 6.974 -6.532 229 HB2 ALA 35 1HB ALA 35 -3.538 7.109 -6.427 230 HB3 ALA 35 2HB ALA 35 -2.798 5.600 -6.952 231 H ILE 36 H ILE 36 -2.088 3.534 -5.191 232 HA ILE 36 HA ILE 36 0.742 3.811 -4.621 233 HB ILE 36 HB ILE 36 -1.018 1.894 -3.044 234 HG12 ILE 36 2HG1 ILE 36 0.757 4.119 -2.016 235 HG13 ILE 36 3HG1 ILE 36 -0.986 4.264 -2.220 236 HG21 ILE 36 1HG2 ILE 36 1.986 2.204 -3.047 237 HG22 ILE 36 2HG2 ILE 36 1.079 0.842 -3.694 238 HG23 ILE 36 3HG2 ILE 36 1.064 1.164 -1.958 239 HD11 ILE 36 3HD1 ILE 36 -1.321 2.489 -0.584 240 HD12 ILE 36 1HD1 ILE 36 -0.389 3.824 0.093 241 HD13 ILE 36 2HD1 ILE 36 0.428 2.334 -0.387 242 H ASN 37 H ASN 37 1.813 2.606 -6.099 243 HA ASN 37 HA ASN 37 0.540 0.163 -7.090 244 HB2 ASN 37 2HB ASN 37 0.206 2.293 -8.597 245 HB3 ASN 37 3HB ASN 37 1.882 1.992 -9.049 246 HD21 ASN 37 1HD2 ASN 37 -1.354 0.790 -9.097 247 HD22 ASN 37 2HD2 ASN 37 -1.133 -0.409 -10.305 248 H VAL 38 H VAL 38 1.997 -1.469 -6.874 249 HA VAL 38 HA VAL 38 4.809 -1.004 -7.267 250 HB VAL 38 HB VAL 38 5.511 -1.846 -5.012 251 HG11 VAL 38 1HG1 VAL 38 4.063 0.787 -5.008 252 HG12 VAL 38 2HG1 VAL 38 5.719 0.506 -5.550 253 HG13 VAL 38 3HG1 VAL 38 5.295 0.281 -3.859 254 HG21 VAL 38 3HG2 VAL 38 3.393 -2.819 -4.303 255 HG22 VAL 38 1HG2 VAL 38 2.666 -1.211 -4.255 256 HG23 VAL 38 2HG2 VAL 38 3.964 -1.630 -3.132 257 H GLU 39 H GLU 39 6.089 -2.907 -7.167 258 HA GLU 39 HA GLU 39 4.683 -5.436 -6.828 259 HB2 GLU 39 2HB GLU 39 4.685 -4.999 -9.260 260 HB3 GLU 39 3HB GLU 39 6.428 -4.773 -9.220 261 HG2 GLU 39 2HG GLU 39 6.730 -7.096 -8.548 262 HG3 GLU 39 3HG GLU 39 4.986 -7.328 -8.542 263 H SER 40 H SER 40 6.032 -7.118 -6.154 264 HA SER 40 HA SER 40 8.379 -6.260 -4.739 265 HB2 SER 40 2HB SER 40 8.385 -8.515 -3.833 266 HB3 SER 40 3HB SER 40 6.770 -7.815 -3.743 267 HG SER 40 HG SER 40 7.136 -9.114 -6.089 268 H GLY 41 H GLY 41 10.364 -7.531 -4.791 269 HA2 GLY 41 2HA GLY 41 11.026 -8.390 -7.532 270 HA3 GLY 41 3HA GLY 41 12.193 -7.809 -6.345 271 H ASP 42 H ASP 42 11.712 -9.234 -4.145 272 HA ASP 42 HA ASP 42 11.820 -12.064 -4.937 273 HB2 ASP 42 2HB ASP 42 14.113 -11.295 -4.649 274 HB3 ASP 42 3HB ASP 42 13.727 -10.652 -3.059 275 H ASP 43 H ASP 43 9.935 -12.740 -4.100 276 HA ASP 43 HA ASP 43 8.313 -13.343 -2.627 277 HB2 ASP 43 2HB ASP 43 10.787 -13.558 -0.957 278 HB3 ASP 43 3HB ASP 43 9.212 -13.908 -0.257 279 H GLY 44 H GLY 44 8.817 -10.439 -2.817 280 HA2 GLY 44 2HA GLY 44 7.542 -8.683 -1.955 281 HA3 GLY 44 3HA GLY 44 7.042 -9.735 -0.647 282 H GLN 45 H GLN 45 10.264 -10.093 -0.585 283 HA GLN 45 HA GLN 45 10.567 -8.522 1.747 284 HB2 GLN 45 2HB GLN 45 12.620 -9.884 0.010 285 HB3 GLN 45 3HB GLN 45 12.997 -9.095 1.537 286 HG2 GLN 45 2HG GLN 45 11.503 -10.624 2.704 287 HG3 GLN 45 3HG GLN 45 11.116 -11.413 1.177 288 HE21 GLN 45 1HE2 GLN 45 14.320 -10.258 1.851 289 HE22 GLN 45 2HE2 GLN 45 15.058 -11.798 2.061 290 H THR 46 H THR 46 11.342 -7.977 -1.577 291 HA THR 46 HA THR 46 12.016 -5.214 -0.878 292 HB THR 46 HB THR 46 13.981 -6.203 -1.908 293 HG1 THR 46 HG1 THR 46 14.287 -4.678 -3.421 294 HG21 THR 46 3HG2 THR 46 12.970 -8.110 -3.021 295 HG22 THR 46 1HG2 THR 46 13.920 -7.180 -4.179 296 HG23 THR 46 2HG2 THR 46 12.161 -7.044 -4.169 297 H LEU 47 H LEU 47 10.801 -3.657 -1.764 298 HA LEU 47 HA LEU 47 8.729 -4.435 -3.705 299 HB2 LEU 47 2HB LEU 47 8.361 -2.643 -1.302 300 HB3 LEU 47 3HB LEU 47 7.156 -2.942 -2.535 301 HG LEU 47 HG LEU 47 8.245 -5.025 -0.634 302 HD11 LEU 47 1HD1 LEU 47 6.041 -4.906 0.408 303 HD12 LEU 47 2HD1 LEU 47 5.597 -3.590 -0.675 304 HD13 LEU 47 3HD1 LEU 47 6.882 -3.359 0.509 305 HD21 LEU 47 3HD2 LEU 47 6.040 -5.137 -2.690 306 HD22 LEU 47 1HD2 LEU 47 6.373 -6.387 -1.492 307 HD23 LEU 47 2HD2 LEU 47 7.568 -6.013 -2.733 308 H ASN 48 H ASN 48 8.523 -3.023 -5.386 309 HA ASN 48 HA ASN 48 9.541 -0.334 -5.042 310 HB2 ASN 48 2HB ASN 48 10.812 -0.519 -7.225 311 HB3 ASN 48 3HB ASN 48 11.518 -1.362 -5.856 312 HD21 ASN 48 1HD2 ASN 48 12.612 -2.922 -6.876 313 HD22 ASN 48 2HD2 ASN 48 11.907 -4.135 -7.881 314 H GLY 49 H GLY 49 8.714 1.184 -6.433 315 HA2 GLY 49 2HA GLY 49 7.288 0.877 -8.742 316 HA3 GLY 49 3HA GLY 49 6.114 0.564 -7.473 317 H THR 50 H THR 50 4.873 2.364 -7.680 318 HA THR 50 HA THR 50 6.212 4.897 -7.028 319 HB THR 50 HB THR 50 4.616 6.072 -8.581 320 HG1 THR 50 HG1 THR 50 3.884 3.423 -9.041 321 HG21 THR 50 3HG2 THR 50 6.498 4.091 -9.881 322 HG22 THR 50 1HG2 THR 50 6.950 5.673 -9.244 323 HG23 THR 50 2HG2 THR 50 5.868 5.558 -10.631 324 H MET 51 H MET 51 4.981 6.429 -5.821 325 HA MET 51 HA MET 51 2.388 5.513 -4.809 326 HB2 MET 51 2HB MET 51 4.750 6.780 -3.466 327 HB3 MET 51 3HB MET 51 3.136 7.073 -2.851 328 HG2 MET 51 2HG MET 51 2.838 4.757 -2.355 329 HG3 MET 51 3HG MET 51 4.349 4.329 -3.150 330 HE1 MET 51 3HE MET 51 2.939 6.804 -0.432 331 HE2 MET 51 1HE MET 51 4.265 7.680 -1.192 332 HE3 MET 51 2HE MET 51 4.404 7.157 0.484 333 H THR 52 H THR 52 0.856 7.219 -4.447 334 HA THR 52 HA THR 52 1.656 9.858 -5.485 335 HB THR 52 HB THR 52 -1.046 8.581 -5.965 336 HG1 THR 52 HG1 THR 52 1.308 8.202 -7.217 337 HG21 THR 52 3HG2 THR 52 -1.333 10.434 -7.554 338 HG22 THR 52 1HG2 THR 52 0.257 11.058 -7.109 339 HG23 THR 52 2HG2 THR 52 -1.048 11.034 -5.921 340 H TYR 53 H TYR 53 1.344 11.415 -4.036 341 HA TYR 53 HA TYR 53 -0.216 10.914 -1.645 342 HB2 TYR 53 2HB TYR 53 1.472 13.275 -2.482 343 HB3 TYR 53 3HB TYR 53 0.582 13.203 -0.976 344 HD1 TYR 53 HD2 TYR 53 1.146 11.104 0.537 345 HD2 TYR 53 HD1 TYR 53 3.682 12.639 -2.513 346 HE1 TYR 53 HE2 TYR 53 3.093 10.058 1.634 347 HE2 TYR 53 HE1 TYR 53 5.628 11.605 -1.427 348 HH TYR 53 HH TYR 53 6.271 10.859 0.847 349 H ALA 54 H ALA 54 -1.683 12.629 -0.853 350 HA ALA 54 HA ALA 54 -3.742 13.100 -2.738 351 HB1 ALA 54 3HB ALA 54 -3.416 14.298 0.013 352 HB2 ALA 54 1HB ALA 54 -4.153 12.733 -0.337 353 HB3 ALA 54 2HB ALA 54 -4.903 14.217 -0.929 354 H GLY 55 H GLY 55 -3.283 14.439 -4.399 355 HA2 GLY 55 2HA GLY 55 -3.532 16.658 -5.216 356 HA3 GLY 55 3HA GLY 55 -2.901 17.254 -3.692 357 H GLU 56 H GLU 56 -0.912 14.791 -4.528 358 HA GLU 56 HA GLU 56 0.937 16.640 -5.885 359 HB2 GLU 56 2HB GLU 56 1.537 14.304 -4.077 360 HB3 GLU 56 3HB GLU 56 2.756 15.202 -4.961 361 HG2 GLU 56 2HG GLU 56 0.921 16.362 -2.879 362 HG3 GLU 56 3HG GLU 56 2.599 15.884 -2.616 363 H GLY 57 H GLY 57 2.760 15.200 -7.011 364 HA2 GLY 57 2HA GLY 57 1.293 13.561 -8.932 365 HA3 GLY 57 3HA GLY 57 2.900 14.240 -9.160 366 HA PRO 58 HA PRO 58 2.995 9.665 -7.792 367 HB2 PRO 58 2HB PRO 58 4.105 9.230 -10.496 368 HB3 PRO 58 3HB PRO 58 2.862 8.323 -9.627 369 HG2 PRO 58 2HG PRO 58 2.246 9.908 -11.700 370 HG3 PRO 58 3HG PRO 58 1.162 9.734 -10.307 371 HD2 PRO 58 2HD PRO 58 3.052 11.967 -10.966 372 HD3 PRO 58 3HD PRO 58 1.405 12.036 -10.302 373 H ILE 59 H ILE 59 4.810 8.905 -6.896 374 HA ILE 59 HA ILE 59 7.423 9.889 -7.839 375 HB ILE 59 HB ILE 59 8.203 10.056 -5.514 376 HG12 ILE 59 2HG1 ILE 59 5.316 9.634 -4.721 377 HG13 ILE 59 3HG1 ILE 59 6.577 8.416 -4.574 378 HG21 ILE 59 1HG2 ILE 59 7.396 12.081 -6.584 379 HG22 ILE 59 2HG2 ILE 59 6.985 12.100 -4.869 380 HG23 ILE 59 3HG2 ILE 59 5.748 11.721 -6.069 381 HD11 ILE 59 3HD1 ILE 59 6.506 11.075 -3.182 382 HD12 ILE 59 1HD1 ILE 59 7.783 9.867 -3.040 383 HD13 ILE 59 2HD1 ILE 59 6.157 9.503 -2.457 384 H GLY 60 H GLY 60 9.220 8.520 -6.812 385 HA2 GLY 60 2HA GLY 60 8.581 5.749 -7.378 386 HA3 GLY 60 3HA GLY 60 10.177 6.400 -7.031 387 H PHE 61 H PHE 61 8.811 4.019 -5.960 388 HA PHE 61 HA PHE 61 9.102 4.660 -3.117 389 HB2 PHE 61 2HB PHE 61 6.742 4.685 -3.397 390 HB3 PHE 61 3HB PHE 61 6.770 3.291 -4.456 391 HD1 PHE 61 HD1 PHE 61 8.581 3.365 -1.233 392 HD2 PHE 61 HD2 PHE 61 5.079 2.134 -3.290 393 HE1 PHE 61 HE1 PHE 61 7.981 1.911 0.651 394 HE2 PHE 61 HE2 PHE 61 4.475 0.675 -1.406 395 HZ PHE 61 HZ PHE 61 5.932 0.562 0.570 396 H ARG 62 H ARG 62 10.330 3.293 -2.051 397 HA ARG 62 HA ARG 62 10.673 0.545 -3.039 398 HB2 ARG 62 2HB ARG 62 12.645 1.855 -3.826 399 HB3 ARG 62 3HB ARG 62 13.009 2.267 -2.154 400 HG2 ARG 62 2HG ARG 62 13.332 -0.102 -1.636 401 HG3 ARG 62 3HG ARG 62 12.967 -0.519 -3.309 402 HD2 ARG 62 2HD ARG 62 15.334 -0.546 -3.044 403 HD3 ARG 62 3HD ARG 62 14.918 0.875 -3.997 404 HE ARG 62 HE ARG 62 15.056 1.643 -1.306 405 HH11 ARG 62 1HH1 ARG 62 17.187 0.499 -3.844 406 HH12 ARG 62 2HH1 ARG 62 18.596 1.266 -3.196 407 HH21 ARG 62 1HH2 ARG 62 16.918 2.675 -0.442 408 HH22 ARG 62 2HH2 ARG 62 18.439 2.512 -1.263 409 H ALA 63 H ALA 63 10.668 -0.975 -1.463 410 HA ALA 63 HA ALA 63 11.030 -0.087 1.305 411 HB1 ALA 63 3HB ALA 63 8.599 -0.128 0.699 412 HB2 ALA 63 1HB ALA 63 9.051 -1.147 2.066 413 HB3 ALA 63 2HB ALA 63 8.758 -1.873 0.490 414 H THR 64 H THR 64 11.808 -1.614 2.711 415 HA THR 64 HA THR 64 12.570 -4.230 1.566 416 HB THR 64 HB THR 64 14.229 -2.535 3.459 417 HG1 THR 64 HG1 THR 64 14.104 -1.850 1.189 418 HG21 THR 64 3HG2 THR 64 14.537 -4.962 3.793 419 HG22 THR 64 1HG2 THR 64 15.974 -4.219 3.094 420 HG23 THR 64 2HG2 THR 64 14.878 -5.146 2.074 421 H LEU 65 H LEU 65 12.030 -5.978 2.792 422 HA LEU 65 HA LEU 65 10.351 -5.572 5.066 423 HB2 LEU 65 2HB LEU 65 9.927 -7.352 3.462 424 HB3 LEU 65 3HB LEU 65 11.455 -8.106 3.866 425 HG LEU 65 HG LEU 65 10.615 -8.537 6.154 426 HD11 LEU 65 1HD1 LEU 65 8.018 -7.443 5.085 427 HD12 LEU 65 2HD1 LEU 65 9.012 -6.729 6.354 428 HD13 LEU 65 3HD1 LEU 65 8.219 -8.280 6.624 429 HD21 LEU 65 3HD2 LEU 65 8.901 -9.595 3.913 430 HD22 LEU 65 1HD2 LEU 65 9.008 -10.294 5.526 431 HD23 LEU 65 2HD2 LEU 65 10.428 -10.272 4.483 432 H LEU 66 H LEU 66 11.003 -5.224 7.030 433 HA LEU 66 HA LEU 66 13.582 -6.189 7.980 434 HB2 LEU 66 2HB LEU 66 11.437 -4.588 9.384 435 HB3 LEU 66 3HB LEU 66 13.008 -4.970 10.061 436 HG LEU 66 HG LEU 66 12.507 -3.233 7.642 437 HD11 LEU 66 1HD1 LEU 66 13.392 -2.539 10.434 438 HD12 LEU 66 2HD1 LEU 66 11.827 -2.170 9.709 439 HD13 LEU 66 3HD1 LEU 66 13.292 -1.421 9.074 440 HD21 LEU 66 3HD2 LEU 66 15.072 -3.935 9.066 441 HD22 LEU 66 1HD2 LEU 66 14.905 -2.734 7.785 442 HD23 LEU 66 2HD2 LEU 66 14.606 -4.436 7.439 443 H GLY 67 H GLY 67 10.209 -6.893 8.255 444 HA2 GLY 67 2HA GLY 67 9.914 -9.379 8.790 445 HA3 GLY 67 3HA GLY 67 10.735 -8.956 10.290 446 H ASN 68 H ASN 68 8.196 -10.072 10.391 447 HA ASN 68 HA ASN 68 6.146 -9.785 11.294 448 HB2 ASN 68 2HB ASN 68 7.509 -7.328 12.393 449 HB3 ASN 68 3HB ASN 68 5.849 -7.738 12.808 450 HD21 ASN 68 1HD2 ASN 68 9.184 -8.502 13.260 451 HD22 ASN 68 2HD2 ASN 68 8.951 -9.673 14.506 452 H ASN 69 H ASN 69 6.486 -8.991 8.629 453 HA ASN 69 HA ASN 69 5.325 -8.040 6.912 454 HB2 ASN 69 2HB ASN 69 3.315 -7.384 9.091 455 HB3 ASN 69 3HB ASN 69 3.013 -7.199 7.368 456 HD21 ASN 69 1HD2 ASN 69 4.336 -9.636 6.559 457 HD22 ASN 69 2HD2 ASN 69 3.360 -10.944 7.117 458 H SER 70 H SER 70 7.072 -6.398 8.894 459 HA SER 70 HA SER 70 6.101 -3.726 8.210 460 HB2 SER 70 2HB SER 70 8.294 -4.526 10.126 461 HB3 SER 70 3HB SER 70 7.591 -2.916 9.937 462 HG SER 70 HG SER 70 5.832 -5.015 10.465 463 H TYR 71 H TYR 71 7.033 -2.578 6.692 464 HA TYR 71 HA TYR 71 9.618 -3.475 5.599 465 HB2 TYR 71 2HB TYR 71 7.336 -2.047 4.214 466 HB3 TYR 71 3HB TYR 71 8.873 -2.481 3.475 467 HD1 TYR 71 HD1 TYR 71 5.681 -3.777 4.752 468 HD2 TYR 71 HD2 TYR 71 9.325 -4.729 2.787 469 HE1 TYR 71 HE1 TYR 71 4.744 -5.947 4.079 470 HE2 TYR 71 HE2 TYR 71 8.398 -6.895 2.106 471 HH TYR 71 HH TYR 71 5.339 -7.629 1.976 472 H GLU 72 H GLU 72 11.210 -1.964 5.286 473 HA GLU 72 HA GLU 72 10.733 0.672 6.423 474 HB2 GLU 72 2HB GLU 72 12.778 -0.634 7.031 475 HB3 GLU 72 3HB GLU 72 13.317 -0.499 5.363 476 HG2 GLU 72 2HG GLU 72 13.527 1.879 5.562 477 HG3 GLU 72 3HG GLU 72 12.770 1.861 7.153 478 H VAL 73 H VAL 73 10.210 2.315 5.207 479 HA VAL 73 HA VAL 73 10.234 1.995 2.311 480 HB VAL 73 HB VAL 73 8.579 3.682 4.179 481 HG11 VAL 73 1HG1 VAL 73 8.543 3.655 1.169 482 HG12 VAL 73 2HG1 VAL 73 8.881 5.026 2.222 483 HG13 VAL 73 3HG1 VAL 73 7.261 4.330 2.172 484 HG21 VAL 73 3HG2 VAL 73 6.728 2.290 3.250 485 HG22 VAL 73 1HG2 VAL 73 7.915 1.388 4.192 486 HG23 VAL 73 2HG2 VAL 73 7.945 1.307 2.436 487 H GLU 74 H GLU 74 11.289 3.262 0.996 488 HA GLU 74 HA GLU 74 12.187 5.926 1.843 489 HB2 GLU 74 2HB GLU 74 13.722 3.904 0.184 490 HB3 GLU 74 3HB GLU 74 14.165 5.599 0.324 491 HG2 GLU 74 2HG GLU 74 14.520 5.306 2.723 492 HG3 GLU 74 3HG GLU 74 14.069 3.606 2.578 493 H ASN 75 H ASN 75 11.523 7.491 0.407 494 HA ASN 75 HA ASN 75 10.298 6.513 -2.071 495 HB2 ASN 75 2HB ASN 75 9.571 8.864 -0.338 496 HB3 ASN 75 3HB ASN 75 8.960 8.667 -1.978 497 HD21 ASN 75 1HD2 ASN 75 7.430 8.723 0.452 498 HD22 ASN 75 2HD2 ASN 75 6.628 7.200 0.563 499 H GLN 76 H GLN 76 10.582 7.562 -3.993 500 HA GLN 76 HA GLN 76 13.001 9.210 -4.188 501 HB2 GLN 76 2HB GLN 76 13.310 7.147 -5.254 502 HB3 GLN 76 3HB GLN 76 11.680 7.127 -5.890 503 HG2 GLN 76 2HG GLN 76 12.458 9.170 -7.276 504 HG3 GLN 76 3HG GLN 76 14.079 8.590 -6.885 505 HE21 GLN 76 1HE2 GLN 76 14.747 6.596 -7.667 506 HE22 GLN 76 2HE2 GLN 76 13.919 5.785 -8.955 507 H TRP 77 H TRP 77 12.636 11.302 -4.773 508 HA TRP 77 HA TRP 77 10.648 11.787 -6.841 509 HB2 TRP 77 2HB TRP 77 9.982 13.931 -5.679 510 HB3 TRP 77 3HB TRP 77 9.431 12.456 -4.901 511 HD1 TRP 77 HD1 TRP 77 12.263 15.088 -4.491 512 HE1 TRP 77 HE1 TRP 77 12.795 15.293 -1.986 513 HE3 TRP 77 HE3 TRP 77 9.151 11.442 -2.703 514 HZ2 TRP 77 HZ2 TRP 77 11.999 14.077 0.431 515 HZ3 TRP 77 HZ3 TRP 77 9.093 11.028 -0.279 516 HH2 TRP 77 HH2 TRP 77 10.486 12.321 1.258 517 H GLY 78 H GLY 78 11.022 13.733 -8.074 518 HA2 GLY 78 2HA GLY 78 12.415 15.651 -8.562 519 HA3 GLY 78 3HA GLY 78 13.745 14.815 -7.774 520 H GLY 79 H GLY 79 12.468 12.375 -9.335 521 HA2 GLY 79 2HA GLY 79 12.490 12.364 -11.950 522 HA3 GLY 79 3HA GLY 79 14.188 12.732 -11.665 523 H ASP 80 H ASP 80 13.624 10.463 -13.056 524 HA ASP 80 HA ASP 80 13.330 8.153 -11.519 525 HB2 ASP 80 2HB ASP 80 14.049 6.936 -13.408 526 HB3 ASP 80 3HB ASP 80 13.290 8.377 -14.082 527 H SER 81 H SER 81 14.868 6.633 -10.836 528 HA SER 81 HA SER 81 16.698 5.918 -9.743 529 HB2 SER 81 2HB SER 81 18.229 8.023 -11.308 530 HB3 SER 81 3HB SER 81 18.908 6.607 -10.502 531 HG SER 81 HG SER 81 17.202 6.682 -12.785 532 H ALA 82 H ALA 82 18.170 9.090 -9.900 533 HA ALA 82 HA ALA 82 18.709 10.623 -8.311 534 HB1 ALA 82 3HB ALA 82 16.785 11.599 -7.161 535 HB2 ALA 82 1HB ALA 82 15.820 10.176 -7.547 536 HB3 ALA 82 2HB ALA 82 16.395 11.231 -8.840 537 HA PRO 83 HA PRO 83 19.575 8.968 -4.219 538 HB2 PRO 83 2HB PRO 83 18.664 11.448 -2.911 539 HB3 PRO 83 3HB PRO 83 20.282 10.746 -2.956 540 HG2 PRO 83 2HG PRO 83 19.677 12.986 -4.308 541 HG3 PRO 83 3HG PRO 83 20.827 11.795 -4.938 542 HD2 PRO 83 2HD PRO 83 17.961 12.233 -5.659 543 HD3 PRO 83 3HD PRO 83 19.353 11.899 -6.716 544 H TRP 84 H TRP 84 18.430 7.909 -2.583 545 HA TRP 84 HA TRP 84 15.530 8.137 -2.751 546 HB2 TRP 84 2HB TRP 84 17.343 6.117 -1.430 547 HB3 TRP 84 3HB TRP 84 15.594 6.105 -1.230 548 HD1 TRP 84 HD1 TRP 84 18.332 5.305 -3.755 549 HE1 TRP 84 HE1 TRP 84 17.294 4.008 -5.725 550 HE3 TRP 84 HE3 TRP 84 13.387 5.797 -2.555 551 HZ2 TRP 84 HZ2 TRP 84 14.731 3.291 -6.650 552 HZ3 TRP 84 HZ3 TRP 84 11.707 4.775 -4.035 553 HH2 TRP 84 HH2 TRP 84 12.368 3.548 -6.039 554 H HIS 85 H HIS 85 14.238 8.795 -1.045 555 HA HIS 85 HA HIS 85 15.716 9.986 1.196 556 HB2 HIS 85 2HB HIS 85 13.058 10.774 -0.038 557 HB3 HIS 85 3HB HIS 85 13.775 11.535 1.376 558 HD1 HIS 85 HD1 HIS 85 15.665 13.235 0.973 559 HD2 HIS 85 HD2 HIS 85 14.299 11.421 -2.505 560 HE1 HIS 85 HE1 HIS 85 16.695 14.534 -0.909 561 H SER 86 H SER 86 15.017 9.488 3.283 562 HA SER 86 HA SER 86 13.696 7.012 3.565 563 HB2 SER 86 2HB SER 86 14.233 9.071 5.702 564 HB3 SER 86 3HB SER 86 14.041 7.332 5.919 565 HG SER 86 HG SER 86 16.189 7.581 5.874 566 H GLY 87 H GLY 87 11.628 6.529 4.038 567 HA2 GLY 87 2HA GLY 87 9.751 8.798 4.236 568 HA3 GLY 87 3HA GLY 87 9.353 7.222 3.563 569 H GLY 88 H GLY 88 10.371 5.527 5.453 570 HA2 GLY 88 2HA GLY 88 10.239 5.741 8.072 571 HA3 GLY 88 3HA GLY 88 8.546 6.030 7.690 572 H ASN 89 H ASN 89 8.105 4.112 8.951 573 HA ASN 89 HA ASN 89 8.692 1.657 7.425 574 HB2 ASN 89 2HB ASN 89 8.198 1.970 10.392 575 HB3 ASN 89 3HB ASN 89 8.307 0.418 9.570 576 HD21 ASN 89 1HD2 ASN 89 10.311 -0.263 8.767 577 HD22 ASN 89 2HD2 ASN 89 11.791 0.454 9.299 578 H TRP 90 H TRP 90 7.015 0.531 6.580 579 HA TRP 90 HA TRP 90 4.296 1.236 7.475 580 HB2 TRP 90 2HB TRP 90 5.280 0.480 4.704 581 HB3 TRP 90 3HB TRP 90 3.587 0.629 5.141 582 HD1 TRP 90 HD1 TRP 90 5.880 3.326 6.526 583 HE1 TRP 90 HE1 TRP 90 5.467 5.521 5.260 584 HE3 TRP 90 HE3 TRP 90 2.904 1.559 2.748 585 HZ2 TRP 90 HZ2 TRP 90 4.053 6.396 2.986 586 HZ3 TRP 90 HZ3 TRP 90 2.065 3.141 1.085 587 HH2 TRP 90 HH2 TRP 90 2.630 5.506 1.199 588 H ILE 91 H ILE 91 2.781 -0.499 7.537 589 HA ILE 91 HA ILE 91 4.021 -3.181 7.589 590 HB ILE 91 HB ILE 91 1.555 -2.192 9.044 591 HG12 ILE 91 2HG1 ILE 91 4.215 -3.120 10.153 592 HG13 ILE 91 3HG1 ILE 91 3.751 -1.433 9.965 593 HG21 ILE 91 1HG2 ILE 91 2.835 -4.927 9.051 594 HG22 ILE 91 2HG2 ILE 91 1.260 -4.508 8.380 595 HG23 ILE 91 3HG2 ILE 91 1.532 -4.413 10.122 596 HD11 ILE 91 3HD1 ILE 91 3.468 -2.182 12.262 597 HD12 ILE 91 1HD1 ILE 91 2.365 -3.452 11.725 598 HD13 ILE 91 2HD1 ILE 91 1.915 -1.758 11.539 599 H LEU 92 H LEU 92 3.400 -4.596 6.089 600 HA LEU 92 HA LEU 92 0.846 -4.190 4.663 601 HB2 LEU 92 2HB LEU 92 3.494 -4.660 3.286 602 HB3 LEU 92 3HB LEU 92 1.938 -4.594 2.493 603 HG LEU 92 HG LEU 92 3.262 -2.278 3.914 604 HD11 LEU 92 1HD1 LEU 92 4.448 -2.920 1.888 605 HD12 LEU 92 2HD1 LEU 92 3.613 -1.380 1.676 606 HD13 LEU 92 3HD1 LEU 92 2.940 -2.855 0.977 607 HD21 LEU 92 3HD2 LEU 92 1.509 -0.935 2.859 608 HD22 LEU 92 1HD2 LEU 92 0.829 -2.128 3.966 609 HD23 LEU 92 2HD2 LEU 92 0.764 -2.405 2.226 610 H GLY 93 H GLY 93 0.084 -6.031 5.858 611 HA2 GLY 93 2HA GLY 93 0.006 -8.390 4.446 612 HA3 GLY 93 3HA GLY 93 1.310 -8.597 5.605 613 H SER 94 H SER 94 -2.034 -8.897 5.103 614 HA SER 94 HA SER 94 -2.577 -8.884 7.982 615 HB2 SER 94 2HB SER 94 -4.974 -9.049 7.310 616 HB3 SER 94 3HB SER 94 -4.184 -7.616 6.661 617 HG SER 94 HG SER 94 -5.403 -8.628 5.045 618 H ARG 95 H ARG 95 -1.700 -11.013 5.547 619 HA ARG 95 HA ARG 95 -3.095 -13.225 6.823 620 HB2 ARG 95 2HB ARG 95 -1.675 -13.082 4.171 621 HB3 ARG 95 3HB ARG 95 -2.142 -14.615 4.893 622 HG2 ARG 95 2HG ARG 95 -4.484 -13.853 4.959 623 HG3 ARG 95 3HG ARG 95 -4.005 -12.356 4.165 624 HD2 ARG 95 2HD ARG 95 -3.292 -13.604 2.192 625 HD3 ARG 95 3HD ARG 95 -3.672 -15.127 2.999 626 HE ARG 95 HE ARG 95 -5.913 -13.351 2.888 627 HH11 ARG 95 1HH1 ARG 95 -4.113 -15.672 0.945 628 HH12 ARG 95 2HH1 ARG 95 -5.498 -16.169 0.041 629 HH21 ARG 95 1HH2 ARG 95 -7.752 -14.012 1.653 630 HH22 ARG 95 2HH2 ARG 95 -7.566 -15.237 0.450 631 H GLU 96 H GLU 96 -0.319 -11.644 7.361 632 HA GLU 96 HA GLU 96 1.262 -12.044 8.884 633 HB2 GLU 96 2HB GLU 96 -0.405 -13.471 10.035 634 HB3 GLU 96 3HB GLU 96 0.148 -14.845 9.091 635 HG2 GLU 96 2HG GLU 96 2.370 -14.628 10.116 636 HG3 GLU 96 3HG GLU 96 1.774 -13.285 11.090 637 H ASN 97 H ASN 97 1.184 -15.329 7.589 638 HA ASN 97 HA ASN 97 4.034 -15.072 6.981 639 HB2 ASN 97 2HB ASN 97 2.249 -17.511 7.104 640 HB3 ASN 97 3HB ASN 97 3.965 -17.553 6.723 641 HD21 ASN 97 1HD2 ASN 97 1.612 -17.410 9.191 642 HD22 ASN 97 2HD2 ASN 97 2.691 -17.352 10.534 643 H GLN 98 H GLN 98 2.217 -13.781 5.245 644 HA GLN 98 HA GLN 98 2.608 -15.392 2.810 645 HB2 GLN 98 2HB GLN 98 0.180 -14.842 3.698 646 HB3 GLN 98 3HB GLN 98 0.480 -13.308 2.888 647 HG2 GLN 98 2HG GLN 98 -0.672 -14.756 1.383 648 HG3 GLN 98 3HG GLN 98 0.992 -14.562 0.819 649 HE21 GLN 98 1HE2 GLN 98 1.011 -16.472 -0.323 650 HE22 GLN 98 2HE2 GLN 98 1.016 -18.017 0.456 651 H ASN 99 H ASN 99 2.256 -12.073 4.041 652 HA ASN 99 HA ASN 99 3.399 -10.154 3.648 653 HB2 ASN 99 2HB ASN 99 5.266 -11.935 2.067 654 HB3 ASN 99 3HB ASN 99 5.536 -10.211 2.296 655 HD21 ASN 99 1HD2 ASN 99 7.132 -12.485 3.121 656 HD22 ASN 99 2HD2 ASN 99 7.306 -12.362 4.834 657 H VAL 100 H VAL 100 3.127 -8.449 2.348 658 HA VAL 100 HA VAL 100 1.536 -8.895 -0.043 659 HB VAL 100 HB VAL 100 2.478 -6.334 1.261 660 HG11 VAL 100 1HG1 VAL 100 1.052 -5.143 -0.303 661 HG12 VAL 100 2HG1 VAL 100 0.637 -6.656 -1.110 662 HG13 VAL 100 3HG1 VAL 100 2.286 -6.042 -1.184 663 HG21 VAL 100 3HG2 VAL 100 -0.232 -7.619 1.012 664 HG22 VAL 100 1HG2 VAL 100 0.116 -6.084 1.807 665 HG23 VAL 100 2HG2 VAL 100 0.769 -7.586 2.463 666 H VAL 101 H VAL 101 2.148 -8.777 -2.086 667 HA VAL 101 HA VAL 101 4.980 -8.120 -2.599 668 HB VAL 101 HB VAL 101 5.010 -9.624 -4.522 669 HG11 VAL 101 1HG1 VAL 101 4.118 -10.960 -1.984 670 HG12 VAL 101 2HG1 VAL 101 5.752 -10.424 -2.368 671 HG13 VAL 101 3HG1 VAL 101 5.009 -11.722 -3.302 672 HG21 VAL 101 3HG2 VAL 101 2.236 -10.440 -3.656 673 HG22 VAL 101 1HG2 VAL 101 3.202 -11.227 -4.903 674 HG23 VAL 101 2HG2 VAL 101 2.653 -9.568 -5.134 675 H ALA 102 H ALA 102 1.712 -7.528 -3.663 676 HA ALA 102 HA ALA 102 2.788 -5.364 -5.294 677 HB1 ALA 102 3HB ALA 102 0.779 -7.252 -6.510 678 HB2 ALA 102 1HB ALA 102 2.518 -7.358 -6.791 679 HB3 ALA 102 2HB ALA 102 1.629 -5.921 -7.288 680 H ILE 103 H ILE 103 1.425 -3.604 -5.562 681 HA ILE 103 HA ILE 103 -1.224 -3.799 -4.346 682 HB ILE 103 HB ILE 103 0.836 -1.665 -3.724 683 HG12 ILE 103 2HG1 ILE 103 0.991 -3.751 -2.384 684 HG13 ILE 103 3HG1 ILE 103 0.575 -2.342 -1.407 685 HG21 ILE 103 1HG2 ILE 103 -0.874 -0.530 -2.414 686 HG22 ILE 103 2HG2 ILE 103 -2.072 -1.719 -2.929 687 HG23 ILE 103 3HG2 ILE 103 -1.346 -0.633 -4.111 688 HD11 ILE 103 3HD1 ILE 103 -1.788 -3.051 -1.463 689 HD12 ILE 103 1HD1 ILE 103 -0.736 -4.254 -0.719 690 HD13 ILE 103 2HD1 ILE 103 -1.312 -4.488 -2.368 691 H ASN 104 H ASN 104 -2.700 -3.012 -5.608 692 HA ASN 104 HA ASN 104 -2.051 -0.792 -7.440 693 HB2 ASN 104 2HB ASN 104 -2.228 -2.874 -8.742 694 HB3 ASN 104 3HB ASN 104 -3.814 -3.187 -8.052 695 HD21 ASN 104 1HD2 ASN 104 -4.814 -3.220 -10.038 696 HD22 ASN 104 2HD2 ASN 104 -5.054 -1.799 -10.991 697 H VAL 105 H VAL 105 -2.947 0.742 -6.194 698 HA VAL 105 HA VAL 105 -5.852 0.571 -5.759 699 HB VAL 105 HB VAL 105 -5.742 1.453 -3.450 700 HG11 VAL 105 1HG1 VAL 105 -4.285 -1.147 -3.882 701 HG12 VAL 105 2HG1 VAL 105 -6.031 -0.924 -3.755 702 HG13 VAL 105 3HG1 VAL 105 -5.001 -0.626 -2.358 703 HG21 VAL 105 3HG2 VAL 105 -2.778 0.940 -3.681 704 HG22 VAL 105 1HG2 VAL 105 -3.636 1.385 -2.205 705 HG23 VAL 105 2HG2 VAL 105 -3.547 2.522 -3.551 706 H GLU 106 H GLU 106 -7.017 2.430 -5.784 707 HA GLU 106 HA GLU 106 -5.656 5.000 -5.698 708 HB2 GLU 106 2HB GLU 106 -5.607 4.358 -8.095 709 HB3 GLU 106 3HB GLU 106 -7.361 4.223 -8.075 710 HG2 GLU 106 2HG GLU 106 -7.554 6.590 -7.559 711 HG3 GLU 106 3HG GLU 106 -5.801 6.740 -7.523 712 H SER 107 H SER 107 -6.651 5.727 -4.177 713 HA SER 107 HA SER 107 -9.418 6.603 -4.226 714 HB2 SER 107 2HB SER 107 -8.823 4.414 -2.232 715 HB3 SER 107 3HB SER 107 -10.284 5.393 -2.238 716 HG SER 107 HG SER 107 -9.816 4.326 -4.675 717 H GLY 108 H GLY 108 -10.177 7.732 -2.288 718 HA2 GLY 108 2HA GLY 108 -9.580 8.428 -0.027 719 HA3 GLY 108 3HA GLY 108 -7.932 8.592 -0.604 720 H ASP 109 H ASP 109 -10.641 10.204 0.179 721 HA ASP 109 HA ASP 109 -10.610 12.349 -1.707 722 HB2 ASP 109 2HB ASP 109 -11.553 12.279 1.179 723 HB3 ASP 109 3HB ASP 109 -11.858 13.600 0.059 724 H ASP 110 H ASP 110 -9.169 11.741 1.418 725 HA ASP 110 HA ASP 110 -6.921 13.482 0.768 726 HB2 ASP 110 2HB ASP 110 -8.494 14.800 2.226 727 HB3 ASP 110 3HB ASP 110 -8.353 13.552 3.456 728 H GLY 111 H GLY 111 -7.277 10.641 0.648 729 HA2 GLY 111 2HA GLY 111 -5.939 8.815 1.153 730 HA3 GLY 111 3HA GLY 111 -5.117 9.790 2.355 731 H GLN 112 H GLN 112 -8.514 9.729 2.552 732 HA GLN 112 HA GLN 112 -8.551 8.655 5.163 733 HB2 GLN 112 2HB GLN 112 -10.776 9.125 3.187 734 HB3 GLN 112 3HB GLN 112 -11.032 8.676 4.865 735 HG2 GLN 112 2HG GLN 112 -9.994 10.725 5.608 736 HG3 GLN 112 3HG GLN 112 -9.606 11.161 3.945 737 HE21 GLN 112 1HE2 GLN 112 -11.229 12.545 5.954 738 HE22 GLN 112 2HE2 GLN 112 -12.780 12.767 5.222 739 H THR 113 H THR 113 -9.294 7.274 2.016 740 HA THR 113 HA THR 113 -9.259 4.605 3.190 741 HB THR 113 HB THR 113 -11.184 3.973 1.664 742 HG1 THR 113 HG1 THR 113 -12.513 6.170 1.483 743 HG21 THR 113 3HG2 THR 113 -12.923 4.770 3.199 744 HG22 THR 113 1HG2 THR 113 -11.795 5.946 3.875 745 HG23 THR 113 2HG2 THR 113 -11.502 4.217 4.082 746 H LEU 114 H LEU 114 -8.411 3.056 1.860 747 HA LEU 114 HA LEU 114 -7.588 3.907 -0.835 748 HB2 LEU 114 2HB LEU 114 -6.114 2.324 1.242 749 HB3 LEU 114 3HB LEU 114 -5.788 2.033 -0.452 750 HG LEU 114 HG LEU 114 -4.121 3.505 0.446 751 HD11 LEU 114 1HD1 LEU 114 -4.812 3.881 -1.860 752 HD12 LEU 114 2HD1 LEU 114 -4.298 5.380 -1.090 753 HD13 LEU 114 3HD1 LEU 114 -6.016 5.048 -1.315 754 HD21 LEU 114 3HD2 LEU 114 -5.329 4.446 2.321 755 HD22 LEU 114 1HD2 LEU 114 -6.390 5.332 1.225 756 HD23 LEU 114 2HD2 LEU 114 -4.674 5.737 1.313 757 H ASN 115 H ASN 115 -8.472 2.738 -2.429 758 HA ASN 115 HA ASN 115 -9.401 0.026 -1.792 759 HB2 ASN 115 2HB ASN 115 -10.904 2.110 -3.392 760 HB3 ASN 115 3HB ASN 115 -11.368 0.418 -3.266 761 HD21 ASN 115 1HD2 ASN 115 -11.326 3.490 -1.740 762 HD22 ASN 115 2HD2 ASN 115 -12.270 3.062 -0.358 763 H GLY 116 H GLY 116 -9.359 -1.448 -3.453 764 HA2 GLY 116 2HA GLY 116 -9.054 -1.184 -6.102 765 HA3 GLY 116 3HA GLY 116 -7.430 -0.837 -5.530 766 H THR 117 H THR 117 -6.236 -2.514 -5.922 767 HA THR 117 HA THR 117 -7.198 -5.159 -5.111 768 HB THR 117 HB THR 117 -5.916 -6.099 -7.093 769 HG1 THR 117 HG1 THR 117 -5.656 -3.368 -7.543 770 HG21 THR 117 3HG2 THR 117 -8.346 -4.382 -7.633 771 HG22 THR 117 1HG2 THR 117 -8.346 -6.060 -7.087 772 HG23 THR 117 2HG2 THR 117 -7.749 -5.656 -8.697 773 H MET 118 H MET 118 -5.517 -6.665 -4.626 774 HA MET 118 HA MET 118 -2.842 -5.601 -4.185 775 HB2 MET 118 2HB MET 118 -2.881 -6.385 -1.826 776 HB3 MET 118 3HB MET 118 -3.949 -5.018 -2.123 777 HG2 MET 118 2HG MET 118 -5.874 -6.483 -2.173 778 HG3 MET 118 3HG MET 118 -4.826 -7.891 -2.017 779 HE1 MET 118 3HE MET 118 -3.638 -8.629 0.094 780 HE2 MET 118 1HE MET 118 -3.481 -7.652 1.549 781 HE3 MET 118 2HE MET 118 -2.713 -7.130 0.052 782 H THR 119 H THR 119 -1.296 -7.274 -3.804 783 HA THR 119 HA THR 119 -2.303 -9.992 -4.305 784 HB THR 119 HB THR 119 0.136 -8.826 -5.665 785 HG1 THR 119 HG1 THR 119 -1.355 -9.136 -7.570 786 HG21 THR 119 3HG2 THR 119 0.240 -11.246 -5.332 787 HG22 THR 119 1HG2 THR 119 0.018 -10.859 -7.038 788 HG23 THR 119 2HG2 THR 119 -1.349 -11.428 -6.080 789 H TYR 120 H TYR 120 -1.478 -11.491 -3.004 790 HA TYR 120 HA TYR 120 0.770 -10.837 -1.251 791 HB2 TYR 120 2HB TYR 120 -1.368 -12.939 -1.191 792 HB3 TYR 120 3HB TYR 120 0.115 -13.162 -0.281 793 HD1 TYR 120 HD2 TYR 120 0.756 -11.342 1.376 794 HD2 TYR 120 HD1 TYR 120 -3.132 -11.712 -0.284 795 HE1 TYR 120 HE2 TYR 120 -0.140 -10.038 3.235 796 HE2 TYR 120 HE1 TYR 120 -4.052 -10.407 1.587 797 HH TYR 120 HH TYR 120 -3.545 -9.677 3.766 798 H ALA 121 H ALA 121 2.402 -12.535 -0.848 799 HA ALA 121 HA ALA 121 3.592 -13.392 -3.252 800 HB1 ALA 121 3HB ALA 121 5.163 -14.633 -1.844 801 HB2 ALA 121 1HB ALA 121 4.106 -14.394 -0.453 802 HB3 ALA 121 2HB ALA 121 4.887 -13.009 -1.217 803 H GLY 122 H GLY 122 3.315 -15.135 -4.462 804 HA2 GLY 122 2HA GLY 122 2.680 -17.229 -5.157 805 HA3 GLY 122 3HA GLY 122 2.527 -17.680 -3.468 806 H GLU 123 H GLU 123 0.671 -14.946 -4.393 807 HA GLU 123 HA GLU 123 -1.695 -16.654 -4.717 808 HB2 GLU 123 2HB GLU 123 -1.444 -14.176 -3.024 809 HB3 GLU 123 3HB GLU 123 -2.981 -14.907 -3.455 810 HG2 GLU 123 2HG GLU 123 -2.298 -16.974 -2.310 811 HG3 GLU 123 3HG GLU 123 -0.784 -16.196 -1.846 812 H GLY 124 H GLY 124 -3.636 -15.086 -5.330 813 HA2 GLY 124 2HA GLY 124 -2.704 -13.610 -7.696 814 HA3 GLY 124 3HA GLY 124 -4.295 -14.341 -7.514 815 HA PRO 125 HA PRO 125 -4.228 -9.722 -6.291 816 HB2 PRO 125 2HB PRO 125 -6.038 -9.426 -8.604 817 HB3 PRO 125 3HB PRO 125 -4.640 -8.452 -8.150 818 HG2 PRO 125 2HG PRO 125 -4.560 -10.110 -10.256 819 HG3 PRO 125 3HG PRO 125 -3.144 -9.864 -9.219 820 HD2 PRO 125 2HD PRO 125 -5.101 -12.134 -9.252 821 HD3 PRO 125 3HD PRO 125 -3.333 -12.179 -9.090 822 H ILE 126 H ILE 126 -5.711 -9.109 -4.853 823 HA ILE 126 HA ILE 126 -8.487 -10.035 -5.151 824 HB ILE 126 HB ILE 126 -8.680 -10.359 -2.725 825 HG12 ILE 126 2HG1 ILE 126 -5.679 -9.976 -2.618 826 HG13 ILE 126 3HG1 ILE 126 -6.847 -8.778 -2.073 827 HG21 ILE 126 1HG2 ILE 126 -7.389 -12.444 -2.544 828 HG22 ILE 126 2HG2 ILE 126 -6.436 -11.970 -3.952 829 HG23 ILE 126 3HG2 ILE 126 -8.163 -12.288 -4.121 830 HD11 ILE 126 3HD1 ILE 126 -5.938 -10.013 -0.193 831 HD12 ILE 126 1HD1 ILE 126 -6.453 -11.535 -0.921 832 HD13 ILE 126 2HD1 ILE 126 -7.653 -10.362 -0.381 833 H GLY 127 H GLY 127 -10.006 -8.705 -3.761 834 HA2 GLY 127 2HA GLY 127 -9.540 -5.936 -4.353 835 HA3 GLY 127 3HA GLY 127 -10.949 -6.602 -3.543 836 H PHE 128 H PHE 128 -8.840 -4.328 -3.102 837 HA PHE 128 HA PHE 128 -8.342 -4.904 -0.261 838 HB2 PHE 128 2HB PHE 128 -6.266 -4.611 -1.477 839 HB3 PHE 128 3HB PHE 128 -6.846 -3.101 -2.170 840 HD1 PHE 128 HD2 PHE 128 -5.919 -4.718 1.040 841 HD2 PHE 128 HD1 PHE 128 -6.499 -1.072 -1.066 842 HE1 PHE 128 HE2 PHE 128 -4.945 -3.481 2.924 843 HE2 PHE 128 HE1 PHE 128 -5.523 0.175 0.813 844 HZ PHE 128 HZ PHE 128 -4.746 -1.030 2.814 845 H LYS 129 H LYS 129 -9.231 -3.624 1.219 846 HA LYS 129 HA LYS 129 -10.153 -0.956 0.468 847 HB2 LYS 129 2HB LYS 129 -12.114 -2.367 0.361 848 HB3 LYS 129 3HB LYS 129 -11.757 -3.053 1.939 849 HG2 LYS 129 2HG LYS 129 -12.211 -0.916 2.994 850 HG3 LYS 129 3HG LYS 129 -12.484 -0.176 1.415 851 HD2 LYS 129 2HD LYS 129 -14.354 -1.706 1.020 852 HD3 LYS 129 3HD LYS 129 -14.088 -2.440 2.600 853 HE2 LYS 129 2HE LYS 129 -14.726 0.469 2.171 854 HE3 LYS 129 3HE LYS 129 -15.937 -0.766 2.520 855 HZ1 LYS 129 3HZ LYS 129 -15.371 0.266 4.552 856 HZ2 LYS 129 1HZ LYS 129 -13.709 0.105 4.273 857 HZ3 LYS 129 2HZ LYS 129 -14.651 -1.267 4.570 858 H GLY 130 H GLY 130 -8.697 0.177 1.632 859 HA2 GLY 130 2HA GLY 130 -8.301 -0.547 4.458 860 HA3 GLY 130 3HA GLY 130 -7.191 0.421 3.493 861 H THR 131 H THR 131 -8.954 0.749 6.023 862 HA THR 131 HA THR 131 -9.850 3.466 5.306 863 HB THR 131 HB THR 131 -11.312 1.579 7.173 864 HG1 THR 131 HG1 THR 131 -11.378 1.920 4.487 865 HG21 THR 131 3HG2 THR 131 -13.060 3.295 7.178 866 HG22 THR 131 1HG2 THR 131 -12.066 4.326 6.150 867 HG23 THR 131 2HG2 THR 131 -11.545 3.958 7.792 868 H LEU 132 H LEU 132 -9.260 5.071 6.693 869 HA LEU 132 HA LEU 132 -7.307 4.708 8.667 870 HB2 LEU 132 2HB LEU 132 -9.290 6.956 8.302 871 HB3 LEU 132 3HB LEU 132 -8.014 6.999 9.498 872 HG LEU 132 HG LEU 132 -7.542 6.775 6.529 873 HD11 LEU 132 1HD1 LEU 132 -8.614 8.909 7.160 874 HD12 LEU 132 2HD1 LEU 132 -6.954 9.123 6.605 875 HD13 LEU 132 3HD1 LEU 132 -7.322 9.191 8.324 876 HD21 LEU 132 3HD2 LEU 132 -5.706 7.311 8.863 877 HD22 LEU 132 1HD2 LEU 132 -5.250 7.421 7.163 878 HD23 LEU 132 2HD2 LEU 132 -5.730 5.868 7.841 879 H THR 133 H THR 133 -7.342 4.288 10.810 880 HA THR 133 HA THR 133 -9.964 3.675 11.967 881 HB THR 133 HB THR 133 -7.242 2.604 12.740 882 HG1 THR 133 HG1 THR 133 -8.515 2.013 10.663 883 HG21 THR 133 3HG2 THR 133 -8.535 0.988 14.075 884 HG22 THR 133 1HG2 THR 133 -10.025 1.826 13.641 885 HG23 THR 133 2HG2 THR 133 -8.808 2.643 14.625 Start of MODEL 15 1 H1 ALA 2 1H ALA 2 0.963 7.551 9.595 2 H2 ALA 2 2H ALA 2 0.680 6.234 8.566 3 H3 ALA 2 3H ALA 2 1.200 5.974 10.156 4 HA ALA 2 HA ALA 2 -0.846 6.855 11.014 5 HB1 ALA 2 3HB ALA 2 -2.686 7.362 9.487 6 HB2 ALA 2 1HB ALA 2 -1.623 7.089 8.106 7 HB3 ALA 2 2HB ALA 2 -1.311 8.431 9.211 8 H LEU 3 H LEU 3 -2.660 5.465 11.341 9 HA LEU 3 HA LEU 3 -2.097 2.738 10.426 10 HB2 LEU 3 2HB LEU 3 -2.191 3.361 12.890 11 HB3 LEU 3 3HB LEU 3 -3.907 3.612 12.684 12 HG LEU 3 HG LEU 3 -3.280 1.441 13.745 13 HD11 LEU 3 1HD1 LEU 3 -4.805 0.047 12.422 14 HD12 LEU 3 2HD1 LEU 3 -4.780 1.257 11.141 15 HD13 LEU 3 3HD1 LEU 3 -5.450 1.659 12.723 16 HD21 LEU 3 3HD2 LEU 3 -1.259 1.008 12.433 17 HD22 LEU 3 1HD2 LEU 3 -2.254 0.746 11.000 18 HD23 LEU 3 2HD2 LEU 3 -2.385 -0.350 12.375 19 H TYR 4 H TYR 4 -3.476 1.615 9.173 20 HA TYR 4 HA TYR 4 -6.098 2.832 8.567 21 HB2 TYR 4 2HB TYR 4 -4.232 1.379 6.675 22 HB3 TYR 4 3HB TYR 4 -5.859 1.901 6.273 23 HD1 TYR 4 HD1 TYR 4 -2.470 3.084 7.139 24 HD2 TYR 4 HD2 TYR 4 -6.288 4.150 5.600 25 HE1 TYR 4 HE1 TYR 4 -1.560 5.236 6.388 26 HE2 TYR 4 HE2 TYR 4 -5.380 6.314 4.846 27 HH TYR 4 HH TYR 4 -3.498 7.823 5.372 28 H ASN 5 H ASN 5 -7.831 1.448 8.319 29 HA ASN 5 HA ASN 5 -7.579 -1.204 9.511 30 HB2 ASN 5 2HB ASN 5 -9.972 0.330 8.443 31 HB3 ASN 5 3HB ASN 5 -10.079 -1.282 9.137 32 HD21 ASN 5 1HD2 ASN 5 -8.105 -0.782 11.199 33 HD22 ASN 5 2HD2 ASN 5 -8.865 0.256 12.354 34 H VAL 6 H VAL 6 -7.887 -3.164 8.378 35 HA VAL 6 HA VAL 6 -7.790 -2.820 5.457 36 HB VAL 6 HB VAL 6 -6.398 -4.846 7.199 37 HG11 VAL 6 1HG1 VAL 6 -6.576 -4.788 4.182 38 HG12 VAL 6 2HG1 VAL 6 -7.218 -6.034 5.248 39 HG13 VAL 6 3HG1 VAL 6 -5.476 -5.799 5.115 40 HG21 VAL 6 3HG2 VAL 6 -4.386 -3.896 6.207 41 HG22 VAL 6 1HG2 VAL 6 -5.343 -2.663 7.028 42 HG23 VAL 6 2HG2 VAL 6 -5.373 -2.779 5.267 43 H GLU 7 H GLU 7 -9.293 -3.641 4.297 44 HA GLU 7 HA GLU 7 -10.713 -6.062 5.155 45 HB2 GLU 7 2HB GLU 7 -11.822 -3.617 3.744 46 HB3 GLU 7 3HB GLU 7 -12.702 -5.128 3.922 47 HG2 GLU 7 2HG GLU 7 -12.689 -4.876 6.332 48 HG3 GLU 7 3HG GLU 7 -11.728 -3.407 6.192 49 H ASN 8 H ASN 8 -10.737 -7.642 3.607 50 HA ASN 8 HA ASN 8 -9.724 -6.909 0.935 51 HB2 ASN 8 2HB ASN 8 -8.951 -9.291 2.632 52 HB3 ASN 8 3HB ASN 8 -8.620 -9.195 0.909 53 HD21 ASN 8 1HD2 ASN 8 -8.038 -6.343 0.982 54 HD22 ASN 8 2HD2 ASN 8 -6.492 -6.184 1.736 55 H GLN 9 H GLN 9 -10.601 -8.005 -0.814 56 HA GLN 9 HA GLN 9 -12.907 -9.730 -0.177 57 HB2 GLN 9 2HB GLN 9 -13.587 -7.535 -1.102 58 HB3 GLN 9 3HB GLN 9 -12.623 -7.858 -2.536 59 HG2 GLN 9 2HG GLN 9 -14.031 -9.815 -3.023 60 HG3 GLN 9 3HG GLN 9 -15.021 -9.425 -1.618 61 HE21 GLN 9 1HE2 GLN 9 -15.798 -9.609 -4.392 62 HE22 GLN 9 2HE2 GLN 9 -16.433 -8.059 -4.836 63 H TRP 10 H TRP 10 -12.613 -11.736 -0.792 64 HA TRP 10 HA TRP 10 -10.528 -12.473 -2.628 65 HB2 TRP 10 2HB TRP 10 -12.519 -13.992 -0.965 66 HB3 TRP 10 3HB TRP 10 -11.586 -14.818 -2.204 67 HD1 TRP 10 HD1 TRP 10 -9.452 -15.876 -1.333 68 HE1 TRP 10 HE1 TRP 10 -7.852 -15.500 0.638 69 HE3 TRP 10 HE3 TRP 10 -11.618 -11.725 0.718 70 HZ2 TRP 10 HZ2 TRP 10 -7.534 -13.704 2.763 71 HZ3 TRP 10 HZ3 TRP 10 -10.591 -10.739 2.715 72 HH2 TRP 10 HH2 TRP 10 -8.594 -11.709 3.724 73 H GLY 11 H GLY 11 -10.753 -13.300 -4.711 74 HA2 GLY 11 2HA GLY 11 -11.907 -14.021 -6.581 75 HA3 GLY 11 3HA GLY 11 -13.424 -13.647 -5.775 76 H GLY 12 H GLY 12 -12.939 -11.001 -5.048 77 HA2 GLY 12 2HA GLY 12 -12.803 -8.832 -5.880 78 HA3 GLY 12 3HA GLY 12 -12.097 -9.480 -7.356 79 H SER 13 H SER 13 -15.010 -10.807 -6.176 80 HA SER 13 HA SER 13 -16.848 -9.190 -7.614 81 HB2 SER 13 2HB SER 13 -17.437 -10.927 -9.365 82 HB3 SER 13 3HB SER 13 -15.905 -10.090 -9.613 83 HG SER 13 HG SER 13 -16.363 -12.724 -9.290 84 H SER 14 H SER 14 -18.862 -9.512 -6.841 85 HA SER 14 HA SER 14 -20.534 -10.308 -5.544 86 HB2 SER 14 2HB SER 14 -21.290 -12.616 -6.156 87 HB3 SER 14 3HB SER 14 -20.960 -11.589 -7.552 88 HG SER 14 HG SER 14 -18.734 -12.922 -6.787 89 H ALA 15 H ALA 15 -18.306 -10.128 -3.963 90 HA ALA 15 HA ALA 15 -18.675 -12.413 -2.188 91 HB1 ALA 15 3HB ALA 15 -16.301 -12.659 -1.799 92 HB2 ALA 15 1HB ALA 15 -15.956 -11.351 -2.933 93 HB3 ALA 15 2HB ALA 15 -16.659 -12.859 -3.515 94 HA PRO 16 HA PRO 16 -18.810 -9.202 0.905 95 HB2 PRO 16 2HB PRO 16 -18.088 -11.236 2.888 96 HB3 PRO 16 3HB PRO 16 -19.610 -10.362 2.693 97 HG2 PRO 16 2HG PRO 16 -19.369 -13.002 2.157 98 HG3 PRO 16 3HG PRO 16 -20.491 -11.945 1.278 99 HD2 PRO 16 2HD PRO 16 -17.800 -12.962 0.457 100 HD3 PRO 16 3HD PRO 16 -19.291 -12.798 -0.492 101 H TRP 17 H TRP 17 -17.414 -8.093 2.384 102 HA TRP 17 HA TRP 17 -14.603 -8.432 1.767 103 HB2 TRP 17 2HB TRP 17 -16.068 -6.369 3.433 104 HB3 TRP 17 3HB TRP 17 -14.340 -6.341 3.108 105 HD1 TRP 17 HD1 TRP 17 -17.710 -5.687 1.441 106 HE1 TRP 17 HE1 TRP 17 -17.315 -4.425 -0.765 107 HE3 TRP 17 HE3 TRP 17 -12.616 -5.986 1.230 108 HZ2 TRP 17 HZ2 TRP 17 -15.134 -3.667 -2.390 109 HZ3 TRP 17 HZ3 TRP 17 -11.451 -4.977 -0.688 110 HH2 TRP 17 HH2 TRP 17 -12.686 -3.841 -2.455 111 H ASN 18 H ASN 18 -13.086 -9.235 3.111 112 HA ASN 18 HA ASN 18 -13.975 -10.110 5.774 113 HB2 ASN 18 2HB ASN 18 -11.803 -11.275 3.989 114 HB3 ASN 18 3HB ASN 18 -12.103 -11.774 5.645 115 HD21 ASN 18 1HD2 ASN 18 -12.218 -13.261 3.145 116 HD22 ASN 18 2HD2 ASN 18 -13.797 -13.952 3.070 117 H GLU 19 H GLU 19 -12.869 -9.482 7.536 118 HA GLU 19 HA GLU 19 -10.669 -7.574 7.112 119 HB2 GLU 19 2HB GLU 19 -11.239 -6.688 9.335 120 HB3 GLU 19 3HB GLU 19 -12.637 -6.651 8.271 121 HG2 GLU 19 2HG GLU 19 -13.510 -8.664 9.325 122 HG3 GLU 19 3HG GLU 19 -12.102 -8.736 10.379 123 H GLY 20 H GLY 20 -8.598 -8.120 7.873 124 HA2 GLY 20 2HA GLY 20 -8.431 -10.002 10.050 125 HA3 GLY 20 3HA GLY 20 -7.838 -10.574 8.501 126 H GLY 21 H GLY 21 -7.557 -7.230 9.636 127 HA2 GLY 21 2HA GLY 21 -5.163 -7.250 10.901 128 HA3 GLY 21 3HA GLY 21 -4.718 -7.370 9.210 129 H GLN 22 H GLN 22 -3.662 -5.342 10.216 130 HA GLN 22 HA GLN 22 -5.131 -3.059 9.184 131 HB2 GLN 22 2HB GLN 22 -4.373 -1.711 11.202 132 HB3 GLN 22 3HB GLN 22 -5.686 -2.835 11.510 133 HG2 GLN 22 2HG GLN 22 -3.816 -4.450 12.269 134 HG3 GLN 22 3HG GLN 22 -2.805 -3.010 12.328 135 HE21 GLN 22 1HE2 GLN 22 -5.149 -1.366 13.129 136 HE22 GLN 22 2HE2 GLN 22 -5.400 -1.714 14.802 137 H TRP 23 H TRP 23 -3.756 -1.513 8.295 138 HA TRP 23 HA TRP 23 -0.920 -2.340 8.175 139 HB2 TRP 23 2HB TRP 23 -2.620 -1.118 5.994 140 HB3 TRP 23 3HB TRP 23 -0.871 -1.270 5.893 141 HD1 TRP 23 HD1 TRP 23 -1.897 -4.303 7.547 142 HE1 TRP 23 HE1 TRP 23 -2.218 -6.243 5.912 143 HE3 TRP 23 HE3 TRP 23 -1.969 -1.661 3.165 144 HZ2 TRP 23 HZ2 TRP 23 -2.441 -6.622 3.123 145 HZ3 TRP 23 HZ3 TRP 23 -2.233 -2.917 1.045 146 HH2 TRP 23 HH2 TRP 23 -2.461 -5.321 1.038 147 H GLU 24 H GLU 24 0.661 -0.695 7.858 148 HA GLU 24 HA GLU 24 -0.297 1.915 8.821 149 HB2 GLU 24 2HB GLU 24 1.086 0.792 10.525 150 HB3 GLU 24 3HB GLU 24 2.418 0.711 9.376 151 HG2 GLU 24 2HG GLU 24 2.554 3.121 9.299 152 HG3 GLU 24 3HG GLU 24 1.139 3.261 10.338 153 H ILE 25 H ILE 25 -0.120 3.468 7.489 154 HA ILE 25 HA ILE 25 1.989 3.504 5.446 155 HB ILE 25 HB ILE 25 -0.980 3.929 4.962 156 HG12 ILE 25 2HG1 ILE 25 0.900 1.942 3.679 157 HG13 ILE 25 3HG1 ILE 25 -0.162 1.563 5.031 158 HG21 ILE 25 1HG2 ILE 25 1.299 4.327 3.033 159 HG22 ILE 25 2HG2 ILE 25 0.287 5.596 3.731 160 HG23 ILE 25 3HG2 ILE 25 -0.418 4.407 2.636 161 HD11 ILE 25 3HD1 ILE 25 -1.112 0.817 2.930 162 HD12 ILE 25 1HD1 ILE 25 -1.030 2.461 2.294 163 HD13 ILE 25 2HD1 ILE 25 -2.101 2.093 3.644 164 H GLY 26 H GLY 26 2.708 5.583 4.952 165 HA2 GLY 26 2HA GLY 26 2.737 7.925 4.996 166 HA3 GLY 26 3HA GLY 26 1.231 7.897 5.904 167 H SER 27 H SER 27 4.485 6.769 6.343 168 HA SER 27 HA SER 27 4.640 6.977 9.122 169 HB2 SER 27 2HB SER 27 6.956 7.364 7.222 170 HB3 SER 27 3HB SER 27 7.039 6.822 8.901 171 HG SER 27 HG SER 27 5.994 4.919 8.317 172 H ARG 28 H ARG 28 5.451 9.434 6.676 173 HA ARG 28 HA ARG 28 6.455 11.403 8.390 174 HB2 ARG 28 2HB ARG 28 6.686 11.489 5.946 175 HB3 ARG 28 3HB ARG 28 4.958 11.776 5.791 176 HG2 ARG 28 2HG ARG 28 5.215 13.881 7.028 177 HG3 ARG 28 3HG ARG 28 6.953 13.597 7.119 178 HD2 ARG 28 2HD ARG 28 7.110 13.667 4.698 179 HD3 ARG 28 3HD ARG 28 5.363 13.870 4.572 180 HE ARG 28 HE ARG 28 6.416 15.890 6.209 181 HH11 ARG 28 1HH1 ARG 28 6.458 14.920 2.829 182 HH12 ARG 28 2HH1 ARG 28 6.572 16.535 2.224 183 HH21 ARG 28 1HH2 ARG 28 6.578 18.037 5.404 184 HH22 ARG 28 2HH2 ARG 28 6.613 18.312 3.697 185 H SER 29 H SER 29 3.139 10.754 7.355 186 HA SER 29 HA SER 29 1.127 11.208 8.270 187 HB2 SER 29 2HB SER 29 2.625 12.535 10.542 188 HB3 SER 29 3HB SER 29 0.920 12.080 10.545 189 HG SER 29 HG SER 29 1.980 10.421 11.520 190 H ASP 30 H ASP 30 3.375 13.792 7.755 191 HA ASP 30 HA ASP 30 1.572 15.975 7.885 192 HB2 ASP 30 2HB ASP 30 4.123 15.655 6.297 193 HB3 ASP 30 3HB ASP 30 3.229 17.166 6.418 194 H GLN 31 H GLN 31 1.677 13.450 5.768 195 HA GLN 31 HA GLN 31 -0.222 14.693 3.995 196 HB2 GLN 31 2HB GLN 31 2.519 14.531 3.202 197 HB3 GLN 31 3HB GLN 31 1.566 13.459 2.185 198 HG2 GLN 31 2HG GLN 31 1.071 16.396 2.630 199 HG3 GLN 31 3HG GLN 31 1.760 15.654 1.182 200 HE21 GLN 31 1HE2 GLN 31 -1.126 16.254 3.003 201 HE22 GLN 31 2HE2 GLN 31 -2.238 15.697 1.803 202 H ASN 32 H ASN 32 -1.671 13.296 3.236 203 HA ASN 32 HA ASN 32 -1.324 10.500 3.942 204 HB2 ASN 32 2HB ASN 32 -3.449 11.968 4.371 205 HB3 ASN 32 3HB ASN 32 -3.807 11.627 2.686 206 HD21 ASN 32 1HD2 ASN 32 -4.136 9.443 2.050 207 HD22 ASN 32 2HD2 ASN 32 -4.636 8.261 3.206 208 H VAL 33 H VAL 33 -1.714 8.817 2.454 209 HA VAL 33 HA VAL 33 -0.766 9.459 -0.235 210 HB VAL 33 HB VAL 33 -1.111 6.761 1.090 211 HG11 VAL 33 1HG1 VAL 33 0.377 7.558 -1.405 212 HG12 VAL 33 2HG1 VAL 33 -1.121 6.626 -1.328 213 HG13 VAL 33 3HG1 VAL 33 0.373 5.949 -0.681 214 HG21 VAL 33 3HG2 VAL 33 1.380 8.436 0.803 215 HG22 VAL 33 1HG2 VAL 33 1.313 6.790 1.434 216 HG23 VAL 33 2HG2 VAL 33 0.517 8.102 2.304 217 H VAL 34 H VAL 34 -2.078 9.273 -1.995 218 HA VAL 34 HA VAL 34 -4.792 8.309 -1.463 219 HB VAL 34 HB VAL 34 -5.516 9.527 -3.483 220 HG11 VAL 34 1HG1 VAL 34 -5.326 11.776 -2.552 221 HG12 VAL 34 2HG1 VAL 34 -4.041 11.224 -1.480 222 HG13 VAL 34 3HG1 VAL 34 -5.674 10.584 -1.297 223 HG21 VAL 34 3HG2 VAL 34 -2.677 10.552 -3.549 224 HG22 VAL 34 1HG2 VAL 34 -4.008 11.164 -4.532 225 HG23 VAL 34 2HG2 VAL 34 -3.439 9.509 -4.750 226 H ALA 35 H ALA 35 -2.016 7.777 -3.546 227 HA ALA 35 HA ALA 35 -3.421 5.402 -4.544 228 HB1 ALA 35 3HB ALA 35 -1.716 7.060 -6.382 229 HB2 ALA 35 1HB ALA 35 -3.464 7.270 -6.251 230 HB3 ALA 35 2HB ALA 35 -2.795 5.732 -6.786 231 H ILE 36 H ILE 36 -2.152 3.633 -5.032 232 HA ILE 36 HA ILE 36 0.694 3.796 -4.479 233 HB ILE 36 HB ILE 36 -1.142 1.913 -2.954 234 HG12 ILE 36 2HG1 ILE 36 0.747 4.025 -1.887 235 HG13 ILE 36 3HG1 ILE 36 -0.992 4.241 -2.051 236 HG21 ILE 36 1HG2 ILE 36 0.892 1.035 -1.908 237 HG22 ILE 36 2HG2 ILE 36 1.870 2.065 -2.954 238 HG23 ILE 36 3HG2 ILE 36 0.894 0.774 -3.654 239 HD11 ILE 36 3HD1 ILE 36 -1.355 2.409 -0.467 240 HD12 ILE 36 1HD1 ILE 36 -0.383 3.705 0.235 241 HD13 ILE 36 2HD1 ILE 36 0.390 2.215 -0.306 242 H ASN 37 H ASN 37 1.657 2.745 -6.087 243 HA ASN 37 HA ASN 37 0.429 0.269 -7.096 244 HB2 ASN 37 2HB ASN 37 1.838 2.391 -8.747 245 HB3 ASN 37 3HB ASN 37 1.298 0.833 -9.353 246 HD21 ASN 37 1HD2 ASN 37 -0.914 0.457 -9.610 247 HD22 ASN 37 2HD2 ASN 37 -2.050 1.752 -9.674 248 H VAL 38 H VAL 38 1.784 -1.373 -6.630 249 HA VAL 38 HA VAL 38 4.640 -0.956 -6.838 250 HB VAL 38 HB VAL 38 5.171 -1.794 -4.564 251 HG11 VAL 38 1HG1 VAL 38 4.652 0.256 -3.307 252 HG12 VAL 38 2HG1 VAL 38 3.536 0.738 -4.585 253 HG13 VAL 38 3HG1 VAL 38 5.260 0.597 -4.925 254 HG21 VAL 38 3HG2 VAL 38 3.474 -1.824 -2.823 255 HG22 VAL 38 1HG2 VAL 38 3.062 -2.950 -4.117 256 HG23 VAL 38 2HG2 VAL 38 2.244 -1.392 -4.007 257 H GLU 39 H GLU 39 5.839 -2.856 -6.973 258 HA GLU 39 HA GLU 39 4.431 -5.384 -6.652 259 HB2 GLU 39 2HB GLU 39 4.217 -4.712 -9.052 260 HB3 GLU 39 3HB GLU 39 5.972 -4.685 -9.168 261 HG2 GLU 39 2HG GLU 39 6.064 -7.060 -8.680 262 HG3 GLU 39 3HG GLU 39 4.315 -7.105 -8.478 263 H SER 40 H SER 40 5.830 -7.100 -6.175 264 HA SER 40 HA SER 40 8.260 -6.245 -4.882 265 HB2 SER 40 2HB SER 40 8.333 -8.651 -4.155 266 HB3 SER 40 3HB SER 40 6.852 -7.802 -3.708 267 HG SER 40 HG SER 40 6.857 -9.096 -6.165 268 H GLY 41 H GLY 41 10.318 -6.973 -5.246 269 HA2 GLY 41 2HA GLY 41 10.838 -7.901 -7.979 270 HA3 GLY 41 3HA GLY 41 12.027 -7.230 -6.864 271 H ASP 42 H ASP 42 10.785 -8.998 -4.759 272 HA ASP 42 HA ASP 42 11.915 -11.593 -5.564 273 HB2 ASP 42 2HB ASP 42 12.365 -10.091 -2.967 274 HB3 ASP 42 3HB ASP 42 12.727 -11.804 -3.159 275 H ASP 43 H ASP 43 11.339 -12.759 -2.938 276 HA ASP 43 HA ASP 43 8.570 -13.384 -3.401 277 HB2 ASP 43 2HB ASP 43 8.855 -14.972 -1.506 278 HB3 ASP 43 3HB ASP 43 10.067 -15.172 -2.764 279 H GLY 44 H GLY 44 8.606 -10.751 -2.838 280 HA2 GLY 44 2HA GLY 44 7.123 -9.397 -1.646 281 HA3 GLY 44 3HA GLY 44 6.950 -10.671 -0.451 282 H GLN 45 H GLN 45 10.142 -10.513 -0.686 283 HA GLN 45 HA GLN 45 10.400 -8.956 1.681 284 HB2 GLN 45 2HB GLN 45 12.522 -10.156 -0.095 285 HB3 GLN 45 3HB GLN 45 12.858 -9.324 1.413 286 HG2 GLN 45 2HG GLN 45 11.403 -11.003 2.565 287 HG3 GLN 45 3HG GLN 45 11.326 -11.878 1.035 288 HE21 GLN 45 1HE2 GLN 45 13.257 -11.039 3.757 289 HE22 GLN 45 2HE2 GLN 45 14.590 -12.066 3.401 290 H THR 46 H THR 46 10.989 -8.338 -1.700 291 HA THR 46 HA THR 46 11.786 -5.597 -1.007 292 HB THR 46 HB THR 46 12.766 -5.562 -3.346 293 HG1 THR 46 HG1 THR 46 13.276 -8.046 -3.801 294 HG21 THR 46 3HG2 THR 46 13.907 -7.565 -1.387 295 HG22 THR 46 1HG2 THR 46 14.186 -5.823 -1.367 296 HG23 THR 46 2HG2 THR 46 14.795 -6.799 -2.704 297 H LEU 47 H LEU 47 10.568 -3.942 -1.783 298 HA LEU 47 HA LEU 47 8.417 -4.609 -3.675 299 HB2 LEU 47 2HB LEU 47 8.166 -2.789 -1.279 300 HB3 LEU 47 3HB LEU 47 6.947 -3.000 -2.511 301 HG LEU 47 HG LEU 47 7.879 -5.124 -0.582 302 HD11 LEU 47 1HD1 LEU 47 5.296 -3.577 -0.737 303 HD12 LEU 47 2HD1 LEU 47 6.562 -3.360 0.473 304 HD13 LEU 47 3HD1 LEU 47 5.665 -4.875 0.399 305 HD21 LEU 47 3HD2 LEU 47 5.708 -5.176 -2.680 306 HD22 LEU 47 1HD2 LEU 47 6.011 -6.439 -1.482 307 HD23 LEU 47 2HD2 LEU 47 7.220 -6.082 -2.716 308 H ASN 48 H ASN 48 8.384 -3.320 -5.413 309 HA ASN 48 HA ASN 48 9.715 -0.707 -5.207 310 HB2 ASN 48 2HB ASN 48 9.833 -2.529 -7.621 311 HB3 ASN 48 3HB ASN 48 10.729 -1.042 -7.359 312 HD21 ASN 48 1HD2 ASN 48 12.431 -1.058 -5.877 313 HD22 ASN 48 2HD2 ASN 48 13.242 -2.511 -5.435 314 H GLY 49 H GLY 49 8.578 0.967 -6.160 315 HA2 GLY 49 2HA GLY 49 6.788 0.636 -8.293 316 HA3 GLY 49 3HA GLY 49 5.872 0.543 -6.805 317 H THR 50 H THR 50 4.738 2.366 -7.496 318 HA THR 50 HA THR 50 6.162 4.910 -7.077 319 HB THR 50 HB THR 50 3.942 4.400 -9.076 320 HG1 THR 50 HG1 THR 50 6.539 3.880 -9.275 321 HG21 THR 50 3HG2 THR 50 5.672 6.824 -8.579 322 HG22 THR 50 1HG2 THR 50 3.953 6.679 -8.214 323 HG23 THR 50 2HG2 THR 50 4.506 6.647 -9.890 324 H MET 51 H MET 51 5.170 6.284 -5.603 325 HA MET 51 HA MET 51 2.461 5.596 -4.673 326 HB2 MET 51 2HB MET 51 4.804 6.949 -3.370 327 HB3 MET 51 3HB MET 51 3.178 7.164 -2.760 328 HG2 MET 51 2HG MET 51 3.003 4.820 -2.270 329 HG3 MET 51 3HG MET 51 4.573 4.498 -2.997 330 HE1 MET 51 3HE MET 51 4.040 7.834 -1.040 331 HE2 MET 51 1HE MET 51 4.181 7.300 0.633 332 HE3 MET 51 2HE MET 51 2.807 6.784 -0.346 333 H THR 52 H THR 52 0.975 7.327 -4.278 334 HA THR 52 HA THR 52 1.736 9.951 -5.366 335 HB THR 52 HB THR 52 -0.964 8.657 -5.823 336 HG1 THR 52 HG1 THR 52 1.308 8.146 -7.059 337 HG21 THR 52 3HG2 THR 52 0.290 11.137 -7.011 338 HG22 THR 52 1HG2 THR 52 -0.965 11.119 -5.771 339 HG23 THR 52 2HG2 THR 52 -1.311 10.501 -7.385 340 H TYR 53 H TYR 53 1.339 11.556 -3.941 341 HA TYR 53 HA TYR 53 -0.307 11.006 -1.589 342 HB2 TYR 53 2HB TYR 53 1.664 13.193 -2.231 343 HB3 TYR 53 3HB TYR 53 0.579 13.300 -0.854 344 HD1 TYR 53 HD2 TYR 53 0.765 11.611 0.966 345 HD2 TYR 53 HD1 TYR 53 3.632 11.887 -2.153 346 HE1 TYR 53 HE2 TYR 53 2.365 10.358 2.340 347 HE2 TYR 53 HE1 TYR 53 5.246 10.641 -0.780 348 HH TYR 53 HH TYR 53 4.361 8.953 2.005 349 H ALA 54 H ALA 54 -1.668 12.859 -0.774 350 HA ALA 54 HA ALA 54 -3.680 13.412 -2.675 351 HB1 ALA 54 3HB ALA 54 -4.124 13.226 -0.272 352 HB2 ALA 54 1HB ALA 54 -4.725 14.748 -0.928 353 HB3 ALA 54 2HB ALA 54 -3.231 14.721 0.006 354 H GLY 55 H GLY 55 -3.302 14.677 -4.388 355 HA2 GLY 55 2HA GLY 55 -3.185 16.730 -5.474 356 HA3 GLY 55 3HA GLY 55 -2.782 17.484 -3.940 357 H GLU 56 H GLU 56 -0.898 14.760 -4.734 358 HA GLU 56 HA GLU 56 1.281 16.506 -5.658 359 HB2 GLU 56 2HB GLU 56 1.414 14.110 -3.843 360 HB3 GLU 56 3HB GLU 56 2.828 14.871 -4.558 361 HG2 GLU 56 2HG GLU 56 0.872 16.232 -2.715 362 HG3 GLU 56 3HG GLU 56 2.432 15.567 -2.233 363 H GLY 57 H GLY 57 3.045 15.203 -6.765 364 HA2 GLY 57 2HA GLY 57 1.758 13.620 -8.833 365 HA3 GLY 57 3HA GLY 57 3.390 14.269 -8.880 366 HA PRO 58 HA PRO 58 3.344 9.653 -7.777 367 HB2 PRO 58 2HB PRO 58 4.769 9.358 -10.338 368 HB3 PRO 58 3HB PRO 58 3.390 8.450 -9.716 369 HG2 PRO 58 2HG PRO 58 3.124 10.191 -11.741 370 HG3 PRO 58 3HG PRO 58 1.851 9.967 -10.527 371 HD2 PRO 58 2HD PRO 58 3.901 12.138 -10.749 372 HD3 PRO 58 3HD PRO 58 2.172 12.259 -10.356 373 H ILE 59 H ILE 59 5.048 8.885 -6.650 374 HA ILE 59 HA ILE 59 7.737 9.915 -7.273 375 HB ILE 59 HB ILE 59 8.271 9.948 -4.871 376 HG12 ILE 59 2HG1 ILE 59 5.317 9.453 -4.431 377 HG13 ILE 59 3HG1 ILE 59 6.581 8.254 -4.180 378 HG21 ILE 59 1HG2 ILE 59 7.558 12.008 -5.947 379 HG22 ILE 59 2HG2 ILE 59 6.998 11.956 -4.276 380 HG23 ILE 59 3HG2 ILE 59 5.872 11.629 -5.595 381 HD11 ILE 59 3HD1 ILE 59 7.569 9.730 -2.463 382 HD12 ILE 59 1HD1 ILE 59 5.932 9.197 -2.079 383 HD13 ILE 59 2HD1 ILE 59 6.212 10.832 -2.679 384 H GLY 60 H GLY 60 9.488 8.525 -6.410 385 HA2 GLY 60 2HA GLY 60 8.943 5.789 -7.126 386 HA3 GLY 60 3HA GLY 60 10.497 6.446 -6.632 387 H PHE 61 H PHE 61 8.895 4.000 -5.873 388 HA PHE 61 HA PHE 61 9.036 4.373 -2.952 389 HB2 PHE 61 2HB PHE 61 6.705 4.162 -3.597 390 HB3 PHE 61 3HB PHE 61 7.063 2.739 -4.560 391 HD1 PHE 61 HD1 PHE 61 6.580 4.031 -1.176 392 HD2 PHE 61 HD2 PHE 61 7.403 0.581 -3.517 393 HE1 PHE 61 HE1 PHE 61 6.064 2.599 0.754 394 HE2 PHE 61 HE2 PHE 61 6.889 -0.856 -1.594 395 HZ PHE 61 HZ PHE 61 6.215 0.149 0.547 396 H ARG 62 H ARG 62 10.483 3.084 -1.993 397 HA ARG 62 HA ARG 62 10.953 0.416 -3.115 398 HB2 ARG 62 2HB ARG 62 12.798 1.920 -3.832 399 HB3 ARG 62 3HB ARG 62 13.137 2.276 -2.144 400 HG2 ARG 62 2HG ARG 62 13.681 -0.087 -1.767 401 HG3 ARG 62 3HG ARG 62 13.354 -0.422 -3.469 402 HD2 ARG 62 2HD ARG 62 15.714 -0.192 -3.212 403 HD3 ARG 62 3HD ARG 62 15.128 1.243 -4.049 404 HE ARG 62 HE ARG 62 15.356 2.455 -1.958 405 HH11 ARG 62 1HH1 ARG 62 16.978 -0.649 -2.171 406 HH12 ARG 62 2HH1 ARG 62 18.093 -0.301 -0.899 407 HH21 ARG 62 1HH2 ARG 62 16.834 2.914 -0.231 408 HH22 ARG 62 2HH2 ARG 62 17.996 1.713 0.214 409 H ALA 63 H ALA 63 10.835 -1.139 -1.574 410 HA ALA 63 HA ALA 63 11.182 -0.313 1.226 411 HB1 ALA 63 3HB ALA 63 9.151 -1.253 1.928 412 HB2 ALA 63 1HB ALA 63 8.883 -2.038 0.370 413 HB3 ALA 63 2HB ALA 63 8.767 -0.286 0.506 414 H THR 64 H THR 64 11.880 -1.863 2.640 415 HA THR 64 HA THR 64 12.575 -4.495 1.500 416 HB THR 64 HB THR 64 14.162 -2.911 3.547 417 HG1 THR 64 HG1 THR 64 14.103 -2.329 1.142 418 HG21 THR 64 3HG2 THR 64 14.374 -5.349 3.821 419 HG22 THR 64 1HG2 THR 64 15.876 -4.642 3.222 420 HG23 THR 64 2HG2 THR 64 14.803 -5.499 2.117 421 H LEU 65 H LEU 65 11.781 -6.203 2.595 422 HA LEU 65 HA LEU 65 10.068 -5.819 4.842 423 HB2 LEU 65 2HB LEU 65 9.649 -7.450 3.033 424 HB3 LEU 65 3HB LEU 65 11.061 -8.352 3.517 425 HG LEU 65 HG LEU 65 8.676 -9.179 4.149 426 HD11 LEU 65 1HD1 LEU 65 9.548 -10.254 6.154 427 HD12 LEU 65 2HD1 LEU 65 10.916 -9.141 6.152 428 HD13 LEU 65 3HD1 LEU 65 10.707 -10.287 4.826 429 HD21 LEU 65 3HD2 LEU 65 9.193 -7.214 6.379 430 HD22 LEU 65 1HD2 LEU 65 7.927 -8.441 6.361 431 HD23 LEU 65 2HD2 LEU 65 7.893 -7.123 5.190 432 H LEU 66 H LEU 66 10.601 -5.750 6.899 433 HA LEU 66 HA LEU 66 13.237 -6.334 7.841 434 HB2 LEU 66 2HB LEU 66 10.710 -5.577 9.304 435 HB3 LEU 66 3HB LEU 66 12.284 -5.710 10.058 436 HG LEU 66 HG LEU 66 11.588 -3.765 7.856 437 HD11 LEU 66 1HD1 LEU 66 10.412 -3.218 9.907 438 HD12 LEU 66 2HD1 LEU 66 11.704 -2.058 9.601 439 HD13 LEU 66 3HD1 LEU 66 11.919 -3.317 10.817 440 HD21 LEU 66 3HD2 LEU 66 13.936 -4.376 7.842 441 HD22 LEU 66 1HD2 LEU 66 14.056 -4.035 9.568 442 HD23 LEU 66 2HD2 LEU 66 13.736 -2.727 8.430 443 H GLY 67 H GLY 67 10.166 -8.011 7.914 444 HA2 GLY 67 2HA GLY 67 10.444 -10.496 8.107 445 HA3 GLY 67 3HA GLY 67 11.424 -10.151 9.523 446 H ASN 68 H ASN 68 9.344 -7.897 9.945 447 HA ASN 68 HA ASN 68 7.410 -9.600 11.388 448 HB2 ASN 68 2HB ASN 68 7.162 -7.753 12.996 449 HB3 ASN 68 3HB ASN 68 8.840 -8.264 12.877 450 HD21 ASN 68 1HD2 ASN 68 7.731 -5.755 13.798 451 HD22 ASN 68 2HD2 ASN 68 8.427 -4.513 12.817 452 H ASN 69 H ASN 69 7.170 -8.784 8.636 453 HA ASN 69 HA ASN 69 5.650 -8.039 7.142 454 HB2 ASN 69 2HB ASN 69 3.928 -7.684 9.605 455 HB3 ASN 69 3HB ASN 69 3.348 -7.336 7.981 456 HD21 ASN 69 1HD2 ASN 69 2.351 -9.294 9.839 457 HD22 ASN 69 2HD2 ASN 69 2.515 -10.831 9.058 458 H SER 70 H SER 70 7.331 -6.164 9.057 459 HA SER 70 HA SER 70 6.186 -3.663 8.087 460 HB2 SER 70 2HB SER 70 6.690 -3.766 10.507 461 HB3 SER 70 3HB SER 70 8.378 -4.109 10.136 462 HG SER 70 HG SER 70 6.909 -1.738 9.699 463 H TYR 71 H TYR 71 7.308 -2.355 6.766 464 HA TYR 71 HA TYR 71 9.729 -3.486 5.551 465 HB2 TYR 71 2HB TYR 71 7.496 -1.885 4.304 466 HB3 TYR 71 3HB TYR 71 9.009 -2.269 3.503 467 HD1 TYR 71 HD1 TYR 71 5.982 -3.820 5.007 468 HD2 TYR 71 HD2 TYR 71 9.280 -4.282 2.363 469 HE1 TYR 71 HE1 TYR 71 5.007 -5.912 4.160 470 HE2 TYR 71 HE2 TYR 71 8.314 -6.368 1.512 471 HH TYR 71 HH TYR 71 6.764 -7.987 1.950 472 H GLU 72 H GLU 72 11.438 -2.194 5.318 473 HA GLU 72 HA GLU 72 11.348 0.482 6.419 474 HB2 GLU 72 2HB GLU 72 13.264 -1.061 6.847 475 HB3 GLU 72 3HB GLU 72 13.625 -1.052 5.130 476 HG2 GLU 72 2HG GLU 72 14.201 1.268 5.204 477 HG3 GLU 72 3HG GLU 72 13.659 1.395 6.877 478 H VAL 73 H VAL 73 10.645 2.091 5.159 479 HA VAL 73 HA VAL 73 10.709 1.674 2.259 480 HB VAL 73 HB VAL 73 8.806 3.224 4.010 481 HG11 VAL 73 1HG1 VAL 73 7.558 3.777 1.987 482 HG12 VAL 73 2HG1 VAL 73 8.812 3.025 1.000 483 HG13 VAL 73 3HG1 VAL 73 9.180 4.469 1.944 484 HG21 VAL 73 3HG2 VAL 73 8.473 0.815 3.995 485 HG22 VAL 73 1HG2 VAL 73 8.409 0.823 2.233 486 HG23 VAL 73 2HG2 VAL 73 7.151 1.635 3.164 487 H GLU 74 H GLU 74 11.526 3.093 0.909 488 HA GLU 74 HA GLU 74 12.293 5.750 1.849 489 HB2 GLU 74 2HB GLU 74 13.957 3.895 0.138 490 HB3 GLU 74 3HB GLU 74 14.263 5.617 0.280 491 HG2 GLU 74 2HG GLU 74 14.628 5.328 2.692 492 HG3 GLU 74 3HG GLU 74 14.388 3.592 2.504 493 H ASN 75 H ASN 75 11.594 7.320 0.546 494 HA ASN 75 HA ASN 75 10.380 6.511 -1.994 495 HB2 ASN 75 2HB ASN 75 9.699 8.774 -0.122 496 HB3 ASN 75 3HB ASN 75 9.047 8.647 -1.749 497 HD21 ASN 75 1HD2 ASN 75 7.600 8.655 0.729 498 HD22 ASN 75 2HD2 ASN 75 6.759 7.148 0.812 499 H GLN 76 H GLN 76 10.587 7.853 -3.764 500 HA GLN 76 HA GLN 76 13.039 9.511 -3.716 501 HB2 GLN 76 2HB GLN 76 13.238 7.376 -4.962 502 HB3 GLN 76 3HB GLN 76 11.921 7.887 -6.004 503 HG2 GLN 76 2HG GLN 76 13.288 9.779 -6.763 504 HG3 GLN 76 3HG GLN 76 14.611 9.201 -5.750 505 HE21 GLN 76 1HE2 GLN 76 15.998 8.820 -7.424 506 HE22 GLN 76 2HE2 GLN 76 15.754 7.566 -8.593 507 H TRP 77 H TRP 77 12.676 11.618 -4.089 508 HA TRP 77 HA TRP 77 10.657 12.395 -6.031 509 HB2 TRP 77 2HB TRP 77 9.721 14.148 -4.542 510 HB3 TRP 77 3HB TRP 77 9.410 12.526 -3.943 511 HD1 TRP 77 HD1 TRP 77 11.907 15.436 -3.267 512 HE1 TRP 77 HE1 TRP 77 12.469 15.441 -0.758 513 HE3 TRP 77 HE3 TRP 77 9.284 11.281 -1.830 514 HZ2 TRP 77 HZ2 TRP 77 11.880 13.906 1.524 515 HZ3 TRP 77 HZ3 TRP 77 9.333 10.628 0.543 516 HH2 TRP 77 HH2 TRP 77 10.607 11.911 2.183 517 H GLY 78 H GLY 78 10.860 14.715 -6.637 518 HA2 GLY 78 2HA GLY 78 12.164 16.721 -6.697 519 HA3 GLY 78 3HA GLY 78 13.527 15.812 -6.057 520 H GLY 79 H GLY 79 12.436 13.728 -8.154 521 HA2 GLY 79 2HA GLY 79 12.532 14.166 -10.692 522 HA3 GLY 79 3HA GLY 79 14.149 14.741 -10.303 523 H ASP 80 H ASP 80 13.582 12.525 -12.072 524 HA ASP 80 HA ASP 80 13.763 10.047 -10.893 525 HB2 ASP 80 2HB ASP 80 14.976 10.953 -13.512 526 HB3 ASP 80 3HB ASP 80 14.570 9.301 -13.068 527 H SER 81 H SER 81 16.317 12.324 -11.757 528 HA SER 81 HA SER 81 18.445 10.495 -11.223 529 HB2 SER 81 2HB SER 81 18.669 13.495 -11.397 530 HB3 SER 81 3HB SER 81 19.901 12.286 -11.759 531 HG SER 81 HG SER 81 17.701 13.104 -13.268 532 H ALA 82 H ALA 82 16.411 12.063 -9.129 533 HA ALA 82 HA ALA 82 18.300 12.952 -7.171 534 HB1 ALA 82 3HB ALA 82 15.336 12.449 -6.908 535 HB2 ALA 82 1HB ALA 82 16.088 13.978 -7.365 536 HB3 ALA 82 2HB ALA 82 16.342 13.317 -5.748 537 HA PRO 83 HA PRO 83 18.965 9.131 -4.991 538 HB2 PRO 83 2HB PRO 83 19.075 10.587 -2.452 539 HB3 PRO 83 3HB PRO 83 20.381 9.789 -3.326 540 HG2 PRO 83 2HG PRO 83 20.217 12.479 -3.108 541 HG3 PRO 83 3HG PRO 83 20.902 11.682 -4.537 542 HD2 PRO 83 2HD PRO 83 18.179 12.865 -4.145 543 HD3 PRO 83 3HD PRO 83 19.272 12.982 -5.540 544 H TRP 84 H TRP 84 18.242 8.026 -2.815 545 HA TRP 84 HA TRP 84 15.333 8.210 -2.773 546 HB2 TRP 84 2HB TRP 84 17.238 6.137 -1.642 547 HB3 TRP 84 3HB TRP 84 15.486 6.070 -1.490 548 HD1 TRP 84 HD1 TRP 84 18.289 5.608 -4.050 549 HE1 TRP 84 HE1 TRP 84 17.336 4.402 -6.113 550 HE3 TRP 84 HE3 TRP 84 13.325 5.677 -2.815 551 HZ2 TRP 84 HZ2 TRP 84 14.814 3.586 -7.091 552 HZ3 TRP 84 HZ3 TRP 84 11.710 4.660 -4.369 553 HH2 TRP 84 HH2 TRP 84 12.441 3.638 -6.460 554 H HIS 85 H HIS 85 14.181 8.761 -0.947 555 HA HIS 85 HA HIS 85 15.797 9.827 1.270 556 HB2 HIS 85 2HB HIS 85 13.108 10.724 0.200 557 HB3 HIS 85 3HB HIS 85 13.865 11.372 1.647 558 HD1 HIS 85 HD1 HIS 85 15.711 13.110 1.327 559 HD2 HIS 85 HD2 HIS 85 14.339 11.485 -2.244 560 HE1 HIS 85 HE1 HIS 85 16.760 14.493 -0.491 561 H SER 86 H SER 86 15.100 9.415 3.387 562 HA SER 86 HA SER 86 13.910 6.910 3.791 563 HB2 SER 86 2HB SER 86 13.980 7.649 6.217 564 HB3 SER 86 3HB SER 86 15.524 7.689 5.364 565 HG SER 86 HG SER 86 13.793 9.879 5.901 566 H GLY 87 H GLY 87 11.818 6.429 3.623 567 HA2 GLY 87 2HA GLY 87 9.821 8.518 3.963 568 HA3 GLY 87 3HA GLY 87 9.534 6.878 3.392 569 H GLY 88 H GLY 88 10.604 5.343 5.326 570 HA2 GLY 88 2HA GLY 88 10.595 5.649 7.919 571 HA3 GLY 88 3HA GLY 88 8.889 5.963 7.619 572 H ASN 89 H ASN 89 8.442 4.130 8.961 573 HA ASN 89 HA ASN 89 9.017 1.556 7.680 574 HB2 ASN 89 2HB ASN 89 8.197 2.204 10.521 575 HB3 ASN 89 3HB ASN 89 8.316 0.566 9.886 576 HD21 ASN 89 1HD2 ASN 89 10.357 -0.265 9.400 577 HD22 ASN 89 2HD2 ASN 89 11.810 0.433 10.023 578 H TRP 90 H TRP 90 7.390 0.320 6.928 579 HA TRP 90 HA TRP 90 4.639 1.314 7.283 580 HB2 TRP 90 2HB TRP 90 6.048 0.369 4.784 581 HB3 TRP 90 3HB TRP 90 4.296 0.352 4.914 582 HD1 TRP 90 HD1 TRP 90 6.433 3.246 6.267 583 HE1 TRP 90 HE1 TRP 90 5.875 5.361 4.942 584 HE3 TRP 90 HE3 TRP 90 3.414 1.183 2.685 585 HZ2 TRP 90 HZ2 TRP 90 4.348 6.070 2.674 586 HZ3 TRP 90 HZ3 TRP 90 2.450 2.651 0.983 587 HH2 TRP 90 HH2 TRP 90 2.907 5.037 0.974 588 H ILE 91 H ILE 91 3.061 -0.277 7.460 589 HA ILE 91 HA ILE 91 4.128 -3.020 7.764 590 HB ILE 91 HB ILE 91 1.669 -1.794 9.050 591 HG12 ILE 91 2HG1 ILE 91 4.233 -2.766 10.335 592 HG13 ILE 91 3HG1 ILE 91 3.881 -1.078 9.987 593 HG21 ILE 91 1HG2 ILE 91 1.310 -4.149 8.531 594 HG22 ILE 91 2HG2 ILE 91 1.480 -3.919 10.273 595 HG23 ILE 91 3HG2 ILE 91 2.823 -4.570 9.334 596 HD11 ILE 91 3HD1 ILE 91 2.320 -2.865 11.842 597 HD12 ILE 91 1HD1 ILE 91 1.971 -1.169 11.503 598 HD13 ILE 91 2HD1 ILE 91 3.469 -1.615 12.319 599 H LEU 92 H LEU 92 3.635 -4.324 6.095 600 HA LEU 92 HA LEU 92 1.049 -3.943 4.746 601 HB2 LEU 92 2HB LEU 92 3.704 -4.293 3.360 602 HB3 LEU 92 3HB LEU 92 2.142 -4.259 2.572 603 HG LEU 92 HG LEU 92 3.376 -1.943 4.070 604 HD11 LEU 92 1HD1 LEU 92 4.609 -2.428 2.040 605 HD12 LEU 92 2HD1 LEU 92 3.670 -0.948 1.848 606 HD13 LEU 92 3HD1 LEU 92 3.111 -2.449 1.113 607 HD21 LEU 92 3HD2 LEU 92 0.889 -2.125 2.375 608 HD22 LEU 92 1HD2 LEU 92 1.573 -0.637 3.031 609 HD23 LEU 92 2HD2 LEU 92 0.949 -1.877 4.120 610 H GLY 93 H GLY 93 0.416 -5.810 5.973 611 HA2 GLY 93 2HA GLY 93 0.360 -8.189 4.601 612 HA3 GLY 93 3HA GLY 93 1.717 -8.322 5.712 613 H SER 94 H SER 94 -1.604 -8.704 5.356 614 HA SER 94 HA SER 94 -2.158 -8.497 8.221 615 HB2 SER 94 2HB SER 94 -4.029 -9.161 5.935 616 HB3 SER 94 3HB SER 94 -4.488 -8.761 7.590 617 HG SER 94 HG SER 94 -4.338 -7.093 5.692 618 H ARG 95 H ARG 95 -0.397 -10.588 7.185 619 HA ARG 95 HA ARG 95 -1.966 -12.881 8.039 620 HB2 ARG 95 2HB ARG 95 -0.373 -12.752 5.502 621 HB3 ARG 95 3HB ARG 95 -0.913 -14.270 6.220 622 HG2 ARG 95 2HG ARG 95 -2.747 -12.019 5.395 623 HG3 ARG 95 3HG ARG 95 -2.383 -13.430 4.397 624 HD2 ARG 95 2HD ARG 95 -3.404 -14.904 5.946 625 HD3 ARG 95 3HD ARG 95 -3.486 -13.663 7.191 626 HE ARG 95 HE ARG 95 -5.127 -12.537 5.694 627 HH11 ARG 95 1HH1 ARG 95 -4.634 -16.001 5.419 628 HH12 ARG 95 2HH1 ARG 95 -6.271 -16.325 4.986 629 HH21 ARG 95 1HH2 ARG 95 -7.324 -12.989 5.147 630 HH22 ARG 95 2HH2 ARG 95 -7.798 -14.621 4.836 631 H GLU 96 H GLU 96 -0.860 -14.595 8.879 632 HA GLU 96 HA GLU 96 1.143 -13.994 10.659 633 HB2 GLU 96 2HB GLU 96 -0.472 -15.842 10.827 634 HB3 GLU 96 3HB GLU 96 0.369 -16.683 9.539 635 HG2 GLU 96 2HG GLU 96 2.338 -16.891 10.941 636 HG3 GLU 96 3HG GLU 96 1.526 -15.994 12.226 637 H ASN 97 H ASN 97 1.491 -15.861 7.620 638 HA ASN 97 HA ASN 97 4.347 -15.121 7.572 639 HB2 ASN 97 2HB ASN 97 3.236 -17.883 6.989 640 HB3 ASN 97 3HB ASN 97 4.901 -17.391 6.716 641 HD21 ASN 97 1HD2 ASN 97 2.581 -18.448 8.979 642 HD22 ASN 97 2HD2 ASN 97 3.635 -18.543 10.347 643 H GLN 98 H GLN 98 2.404 -13.769 6.192 644 HA GLN 98 HA GLN 98 3.013 -14.493 3.443 645 HB2 GLN 98 2HB GLN 98 0.950 -15.685 4.002 646 HB3 GLN 98 3HB GLN 98 0.196 -14.186 4.485 647 HG2 GLN 98 2HG GLN 98 0.193 -13.401 2.228 648 HG3 GLN 98 3HG GLN 98 1.127 -14.807 1.701 649 HE21 GLN 98 1HE2 GLN 98 -1.567 -13.908 0.908 650 HE22 GLN 98 2HE2 GLN 98 -2.615 -15.254 1.217 651 H ASN 99 H ASN 99 3.876 -12.742 2.662 652 HA ASN 99 HA ASN 99 3.282 -10.085 3.743 653 HB2 ASN 99 2HB ASN 99 5.392 -11.039 1.789 654 HB3 ASN 99 3HB ASN 99 5.241 -9.386 2.364 655 HD21 ASN 99 1HD2 ASN 99 7.445 -11.276 2.573 656 HD22 ASN 99 2HD2 ASN 99 7.783 -11.432 4.261 657 H VAL 100 H VAL 100 3.174 -8.265 2.195 658 HA VAL 100 HA VAL 100 1.386 -8.907 -0.040 659 HB VAL 100 HB VAL 100 1.184 -6.532 -0.488 660 HG11 VAL 100 1HG1 VAL 100 -0.190 -7.430 1.280 661 HG12 VAL 100 2HG1 VAL 100 0.268 -5.766 1.639 662 HG13 VAL 100 3HG1 VAL 100 1.077 -7.100 2.460 663 HG21 VAL 100 3HG2 VAL 100 2.411 -4.845 0.724 664 HG22 VAL 100 1HG2 VAL 100 3.534 -5.925 -0.093 665 HG23 VAL 100 2HG2 VAL 100 3.268 -6.083 1.644 666 H VAL 101 H VAL 101 1.857 -8.820 -2.225 667 HA VAL 101 HA VAL 101 4.691 -8.321 -2.871 668 HB VAL 101 HB VAL 101 4.487 -9.856 -4.812 669 HG11 VAL 101 1HG1 VAL 101 5.492 -10.616 -2.749 670 HG12 VAL 101 2HG1 VAL 101 4.594 -11.925 -3.516 671 HG13 VAL 101 3HG1 VAL 101 3.911 -11.085 -2.123 672 HG21 VAL 101 3HG2 VAL 101 1.838 -10.593 -3.568 673 HG22 VAL 101 1HG2 VAL 101 2.627 -11.449 -4.894 674 HG23 VAL 101 2HG2 VAL 101 2.075 -9.790 -5.121 675 H ALA 102 H ALA 102 1.407 -7.633 -3.767 676 HA ALA 102 HA ALA 102 2.441 -5.479 -5.430 677 HB1 ALA 102 3HB ALA 102 2.071 -7.385 -6.984 678 HB2 ALA 102 1HB ALA 102 1.059 -5.984 -7.340 679 HB3 ALA 102 2HB ALA 102 0.372 -7.382 -6.519 680 H ILE 103 H ILE 103 1.119 -3.648 -5.462 681 HA ILE 103 HA ILE 103 -1.532 -3.920 -4.265 682 HB ILE 103 HB ILE 103 0.545 -1.894 -3.376 683 HG12 ILE 103 2HG1 ILE 103 -0.905 -3.993 -1.747 684 HG13 ILE 103 3HG1 ILE 103 0.723 -4.196 -2.381 685 HG21 ILE 103 1HG2 ILE 103 -1.183 -1.030 -1.869 686 HG22 ILE 103 2HG2 ILE 103 -2.351 -2.143 -2.579 687 HG23 ILE 103 3HG2 ILE 103 -1.643 -0.860 -3.562 688 HD11 ILE 103 3HD1 ILE 103 -0.141 -2.069 -0.431 689 HD12 ILE 103 1HD1 ILE 103 1.494 -2.319 -1.042 690 HD13 ILE 103 2HD1 ILE 103 0.732 -3.547 -0.029 691 H ASN 104 H ASN 104 -2.968 -2.969 -5.539 692 HA ASN 104 HA ASN 104 -2.179 -0.584 -7.088 693 HB2 ASN 104 2HB ASN 104 -2.412 -2.480 -8.605 694 HB3 ASN 104 3HB ASN 104 -3.999 -2.848 -7.941 695 HD21 ASN 104 1HD2 ASN 104 -4.992 -2.672 -9.920 696 HD22 ASN 104 2HD2 ASN 104 -5.247 -1.156 -10.706 697 H VAL 105 H VAL 105 -3.068 0.952 -5.917 698 HA VAL 105 HA VAL 105 -5.977 0.913 -5.511 699 HB VAL 105 HB VAL 105 -5.780 1.774 -3.145 700 HG11 VAL 105 1HG1 VAL 105 -4.725 -1.015 -3.282 701 HG12 VAL 105 2HG1 VAL 105 -6.304 -0.624 -3.958 702 HG13 VAL 105 3HG1 VAL 105 -5.985 -0.312 -2.258 703 HG21 VAL 105 3HG2 VAL 105 -2.989 0.670 -3.419 704 HG22 VAL 105 1HG2 VAL 105 -3.753 1.156 -1.905 705 HG23 VAL 105 2HG2 VAL 105 -3.427 2.358 -3.154 706 H GLU 106 H GLU 106 -7.009 2.831 -5.309 707 HA GLU 106 HA GLU 106 -5.450 5.275 -5.067 708 HB2 GLU 106 2HB GLU 106 -5.540 4.828 -7.505 709 HB3 GLU 106 3HB GLU 106 -7.296 4.813 -7.422 710 HG2 GLU 106 2HG GLU 106 -7.346 7.136 -6.832 711 HG3 GLU 106 3HG GLU 106 -5.592 7.185 -6.690 712 H SER 107 H SER 107 -6.645 7.037 -4.330 713 HA SER 107 HA SER 107 -9.280 6.319 -3.267 714 HB2 SER 107 2HB SER 107 -7.574 6.649 -1.547 715 HB3 SER 107 3HB SER 107 -7.215 8.250 -2.193 716 HG SER 107 HG SER 107 -9.524 7.331 -0.861 717 H GLY 108 H GLY 108 -10.987 7.518 -3.798 718 HA2 GLY 108 2HA GLY 108 -10.698 9.789 -5.558 719 HA3 GLY 108 3HA GLY 108 -12.207 9.112 -4.958 720 H ASP 109 H ASP 109 -10.417 9.407 -2.315 721 HA ASP 109 HA ASP 109 -11.394 12.122 -1.713 722 HB2 ASP 109 2HB ASP 109 -11.142 9.710 0.108 723 HB3 ASP 109 3HB ASP 109 -11.445 11.338 0.695 724 H ASP 110 H ASP 110 -10.062 12.510 0.674 725 HA ASP 110 HA ASP 110 -7.387 13.059 -0.239 726 HB2 ASP 110 2HB ASP 110 -8.714 13.464 2.446 727 HB3 ASP 110 3HB ASP 110 -7.082 13.997 2.068 728 H GLY 111 H GLY 111 -7.964 10.250 -0.153 729 HA2 GLY 111 2HA GLY 111 -6.706 8.387 0.372 730 HA3 GLY 111 3HA GLY 111 -5.737 9.382 1.441 731 H GLN 112 H GLN 112 -8.972 9.823 2.086 732 HA GLN 112 HA GLN 112 -8.816 8.647 4.651 733 HB2 GLN 112 2HB GLN 112 -11.220 9.571 3.067 734 HB3 GLN 112 3HB GLN 112 -11.243 9.156 4.776 735 HG2 GLN 112 2HG GLN 112 -9.709 10.971 5.264 736 HG3 GLN 112 3HG GLN 112 -9.604 11.363 3.548 737 HE21 GLN 112 1HE2 GLN 112 -10.478 12.987 5.810 738 HE22 GLN 112 2HE2 GLN 112 -12.086 13.495 5.431 739 H THR 113 H THR 113 -10.447 7.677 1.642 740 HA THR 113 HA THR 113 -10.821 4.989 2.718 741 HB THR 113 HB THR 113 -12.463 4.826 0.781 742 HG1 THR 113 HG1 THR 113 -13.080 7.344 0.422 743 HG21 THR 113 3HG2 THR 113 -14.237 6.098 1.926 744 HG22 THR 113 1HG2 THR 113 -13.015 6.932 2.884 745 HG23 THR 113 2HG2 THR 113 -13.250 5.193 3.073 746 H LEU 114 H LEU 114 -9.336 3.562 1.916 747 HA LEU 114 HA LEU 114 -8.141 4.193 -0.702 748 HB2 LEU 114 2HB LEU 114 -6.622 4.173 1.307 749 HB3 LEU 114 3HB LEU 114 -7.024 2.485 1.520 750 HG LEU 114 HG LEU 114 -6.002 1.967 -0.660 751 HD11 LEU 114 1HD1 LEU 114 -5.262 4.892 -0.655 752 HD12 LEU 114 2HD1 LEU 114 -6.354 4.088 -1.786 753 HD13 LEU 114 3HD1 LEU 114 -4.638 3.683 -1.776 754 HD21 LEU 114 3HD2 LEU 114 -4.217 3.502 1.224 755 HD22 LEU 114 1HD2 LEU 114 -3.682 2.318 0.032 756 HD23 LEU 114 2HD2 LEU 114 -4.684 1.812 1.395 757 H ASN 115 H ASN 115 -8.740 2.835 -2.321 758 HA ASN 115 HA ASN 115 -9.228 0.069 -1.628 759 HB2 ASN 115 2HB ASN 115 -11.420 0.026 -2.856 760 HB3 ASN 115 3HB ASN 115 -11.438 0.896 -1.330 761 HD21 ASN 115 1HD2 ASN 115 -13.186 2.138 -1.813 762 HD22 ASN 115 2HD2 ASN 115 -13.185 3.377 -3.017 763 H GLY 116 H GLY 116 -9.647 -1.305 -3.496 764 HA2 GLY 116 2HA GLY 116 -9.403 -0.983 -6.107 765 HA3 GLY 116 3HA GLY 116 -7.751 -0.644 -5.601 766 H THR 117 H THR 117 -6.529 -2.331 -5.943 767 HA THR 117 HA THR 117 -7.473 -4.977 -5.121 768 HB THR 117 HB THR 117 -6.311 -5.972 -7.123 769 HG1 THR 117 HG1 THR 117 -6.298 -4.340 -8.949 770 HG21 THR 117 3HG2 THR 117 -8.748 -5.845 -7.030 771 HG22 THR 117 1HG2 THR 117 -8.189 -5.548 -8.676 772 HG23 THR 117 2HG2 THR 117 -8.705 -4.200 -7.661 773 H MET 118 H MET 118 -5.719 -6.530 -4.806 774 HA MET 118 HA MET 118 -3.031 -5.554 -4.697 775 HB2 MET 118 2HB MET 118 -2.677 -5.707 -2.331 776 HB3 MET 118 3HB MET 118 -4.021 -4.620 -2.604 777 HG2 MET 118 2HG MET 118 -4.676 -5.902 -0.776 778 HG3 MET 118 3HG MET 118 -5.532 -6.616 -2.134 779 HE1 MET 118 3HE MET 118 -1.708 -8.481 -0.343 780 HE2 MET 118 1HE MET 118 -2.439 -7.021 0.307 781 HE3 MET 118 2HE MET 118 -1.725 -7.006 -1.304 782 H THR 119 H THR 119 -1.548 -7.265 -3.951 783 HA THR 119 HA THR 119 -2.725 -9.940 -4.206 784 HB THR 119 HB THR 119 -0.209 -9.037 -5.629 785 HG1 THR 119 HG1 THR 119 -1.686 -9.618 -7.496 786 HG21 THR 119 3HG2 THR 119 -0.301 -11.236 -6.705 787 HG22 THR 119 1HG2 THR 119 -1.727 -11.648 -5.752 788 HG23 THR 119 2HG2 THR 119 -0.175 -11.397 -4.953 789 H TYR 120 H TYR 120 -2.117 -11.215 -2.578 790 HA TYR 120 HA TYR 120 0.207 -10.543 -0.959 791 HB2 TYR 120 2HB TYR 120 -1.917 -12.663 -0.682 792 HB3 TYR 120 3HB TYR 120 -0.492 -12.633 0.336 793 HD1 TYR 120 HD2 TYR 120 -0.111 -10.589 1.795 794 HD2 TYR 120 HD1 TYR 120 -3.807 -11.364 -0.162 795 HE1 TYR 120 HE2 TYR 120 -1.254 -9.072 3.363 796 HE2 TYR 120 HE1 TYR 120 -4.958 -9.857 1.411 797 HH TYR 120 HH TYR 120 -4.768 -8.723 3.345 798 H ALA 121 H ALA 121 1.739 -12.291 -0.371 799 HA ALA 121 HA ALA 121 3.151 -13.131 -2.599 800 HB1 ALA 121 3HB ALA 121 3.339 -14.292 0.173 801 HB2 ALA 121 1HB ALA 121 4.114 -12.801 -0.363 802 HB3 ALA 121 2HB ALA 121 4.581 -14.342 -1.080 803 H GLY 122 H GLY 122 0.616 -14.905 -0.901 804 HA2 GLY 122 2HA GLY 122 0.941 -17.016 -2.902 805 HA3 GLY 122 3HA GLY 122 0.916 -17.468 -1.204 806 H GLU 123 H GLU 123 -1.036 -14.845 -2.421 807 HA GLU 123 HA GLU 123 -3.415 -16.504 -1.861 808 HB2 GLU 123 2HB GLU 123 -2.860 -14.430 -0.413 809 HB3 GLU 123 3HB GLU 123 -3.404 -13.501 -1.803 810 HG2 GLU 123 2HG GLU 123 -5.245 -13.658 -0.354 811 HG3 GLU 123 3HG GLU 123 -5.564 -14.793 -1.666 812 H GLY 124 H GLY 124 -2.270 -13.775 -3.825 813 HA2 GLY 124 2HA GLY 124 -2.584 -13.923 -6.247 814 HA3 GLY 124 3HA GLY 124 -4.181 -14.589 -5.915 815 HA PRO 125 HA PRO 125 -4.445 -9.916 -6.357 816 HB2 PRO 125 2HB PRO 125 -6.167 -10.398 -8.663 817 HB3 PRO 125 3HB PRO 125 -4.681 -9.451 -8.567 818 HG2 PRO 125 2HG PRO 125 -4.837 -11.802 -9.917 819 HG3 PRO 125 3HG PRO 125 -3.350 -11.236 -9.139 820 HD2 PRO 125 2HD PRO 125 -5.345 -13.249 -8.167 821 HD3 PRO 125 3HD PRO 125 -3.569 -13.299 -8.097 822 H ILE 126 H ILE 126 -5.802 -9.414 -4.780 823 HA ILE 126 HA ILE 126 -8.630 -10.126 -5.090 824 HB ILE 126 HB ILE 126 -8.847 -10.325 -2.640 825 HG12 ILE 126 2HG1 ILE 126 -5.822 -10.241 -2.614 826 HG13 ILE 126 3HG1 ILE 126 -6.877 -8.957 -2.033 827 HG21 ILE 126 1HG2 ILE 126 -7.796 -12.532 -2.406 828 HG22 ILE 126 2HG2 ILE 126 -6.847 -12.222 -3.862 829 HG23 ILE 126 3HG2 ILE 126 -8.604 -12.338 -3.961 830 HD11 ILE 126 3HD1 ILE 126 -6.033 -10.258 -0.191 831 HD12 ILE 126 1HD1 ILE 126 -6.663 -11.738 -0.909 832 HD13 ILE 126 2HD1 ILE 126 -7.775 -10.492 -0.344 833 H GLY 127 H GLY 127 -10.066 -8.672 -3.857 834 HA2 GLY 127 2HA GLY 127 -9.387 -5.954 -4.434 835 HA3 GLY 127 3HA GLY 127 -10.867 -6.509 -3.668 836 H PHE 128 H PHE 128 -9.007 -4.253 -3.089 837 HA PHE 128 HA PHE 128 -8.630 -4.889 -0.248 838 HB2 PHE 128 2HB PHE 128 -6.399 -4.779 -1.101 839 HB3 PHE 128 3HB PHE 128 -6.742 -3.303 -1.997 840 HD1 PHE 128 HD1 PHE 128 -7.274 -4.316 1.580 841 HD2 PHE 128 HD2 PHE 128 -5.520 -1.559 -1.128 842 HE1 PHE 128 HE1 PHE 128 -6.473 -2.960 3.471 843 HE2 PHE 128 HE2 PHE 128 -4.720 -0.203 0.748 844 HZ PHE 128 HZ PHE 128 -5.197 -0.897 3.052 845 H LYS 129 H LYS 129 -9.463 -3.572 1.148 846 HA LYS 129 HA LYS 129 -10.387 -0.917 0.341 847 HB2 LYS 129 2HB LYS 129 -12.266 -2.430 0.104 848 HB3 LYS 129 3HB LYS 129 -11.963 -3.110 1.689 849 HG2 LYS 129 2HG LYS 129 -12.610 -1.004 2.719 850 HG3 LYS 129 3HG LYS 129 -12.879 -0.306 1.117 851 HD2 LYS 129 2HD LYS 129 -14.582 -1.987 0.650 852 HD3 LYS 129 3HD LYS 129 -14.302 -2.719 2.231 853 HE2 LYS 129 2HE LYS 129 -15.236 0.094 1.765 854 HE3 LYS 129 3HE LYS 129 -16.291 -1.262 2.156 855 HZ1 LYS 129 3HZ LYS 129 -14.909 -1.561 4.203 856 HZ2 LYS 129 1HZ LYS 129 -15.836 -0.141 4.172 857 HZ3 LYS 129 2HZ LYS 129 -14.183 -0.070 3.854 858 H GLY 130 H GLY 130 -9.630 0.527 1.810 859 HA2 GLY 130 2HA GLY 130 -9.338 -0.368 4.585 860 HA3 GLY 130 3HA GLY 130 -7.974 0.367 3.761 861 H THR 131 H THR 131 -9.708 1.118 6.087 862 HA THR 131 HA THR 131 -10.350 3.846 5.183 863 HB THR 131 HB THR 131 -11.645 2.342 7.481 864 HG1 THR 131 HG1 THR 131 -12.913 1.542 6.008 865 HG21 THR 131 3HG2 THR 131 -13.246 4.199 7.493 866 HG22 THR 131 1HG2 THR 131 -12.367 4.975 6.173 867 HG23 THR 131 2HG2 THR 131 -11.607 4.793 7.755 868 H LEU 132 H LEU 132 -9.324 5.496 6.253 869 HA LEU 132 HA LEU 132 -7.213 4.920 8.058 870 HB2 LEU 132 2HB LEU 132 -7.175 6.860 6.563 871 HB3 LEU 132 3HB LEU 132 -8.579 7.533 7.363 872 HG LEU 132 HG LEU 132 -7.245 7.836 9.422 873 HD11 LEU 132 1HD1 LEU 132 -4.824 7.560 9.353 874 HD12 LEU 132 2HD1 LEU 132 -4.943 6.867 7.736 875 HD13 LEU 132 3HD1 LEU 132 -5.653 6.024 9.113 876 HD21 LEU 132 3HD2 LEU 132 -7.429 9.659 7.807 877 HD22 LEU 132 1HD2 LEU 132 -6.007 9.055 6.957 878 HD23 LEU 132 2HD2 LEU 132 -5.854 9.667 8.602 879 H THR 133 H THR 133 -7.103 5.148 10.331 880 HA THR 133 HA THR 133 -9.715 5.253 11.612 881 HB THR 133 HB THR 133 -8.311 3.231 12.085 882 HG1 THR 133 HG1 THR 133 -9.093 5.050 14.073 883 HG21 THR 133 3HG2 THR 133 -6.092 4.239 11.965 884 HG22 THR 133 1HG2 THR 133 -6.329 3.481 13.539 885 HG23 THR 133 2HG2 THR 133 -6.443 5.233 13.378 Start of MODEL 16 1 H1 ALA 2 1H ALA 2 -0.284 8.598 8.340 2 H2 ALA 2 2H ALA 2 -0.051 7.017 7.752 3 H3 ALA 2 3H ALA 2 0.076 7.334 9.412 4 HA ALA 2 HA ALA 2 -2.218 7.830 9.579 5 HB1 ALA 2 3HB ALA 2 -2.311 7.245 6.619 6 HB2 ALA 2 1HB ALA 2 -2.498 8.833 7.366 7 HB3 ALA 2 2HB ALA 2 -3.699 7.575 7.656 8 H LEU 3 H LEU 3 -3.285 6.172 10.469 9 HA LEU 3 HA LEU 3 -2.407 3.465 9.818 10 HB2 LEU 3 2HB LEU 3 -2.551 4.462 12.201 11 HB3 LEU 3 3HB LEU 3 -4.281 4.292 12.040 12 HG LEU 3 HG LEU 3 -3.255 2.479 13.359 13 HD11 LEU 3 1HD1 LEU 3 -4.284 0.579 12.225 14 HD12 LEU 3 2HD1 LEU 3 -4.450 1.549 10.762 15 HD13 LEU 3 3HD1 LEU 3 -5.324 2.002 12.225 16 HD21 LEU 3 3HD2 LEU 3 -1.860 1.736 10.793 17 HD22 LEU 3 1HD2 LEU 3 -1.864 0.792 12.280 18 HD23 LEU 3 2HD2 LEU 3 -1.092 2.377 12.245 19 H TYR 4 H TYR 4 -3.707 2.022 8.783 20 HA TYR 4 HA TYR 4 -6.437 2.936 8.161 21 HB2 TYR 4 2HB TYR 4 -4.499 1.561 6.301 22 HB3 TYR 4 3HB TYR 4 -6.204 1.780 5.956 23 HD1 TYR 4 HD2 TYR 4 -7.065 4.242 5.998 24 HD2 TYR 4 HD1 TYR 4 -2.968 3.161 5.614 25 HE1 TYR 4 HE2 TYR 4 -6.588 6.438 4.989 26 HE2 TYR 4 HE1 TYR 4 -2.480 5.354 4.604 27 HH TYR 4 HH TYR 4 -3.912 7.118 3.271 28 H ASN 5 H ASN 5 -8.027 1.469 8.042 29 HA ASN 5 HA ASN 5 -7.573 -1.125 9.315 30 HB2 ASN 5 2HB ASN 5 -10.131 0.214 8.355 31 HB3 ASN 5 3HB ASN 5 -10.067 -1.322 9.211 32 HD21 ASN 5 1HD2 ASN 5 -9.453 -1.331 11.400 33 HD22 ASN 5 2HD2 ASN 5 -9.588 0.089 12.376 34 H VAL 6 H VAL 6 -7.842 -3.091 8.182 35 HA VAL 6 HA VAL 6 -7.901 -2.681 5.270 36 HB VAL 6 HB VAL 6 -6.323 -4.680 6.872 37 HG11 VAL 6 1HG1 VAL 6 -7.185 -5.810 4.887 38 HG12 VAL 6 2HG1 VAL 6 -5.453 -5.525 4.740 39 HG13 VAL 6 3HG1 VAL 6 -6.591 -4.500 3.868 40 HG21 VAL 6 3HG2 VAL 6 -5.375 -2.460 6.772 41 HG22 VAL 6 1HG2 VAL 6 -5.539 -2.448 5.016 42 HG23 VAL 6 2HG2 VAL 6 -4.421 -3.572 5.790 43 H GLU 7 H GLU 7 -9.345 -3.591 4.105 44 HA GLU 7 HA GLU 7 -10.659 -6.055 5.008 45 HB2 GLU 7 2HB GLU 7 -11.862 -3.681 3.568 46 HB3 GLU 7 3HB GLU 7 -12.669 -5.233 3.717 47 HG2 GLU 7 2HG GLU 7 -12.715 -5.005 6.124 48 HG3 GLU 7 3HG GLU 7 -11.826 -3.485 6.014 49 H ASN 8 H ASN 8 -10.700 -7.662 3.533 50 HA ASN 8 HA ASN 8 -9.664 -7.078 0.840 51 HB2 ASN 8 2HB ASN 8 -9.046 -9.417 2.647 52 HB3 ASN 8 3HB ASN 8 -8.691 -9.421 0.925 53 HD21 ASN 8 1HD2 ASN 8 -7.967 -6.612 0.850 54 HD22 ASN 8 2HD2 ASN 8 -6.421 -6.493 1.606 55 H GLN 9 H GLN 9 -10.649 -8.049 -0.863 56 HA GLN 9 HA GLN 9 -13.037 -9.663 -0.235 57 HB2 GLN 9 2HB GLN 9 -13.529 -7.362 -1.040 58 HB3 GLN 9 3HB GLN 9 -12.664 -7.726 -2.521 59 HG2 GLN 9 2HG GLN 9 -14.301 -9.494 -3.023 60 HG3 GLN 9 3HG GLN 9 -15.184 -9.065 -1.556 61 HE21 GLN 9 1HE2 GLN 9 -17.039 -8.440 -2.588 62 HE22 GLN 9 2HE2 GLN 9 -17.137 -7.021 -3.576 63 H TRP 10 H TRP 10 -12.897 -11.689 -0.979 64 HA TRP 10 HA TRP 10 -11.593 -12.161 -3.553 65 HB2 TRP 10 2HB TRP 10 -10.568 -14.260 -2.645 66 HB3 TRP 10 3HB TRP 10 -9.899 -12.799 -1.942 67 HD1 TRP 10 HD1 TRP 10 -12.381 -15.638 -1.025 68 HE1 TRP 10 HE1 TRP 10 -12.351 -15.933 1.530 69 HE3 TRP 10 HE3 TRP 10 -9.268 -11.769 0.214 70 HZ2 TRP 10 HZ2 TRP 10 -11.165 -14.708 3.770 71 HZ3 TRP 10 HZ3 TRP 10 -8.734 -11.412 2.592 72 HH2 TRP 10 HH2 TRP 10 -9.663 -12.847 4.331 73 H GLY 11 H GLY 11 -12.561 -13.747 -4.818 74 HA2 GLY 11 2HA GLY 11 -13.945 -15.717 -4.985 75 HA3 GLY 11 3HA GLY 11 -14.844 -15.139 -3.584 76 H GLY 12 H GLY 12 -14.046 -12.586 -5.558 77 HA2 GLY 12 2HA GLY 12 -15.101 -11.788 -7.543 78 HA3 GLY 12 3HA GLY 12 -16.465 -12.840 -7.197 79 H SER 13 H SER 13 -16.795 -10.177 -7.818 80 HA SER 13 HA SER 13 -17.011 -8.420 -5.673 81 HB2 SER 13 2HB SER 13 -18.710 -8.587 -8.170 82 HB3 SER 13 3HB SER 13 -18.677 -7.211 -7.068 83 HG SER 13 HG SER 13 -16.715 -6.679 -7.739 84 H SER 14 H SER 14 -19.040 -11.133 -6.505 85 HA SER 14 HA SER 14 -21.284 -10.364 -4.954 86 HB2 SER 14 2HB SER 14 -20.408 -13.121 -5.841 87 HB3 SER 14 3HB SER 14 -22.011 -12.687 -5.246 88 HG SER 14 HG SER 14 -20.738 -11.857 -7.639 89 H ALA 15 H ALA 15 -18.198 -11.207 -3.983 90 HA ALA 15 HA ALA 15 -19.061 -12.583 -1.564 91 HB1 ALA 15 3HB ALA 15 -16.280 -11.978 -2.564 92 HB2 ALA 15 1HB ALA 15 -17.140 -13.506 -2.760 93 HB3 ALA 15 2HB ALA 15 -16.680 -12.951 -1.149 94 HA PRO 16 HA PRO 16 -18.853 -8.872 0.879 95 HB2 PRO 16 2HB PRO 16 -18.243 -10.493 3.231 96 HB3 PRO 16 3HB PRO 16 -19.721 -9.608 2.845 97 HG2 PRO 16 2HG PRO 16 -19.613 -12.314 2.855 98 HG3 PRO 16 3HG PRO 16 -20.672 -11.405 1.764 99 HD2 PRO 16 2HD PRO 16 -18.016 -12.672 1.207 100 HD3 PRO 16 3HD PRO 16 -19.498 -12.673 0.224 101 H TRP 17 H TRP 17 -17.465 -7.688 2.347 102 HA TRP 17 HA TRP 17 -14.656 -8.084 1.703 103 HB2 TRP 17 2HB TRP 17 -16.093 -5.888 3.215 104 HB3 TRP 17 3HB TRP 17 -14.356 -5.911 2.943 105 HD1 TRP 17 HD1 TRP 17 -17.671 -5.363 1.113 106 HE1 TRP 17 HE1 TRP 17 -17.196 -4.213 -1.134 107 HE3 TRP 17 HE3 TRP 17 -12.572 -5.605 1.139 108 HZ2 TRP 17 HZ2 TRP 17 -14.958 -3.507 -2.700 109 HZ3 TRP 17 HZ3 TRP 17 -11.336 -4.674 -0.777 110 HH2 TRP 17 HH2 TRP 17 -12.508 -3.647 -2.653 111 H ASN 18 H ASN 18 -13.166 -8.882 3.077 112 HA ASN 18 HA ASN 18 -14.099 -9.665 5.764 113 HB2 ASN 18 2HB ASN 18 -11.933 -10.891 4.033 114 HB3 ASN 18 3HB ASN 18 -12.363 -11.431 5.650 115 HD21 ASN 18 1HD2 ASN 18 -13.269 -11.349 2.322 116 HD22 ASN 18 2HD2 ASN 18 -14.564 -12.488 2.428 117 H GLU 19 H GLU 19 -12.839 -9.182 7.545 118 HA GLU 19 HA GLU 19 -10.527 -7.443 7.004 119 HB2 GLU 19 2HB GLU 19 -10.953 -6.357 9.141 120 HB3 GLU 19 3HB GLU 19 -12.398 -6.301 8.144 121 HG2 GLU 19 2HG GLU 19 -13.394 -8.099 9.412 122 HG3 GLU 19 3HG GLU 19 -11.918 -8.285 10.358 123 H GLY 20 H GLY 20 -8.544 -7.970 7.918 124 HA2 GLY 20 2HA GLY 20 -8.495 -9.909 10.074 125 HA3 GLY 20 3HA GLY 20 -7.776 -10.411 8.554 126 H GLY 21 H GLY 21 -7.653 -7.109 9.815 127 HA2 GLY 21 2HA GLY 21 -5.384 -6.985 11.213 128 HA3 GLY 21 3HA GLY 21 -4.760 -7.253 9.596 129 H GLN 22 H GLN 22 -3.793 -5.145 10.475 130 HA GLN 22 HA GLN 22 -5.249 -2.954 9.211 131 HB2 GLN 22 2HB GLN 22 -4.659 -1.445 11.096 132 HB3 GLN 22 3HB GLN 22 -5.789 -2.710 11.562 133 HG2 GLN 22 2HG GLN 22 -3.825 -3.996 12.460 134 HG3 GLN 22 3HG GLN 22 -2.847 -2.562 12.170 135 HE21 GLN 22 1HE2 GLN 22 -5.090 -0.786 12.872 136 HE22 GLN 22 2HE2 GLN 22 -5.201 -0.835 14.595 137 H TRP 23 H TRP 23 -3.860 -1.367 8.315 138 HA TRP 23 HA TRP 23 -1.037 -2.218 8.237 139 HB2 TRP 23 2HB TRP 23 -2.717 -1.035 6.025 140 HB3 TRP 23 3HB TRP 23 -0.969 -1.185 5.937 141 HD1 TRP 23 HD1 TRP 23 -2.230 -4.188 7.635 142 HE1 TRP 23 HE1 TRP 23 -2.435 -6.160 6.005 143 HE3 TRP 23 HE3 TRP 23 -1.728 -1.649 3.219 144 HZ2 TRP 23 HZ2 TRP 23 -2.373 -6.587 3.229 145 HZ3 TRP 23 HZ3 TRP 23 -1.806 -2.946 1.106 146 HH2 TRP 23 HH2 TRP 23 -2.120 -5.339 1.131 147 H GLU 24 H GLU 24 0.566 -0.647 7.969 148 HA GLU 24 HA GLU 24 -0.277 2.026 8.905 149 HB2 GLU 24 2HB GLU 24 1.146 0.886 10.554 150 HB3 GLU 24 3HB GLU 24 2.381 0.638 9.327 151 HG2 GLU 24 2HG GLU 24 2.720 3.034 9.145 152 HG3 GLU 24 3HG GLU 24 1.432 3.324 10.310 153 H ILE 25 H ILE 25 -0.198 3.497 7.353 154 HA ILE 25 HA ILE 25 1.908 3.242 5.322 155 HB ILE 25 HB ILE 25 -1.016 3.790 4.791 156 HG12 ILE 25 2HG1 ILE 25 0.753 1.556 3.785 157 HG13 ILE 25 3HG1 ILE 25 -0.346 1.402 5.149 158 HG21 ILE 25 1HG2 ILE 25 1.312 3.814 2.879 159 HG22 ILE 25 2HG2 ILE 25 0.355 5.207 3.381 160 HG23 ILE 25 3HG2 ILE 25 -0.388 3.920 2.429 161 HD11 ILE 25 3HD1 ILE 25 -2.238 1.831 3.690 162 HD12 ILE 25 1HD1 ILE 25 -1.284 0.472 3.095 163 HD13 ILE 25 2HD1 ILE 25 -1.146 2.053 2.320 164 H GLY 26 H GLY 26 2.905 5.077 4.756 165 HA2 GLY 26 2HA GLY 26 2.843 7.396 4.134 166 HA3 GLY 26 3HA GLY 26 1.621 7.649 5.366 167 H SER 27 H SER 27 3.238 5.967 7.250 168 HA SER 27 HA SER 27 4.417 6.497 9.131 169 HB2 SER 27 2HB SER 27 6.878 7.180 8.499 170 HB3 SER 27 3HB SER 27 6.271 5.576 8.097 171 HG SER 27 HG SER 27 7.201 7.492 6.463 172 H ARG 28 H ARG 28 2.863 8.784 7.994 173 HA ARG 28 HA ARG 28 3.989 10.851 9.648 174 HB2 ARG 28 2HB ARG 28 3.442 11.315 6.701 175 HB3 ARG 28 3HB ARG 28 3.707 12.593 7.873 176 HG2 ARG 28 2HG ARG 28 5.969 11.629 8.298 177 HG3 ARG 28 3HG ARG 28 5.686 10.521 6.957 178 HD2 ARG 28 2HD ARG 28 5.616 13.530 6.776 179 HD3 ARG 28 3HD ARG 28 6.987 12.524 6.321 180 HE ARG 28 HE ARG 28 4.845 11.576 4.876 181 HH11 ARG 28 1HH1 ARG 28 6.569 14.611 5.199 182 HH12 ARG 28 2HH1 ARG 28 6.251 15.137 3.585 183 HH21 ARG 28 1HH2 ARG 28 4.417 12.261 2.703 184 HH22 ARG 28 2HH2 ARG 28 5.020 13.783 2.145 185 H SER 29 H SER 29 2.418 12.354 10.291 186 HA SER 29 HA SER 29 -0.321 11.442 9.878 187 HB2 SER 29 2HB SER 29 0.696 13.571 11.769 188 HB3 SER 29 3HB SER 29 -0.866 12.751 11.824 189 HG SER 29 HG SER 29 1.032 12.001 13.225 190 H ASP 30 H ASP 30 1.832 13.775 8.721 191 HA ASP 30 HA ASP 30 0.018 15.955 8.315 192 HB2 ASP 30 2HB ASP 30 2.764 15.407 7.184 193 HB3 ASP 30 3HB ASP 30 1.863 16.890 6.907 194 H GLN 31 H GLN 31 1.117 13.242 6.390 195 HA GLN 31 HA GLN 31 -0.691 14.123 4.270 196 HB2 GLN 31 2HB GLN 31 2.198 13.709 4.043 197 HB3 GLN 31 3HB GLN 31 1.240 12.945 2.782 198 HG2 GLN 31 2HG GLN 31 1.049 15.844 3.553 199 HG3 GLN 31 3HG GLN 31 2.000 15.214 2.202 200 HE21 GLN 31 1HE2 GLN 31 -1.209 15.758 3.433 201 HE22 GLN 31 2HE2 GLN 31 -2.029 15.533 1.925 202 H ASN 32 H ASN 32 -2.052 12.723 3.608 203 HA ASN 32 HA ASN 32 -1.596 9.885 4.122 204 HB2 ASN 32 2HB ASN 32 -4.102 11.418 3.370 205 HB3 ASN 32 3HB ASN 32 -4.026 9.662 3.441 206 HD21 ASN 32 1HD2 ASN 32 -5.523 9.473 5.056 207 HD22 ASN 32 2HD2 ASN 32 -5.232 9.983 6.683 208 H VAL 33 H VAL 33 -1.887 8.384 2.451 209 HA VAL 33 HA VAL 33 -1.082 9.405 -0.153 210 HB VAL 33 HB VAL 33 -0.563 7.079 -0.724 211 HG11 VAL 33 1HG1 VAL 33 0.528 7.922 1.958 212 HG12 VAL 33 2HG1 VAL 33 1.158 8.382 0.374 213 HG13 VAL 33 3HG1 VAL 33 1.243 6.701 0.906 214 HG21 VAL 33 3HG2 VAL 33 -1.606 6.443 2.037 215 HG22 VAL 33 1HG2 VAL 33 -0.746 5.316 0.990 216 HG23 VAL 33 2HG2 VAL 33 -2.321 5.943 0.505 217 H VAL 34 H VAL 34 -2.234 9.089 -2.038 218 HA VAL 34 HA VAL 34 -4.972 8.077 -1.656 219 HB VAL 34 HB VAL 34 -5.642 9.430 -3.609 220 HG11 VAL 34 1HG1 VAL 34 -4.333 10.977 -1.387 221 HG12 VAL 34 2HG1 VAL 34 -5.961 10.299 -1.372 222 HG13 VAL 34 3HG1 VAL 34 -5.560 11.607 -2.489 223 HG21 VAL 34 3HG2 VAL 34 -2.840 10.549 -3.444 224 HG22 VAL 34 1HG2 VAL 34 -4.140 11.184 -4.451 225 HG23 VAL 34 2HG2 VAL 34 -3.497 9.568 -4.756 226 H ALA 35 H ALA 35 -2.023 7.504 -3.289 227 HA ALA 35 HA ALA 35 -3.317 5.285 -4.660 228 HB1 ALA 35 3HB ALA 35 -2.448 5.771 -6.824 229 HB2 ALA 35 1HB ALA 35 -1.543 7.154 -6.211 230 HB3 ALA 35 2HB ALA 35 -3.304 7.207 -6.261 231 H ILE 36 H ILE 36 -2.043 3.532 -4.969 232 HA ILE 36 HA ILE 36 0.808 3.707 -4.427 233 HB ILE 36 HB ILE 36 -1.025 1.820 -2.910 234 HG12 ILE 36 2HG1 ILE 36 0.826 3.955 -1.829 235 HG13 ILE 36 3HG1 ILE 36 -0.921 4.125 -1.984 236 HG21 ILE 36 1HG2 ILE 36 1.029 0.984 -1.839 237 HG22 ILE 36 2HG2 ILE 36 1.984 1.992 -2.928 238 HG23 ILE 36 3HG2 ILE 36 1.000 0.677 -3.576 239 HD11 ILE 36 3HD1 ILE 36 -0.268 3.571 0.296 240 HD12 ILE 36 1HD1 ILE 36 0.505 2.097 -0.280 241 HD13 ILE 36 2HD1 ILE 36 -1.242 2.287 -0.416 242 H ASN 37 H ASN 37 1.735 2.631 -6.073 243 HA ASN 37 HA ASN 37 0.448 0.165 -6.978 244 HB2 ASN 37 2HB ASN 37 0.131 2.365 -8.453 245 HB3 ASN 37 3HB ASN 37 1.735 1.911 -9.023 246 HD21 ASN 37 1HD2 ASN 37 -1.110 1.878 -10.094 247 HD22 ASN 37 2HD2 ASN 37 -1.289 0.304 -10.774 248 H VAL 38 H VAL 38 1.901 -1.440 -6.723 249 HA VAL 38 HA VAL 38 4.708 -0.931 -7.134 250 HB VAL 38 HB VAL 38 5.430 -1.675 -4.883 251 HG11 VAL 38 1HG1 VAL 38 4.937 0.405 -3.669 252 HG12 VAL 38 2HG1 VAL 38 3.704 0.792 -4.871 253 HG13 VAL 38 3HG1 VAL 38 5.398 0.696 -5.346 254 HG21 VAL 38 3HG2 VAL 38 3.830 -1.660 -3.017 255 HG22 VAL 38 1HG2 VAL 38 3.440 -2.897 -4.211 256 HG23 VAL 38 2HG2 VAL 38 2.515 -1.396 -4.163 257 H GLU 39 H GLU 39 5.984 -2.815 -7.197 258 HA GLU 39 HA GLU 39 4.584 -5.368 -6.896 259 HB2 GLU 39 2HB GLU 39 4.597 -4.748 -9.287 260 HB3 GLU 39 3HB GLU 39 6.342 -4.569 -9.223 261 HG2 GLU 39 2HG GLU 39 6.573 -6.942 -8.727 262 HG3 GLU 39 3HG GLU 39 4.820 -7.125 -8.776 263 H SER 40 H SER 40 5.882 -7.021 -6.151 264 HA SER 40 HA SER 40 8.180 -6.241 -4.685 265 HB2 SER 40 2HB SER 40 8.261 -8.590 -3.990 266 HB3 SER 40 3HB SER 40 6.626 -7.938 -3.869 267 HG SER 40 HG SER 40 7.164 -9.058 -6.308 268 H GLY 41 H GLY 41 10.276 -7.085 -4.821 269 HA2 GLY 41 2HA GLY 41 11.055 -7.783 -7.572 270 HA3 GLY 41 3HA GLY 41 12.097 -6.987 -6.399 271 H ASP 42 H ASP 42 11.704 -8.575 -4.183 272 HA ASP 42 HA ASP 42 12.624 -11.226 -5.074 273 HB2 ASP 42 2HB ASP 42 14.560 -9.888 -4.431 274 HB3 ASP 42 3HB ASP 42 13.820 -9.521 -2.882 275 H ASP 43 H ASP 43 10.702 -12.251 -4.601 276 HA ASP 43 HA ASP 43 9.165 -13.396 -3.368 277 HB2 ASP 43 2HB ASP 43 11.472 -13.310 -1.439 278 HB3 ASP 43 3HB ASP 43 10.006 -14.231 -1.125 279 H GLY 44 H GLY 44 8.894 -10.498 -3.169 280 HA2 GLY 44 2HA GLY 44 7.415 -9.096 -2.063 281 HA3 GLY 44 3HA GLY 44 7.034 -10.434 -0.992 282 H GLN 45 H GLN 45 10.302 -10.133 -0.909 283 HA GLN 45 HA GLN 45 10.238 -8.864 1.668 284 HB2 GLN 45 2HB GLN 45 12.593 -9.778 0.004 285 HB3 GLN 45 3HB GLN 45 12.660 -9.298 1.695 286 HG2 GLN 45 2HG GLN 45 11.118 -11.649 0.605 287 HG3 GLN 45 3HG GLN 45 12.686 -11.730 1.405 288 HE21 GLN 45 1HE2 GLN 45 12.802 -11.469 3.607 289 HE22 GLN 45 2HE2 GLN 45 11.409 -11.520 4.630 290 H THR 46 H THR 46 11.073 -8.016 -1.583 291 HA THR 46 HA THR 46 11.563 -5.261 -0.690 292 HB THR 46 HB THR 46 12.853 -5.000 -2.843 293 HG1 THR 46 HG1 THR 46 13.664 -7.239 -3.517 294 HG21 THR 46 3HG2 THR 46 13.905 -7.044 -0.878 295 HG22 THR 46 1HG2 THR 46 14.004 -5.294 -0.696 296 HG23 THR 46 2HG2 THR 46 14.885 -6.096 -1.997 297 H LEU 47 H LEU 47 10.564 -3.602 -1.879 298 HA LEU 47 HA LEU 47 8.550 -4.452 -3.844 299 HB2 LEU 47 2HB LEU 47 8.107 -2.515 -1.564 300 HB3 LEU 47 3HB LEU 47 6.969 -2.822 -2.856 301 HG LEU 47 HG LEU 47 7.854 -4.865 -0.814 302 HD11 LEU 47 1HD1 LEU 47 6.535 -3.091 0.201 303 HD12 LEU 47 2HD1 LEU 47 5.615 -4.590 0.119 304 HD13 LEU 47 3HD1 LEU 47 5.290 -3.295 -1.031 305 HD21 LEU 47 3HD2 LEU 47 7.205 -5.891 -2.915 306 HD22 LEU 47 1HD2 LEU 47 5.714 -4.953 -2.939 307 HD23 LEU 47 2HD2 LEU 47 5.967 -6.172 -1.693 308 H ASN 48 H ASN 48 8.552 -3.228 -5.634 309 HA ASN 48 HA ASN 48 9.794 -0.553 -5.516 310 HB2 ASN 48 2HB ASN 48 10.130 -2.670 -7.654 311 HB3 ASN 48 3HB ASN 48 10.554 -0.982 -7.901 312 HD21 ASN 48 1HD2 ASN 48 12.206 -3.361 -7.979 313 HD22 ASN 48 2HD2 ASN 48 13.468 -3.107 -6.825 314 H GLY 49 H GLY 49 8.685 1.055 -6.578 315 HA2 GLY 49 2HA GLY 49 6.958 0.692 -8.728 316 HA3 GLY 49 3HA GLY 49 5.983 0.527 -7.281 317 H THR 50 H THR 50 4.781 2.325 -7.812 318 HA THR 50 HA THR 50 6.129 4.881 -7.328 319 HB THR 50 HB THR 50 4.032 4.371 -9.460 320 HG1 THR 50 HG1 THR 50 6.676 4.099 -9.501 321 HG21 THR 50 3HG2 THR 50 4.422 6.712 -10.100 322 HG22 THR 50 1HG2 THR 50 5.516 6.902 -8.727 323 HG23 THR 50 2HG2 THR 50 3.801 6.593 -8.454 324 H MET 51 H MET 51 5.078 6.169 -5.904 325 HA MET 51 HA MET 51 2.336 5.419 -5.119 326 HB2 MET 51 2HB MET 51 3.886 4.558 -3.442 327 HB3 MET 51 3HB MET 51 4.639 6.132 -3.288 328 HG2 MET 51 2HG MET 51 1.731 5.835 -2.686 329 HG3 MET 51 3HG MET 51 2.923 5.280 -1.514 330 HE1 MET 51 3HE MET 51 4.713 6.794 -0.396 331 HE2 MET 51 1HE MET 51 4.856 8.534 -0.643 332 HE3 MET 51 2HE MET 51 5.297 7.425 -1.936 333 H THR 52 H THR 52 0.967 7.139 -4.413 334 HA THR 52 HA THR 52 1.998 9.833 -5.022 335 HB THR 52 HB THR 52 -0.718 8.785 -5.836 336 HG1 THR 52 HG1 THR 52 1.654 8.406 -6.960 337 HG21 THR 52 3HG2 THR 52 -0.818 10.859 -7.170 338 HG22 THR 52 1HG2 THR 52 0.720 11.366 -6.480 339 HG23 THR 52 2HG2 THR 52 -0.695 11.193 -5.442 340 H TYR 53 H TYR 53 1.585 11.315 -3.500 341 HA TYR 53 HA TYR 53 -0.068 10.687 -1.210 342 HB2 TYR 53 2HB TYR 53 1.586 13.129 -1.874 343 HB3 TYR 53 3HB TYR 53 0.672 12.939 -0.388 344 HD1 TYR 53 HD2 TYR 53 1.341 11.080 1.201 345 HD2 TYR 53 HD1 TYR 53 3.744 12.247 -2.110 346 HE1 TYR 53 HE2 TYR 53 3.300 10.026 2.254 347 HE2 TYR 53 HE1 TYR 53 5.704 11.202 -1.063 348 HH TYR 53 HH TYR 53 6.476 10.561 1.166 349 H ALA 54 H ALA 54 -1.556 12.450 -0.375 350 HA ALA 54 HA ALA 54 -3.638 12.848 -2.226 351 HB1 ALA 54 3HB ALA 54 -3.237 14.157 0.460 352 HB2 ALA 54 1HB ALA 54 -4.012 12.598 0.174 353 HB3 ALA 54 2HB ALA 54 -4.749 14.075 -0.445 354 H GLY 55 H GLY 55 -3.330 14.123 -3.962 355 HA2 GLY 55 2HA GLY 55 -3.514 16.202 -4.995 356 HA3 GLY 55 3HA GLY 55 -3.125 16.972 -3.468 357 H GLU 56 H GLU 56 -0.884 14.585 -4.039 358 HA GLU 56 HA GLU 56 0.979 16.581 -5.134 359 HB2 GLU 56 2HB GLU 56 1.525 14.150 -3.438 360 HB3 GLU 56 3HB GLU 56 2.772 15.182 -4.119 361 HG2 GLU 56 2HG GLU 56 0.668 16.032 -2.135 362 HG3 GLU 56 3HG GLU 56 2.370 15.715 -1.783 363 H GLY 57 H GLY 57 2.950 15.357 -6.198 364 HA2 GLY 57 2HA GLY 57 1.759 13.869 -8.389 365 HA3 GLY 57 3HA GLY 57 3.377 14.549 -8.351 366 HA PRO 58 HA PRO 58 3.204 9.843 -7.268 367 HB2 PRO 58 2HB PRO 58 4.185 9.490 -10.037 368 HB3 PRO 58 3HB PRO 58 2.955 8.575 -9.162 369 HG2 PRO 58 2HG PRO 58 2.304 10.271 -11.130 370 HG3 PRO 58 3HG PRO 58 1.276 10.075 -9.696 371 HD2 PRO 58 2HD PRO 58 3.207 12.257 -10.365 372 HD3 PRO 58 3HD PRO 58 1.601 12.359 -9.616 373 H ILE 59 H ILE 59 5.055 8.960 -6.476 374 HA ILE 59 HA ILE 59 7.631 9.934 -7.509 375 HB ILE 59 HB ILE 59 8.538 9.956 -5.217 376 HG12 ILE 59 2HG1 ILE 59 5.673 9.594 -4.310 377 HG13 ILE 59 3HG1 ILE 59 6.901 8.334 -4.260 378 HG21 ILE 59 1HG2 ILE 59 6.129 11.731 -5.590 379 HG22 ILE 59 2HG2 ILE 59 7.761 12.044 -6.181 380 HG23 ILE 59 3HG2 ILE 59 7.440 12.015 -4.447 381 HD11 ILE 59 3HD1 ILE 59 6.984 10.945 -2.770 382 HD12 ILE 59 1HD1 ILE 59 8.211 9.683 -2.709 383 HD13 ILE 59 2HD1 ILE 59 6.594 9.366 -2.083 384 H GLY 60 H GLY 60 9.471 8.519 -6.743 385 HA2 GLY 60 2HA GLY 60 8.855 5.797 -7.436 386 HA3 GLY 60 3HA GLY 60 10.439 6.431 -7.005 387 H PHE 61 H PHE 61 8.763 4.024 -6.143 388 HA PHE 61 HA PHE 61 8.962 4.493 -3.241 389 HB2 PHE 61 2HB PHE 61 6.619 4.386 -3.940 390 HB3 PHE 61 3HB PHE 61 6.907 2.852 -4.742 391 HD1 PHE 61 HD2 PHE 61 7.281 0.808 -3.416 392 HD2 PHE 61 HD1 PHE 61 6.302 4.518 -1.578 393 HE1 PHE 61 HE2 PHE 61 6.680 -0.378 -1.346 394 HE2 PHE 61 HE1 PHE 61 5.703 3.339 0.487 395 HZ PHE 61 HZ PHE 61 5.891 0.886 0.605 396 H ARG 62 H ARG 62 10.245 3.140 -2.199 397 HA ARG 62 HA ARG 62 10.565 0.410 -3.189 398 HB2 ARG 62 2HB ARG 62 12.497 1.631 -4.080 399 HB3 ARG 62 3HB ARG 62 12.910 2.172 -2.457 400 HG2 ARG 62 2HG ARG 62 13.368 -0.103 -1.778 401 HG3 ARG 62 3HG ARG 62 12.856 -0.704 -3.355 402 HD2 ARG 62 2HD ARG 62 15.305 -0.584 -3.159 403 HD3 ARG 62 3HD ARG 62 14.690 0.471 -4.432 404 HE ARG 62 HE ARG 62 15.474 2.268 -3.278 405 HH11 ARG 62 1HH1 ARG 62 15.398 -0.464 -1.069 406 HH12 ARG 62 2HH1 ARG 62 16.211 0.397 0.195 407 HH21 ARG 62 1HH2 ARG 62 16.597 3.357 -1.611 408 HH22 ARG 62 2HH2 ARG 62 16.844 2.547 -0.093 409 H ALA 63 H ALA 63 10.546 -1.088 -1.605 410 HA ALA 63 HA ALA 63 10.899 -0.167 1.160 411 HB1 ALA 63 3HB ALA 63 8.486 -0.115 0.589 412 HB2 ALA 63 1HB ALA 63 8.882 -1.228 1.900 413 HB3 ALA 63 2HB ALA 63 8.563 -1.851 0.283 414 H THR 64 H THR 64 11.551 -1.707 2.627 415 HA THR 64 HA THR 64 12.235 -4.362 1.547 416 HB THR 64 HB THR 64 13.941 -2.704 3.435 417 HG1 THR 64 HG1 THR 64 15.132 -3.349 1.104 418 HG21 THR 64 3HG2 THR 64 14.143 -5.125 3.809 419 HG22 THR 64 1HG2 THR 64 15.615 -4.472 3.087 420 HG23 THR 64 2HG2 THR 64 14.467 -5.367 2.092 421 H LEU 65 H LEU 65 11.627 -6.051 2.793 422 HA LEU 65 HA LEU 65 10.009 -5.602 5.118 423 HB2 LEU 65 2HB LEU 65 9.547 -7.332 3.377 424 HB3 LEU 65 3HB LEU 65 10.982 -8.189 3.877 425 HG LEU 65 HG LEU 65 8.732 -9.105 4.651 426 HD11 LEU 65 1HD1 LEU 65 10.795 -9.892 5.596 427 HD12 LEU 65 2HD1 LEU 65 9.556 -9.755 6.846 428 HD13 LEU 65 3HD1 LEU 65 10.825 -8.538 6.724 429 HD21 LEU 65 3HD2 LEU 65 7.764 -8.114 6.655 430 HD22 LEU 65 1HD2 LEU 65 7.707 -6.994 5.293 431 HD23 LEU 65 2HD2 LEU 65 8.919 -6.784 6.555 432 H LEU 66 H LEU 66 10.828 -5.259 7.062 433 HA LEU 66 HA LEU 66 13.506 -6.090 7.795 434 HB2 LEU 66 2HB LEU 66 11.371 -4.428 9.061 435 HB3 LEU 66 3HB LEU 66 12.637 -5.081 10.075 436 HG LEU 66 HG LEU 66 14.328 -3.884 8.780 437 HD11 LEU 66 1HD1 LEU 66 13.236 -3.903 6.609 438 HD12 LEU 66 2HD1 LEU 66 13.698 -2.266 7.081 439 HD13 LEU 66 3HD1 LEU 66 12.015 -2.779 7.207 440 HD21 LEU 66 3HD2 LEU 66 13.316 -2.787 10.701 441 HD22 LEU 66 1HD2 LEU 66 12.051 -2.120 9.667 442 HD23 LEU 66 2HD2 LEU 66 13.724 -1.616 9.447 443 H GLY 67 H GLY 67 10.240 -7.090 8.355 444 HA2 GLY 67 2HA GLY 67 10.665 -9.633 9.150 445 HA3 GLY 67 3HA GLY 67 10.809 -8.722 10.649 446 H ASN 68 H ASN 68 8.838 -10.451 10.722 447 HA ASN 68 HA ASN 68 6.602 -10.924 10.543 448 HB2 ASN 68 2HB ASN 68 6.853 -9.554 12.586 449 HB3 ASN 68 3HB ASN 68 6.528 -8.102 11.653 450 HD21 ASN 68 1HD2 ASN 68 4.448 -7.496 11.352 451 HD22 ASN 68 2HD2 ASN 68 3.076 -8.417 11.849 452 H ASN 69 H ASN 69 5.756 -7.586 10.047 453 HA ASN 69 HA ASN 69 5.281 -7.991 7.186 454 HB2 ASN 69 2HB ASN 69 3.153 -7.020 9.125 455 HB3 ASN 69 3HB ASN 69 3.005 -6.987 7.377 456 HD21 ASN 69 1HD2 ASN 69 2.895 -9.013 6.259 457 HD22 ASN 69 2HD2 ASN 69 2.293 -10.415 7.071 458 H SER 70 H SER 70 7.071 -6.473 9.030 459 HA SER 70 HA SER 70 6.276 -3.697 8.622 460 HB2 SER 70 2HB SER 70 6.994 -4.385 10.864 461 HB3 SER 70 3HB SER 70 8.544 -4.922 10.219 462 HG SER 70 HG SER 70 7.526 -2.298 10.475 463 H TYR 71 H TYR 71 7.053 -2.557 7.003 464 HA TYR 71 HA TYR 71 9.515 -3.433 5.621 465 HB2 TYR 71 2HB TYR 71 7.077 -1.981 4.569 466 HB3 TYR 71 3HB TYR 71 8.563 -2.190 3.662 467 HD1 TYR 71 HD1 TYR 71 5.739 -4.033 5.214 468 HD2 TYR 71 HD2 TYR 71 8.938 -4.132 2.416 469 HE1 TYR 71 HE1 TYR 71 4.852 -6.124 4.278 470 HE2 TYR 71 HE2 TYR 71 8.068 -6.226 1.481 471 HH TYR 71 HH TYR 71 6.628 -7.943 1.858 472 H GLU 72 H GLU 72 11.131 -1.942 5.425 473 HA GLU 72 HA GLU 72 10.577 0.746 6.407 474 HB2 GLU 72 2HB GLU 72 12.674 -0.389 7.156 475 HB3 GLU 72 3HB GLU 72 13.222 -0.412 5.484 476 HG2 GLU 72 2HG GLU 72 13.231 2.011 5.421 477 HG3 GLU 72 3HG GLU 72 12.590 2.079 7.059 478 H VAL 73 H VAL 73 10.200 2.354 5.080 479 HA VAL 73 HA VAL 73 10.339 1.776 2.229 480 HB VAL 73 HB VAL 73 8.596 3.654 3.810 481 HG11 VAL 73 1HG1 VAL 73 9.209 4.729 1.708 482 HG12 VAL 73 2HG1 VAL 73 7.514 4.241 1.699 483 HG13 VAL 73 3HG1 VAL 73 8.709 3.288 0.821 484 HG21 VAL 73 3HG2 VAL 73 7.966 1.229 2.136 485 HG22 VAL 73 1HG2 VAL 73 6.785 2.248 2.959 486 HG23 VAL 73 2HG2 VAL 73 7.945 1.310 3.898 487 H GLU 74 H GLU 74 11.531 2.879 0.940 488 HA GLU 74 HA GLU 74 12.584 5.475 1.738 489 HB2 GLU 74 2HB GLU 74 14.083 3.223 0.358 490 HB3 GLU 74 3HB GLU 74 14.689 4.872 0.489 491 HG2 GLU 74 2HG GLU 74 14.687 4.703 2.923 492 HG3 GLU 74 3HG GLU 74 14.035 3.074 2.824 493 H ASN 75 H ASN 75 11.985 6.989 0.350 494 HA ASN 75 HA ASN 75 10.851 6.108 -2.213 495 HB2 ASN 75 2HB ASN 75 10.099 8.430 -0.442 496 HB3 ASN 75 3HB ASN 75 9.504 8.226 -2.087 497 HD21 ASN 75 1HD2 ASN 75 8.078 8.265 0.469 498 HD22 ASN 75 2HD2 ASN 75 7.216 6.773 0.546 499 H GLN 76 H GLN 76 10.995 7.510 -3.996 500 HA GLN 76 HA GLN 76 13.441 9.158 -3.964 501 HB2 GLN 76 2HB GLN 76 13.613 6.974 -5.168 502 HB3 GLN 76 3HB GLN 76 12.335 7.517 -6.241 503 HG2 GLN 76 2HG GLN 76 13.765 9.352 -6.995 504 HG3 GLN 76 3HG GLN 76 15.047 8.772 -5.933 505 HE21 GLN 76 1HE2 GLN 76 16.488 8.282 -7.519 506 HE22 GLN 76 2HE2 GLN 76 16.239 7.019 -8.674 507 H TRP 77 H TRP 77 13.016 11.250 -4.353 508 HA TRP 77 HA TRP 77 10.889 11.918 -6.232 509 HB2 TRP 77 2HB TRP 77 10.130 13.784 -4.746 510 HB3 TRP 77 3HB TRP 77 9.779 12.185 -4.114 511 HD1 TRP 77 HD1 TRP 77 12.433 14.983 -3.602 512 HE1 TRP 77 HE1 TRP 77 13.116 14.990 -1.128 513 HE3 TRP 77 HE3 TRP 77 9.713 10.964 -2.001 514 HZ2 TRP 77 HZ2 TRP 77 12.579 13.491 1.201 515 HZ3 TRP 77 HZ3 TRP 77 9.853 10.319 0.370 516 HH2 TRP 77 HH2 TRP 77 11.254 11.554 1.934 517 H GLY 78 H GLY 78 11.069 14.042 -7.154 518 HA2 GLY 78 2HA GLY 78 12.277 16.034 -7.601 519 HA3 GLY 78 3HA GLY 78 13.679 15.336 -6.797 520 H GLY 79 H GLY 79 12.742 12.823 -8.419 521 HA2 GLY 79 2HA GLY 79 12.801 12.759 -11.003 522 HA3 GLY 79 3HA GLY 79 14.398 13.455 -10.748 523 H ASP 80 H ASP 80 13.980 11.016 -12.035 524 HA ASP 80 HA ASP 80 14.403 8.859 -10.176 525 HB2 ASP 80 2HB ASP 80 14.839 7.474 -12.215 526 HB3 ASP 80 3HB ASP 80 13.289 8.309 -12.227 527 H SER 81 H SER 81 16.425 11.058 -11.912 528 HA SER 81 HA SER 81 18.852 9.633 -11.579 529 HB2 SER 81 2HB SER 81 18.509 12.610 -11.929 530 HB3 SER 81 3HB SER 81 19.896 11.619 -12.392 531 HG SER 81 HG SER 81 18.630 10.623 -13.953 532 H ALA 82 H ALA 82 16.890 11.140 -9.330 533 HA ALA 82 HA ALA 82 18.974 12.214 -7.628 534 HB1 ALA 82 3HB ALA 82 16.795 13.324 -7.738 535 HB2 ALA 82 1HB ALA 82 17.113 12.744 -6.104 536 HB3 ALA 82 2HB ALA 82 16.009 11.858 -7.153 537 HA PRO 83 HA PRO 83 19.556 8.533 -5.178 538 HB2 PRO 83 2HB PRO 83 20.009 9.549 -2.713 539 HB3 PRO 83 3HB PRO 83 21.184 9.707 -4.024 540 HG2 PRO 83 2HG PRO 83 19.174 11.700 -3.037 541 HG3 PRO 83 3HG PRO 83 20.881 11.949 -3.449 542 HD2 PRO 83 2HD PRO 83 18.877 12.589 -5.141 543 HD3 PRO 83 3HD PRO 83 20.455 12.013 -5.715 544 H TRP 84 H TRP 84 18.786 7.564 -2.960 545 HA TRP 84 HA TRP 84 15.889 7.830 -2.949 546 HB2 TRP 84 2HB TRP 84 17.736 5.802 -1.677 547 HB3 TRP 84 3HB TRP 84 15.988 5.802 -1.482 548 HD1 TRP 84 HD1 TRP 84 18.718 4.925 -3.974 549 HE1 TRP 84 HE1 TRP 84 17.671 3.649 -5.949 550 HE3 TRP 84 HE3 TRP 84 13.777 5.583 -2.838 551 HZ2 TRP 84 HZ2 TRP 84 15.088 3.004 -6.901 552 HZ3 TRP 84 HZ3 TRP 84 12.085 4.606 -4.332 553 HH2 TRP 84 HH2 TRP 84 12.726 3.346 -6.319 554 H HIS 85 H HIS 85 14.703 8.407 -1.139 555 HA HIS 85 HA HIS 85 16.283 9.582 1.049 556 HB2 HIS 85 2HB HIS 85 13.638 10.519 -0.096 557 HB3 HIS 85 3HB HIS 85 14.457 11.230 1.288 558 HD1 HIS 85 HD1 HIS 85 16.553 12.713 0.784 559 HD2 HIS 85 HD2 HIS 85 14.644 11.234 -2.599 560 HE1 HIS 85 HE1 HIS 85 17.481 14.025 -1.139 561 H SER 86 H SER 86 15.463 9.295 3.146 562 HA SER 86 HA SER 86 14.140 6.873 3.647 563 HB2 SER 86 2HB SER 86 14.000 7.790 6.006 564 HB3 SER 86 3HB SER 86 15.616 7.745 5.305 565 HG SER 86 HG SER 86 13.967 10.043 5.155 566 H GLY 87 H GLY 87 12.024 6.344 4.014 567 HA2 GLY 87 2HA GLY 87 10.073 8.542 3.815 568 HA3 GLY 87 3HA GLY 87 9.784 6.891 3.281 569 H GLY 88 H GLY 88 10.541 5.343 5.325 570 HA2 GLY 88 2HA GLY 88 10.274 5.836 7.918 571 HA3 GLY 88 3HA GLY 88 8.611 6.067 7.401 572 H ASN 89 H ASN 89 8.251 4.258 8.937 573 HA ASN 89 HA ASN 89 8.856 1.675 7.666 574 HB2 ASN 89 2HB ASN 89 9.780 1.894 9.940 575 HB3 ASN 89 3HB ASN 89 8.164 2.233 10.555 576 HD21 ASN 89 1HD2 ASN 89 10.280 -0.186 9.252 577 HD22 ASN 89 2HD2 ASN 89 9.325 -1.554 9.714 578 H TRP 90 H TRP 90 7.201 0.682 6.696 579 HA TRP 90 HA TRP 90 4.475 1.442 7.497 580 HB2 TRP 90 2HB TRP 90 5.517 0.564 4.787 581 HB3 TRP 90 3HB TRP 90 3.825 0.836 5.170 582 HD1 TRP 90 HD1 TRP 90 6.060 3.446 6.669 583 HE1 TRP 90 HE1 TRP 90 5.919 5.621 5.314 584 HE3 TRP 90 HE3 TRP 90 3.522 1.680 2.596 585 HZ2 TRP 90 HZ2 TRP 90 4.865 6.478 2.827 586 HZ3 TRP 90 HZ3 TRP 90 2.985 3.244 0.777 587 HH2 TRP 90 HH2 TRP 90 3.639 5.588 0.889 588 H ILE 91 H ILE 91 2.944 -0.230 7.611 589 HA ILE 91 HA ILE 91 4.106 -2.943 7.698 590 HB ILE 91 HB ILE 91 1.616 -1.902 9.092 591 HG12 ILE 91 2HG1 ILE 91 4.275 -2.762 10.260 592 HG13 ILE 91 3HG1 ILE 91 3.777 -1.089 10.038 593 HG21 ILE 91 1HG2 ILE 91 2.930 -4.617 9.244 594 HG22 ILE 91 2HG2 ILE 91 1.393 -4.255 8.460 595 HG23 ILE 91 3HG2 ILE 91 1.553 -4.080 10.208 596 HD11 ILE 91 3HD1 ILE 91 2.427 -3.113 11.810 597 HD12 ILE 91 1HD1 ILE 91 1.928 -1.436 11.591 598 HD13 ILE 91 2HD1 ILE 91 3.482 -1.802 12.339 599 H LEU 92 H LEU 92 3.538 -4.263 6.073 600 HA LEU 92 HA LEU 92 1.013 -3.741 4.648 601 HB2 LEU 92 2HB LEU 92 3.680 -4.198 3.317 602 HB3 LEU 92 3HB LEU 92 2.142 -4.061 2.495 603 HG LEU 92 HG LEU 92 3.449 -1.852 4.087 604 HD11 LEU 92 1HD1 LEU 92 4.683 -2.380 2.049 605 HD12 LEU 92 2HD1 LEU 92 3.878 -0.814 1.930 606 HD13 LEU 92 3HD1 LEU 92 3.200 -2.220 1.105 607 HD21 LEU 92 3HD2 LEU 92 1.725 -0.435 3.022 608 HD22 LEU 92 1HD2 LEU 92 1.038 -1.651 4.100 609 HD23 LEU 92 2HD2 LEU 92 0.979 -1.886 2.355 610 H GLY 93 H GLY 93 0.091 -5.558 5.621 611 HA2 GLY 93 2HA GLY 93 -0.131 -7.837 4.202 612 HA3 GLY 93 3HA GLY 93 1.217 -8.191 5.273 613 H SER 94 H SER 94 -2.109 -8.494 4.953 614 HA SER 94 HA SER 94 -2.639 -8.205 7.793 615 HB2 SER 94 2HB SER 94 -4.986 -8.754 7.150 616 HB3 SER 94 3HB SER 94 -4.352 -7.357 6.283 617 HG SER 94 HG SER 94 -5.455 -8.811 4.889 618 H ARG 95 H ARG 95 -1.527 -10.549 5.657 619 HA ARG 95 HA ARG 95 -2.668 -12.750 7.162 620 HB2 ARG 95 2HB ARG 95 -0.882 -12.704 4.730 621 HB3 ARG 95 3HB ARG 95 -1.340 -14.184 5.555 622 HG2 ARG 95 2HG ARG 95 -3.710 -13.706 5.066 623 HG3 ARG 95 3HG ARG 95 -3.223 -12.238 4.211 624 HD2 ARG 95 2HD ARG 95 -1.919 -13.585 2.640 625 HD3 ARG 95 3HD ARG 95 -2.386 -15.050 3.498 626 HE ARG 95 HE ARG 95 -4.046 -13.455 1.708 627 HH11 ARG 95 1HH1 ARG 95 -3.863 -16.129 3.972 628 HH12 ARG 95 2HH1 ARG 95 -5.284 -16.911 3.374 629 HH21 ARG 95 1HH2 ARG 95 -5.922 -14.528 0.862 630 HH22 ARG 95 2HH2 ARG 95 -6.443 -16.001 1.589 631 H GLU 96 H GLU 96 -1.539 -14.083 8.455 632 HA GLU 96 HA GLU 96 0.604 -12.862 9.889 633 HB2 GLU 96 2HB GLU 96 -1.167 -14.158 10.987 634 HB3 GLU 96 3HB GLU 96 -0.629 -15.607 10.155 635 HG2 GLU 96 2HG GLU 96 1.477 -15.540 11.353 636 HG3 GLU 96 3HG GLU 96 0.992 -14.044 12.153 637 H ASN 97 H ASN 97 0.348 -15.440 7.546 638 HA ASN 97 HA ASN 97 3.250 -15.937 7.763 639 HB2 ASN 97 2HB ASN 97 1.038 -17.753 6.774 640 HB3 ASN 97 3HB ASN 97 2.751 -18.138 6.672 641 HD21 ASN 97 1HD2 ASN 97 0.614 -19.528 8.057 642 HD22 ASN 97 2HD2 ASN 97 1.079 -19.599 9.717 643 H GLN 98 H GLN 98 1.936 -13.781 6.160 644 HA GLN 98 HA GLN 98 3.164 -14.397 3.631 645 HB2 GLN 98 2HB GLN 98 0.429 -14.971 3.928 646 HB3 GLN 98 3HB GLN 98 0.526 -13.518 2.940 647 HG2 GLN 98 2HG GLN 98 1.895 -14.624 1.335 648 HG3 GLN 98 3HG GLN 98 2.056 -16.043 2.369 649 HE21 GLN 98 1HE2 GLN 98 1.010 -15.781 -0.350 650 HE22 GLN 98 2HE2 GLN 98 -0.592 -16.431 -0.298 651 H ASN 99 H ASN 99 3.992 -12.643 2.753 652 HA ASN 99 HA ASN 99 3.231 -10.013 3.795 653 HB2 ASN 99 2HB ASN 99 5.675 -10.975 2.297 654 HB3 ASN 99 3HB ASN 99 5.378 -9.282 2.669 655 HD21 ASN 99 1HD2 ASN 99 7.566 -10.982 3.512 656 HD22 ASN 99 2HD2 ASN 99 7.528 -10.998 5.239 657 H VAL 100 H VAL 100 3.273 -8.202 2.236 658 HA VAL 100 HA VAL 100 1.580 -8.925 -0.053 659 HB VAL 100 HB VAL 100 1.376 -6.555 -0.567 660 HG11 VAL 100 1HG1 VAL 100 1.052 -7.146 2.361 661 HG12 VAL 100 2HG1 VAL 100 -0.113 -7.494 1.084 662 HG13 VAL 100 3HG1 VAL 100 0.279 -5.823 1.493 663 HG21 VAL 100 3HG2 VAL 100 2.463 -4.843 0.734 664 HG22 VAL 100 1HG2 VAL 100 3.677 -5.904 0.020 665 HG23 VAL 100 2HG2 VAL 100 3.264 -6.059 1.730 666 H VAL 101 H VAL 101 2.043 -8.638 -2.243 667 HA VAL 101 HA VAL 101 4.870 -8.096 -2.838 668 HB VAL 101 HB VAL 101 4.839 -9.673 -4.716 669 HG11 VAL 101 1HG1 VAL 101 4.088 -10.935 -2.092 670 HG12 VAL 101 2HG1 VAL 101 5.694 -10.389 -2.572 671 HG13 VAL 101 3HG1 VAL 101 4.929 -11.729 -3.423 672 HG21 VAL 101 3HG2 VAL 101 3.036 -11.332 -4.925 673 HG22 VAL 101 1HG2 VAL 101 2.469 -9.691 -5.236 674 HG23 VAL 101 2HG2 VAL 101 2.115 -10.470 -3.694 675 H ALA 102 H ALA 102 1.553 -7.828 -3.980 676 HA ALA 102 HA ALA 102 2.501 -5.659 -5.714 677 HB1 ALA 102 3HB ALA 102 2.183 -7.647 -7.128 678 HB2 ALA 102 1HB ALA 102 1.046 -6.362 -7.530 679 HB3 ALA 102 2HB ALA 102 0.507 -7.748 -6.588 680 H ILE 103 H ILE 103 1.326 -3.844 -5.557 681 HA ILE 103 HA ILE 103 -1.391 -4.072 -4.475 682 HB ILE 103 HB ILE 103 0.689 -2.030 -3.631 683 HG12 ILE 103 2HG1 ILE 103 -0.758 -4.098 -1.957 684 HG13 ILE 103 3HG1 ILE 103 0.875 -4.306 -2.584 685 HG21 ILE 103 1HG2 ILE 103 -1.513 -1.009 -3.847 686 HG22 ILE 103 2HG2 ILE 103 -1.036 -1.132 -2.154 687 HG23 ILE 103 3HG2 ILE 103 -2.207 -2.269 -2.825 688 HD11 ILE 103 3HD1 ILE 103 0.893 -3.609 -0.255 689 HD12 ILE 103 1HD1 ILE 103 -0.020 -2.162 -0.670 690 HD13 ILE 103 2HD1 ILE 103 1.616 -2.376 -1.290 691 H ASN 104 H ASN 104 -2.792 -3.165 -5.807 692 HA ASN 104 HA ASN 104 -1.965 -0.842 -7.420 693 HB2 ASN 104 2HB ASN 104 -2.252 -2.784 -8.883 694 HB3 ASN 104 3HB ASN 104 -3.835 -3.106 -8.190 695 HD21 ASN 104 1HD2 ASN 104 -5.576 -1.872 -8.817 696 HD22 ASN 104 2HD2 ASN 104 -5.532 -0.803 -10.175 697 H VAL 105 H VAL 105 -2.812 0.730 -6.261 698 HA VAL 105 HA VAL 105 -5.694 0.660 -5.775 699 HB VAL 105 HB VAL 105 -5.520 1.507 -3.447 700 HG11 VAL 105 1HG1 VAL 105 -4.240 -1.169 -3.974 701 HG12 VAL 105 2HG1 VAL 105 -5.959 -0.837 -3.766 702 HG13 VAL 105 3HG1 VAL 105 -4.852 -0.641 -2.408 703 HG21 VAL 105 3HG2 VAL 105 -3.392 1.252 -2.242 704 HG22 VAL 105 1HG2 VAL 105 -3.298 2.458 -3.525 705 HG23 VAL 105 2HG2 VAL 105 -2.598 0.858 -3.768 706 H GLU 106 H GLU 106 -6.780 2.531 -5.754 707 HA GLU 106 HA GLU 106 -5.348 5.058 -5.713 708 HB2 GLU 106 2HB GLU 106 -5.400 4.427 -8.113 709 HB3 GLU 106 3HB GLU 106 -7.151 4.284 -8.028 710 HG2 GLU 106 2HG GLU 106 -7.339 6.657 -7.538 711 HG3 GLU 106 3HG GLU 106 -5.583 6.813 -7.557 712 H SER 107 H SER 107 -6.693 6.799 -5.180 713 HA SER 107 HA SER 107 -9.449 6.113 -4.453 714 HB2 SER 107 2HB SER 107 -8.095 5.792 -2.439 715 HB3 SER 107 3HB SER 107 -7.469 7.431 -2.591 716 HG SER 107 HG SER 107 -9.399 6.912 -1.154 717 H GLY 108 H GLY 108 -10.907 7.757 -4.524 718 HA2 GLY 108 2HA GLY 108 -10.009 10.239 -5.776 719 HA3 GLY 108 3HA GLY 108 -11.673 9.676 -5.652 720 H ASP 109 H ASP 109 -10.176 9.186 -2.745 721 HA ASP 109 HA ASP 109 -11.461 11.542 -1.597 722 HB2 ASP 109 2HB ASP 109 -10.439 8.978 -0.394 723 HB3 ASP 109 3HB ASP 109 -10.794 10.377 0.611 724 H ASP 110 H ASP 110 -10.230 12.282 0.482 725 HA ASP 110 HA ASP 110 -7.680 13.302 -0.454 726 HB2 ASP 110 2HB ASP 110 -7.863 14.775 1.543 727 HB3 ASP 110 3HB ASP 110 -9.249 14.900 0.467 728 H GLY 111 H GLY 111 -8.181 10.495 0.534 729 HA2 GLY 111 2HA GLY 111 -6.452 9.120 1.451 730 HA3 GLY 111 3HA GLY 111 -6.022 10.442 2.530 731 H GLN 112 H GLN 112 -9.308 10.279 2.386 732 HA GLN 112 HA GLN 112 -9.620 9.313 5.014 733 HB2 GLN 112 2HB GLN 112 -11.220 10.857 3.996 734 HB3 GLN 112 3HB GLN 112 -11.670 9.643 2.814 735 HG2 GLN 112 2HG GLN 112 -12.632 8.261 4.530 736 HG3 GLN 112 3HG GLN 112 -12.070 9.366 5.781 737 HE21 GLN 112 1HE2 GLN 112 -14.398 8.821 3.272 738 HE22 GLN 112 2HE2 GLN 112 -15.440 10.134 3.683 739 H THR 113 H THR 113 -10.256 7.803 1.846 740 HA THR 113 HA THR 113 -10.003 5.196 3.153 741 HB THR 113 HB THR 113 -11.751 4.269 1.711 742 HG1 THR 113 HG1 THR 113 -12.328 6.933 0.838 743 HG21 THR 113 3HG2 THR 113 -12.475 5.118 3.877 744 HG22 THR 113 1HG2 THR 113 -13.728 5.405 2.667 745 HG23 THR 113 2HG2 THR 113 -12.692 6.727 3.194 746 H LEU 114 H LEU 114 -9.291 3.516 1.694 747 HA LEU 114 HA LEU 114 -8.107 4.413 -0.838 748 HB2 LEU 114 2HB LEU 114 -6.377 4.518 0.959 749 HB3 LEU 114 3HB LEU 114 -6.660 2.823 1.288 750 HG LEU 114 HG LEU 114 -5.849 2.256 -0.969 751 HD11 LEU 114 1HD1 LEU 114 -5.237 5.203 -1.156 752 HD12 LEU 114 2HD1 LEU 114 -6.410 4.310 -2.127 753 HD13 LEU 114 3HD1 LEU 114 -4.689 3.967 -2.287 754 HD21 LEU 114 3HD2 LEU 114 -3.490 2.744 -0.535 755 HD22 LEU 114 1HD2 LEU 114 -4.326 2.220 0.928 756 HD23 LEU 114 2HD2 LEU 114 -3.962 3.929 0.683 757 H ASN 115 H ASN 115 -8.470 2.886 -2.454 758 HA ASN 115 HA ASN 115 -8.835 0.134 -1.635 759 HB2 ASN 115 2HB ASN 115 -10.999 -0.088 -2.915 760 HB3 ASN 115 3HB ASN 115 -11.097 0.795 -1.399 761 HD21 ASN 115 1HD2 ASN 115 -11.778 2.865 -1.411 762 HD22 ASN 115 2HD2 ASN 115 -12.262 3.719 -2.827 763 H GLY 116 H GLY 116 -9.231 -1.338 -3.479 764 HA2 GLY 116 2HA GLY 116 -8.926 -0.981 -6.116 765 HA3 GLY 116 3HA GLY 116 -7.280 -0.754 -5.535 766 H THR 117 H THR 117 -6.175 -2.514 -5.944 767 HA THR 117 HA THR 117 -7.272 -5.124 -5.173 768 HB THR 117 HB THR 117 -6.148 -6.130 -7.198 769 HG1 THR 117 HG1 THR 117 -5.725 -4.675 -8.935 770 HG21 THR 117 3HG2 THR 117 -8.572 -5.842 -7.126 771 HG22 THR 117 1HG2 THR 117 -7.968 -5.549 -8.757 772 HG23 THR 117 2HG2 THR 117 -8.411 -4.192 -7.722 773 H MET 118 H MET 118 -5.620 -6.752 -4.773 774 HA MET 118 HA MET 118 -2.880 -5.846 -4.561 775 HB2 MET 118 2HB MET 118 -2.691 -6.313 -2.176 776 HB3 MET 118 3HB MET 118 -3.825 -5.005 -2.483 777 HG2 MET 118 2HG MET 118 -5.692 -6.435 -2.083 778 HG3 MET 118 3HG MET 118 -4.650 -7.854 -2.021 779 HE1 MET 118 3HE MET 118 -2.984 -8.390 -0.172 780 HE2 MET 118 1HE MET 118 -2.691 -7.402 1.254 781 HE3 MET 118 2HE MET 118 -2.173 -6.835 -0.332 782 H THR 119 H THR 119 -1.468 -7.603 -3.660 783 HA THR 119 HA THR 119 -2.526 -10.303 -3.869 784 HB THR 119 HB THR 119 -0.335 -9.363 -5.745 785 HG1 THR 119 HG1 THR 119 -3.050 -9.404 -5.967 786 HG21 THR 119 3HG2 THR 119 -1.726 -12.036 -5.500 787 HG22 THR 119 1HG2 THR 119 -0.059 -11.691 -5.031 788 HG23 THR 119 2HG2 THR 119 -0.534 -11.605 -6.728 789 H TYR 120 H TYR 120 -1.347 -11.783 -2.712 790 HA TYR 120 HA TYR 120 0.950 -10.792 -1.172 791 HB2 TYR 120 2HB TYR 120 -0.956 -13.086 -0.733 792 HB3 TYR 120 3HB TYR 120 0.547 -12.951 0.163 793 HD1 TYR 120 HD2 TYR 120 0.889 -11.095 1.707 794 HD2 TYR 120 HD1 TYR 120 -2.845 -11.703 -0.217 795 HE1 TYR 120 HE2 TYR 120 -0.173 -9.629 3.340 796 HE2 TYR 120 HE1 TYR 120 -3.927 -10.224 1.428 797 HH TYR 120 HH TYR 120 -3.555 -9.352 3.664 798 H ALA 121 H ALA 121 2.569 -12.568 -0.573 799 HA ALA 121 HA ALA 121 3.918 -13.441 -2.919 800 HB1 ALA 121 3HB ALA 121 5.552 -14.405 -1.380 801 HB2 ALA 121 1HB ALA 121 4.418 -14.216 -0.044 802 HB3 ALA 121 2HB ALA 121 5.068 -12.792 -0.854 803 H GLY 122 H GLY 122 1.346 -14.653 -2.873 804 HA2 GLY 122 2HA GLY 122 1.630 -17.087 -3.939 805 HA3 GLY 122 3HA GLY 122 1.703 -17.461 -2.217 806 H GLU 123 H GLU 123 -0.159 -15.046 -3.950 807 HA GLU 123 HA GLU 123 -2.666 -16.315 -3.138 808 HB2 GLU 123 2HB GLU 123 -2.021 -14.707 -1.373 809 HB3 GLU 123 3HB GLU 123 -1.855 -13.448 -2.584 810 HG2 GLU 123 2HG GLU 123 -3.900 -13.077 -1.457 811 HG3 GLU 123 3HG GLU 123 -4.301 -13.705 -3.054 812 H GLY 124 H GLY 124 -4.492 -15.371 -4.348 813 HA2 GLY 124 2HA GLY 124 -3.664 -14.554 -7.021 814 HA3 GLY 124 3HA GLY 124 -5.285 -15.043 -6.535 815 HA PRO 125 HA PRO 125 -4.899 -10.317 -6.782 816 HB2 PRO 125 2HB PRO 125 -7.092 -10.619 -8.736 817 HB3 PRO 125 3HB PRO 125 -5.622 -9.647 -8.851 818 HG2 PRO 125 2HG PRO 125 -5.966 -11.884 -10.309 819 HG3 PRO 125 3HG PRO 125 -4.375 -11.390 -9.702 820 HD2 PRO 125 2HD PRO 125 -6.230 -13.500 -8.680 821 HD3 PRO 125 3HD PRO 125 -4.458 -13.508 -8.788 822 H ILE 126 H ILE 126 -5.955 -9.568 -5.040 823 HA ILE 126 HA ILE 126 -8.797 -10.254 -4.765 824 HB ILE 126 HB ILE 126 -8.557 -10.276 -2.311 825 HG12 ILE 126 2HG1 ILE 126 -5.575 -10.165 -2.828 826 HG13 ILE 126 3HG1 ILE 126 -6.539 -8.842 -2.186 827 HG21 ILE 126 1HG2 ILE 126 -7.467 -12.449 -2.105 828 HG22 ILE 126 2HG2 ILE 126 -6.727 -12.234 -3.690 829 HG23 ILE 126 3HG2 ILE 126 -8.478 -12.378 -3.550 830 HD11 ILE 126 3HD1 ILE 126 -6.093 -11.510 -0.869 831 HD12 ILE 126 1HD1 ILE 126 -7.081 -10.201 -0.224 832 HD13 ILE 126 2HD1 ILE 126 -5.344 -9.979 -0.417 833 H GLY 127 H GLY 127 -10.092 -8.708 -3.717 834 HA2 GLY 127 2HA GLY 127 -9.420 -6.019 -4.392 835 HA3 GLY 127 3HA GLY 127 -10.862 -6.540 -3.538 836 H PHE 128 H PHE 128 -8.948 -4.306 -3.148 837 HA PHE 128 HA PHE 128 -8.334 -4.834 -0.313 838 HB2 PHE 128 2HB PHE 128 -6.217 -4.616 -1.414 839 HB3 PHE 128 3HB PHE 128 -6.752 -3.192 -2.302 840 HD1 PHE 128 HD1 PHE 128 -5.861 -4.455 1.063 841 HD2 PHE 128 HD2 PHE 128 -6.572 -1.030 -1.362 842 HE1 PHE 128 HE1 PHE 128 -4.982 -3.009 2.849 843 HE2 PHE 128 HE2 PHE 128 -5.693 0.419 0.417 844 HZ PHE 128 HZ PHE 128 -4.900 -0.565 2.527 845 H LYS 129 H LYS 129 -9.159 -3.460 1.132 846 HA LYS 129 HA LYS 129 -10.058 -0.834 0.246 847 HB2 LYS 129 2HB LYS 129 -11.968 -2.476 0.207 848 HB3 LYS 129 3HB LYS 129 -11.742 -2.683 1.934 849 HG2 LYS 129 2HG LYS 129 -12.228 -0.324 2.282 850 HG3 LYS 129 3HG LYS 129 -12.446 -0.117 0.541 851 HD2 LYS 129 2HD LYS 129 -14.278 -1.745 0.589 852 HD3 LYS 129 3HD LYS 129 -14.069 -1.920 2.335 853 HE2 LYS 129 2HE LYS 129 -14.507 0.511 2.553 854 HE3 LYS 129 3HE LYS 129 -14.841 0.554 0.831 855 HZ1 LYS 129 3HZ LYS 129 -16.876 0.391 2.079 856 HZ2 LYS 129 1HZ LYS 129 -16.346 -1.024 2.835 857 HZ3 LYS 129 2HZ LYS 129 -16.648 -1.018 1.174 858 H GLY 130 H GLY 130 -9.445 0.694 1.698 859 HA2 GLY 130 2HA GLY 130 -8.867 -0.173 4.437 860 HA3 GLY 130 3HA GLY 130 -7.701 0.776 3.525 861 H THR 131 H THR 131 -9.353 1.255 5.997 862 HA THR 131 HA THR 131 -10.418 3.872 5.168 863 HB THR 131 HB THR 131 -11.594 2.070 7.305 864 HG1 THR 131 HG1 THR 131 -12.158 2.476 4.587 865 HG21 THR 131 3HG2 THR 131 -12.585 4.691 6.165 866 HG22 THR 131 1HG2 THR 131 -11.876 4.476 7.766 867 HG23 THR 131 2HG2 THR 131 -13.413 3.707 7.376 868 H LEU 132 H LEU 132 -9.734 5.581 6.339 869 HA LEU 132 HA LEU 132 -7.619 5.352 8.200 870 HB2 LEU 132 2HB LEU 132 -7.990 7.349 6.827 871 HB3 LEU 132 3HB LEU 132 -9.494 7.664 7.665 872 HG LEU 132 HG LEU 132 -8.178 7.986 9.770 873 HD11 LEU 132 1HD1 LEU 132 -6.191 6.737 9.188 874 HD12 LEU 132 2HD1 LEU 132 -5.768 8.411 9.553 875 HD13 LEU 132 3HD1 LEU 132 -5.837 7.865 7.878 876 HD21 LEU 132 3HD2 LEU 132 -7.359 10.217 9.152 877 HD22 LEU 132 1HD2 LEU 132 -8.950 9.887 8.463 878 HD23 LEU 132 2HD2 LEU 132 -7.513 9.792 7.448 879 H THR 133 H THR 133 -7.598 5.293 10.409 880 HA THR 133 HA THR 133 -10.218 5.139 11.717 881 HB THR 133 HB THR 133 -8.882 3.011 11.717 882 HG1 THR 133 HG1 THR 133 -10.357 3.159 13.345 883 HG21 THR 133 3HG2 THR 133 -6.635 3.933 11.928 884 HG22 THR 133 1HG2 THR 133 -6.965 2.824 13.259 885 HG23 THR 133 2HG2 THR 133 -7.026 4.566 13.527 Start of MODEL 17 1 H1 ALA 2 1H ALA 2 -3.632 8.125 11.931 2 H2 ALA 2 2H ALA 2 -2.315 9.147 11.654 3 H3 ALA 2 3H ALA 2 -2.134 7.764 12.621 4 HA ALA 2 HA ALA 2 -2.799 7.765 9.742 5 HB1 ALA 2 3HB ALA 2 -0.505 8.480 10.114 6 HB2 ALA 2 1HB ALA 2 -0.539 6.853 9.430 7 HB3 ALA 2 2HB ALA 2 -0.217 7.085 11.152 8 H LEU 3 H LEU 3 -1.839 5.391 9.045 9 HA LEU 3 HA LEU 3 -1.839 3.122 9.237 10 HB2 LEU 3 2HB LEU 3 -1.514 3.292 11.703 11 HB3 LEU 3 3HB LEU 3 -3.240 3.457 11.902 12 HG LEU 3 HG LEU 3 -2.208 0.994 10.555 13 HD11 LEU 3 1HD1 LEU 3 -1.961 -0.066 12.777 14 HD12 LEU 3 2HD1 LEU 3 -2.133 1.523 13.527 15 HD13 LEU 3 3HD1 LEU 3 -0.757 1.183 12.476 16 HD21 LEU 3 3HD2 LEU 3 -4.448 1.459 12.529 17 HD22 LEU 3 1HD2 LEU 3 -4.138 -0.010 11.598 18 HD23 LEU 3 2HD2 LEU 3 -4.630 1.467 10.775 19 H TYR 4 H TYR 4 -3.389 1.463 8.751 20 HA TYR 4 HA TYR 4 -6.046 2.545 8.120 21 HB2 TYR 4 2HB TYR 4 -4.200 1.144 6.179 22 HB3 TYR 4 3HB TYR 4 -5.895 1.493 5.871 23 HD1 TYR 4 HD1 TYR 4 -2.574 3.020 6.420 24 HD2 TYR 4 HD2 TYR 4 -6.580 3.662 5.147 25 HE1 TYR 4 HE1 TYR 4 -1.925 5.210 5.529 26 HE2 TYR 4 HE2 TYR 4 -5.942 5.860 4.241 27 HH TYR 4 HH TYR 4 -4.180 7.562 4.581 28 H ASN 5 H ASN 5 -7.640 0.963 7.744 29 HA ASN 5 HA ASN 5 -7.102 -1.563 9.135 30 HB2 ASN 5 2HB ASN 5 -9.705 -0.211 8.347 31 HB3 ASN 5 3HB ASN 5 -9.609 -1.796 9.102 32 HD21 ASN 5 1HD2 ASN 5 -10.868 0.652 10.027 33 HD22 ASN 5 2HD2 ASN 5 -10.157 1.009 11.562 34 H VAL 6 H VAL 6 -7.816 -3.578 8.072 35 HA VAL 6 HA VAL 6 -7.733 -3.225 5.154 36 HB VAL 6 HB VAL 6 -6.628 -5.469 6.847 37 HG11 VAL 6 1HG1 VAL 6 -6.812 -5.285 3.842 38 HG12 VAL 6 2HG1 VAL 6 -7.665 -6.436 4.869 39 HG13 VAL 6 3HG1 VAL 6 -5.913 -6.508 4.739 40 HG21 VAL 6 3HG2 VAL 6 -4.516 -4.817 5.837 41 HG22 VAL 6 1HG2 VAL 6 -5.247 -3.470 6.706 42 HG23 VAL 6 2HG2 VAL 6 -5.333 -3.528 4.949 43 H GLU 7 H GLU 7 -9.436 -3.724 4.123 44 HA GLU 7 HA GLU 7 -11.266 -5.782 5.135 45 HB2 GLU 7 2HB GLU 7 -11.908 -3.273 3.536 46 HB3 GLU 7 3HB GLU 7 -13.076 -4.472 4.059 47 HG2 GLU 7 2HG GLU 7 -12.700 -3.920 6.376 48 HG3 GLU 7 3HG GLU 7 -11.382 -2.839 5.938 49 H ASN 8 H ASN 8 -11.564 -7.454 3.673 50 HA ASN 8 HA ASN 8 -10.465 -7.009 0.978 51 HB2 ASN 8 2HB ASN 8 -9.913 -9.335 2.816 52 HB3 ASN 8 3HB ASN 8 -9.597 -9.376 1.087 53 HD21 ASN 8 1HD2 ASN 8 -8.777 -6.561 1.019 54 HD22 ASN 8 2HD2 ASN 8 -7.213 -6.524 1.752 55 H GLN 9 H GLN 9 -11.309 -8.120 -0.690 56 HA GLN 9 HA GLN 9 -13.686 -9.791 -0.179 57 HB2 GLN 9 2HB GLN 9 -14.369 -7.581 -1.035 58 HB3 GLN 9 3HB GLN 9 -13.289 -7.779 -2.413 59 HG2 GLN 9 2HG GLN 9 -14.626 -9.661 -3.185 60 HG3 GLN 9 3HG GLN 9 -15.694 -9.479 -1.791 61 HE21 GLN 9 1HE2 GLN 9 -16.287 -9.326 -4.653 62 HE22 GLN 9 2HE2 GLN 9 -16.981 -7.773 -4.913 63 H TRP 10 H TRP 10 -13.322 -11.806 -0.931 64 HA TRP 10 HA TRP 10 -11.641 -12.138 -3.294 65 HB2 TRP 10 2HB TRP 10 -10.140 -13.711 -2.227 66 HB3 TRP 10 3HB TRP 10 -10.109 -12.193 -1.343 67 HD1 TRP 10 HD1 TRP 10 -11.136 -15.846 -0.980 68 HE1 TRP 10 HE1 TRP 10 -11.630 -16.335 1.493 69 HE3 TRP 10 HE3 TRP 10 -10.905 -11.085 0.871 70 HZ2 TRP 10 HZ2 TRP 10 -11.880 -14.914 3.903 71 HZ3 TRP 10 HZ3 TRP 10 -11.275 -10.745 3.279 72 HH2 TRP 10 HH2 TRP 10 -11.754 -12.621 4.761 73 H GLY 11 H GLY 11 -14.630 -12.748 -2.458 74 HA2 GLY 11 2HA GLY 11 -14.521 -15.638 -2.656 75 HA3 GLY 11 3HA GLY 11 -15.901 -14.647 -2.221 76 H GLY 12 H GLY 12 -13.980 -13.753 -5.018 77 HA2 GLY 12 2HA GLY 12 -14.337 -13.995 -7.263 78 HA3 GLY 12 3HA GLY 12 -15.488 -15.268 -6.909 79 H SER 13 H SER 13 -17.383 -13.906 -5.458 80 HA SER 13 HA SER 13 -18.322 -11.559 -6.665 81 HB2 SER 13 2HB SER 13 -18.499 -13.043 -8.673 82 HB3 SER 13 3HB SER 13 -19.618 -14.072 -7.780 83 HG SER 13 HG SER 13 -21.025 -12.769 -8.677 84 H SER 14 H SER 14 -20.408 -10.942 -5.843 85 HA SER 14 HA SER 14 -21.996 -10.781 -4.234 86 HB2 SER 14 2HB SER 14 -21.989 -13.814 -4.312 87 HB3 SER 14 3HB SER 14 -23.293 -12.790 -3.714 88 HG SER 14 HG SER 14 -23.921 -12.438 -5.683 89 H ALA 15 H ALA 15 -19.223 -10.887 -3.442 90 HA ALA 15 HA ALA 15 -19.414 -12.112 -0.783 91 HB1 ALA 15 3HB ALA 15 -17.616 -13.022 -2.203 92 HB2 ALA 15 1HB ALA 15 -16.982 -12.198 -0.776 93 HB3 ALA 15 2HB ALA 15 -16.936 -11.400 -2.347 94 HA PRO 16 HA PRO 16 -19.287 -7.913 0.714 95 HB2 PRO 16 2HB PRO 16 -19.398 -8.472 3.331 96 HB3 PRO 16 3HB PRO 16 -20.810 -8.698 2.293 97 HG2 PRO 16 2HG PRO 16 -18.846 -10.737 3.273 98 HG3 PRO 16 3HG PRO 16 -20.615 -10.830 3.199 99 HD2 PRO 16 2HD PRO 16 -18.978 -11.951 1.325 100 HD3 PRO 16 3HD PRO 16 -20.619 -11.377 0.963 101 H TRP 17 H TRP 17 -17.914 -6.707 2.297 102 HA TRP 17 HA TRP 17 -15.161 -7.468 1.911 103 HB2 TRP 17 2HB TRP 17 -16.430 -5.075 3.260 104 HB3 TRP 17 3HB TRP 17 -14.695 -5.289 3.055 105 HD1 TRP 17 HD1 TRP 17 -17.779 -4.118 1.249 106 HE1 TRP 17 HE1 TRP 17 -17.140 -3.303 -1.094 107 HE3 TRP 17 HE3 TRP 17 -12.956 -5.801 1.085 108 HZ2 TRP 17 HZ2 TRP 17 -14.898 -3.355 -2.813 109 HZ3 TRP 17 HZ3 TRP 17 -11.631 -5.377 -0.952 110 HH2 TRP 17 HH2 TRP 17 -12.580 -4.184 -2.852 111 H ASN 18 H ASN 18 -13.881 -8.419 3.387 112 HA ASN 18 HA ASN 18 -15.009 -8.823 6.077 113 HB2 ASN 18 2HB ASN 18 -13.258 -10.671 4.419 114 HB3 ASN 18 3HB ASN 18 -13.734 -10.957 6.091 115 HD21 ASN 18 1HD2 ASN 18 -14.230 -12.392 3.519 116 HD22 ASN 18 2HD2 ASN 18 -15.936 -12.621 3.455 117 H GLU 19 H GLU 19 -13.799 -8.036 7.685 118 HA GLU 19 HA GLU 19 -11.211 -6.926 7.056 119 HB2 GLU 19 2HB GLU 19 -11.250 -6.098 9.419 120 HB3 GLU 19 3HB GLU 19 -12.620 -5.569 8.460 121 HG2 GLU 19 2HG GLU 19 -13.991 -7.328 9.482 122 HG3 GLU 19 3HG GLU 19 -12.624 -7.790 10.492 123 H GLY 20 H GLY 20 -9.303 -7.829 7.448 124 HA2 GLY 20 2HA GLY 20 -9.211 -10.148 9.258 125 HA3 GLY 20 3HA GLY 20 -8.610 -10.307 7.617 126 H GLY 21 H GLY 21 -8.128 -7.269 9.153 127 HA2 GLY 21 2HA GLY 21 -5.965 -7.461 10.706 128 HA3 GLY 21 3HA GLY 21 -5.276 -7.712 9.108 129 H GLN 22 H GLN 22 -4.151 -5.713 9.993 130 HA GLN 22 HA GLN 22 -5.380 -3.447 8.681 131 HB2 GLN 22 2HB GLN 22 -5.017 -1.934 10.568 132 HB3 GLN 22 3HB GLN 22 -6.106 -3.233 11.030 133 HG2 GLN 22 2HG GLN 22 -4.062 -4.383 12.000 134 HG3 GLN 22 3HG GLN 22 -3.234 -2.841 11.783 135 HE21 GLN 22 1HE2 GLN 22 -3.996 -1.048 12.922 136 HE22 GLN 22 2HE2 GLN 22 -4.871 -1.212 14.400 137 H TRP 23 H TRP 23 -3.818 -1.888 8.030 138 HA TRP 23 HA TRP 23 -1.046 -2.889 8.190 139 HB2 TRP 23 2HB TRP 23 -2.431 -1.521 5.877 140 HB3 TRP 23 3HB TRP 23 -0.704 -1.849 5.933 141 HD1 TRP 23 HD1 TRP 23 -2.094 -4.833 7.389 142 HE1 TRP 23 HE1 TRP 23 -2.510 -6.680 5.648 143 HE3 TRP 23 HE3 TRP 23 -1.719 -2.023 3.139 144 HZ2 TRP 23 HZ2 TRP 23 -2.642 -6.911 2.838 145 HZ3 TRP 23 HZ3 TRP 23 -1.987 -3.144 0.962 146 HH2 TRP 23 HH2 TRP 23 -2.440 -5.526 0.822 147 H GLU 24 H GLU 24 0.620 -1.316 8.273 148 HA GLU 24 HA GLU 24 -0.398 1.290 9.148 149 HB2 GLU 24 2HB GLU 24 0.910 0.079 10.881 150 HB3 GLU 24 3HB GLU 24 2.294 0.066 9.793 151 HG2 GLU 24 2HG GLU 24 2.450 2.457 9.862 152 HG3 GLU 24 3HG GLU 24 0.948 2.565 10.780 153 H ILE 25 H ILE 25 -0.207 2.851 7.824 154 HA ILE 25 HA ILE 25 2.002 2.983 5.909 155 HB ILE 25 HB ILE 25 -0.934 3.159 5.143 156 HG12 ILE 25 2HG1 ILE 25 1.183 1.235 4.170 157 HG13 ILE 25 3HG1 ILE 25 -0.023 0.848 5.391 158 HG21 ILE 25 1HG2 ILE 25 1.497 3.607 3.412 159 HG22 ILE 25 2HG2 ILE 25 0.350 4.834 3.946 160 HG23 ILE 25 3HG2 ILE 25 -0.170 3.554 2.851 161 HD11 ILE 25 3HD1 ILE 25 -0.559 1.583 2.521 162 HD12 ILE 25 1HD1 ILE 25 -1.796 1.251 3.733 163 HD13 ILE 25 2HD1 ILE 25 -0.693 -0.025 3.237 164 H GLY 26 H GLY 26 2.411 5.128 5.210 165 HA2 GLY 26 2HA GLY 26 2.103 7.456 5.166 166 HA3 GLY 26 3HA GLY 26 0.748 7.264 6.266 167 H SER 27 H SER 27 4.272 7.346 6.044 168 HA SER 27 HA SER 27 4.457 7.695 8.917 169 HB2 SER 27 2HB SER 27 6.954 7.682 8.387 170 HB3 SER 27 3HB SER 27 6.075 6.181 8.107 171 HG SER 27 HG SER 27 7.520 7.546 6.389 172 H ARG 28 H ARG 28 3.453 9.701 6.797 173 HA ARG 28 HA ARG 28 5.024 11.951 7.815 174 HB2 ARG 28 2HB ARG 28 4.937 13.110 5.671 175 HB3 ARG 28 3HB ARG 28 5.688 11.537 5.445 176 HG2 ARG 28 2HG ARG 28 3.691 10.650 4.474 177 HG3 ARG 28 3HG ARG 28 2.795 12.118 4.862 178 HD2 ARG 28 2HD ARG 28 3.341 12.193 2.545 179 HD3 ARG 28 3HD ARG 28 4.353 13.373 3.368 180 HE ARG 28 HE ARG 28 5.736 10.929 3.148 181 HH11 ARG 28 1HH1 ARG 28 4.626 13.626 1.171 182 HH12 ARG 28 2HH1 ARG 28 5.801 13.399 -0.060 183 HH21 ARG 28 1HH2 ARG 28 7.330 10.612 1.497 184 HH22 ARG 28 2HH2 ARG 28 7.363 11.690 0.141 185 H SER 29 H SER 29 3.800 13.599 8.571 186 HA SER 29 HA SER 29 0.930 13.162 8.609 187 HB2 SER 29 2HB SER 29 2.168 13.706 10.691 188 HB3 SER 29 3HB SER 29 2.588 15.273 10.007 189 HG SER 29 HG SER 29 -0.007 14.293 10.605 190 H ASP 30 H ASP 30 3.201 15.134 6.971 191 HA ASP 30 HA ASP 30 1.640 17.415 6.427 192 HB2 ASP 30 2HB ASP 30 4.001 16.214 4.986 193 HB3 ASP 30 3HB ASP 30 3.269 17.739 4.514 194 H GLN 31 H GLN 31 1.833 14.338 4.840 195 HA GLN 31 HA GLN 31 -0.248 15.205 2.963 196 HB2 GLN 31 2HB GLN 31 2.298 13.811 2.114 197 HB3 GLN 31 3HB GLN 31 0.885 14.006 1.086 198 HG2 GLN 31 2HG GLN 31 2.256 16.370 2.315 199 HG3 GLN 31 3HG GLN 31 2.839 15.633 0.825 200 HE21 GLN 31 1HE2 GLN 31 -0.563 15.680 1.510 201 HE22 GLN 31 2HE2 GLN 31 -0.978 16.876 0.347 202 H ASN 32 H ASN 32 -1.830 13.775 2.621 203 HA ASN 32 HA ASN 32 -1.641 11.192 3.940 204 HB2 ASN 32 2HB ASN 32 -3.671 12.729 4.194 205 HB3 ASN 32 3HB ASN 32 -4.052 12.365 2.522 206 HD21 ASN 32 1HD2 ASN 32 -6.015 11.445 3.142 207 HD22 ASN 32 2HD2 ASN 32 -6.085 9.880 3.881 208 H VAL 33 H VAL 33 -2.515 9.276 2.797 209 HA VAL 33 HA VAL 33 -1.178 9.033 0.222 210 HB VAL 33 HB VAL 33 -2.541 6.932 1.904 211 HG11 VAL 33 1HG1 VAL 33 -0.622 6.653 -0.402 212 HG12 VAL 33 2HG1 VAL 33 -2.341 6.274 -0.418 213 HG13 VAL 33 3HG1 VAL 33 -1.237 5.329 0.582 214 HG21 VAL 33 3HG2 VAL 33 -0.721 7.915 3.147 215 HG22 VAL 33 1HG2 VAL 33 0.365 7.717 1.773 216 HG23 VAL 33 2HG2 VAL 33 -0.267 6.300 2.609 217 H VAL 34 H VAL 34 -2.251 9.109 -1.678 218 HA VAL 34 HA VAL 34 -5.115 8.509 -1.610 219 HB VAL 34 HB VAL 34 -5.361 9.762 -3.723 220 HG11 VAL 34 1HG1 VAL 34 -5.137 11.991 -2.713 221 HG12 VAL 34 2HG1 VAL 34 -4.188 11.280 -1.406 222 HG13 VAL 34 3HG1 VAL 34 -5.876 10.820 -1.620 223 HG21 VAL 34 3HG2 VAL 34 -3.552 11.286 -4.414 224 HG22 VAL 34 1HG2 VAL 34 -3.106 9.590 -4.582 225 HG23 VAL 34 2HG2 VAL 34 -2.491 10.529 -3.222 226 H ALA 35 H ALA 35 -2.140 7.581 -3.254 227 HA ALA 35 HA ALA 35 -3.583 5.263 -4.249 228 HB1 ALA 35 3HB ALA 35 -2.049 6.857 -6.281 229 HB2 ALA 35 1HB ALA 35 -3.784 7.063 -6.022 230 HB3 ALA 35 2HB ALA 35 -3.145 5.504 -6.538 231 H ILE 36 H ILE 36 -2.283 3.512 -4.862 232 HA ILE 36 HA ILE 36 0.590 3.777 -4.424 233 HB ILE 36 HB ILE 36 -1.104 1.785 -2.890 234 HG12 ILE 36 2HG1 ILE 36 0.705 3.963 -1.823 235 HG13 ILE 36 3HG1 ILE 36 -1.044 4.103 -1.940 236 HG21 ILE 36 1HG2 ILE 36 1.047 1.060 -1.896 237 HG22 ILE 36 2HG2 ILE 36 1.890 2.080 -3.064 238 HG23 ILE 36 3HG2 ILE 36 0.915 0.721 -3.621 239 HD11 ILE 36 3HD1 ILE 36 0.430 2.045 -0.310 240 HD12 ILE 36 1HD1 ILE 36 -1.315 2.269 -0.382 241 HD13 ILE 36 2HD1 ILE 36 -0.290 3.525 0.318 242 H ASN 37 H ASN 37 1.608 2.701 -6.023 243 HA ASN 37 HA ASN 37 0.455 0.172 -6.979 244 HB2 ASN 37 2HB ASN 37 1.105 2.571 -8.575 245 HB3 ASN 37 3HB ASN 37 1.786 1.069 -9.192 246 HD21 ASN 37 1HD2 ASN 37 -1.221 1.183 -7.428 247 HD22 ASN 37 2HD2 ASN 37 -2.233 0.785 -8.777 248 H VAL 38 H VAL 38 1.860 -1.393 -6.537 249 HA VAL 38 HA VAL 38 4.690 -0.971 -6.881 250 HB VAL 38 HB VAL 38 5.325 -1.692 -4.576 251 HG11 VAL 38 1HG1 VAL 38 5.491 0.647 -5.175 252 HG12 VAL 38 2HG1 VAL 38 4.995 0.479 -3.494 253 HG13 VAL 38 3HG1 VAL 38 3.805 0.901 -4.726 254 HG21 VAL 38 3HG2 VAL 38 3.189 -2.698 -3.933 255 HG22 VAL 38 1HG2 VAL 38 2.451 -1.093 -3.905 256 HG23 VAL 38 2HG2 VAL 38 3.721 -1.497 -2.756 257 H GLU 39 H GLU 39 5.903 -2.886 -6.819 258 HA GLU 39 HA GLU 39 4.509 -5.384 -6.321 259 HB2 GLU 39 2HB GLU 39 4.204 -4.905 -8.752 260 HB3 GLU 39 3HB GLU 39 5.948 -4.849 -8.937 261 HG2 GLU 39 2HG GLU 39 6.097 -7.192 -8.226 262 HG3 GLU 39 3HG GLU 39 4.345 -7.245 -8.061 263 H SER 40 H SER 40 5.985 -7.128 -5.949 264 HA SER 40 HA SER 40 8.434 -6.221 -4.759 265 HB2 SER 40 2HB SER 40 8.646 -8.663 -4.140 266 HB3 SER 40 3HB SER 40 7.186 -7.871 -3.550 267 HG SER 40 HG SER 40 7.457 -9.969 -5.251 268 H GLY 41 H GLY 41 10.519 -6.803 -5.288 269 HA2 GLY 41 2HA GLY 41 10.916 -7.722 -8.050 270 HA3 GLY 41 3HA GLY 41 12.130 -6.962 -7.020 271 H ASP 42 H ASP 42 10.814 -8.846 -4.950 272 HA ASP 42 HA ASP 42 12.141 -11.363 -5.646 273 HB2 ASP 42 2HB ASP 42 12.556 -9.756 -3.110 274 HB3 ASP 42 3HB ASP 42 13.017 -11.444 -3.260 275 H ASP 43 H ASP 43 11.665 -12.571 -3.125 276 HA ASP 43 HA ASP 43 8.847 -13.157 -3.317 277 HB2 ASP 43 2HB ASP 43 10.936 -14.051 -1.315 278 HB3 ASP 43 3HB ASP 43 9.296 -14.676 -1.375 279 H GLY 44 H GLY 44 9.409 -10.433 -2.631 280 HA2 GLY 44 2HA GLY 44 7.963 -9.060 -1.299 281 HA3 GLY 44 3HA GLY 44 7.991 -10.300 -0.056 282 H GLN 45 H GLN 45 11.049 -10.266 -1.002 283 HA GLN 45 HA GLN 45 11.983 -8.915 1.296 284 HB2 GLN 45 2HB GLN 45 13.222 -10.750 0.196 285 HB3 GLN 45 3HB GLN 45 13.543 -9.708 -1.180 286 HG2 GLN 45 2HG GLN 45 15.488 -9.817 0.211 287 HG3 GLN 45 3HG GLN 45 14.805 -8.194 0.309 288 HE21 GLN 45 1HE2 GLN 45 15.747 -7.750 2.277 289 HE22 GLN 45 2HE2 GLN 45 15.219 -8.486 3.750 290 H THR 46 H THR 46 11.778 -7.980 -2.087 291 HA THR 46 HA THR 46 12.305 -5.202 -1.272 292 HB THR 46 HB THR 46 13.247 -4.802 -3.540 293 HG1 THR 46 HG1 THR 46 13.729 -7.446 -4.123 294 HG21 THR 46 3HG2 THR 46 15.392 -5.930 -3.196 295 HG22 THR 46 1HG2 THR 46 14.633 -7.040 -2.055 296 HG23 THR 46 2HG2 THR 46 14.755 -5.325 -1.667 297 H LEU 47 H LEU 47 10.975 -3.632 -2.107 298 HA LEU 47 HA LEU 47 8.815 -4.483 -3.921 299 HB2 LEU 47 2HB LEU 47 8.574 -2.628 -1.551 300 HB3 LEU 47 3HB LEU 47 7.304 -2.965 -2.702 301 HG LEU 47 HG LEU 47 8.498 -5.005 -0.820 302 HD11 LEU 47 1HD1 LEU 47 6.331 -4.826 0.341 303 HD12 LEU 47 2HD1 LEU 47 5.885 -3.486 -0.716 304 HD13 LEU 47 3HD1 LEU 47 7.245 -3.324 0.396 305 HD21 LEU 47 3HD2 LEU 47 7.663 -6.020 -2.843 306 HD22 LEU 47 1HD2 LEU 47 6.147 -5.133 -2.709 307 HD23 LEU 47 2HD2 LEU 47 6.560 -6.360 -1.511 308 H ASN 48 H ASN 48 8.704 -3.161 -5.733 309 HA ASN 48 HA ASN 48 9.869 -0.484 -5.482 310 HB2 ASN 48 2HB ASN 48 10.203 -2.417 -7.790 311 HB3 ASN 48 3HB ASN 48 10.698 -0.735 -7.822 312 HD21 ASN 48 1HD2 ASN 48 11.681 -0.776 -5.074 313 HD22 ASN 48 2HD2 ASN 48 13.155 -1.677 -5.112 314 H GLY 49 H GLY 49 8.700 1.117 -6.539 315 HA2 GLY 49 2HA GLY 49 6.965 0.695 -8.676 316 HA3 GLY 49 3HA GLY 49 6.021 0.535 -7.207 317 H THR 50 H THR 50 4.800 2.311 -7.817 318 HA THR 50 HA THR 50 6.121 4.886 -7.358 319 HB THR 50 HB THR 50 3.912 4.371 -9.376 320 HG1 THR 50 HG1 THR 50 6.579 4.114 -9.569 321 HG21 THR 50 3HG2 THR 50 3.818 6.611 -8.369 322 HG22 THR 50 1HG2 THR 50 4.319 6.708 -10.055 323 HG23 THR 50 2HG2 THR 50 5.517 6.861 -8.773 324 H MET 51 H MET 51 5.133 6.096 -5.859 325 HA MET 51 HA MET 51 2.474 5.214 -4.922 326 HB2 MET 51 2HB MET 51 4.294 4.809 -3.289 327 HB3 MET 51 3HB MET 51 4.659 6.532 -3.290 328 HG2 MET 51 2HG MET 51 2.323 6.931 -2.499 329 HG3 MET 51 3HG MET 51 2.156 5.183 -2.334 330 HE1 MET 51 3HE MET 51 1.589 7.223 -0.039 331 HE2 MET 51 1HE MET 51 2.331 6.390 1.326 332 HE3 MET 51 2HE MET 51 1.413 5.480 0.126 333 H THR 52 H THR 52 0.938 6.846 -4.437 334 HA THR 52 HA THR 52 1.748 9.526 -5.337 335 HB THR 52 HB THR 52 -0.954 8.234 -5.756 336 HG1 THR 52 HG1 THR 52 1.088 7.592 -7.027 337 HG21 THR 52 3HG2 THR 52 -1.362 10.179 -7.212 338 HG22 THR 52 1HG2 THR 52 0.202 10.848 -6.747 339 HG23 THR 52 2HG2 THR 52 -1.070 10.672 -5.540 340 H TYR 53 H TYR 53 1.499 11.065 -3.925 341 HA TYR 53 HA TYR 53 -0.260 10.662 -1.615 342 HB2 TYR 53 2HB TYR 53 2.093 12.485 -2.087 343 HB3 TYR 53 3HB TYR 53 0.994 12.698 -0.732 344 HD1 TYR 53 HD1 TYR 53 3.574 10.529 -2.200 345 HD2 TYR 53 HD2 TYR 53 1.092 11.254 1.173 346 HE1 TYR 53 HE1 TYR 53 4.936 8.972 -0.865 347 HE2 TYR 53 HE2 TYR 53 2.441 9.706 2.512 348 HH TYR 53 HH TYR 53 5.454 8.421 1.351 349 H ALA 54 H ALA 54 -1.495 12.516 -0.908 350 HA ALA 54 HA ALA 54 -3.083 13.569 -2.974 351 HB1 ALA 54 3HB ALA 54 -2.834 14.560 -0.132 352 HB2 ALA 54 1HB ALA 54 -3.872 13.240 -0.676 353 HB3 ALA 54 2HB ALA 54 -4.166 14.878 -1.248 354 H GLY 55 H GLY 55 -3.052 15.442 -4.069 355 HA2 GLY 55 2HA GLY 55 -2.527 17.603 -4.667 356 HA3 GLY 55 3HA GLY 55 -1.632 17.757 -3.167 357 H GLU 56 H GLU 56 0.453 16.150 -3.294 358 HA GLU 56 HA GLU 56 2.085 17.502 -5.157 359 HB2 GLU 56 2HB GLU 56 3.917 16.098 -4.324 360 HB3 GLU 56 3HB GLU 56 3.027 16.916 -3.058 361 HG2 GLU 56 2HG GLU 56 1.882 14.857 -2.504 362 HG3 GLU 56 3HG GLU 56 2.717 14.023 -3.819 363 H GLY 57 H GLY 57 0.866 14.179 -5.147 364 HA2 GLY 57 2HA GLY 57 0.298 13.279 -7.349 365 HA3 GLY 57 3HA GLY 57 1.753 14.060 -7.950 366 HA PRO 58 HA PRO 58 2.840 9.666 -7.065 367 HB2 PRO 58 2HB PRO 58 3.852 9.051 -9.462 368 HB3 PRO 58 3HB PRO 58 2.112 9.036 -9.162 369 HG2 PRO 58 2HG PRO 58 3.786 11.110 -10.512 370 HG3 PRO 58 3HG PRO 58 2.181 10.501 -10.951 371 HD2 PRO 58 2HD PRO 58 2.624 12.851 -9.601 372 HD3 PRO 58 3HD PRO 58 1.113 11.920 -9.516 373 H ILE 59 H ILE 59 4.768 8.972 -6.344 374 HA ILE 59 HA ILE 59 7.217 10.251 -7.297 375 HB ILE 59 HB ILE 59 8.146 10.319 -5.033 376 HG12 ILE 59 2HG1 ILE 59 5.368 9.647 -4.050 377 HG13 ILE 59 3HG1 ILE 59 6.726 8.524 -4.071 378 HG21 ILE 59 1HG2 ILE 59 5.563 11.847 -5.279 379 HG22 ILE 59 2HG2 ILE 59 7.132 12.330 -5.918 380 HG23 ILE 59 3HG2 ILE 59 6.885 12.224 -4.172 381 HD11 ILE 59 3HD1 ILE 59 6.482 11.063 -2.486 382 HD12 ILE 59 1HD1 ILE 59 7.957 10.101 -2.598 383 HD13 ILE 59 2HD1 ILE 59 6.510 9.412 -1.865 384 H GLY 60 H GLY 60 9.175 8.941 -6.477 385 HA2 GLY 60 2HA GLY 60 8.728 6.222 -7.334 386 HA3 GLY 60 3HA GLY 60 10.270 6.908 -6.846 387 H PHE 61 H PHE 61 8.842 4.355 -6.134 388 HA PHE 61 HA PHE 61 8.928 4.690 -3.206 389 HB2 PHE 61 2HB PHE 61 6.612 4.450 -4.005 390 HB3 PHE 61 3HB PHE 61 7.052 2.952 -4.815 391 HD1 PHE 61 HD2 PHE 61 7.699 0.964 -3.408 392 HD2 PHE 61 HD1 PHE 61 6.034 4.504 -1.746 393 HE1 PHE 61 HE2 PHE 61 7.104 -0.282 -1.380 394 HE2 PHE 61 HE1 PHE 61 5.421 3.270 0.280 395 HZ PHE 61 HZ PHE 61 5.953 0.862 0.474 396 H ARG 62 H ARG 62 10.486 3.439 -2.281 397 HA ARG 62 HA ARG 62 10.956 0.775 -3.437 398 HB2 ARG 62 2HB ARG 62 12.792 2.404 -4.085 399 HB3 ARG 62 3HB ARG 62 13.179 2.558 -2.377 400 HG2 ARG 62 2HG ARG 62 13.634 0.121 -2.312 401 HG3 ARG 62 3HG ARG 62 13.336 0.061 -4.051 402 HD2 ARG 62 2HD ARG 62 15.675 0.199 -3.858 403 HD3 ARG 62 3HD ARG 62 15.162 1.830 -4.256 404 HE ARG 62 HE ARG 62 15.455 2.390 -1.867 405 HH11 ARG 62 1HH1 ARG 62 17.093 -0.467 -3.153 406 HH12 ARG 62 2HH1 ARG 62 18.233 -0.550 -1.856 407 HH21 ARG 62 1HH2 ARG 62 16.983 2.260 -0.162 408 HH22 ARG 62 2HH2 ARG 62 18.179 1.004 -0.148 409 H ALA 63 H ALA 63 10.900 -0.808 -1.899 410 HA ALA 63 HA ALA 63 11.321 0.003 0.885 411 HB1 ALA 63 3HB ALA 63 8.877 0.044 0.446 412 HB2 ALA 63 1HB ALA 63 9.352 -1.143 1.660 413 HB3 ALA 63 2HB ALA 63 8.959 -1.667 0.027 414 H THR 64 H THR 64 12.095 -1.565 2.253 415 HA THR 64 HA THR 64 12.795 -4.146 1.007 416 HB THR 64 HB THR 64 14.486 -2.516 2.925 417 HG1 THR 64 HG1 THR 64 14.279 -1.855 0.607 418 HG21 THR 64 3HG2 THR 64 14.795 -4.933 3.210 419 HG22 THR 64 1HG2 THR 64 16.226 -4.201 2.474 420 HG23 THR 64 2HG2 THR 64 15.084 -5.105 1.476 421 H LEU 65 H LEU 65 12.336 -5.935 2.204 422 HA LEU 65 HA LEU 65 10.615 -5.757 4.446 423 HB2 LEU 65 2HB LEU 65 10.599 -7.666 2.919 424 HB3 LEU 65 3HB LEU 65 12.228 -8.082 3.405 425 HG LEU 65 HG LEU 65 11.371 -8.474 5.718 426 HD11 LEU 65 1HD1 LEU 65 8.990 -8.790 6.050 427 HD12 LEU 65 2HD1 LEU 65 8.679 -8.276 4.390 428 HD13 LEU 65 3HD1 LEU 65 9.337 -7.130 5.557 429 HD21 LEU 65 3HD2 LEU 65 10.216 -10.142 3.485 430 HD22 LEU 65 1HD2 LEU 65 10.344 -10.653 5.169 431 HD23 LEU 65 2HD2 LEU 65 11.801 -10.330 4.226 432 H LEU 66 H LEU 66 11.051 -5.258 6.434 433 HA LEU 66 HA LEU 66 13.665 -5.037 7.407 434 HB2 LEU 66 2HB LEU 66 11.862 -3.604 8.157 435 HB3 LEU 66 3HB LEU 66 10.994 -4.982 8.802 436 HG LEU 66 HG LEU 66 12.894 -5.341 10.347 437 HD11 LEU 66 1HD1 LEU 66 14.628 -4.117 9.163 438 HD12 LEU 66 2HD1 LEU 66 14.407 -3.434 10.769 439 HD13 LEU 66 3HD1 LEU 66 13.728 -2.613 9.365 440 HD21 LEU 66 3HD2 LEU 66 12.225 -3.551 11.887 441 HD22 LEU 66 1HD2 LEU 66 10.834 -4.295 11.095 442 HD23 LEU 66 2HD2 LEU 66 11.416 -2.718 10.557 443 H GLY 67 H GLY 67 11.137 -7.488 7.771 444 HA2 GLY 67 2HA GLY 67 12.929 -9.566 8.261 445 HA3 GLY 67 3HA GLY 67 12.369 -8.980 9.821 446 H ASN 68 H ASN 68 9.719 -8.279 8.952 447 HA ASN 68 HA ASN 68 8.369 -10.412 7.756 448 HB2 ASN 68 2HB ASN 68 7.293 -11.429 9.758 449 HB3 ASN 68 3HB ASN 68 9.012 -11.762 9.670 450 HD21 ASN 68 1HD2 ASN 68 7.157 -11.770 11.940 451 HD22 ASN 68 2HD2 ASN 68 7.835 -10.692 13.106 452 H ASN 69 H ASN 69 6.727 -9.361 6.911 453 HA ASN 69 HA ASN 69 4.964 -8.017 6.597 454 HB2 ASN 69 2HB ASN 69 4.823 -8.083 9.608 455 HB3 ASN 69 3HB ASN 69 3.647 -7.221 8.624 456 HD21 ASN 69 1HD2 ASN 69 3.165 -9.443 10.368 457 HD22 ASN 69 2HD2 ASN 69 2.528 -10.718 9.383 458 H SER 70 H SER 70 7.114 -6.668 9.054 459 HA SER 70 HA SER 70 6.496 -3.964 8.339 460 HB2 SER 70 2HB SER 70 8.883 -4.973 9.881 461 HB3 SER 70 3HB SER 70 8.175 -3.359 9.939 462 HG SER 70 HG SER 70 6.933 -4.077 11.452 463 H TYR 71 H TYR 71 7.454 -2.702 6.894 464 HA TYR 71 HA TYR 71 9.914 -3.649 5.574 465 HB2 TYR 71 2HB TYR 71 7.535 -2.255 4.318 466 HB3 TYR 71 3HB TYR 71 9.078 -2.486 3.517 467 HD1 TYR 71 HD1 TYR 71 5.987 -4.102 4.646 468 HD2 TYR 71 HD2 TYR 71 9.701 -4.642 2.662 469 HE1 TYR 71 HE1 TYR 71 5.178 -6.241 3.706 470 HE2 TYR 71 HE2 TYR 71 8.903 -6.760 1.729 471 HH TYR 71 HH TYR 71 5.801 -7.636 1.546 472 H GLU 72 H GLU 72 11.402 -2.059 5.027 473 HA GLU 72 HA GLU 72 10.898 0.553 6.242 474 HB2 GLU 72 2HB GLU 72 13.052 -0.610 6.756 475 HB3 GLU 72 3HB GLU 72 13.449 -0.559 5.045 476 HG2 GLU 72 2HG GLU 72 13.459 1.868 5.086 477 HG3 GLU 72 3HG GLU 72 12.978 1.852 6.778 478 H VAL 73 H VAL 73 10.123 2.113 5.002 479 HA VAL 73 HA VAL 73 10.189 1.718 2.111 480 HB VAL 73 HB VAL 73 8.340 3.316 3.883 481 HG11 VAL 73 1HG1 VAL 73 8.232 3.042 0.886 482 HG12 VAL 73 2HG1 VAL 73 8.710 4.498 1.759 483 HG13 VAL 73 3HG1 VAL 73 7.065 3.888 1.902 484 HG21 VAL 73 3HG2 VAL 73 7.931 0.947 3.961 485 HG22 VAL 73 1HG2 VAL 73 7.932 0.850 2.199 486 HG23 VAL 73 2HG2 VAL 73 6.653 1.731 3.032 487 H GLU 74 H GLU 74 11.000 3.147 0.749 488 HA GLU 74 HA GLU 74 12.092 5.672 1.768 489 HB2 GLU 74 2HB GLU 74 13.110 3.866 -0.426 490 HB3 GLU 74 3HB GLU 74 13.741 5.466 -0.081 491 HG2 GLU 74 2HG GLU 74 14.449 4.736 2.122 492 HG3 GLU 74 3HG GLU 74 13.773 3.141 1.827 493 H ASN 75 H ASN 75 11.885 7.462 0.362 494 HA ASN 75 HA ASN 75 9.877 7.116 -1.751 495 HB2 ASN 75 2HB ASN 75 9.944 9.207 0.413 496 HB3 ASN 75 3HB ASN 75 9.031 9.425 -1.071 497 HD21 ASN 75 1HD2 ASN 75 8.400 6.472 -1.075 498 HD22 ASN 75 2HD2 ASN 75 7.144 6.301 0.098 499 H GLN 76 H GLN 76 10.224 8.188 -3.575 500 HA GLN 76 HA GLN 76 12.686 9.799 -3.775 501 HB2 GLN 76 2HB GLN 76 12.659 7.744 -5.082 502 HB3 GLN 76 3HB GLN 76 11.148 8.231 -5.827 503 HG2 GLN 76 2HG GLN 76 12.395 10.246 -6.718 504 HG3 GLN 76 3HG GLN 76 13.868 9.420 -6.216 505 HE21 GLN 76 1HE2 GLN 76 14.494 7.527 -7.282 506 HE22 GLN 76 2HE2 GLN 76 13.816 7.096 -8.811 507 H TRP 77 H TRP 77 12.264 11.934 -3.917 508 HA TRP 77 HA TRP 77 9.970 12.760 -5.544 509 HB2 TRP 77 2HB TRP 77 9.673 14.708 -3.957 510 HB3 TRP 77 3HB TRP 77 9.197 13.136 -3.335 511 HD1 TRP 77 HD1 TRP 77 12.245 15.530 -3.101 512 HE1 TRP 77 HE1 TRP 77 13.240 15.333 -0.743 513 HE3 TRP 77 HE3 TRP 77 9.220 11.851 -1.277 514 HZ2 TRP 77 HZ2 TRP 77 12.791 13.817 1.594 515 HZ3 TRP 77 HZ3 TRP 77 9.566 11.083 1.044 516 HH2 TRP 77 HH2 TRP 77 11.314 12.049 2.443 517 H GLY 78 H GLY 78 12.392 12.514 -6.631 518 HA2 GLY 78 2HA GLY 78 13.583 15.210 -6.635 519 HA3 GLY 78 3HA GLY 78 14.413 13.747 -7.144 520 H GLY 79 H GLY 79 13.363 12.577 -9.010 521 HA2 GLY 79 2HA GLY 79 11.546 13.695 -10.757 522 HA3 GLY 79 3HA GLY 79 13.120 14.338 -11.212 523 H ASP 80 H ASP 80 14.872 12.623 -11.312 524 HA ASP 80 HA ASP 80 13.869 10.022 -12.219 525 HB2 ASP 80 2HB ASP 80 14.163 11.421 -14.250 526 HB3 ASP 80 3HB ASP 80 15.838 11.696 -13.794 527 H SER 81 H SER 81 14.858 8.570 -11.054 528 HA SER 81 HA SER 81 16.457 7.325 -10.074 529 HB2 SER 81 2HB SER 81 18.034 7.930 -11.890 530 HB3 SER 81 3HB SER 81 18.473 9.396 -11.013 531 HG SER 81 HG SER 81 18.807 7.488 -9.295 532 H ALA 82 H ALA 82 17.835 10.578 -9.525 533 HA ALA 82 HA ALA 82 18.019 11.874 -7.671 534 HB1 ALA 82 3HB ALA 82 15.645 10.286 -6.666 535 HB2 ALA 82 1HB ALA 82 15.575 11.758 -7.632 536 HB3 ALA 82 2HB ALA 82 16.218 11.807 -5.990 537 HA PRO 83 HA PRO 83 20.642 9.962 -4.650 538 HB2 PRO 83 2HB PRO 83 19.182 11.461 -2.536 539 HB3 PRO 83 3HB PRO 83 20.915 11.414 -2.887 540 HG2 PRO 83 2HG PRO 83 19.480 13.548 -3.554 541 HG3 PRO 83 3HG PRO 83 20.735 12.923 -4.643 542 HD2 PRO 83 2HD PRO 83 17.769 12.617 -4.803 543 HD3 PRO 83 3HD PRO 83 18.943 12.903 -6.103 544 H TRP 84 H TRP 84 17.225 10.239 -3.490 545 HA TRP 84 HA TRP 84 15.763 8.564 -3.005 546 HB2 TRP 84 2HB TRP 84 18.213 6.834 -2.793 547 HB3 TRP 84 3HB TRP 84 16.722 6.341 -2.007 548 HD1 TRP 84 HD1 TRP 84 18.430 6.376 -5.345 549 HE1 TRP 84 HE1 TRP 84 16.898 5.292 -7.096 550 HE3 TRP 84 HE3 TRP 84 14.104 6.159 -2.624 551 HZ2 TRP 84 HZ2 TRP 84 14.212 4.449 -7.312 552 HZ3 TRP 84 HZ3 TRP 84 12.100 5.203 -3.676 553 HH2 TRP 84 HH2 TRP 84 12.148 4.367 -5.968 554 H HIS 85 H HIS 85 14.700 9.066 -1.202 555 HA HIS 85 HA HIS 85 16.310 9.570 1.199 556 HB2 HIS 85 2HB HIS 85 13.669 10.740 0.306 557 HB3 HIS 85 3HB HIS 85 14.445 11.072 1.847 558 HD1 HIS 85 HD1 HIS 85 16.570 12.607 1.783 559 HD2 HIS 85 HD2 HIS 85 14.676 12.103 -1.884 560 HE1 HIS 85 HE1 HIS 85 17.501 14.393 0.296 561 H SER 86 H SER 86 15.736 8.566 3.052 562 HA SER 86 HA SER 86 13.960 6.353 2.968 563 HB2 SER 86 2HB SER 86 15.093 7.708 5.423 564 HB3 SER 86 3HB SER 86 14.543 6.040 5.284 565 HG SER 86 HG SER 86 16.244 5.860 3.609 566 H GLY 87 H GLY 87 11.910 6.117 3.813 567 HA2 GLY 87 2HA GLY 87 10.526 8.656 4.403 568 HA3 GLY 87 3HA GLY 87 9.773 7.257 3.650 569 H GLY 88 H GLY 88 10.915 5.315 5.480 570 HA2 GLY 88 2HA GLY 88 10.820 5.566 8.119 571 HA3 GLY 88 3HA GLY 88 9.124 5.817 7.738 572 H ASN 89 H ASN 89 8.777 3.909 9.094 573 HA ASN 89 HA ASN 89 9.264 1.422 7.593 574 HB2 ASN 89 2HB ASN 89 10.466 1.531 9.784 575 HB3 ASN 89 3HB ASN 89 8.907 1.698 10.585 576 HD21 ASN 89 1HD2 ASN 89 11.040 -0.444 8.892 577 HD22 ASN 89 2HD2 ASN 89 10.213 -1.908 9.291 578 H TRP 90 H TRP 90 7.563 0.407 6.908 579 HA TRP 90 HA TRP 90 4.899 1.146 7.980 580 HB2 TRP 90 2HB TRP 90 5.599 0.440 5.116 581 HB3 TRP 90 3HB TRP 90 3.972 0.723 5.715 582 HD1 TRP 90 HD1 TRP 90 6.068 3.288 7.289 583 HE1 TRP 90 HE1 TRP 90 5.981 5.497 5.976 584 HE3 TRP 90 HE3 TRP 90 3.915 1.593 2.966 585 HZ2 TRP 90 HZ2 TRP 90 5.099 6.403 3.446 586 HZ3 TRP 90 HZ3 TRP 90 3.494 3.196 1.173 587 HH2 TRP 90 HH2 TRP 90 4.082 5.546 1.414 588 H ILE 91 H ILE 91 3.302 -0.517 7.996 589 HA ILE 91 HA ILE 91 4.502 -3.206 8.007 590 HB ILE 91 HB ILE 91 2.034 -2.235 9.475 591 HG12 ILE 91 2HG1 ILE 91 4.727 -3.110 10.542 592 HG13 ILE 91 3HG1 ILE 91 4.197 -1.439 10.400 593 HG21 ILE 91 1HG2 ILE 91 1.977 -4.447 10.516 594 HG22 ILE 91 2HG2 ILE 91 3.364 -4.950 9.550 595 HG23 ILE 91 3HG2 ILE 91 1.827 -4.584 8.764 596 HD11 ILE 91 3HD1 ILE 91 2.924 -3.554 12.119 597 HD12 ILE 91 1HD1 ILE 91 2.406 -1.870 11.996 598 HD13 ILE 91 2HD1 ILE 91 3.988 -2.264 12.676 599 H LEU 92 H LEU 92 4.012 -4.431 6.391 600 HA LEU 92 HA LEU 92 1.394 -4.133 5.070 601 HB2 LEU 92 2HB LEU 92 4.015 -4.595 3.645 602 HB3 LEU 92 3HB LEU 92 2.443 -4.577 2.882 603 HG LEU 92 HG LEU 92 3.751 -2.198 4.221 604 HD11 LEU 92 1HD1 LEU 92 4.871 -2.830 2.159 605 HD12 LEU 92 2HD1 LEU 92 3.970 -1.328 1.950 606 HD13 LEU 92 3HD1 LEU 92 3.330 -2.837 1.302 607 HD21 LEU 92 3HD2 LEU 92 1.176 -2.440 2.668 608 HD22 LEU 92 1HD2 LEU 92 1.916 -0.928 3.186 609 HD23 LEU 92 2HD2 LEU 92 1.339 -2.085 4.384 610 H GLY 93 H GLY 93 0.831 -5.860 6.488 611 HA2 GLY 93 2HA GLY 93 0.846 -8.359 5.227 612 HA3 GLY 93 3HA GLY 93 2.005 -8.382 6.551 613 H SER 94 H SER 94 -1.239 -8.639 5.683 614 HA SER 94 HA SER 94 -2.280 -8.192 8.345 615 HB2 SER 94 2HB SER 94 -4.383 -9.201 7.061 616 HB3 SER 94 3HB SER 94 -3.868 -7.530 6.800 617 HG SER 94 HG SER 94 -4.153 -9.287 4.931 618 H ARG 95 H ARG 95 -0.827 -10.678 6.666 619 HA ARG 95 HA ARG 95 -2.026 -12.700 8.395 620 HB2 ARG 95 2HB ARG 95 -0.608 -12.950 5.764 621 HB3 ARG 95 3HB ARG 95 -0.924 -14.343 6.788 622 HG2 ARG 95 2HG ARG 95 -3.321 -13.888 6.671 623 HG3 ARG 95 3HG ARG 95 -3.004 -12.485 5.651 624 HD2 ARG 95 2HD ARG 95 -2.042 -13.914 3.938 625 HD3 ARG 95 3HD ARG 95 -2.265 -15.324 4.973 626 HE ARG 95 HE ARG 95 -4.768 -14.369 4.771 627 HH11 ARG 95 1HH1 ARG 95 -2.332 -15.099 2.380 628 HH12 ARG 95 2HH1 ARG 95 -3.458 -15.529 1.132 629 HH21 ARG 95 1HH2 ARG 95 -6.290 -14.966 3.152 630 HH22 ARG 95 2HH2 ARG 95 -5.742 -15.458 1.589 631 H GLU 96 H GLU 96 -0.705 -14.282 9.354 632 HA GLU 96 HA GLU 96 1.397 -13.127 10.825 633 HB2 GLU 96 2HB GLU 96 -0.134 -14.805 11.710 634 HB3 GLU 96 3HB GLU 96 0.520 -15.997 10.595 635 HG2 GLU 96 2HG GLU 96 2.680 -15.837 11.684 636 HG3 GLU 96 3HG GLU 96 2.033 -14.642 12.808 637 H ASN 97 H ASN 97 1.358 -15.520 8.215 638 HA ASN 97 HA ASN 97 4.303 -15.325 8.111 639 HB2 ASN 97 2HB ASN 97 2.600 -17.767 7.592 640 HB3 ASN 97 3HB ASN 97 4.335 -17.675 7.304 641 HD21 ASN 97 1HD2 ASN 97 5.736 -17.515 9.091 642 HD22 ASN 97 2HD2 ASN 97 5.233 -18.012 10.667 643 H GLN 98 H GLN 98 2.535 -13.686 6.622 644 HA GLN 98 HA GLN 98 3.402 -14.435 3.968 645 HB2 GLN 98 2HB GLN 98 0.936 -15.295 4.572 646 HB3 GLN 98 3HB GLN 98 0.538 -13.665 4.050 647 HG2 GLN 98 2HG GLN 98 1.536 -14.055 1.892 648 HG3 GLN 98 3HG GLN 98 2.122 -15.636 2.413 649 HE21 GLN 98 1HE2 GLN 98 0.484 -15.156 0.158 650 HE22 GLN 98 2HE2 GLN 98 -1.039 -15.937 0.422 651 H ASN 99 H ASN 99 4.197 -12.733 3.024 652 HA ASN 99 HA ASN 99 3.681 -10.089 4.157 653 HB2 ASN 99 2HB ASN 99 5.874 -11.092 2.314 654 HB3 ASN 99 3HB ASN 99 5.711 -9.428 2.857 655 HD21 ASN 99 1HD2 ASN 99 7.875 -11.343 3.227 656 HD22 ASN 99 2HD2 ASN 99 8.115 -11.481 4.931 657 H VAL 100 H VAL 100 3.439 -8.263 2.705 658 HA VAL 100 HA VAL 100 1.745 -8.904 0.439 659 HB VAL 100 HB VAL 100 2.630 -6.222 1.530 660 HG11 VAL 100 1HG1 VAL 100 0.604 -6.796 -0.641 661 HG12 VAL 100 2HG1 VAL 100 2.193 -6.079 -0.891 662 HG13 VAL 100 3HG1 VAL 100 0.978 -5.212 0.044 663 HG21 VAL 100 3HG2 VAL 100 0.009 -7.699 1.644 664 HG22 VAL 100 1HG2 VAL 100 0.294 -6.069 2.263 665 HG23 VAL 100 2HG2 VAL 100 1.124 -7.448 2.985 666 H VAL 101 H VAL 101 2.214 -8.778 -1.617 667 HA VAL 101 HA VAL 101 5.001 -8.099 -2.350 668 HB VAL 101 HB VAL 101 4.944 -9.677 -4.232 669 HG11 VAL 101 1HG1 VAL 101 4.295 -10.982 -1.600 670 HG12 VAL 101 2HG1 VAL 101 5.864 -10.315 -2.046 671 HG13 VAL 101 3HG1 VAL 101 5.207 -11.692 -2.933 672 HG21 VAL 101 3HG2 VAL 101 2.289 -10.515 -3.084 673 HG22 VAL 101 1HG2 VAL 101 3.165 -11.380 -4.346 674 HG23 VAL 101 2HG2 VAL 101 2.562 -9.754 -4.650 675 H ALA 102 H ALA 102 1.670 -7.612 -3.253 676 HA ALA 102 HA ALA 102 2.631 -5.467 -4.995 677 HB1 ALA 102 3HB ALA 102 2.279 -7.534 -6.417 678 HB2 ALA 102 1HB ALA 102 1.425 -6.074 -6.922 679 HB3 ALA 102 2HB ALA 102 0.555 -7.350 -6.085 680 H ILE 103 H ILE 103 1.373 -3.738 -5.097 681 HA ILE 103 HA ILE 103 -1.322 -3.872 -3.898 682 HB ILE 103 HB ILE 103 0.725 -1.725 -3.257 683 HG12 ILE 103 2HG1 ILE 103 -0.646 -3.668 -1.393 684 HG13 ILE 103 3HG1 ILE 103 0.977 -3.902 -2.035 685 HG21 ILE 103 1HG2 ILE 103 -0.993 -0.735 -1.835 686 HG22 ILE 103 2HG2 ILE 103 -2.145 -1.967 -2.337 687 HG23 ILE 103 3HG2 ILE 103 -1.531 -0.804 -3.513 688 HD11 ILE 103 3HD1 ILE 103 1.035 -3.011 0.222 689 HD12 ILE 103 1HD1 ILE 103 0.074 -1.624 -0.287 690 HD13 ILE 103 2HD1 ILE 103 1.707 -1.852 -0.920 691 H ASN 104 H ASN 104 -2.778 -3.134 -5.241 692 HA ASN 104 HA ASN 104 -2.162 -0.806 -6.939 693 HB2 ASN 104 2HB ASN 104 -2.310 -2.805 -8.343 694 HB3 ASN 104 3HB ASN 104 -3.882 -3.199 -7.653 695 HD21 ASN 104 1HD2 ASN 104 -4.898 -3.156 -9.628 696 HD22 ASN 104 2HD2 ASN 104 -5.213 -1.692 -10.492 697 H VAL 105 H VAL 105 -3.116 0.713 -5.865 698 HA VAL 105 HA VAL 105 -5.983 0.516 -5.260 699 HB VAL 105 HB VAL 105 -5.805 1.345 -2.938 700 HG11 VAL 105 1HG1 VAL 105 -6.179 -0.995 -3.277 701 HG12 VAL 105 2HG1 VAL 105 -5.063 -0.781 -1.924 702 HG13 VAL 105 3HG1 VAL 105 -4.452 -1.277 -3.503 703 HG21 VAL 105 3HG2 VAL 105 -3.615 2.378 -3.032 704 HG22 VAL 105 1HG2 VAL 105 -2.865 0.804 -3.288 705 HG23 VAL 105 2HG2 VAL 105 -3.660 1.166 -1.755 706 H GLU 106 H GLU 106 -7.119 2.374 -5.090 707 HA GLU 106 HA GLU 106 -5.699 4.908 -5.059 708 HB2 GLU 106 2HB GLU 106 -6.118 4.315 -7.457 709 HB3 GLU 106 3HB GLU 106 -7.835 4.246 -7.098 710 HG2 GLU 106 2HG GLU 106 -7.854 6.598 -6.533 711 HG3 GLU 106 3HG GLU 106 -6.111 6.690 -6.776 712 H SER 107 H SER 107 -6.778 6.438 -3.984 713 HA SER 107 HA SER 107 -8.889 5.582 -2.263 714 HB2 SER 107 2HB SER 107 -7.133 7.073 -1.451 715 HB3 SER 107 3HB SER 107 -7.625 8.311 -2.609 716 HG SER 107 HG SER 107 -9.377 7.221 -0.671 717 H GLY 108 H GLY 108 -8.637 8.081 -4.785 718 HA2 GLY 108 2HA GLY 108 -10.287 8.869 -6.203 719 HA3 GLY 108 3HA GLY 108 -11.438 7.773 -5.446 720 H ASP 109 H ASP 109 -10.126 9.090 -2.847 721 HA ASP 109 HA ASP 109 -11.802 11.487 -2.810 722 HB2 ASP 109 2HB ASP 109 -12.704 9.458 -1.525 723 HB3 ASP 109 3HB ASP 109 -11.270 9.558 -0.519 724 H ASP 110 H ASP 110 -10.773 11.937 -0.024 725 HA ASP 110 HA ASP 110 -8.235 13.133 -0.808 726 HB2 ASP 110 2HB ASP 110 -9.916 13.455 1.680 727 HB3 ASP 110 3HB ASP 110 -8.390 14.289 1.412 728 H GLY 111 H GLY 111 -8.792 10.173 -0.024 729 HA2 GLY 111 2HA GLY 111 -7.005 8.701 0.600 730 HA3 GLY 111 3HA GLY 111 -6.363 9.976 1.610 731 H GLN 112 H GLN 112 -9.670 9.750 2.041 732 HA GLN 112 HA GLN 112 -9.402 8.790 4.709 733 HB2 GLN 112 2HB GLN 112 -11.876 9.151 3.005 734 HB3 GLN 112 3HB GLN 112 -11.882 8.830 4.733 735 HG2 GLN 112 2HG GLN 112 -10.673 10.935 5.115 736 HG3 GLN 112 3HG GLN 112 -10.719 11.255 3.383 737 HE21 GLN 112 1HE2 GLN 112 -12.668 11.781 2.406 738 HE22 GLN 112 2HE2 GLN 112 -14.035 12.300 3.333 739 H THR 113 H THR 113 -10.585 7.376 1.731 740 HA THR 113 HA THR 113 -10.270 4.711 2.910 741 HB THR 113 HB THR 113 -12.264 4.016 1.465 742 HG1 THR 113 HG1 THR 113 -13.752 5.875 1.180 743 HG21 THR 113 3HG2 THR 113 -13.907 4.706 3.167 744 HG22 THR 113 1HG2 THR 113 -12.746 5.879 3.801 745 HG23 THR 113 2HG2 THR 113 -12.405 4.153 3.902 746 H LEU 114 H LEU 114 -9.352 3.207 1.606 747 HA LEU 114 HA LEU 114 -8.722 4.021 -1.150 748 HB2 LEU 114 2HB LEU 114 -7.009 2.587 0.873 749 HB3 LEU 114 3HB LEU 114 -6.700 2.441 -0.845 750 HG LEU 114 HG LEU 114 -6.435 4.955 -0.900 751 HD11 LEU 114 1HD1 LEU 114 -6.332 4.642 2.101 752 HD12 LEU 114 2HD1 LEU 114 -7.595 5.472 1.199 753 HD13 LEU 114 3HD1 LEU 114 -5.949 6.097 1.183 754 HD21 LEU 114 3HD2 LEU 114 -4.525 3.483 -0.969 755 HD22 LEU 114 1HD2 LEU 114 -4.532 3.340 0.790 756 HD23 LEU 114 2HD2 LEU 114 -4.158 4.888 0.029 757 H ASN 115 H ASN 115 -8.885 2.433 -2.749 758 HA ASN 115 HA ASN 115 -9.590 -0.257 -1.912 759 HB2 ASN 115 2HB ASN 115 -11.628 -0.321 -3.331 760 HB3 ASN 115 3HB ASN 115 -11.781 0.791 -1.975 761 HD21 ASN 115 1HD2 ASN 115 -11.962 2.971 -2.375 762 HD22 ASN 115 2HD2 ASN 115 -12.207 3.620 -3.955 763 H GLY 116 H GLY 116 -9.647 -1.775 -3.685 764 HA2 GLY 116 2HA GLY 116 -9.180 -1.521 -6.289 765 HA3 GLY 116 3HA GLY 116 -7.599 -1.130 -5.623 766 H THR 117 H THR 117 -6.307 -2.813 -5.818 767 HA THR 117 HA THR 117 -7.266 -5.447 -4.984 768 HB THR 117 HB THR 117 -5.868 -6.432 -6.867 769 HG1 THR 117 HG1 THR 117 -5.909 -3.695 -7.598 770 HG21 THR 117 3HG2 THR 117 -8.307 -6.456 -6.952 771 HG22 THR 117 1HG2 THR 117 -7.644 -6.152 -8.557 772 HG23 THR 117 2HG2 THR 117 -8.319 -4.823 -7.616 773 H MET 118 H MET 118 -5.526 -6.925 -4.434 774 HA MET 118 HA MET 118 -2.890 -5.782 -4.050 775 HB2 MET 118 2HB MET 118 -2.783 -6.202 -1.664 776 HB3 MET 118 3HB MET 118 -4.146 -5.150 -1.995 777 HG2 MET 118 2HG MET 118 -4.952 -6.640 -0.408 778 HG3 MET 118 3HG MET 118 -5.570 -7.280 -1.927 779 HE1 MET 118 3HE MET 118 -2.856 -7.597 0.846 780 HE2 MET 118 1HE MET 118 -1.841 -7.586 -0.598 781 HE3 MET 118 2HE MET 118 -1.985 -9.055 0.370 782 H THR 119 H THR 119 -1.284 -7.409 -3.524 783 HA THR 119 HA THR 119 -2.219 -10.149 -4.075 784 HB THR 119 HB THR 119 0.338 -8.937 -5.139 785 HG1 THR 119 HG1 THR 119 -2.164 -8.660 -6.001 786 HG21 THR 119 3HG2 THR 119 -1.042 -11.566 -5.702 787 HG22 THR 119 1HG2 THR 119 0.485 -11.343 -4.843 788 HG23 THR 119 2HG2 THR 119 0.377 -10.956 -6.560 789 H TYR 120 H TYR 120 -1.618 -11.571 -2.573 790 HA TYR 120 HA TYR 120 0.346 -10.918 -0.542 791 HB2 TYR 120 2HB TYR 120 -1.464 -13.300 -0.972 792 HB3 TYR 120 3HB TYR 120 -0.249 -13.254 0.288 793 HD1 TYR 120 HD2 TYR 120 -0.448 -11.511 2.089 794 HD2 TYR 120 HD1 TYR 120 -3.588 -12.328 -0.660 795 HE1 TYR 120 HE2 TYR 120 -2.046 -10.479 3.626 796 HE2 TYR 120 HE1 TYR 120 -5.210 -11.302 0.884 797 HH TYR 120 HH TYR 120 -5.492 -10.686 3.127 798 H ALA 121 H ALA 121 2.132 -12.364 -0.048 799 HA ALA 121 HA ALA 121 3.694 -13.094 -2.262 800 HB1 ALA 121 3HB ALA 121 4.630 -12.623 -0.029 801 HB2 ALA 121 1HB ALA 121 5.169 -14.180 -0.660 802 HB3 ALA 121 2HB ALA 121 3.909 -14.118 0.573 803 H GLY 122 H GLY 122 3.670 -14.802 -3.560 804 HA2 GLY 122 2HA GLY 122 3.270 -16.881 -4.403 805 HA3 GLY 122 3HA GLY 122 3.191 -17.448 -2.748 806 H GLU 123 H GLU 123 0.961 -15.033 -4.058 807 HA GLU 123 HA GLU 123 -1.096 -17.039 -4.433 808 HB2 GLU 123 2HB GLU 123 -1.080 -16.521 -1.997 809 HB3 GLU 123 3HB GLU 123 -1.410 -14.841 -2.382 810 HG2 GLU 123 2HG GLU 123 -3.548 -15.432 -3.305 811 HG3 GLU 123 3HG GLU 123 -3.219 -17.147 -3.065 812 H GLY 124 H GLY 124 -3.097 -16.071 -5.344 813 HA2 GLY 124 2HA GLY 124 -2.393 -14.103 -7.317 814 HA3 GLY 124 3HA GLY 124 -3.945 -14.906 -7.151 815 HA PRO 125 HA PRO 125 -3.943 -10.394 -5.520 816 HB2 PRO 125 2HB PRO 125 -5.150 -9.175 -7.633 817 HB3 PRO 125 3HB PRO 125 -3.394 -9.302 -7.469 818 HG2 PRO 125 2HG PRO 125 -5.267 -10.997 -9.087 819 HG3 PRO 125 3HG PRO 125 -3.688 -10.330 -9.541 820 HD2 PRO 125 2HD PRO 125 -3.998 -12.895 -8.763 821 HD3 PRO 125 3HD PRO 125 -2.525 -11.969 -8.399 822 H ILE 126 H ILE 126 -5.673 -9.627 -4.456 823 HA ILE 126 HA ILE 126 -8.357 -10.552 -5.227 824 HB ILE 126 HB ILE 126 -8.974 -10.836 -2.877 825 HG12 ILE 126 2HG1 ILE 126 -6.043 -10.409 -2.235 826 HG13 ILE 126 3HG1 ILE 126 -7.310 -9.222 -1.951 827 HG21 ILE 126 1HG2 ILE 126 -7.683 -12.895 -2.402 828 HG22 ILE 126 2HG2 ILE 126 -6.549 -12.441 -3.679 829 HG23 ILE 126 3HG2 ILE 126 -8.225 -12.801 -4.082 830 HD11 ILE 126 3HD1 ILE 126 -6.801 -10.350 0.094 831 HD12 ILE 126 1HD1 ILE 126 -7.051 -11.926 -0.655 832 HD13 ILE 126 2HD1 ILE 126 -8.414 -10.837 -0.434 833 H GLY 127 H GLY 127 -10.092 -9.201 -3.999 834 HA2 GLY 127 2HA GLY 127 -9.603 -6.467 -4.632 835 HA3 GLY 127 3HA GLY 127 -11.048 -7.117 -3.871 836 H PHE 128 H PHE 128 -8.990 -4.818 -3.378 837 HA PHE 128 HA PHE 128 -8.682 -5.338 -0.502 838 HB2 PHE 128 2HB PHE 128 -6.497 -5.269 -1.563 839 HB3 PHE 128 3HB PHE 128 -6.880 -3.727 -2.321 840 HD1 PHE 128 HD1 PHE 128 -6.144 -5.397 0.867 841 HD2 PHE 128 HD2 PHE 128 -6.689 -1.665 -1.104 842 HE1 PHE 128 HE1 PHE 128 -5.243 -4.216 2.836 843 HE2 PHE 128 HE2 PHE 128 -5.780 -0.486 0.847 844 HZ PHE 128 HZ PHE 128 -5.057 -1.760 2.823 845 H LYS 129 H LYS 129 -9.349 -3.850 0.894 846 HA LYS 129 HA LYS 129 -10.104 -1.202 -0.020 847 HB2 LYS 129 2HB LYS 129 -12.136 -2.596 -0.067 848 HB3 LYS 129 3HB LYS 129 -11.850 -3.069 1.596 849 HG2 LYS 129 2HG LYS 129 -12.182 -0.774 2.318 850 HG3 LYS 129 3HG LYS 129 -12.435 -0.280 0.640 851 HD2 LYS 129 2HD LYS 129 -14.372 -1.778 0.497 852 HD3 LYS 129 3HD LYS 129 -14.114 -2.255 2.178 853 HE2 LYS 129 2HE LYS 129 -14.712 0.517 1.195 854 HE3 LYS 129 3HE LYS 129 -15.868 -0.575 1.958 855 HZ1 LYS 129 3HZ LYS 129 -13.428 0.556 3.212 856 HZ2 LYS 129 1HZ LYS 129 -14.451 -0.576 3.940 857 HZ3 LYS 129 2HZ LYS 129 -15.021 0.984 3.577 858 H GLY 130 H GLY 130 -9.521 0.329 1.495 859 HA2 GLY 130 2HA GLY 130 -8.801 -0.647 4.166 860 HA3 GLY 130 3HA GLY 130 -7.662 0.320 3.234 861 H THR 131 H THR 131 -9.067 0.818 5.823 862 HA THR 131 HA THR 131 -10.363 3.331 5.063 863 HB THR 131 HB THR 131 -11.037 1.536 7.421 864 HG1 THR 131 HG1 THR 131 -12.396 0.590 6.096 865 HG21 THR 131 3HG2 THR 131 -11.434 3.873 7.941 866 HG22 THR 131 1HG2 THR 131 -12.979 3.058 7.687 867 HG23 THR 131 2HG2 THR 131 -12.308 4.089 6.421 868 H LEU 132 H LEU 132 -9.441 5.126 6.020 869 HA LEU 132 HA LEU 132 -7.083 4.831 7.602 870 HB2 LEU 132 2HB LEU 132 -7.383 6.698 6.044 871 HB3 LEU 132 3HB LEU 132 -8.764 7.267 6.952 872 HG LEU 132 HG LEU 132 -7.251 7.722 8.879 873 HD11 LEU 132 1HD1 LEU 132 -5.100 7.078 6.882 874 HD12 LEU 132 2HD1 LEU 132 -5.464 6.167 8.350 875 HD13 LEU 132 3HD1 LEU 132 -4.834 7.812 8.461 876 HD21 LEU 132 3HD2 LEU 132 -6.280 9.743 7.926 877 HD22 LEU 132 1HD2 LEU 132 -7.911 9.484 7.313 878 HD23 LEU 132 2HD2 LEU 132 -6.516 9.106 6.300 879 H THR 133 H THR 133 -6.820 5.085 9.845 880 HA THR 133 HA THR 133 -9.326 5.139 11.325 881 HB THR 133 HB THR 133 -8.048 3.003 11.553 882 HG1 THR 133 HG1 THR 133 -9.097 3.160 13.381 883 HG21 THR 133 3HG2 THR 133 -5.929 4.749 12.822 884 HG22 THR 133 1HG2 THR 133 -5.772 3.838 11.323 885 HG23 THR 133 2HG2 THR 133 -5.951 2.987 12.855 Start of MODEL 18 1 H1 ALA 2 1H ALA 2 1.690 5.047 10.502 2 H2 ALA 2 2H ALA 2 1.706 6.590 9.796 3 H3 ALA 2 3H ALA 2 1.306 5.239 8.867 4 HA ALA 2 HA ALA 2 -0.274 6.244 11.145 5 HB1 ALA 2 3HB ALA 2 -1.907 6.948 9.462 6 HB2 ALA 2 1HB ALA 2 -0.817 6.425 8.179 7 HB3 ALA 2 2HB ALA 2 -0.363 7.766 9.230 8 H LEU 3 H LEU 3 -2.235 5.078 11.494 9 HA LEU 3 HA LEU 3 -1.901 2.272 10.790 10 HB2 LEU 3 2HB LEU 3 -2.194 3.082 13.178 11 HB3 LEU 3 3HB LEU 3 -3.839 3.501 12.760 12 HG LEU 3 HG LEU 3 -3.580 1.354 14.026 13 HD11 LEU 3 1HD1 LEU 3 -4.819 1.107 11.292 14 HD12 LEU 3 2HD1 LEU 3 -5.593 1.749 12.744 15 HD13 LEU 3 3HD1 LEU 3 -5.133 0.048 12.668 16 HD21 LEU 3 3HD2 LEU 3 -1.503 0.597 12.980 17 HD22 LEU 3 1HD2 LEU 3 -2.359 0.351 11.457 18 HD23 LEU 3 2HD2 LEU 3 -2.772 -0.625 12.867 19 H TYR 4 H TYR 4 -3.150 1.265 9.385 20 HA TYR 4 HA TYR 4 -5.669 2.534 8.561 21 HB2 TYR 4 2HB TYR 4 -3.486 1.361 6.903 22 HB3 TYR 4 3HB TYR 4 -5.150 1.139 6.369 23 HD1 TYR 4 HD1 TYR 4 -2.792 3.841 7.449 24 HD2 TYR 4 HD2 TYR 4 -6.158 2.735 5.097 25 HE1 TYR 4 HE1 TYR 4 -2.826 6.089 6.432 26 HE2 TYR 4 HE2 TYR 4 -6.200 4.959 4.083 27 HH TYR 4 HH TYR 4 -3.669 7.223 4.472 28 H ASN 5 H ASN 5 -7.399 1.246 8.197 29 HA ASN 5 HA ASN 5 -7.226 -1.442 9.353 30 HB2 ASN 5 2HB ASN 5 -9.602 0.314 8.678 31 HB3 ASN 5 3HB ASN 5 -9.746 -1.341 9.258 32 HD21 ASN 5 1HD2 ASN 5 -10.666 1.184 10.433 33 HD22 ASN 5 2HD2 ASN 5 -9.959 1.248 12.002 34 H VAL 6 H VAL 6 -7.742 -3.264 8.141 35 HA VAL 6 HA VAL 6 -7.915 -2.700 5.256 36 HB VAL 6 HB VAL 6 -6.450 -4.922 6.687 37 HG11 VAL 6 1HG1 VAL 6 -5.758 -5.711 4.472 38 HG12 VAL 6 2HG1 VAL 6 -6.833 -4.529 3.724 39 HG13 VAL 6 3HG1 VAL 6 -7.504 -5.838 4.698 40 HG21 VAL 6 3HG2 VAL 6 -5.285 -2.789 6.654 41 HG22 VAL 6 1HG2 VAL 6 -5.489 -2.687 4.906 42 HG23 VAL 6 2HG2 VAL 6 -4.476 -3.952 5.602 43 H GLU 7 H GLU 7 -9.559 -3.478 4.177 44 HA GLU 7 HA GLU 7 -11.055 -5.793 5.209 45 HB2 GLU 7 2HB GLU 7 -12.107 -3.317 3.806 46 HB3 GLU 7 3HB GLU 7 -13.062 -4.755 4.139 47 HG2 GLU 7 2HG GLU 7 -12.842 -4.405 6.512 48 HG3 GLU 7 3HG GLU 7 -11.760 -3.042 6.242 49 H ASN 8 H ASN 8 -11.528 -7.353 3.649 50 HA ASN 8 HA ASN 8 -10.616 -6.741 0.918 51 HB2 ASN 8 2HB ASN 8 -9.852 -9.168 2.530 52 HB3 ASN 8 3HB ASN 8 -9.654 -9.052 0.786 53 HD21 ASN 8 1HD2 ASN 8 -8.428 -8.173 3.848 54 HD22 ASN 8 2HD2 ASN 8 -7.036 -7.316 3.283 55 H GLN 9 H GLN 9 -11.488 -7.923 -0.758 56 HA GLN 9 HA GLN 9 -13.855 -9.572 -0.127 57 HB2 GLN 9 2HB GLN 9 -14.641 -7.396 -0.850 58 HB3 GLN 9 3HB GLN 9 -13.592 -7.445 -2.257 59 HG2 GLN 9 2HG GLN 9 -14.877 -9.356 -3.125 60 HG3 GLN 9 3HG GLN 9 -15.952 -9.238 -1.730 61 HE21 GLN 9 1HE2 GLN 9 -17.457 -7.624 -1.650 62 HE22 GLN 9 2HE2 GLN 9 -17.801 -6.582 -2.982 63 H TRP 10 H TRP 10 -13.832 -11.512 -1.088 64 HA TRP 10 HA TRP 10 -12.377 -11.829 -3.599 65 HB2 TRP 10 2HB TRP 10 -11.432 -13.987 -2.786 66 HB3 TRP 10 3HB TRP 10 -10.804 -12.586 -1.926 67 HD1 TRP 10 HD1 TRP 10 -12.845 -15.754 -1.411 68 HE1 TRP 10 HE1 TRP 10 -13.226 -16.110 1.101 69 HE3 TRP 10 HE3 TRP 10 -11.058 -11.288 0.315 70 HZ2 TRP 10 HZ2 TRP 10 -12.816 -14.689 3.506 71 HZ3 TRP 10 HZ3 TRP 10 -11.086 -10.868 2.737 72 HH2 TRP 10 HH2 TRP 10 -11.946 -12.529 4.296 73 H GLY 11 H GLY 11 -13.213 -13.371 -4.975 74 HA2 GLY 11 2HA GLY 11 -14.599 -15.215 -5.519 75 HA3 GLY 11 3HA GLY 11 -15.478 -14.964 -4.017 76 H GLY 12 H GLY 12 -14.856 -12.070 -5.612 77 HA2 GLY 12 2HA GLY 12 -16.094 -11.060 -7.402 78 HA3 GLY 12 3HA GLY 12 -17.405 -12.183 -7.070 79 H SER 13 H SER 13 -17.590 -9.351 -7.286 80 HA SER 13 HA SER 13 -17.737 -7.988 -4.886 81 HB2 SER 13 2HB SER 13 -19.584 -7.626 -7.248 82 HB3 SER 13 3HB SER 13 -19.182 -6.419 -6.024 83 HG SER 13 HG SER 13 -16.888 -6.977 -6.801 84 H SER 14 H SER 14 -19.839 -10.455 -6.071 85 HA SER 14 HA SER 14 -22.167 -9.959 -4.636 86 HB2 SER 14 2HB SER 14 -20.933 -12.659 -5.229 87 HB3 SER 14 3HB SER 14 -22.634 -12.325 -4.907 88 HG SER 14 HG SER 14 -21.313 -12.204 -7.236 89 H ALA 15 H ALA 15 -19.089 -11.302 -3.615 90 HA ALA 15 HA ALA 15 -20.040 -12.252 -1.084 91 HB1 ALA 15 3HB ALA 15 -17.217 -11.810 -2.060 92 HB2 ALA 15 1HB ALA 15 -18.138 -13.306 -2.215 93 HB3 ALA 15 2HB ALA 15 -17.687 -12.711 -0.619 94 HA PRO 16 HA PRO 16 -19.751 -8.449 1.153 95 HB2 PRO 16 2HB PRO 16 -19.542 -9.378 3.662 96 HB3 PRO 16 3HB PRO 16 -21.032 -9.580 2.727 97 HG2 PRO 16 2HG PRO 16 -18.801 -11.538 3.161 98 HG3 PRO 16 3HG PRO 16 -20.549 -11.795 3.319 99 HD2 PRO 16 2HD PRO 16 -19.191 -12.515 1.097 100 HD3 PRO 16 3HD PRO 16 -20.864 -11.923 1.027 101 H TRP 17 H TRP 17 -18.331 -7.237 2.570 102 HA TRP 17 HA TRP 17 -15.551 -7.859 2.024 103 HB2 TRP 17 2HB TRP 17 -16.885 -5.441 3.263 104 HB3 TRP 17 3HB TRP 17 -15.139 -5.605 3.108 105 HD1 TRP 17 HD1 TRP 17 -18.287 -4.967 1.035 106 HE1 TRP 17 HE1 TRP 17 -17.600 -4.126 -1.294 107 HE3 TRP 17 HE3 TRP 17 -13.245 -5.697 1.381 108 HZ2 TRP 17 HZ2 TRP 17 -15.208 -3.811 -2.798 109 HZ3 TRP 17 HZ3 TRP 17 -11.830 -5.101 -0.544 110 HH2 TRP 17 HH2 TRP 17 -12.794 -4.181 -2.583 111 H ASN 18 H ASN 18 -14.128 -8.602 3.487 112 HA ASN 18 HA ASN 18 -15.036 -8.789 6.269 113 HB2 ASN 18 2HB ASN 18 -13.605 -10.887 4.624 114 HB3 ASN 18 3HB ASN 18 -13.747 -10.955 6.377 115 HD21 ASN 18 1HD2 ASN 18 -15.375 -11.340 3.358 116 HD22 ASN 18 2HD2 ASN 18 -16.832 -12.007 3.994 117 H GLU 19 H GLU 19 -13.433 -8.512 7.817 118 HA GLU 19 HA GLU 19 -11.420 -6.727 7.032 119 HB2 GLU 19 2HB GLU 19 -10.694 -6.747 9.341 120 HB3 GLU 19 3HB GLU 19 -12.442 -6.604 9.208 121 HG2 GLU 19 2HG GLU 19 -12.692 -8.957 9.780 122 HG3 GLU 19 3HG GLU 19 -10.942 -9.136 9.864 123 H GLY 20 H GLY 20 -9.418 -6.908 6.645 124 HA2 GLY 20 2HA GLY 20 -8.165 -9.599 6.640 125 HA3 GLY 20 3HA GLY 20 -7.754 -8.328 5.494 126 H GLY 21 H GLY 21 -8.255 -7.912 8.912 127 HA2 GLY 21 2HA GLY 21 -6.734 -7.471 10.612 128 HA3 GLY 21 3HA GLY 21 -5.425 -7.725 9.466 129 H GLN 22 H GLN 22 -4.437 -5.836 10.343 130 HA GLN 22 HA GLN 22 -5.345 -3.485 8.931 131 HB2 GLN 22 2HB GLN 22 -4.923 -2.069 10.988 132 HB3 GLN 22 3HB GLN 22 -6.391 -3.027 10.994 133 HG2 GLN 22 2HG GLN 22 -5.155 -4.727 12.352 134 HG3 GLN 22 3HG GLN 22 -3.838 -3.558 12.477 135 HE21 GLN 22 1HE2 GLN 22 -4.205 -1.637 13.571 136 HE22 GLN 22 2HE2 GLN 22 -5.454 -1.480 14.755 137 H TRP 23 H TRP 23 -3.708 -1.948 8.573 138 HA TRP 23 HA TRP 23 -0.978 -3.033 8.880 139 HB2 TRP 23 2HB TRP 23 -2.195 -1.908 6.348 140 HB3 TRP 23 3HB TRP 23 -0.493 -2.272 6.557 141 HD1 TRP 23 HD1 TRP 23 -1.774 -5.128 8.185 142 HE1 TRP 23 HE1 TRP 23 -2.204 -7.096 6.585 143 HE3 TRP 23 HE3 TRP 23 -1.723 -2.598 3.750 144 HZ2 TRP 23 HZ2 TRP 23 -2.470 -7.522 3.820 145 HZ3 TRP 23 HZ3 TRP 23 -2.064 -3.865 1.670 146 HH2 TRP 23 HH2 TRP 23 -2.430 -6.268 1.709 147 H GLU 24 H GLU 24 0.600 -1.227 7.902 148 HA GLU 24 HA GLU 24 -0.382 1.366 8.861 149 HB2 GLU 24 2HB GLU 24 1.170 0.544 10.542 150 HB3 GLU 24 3HB GLU 24 2.400 0.271 9.309 151 HG2 GLU 24 2HG GLU 24 2.599 2.611 8.883 152 HG3 GLU 24 3HG GLU 24 1.216 2.968 9.909 153 H ILE 25 H ILE 25 -0.485 2.768 7.345 154 HA ILE 25 HA ILE 25 1.440 2.653 5.126 155 HB ILE 25 HB ILE 25 -1.536 3.196 4.954 156 HG12 ILE 25 2HG1 ILE 25 0.113 0.989 3.701 157 HG13 ILE 25 3HG1 ILE 25 -0.852 0.805 5.160 158 HG21 ILE 25 1HG2 ILE 25 0.548 3.286 2.773 159 HG22 ILE 25 2HG2 ILE 25 -0.317 4.669 3.445 160 HG23 ILE 25 3HG2 ILE 25 -1.194 3.436 2.540 161 HD11 ILE 25 3HD1 ILE 25 -2.874 1.289 3.900 162 HD12 ILE 25 1HD1 ILE 25 -1.998 -0.073 3.202 163 HD13 ILE 25 2HD1 ILE 25 -1.918 1.513 2.436 164 H GLY 26 H GLY 26 2.363 4.544 4.608 165 HA2 GLY 26 2HA GLY 26 2.476 6.862 4.263 166 HA3 GLY 26 3HA GLY 26 1.050 7.058 5.264 167 H SER 27 H SER 27 4.420 7.260 5.103 168 HA SER 27 HA SER 27 5.050 7.205 7.873 169 HB2 SER 27 2HB SER 27 6.441 8.739 5.667 170 HB3 SER 27 3HB SER 27 7.126 8.287 7.227 171 HG SER 27 HG SER 27 7.808 6.654 6.105 172 H ARG 28 H ARG 28 4.197 9.756 5.597 173 HA ARG 28 HA ARG 28 4.391 11.893 7.447 174 HB2 ARG 28 2HB ARG 28 2.946 11.675 4.806 175 HB3 ARG 28 3HB ARG 28 3.077 13.160 5.728 176 HG2 ARG 28 2HG ARG 28 5.512 13.090 5.492 177 HG3 ARG 28 3HG ARG 28 5.372 11.593 4.568 178 HD2 ARG 28 2HD ARG 28 4.049 12.755 2.872 179 HD3 ARG 28 3HD ARG 28 4.160 14.246 3.801 180 HE ARG 28 HE ARG 28 6.753 13.440 3.346 181 HH11 ARG 28 1HH1 ARG 28 3.981 14.328 1.367 182 HH12 ARG 28 2HH1 ARG 28 4.926 14.985 0.087 183 HH21 ARG 28 1HH2 ARG 28 8.026 14.330 1.644 184 HH22 ARG 28 2HH2 ARG 28 7.240 14.987 0.248 185 H SER 29 H SER 29 2.897 12.797 8.745 186 HA SER 29 HA SER 29 0.337 11.397 8.977 187 HB2 SER 29 2HB SER 29 1.686 13.256 10.946 188 HB3 SER 29 3HB SER 29 0.246 12.281 11.236 189 HG SER 29 HG SER 29 2.351 10.821 10.302 190 H ASP 30 H ASP 30 1.802 14.467 8.258 191 HA ASP 30 HA ASP 30 -0.740 15.894 8.330 192 HB2 ASP 30 2HB ASP 30 2.037 16.819 7.561 193 HB3 ASP 30 3HB ASP 30 0.617 17.855 7.634 194 H GLN 31 H GLN 31 0.774 13.917 6.229 195 HA GLN 31 HA GLN 31 -0.703 15.024 3.957 196 HB2 GLN 31 2HB GLN 31 1.673 15.789 3.815 197 HB3 GLN 31 3HB GLN 31 2.171 14.103 3.786 198 HG2 GLN 31 2HG GLN 31 2.192 15.019 1.563 199 HG3 GLN 31 3HG GLN 31 0.936 13.788 1.696 200 HE21 GLN 31 1HE2 GLN 31 -0.212 14.607 -0.010 201 HE22 GLN 31 2HE2 GLN 31 -1.106 16.083 0.069 202 H ASN 32 H ASN 32 -1.952 13.451 3.139 203 HA ASN 32 HA ASN 32 -1.324 10.711 3.927 204 HB2 ASN 32 2HB ASN 32 -3.595 11.743 4.458 205 HB3 ASN 32 3HB ASN 32 -3.926 11.646 2.735 206 HD21 ASN 32 1HD2 ASN 32 -5.643 10.238 3.198 207 HD22 ASN 32 2HD2 ASN 32 -5.344 8.572 3.578 208 H VAL 33 H VAL 33 -1.865 8.980 2.441 209 HA VAL 33 HA VAL 33 -0.828 9.528 -0.240 210 HB VAL 33 HB VAL 33 -1.176 6.937 1.287 211 HG11 VAL 33 1HG1 VAL 33 0.086 7.404 -1.403 212 HG12 VAL 33 2HG1 VAL 33 -1.429 6.557 -1.092 213 HG13 VAL 33 3HG1 VAL 33 0.095 5.886 -0.508 214 HG21 VAL 33 3HG2 VAL 33 1.317 8.484 0.586 215 HG22 VAL 33 1HG2 VAL 33 1.271 6.913 1.385 216 HG23 VAL 33 2HG2 VAL 33 0.600 8.333 2.190 217 H VAL 34 H VAL 34 -2.066 9.212 -2.050 218 HA VAL 34 HA VAL 34 -4.827 8.325 -1.570 219 HB VAL 34 HB VAL 34 -5.450 9.515 -3.669 220 HG11 VAL 34 1HG1 VAL 34 -4.202 11.212 -1.521 221 HG12 VAL 34 2HG1 VAL 34 -5.828 10.533 -1.501 222 HG13 VAL 34 3HG1 VAL 34 -5.394 11.757 -2.697 223 HG21 VAL 34 3HG2 VAL 34 -2.652 10.637 -3.484 224 HG22 VAL 34 1HG2 VAL 34 -3.915 11.204 -4.579 225 HG23 VAL 34 2HG2 VAL 34 -3.266 9.573 -4.751 226 H ALA 35 H ALA 35 -1.964 7.717 -3.466 227 HA ALA 35 HA ALA 35 -3.346 5.360 -4.521 228 HB1 ALA 35 3HB ALA 35 -1.661 7.125 -6.294 229 HB2 ALA 35 1HB ALA 35 -3.427 7.094 -6.291 230 HB3 ALA 35 2HB ALA 35 -2.514 5.657 -6.757 231 H ILE 36 H ILE 36 -2.092 3.588 -4.896 232 HA ILE 36 HA ILE 36 0.758 3.768 -4.356 233 HB ILE 36 HB ILE 36 -1.078 1.854 -2.870 234 HG12 ILE 36 2HG1 ILE 36 0.776 3.964 -1.751 235 HG13 ILE 36 3HG1 ILE 36 -0.959 4.184 -1.951 236 HG21 ILE 36 1HG2 ILE 36 0.977 0.749 -3.559 237 HG22 ILE 36 2HG2 ILE 36 0.963 1.000 -1.812 238 HG23 ILE 36 3HG2 ILE 36 1.932 2.050 -2.846 239 HD11 ILE 36 3HD1 ILE 36 -1.363 2.339 -0.401 240 HD12 ILE 36 1HD1 ILE 36 -0.398 3.612 0.343 241 HD13 ILE 36 2HD1 ILE 36 0.376 2.123 -0.204 242 H ASN 37 H ASN 37 1.647 2.815 -6.060 243 HA ASN 37 HA ASN 37 0.390 0.356 -7.055 244 HB2 ASN 37 2HB ASN 37 0.282 2.597 -8.507 245 HB3 ASN 37 3HB ASN 37 1.915 2.099 -8.938 246 HD21 ASN 37 1HD2 ASN 37 -0.821 0.050 -8.204 247 HD22 ASN 37 2HD2 ASN 37 -0.964 -0.661 -9.765 248 H VAL 38 H VAL 38 1.787 -1.269 -6.598 249 HA VAL 38 HA VAL 38 4.616 -0.815 -6.931 250 HB VAL 38 HB VAL 38 5.226 -1.604 -4.645 251 HG11 VAL 38 1HG1 VAL 38 5.395 0.748 -5.121 252 HG12 VAL 38 2HG1 VAL 38 4.791 0.532 -3.479 253 HG13 VAL 38 3HG1 VAL 38 3.682 0.979 -4.774 254 HG21 VAL 38 3HG2 VAL 38 3.594 -1.490 -2.843 255 HG22 VAL 38 1HG2 VAL 38 3.094 -2.662 -4.062 256 HG23 VAL 38 2HG2 VAL 38 2.332 -1.071 -4.002 257 H GLU 39 H GLU 39 5.834 -2.692 -7.020 258 HA GLU 39 HA GLU 39 4.450 -5.218 -6.605 259 HB2 GLU 39 2HB GLU 39 4.228 -4.636 -9.013 260 HB3 GLU 39 3HB GLU 39 5.977 -4.533 -9.126 261 HG2 GLU 39 2HG GLU 39 6.179 -6.888 -8.599 262 HG3 GLU 39 3HG GLU 39 4.433 -7.009 -8.398 263 H SER 40 H SER 40 5.855 -6.895 -6.073 264 HA SER 40 HA SER 40 8.242 -6.035 -4.777 265 HB2 SER 40 2HB SER 40 6.816 -7.835 -3.867 266 HB3 SER 40 3HB SER 40 7.254 -8.848 -5.244 267 HG SER 40 HG SER 40 9.126 -7.695 -3.458 268 H GLY 41 H GLY 41 10.330 -6.414 -5.261 269 HA2 GLY 41 2HA GLY 41 10.857 -7.138 -8.038 270 HA3 GLY 41 3HA GLY 41 11.979 -6.342 -6.942 271 H ASP 42 H ASP 42 11.231 -8.364 -4.817 272 HA ASP 42 HA ASP 42 12.487 -10.756 -5.905 273 HB2 ASP 42 2HB ASP 42 14.381 -9.370 -5.250 274 HB3 ASP 42 3HB ASP 42 13.711 -9.186 -3.634 275 H ASP 43 H ASP 43 10.327 -11.532 -5.438 276 HA ASP 43 HA ASP 43 8.848 -12.804 -4.274 277 HB2 ASP 43 2HB ASP 43 11.431 -13.541 -2.928 278 HB3 ASP 43 3HB ASP 43 9.915 -14.361 -2.576 279 H GLY 44 H GLY 44 9.157 -10.074 -3.161 280 HA2 GLY 44 2HA GLY 44 7.675 -9.190 -1.527 281 HA3 GLY 44 3HA GLY 44 7.849 -10.675 -0.602 282 H GLN 45 H GLN 45 10.875 -10.311 -1.221 283 HA GLN 45 HA GLN 45 11.493 -9.140 1.275 284 HB2 GLN 45 2HB GLN 45 12.914 -10.849 0.262 285 HB3 GLN 45 3HB GLN 45 13.301 -9.766 -1.067 286 HG2 GLN 45 2HG GLN 45 15.121 -9.865 0.524 287 HG3 GLN 45 3HG GLN 45 14.408 -8.252 0.482 288 HE21 GLN 45 1HE2 GLN 45 15.136 -7.716 2.497 289 HE22 GLN 45 2HE2 GLN 45 14.479 -8.387 3.953 290 H THR 46 H THR 46 11.601 -7.931 -2.026 291 HA THR 46 HA THR 46 11.955 -5.227 -0.911 292 HB THR 46 HB THR 46 13.052 -4.631 -3.094 293 HG1 THR 46 HG1 THR 46 13.991 -6.830 -3.964 294 HG21 THR 46 3HG2 THR 46 15.226 -5.647 -2.528 295 HG22 THR 46 1HG2 THR 46 14.409 -6.766 -1.435 296 HG23 THR 46 2HG2 THR 46 14.399 -5.035 -1.095 297 H LEU 47 H LEU 47 10.802 -3.541 -1.904 298 HA LEU 47 HA LEU 47 8.722 -4.338 -3.824 299 HB2 LEU 47 2HB LEU 47 8.345 -2.511 -1.447 300 HB3 LEU 47 3HB LEU 47 7.151 -2.806 -2.688 301 HG LEU 47 HG LEU 47 8.180 -4.856 -0.723 302 HD11 LEU 47 1HD1 LEU 47 5.546 -3.399 -0.878 303 HD12 LEU 47 2HD1 LEU 47 6.799 -3.163 0.341 304 HD13 LEU 47 3HD1 LEU 47 5.940 -4.701 0.243 305 HD21 LEU 47 3HD2 LEU 47 6.344 -6.244 -1.592 306 HD22 LEU 47 1HD2 LEU 47 7.550 -5.886 -2.826 307 HD23 LEU 47 2HD2 LEU 47 6.015 -5.017 -2.817 308 H ASN 48 H ASN 48 8.683 -3.033 -5.586 309 HA ASN 48 HA ASN 48 9.812 -0.332 -5.308 310 HB2 ASN 48 2HB ASN 48 10.202 -2.228 -7.643 311 HB3 ASN 48 3HB ASN 48 10.705 -0.551 -7.620 312 HD21 ASN 48 1HD2 ASN 48 11.617 -0.726 -4.815 313 HD22 ASN 48 2HD2 ASN 48 13.100 -1.624 -4.873 314 H GLY 49 H GLY 49 8.645 1.263 -6.361 315 HA2 GLY 49 2HA GLY 49 6.908 0.819 -8.503 316 HA3 GLY 49 3HA GLY 49 5.963 0.663 -7.034 317 H THR 50 H THR 50 4.727 2.423 -7.667 318 HA THR 50 HA THR 50 6.022 5.021 -7.269 319 HB THR 50 HB THR 50 3.877 4.390 -9.317 320 HG1 THR 50 HG1 THR 50 6.547 4.194 -9.406 321 HG21 THR 50 3HG2 THR 50 5.373 6.956 -8.751 322 HG22 THR 50 1HG2 THR 50 3.675 6.653 -8.382 323 HG23 THR 50 2HG2 THR 50 4.217 6.702 -10.060 324 H MET 51 H MET 51 5.004 6.284 -5.828 325 HA MET 51 HA MET 51 2.275 5.538 -4.997 326 HB2 MET 51 2HB MET 51 3.864 4.719 -3.332 327 HB3 MET 51 3HB MET 51 4.598 6.307 -3.219 328 HG2 MET 51 2HG MET 51 1.704 6.059 -2.611 329 HG3 MET 51 3HG MET 51 2.861 5.417 -1.443 330 HE1 MET 51 3HE MET 51 4.927 8.540 -0.447 331 HE2 MET 51 1HE MET 51 5.334 7.430 -1.755 332 HE3 MET 51 2HE MET 51 4.675 6.808 -0.242 333 H THR 52 H THR 52 0.896 7.263 -4.403 334 HA THR 52 HA THR 52 1.934 9.937 -5.099 335 HB THR 52 HB THR 52 -0.788 8.853 -5.845 336 HG1 THR 52 HG1 THR 52 1.466 8.297 -6.957 337 HG21 THR 52 3HG2 THR 52 -0.739 11.287 -5.502 338 HG22 THR 52 1HG2 THR 52 -0.956 10.885 -7.206 339 HG23 THR 52 2HG2 THR 52 0.621 11.415 -6.618 340 H TYR 53 H TYR 53 1.532 11.497 -3.664 341 HA TYR 53 HA TYR 53 -0.155 10.980 -1.359 342 HB2 TYR 53 2HB TYR 53 1.685 13.262 -2.070 343 HB3 TYR 53 3HB TYR 53 0.663 13.269 -0.642 344 HD1 TYR 53 HD2 TYR 53 0.998 11.352 1.035 345 HD2 TYR 53 HD1 TYR 53 3.810 12.317 -2.004 346 HE1 TYR 53 HE2 TYR 53 2.755 10.200 2.307 347 HE2 TYR 53 HE1 TYR 53 5.579 11.169 -0.736 348 HH TYR 53 HH TYR 53 4.961 9.077 1.776 349 H ALA 54 H ALA 54 -1.668 12.634 -0.603 350 HA ALA 54 HA ALA 54 -3.636 13.217 -2.527 351 HB1 ALA 54 3HB ALA 54 -3.338 14.372 0.244 352 HB2 ALA 54 1HB ALA 54 -4.120 12.842 -0.148 353 HB3 ALA 54 2HB ALA 54 -4.811 14.357 -0.728 354 H GLY 55 H GLY 55 -3.295 14.610 -4.124 355 HA2 GLY 55 2HA GLY 55 -3.344 16.764 -5.023 356 HA3 GLY 55 3HA GLY 55 -2.956 17.405 -3.438 357 H GLU 56 H GLU 56 -0.828 14.928 -4.318 358 HA GLU 56 HA GLU 56 1.062 16.891 -5.419 359 HB2 GLU 56 2HB GLU 56 1.654 14.713 -3.412 360 HB3 GLU 56 3HB GLU 56 2.902 15.573 -4.296 361 HG2 GLU 56 2HG GLU 56 2.098 17.691 -3.292 362 HG3 GLU 56 3HG GLU 56 0.935 16.765 -2.349 363 H GLY 57 H GLY 57 2.943 15.789 -6.553 364 HA2 GLY 57 2HA GLY 57 1.808 14.032 -8.535 365 HA3 GLY 57 3HA GLY 57 3.434 14.697 -8.539 366 HA PRO 58 HA PRO 58 3.124 10.091 -7.079 367 HB2 PRO 58 2HB PRO 58 4.014 8.926 -9.398 368 HB3 PRO 58 3HB PRO 58 2.306 9.114 -8.988 369 HG2 PRO 58 2HG PRO 58 4.029 10.823 -10.743 370 HG3 PRO 58 3HG PRO 58 2.372 10.250 -11.021 371 HD2 PRO 58 2HD PRO 58 2.859 12.742 -10.185 372 HD3 PRO 58 3HD PRO 58 1.454 11.829 -9.588 373 H ILE 59 H ILE 59 4.915 9.115 -6.256 374 HA ILE 59 HA ILE 59 7.545 10.014 -7.223 375 HB ILE 59 HB ILE 59 8.388 10.004 -4.918 376 HG12 ILE 59 2HG1 ILE 59 5.503 9.674 -4.071 377 HG13 ILE 59 3HG1 ILE 59 6.717 8.401 -4.002 378 HG21 ILE 59 1HG2 ILE 59 7.672 12.108 -5.861 379 HG22 ILE 59 2HG2 ILE 59 7.289 12.063 -4.139 380 HG23 ILE 59 3HG2 ILE 59 6.016 11.816 -5.333 381 HD11 ILE 59 3HD1 ILE 59 6.398 9.418 -1.829 382 HD12 ILE 59 1HD1 ILE 59 6.792 11.001 -2.495 383 HD13 ILE 59 2HD1 ILE 59 8.021 9.739 -2.436 384 H GLY 60 H GLY 60 9.325 8.554 -6.379 385 HA2 GLY 60 2HA GLY 60 8.620 5.841 -7.087 386 HA3 GLY 60 3HA GLY 60 10.235 6.443 -6.733 387 H PHE 61 H PHE 61 8.549 4.092 -5.805 388 HA PHE 61 HA PHE 61 8.811 4.538 -2.898 389 HB2 PHE 61 2HB PHE 61 6.483 4.252 -3.584 390 HB3 PHE 61 3HB PHE 61 6.885 2.769 -4.430 391 HD1 PHE 61 HD2 PHE 61 7.329 0.712 -3.192 392 HD2 PHE 61 HD1 PHE 61 6.226 4.306 -1.196 393 HE1 PHE 61 HE2 PHE 61 6.800 -0.581 -1.173 394 HE2 PHE 61 HE1 PHE 61 5.691 3.013 0.828 395 HZ PHE 61 HZ PHE 61 5.977 0.570 0.840 396 H ARG 62 H ARG 62 10.435 3.356 -1.970 397 HA ARG 62 HA ARG 62 11.030 0.695 -3.080 398 HB2 ARG 62 2HB ARG 62 12.862 2.224 -3.569 399 HB3 ARG 62 3HB ARG 62 12.913 2.751 -1.889 400 HG2 ARG 62 2HG ARG 62 13.478 0.352 -1.302 401 HG3 ARG 62 3HG ARG 62 13.699 0.081 -3.030 402 HD2 ARG 62 2HD ARG 62 15.179 2.109 -1.354 403 HD3 ARG 62 3HD ARG 62 15.823 0.561 -1.893 404 HE ARG 62 HE ARG 62 15.430 2.962 -3.469 405 HH11 ARG 62 1HH1 ARG 62 16.212 -0.453 -3.442 406 HH12 ARG 62 2HH1 ARG 62 16.977 -0.439 -4.984 407 HH21 ARG 62 1HH2 ARG 62 16.467 2.995 -5.540 408 HH22 ARG 62 2HH2 ARG 62 17.110 1.532 -6.195 409 H ALA 63 H ALA 63 10.747 -0.899 -1.583 410 HA ALA 63 HA ALA 63 11.064 -0.163 1.244 411 HB1 ALA 63 3HB ALA 63 9.053 -1.115 1.915 412 HB2 ALA 63 1HB ALA 63 8.853 -1.999 0.400 413 HB3 ALA 63 2HB ALA 63 8.638 -0.252 0.438 414 H THR 64 H THR 64 11.942 -1.672 2.579 415 HA THR 64 HA THR 64 12.727 -4.245 1.367 416 HB THR 64 HB THR 64 14.188 -2.666 3.507 417 HG1 THR 64 HG1 THR 64 15.564 -2.050 1.892 418 HG21 THR 64 3HG2 THR 64 14.974 -5.161 1.990 419 HG22 THR 64 1HG2 THR 64 14.532 -5.086 3.694 420 HG23 THR 64 2HG2 THR 64 15.999 -4.290 3.131 421 H LEU 65 H LEU 65 11.974 -6.018 2.356 422 HA LEU 65 HA LEU 65 10.222 -5.845 4.581 423 HB2 LEU 65 2HB LEU 65 9.972 -7.388 2.664 424 HB3 LEU 65 3HB LEU 65 11.392 -8.256 3.188 425 HG LEU 65 HG LEU 65 9.012 -9.197 3.656 426 HD11 LEU 65 1HD1 LEU 65 9.824 -10.313 5.661 427 HD12 LEU 65 2HD1 LEU 65 11.151 -9.155 5.761 428 HD13 LEU 65 3HD1 LEU 65 11.041 -10.255 4.386 429 HD21 LEU 65 3HD2 LEU 65 8.115 -7.201 4.739 430 HD22 LEU 65 1HD2 LEU 65 9.338 -7.329 6.002 431 HD23 LEU 65 2HD2 LEU 65 8.106 -8.580 5.839 432 H LEU 66 H LEU 66 10.742 -5.739 6.617 433 HA LEU 66 HA LEU 66 13.301 -6.257 7.731 434 HB2 LEU 66 2HB LEU 66 10.609 -5.659 8.891 435 HB3 LEU 66 3HB LEU 66 11.898 -6.186 9.947 436 HG LEU 66 HG LEU 66 11.663 -3.759 9.955 437 HD11 LEU 66 1HD1 LEU 66 13.852 -4.721 10.365 438 HD12 LEU 66 2HD1 LEU 66 13.982 -3.168 9.542 439 HD13 LEU 66 3HD1 LEU 66 14.211 -4.664 8.639 440 HD21 LEU 66 3HD2 LEU 66 10.811 -3.440 7.693 441 HD22 LEU 66 1HD2 LEU 66 12.379 -3.901 7.030 442 HD23 LEU 66 2HD2 LEU 66 12.225 -2.428 7.991 443 H GLY 67 H GLY 67 10.392 -8.196 7.498 444 HA2 GLY 67 2HA GLY 67 10.825 -10.652 7.554 445 HA3 GLY 67 3HA GLY 67 11.774 -10.342 8.999 446 H ASN 68 H ASN 68 9.373 -8.282 9.307 447 HA ASN 68 HA ASN 68 7.542 -10.202 10.605 448 HB2 ASN 68 2HB ASN 68 7.228 -8.642 12.472 449 HB3 ASN 68 3HB ASN 68 8.921 -9.090 12.324 450 HD21 ASN 68 1HD2 ASN 68 7.712 -6.774 13.588 451 HD22 ASN 68 2HD2 ASN 68 8.406 -5.389 12.822 452 H ASN 69 H ASN 69 7.236 -9.193 8.031 453 HA ASN 69 HA ASN 69 5.713 -8.311 6.622 454 HB2 ASN 69 2HB ASN 69 4.045 -8.112 9.138 455 HB3 ASN 69 3HB ASN 69 3.433 -7.682 7.547 456 HD21 ASN 69 1HD2 ASN 69 2.456 -9.730 9.298 457 HD22 ASN 69 2HD2 ASN 69 2.629 -11.232 8.454 458 H SER 70 H SER 70 7.414 -6.557 8.671 459 HA SER 70 HA SER 70 6.239 -3.988 7.938 460 HB2 SER 70 2HB SER 70 8.554 -4.604 9.788 461 HB3 SER 70 3HB SER 70 7.799 -3.026 9.553 462 HG SER 70 HG SER 70 6.287 -5.269 10.385 463 H TYR 71 H TYR 71 7.241 -2.606 6.582 464 HA TYR 71 HA TYR 71 9.717 -3.541 5.289 465 HB2 TYR 71 2HB TYR 71 7.368 -2.075 4.077 466 HB3 TYR 71 3HB TYR 71 8.892 -2.373 3.264 467 HD1 TYR 71 HD1 TYR 71 5.849 -3.978 4.598 468 HD2 TYR 71 HD2 TYR 71 9.366 -4.467 2.264 469 HE1 TYR 71 HE1 TYR 71 4.971 -6.105 3.722 470 HE2 TYR 71 HE2 TYR 71 8.498 -6.587 1.387 471 HH TYR 71 HH TYR 71 5.472 -7.476 1.403 472 H GLU 72 H GLU 72 11.343 -2.097 5.187 473 HA GLU 72 HA GLU 72 10.861 0.553 6.284 474 HB2 GLU 72 2HB GLU 72 12.867 -0.790 6.965 475 HB3 GLU 72 3HB GLU 72 13.469 -0.651 5.321 476 HG2 GLU 72 2HG GLU 72 13.693 1.719 5.538 477 HG3 GLU 72 3HG GLU 72 12.886 1.694 7.106 478 H VAL 73 H VAL 73 10.478 2.255 5.052 479 HA VAL 73 HA VAL 73 10.607 1.854 2.154 480 HB VAL 73 HB VAL 73 8.769 3.538 3.849 481 HG11 VAL 73 1HG1 VAL 73 9.253 4.741 1.796 482 HG12 VAL 73 2HG1 VAL 73 7.599 4.128 1.782 483 HG13 VAL 73 3HG1 VAL 73 8.848 3.311 0.844 484 HG21 VAL 73 3HG2 VAL 73 8.269 1.157 3.864 485 HG22 VAL 73 1HG2 VAL 73 8.255 1.141 2.101 486 HG23 VAL 73 2HG2 VAL 73 7.033 2.055 2.983 487 H GLU 74 H GLU 74 11.516 3.210 0.837 488 HA GLU 74 HA GLU 74 12.648 5.745 1.799 489 HB2 GLU 74 2HB GLU 74 13.723 3.807 -0.265 490 HB3 GLU 74 3HB GLU 74 14.356 5.427 -0.015 491 HG2 GLU 74 2HG GLU 74 15.008 4.850 2.242 492 HG3 GLU 74 3HG GLU 74 14.304 3.245 2.056 493 H ASN 75 H ASN 75 12.357 7.513 0.372 494 HA ASN 75 HA ASN 75 10.346 7.025 -1.727 495 HB2 ASN 75 2HB ASN 75 10.538 9.307 0.235 496 HB3 ASN 75 3HB ASN 75 9.509 9.347 -1.187 497 HD21 ASN 75 1HD2 ASN 75 8.841 9.473 1.652 498 HD22 ASN 75 2HD2 ASN 75 7.735 8.174 1.928 499 H GLN 76 H GLN 76 10.725 7.878 -3.720 500 HA GLN 76 HA GLN 76 13.115 9.542 -4.082 501 HB2 GLN 76 2HB GLN 76 13.268 7.486 -5.245 502 HB3 GLN 76 3HB GLN 76 11.607 7.581 -5.791 503 HG2 GLN 76 2HG GLN 76 12.370 9.646 -7.112 504 HG3 GLN 76 3HG GLN 76 14.006 9.053 -6.804 505 HE21 GLN 76 1HE2 GLN 76 14.678 7.157 -7.762 506 HE22 GLN 76 2HE2 GLN 76 13.806 6.388 -9.043 507 H TRP 77 H TRP 77 12.658 11.682 -4.458 508 HA TRP 77 HA TRP 77 10.472 12.258 -6.301 509 HB2 TRP 77 2HB TRP 77 9.781 14.232 -4.935 510 HB3 TRP 77 3HB TRP 77 9.459 12.690 -4.158 511 HD1 TRP 77 HD1 TRP 77 12.158 15.479 -4.013 512 HE1 TRP 77 HE1 TRP 77 12.956 15.691 -1.580 513 HE3 TRP 77 HE3 TRP 77 9.454 11.669 -1.947 514 HZ2 TRP 77 HZ2 TRP 77 12.492 14.420 0.892 515 HZ3 TRP 77 HZ3 TRP 77 9.686 11.239 0.467 516 HH2 TRP 77 HH2 TRP 77 11.171 12.584 1.853 517 H GLY 78 H GLY 78 10.628 14.315 -7.381 518 HA2 GLY 78 2HA GLY 78 11.853 16.339 -7.845 519 HA3 GLY 78 3HA GLY 78 13.305 15.535 -7.261 520 H GLY 79 H GLY 79 11.811 13.229 -8.939 521 HA2 GLY 79 2HA GLY 79 11.687 13.363 -11.513 522 HA3 GLY 79 3HA GLY 79 13.389 13.783 -11.349 523 H ASP 80 H ASP 80 12.816 11.537 -12.823 524 HA ASP 80 HA ASP 80 12.777 9.210 -11.241 525 HB2 ASP 80 2HB ASP 80 13.217 7.982 -13.224 526 HB3 ASP 80 3HB ASP 80 12.239 9.353 -13.729 527 H SER 81 H SER 81 14.471 7.694 -10.945 528 HA SER 81 HA SER 81 16.490 7.032 -10.212 529 HB2 SER 81 2HB SER 81 17.666 9.459 -11.607 530 HB3 SER 81 3HB SER 81 18.530 8.009 -11.093 531 HG SER 81 HG SER 81 16.486 8.149 -13.082 532 H ALA 82 H ALA 82 17.634 10.349 -10.089 533 HA ALA 82 HA ALA 82 18.150 11.745 -8.361 534 HB1 ALA 82 3HB ALA 82 15.440 10.780 -7.445 535 HB2 ALA 82 1HB ALA 82 15.753 12.114 -8.552 536 HB3 ALA 82 2HB ALA 82 16.237 12.235 -6.862 537 HA PRO 83 HA PRO 83 19.605 9.610 -4.646 538 HB2 PRO 83 2HB PRO 83 19.325 11.467 -2.694 539 HB3 PRO 83 3HB PRO 83 20.572 11.608 -3.940 540 HG2 PRO 83 2HG PRO 83 17.882 12.925 -3.808 541 HG3 PRO 83 3HG PRO 83 19.459 13.645 -4.193 542 HD2 PRO 83 2HD PRO 83 17.726 12.958 -6.118 543 HD3 PRO 83 3HD PRO 83 19.474 12.788 -6.340 544 H TRP 84 H TRP 84 18.722 8.473 -2.835 545 HA TRP 84 HA TRP 84 15.807 8.562 -2.765 546 HB2 TRP 84 2HB TRP 84 17.798 6.461 -1.914 547 HB3 TRP 84 3HB TRP 84 16.097 6.380 -1.463 548 HD1 TRP 84 HD1 TRP 84 18.394 6.115 -4.514 549 HE1 TRP 84 HE1 TRP 84 17.095 4.982 -6.429 550 HE3 TRP 84 HE3 TRP 84 13.760 5.964 -2.365 551 HZ2 TRP 84 HZ2 TRP 84 14.451 4.141 -6.953 552 HZ3 TRP 84 HZ3 TRP 84 11.900 4.982 -3.638 553 HH2 TRP 84 HH2 TRP 84 12.238 4.089 -5.884 554 H HIS 85 H HIS 85 14.656 9.002 -0.916 555 HA HIS 85 HA HIS 85 16.286 10.016 1.303 556 HB2 HIS 85 2HB HIS 85 13.523 10.862 0.363 557 HB3 HIS 85 3HB HIS 85 14.378 11.538 1.744 558 HD1 HIS 85 HD1 HIS 85 16.274 13.249 1.239 559 HD2 HIS 85 HD2 HIS 85 14.415 11.728 -2.157 560 HE1 HIS 85 HE1 HIS 85 17.019 14.715 -0.655 561 H SER 86 H SER 86 15.759 9.298 3.367 562 HA SER 86 HA SER 86 14.373 6.849 3.577 563 HB2 SER 86 2HB SER 86 14.624 7.315 6.076 564 HB3 SER 86 3HB SER 86 16.121 7.277 5.140 565 HG SER 86 HG SER 86 14.689 9.558 6.037 566 H GLY 87 H GLY 87 12.239 6.404 3.984 567 HA2 GLY 87 2HA GLY 87 10.517 8.744 4.385 568 HA3 GLY 87 3HA GLY 87 10.023 7.222 3.664 569 H GLY 88 H GLY 88 10.803 5.345 5.472 570 HA2 GLY 88 2HA GLY 88 10.520 5.582 8.122 571 HA3 GLY 88 3HA GLY 88 8.872 5.891 7.597 572 H ASN 89 H ASN 89 8.498 3.937 8.976 573 HA ASN 89 HA ASN 89 9.062 1.474 7.455 574 HB2 ASN 89 2HB ASN 89 10.029 1.611 9.772 575 HB3 ASN 89 3HB ASN 89 8.384 1.688 10.394 576 HD21 ASN 89 1HD2 ASN 89 10.841 -0.306 9.064 577 HD22 ASN 89 2HD2 ASN 89 10.027 -1.818 9.270 578 H TRP 90 H TRP 90 7.369 0.620 6.442 579 HA TRP 90 HA TRP 90 4.649 1.263 7.396 580 HB2 TRP 90 2HB TRP 90 5.613 0.434 4.640 581 HB3 TRP 90 3HB TRP 90 3.928 0.658 5.078 582 HD1 TRP 90 HD1 TRP 90 6.304 3.269 6.438 583 HE1 TRP 90 HE1 TRP 90 6.006 5.464 5.149 584 HE3 TRP 90 HE3 TRP 90 3.301 1.568 2.668 585 HZ2 TRP 90 HZ2 TRP 90 4.661 6.363 2.819 586 HZ3 TRP 90 HZ3 TRP 90 2.553 3.160 0.949 587 HH2 TRP 90 HH2 TRP 90 3.220 5.507 1.025 588 H ILE 91 H ILE 91 3.137 -0.452 7.538 589 HA ILE 91 HA ILE 91 4.405 -3.115 7.626 590 HB ILE 91 HB ILE 91 1.927 -2.155 9.086 591 HG12 ILE 91 2HG1 ILE 91 4.642 -2.927 10.185 592 HG13 ILE 91 3HG1 ILE 91 4.108 -1.268 9.937 593 HG21 ILE 91 1HG2 ILE 91 1.754 -4.515 8.491 594 HG22 ILE 91 2HG2 ILE 91 1.991 -4.328 10.228 595 HG23 ILE 91 3HG2 ILE 91 3.338 -4.826 9.205 596 HD11 ILE 91 3HD1 ILE 91 2.300 -1.621 11.544 597 HD12 ILE 91 1HD1 ILE 91 3.884 -1.923 12.258 598 HD13 ILE 91 2HD1 ILE 91 2.852 -3.276 11.797 599 H LEU 92 H LEU 92 3.870 -4.484 6.076 600 HA LEU 92 HA LEU 92 1.225 -4.279 4.808 601 HB2 LEU 92 2HB LEU 92 3.832 -4.483 3.299 602 HB3 LEU 92 3HB LEU 92 2.244 -4.621 2.578 603 HG LEU 92 HG LEU 92 3.315 -2.145 3.939 604 HD11 LEU 92 1HD1 LEU 92 3.452 -1.217 1.680 605 HD12 LEU 92 2HD1 LEU 92 2.984 -2.780 1.012 606 HD13 LEU 92 3HD1 LEU 92 4.511 -2.612 1.877 607 HD21 LEU 92 3HD2 LEU 92 0.890 -2.303 4.077 608 HD22 LEU 92 1HD2 LEU 92 0.795 -2.612 2.343 609 HD23 LEU 92 2HD2 LEU 92 1.361 -1.049 2.931 610 H GLY 93 H GLY 93 0.799 -6.100 6.165 611 HA2 GLY 93 2HA GLY 93 0.716 -8.513 4.868 612 HA3 GLY 93 3HA GLY 93 2.172 -8.573 5.854 613 H SER 94 H SER 94 -0.825 -9.587 5.829 614 HA SER 94 HA SER 94 -1.139 -9.302 8.746 615 HB2 SER 94 2HB SER 94 -3.602 -9.697 8.375 616 HB3 SER 94 3HB SER 94 -2.994 -8.167 7.747 617 HG SER 94 HG SER 94 -4.366 -9.254 6.276 618 H ARG 95 H ARG 95 -0.086 -11.327 6.538 619 HA ARG 95 HA ARG 95 -1.285 -13.702 7.741 620 HB2 ARG 95 2HB ARG 95 0.256 -13.346 5.172 621 HB3 ARG 95 3HB ARG 95 -0.166 -14.927 5.824 622 HG2 ARG 95 2HG ARG 95 -2.528 -14.361 5.702 623 HG3 ARG 95 3HG ARG 95 -2.128 -12.763 5.083 624 HD2 ARG 95 2HD ARG 95 -1.110 -13.801 3.099 625 HD3 ARG 95 3HD ARG 95 -1.549 -15.396 3.724 626 HE ARG 95 HE ARG 95 -3.517 -13.317 3.022 627 HH11 ARG 95 1HH1 ARG 95 -2.491 -16.681 2.896 628 HH12 ARG 95 2HH1 ARG 95 -4.049 -17.250 2.392 629 HH21 ARG 95 1HH2 ARG 95 -5.550 -14.092 2.322 630 HH22 ARG 95 2HH2 ARG 95 -5.774 -15.785 2.050 631 H GLU 96 H GLU 96 -0.083 -15.267 8.656 632 HA GLU 96 HA GLU 96 2.068 -14.418 10.223 633 HB2 GLU 96 2HB GLU 96 2.161 -16.792 10.931 634 HB3 GLU 96 3HB GLU 96 0.544 -16.102 10.988 635 HG2 GLU 96 2HG GLU 96 0.102 -17.157 8.765 636 HG3 GLU 96 3HG GLU 96 1.658 -17.971 8.908 637 H ASN 97 H ASN 97 2.011 -16.295 7.238 638 HA ASN 97 HA ASN 97 4.960 -16.304 7.252 639 HB2 ASN 97 2HB ASN 97 4.922 -18.491 6.178 640 HB3 ASN 97 3HB ASN 97 4.052 -18.557 7.706 641 HD21 ASN 97 1HD2 ASN 97 3.863 -20.249 5.312 642 HD22 ASN 97 2HD2 ASN 97 2.209 -20.189 4.814 643 H GLN 98 H GLN 98 3.152 -14.359 5.962 644 HA GLN 98 HA GLN 98 4.056 -14.770 3.236 645 HB2 GLN 98 2HB GLN 98 1.657 -15.774 3.666 646 HB3 GLN 98 3HB GLN 98 1.169 -14.095 3.466 647 HG2 GLN 98 2HG GLN 98 0.977 -15.132 1.353 648 HG3 GLN 98 3HG GLN 98 2.396 -14.086 1.296 649 HE21 GLN 98 1HE2 GLN 98 3.343 -15.246 -0.375 650 HE22 GLN 98 2HE2 GLN 98 4.024 -16.817 -0.135 651 H ASN 99 H ASN 99 4.768 -12.964 2.419 652 HA ASN 99 HA ASN 99 4.153 -10.410 3.714 653 HB2 ASN 99 2HB ASN 99 6.293 -11.207 1.720 654 HB3 ASN 99 3HB ASN 99 6.120 -9.598 2.413 655 HD21 ASN 99 1HD2 ASN 99 8.315 -11.567 2.540 656 HD22 ASN 99 2HD2 ASN 99 8.615 -11.813 4.224 657 H VAL 100 H VAL 100 3.662 -8.535 2.444 658 HA VAL 100 HA VAL 100 1.925 -9.136 0.167 659 HB VAL 100 HB VAL 100 2.560 -6.469 1.463 660 HG11 VAL 100 1HG1 VAL 100 0.614 -7.087 -0.765 661 HG12 VAL 100 2HG1 VAL 100 2.085 -6.125 -0.907 662 HG13 VAL 100 3HG1 VAL 100 0.746 -5.543 0.082 663 HG21 VAL 100 3HG2 VAL 100 0.235 -6.603 2.228 664 HG22 VAL 100 1HG2 VAL 100 1.191 -7.965 2.809 665 HG23 VAL 100 2HG2 VAL 100 0.080 -8.185 1.459 666 H VAL 101 H VAL 101 2.238 -8.643 -1.932 667 HA VAL 101 HA VAL 101 4.947 -7.677 -2.644 668 HB VAL 101 HB VAL 101 5.181 -9.202 -4.522 669 HG11 VAL 101 1HG1 VAL 101 5.715 -11.169 -3.283 670 HG12 VAL 101 2HG1 VAL 101 4.604 -10.709 -1.991 671 HG13 VAL 101 3HG1 VAL 101 6.054 -9.756 -2.286 672 HG21 VAL 101 3HG2 VAL 101 2.840 -9.591 -5.045 673 HG22 VAL 101 1HG2 VAL 101 2.633 -10.474 -3.532 674 HG23 VAL 101 2HG2 VAL 101 3.684 -11.119 -4.794 675 H ALA 102 H ALA 102 1.612 -7.882 -3.755 676 HA ALA 102 HA ALA 102 2.318 -5.741 -5.647 677 HB1 ALA 102 3HB ALA 102 1.918 -7.873 -6.839 678 HB2 ALA 102 1HB ALA 102 0.771 -6.605 -7.276 679 HB3 ALA 102 2HB ALA 102 0.281 -7.893 -6.182 680 H ILE 103 H ILE 103 1.230 -3.949 -5.409 681 HA ILE 103 HA ILE 103 -1.438 -4.064 -4.189 682 HB ILE 103 HB ILE 103 0.707 -2.025 -3.545 683 HG12 ILE 103 2HG1 ILE 103 -0.695 -3.981 -1.712 684 HG13 ILE 103 3HG1 ILE 103 0.909 -4.237 -2.394 685 HG21 ILE 103 1HG2 ILE 103 -1.486 -0.978 -3.713 686 HG22 ILE 103 2HG2 ILE 103 -0.933 -1.019 -2.039 687 HG23 ILE 103 3HG2 ILE 103 -2.150 -2.169 -2.594 688 HD11 ILE 103 3HD1 ILE 103 0.108 -1.998 -0.549 689 HD12 ILE 103 1HD1 ILE 103 1.714 -2.243 -1.233 690 HD13 ILE 103 2HD1 ILE 103 1.045 -3.427 -0.113 691 H ASN 104 H ASN 104 -2.870 -3.253 -5.525 692 HA ASN 104 HA ASN 104 -2.098 -0.990 -7.237 693 HB2 ASN 104 2HB ASN 104 -2.457 -3.114 -8.522 694 HB3 ASN 104 3HB ASN 104 -4.107 -3.159 -7.914 695 HD21 ASN 104 1HD2 ASN 104 -5.611 -1.714 -8.713 696 HD22 ASN 104 2HD2 ASN 104 -5.335 -0.791 -10.150 697 H VAL 105 H VAL 105 -2.892 0.591 -6.049 698 HA VAL 105 HA VAL 105 -5.779 0.596 -5.509 699 HB VAL 105 HB VAL 105 -5.557 1.446 -3.202 700 HG11 VAL 105 1HG1 VAL 105 -4.912 -0.694 -2.143 701 HG12 VAL 105 2HG1 VAL 105 -4.329 -1.253 -3.711 702 HG13 VAL 105 3HG1 VAL 105 -6.037 -0.881 -3.487 703 HG21 VAL 105 3HG2 VAL 105 -3.314 2.365 -3.320 704 HG22 VAL 105 1HG2 VAL 105 -2.646 0.746 -3.522 705 HG23 VAL 105 2HG2 VAL 105 -3.430 1.191 -2.007 706 H GLU 106 H GLU 106 -6.798 2.502 -5.529 707 HA GLU 106 HA GLU 106 -5.251 4.958 -5.479 708 HB2 GLU 106 2HB GLU 106 -5.401 4.277 -7.878 709 HB3 GLU 106 3HB GLU 106 -7.153 4.319 -7.745 710 HG2 GLU 106 2HG GLU 106 -7.086 6.694 -7.259 711 HG3 GLU 106 3HG GLU 106 -5.326 6.671 -7.313 712 H SER 107 H SER 107 -6.482 6.738 -4.863 713 HA SER 107 HA SER 107 -9.266 6.207 -4.116 714 HB2 SER 107 2HB SER 107 -7.915 5.764 -2.130 715 HB3 SER 107 3HB SER 107 -7.150 7.345 -2.273 716 HG SER 107 HG SER 107 -9.593 6.638 -1.254 717 H GLY 108 H GLY 108 -10.589 7.952 -4.253 718 HA2 GLY 108 2HA GLY 108 -9.358 10.473 -5.155 719 HA3 GLY 108 3HA GLY 108 -11.007 9.968 -5.514 720 H ASP 109 H ASP 109 -10.645 9.012 -2.471 721 HA ASP 109 HA ASP 109 -11.918 11.442 -1.477 722 HB2 ASP 109 2HB ASP 109 -12.023 8.596 -0.519 723 HB3 ASP 109 3HB ASP 109 -12.616 9.929 0.462 724 H ASP 110 H ASP 110 -9.390 11.967 -1.635 725 HA ASP 110 HA ASP 110 -7.654 12.874 -0.483 726 HB2 ASP 110 2HB ASP 110 -9.623 13.837 0.776 727 HB3 ASP 110 3HB ASP 110 -9.384 12.574 1.979 728 H GLY 111 H GLY 111 -8.170 9.802 -0.442 729 HA2 GLY 111 2HA GLY 111 -6.559 8.151 0.004 730 HA3 GLY 111 3HA GLY 111 -5.771 9.267 1.091 731 H GLN 112 H GLN 112 -8.888 9.465 1.985 732 HA GLN 112 HA GLN 112 -8.414 8.096 4.403 733 HB2 GLN 112 2HB GLN 112 -10.979 9.170 3.244 734 HB3 GLN 112 3HB GLN 112 -10.842 8.509 4.868 735 HG2 GLN 112 2HG GLN 112 -9.181 10.218 5.415 736 HG3 GLN 112 3HG GLN 112 -9.347 10.888 3.794 737 HE21 GLN 112 1HE2 GLN 112 -9.845 12.038 6.448 738 HE22 GLN 112 2HE2 GLN 112 -11.473 12.613 6.406 739 H THR 113 H THR 113 -10.254 7.165 1.508 740 HA THR 113 HA THR 113 -10.332 4.465 2.623 741 HB THR 113 HB THR 113 -12.391 4.127 1.199 742 HG1 THR 113 HG1 THR 113 -12.178 5.922 -0.172 743 HG21 THR 113 3HG2 THR 113 -12.583 6.232 3.360 744 HG22 THR 113 1HG2 THR 113 -12.549 4.488 3.620 745 HG23 THR 113 2HG2 THR 113 -13.912 5.229 2.778 746 H LEU 114 H LEU 114 -8.916 3.263 1.568 747 HA LEU 114 HA LEU 114 -8.116 3.965 -1.154 748 HB2 LEU 114 2HB LEU 114 -7.038 1.873 0.739 749 HB3 LEU 114 3HB LEU 114 -6.357 2.267 -0.826 750 HG LEU 114 HG LEU 114 -6.488 4.137 1.544 751 HD11 LEU 114 1HD1 LEU 114 -4.064 3.838 1.631 752 HD12 LEU 114 2HD1 LEU 114 -4.164 2.642 0.338 753 HD13 LEU 114 3HD1 LEU 114 -4.918 2.319 1.900 754 HD21 LEU 114 3HD2 LEU 114 -6.594 5.364 -0.547 755 HD22 LEU 114 1HD2 LEU 114 -5.216 4.455 -1.174 756 HD23 LEU 114 2HD2 LEU 114 -4.999 5.557 0.182 757 H ASN 115 H ASN 115 -8.823 2.928 -2.894 758 HA ASN 115 HA ASN 115 -10.248 0.372 -2.516 759 HB2 ASN 115 2HB ASN 115 -10.771 2.406 -4.698 760 HB3 ASN 115 3HB ASN 115 -11.742 0.996 -4.301 761 HD21 ASN 115 1HD2 ASN 115 -13.057 1.056 -2.454 762 HD22 ASN 115 2HD2 ASN 115 -13.494 2.553 -1.705 763 H GLY 116 H GLY 116 -9.438 -1.342 -3.659 764 HA2 GLY 116 2HA GLY 116 -8.535 -1.231 -6.278 765 HA3 GLY 116 3HA GLY 116 -7.122 -1.007 -5.267 766 H THR 117 H THR 117 -6.081 -2.827 -5.600 767 HA THR 117 HA THR 117 -7.306 -5.342 -4.731 768 HB THR 117 HB THR 117 -6.056 -6.491 -6.650 769 HG1 THR 117 HG1 THR 117 -6.331 -4.063 -8.043 770 HG21 THR 117 3HG2 THR 117 -8.417 -4.716 -7.306 771 HG22 THR 117 1HG2 THR 117 -8.493 -6.334 -6.609 772 HG23 THR 117 2HG2 THR 117 -7.893 -6.109 -8.253 773 H MET 118 H MET 118 -5.690 -7.018 -4.228 774 HA MET 118 HA MET 118 -2.959 -6.085 -3.854 775 HB2 MET 118 2HB MET 118 -2.892 -6.621 -1.488 776 HB3 MET 118 3HB MET 118 -4.090 -5.374 -1.796 777 HG2 MET 118 2HG MET 118 -5.879 -6.823 -1.420 778 HG3 MET 118 3HG MET 118 -4.871 -8.256 -1.624 779 HE1 MET 118 3HE MET 118 -2.853 -8.441 1.630 780 HE2 MET 118 1HE MET 118 -2.340 -7.723 0.104 781 HE3 MET 118 2HE MET 118 -3.278 -9.213 0.104 782 H THR 119 H THR 119 -1.462 -7.758 -3.545 783 HA THR 119 HA THR 119 -2.490 -10.495 -3.507 784 HB THR 119 HB THR 119 -0.433 -9.603 -5.545 785 HG1 THR 119 HG1 THR 119 -3.156 -9.468 -5.597 786 HG21 THR 119 3HG2 THR 119 -0.817 -11.828 -6.510 787 HG22 THR 119 1HG2 THR 119 -1.954 -12.197 -5.212 788 HG23 THR 119 2HG2 THR 119 -0.246 -11.951 -4.844 789 H TYR 120 H TYR 120 -1.265 -11.860 -2.308 790 HA TYR 120 HA TYR 120 1.111 -10.838 -1.013 791 HB2 TYR 120 2HB TYR 120 -0.559 -13.304 -0.675 792 HB3 TYR 120 3HB TYR 120 1.064 -13.246 0.001 793 HD1 TYR 120 HD2 TYR 120 1.598 -11.722 1.804 794 HD2 TYR 120 HD1 TYR 120 -2.360 -11.975 0.284 795 HE1 TYR 120 HE2 TYR 120 0.776 -10.549 3.789 796 HE2 TYR 120 HE1 TYR 120 -3.198 -10.793 2.279 797 HH TYR 120 HH TYR 120 -2.557 -10.287 4.553 798 H ALA 121 H ALA 121 2.940 -12.571 -0.760 799 HA ALA 121 HA ALA 121 4.356 -12.574 -3.115 800 HB1 ALA 121 3HB ALA 121 5.335 -12.861 -0.874 801 HB2 ALA 121 1HB ALA 121 5.978 -13.995 -2.061 802 HB3 ALA 121 2HB ALA 121 4.791 -14.538 -0.878 803 H GLY 122 H GLY 122 2.072 -15.051 -2.137 804 HA2 GLY 122 2HA GLY 122 2.186 -16.148 -4.775 805 HA3 GLY 122 3HA GLY 122 2.912 -17.216 -3.586 806 H GLU 123 H GLU 123 0.222 -15.139 -2.772 807 HA GLU 123 HA GLU 123 -1.784 -17.089 -3.243 808 HB2 GLU 123 2HB GLU 123 -2.304 -17.637 -0.885 809 HB3 GLU 123 3HB GLU 123 -0.744 -18.259 -1.399 810 HG2 GLU 123 2HG GLU 123 0.366 -16.384 -0.268 811 HG3 GLU 123 3HG GLU 123 -1.204 -15.792 0.271 812 H GLY 124 H GLY 124 -3.811 -16.305 -2.993 813 HA2 GLY 124 2HA GLY 124 -5.538 -14.947 -2.363 814 HA3 GLY 124 3HA GLY 124 -4.474 -14.220 -1.182 815 HA PRO 125 HA PRO 125 -4.346 -11.294 -4.932 816 HB2 PRO 125 2HB PRO 125 -5.688 -12.441 -7.221 817 HB3 PRO 125 3HB PRO 125 -3.976 -12.038 -7.074 818 HG2 PRO 125 2HG PRO 125 -4.930 -14.611 -7.291 819 HG3 PRO 125 3HG PRO 125 -3.388 -14.185 -6.534 820 HD2 PRO 125 2HD PRO 125 -6.032 -14.779 -5.244 821 HD3 PRO 125 3HD PRO 125 -4.398 -15.292 -4.757 822 H ILE 126 H ILE 126 -5.914 -10.205 -3.710 823 HA ILE 126 HA ILE 126 -8.723 -10.738 -4.411 824 HB ILE 126 HB ILE 126 -9.345 -10.481 -2.030 825 HG12 ILE 126 2HG1 ILE 126 -6.344 -10.523 -1.607 826 HG13 ILE 126 3HG1 ILE 126 -7.436 -9.193 -1.241 827 HG21 ILE 126 1HG2 ILE 126 -7.359 -12.693 -2.562 828 HG22 ILE 126 2HG2 ILE 126 -9.058 -12.701 -3.032 829 HG23 ILE 126 3HG2 ILE 126 -8.615 -12.702 -1.323 830 HD11 ILE 126 3HD1 ILE 126 -6.816 -10.340 0.783 831 HD12 ILE 126 1HD1 ILE 126 -7.363 -11.877 0.114 832 HD13 ILE 126 2HD1 ILE 126 -8.529 -10.605 0.457 833 H GLY 127 H GLY 127 -10.244 -9.044 -3.656 834 HA2 GLY 127 2HA GLY 127 -9.410 -6.446 -4.492 835 HA3 GLY 127 3HA GLY 127 -10.973 -6.872 -3.813 836 H PHE 128 H PHE 128 -8.904 -4.680 -3.347 837 HA PHE 128 HA PHE 128 -8.536 -5.066 -0.449 838 HB2 PHE 128 2HB PHE 128 -6.409 -4.920 -1.646 839 HB3 PHE 128 3HB PHE 128 -6.899 -3.391 -2.362 840 HD1 PHE 128 HD1 PHE 128 -5.938 -5.051 0.786 841 HD2 PHE 128 HD2 PHE 128 -6.695 -1.346 -1.165 842 HE1 PHE 128 HE1 PHE 128 -4.956 -3.846 2.693 843 HE2 PHE 128 HE2 PHE 128 -5.713 -0.137 0.738 844 HZ PHE 128 HZ PHE 128 -4.845 -1.389 2.671 845 H LYS 129 H LYS 129 -9.402 -3.685 0.904 846 HA LYS 129 HA LYS 129 -10.244 -1.040 -0.006 847 HB2 LYS 129 2HB LYS 129 -12.215 -2.456 -0.090 848 HB3 LYS 129 3HB LYS 129 -11.904 -3.045 1.530 849 HG2 LYS 129 2HG LYS 129 -12.367 -0.843 2.438 850 HG3 LYS 129 3HG LYS 129 -12.626 -0.215 0.807 851 HD2 LYS 129 2HD LYS 129 -14.475 -1.789 0.491 852 HD3 LYS 129 3HD LYS 129 -14.219 -2.414 2.120 853 HE2 LYS 129 2HE LYS 129 -14.914 0.440 1.466 854 HE3 LYS 129 3HE LYS 129 -16.081 -0.788 1.957 855 HZ1 LYS 129 3HZ LYS 129 -14.697 -1.074 4.007 856 HZ2 LYS 129 1HZ LYS 129 -15.494 0.418 3.882 857 HZ3 LYS 129 2HZ LYS 129 -13.849 0.322 3.549 858 H GLY 130 H GLY 130 -9.011 0.287 1.236 859 HA2 GLY 130 2HA GLY 130 -8.599 -0.510 4.049 860 HA3 GLY 130 3HA GLY 130 -7.402 0.350 3.090 861 H THR 131 H THR 131 -8.538 1.118 5.593 862 HA THR 131 HA THR 131 -9.463 3.763 4.756 863 HB THR 131 HB THR 131 -11.507 2.474 5.218 864 HG1 THR 131 HG1 THR 131 -12.401 4.195 6.113 865 HG21 THR 131 3HG2 THR 131 -10.656 0.942 6.915 866 HG22 THR 131 1HG2 THR 131 -12.062 1.817 7.520 867 HG23 THR 131 2HG2 THR 131 -10.443 2.285 8.039 868 H LEU 132 H LEU 132 -8.959 5.418 6.060 869 HA LEU 132 HA LEU 132 -6.836 5.009 7.966 870 HB2 LEU 132 2HB LEU 132 -6.747 6.880 6.417 871 HB3 LEU 132 3HB LEU 132 -8.260 7.503 7.038 872 HG LEU 132 HG LEU 132 -7.160 7.930 9.219 873 HD11 LEU 132 1HD1 LEU 132 -4.718 7.867 9.357 874 HD12 LEU 132 2HD1 LEU 132 -4.653 7.103 7.768 875 HD13 LEU 132 3HD1 LEU 132 -5.407 6.262 9.121 876 HD21 LEU 132 3HD2 LEU 132 -5.829 9.854 8.463 877 HD22 LEU 132 1HD2 LEU 132 -7.352 9.715 7.582 878 HD23 LEU 132 2HD2 LEU 132 -5.843 9.203 6.824 879 H THR 133 H THR 133 -7.046 4.876 10.115 880 HA THR 133 HA THR 133 -9.685 5.002 11.224 881 HB THR 133 HB THR 133 -8.188 3.193 11.940 882 HG1 THR 133 HG1 THR 133 -8.410 4.736 14.269 883 HG21 THR 133 3HG2 THR 133 -6.035 4.311 11.817 884 HG22 THR 133 1HG2 THR 133 -6.275 3.667 13.439 885 HG23 THR 133 2HG2 THR 133 -6.493 5.389 13.133 Start of MODEL 19 1 H1 ALA 2 1H ALA 2 0.982 6.237 9.076 2 H2 ALA 2 2H ALA 2 1.041 6.137 10.763 3 H3 ALA 2 3H ALA 2 0.975 7.649 10.018 4 HA ALA 2 HA ALA 2 -1.146 7.040 10.951 5 HB1 ALA 2 3HB ALA 2 -1.107 8.454 8.963 6 HB2 ALA 2 1HB ALA 2 -2.505 7.378 8.929 7 HB3 ALA 2 2HB ALA 2 -1.095 7.021 7.930 8 H LEU 3 H LEU 3 -2.573 5.495 11.441 9 HA LEU 3 HA LEU 3 -1.974 2.784 10.543 10 HB2 LEU 3 2HB LEU 3 -2.257 3.527 12.997 11 HB3 LEU 3 3HB LEU 3 -3.967 3.623 12.654 12 HG LEU 3 HG LEU 3 -3.242 1.547 13.849 13 HD11 LEU 3 1HD1 LEU 3 -4.573 0.005 12.554 14 HD12 LEU 3 2HD1 LEU 3 -4.472 1.062 11.148 15 HD13 LEU 3 3HD1 LEU 3 -5.333 1.597 12.594 16 HD21 LEU 3 3HD2 LEU 3 -1.969 0.820 11.215 17 HD22 LEU 3 1HD2 LEU 3 -2.099 -0.206 12.637 18 HD23 LEU 3 2HD2 LEU 3 -1.094 1.245 12.685 19 H TYR 4 H TYR 4 -3.302 1.582 9.337 20 HA TYR 4 HA TYR 4 -5.885 2.740 8.527 21 HB2 TYR 4 2HB TYR 4 -3.878 1.292 6.785 22 HB3 TYR 4 3HB TYR 4 -5.523 1.657 6.294 23 HD1 TYR 4 HD1 TYR 4 -2.297 3.201 7.255 24 HD2 TYR 4 HD2 TYR 4 -6.076 3.776 5.387 25 HE1 TYR 4 HE1 TYR 4 -1.536 5.370 6.387 26 HE2 TYR 4 HE2 TYR 4 -5.319 5.949 4.517 27 HH TYR 4 HH TYR 4 -2.057 6.898 4.574 28 H ASN 5 H ASN 5 -7.549 1.312 8.196 29 HA ASN 5 HA ASN 5 -7.182 -1.352 9.364 30 HB2 ASN 5 2HB ASN 5 -9.028 0.119 10.234 31 HB3 ASN 5 3HB ASN 5 -9.758 0.081 8.633 32 HD21 ASN 5 1HD2 ASN 5 -9.209 -1.624 11.576 33 HD22 ASN 5 2HD2 ASN 5 -10.210 -2.982 11.214 34 H VAL 6 H VAL 6 -7.660 -3.210 8.130 35 HA VAL 6 HA VAL 6 -7.984 -2.642 5.258 36 HB VAL 6 HB VAL 6 -6.135 -4.616 6.590 37 HG11 VAL 6 1HG1 VAL 6 -7.160 -5.708 4.678 38 HG12 VAL 6 2HG1 VAL 6 -5.474 -5.318 4.327 39 HG13 VAL 6 3HG1 VAL 6 -6.766 -4.326 3.653 40 HG21 VAL 6 3HG2 VAL 6 -5.618 -2.293 4.739 41 HG22 VAL 6 1HG2 VAL 6 -4.396 -3.381 5.400 42 HG23 VAL 6 2HG2 VAL 6 -5.318 -2.328 6.475 43 H GLU 7 H GLU 7 -9.570 -3.622 4.291 44 HA GLU 7 HA GLU 7 -10.521 -6.205 5.311 45 HB2 GLU 7 2HB GLU 7 -12.136 -3.980 4.032 46 HB3 GLU 7 3HB GLU 7 -12.751 -5.609 4.274 47 HG2 GLU 7 2HG GLU 7 -12.475 -5.349 6.691 48 HG3 GLU 7 3HG GLU 7 -11.860 -3.718 6.448 49 H ASN 8 H ASN 8 -10.980 -7.766 3.742 50 HA ASN 8 HA ASN 8 -9.921 -7.138 1.052 51 HB2 ASN 8 2HB ASN 8 -9.342 -9.542 2.768 52 HB3 ASN 8 3HB ASN 8 -9.079 -9.544 1.030 53 HD21 ASN 8 1HD2 ASN 8 -8.166 -6.812 0.862 54 HD22 ASN 8 2HD2 ASN 8 -6.588 -6.790 1.571 55 H GLN 9 H GLN 9 -10.869 -8.114 -0.698 56 HA GLN 9 HA GLN 9 -13.314 -9.664 -0.125 57 HB2 GLN 9 2HB GLN 9 -13.755 -7.319 -0.876 58 HB3 GLN 9 3HB GLN 9 -12.931 -7.698 -2.382 59 HG2 GLN 9 2HG GLN 9 -14.607 -9.450 -2.815 60 HG3 GLN 9 3HG GLN 9 -15.456 -8.961 -1.347 61 HE21 GLN 9 1HE2 GLN 9 -17.304 -8.275 -2.326 62 HE22 GLN 9 2HE2 GLN 9 -17.378 -6.894 -3.365 63 H TRP 10 H TRP 10 -13.352 -11.601 -1.044 64 HA TRP 10 HA TRP 10 -11.985 -11.981 -3.599 65 HB2 TRP 10 2HB TRP 10 -11.349 -14.322 -2.733 66 HB3 TRP 10 3HB TRP 10 -10.412 -12.964 -2.125 67 HD1 TRP 10 HD1 TRP 10 -13.292 -15.292 -0.981 68 HE1 TRP 10 HE1 TRP 10 -13.219 -15.458 1.587 69 HE3 TRP 10 HE3 TRP 10 -9.541 -11.944 -0.066 70 HZ2 TRP 10 HZ2 TRP 10 -11.765 -14.318 3.718 71 HZ3 TRP 10 HZ3 TRP 10 -8.872 -11.543 2.267 72 HH2 TRP 10 HH2 TRP 10 -9.959 -12.698 4.116 73 H GLY 11 H GLY 11 -13.087 -13.240 -5.054 74 HA2 GLY 11 2HA GLY 11 -14.639 -15.016 -5.540 75 HA3 GLY 11 3HA GLY 11 -15.493 -14.610 -4.057 76 H GLY 12 H GLY 12 -14.551 -11.808 -5.630 77 HA2 GLY 12 2HA GLY 12 -15.592 -10.677 -7.452 78 HA3 GLY 12 3HA GLY 12 -16.987 -11.724 -7.257 79 H SER 13 H SER 13 -17.230 -9.026 -7.542 80 HA SER 13 HA SER 13 -17.411 -7.420 -5.322 81 HB2 SER 13 2HB SER 13 -19.370 -7.474 -7.623 82 HB3 SER 13 3HB SER 13 -18.996 -6.095 -6.585 83 HG SER 13 HG SER 13 -17.909 -6.214 -8.700 84 H SER 14 H SER 14 -19.574 -9.979 -6.278 85 HA SER 14 HA SER 14 -21.785 -9.230 -4.663 86 HB2 SER 14 2HB SER 14 -22.012 -10.837 -6.515 87 HB3 SER 14 3HB SER 14 -21.019 -12.001 -5.638 88 HG SER 14 HG SER 14 -23.447 -10.895 -4.691 89 H ALA 15 H ALA 15 -18.934 -11.210 -4.071 90 HA ALA 15 HA ALA 15 -19.680 -12.273 -1.572 91 HB1 ALA 15 3HB ALA 15 -17.312 -12.816 -1.312 92 HB2 ALA 15 1HB ALA 15 -16.908 -11.750 -2.656 93 HB3 ALA 15 2HB ALA 15 -17.866 -13.204 -2.940 94 HA PRO 16 HA PRO 16 -19.135 -8.842 1.162 95 HB2 PRO 16 2HB PRO 16 -18.634 -10.092 3.477 96 HB3 PRO 16 3HB PRO 16 -20.203 -10.236 2.676 97 HG2 PRO 16 2HG PRO 16 -17.882 -12.136 2.616 98 HG3 PRO 16 3HG PRO 16 -19.598 -12.487 2.909 99 HD2 PRO 16 2HD PRO 16 -18.431 -12.842 0.497 100 HD3 PRO 16 3HD PRO 16 -20.130 -12.362 0.667 101 H TRP 17 H TRP 17 -17.596 -7.626 2.319 102 HA TRP 17 HA TRP 17 -14.825 -8.258 1.726 103 HB2 TRP 17 2HB TRP 17 -16.065 -5.929 3.226 104 HB3 TRP 17 3HB TRP 17 -14.363 -6.074 2.838 105 HD1 TRP 17 HD1 TRP 17 -17.757 -5.373 1.221 106 HE1 TRP 17 HE1 TRP 17 -17.366 -4.197 -1.031 107 HE3 TRP 17 HE3 TRP 17 -12.670 -5.790 0.955 108 HZ2 TRP 17 HZ2 TRP 17 -15.197 -3.531 -2.704 109 HZ3 TRP 17 HZ3 TRP 17 -11.516 -4.853 -1.010 110 HH2 TRP 17 HH2 TRP 17 -12.755 -3.750 -2.798 111 H ASN 18 H ASN 18 -13.533 -9.306 3.166 112 HA ASN 18 HA ASN 18 -14.611 -9.682 5.870 113 HB2 ASN 18 2HB ASN 18 -12.633 -11.336 4.277 114 HB3 ASN 18 3HB ASN 18 -12.987 -11.608 5.977 115 HD21 ASN 18 1HD2 ASN 18 -14.120 -11.938 2.734 116 HD22 ASN 18 2HD2 ASN 18 -15.511 -12.894 3.100 117 H GLU 19 H GLU 19 -13.422 -9.063 7.612 118 HA GLU 19 HA GLU 19 -11.503 -7.069 7.152 119 HB2 GLU 19 2HB GLU 19 -11.172 -7.105 9.627 120 HB3 GLU 19 3HB GLU 19 -12.824 -6.864 9.085 121 HG2 GLU 19 2HG GLU 19 -13.319 -9.213 9.551 122 HG3 GLU 19 3HG GLU 19 -11.666 -9.445 10.110 123 H GLY 20 H GLY 20 -9.506 -7.029 7.054 124 HA2 GLY 20 2HA GLY 20 -8.086 -9.613 6.967 125 HA3 GLY 20 3HA GLY 20 -7.614 -8.177 6.077 126 H GLY 21 H GLY 21 -8.048 -6.587 8.737 127 HA2 GLY 21 2HA GLY 21 -6.549 -6.933 10.733 128 HA3 GLY 21 3HA GLY 21 -5.281 -7.147 9.533 129 H GLN 22 H GLN 22 -4.132 -5.370 10.360 130 HA GLN 22 HA GLN 22 -5.190 -2.804 9.466 131 HB2 GLN 22 2HB GLN 22 -4.292 -1.752 11.567 132 HB3 GLN 22 3HB GLN 22 -5.701 -2.775 11.804 133 HG2 GLN 22 2HG GLN 22 -4.094 -4.618 12.440 134 HG3 GLN 22 3HG GLN 22 -2.833 -3.388 12.464 135 HE21 GLN 22 1HE2 GLN 22 -4.744 -1.367 13.479 136 HE22 GLN 22 2HE2 GLN 22 -4.964 -1.733 15.148 137 H TRP 23 H TRP 23 -3.714 -1.537 8.479 138 HA TRP 23 HA TRP 23 -0.901 -2.458 8.455 139 HB2 TRP 23 2HB TRP 23 -2.563 -1.237 6.244 140 HB3 TRP 23 3HB TRP 23 -0.814 -1.402 6.153 141 HD1 TRP 23 HD1 TRP 23 -2.119 -4.430 7.787 142 HE1 TRP 23 HE1 TRP 23 -2.327 -6.352 6.099 143 HE3 TRP 23 HE3 TRP 23 -1.588 -1.781 3.428 144 HZ2 TRP 23 HZ2 TRP 23 -2.279 -6.710 3.314 145 HZ3 TRP 23 HZ3 TRP 23 -1.676 -3.024 1.283 146 HH2 TRP 23 HH2 TRP 23 -2.012 -5.412 1.244 147 H GLU 24 H GLU 24 0.599 -0.599 7.643 148 HA GLU 24 HA GLU 24 -0.361 1.962 8.716 149 HB2 GLU 24 2HB GLU 24 1.041 0.927 10.458 150 HB3 GLU 24 3HB GLU 24 2.370 0.801 9.312 151 HG2 GLU 24 2HG GLU 24 2.533 3.196 9.151 152 HG3 GLU 24 3HG GLU 24 1.105 3.400 10.161 153 H ILE 25 H ILE 25 -0.131 3.563 7.343 154 HA ILE 25 HA ILE 25 1.974 3.449 5.286 155 HB ILE 25 HB ILE 25 -0.992 3.814 4.724 156 HG12 ILE 25 2HG1 ILE 25 0.927 1.740 3.654 157 HG13 ILE 25 3HG1 ILE 25 -0.175 1.473 4.999 158 HG21 ILE 25 1HG2 ILE 25 0.326 5.373 3.380 159 HG22 ILE 25 2HG2 ILE 25 -0.428 4.126 2.386 160 HG23 ILE 25 3HG2 ILE 25 1.292 4.027 2.769 161 HD11 ILE 25 3HD1 ILE 25 -0.975 2.142 2.175 162 HD12 ILE 25 1HD1 ILE 25 -2.074 1.847 3.522 163 HD13 ILE 25 2HD1 ILE 25 -1.043 0.547 2.926 164 H GLY 26 H GLY 26 2.571 5.502 4.426 165 HA2 GLY 26 2HA GLY 26 2.465 7.821 4.106 166 HA3 GLY 26 3HA GLY 26 1.067 7.875 5.165 167 H SER 27 H SER 27 3.974 6.302 6.202 168 HA SER 27 HA SER 27 4.191 8.072 8.442 169 HB2 SER 27 2HB SER 27 6.150 5.918 7.638 170 HB3 SER 27 3HB SER 27 5.841 6.558 9.258 171 HG SER 27 HG SER 27 4.762 4.581 9.008 172 H ARG 28 H ARG 28 5.003 8.821 5.458 173 HA ARG 28 HA ARG 28 7.793 9.417 5.504 174 HB2 ARG 28 2HB ARG 28 6.693 9.264 3.378 175 HB3 ARG 28 3HB ARG 28 5.551 10.528 3.822 176 HG2 ARG 28 2HG ARG 28 7.361 12.166 3.863 177 HG3 ARG 28 3HG ARG 28 8.518 10.908 3.428 178 HD2 ARG 28 2HD ARG 28 7.402 10.587 1.296 179 HD3 ARG 28 3HD ARG 28 6.160 11.758 1.741 180 HE ARG 28 HE ARG 28 8.792 12.859 1.879 181 HH11 ARG 28 1HH1 ARG 28 6.220 12.079 -0.398 182 HH12 ARG 28 2HH1 ARG 28 6.654 13.332 -1.504 183 HH21 ARG 28 1HH2 ARG 28 9.352 14.507 0.400 184 HH22 ARG 28 2HH2 ARG 28 8.430 14.722 -1.053 185 H SER 29 H SER 29 4.950 11.455 6.009 186 HA SER 29 HA SER 29 6.299 13.115 7.918 187 HB2 SER 29 2HB SER 29 5.455 14.313 5.257 188 HB3 SER 29 3HB SER 29 5.979 15.238 6.660 189 HG SER 29 HG SER 29 7.767 13.290 5.970 190 H ASP 30 H ASP 30 4.068 11.389 7.540 191 HA ASP 30 HA ASP 30 1.803 11.155 8.042 192 HB2 ASP 30 2HB ASP 30 2.031 13.954 9.191 193 HB3 ASP 30 3HB ASP 30 0.784 12.772 9.556 194 H GLN 31 H GLN 31 0.799 11.106 5.949 195 HA GLN 31 HA GLN 31 -0.488 13.410 5.072 196 HB2 GLN 31 2HB GLN 31 2.178 13.041 4.126 197 HB3 GLN 31 3HB GLN 31 1.103 12.564 2.820 198 HG2 GLN 31 2HG GLN 31 0.930 15.196 4.272 199 HG3 GLN 31 3HG GLN 31 1.816 14.944 2.768 200 HE21 GLN 31 1HE2 GLN 31 0.709 14.749 0.869 201 HE22 GLN 31 2HE2 GLN 31 -0.989 15.047 0.728 202 H ASN 32 H ASN 32 -2.115 12.738 3.640 203 HA ASN 32 HA ASN 32 -2.538 9.893 3.692 204 HB2 ASN 32 2HB ASN 32 -4.236 12.247 3.041 205 HB3 ASN 32 3HB ASN 32 -4.719 10.661 2.468 206 HD21 ASN 32 1HD2 ASN 32 -3.731 9.167 4.729 207 HD22 ASN 32 2HD2 ASN 32 -4.762 9.547 6.054 208 H VAL 33 H VAL 33 -2.491 8.511 2.135 209 HA VAL 33 HA VAL 33 -1.360 9.304 -0.419 210 HB VAL 33 HB VAL 33 -1.912 6.532 0.648 211 HG11 VAL 33 1HG1 VAL 33 -1.714 6.562 -1.742 212 HG12 VAL 33 2HG1 VAL 33 -0.270 5.829 -1.040 213 HG13 VAL 33 3HG1 VAL 33 -0.219 7.488 -1.642 214 HG21 VAL 33 3HG2 VAL 33 0.632 8.145 0.734 215 HG22 VAL 33 1HG2 VAL 33 0.488 6.440 1.168 216 HG23 VAL 33 2HG2 VAL 33 -0.363 7.666 2.113 217 H VAL 34 H VAL 34 -2.442 9.129 -2.364 218 HA VAL 34 HA VAL 34 -5.252 8.277 -2.163 219 HB VAL 34 HB VAL 34 -5.712 9.688 -4.150 220 HG11 VAL 34 1HG1 VAL 34 -5.597 11.837 -2.985 221 HG12 VAL 34 2HG1 VAL 34 -4.492 11.129 -1.806 222 HG13 VAL 34 3HG1 VAL 34 -6.149 10.541 -1.922 223 HG21 VAL 34 3HG2 VAL 34 -3.497 9.742 -5.139 224 HG22 VAL 34 1HG2 VAL 34 -2.875 10.629 -3.747 225 HG23 VAL 34 2HG2 VAL 34 -4.057 11.385 -4.816 226 H ALA 35 H ALA 35 -2.234 7.618 -3.677 227 HA ALA 35 HA ALA 35 -3.501 5.398 -5.074 228 HB1 ALA 35 3HB ALA 35 -3.509 7.239 -6.716 229 HB2 ALA 35 1HB ALA 35 -2.497 5.885 -7.222 230 HB3 ALA 35 2HB ALA 35 -1.751 7.343 -6.573 231 H ILE 36 H ILE 36 -2.217 3.619 -5.273 232 HA ILE 36 HA ILE 36 0.637 3.856 -4.689 233 HB ILE 36 HB ILE 36 -1.184 1.918 -3.229 234 HG12 ILE 36 2HG1 ILE 36 0.556 4.118 -2.105 235 HG13 ILE 36 3HG1 ILE 36 -1.187 4.237 -2.322 236 HG21 ILE 36 1HG2 ILE 36 0.874 1.170 -2.089 237 HG22 ILE 36 2HG2 ILE 36 1.818 2.209 -3.156 238 HG23 ILE 36 3HG2 ILE 36 0.907 0.857 -3.826 239 HD11 ILE 36 3HD1 ILE 36 -1.513 2.404 -0.746 240 HD12 ILE 36 1HD1 ILE 36 -0.606 3.729 -0.012 241 HD13 ILE 36 2HD1 ILE 36 0.233 2.266 -0.540 242 H ASN 37 H ASN 37 1.574 2.931 -6.412 243 HA ASN 37 HA ASN 37 0.418 0.417 -7.398 244 HB2 ASN 37 2HB ASN 37 1.830 2.605 -8.964 245 HB3 ASN 37 3HB ASN 37 1.380 1.038 -9.627 246 HD21 ASN 37 1HD2 ASN 37 -1.154 0.945 -8.188 247 HD22 ASN 37 2HD2 ASN 37 -2.205 2.049 -8.993 248 H VAL 38 H VAL 38 1.744 -1.196 -6.734 249 HA VAL 38 HA VAL 38 4.607 -0.851 -6.954 250 HB VAL 38 HB VAL 38 5.071 -1.606 -4.610 251 HG11 VAL 38 1HG1 VAL 38 5.381 0.725 -5.198 252 HG12 VAL 38 2HG1 VAL 38 4.756 0.589 -3.555 253 HG13 VAL 38 3HG1 VAL 38 3.678 1.049 -4.873 254 HG21 VAL 38 3HG2 VAL 38 3.354 -1.298 -2.896 255 HG22 VAL 38 1HG2 VAL 38 2.863 -2.513 -4.076 256 HG23 VAL 38 2HG2 VAL 38 2.186 -0.885 -4.147 257 H GLU 39 H GLU 39 5.746 -2.772 -7.006 258 HA GLU 39 HA GLU 39 4.294 -5.260 -6.576 259 HB2 GLU 39 2HB GLU 39 4.009 -4.654 -8.965 260 HB3 GLU 39 3HB GLU 39 5.755 -4.598 -9.142 261 HG2 GLU 39 2HG GLU 39 5.914 -6.960 -8.718 262 HG3 GLU 39 3HG GLU 39 4.186 -7.040 -8.369 263 H SER 40 H SER 40 5.664 -7.020 -6.120 264 HA SER 40 HA SER 40 8.012 -6.253 -4.745 265 HB2 SER 40 2HB SER 40 8.233 -8.748 -4.352 266 HB3 SER 40 3HB SER 40 6.735 -8.006 -3.793 267 HG SER 40 HG SER 40 6.837 -9.095 -6.386 268 H GLY 41 H GLY 41 10.112 -6.851 -5.021 269 HA2 GLY 41 2HA GLY 41 10.872 -7.485 -7.792 270 HA3 GLY 41 3HA GLY 41 11.909 -6.703 -6.600 271 H ASP 42 H ASP 42 11.668 -8.268 -4.440 272 HA ASP 42 HA ASP 42 12.807 -10.824 -5.326 273 HB2 ASP 42 2HB ASP 42 12.971 -9.424 -2.632 274 HB3 ASP 42 3HB ASP 42 13.712 -10.975 -3.009 275 H ASP 43 H ASP 43 12.351 -12.001 -2.636 276 HA ASP 43 HA ASP 43 9.816 -13.229 -3.189 277 HB2 ASP 43 2HB ASP 43 11.583 -13.487 -0.740 278 HB3 ASP 43 3HB ASP 43 10.264 -14.563 -1.177 279 H GLY 44 H GLY 44 9.293 -10.543 -2.811 280 HA2 GLY 44 2HA GLY 44 7.591 -9.338 -1.791 281 HA3 GLY 44 3HA GLY 44 7.358 -10.670 -0.669 282 H GLN 45 H GLN 45 10.560 -9.969 -0.703 283 HA GLN 45 HA GLN 45 10.395 -8.597 1.828 284 HB2 GLN 45 2HB GLN 45 12.774 -9.511 0.209 285 HB3 GLN 45 3HB GLN 45 12.877 -8.777 1.803 286 HG2 GLN 45 2HG GLN 45 11.598 -10.626 2.742 287 HG3 GLN 45 3HG GLN 45 11.494 -11.369 1.146 288 HE21 GLN 45 1HE2 GLN 45 13.460 -10.761 3.887 289 HE22 GLN 45 2HE2 GLN 45 14.805 -11.732 3.414 290 H THR 46 H THR 46 10.878 -7.830 -1.460 291 HA THR 46 HA THR 46 11.352 -5.035 -0.713 292 HB THR 46 HB THR 46 12.605 -4.799 -2.877 293 HG1 THR 46 HG1 THR 46 13.515 -7.178 -3.301 294 HG21 THR 46 3HG2 THR 46 13.771 -6.709 -0.845 295 HG22 THR 46 1HG2 THR 46 13.787 -4.949 -0.734 296 HG23 THR 46 2HG2 THR 46 14.694 -5.756 -2.010 297 H LEU 47 H LEU 47 10.257 -3.490 -1.882 298 HA LEU 47 HA LEU 47 8.353 -4.457 -3.889 299 HB2 LEU 47 2HB LEU 47 7.745 -2.495 -1.664 300 HB3 LEU 47 3HB LEU 47 6.665 -2.874 -2.986 301 HG LEU 47 HG LEU 47 7.565 -4.809 -0.853 302 HD11 LEU 47 1HD1 LEU 47 5.283 -4.659 -0.050 303 HD12 LEU 47 2HD1 LEU 47 4.916 -3.443 -1.275 304 HD13 LEU 47 3HD1 LEU 47 6.080 -3.088 0.003 305 HD21 LEU 47 3HD2 LEU 47 5.829 -6.270 -1.789 306 HD22 LEU 47 1HD2 LEU 47 7.125 -5.949 -2.937 307 HD23 LEU 47 2HD2 LEU 47 5.578 -5.116 -3.101 308 H ASN 48 H ASN 48 8.282 -3.201 -5.694 309 HA ASN 48 HA ASN 48 9.615 -0.576 -5.571 310 HB2 ASN 48 2HB ASN 48 9.820 -2.681 -7.743 311 HB3 ASN 48 3HB ASN 48 10.421 -1.039 -7.909 312 HD21 ASN 48 1HD2 ASN 48 11.359 -0.954 -5.115 313 HD22 ASN 48 2HD2 ASN 48 12.785 -1.928 -5.090 314 H GLY 49 H GLY 49 8.573 1.071 -6.628 315 HA2 GLY 49 2HA GLY 49 6.873 0.847 -8.800 316 HA3 GLY 49 3HA GLY 49 5.859 0.651 -7.381 317 H THR 50 H THR 50 4.725 2.539 -7.762 318 HA THR 50 HA THR 50 6.193 4.969 -7.077 319 HB THR 50 HB THR 50 4.722 6.240 -8.694 320 HG1 THR 50 HG1 THR 50 4.353 4.041 -10.298 321 HG21 THR 50 3HG2 THR 50 7.086 5.738 -9.206 322 HG22 THR 50 1HG2 THR 50 6.089 5.757 -10.661 323 HG23 THR 50 2HG2 THR 50 6.587 4.224 -9.961 324 H MET 51 H MET 51 4.881 6.563 -6.049 325 HA MET 51 HA MET 51 2.205 5.705 -5.257 326 HB2 MET 51 2HB MET 51 3.630 4.747 -3.561 327 HB3 MET 51 3HB MET 51 4.454 6.277 -3.323 328 HG2 MET 51 2HG MET 51 1.531 6.210 -2.867 329 HG3 MET 51 3HG MET 51 2.557 5.374 -1.704 330 HE1 MET 51 3HE MET 51 5.242 7.392 -1.934 331 HE2 MET 51 1HE MET 51 4.607 6.460 -0.578 332 HE3 MET 51 2HE MET 51 4.876 8.192 -0.408 333 H THR 52 H THR 52 0.810 7.374 -4.626 334 HA THR 52 HA THR 52 1.866 10.093 -5.015 335 HB THR 52 HB THR 52 -0.736 9.018 -6.119 336 HG1 THR 52 HG1 THR 52 1.828 9.310 -7.151 337 HG21 THR 52 3HG2 THR 52 0.566 11.731 -6.396 338 HG22 THR 52 1HG2 THR 52 -0.927 11.376 -5.532 339 HG23 THR 52 2HG2 THR 52 -0.861 11.198 -7.287 340 H TYR 53 H TYR 53 1.343 11.487 -3.457 341 HA TYR 53 HA TYR 53 -0.621 10.778 -1.420 342 HB2 TYR 53 2HB TYR 53 1.382 13.035 -1.580 343 HB3 TYR 53 3HB TYR 53 0.207 12.880 -0.289 344 HD1 TYR 53 HD2 TYR 53 0.293 10.747 1.122 345 HD2 TYR 53 HD1 TYR 53 3.452 11.973 -1.446 346 HE1 TYR 53 HE2 TYR 53 1.858 9.336 2.380 347 HE2 TYR 53 HE1 TYR 53 5.021 10.562 -0.189 348 HH TYR 53 HH TYR 53 4.049 8.175 1.895 349 H ALA 54 H ALA 54 -2.093 12.508 -0.637 350 HA ALA 54 HA ALA 54 -3.667 13.511 -2.780 351 HB1 ALA 54 3HB ALA 54 -4.622 12.818 -0.606 352 HB2 ALA 54 1HB ALA 54 -5.089 14.456 -1.057 353 HB3 ALA 54 2HB ALA 54 -3.837 14.202 0.151 354 H GLY 55 H GLY 55 -2.588 14.986 -4.030 355 HA2 GLY 55 2HA GLY 55 -2.560 17.362 -4.430 356 HA3 GLY 55 3HA GLY 55 -2.142 17.603 -2.739 357 H GLU 56 H GLU 56 -0.384 15.024 -3.811 358 HA GLU 56 HA GLU 56 1.903 16.738 -4.557 359 HB2 GLU 56 2HB GLU 56 1.871 14.155 -2.997 360 HB3 GLU 56 3HB GLU 56 3.332 14.909 -3.605 361 HG2 GLU 56 2HG GLU 56 1.419 16.186 -1.666 362 HG3 GLU 56 3HG GLU 56 2.929 15.385 -1.226 363 H GLY 57 H GLY 57 3.528 15.617 -5.926 364 HA2 GLY 57 2HA GLY 57 2.147 14.202 -8.032 365 HA3 GLY 57 3HA GLY 57 3.811 14.771 -8.078 366 HA PRO 58 HA PRO 58 3.479 10.087 -7.178 367 HB2 PRO 58 2HB PRO 58 4.639 9.805 -9.879 368 HB3 PRO 58 3HB PRO 58 3.293 8.934 -9.147 369 HG2 PRO 58 2HG PRO 58 2.870 10.740 -11.072 370 HG3 PRO 58 3HG PRO 58 1.744 10.565 -9.714 371 HD2 PRO 58 2HD PRO 58 3.888 12.616 -10.132 372 HD3 PRO 58 3HD PRO 58 2.226 12.834 -9.544 373 H ILE 59 H ILE 59 5.217 9.125 -6.300 374 HA ILE 59 HA ILE 59 7.889 10.028 -7.123 375 HB ILE 59 HB ILE 59 8.645 9.878 -4.775 376 HG12 ILE 59 2HG1 ILE 59 5.704 9.592 -4.116 377 HG13 ILE 59 3HG1 ILE 59 6.899 8.308 -3.982 378 HG21 ILE 59 1HG2 ILE 59 8.021 12.049 -5.695 379 HG22 ILE 59 2HG2 ILE 59 7.623 11.956 -3.979 380 HG23 ILE 59 3HG2 ILE 59 6.351 11.795 -5.188 381 HD11 ILE 59 3HD1 ILE 59 6.468 9.243 -1.805 382 HD12 ILE 59 1HD1 ILE 59 6.817 10.866 -2.393 383 HD13 ILE 59 2HD1 ILE 59 8.103 9.669 -2.302 384 H GLY 60 H GLY 60 9.619 8.505 -6.524 385 HA2 GLY 60 2HA GLY 60 8.867 5.843 -7.313 386 HA3 GLY 60 3HA GLY 60 10.487 6.402 -6.911 387 H PHE 61 H PHE 61 8.610 4.071 -6.079 388 HA PHE 61 HA PHE 61 8.946 4.432 -3.173 389 HB2 PHE 61 2HB PHE 61 6.590 4.325 -3.885 390 HB3 PHE 61 3HB PHE 61 6.885 2.771 -4.646 391 HD1 PHE 61 HD2 PHE 61 7.292 0.768 -3.254 392 HD2 PHE 61 HD1 PHE 61 6.265 4.524 -1.538 393 HE1 PHE 61 HE2 PHE 61 6.698 -0.360 -1.151 394 HE2 PHE 61 HE1 PHE 61 5.673 3.406 0.571 395 HZ PHE 61 HZ PHE 61 5.886 0.958 0.764 396 H ARG 62 H ARG 62 10.353 3.139 -2.231 397 HA ARG 62 HA ARG 62 10.642 0.394 -3.208 398 HB2 ARG 62 2HB ARG 62 12.566 1.589 -4.109 399 HB3 ARG 62 3HB ARG 62 12.943 2.229 -2.517 400 HG2 ARG 62 2HG ARG 62 13.548 0.076 -1.708 401 HG3 ARG 62 3HG ARG 62 12.969 -0.704 -3.183 402 HD2 ARG 62 2HD ARG 62 15.415 -0.498 -3.163 403 HD3 ARG 62 3HD ARG 62 14.694 0.431 -4.477 404 HE ARG 62 HE ARG 62 15.329 2.389 -3.437 405 HH11 ARG 62 1HH1 ARG 62 16.089 -0.352 -1.350 406 HH12 ARG 62 2HH1 ARG 62 17.085 0.588 -0.289 407 HH21 ARG 62 1HH2 ARG 62 16.650 3.596 -2.057 408 HH22 ARG 62 2HH2 ARG 62 17.358 2.856 -0.669 409 H ALA 63 H ALA 63 10.537 -1.075 -1.636 410 HA ALA 63 HA ALA 63 10.836 -0.133 1.137 411 HB1 ALA 63 3HB ALA 63 8.440 -0.246 0.534 412 HB2 ALA 63 1HB ALA 63 8.879 -1.381 1.811 413 HB3 ALA 63 2HB ALA 63 8.642 -1.961 0.167 414 H THR 64 H THR 64 11.849 -1.494 2.517 415 HA THR 64 HA THR 64 12.593 -4.162 1.505 416 HB THR 64 HB THR 64 14.236 -2.337 3.297 417 HG1 THR 64 HG1 THR 64 13.939 -2.467 0.600 418 HG21 THR 64 3HG2 THR 64 16.041 -3.959 2.879 419 HG22 THR 64 1HG2 THR 64 14.928 -4.954 1.939 420 HG23 THR 64 2HG2 THR 64 14.666 -4.730 3.669 421 H LEU 65 H LEU 65 12.031 -5.823 2.811 422 HA LEU 65 HA LEU 65 10.449 -5.304 5.133 423 HB2 LEU 65 2HB LEU 65 9.882 -7.099 3.630 424 HB3 LEU 65 3HB LEU 65 11.430 -7.874 3.912 425 HG LEU 65 HG LEU 65 10.732 -8.183 6.315 426 HD11 LEU 65 1HD1 LEU 65 8.039 -7.360 5.240 427 HD12 LEU 65 2HD1 LEU 65 9.017 -6.451 6.393 428 HD13 LEU 65 3HD1 LEU 65 8.358 -8.023 6.844 429 HD21 LEU 65 3HD2 LEU 65 9.269 -10.087 5.818 430 HD22 LEU 65 1HD2 LEU 65 10.631 -9.997 4.702 431 HD23 LEU 65 2HD2 LEU 65 9.031 -9.466 4.187 432 H LEU 66 H LEU 66 11.199 -4.923 7.048 433 HA LEU 66 HA LEU 66 13.801 -5.827 7.950 434 HB2 LEU 66 2HB LEU 66 11.583 -4.465 9.480 435 HB3 LEU 66 3HB LEU 66 13.221 -4.697 10.045 436 HG LEU 66 HG LEU 66 12.375 -2.945 7.737 437 HD11 LEU 66 1HD1 LEU 66 13.364 -2.289 10.500 438 HD12 LEU 66 2HD1 LEU 66 11.744 -2.014 9.862 439 HD13 LEU 66 3HD1 LEU 66 13.117 -1.126 9.199 440 HD21 LEU 66 3HD2 LEU 66 14.704 -2.202 7.710 441 HD22 LEU 66 1HD2 LEU 66 14.564 -3.919 7.340 442 HD23 LEU 66 2HD2 LEU 66 15.101 -3.406 8.940 443 H GLY 67 H GLY 67 10.492 -6.748 8.186 444 HA2 GLY 67 2HA GLY 67 10.280 -9.225 8.654 445 HA3 GLY 67 3HA GLY 67 11.151 -8.847 10.139 446 H ASN 68 H ASN 68 8.537 -10.015 10.030 447 HA ASN 68 HA ASN 68 6.524 -9.850 11.061 448 HB2 ASN 68 2HB ASN 68 7.833 -7.462 12.394 449 HB3 ASN 68 3HB ASN 68 6.260 -8.100 12.854 450 HD21 ASN 68 1HD2 ASN 68 8.604 -7.871 14.463 451 HD22 ASN 68 2HD2 ASN 68 9.031 -9.462 14.973 452 H ASN 69 H ASN 69 6.783 -8.727 8.495 453 HA ASN 69 HA ASN 69 5.564 -7.584 6.948 454 HB2 ASN 69 2HB ASN 69 3.671 -7.147 9.275 455 HB3 ASN 69 3HB ASN 69 3.323 -6.653 7.624 456 HD21 ASN 69 1HD2 ASN 69 4.481 -8.941 6.345 457 HD22 ASN 69 2HD2 ASN 69 3.446 -10.279 6.682 458 H SER 70 H SER 70 7.337 -6.156 9.168 459 HA SER 70 HA SER 70 6.500 -3.421 8.654 460 HB2 SER 70 2HB SER 70 8.860 -4.427 10.259 461 HB3 SER 70 3HB SER 70 8.188 -2.796 10.275 462 HG SER 70 HG SER 70 6.311 -4.702 10.827 463 H TYR 71 H TYR 71 7.269 -2.314 7.003 464 HA TYR 71 HA TYR 71 9.737 -3.254 5.712 465 HB2 TYR 71 2HB TYR 71 7.317 -1.866 4.568 466 HB3 TYR 71 3HB TYR 71 8.823 -2.066 3.689 467 HD1 TYR 71 HD1 TYR 71 6.056 -3.939 5.301 468 HD2 TYR 71 HD2 TYR 71 9.262 -4.050 2.516 469 HE1 TYR 71 HE1 TYR 71 5.269 -6.124 4.489 470 HE2 TYR 71 HE2 TYR 71 8.490 -6.237 1.700 471 HH TYR 71 HH TYR 71 7.134 -7.995 2.168 472 H GLU 72 H GLU 72 11.397 -1.876 5.593 473 HA GLU 72 HA GLU 72 11.016 0.862 6.473 474 HB2 GLU 72 2HB GLU 72 13.024 -0.421 7.227 475 HB3 GLU 72 3HB GLU 72 13.539 -0.564 5.552 476 HG2 GLU 72 2HG GLU 72 13.856 1.825 5.399 477 HG3 GLU 72 3HG GLU 72 13.191 2.046 7.014 478 H VAL 73 H VAL 73 10.580 2.399 5.083 479 HA VAL 73 HA VAL 73 10.725 1.732 2.230 480 HB VAL 73 HB VAL 73 8.864 3.588 3.723 481 HG11 VAL 73 1HG1 VAL 73 9.409 4.593 1.583 482 HG12 VAL 73 2HG1 VAL 73 7.755 3.987 1.568 483 HG13 VAL 73 3HG1 VAL 73 9.033 3.082 0.755 484 HG21 VAL 73 3HG2 VAL 73 7.120 2.048 2.908 485 HG22 VAL 73 1HG2 VAL 73 8.291 1.243 3.954 486 HG23 VAL 73 2HG2 VAL 73 8.376 1.029 2.208 487 H GLU 74 H GLU 74 11.726 2.962 0.836 488 HA GLU 74 HA GLU 74 12.704 5.584 1.648 489 HB2 GLU 74 2HB GLU 74 14.280 3.452 0.170 490 HB3 GLU 74 3HB GLU 74 14.775 5.136 0.276 491 HG2 GLU 74 2HG GLU 74 14.896 4.935 2.718 492 HG3 GLU 74 3HG GLU 74 14.428 3.242 2.596 493 H ASN 75 H ASN 75 12.217 7.130 0.166 494 HA ASN 75 HA ASN 75 10.993 6.166 -2.317 495 HB2 ASN 75 2HB ASN 75 10.365 8.628 -0.692 496 HB3 ASN 75 3HB ASN 75 9.666 8.271 -2.267 497 HD21 ASN 75 1HD2 ASN 75 9.675 7.524 1.101 498 HD22 ASN 75 2HD2 ASN 75 8.295 6.481 1.088 499 H GLN 76 H GLN 76 11.203 7.488 -4.160 500 HA GLN 76 HA GLN 76 13.718 9.032 -4.164 501 HB2 GLN 76 2HB GLN 76 13.799 6.863 -5.390 502 HB3 GLN 76 3HB GLN 76 12.514 7.441 -6.432 503 HG2 GLN 76 2HG GLN 76 13.940 9.221 -7.243 504 HG3 GLN 76 3HG GLN 76 15.236 8.688 -6.170 505 HE21 GLN 76 1HE2 GLN 76 16.667 8.224 -7.776 506 HE22 GLN 76 2HE2 GLN 76 16.450 6.934 -8.906 507 H TRP 77 H TRP 77 13.439 11.131 -4.526 508 HA TRP 77 HA TRP 77 11.450 11.990 -6.463 509 HB2 TRP 77 2HB TRP 77 10.538 13.727 -4.994 510 HB3 TRP 77 3HB TRP 77 10.258 12.124 -4.329 511 HD1 TRP 77 HD1 TRP 77 12.682 15.122 -3.820 512 HE1 TRP 77 HE1 TRP 77 13.352 15.192 -1.337 513 HE3 TRP 77 HE3 TRP 77 10.294 10.894 -2.200 514 HZ2 TRP 77 HZ2 TRP 77 12.926 13.677 0.990 515 HZ3 TRP 77 HZ3 TRP 77 10.477 10.290 0.184 516 HH2 TRP 77 HH2 TRP 77 11.762 11.648 1.736 517 H GLY 78 H GLY 78 11.728 14.265 -7.098 518 HA2 GLY 78 2HA GLY 78 13.065 16.236 -7.188 519 HA3 GLY 78 3HA GLY 78 14.409 15.317 -6.521 520 H GLY 79 H GLY 79 13.226 13.242 -8.600 521 HA2 GLY 79 2HA GLY 79 13.366 13.605 -11.133 522 HA3 GLY 79 3HA GLY 79 14.997 14.148 -10.762 523 H ASP 80 H ASP 80 14.381 11.934 -12.495 524 HA ASP 80 HA ASP 80 14.523 9.459 -11.343 525 HB2 ASP 80 2HB ASP 80 14.013 9.887 -13.673 526 HB3 ASP 80 3HB ASP 80 15.623 10.531 -13.938 527 H SER 81 H SER 81 17.168 11.650 -12.247 528 HA SER 81 HA SER 81 19.211 9.788 -11.562 529 HB2 SER 81 2HB SER 81 20.725 11.750 -11.893 530 HB3 SER 81 3HB SER 81 19.665 11.408 -13.261 531 HG SER 81 HG SER 81 19.797 13.610 -11.648 532 H ALA 82 H ALA 82 17.188 11.489 -9.591 533 HA ALA 82 HA ALA 82 19.069 12.364 -7.605 534 HB1 ALA 82 3HB ALA 82 16.916 13.486 -7.866 535 HB2 ALA 82 1HB ALA 82 17.082 12.819 -6.241 536 HB3 ALA 82 2HB ALA 82 16.081 11.996 -7.434 537 HA PRO 83 HA PRO 83 19.494 8.527 -5.405 538 HB2 PRO 83 2HB PRO 83 20.089 9.407 -2.928 539 HB3 PRO 83 3HB PRO 83 21.211 9.583 -4.282 540 HG2 PRO 83 2HG PRO 83 19.335 11.606 -3.112 541 HG3 PRO 83 3HG PRO 83 21.032 11.805 -3.595 542 HD2 PRO 83 2HD PRO 83 18.941 12.582 -5.158 543 HD3 PRO 83 3HD PRO 83 20.493 12.034 -5.828 544 H TRP 84 H TRP 84 18.788 7.604 -3.077 545 HA TRP 84 HA TRP 84 15.894 7.959 -3.016 546 HB2 TRP 84 2HB TRP 84 17.678 5.758 -1.954 547 HB3 TRP 84 3HB TRP 84 15.945 5.841 -1.672 548 HD1 TRP 84 HD1 TRP 84 18.481 5.192 -4.479 549 HE1 TRP 84 HE1 TRP 84 17.263 3.989 -6.406 550 HE3 TRP 84 HE3 TRP 84 13.688 5.493 -2.728 551 HZ2 TRP 84 HZ2 TRP 84 14.628 3.259 -7.081 552 HZ3 TRP 84 HZ3 TRP 84 11.879 4.517 -4.078 553 HH2 TRP 84 HH2 TRP 84 12.340 3.426 -6.210 554 H HIS 85 H HIS 85 14.840 8.560 -1.193 555 HA HIS 85 HA HIS 85 16.540 9.361 1.080 556 HB2 HIS 85 2HB HIS 85 14.059 10.728 -0.002 557 HB3 HIS 85 3HB HIS 85 14.850 11.160 1.512 558 HD1 HIS 85 HD1 HIS 85 17.056 12.494 1.356 559 HD2 HIS 85 HD2 HIS 85 15.413 11.533 -2.342 560 HE1 HIS 85 HE1 HIS 85 18.340 13.852 -0.321 561 H SER 86 H SER 86 15.783 8.939 3.146 562 HA SER 86 HA SER 86 14.213 6.635 3.428 563 HB2 SER 86 2HB SER 86 14.318 7.279 5.899 564 HB3 SER 86 3HB SER 86 15.862 7.045 5.077 565 HG SER 86 HG SER 86 14.639 9.588 5.265 566 H GLY 87 H GLY 87 12.102 6.311 3.820 567 HA2 GLY 87 2HA GLY 87 10.401 8.707 3.930 568 HA3 GLY 87 3HA GLY 87 9.915 7.149 3.276 569 H GLY 88 H GLY 88 10.689 5.398 5.239 570 HA2 GLY 88 2HA GLY 88 10.487 5.797 7.859 571 HA3 GLY 88 3HA GLY 88 8.830 6.136 7.374 572 H ASN 89 H ASN 89 8.443 4.306 8.902 573 HA ASN 89 HA ASN 89 8.979 1.690 7.668 574 HB2 ASN 89 2HB ASN 89 9.793 2.002 10.002 575 HB3 ASN 89 3HB ASN 89 8.134 2.303 10.503 576 HD21 ASN 89 1HD2 ASN 89 10.417 -0.080 9.467 577 HD22 ASN 89 2HD2 ASN 89 9.454 -1.462 9.851 578 H TRP 90 H TRP 90 7.279 0.856 6.540 579 HA TRP 90 HA TRP 90 4.589 1.604 7.421 580 HB2 TRP 90 2HB TRP 90 5.624 0.778 4.689 581 HB3 TRP 90 3HB TRP 90 3.936 1.088 5.070 582 HD1 TRP 90 HD1 TRP 90 6.424 3.563 6.547 583 HE1 TRP 90 HE1 TRP 90 6.266 5.789 5.283 584 HE3 TRP 90 HE3 TRP 90 3.434 2.089 2.669 585 HZ2 TRP 90 HZ2 TRP 90 5.038 6.799 2.956 586 HZ3 TRP 90 HZ3 TRP 90 2.814 3.756 0.968 587 HH2 TRP 90 HH2 TRP 90 3.599 6.057 1.115 588 H ILE 91 H ILE 91 3.042 -0.079 7.510 589 HA ILE 91 HA ILE 91 4.221 -2.779 7.687 590 HB ILE 91 HB ILE 91 1.651 -1.731 8.903 591 HG12 ILE 91 2HG1 ILE 91 4.224 -2.560 10.271 592 HG13 ILE 91 3HG1 ILE 91 3.755 -0.892 9.961 593 HG21 ILE 91 1HG2 ILE 91 1.448 -4.087 8.331 594 HG22 ILE 91 2HG2 ILE 91 1.545 -3.894 10.081 595 HG23 ILE 91 3HG2 ILE 91 2.953 -4.444 9.173 596 HD11 ILE 91 3HD1 ILE 91 3.292 -1.569 12.268 597 HD12 ILE 91 1HD1 ILE 91 2.228 -2.842 11.676 598 HD13 ILE 91 2HD1 ILE 91 1.814 -1.155 11.403 599 H LEU 92 H LEU 92 3.805 -4.107 6.028 600 HA LEU 92 HA LEU 92 1.250 -3.810 4.592 601 HB2 LEU 92 2HB LEU 92 3.947 -4.248 3.309 602 HB3 LEU 92 3HB LEU 92 2.415 -4.238 2.461 603 HG LEU 92 HG LEU 92 3.611 -1.877 3.912 604 HD11 LEU 92 1HD1 LEU 92 3.377 -2.425 0.962 605 HD12 LEU 92 2HD1 LEU 92 4.868 -2.473 1.906 606 HD13 LEU 92 3HD1 LEU 92 4.003 -0.948 1.703 607 HD21 LEU 92 3HD2 LEU 92 1.839 -0.596 2.810 608 HD22 LEU 92 1HD2 LEU 92 1.181 -1.813 3.905 609 HD23 LEU 92 2HD2 LEU 92 1.163 -2.095 2.164 610 H GLY 93 H GLY 93 0.585 -5.540 5.954 611 HA2 GLY 93 2HA GLY 93 0.389 -7.978 4.713 612 HA3 GLY 93 3HA GLY 93 1.727 -8.138 5.848 613 H SER 94 H SER 94 -1.428 -8.779 5.560 614 HA SER 94 HA SER 94 -2.033 -8.085 8.346 615 HB2 SER 94 2HB SER 94 -4.391 -8.466 7.756 616 HB3 SER 94 3HB SER 94 -3.651 -7.247 6.727 617 HG SER 94 HG SER 94 -4.919 -9.399 5.966 618 H ARG 95 H ARG 95 -1.011 -10.658 6.497 619 HA ARG 95 HA ARG 95 -2.203 -12.564 8.362 620 HB2 ARG 95 2HB ARG 95 -1.130 -12.979 5.593 621 HB3 ARG 95 3HB ARG 95 -1.422 -14.321 6.694 622 HG2 ARG 95 2HG ARG 95 -3.774 -13.672 6.859 623 HG3 ARG 95 3HG ARG 95 -3.478 -12.336 5.746 624 HD2 ARG 95 2HD ARG 95 -2.889 -13.888 3.986 625 HD3 ARG 95 3HD ARG 95 -3.035 -15.248 5.097 626 HE ARG 95 HE ARG 95 -5.475 -13.903 5.094 627 HH11 ARG 95 1HH1 ARG 95 -3.498 -15.665 2.812 628 HH12 ARG 95 2HH1 ARG 95 -4.847 -16.293 1.923 629 HH21 ARG 95 1HH2 ARG 95 -7.259 -14.718 3.927 630 HH22 ARG 95 2HH2 ARG 95 -7.000 -15.750 2.560 631 H GLU 96 H GLU 96 -0.950 -14.337 9.094 632 HA GLU 96 HA GLU 96 1.340 -13.347 10.465 633 HB2 GLU 96 2HB GLU 96 -0.427 -15.022 11.274 634 HB3 GLU 96 3HB GLU 96 0.429 -16.216 10.316 635 HG2 GLU 96 2HG GLU 96 1.204 -16.488 12.501 636 HG3 GLU 96 3HG GLU 96 2.486 -15.617 11.660 637 H ASN 97 H ASN 97 0.829 -15.587 7.793 638 HA ASN 97 HA ASN 97 3.754 -15.870 7.503 639 HB2 ASN 97 2HB ASN 97 3.371 -18.053 6.470 640 HB3 ASN 97 3HB ASN 97 2.643 -17.993 8.071 641 HD21 ASN 97 1HD2 ASN 97 0.423 -18.089 8.261 642 HD22 ASN 97 2HD2 ASN 97 -0.609 -18.514 6.940 643 H GLN 98 H GLN 98 1.881 -13.821 6.304 644 HA GLN 98 HA GLN 98 2.659 -14.349 3.546 645 HB2 GLN 98 2HB GLN 98 0.000 -14.601 4.422 646 HB3 GLN 98 3HB GLN 98 0.077 -13.128 3.465 647 HG2 GLN 98 2HG GLN 98 1.013 -14.327 1.600 648 HG3 GLN 98 3HG GLN 98 1.098 -15.805 2.556 649 HE21 GLN 98 1HE2 GLN 98 -0.176 -16.918 1.083 650 HE22 GLN 98 2HE2 GLN 98 -1.885 -16.651 0.930 651 H ASN 99 H ASN 99 3.863 -12.782 2.918 652 HA ASN 99 HA ASN 99 3.532 -10.069 3.919 653 HB2 ASN 99 2HB ASN 99 5.596 -11.336 2.093 654 HB3 ASN 99 3HB ASN 99 5.624 -9.654 2.597 655 HD21 ASN 99 1HD2 ASN 99 7.565 -11.820 3.016 656 HD22 ASN 99 2HD2 ASN 99 7.787 -11.923 4.725 657 H VAL 100 H VAL 100 3.340 -8.275 2.456 658 HA VAL 100 HA VAL 100 1.598 -8.912 0.217 659 HB VAL 100 HB VAL 100 2.575 -6.220 1.208 660 HG11 VAL 100 1HG1 VAL 100 0.844 -5.274 -0.265 661 HG12 VAL 100 2HG1 VAL 100 0.574 -6.878 -0.944 662 HG13 VAL 100 3HG1 VAL 100 2.127 -6.075 -1.167 663 HG21 VAL 100 3HG2 VAL 100 -0.101 -7.581 1.394 664 HG22 VAL 100 1HG2 VAL 100 0.287 -5.969 1.994 665 HG23 VAL 100 2HG2 VAL 100 1.053 -7.385 2.713 666 H VAL 101 H VAL 101 2.088 -8.973 -1.855 667 HA VAL 101 HA VAL 101 4.864 -8.289 -2.602 668 HB VAL 101 HB VAL 101 4.851 -9.949 -4.403 669 HG11 VAL 101 1HG1 VAL 101 5.705 -10.570 -2.226 670 HG12 VAL 101 2HG1 VAL 101 4.981 -11.945 -3.053 671 HG13 VAL 101 3HG1 VAL 101 4.104 -11.138 -1.747 672 HG21 VAL 101 3HG2 VAL 101 2.488 -10.005 -4.931 673 HG22 VAL 101 1HG2 VAL 101 2.126 -10.700 -3.353 674 HG23 VAL 101 2HG2 VAL 101 3.053 -11.627 -4.531 675 H ALA 102 H ALA 102 1.565 -7.659 -3.341 676 HA ALA 102 HA ALA 102 2.510 -5.621 -5.177 677 HB1 ALA 102 3HB ALA 102 2.075 -7.654 -6.588 678 HB2 ALA 102 1HB ALA 102 1.161 -6.215 -7.041 679 HB3 ALA 102 2HB ALA 102 0.371 -7.502 -6.150 680 H ILE 103 H ILE 103 1.272 -3.821 -5.227 681 HA ILE 103 HA ILE 103 -1.385 -3.961 -4.004 682 HB ILE 103 HB ILE 103 0.710 -1.874 -3.311 683 HG12 ILE 103 2HG1 ILE 103 -0.720 -3.818 -1.495 684 HG13 ILE 103 3HG1 ILE 103 0.908 -4.058 -2.121 685 HG21 ILE 103 1HG2 ILE 103 -1.459 -0.829 -3.545 686 HG22 ILE 103 2HG2 ILE 103 -0.996 -0.894 -1.845 687 HG23 ILE 103 3HG2 ILE 103 -2.184 -2.032 -2.478 688 HD11 ILE 103 3HD1 ILE 103 1.651 -2.037 -0.969 689 HD12 ILE 103 1HD1 ILE 103 0.956 -3.209 0.150 690 HD13 ILE 103 2HD1 ILE 103 0.019 -1.797 -0.339 691 H ASN 104 H ASN 104 -2.829 -3.101 -5.324 692 HA ASN 104 HA ASN 104 -2.042 -0.814 -6.997 693 HB2 ASN 104 2HB ASN 104 -2.247 -2.859 -8.370 694 HB3 ASN 104 3HB ASN 104 -3.898 -3.070 -7.791 695 HD21 ASN 104 1HD2 ASN 104 -4.681 -2.955 -9.915 696 HD22 ASN 104 2HD2 ASN 104 -4.776 -1.454 -10.769 697 H VAL 105 H VAL 105 -2.994 0.772 -6.015 698 HA VAL 105 HA VAL 105 -5.873 0.624 -5.481 699 HB VAL 105 HB VAL 105 -5.693 1.651 -3.212 700 HG11 VAL 105 1HG1 VAL 105 -5.093 -0.453 -2.058 701 HG12 VAL 105 2HG1 VAL 105 -4.486 -1.080 -3.593 702 HG13 VAL 105 3HG1 VAL 105 -6.199 -0.687 -3.414 703 HG21 VAL 105 3HG2 VAL 105 -3.399 2.506 -3.405 704 HG22 VAL 105 1HG2 VAL 105 -2.799 0.850 -3.435 705 HG23 VAL 105 2HG2 VAL 105 -3.594 1.470 -1.989 706 H GLU 106 H GLU 106 -7.019 2.427 -5.555 707 HA GLU 106 HA GLU 106 -5.684 5.008 -5.712 708 HB2 GLU 106 2HB GLU 106 -7.529 3.914 -7.855 709 HB3 GLU 106 3HB GLU 106 -7.128 5.617 -7.698 710 HG2 GLU 106 2HG GLU 106 -4.772 5.111 -8.082 711 HG3 GLU 106 3HG GLU 106 -5.151 3.397 -8.211 712 H SER 107 H SER 107 -7.134 6.748 -5.201 713 HA SER 107 HA SER 107 -9.676 5.829 -4.044 714 HB2 SER 107 2HB SER 107 -8.020 6.079 -2.254 715 HB3 SER 107 3HB SER 107 -7.728 7.744 -2.751 716 HG SER 107 HG SER 107 -9.606 6.781 -1.126 717 H GLY 108 H GLY 108 -11.381 7.209 -4.093 718 HA2 GLY 108 2HA GLY 108 -11.155 9.513 -5.863 719 HA3 GLY 108 3HA GLY 108 -12.646 8.831 -5.215 720 H ASP 109 H ASP 109 -10.929 8.806 -2.612 721 HA ASP 109 HA ASP 109 -11.833 11.425 -1.677 722 HB2 ASP 109 2HB ASP 109 -10.787 9.010 -0.171 723 HB3 ASP 109 3HB ASP 109 -11.258 10.523 0.592 724 H ASP 110 H ASP 110 -10.143 12.039 0.292 725 HA ASP 110 HA ASP 110 -7.625 12.478 -1.105 726 HB2 ASP 110 2HB ASP 110 -7.179 14.153 0.659 727 HB3 ASP 110 3HB ASP 110 -8.689 14.466 -0.180 728 H GLY 111 H GLY 111 -8.223 9.875 -0.122 729 HA2 GLY 111 2HA GLY 111 -6.677 8.291 0.661 730 HA3 GLY 111 3HA GLY 111 -5.913 9.531 1.630 731 H GLN 112 H GLN 112 -9.252 9.649 1.992 732 HA GLN 112 HA GLN 112 -9.209 8.812 4.694 733 HB2 GLN 112 2HB GLN 112 -10.881 10.375 3.683 734 HB3 GLN 112 3HB GLN 112 -11.607 9.005 2.857 735 HG2 GLN 112 2HG GLN 112 -12.106 7.986 5.041 736 HG3 GLN 112 3HG GLN 112 -11.432 9.411 5.832 737 HE21 GLN 112 1HE2 GLN 112 -14.099 8.096 4.100 738 HE22 GLN 112 2HE2 GLN 112 -15.163 9.434 4.318 739 H THR 113 H THR 113 -10.145 7.262 1.718 740 HA THR 113 HA THR 113 -9.999 4.643 3.013 741 HB THR 113 HB THR 113 -11.925 3.818 1.667 742 HG1 THR 113 HG1 THR 113 -12.507 6.570 1.120 743 HG21 THR 113 3HG2 THR 113 -13.727 4.873 2.987 744 HG22 THR 113 1HG2 THR 113 -12.603 6.132 3.498 745 HG23 THR 113 2HG2 THR 113 -12.339 4.458 3.985 746 H LEU 114 H LEU 114 -9.233 3.014 1.671 747 HA LEU 114 HA LEU 114 -8.256 3.914 -0.957 748 HB2 LEU 114 2HB LEU 114 -6.944 2.003 0.980 749 HB3 LEU 114 3HB LEU 114 -6.367 2.331 -0.642 750 HG LEU 114 HG LEU 114 -6.548 4.379 1.571 751 HD11 LEU 114 1HD1 LEU 114 -4.864 2.708 2.075 752 HD12 LEU 114 2HD1 LEU 114 -4.105 4.232 1.619 753 HD13 LEU 114 3HD1 LEU 114 -4.170 2.900 0.464 754 HD21 LEU 114 3HD2 LEU 114 -5.312 4.511 -1.179 755 HD22 LEU 114 1HD2 LEU 114 -5.196 5.764 0.057 756 HD23 LEU 114 2HD2 LEU 114 -6.762 5.363 -0.651 757 H ASN 115 H ASN 115 -8.956 2.753 -2.645 758 HA ASN 115 HA ASN 115 -10.082 0.079 -2.110 759 HB2 ASN 115 2HB ASN 115 -11.109 2.191 -4.019 760 HB3 ASN 115 3HB ASN 115 -11.725 0.548 -3.936 761 HD21 ASN 115 1HD2 ASN 115 -11.511 0.500 -0.983 762 HD22 ASN 115 2HD2 ASN 115 -12.836 1.461 -0.422 763 H GLY 116 H GLY 116 -9.598 -1.527 -3.587 764 HA2 GLY 116 2HA GLY 116 -8.870 -1.296 -6.205 765 HA3 GLY 116 3HA GLY 116 -7.375 -0.978 -5.347 766 H THR 117 H THR 117 -6.253 -2.720 -5.873 767 HA THR 117 HA THR 117 -7.253 -5.326 -4.969 768 HB THR 117 HB THR 117 -6.033 -6.357 -6.942 769 HG1 THR 117 HG1 THR 117 -5.064 -5.057 -8.306 770 HG21 THR 117 3HG2 THR 117 -7.891 -5.951 -8.522 771 HG22 THR 117 1HG2 THR 117 -8.437 -4.614 -7.510 772 HG23 THR 117 2HG2 THR 117 -8.462 -6.264 -6.883 773 H MET 118 H MET 118 -5.559 -6.862 -4.492 774 HA MET 118 HA MET 118 -2.860 -5.835 -4.256 775 HB2 MET 118 2HB MET 118 -2.704 -6.315 -1.869 776 HB3 MET 118 3HB MET 118 -3.896 -5.065 -2.186 777 HG2 MET 118 2HG MET 118 -5.692 -6.532 -1.777 778 HG3 MET 118 3HG MET 118 -4.645 -7.949 -1.824 779 HE1 MET 118 3HE MET 118 -2.589 -7.626 1.428 780 HE2 MET 118 1HE MET 118 -2.138 -6.959 -0.138 781 HE3 MET 118 2HE MET 118 -2.895 -8.544 -0.042 782 H THR 119 H THR 119 -1.335 -7.516 -3.677 783 HA THR 119 HA THR 119 -2.408 -10.240 -4.037 784 HB THR 119 HB THR 119 0.062 -9.188 -5.434 785 HG1 THR 119 HG1 THR 119 -1.379 -9.676 -7.324 786 HG21 THR 119 3HG2 THR 119 0.181 -11.576 -4.884 787 HG22 THR 119 1HG2 THR 119 0.025 -11.328 -6.621 788 HG23 THR 119 2HG2 THR 119 -1.372 -11.835 -5.676 789 H TYR 120 H TYR 120 -1.667 -11.671 -2.610 790 HA TYR 120 HA TYR 120 0.542 -10.919 -0.870 791 HB2 TYR 120 2HB TYR 120 -1.726 -12.835 -0.659 792 HB3 TYR 120 3HB TYR 120 -0.244 -13.234 0.205 793 HD1 TYR 120 HD2 TYR 120 0.755 -11.248 1.578 794 HD2 TYR 120 HD1 TYR 120 -3.322 -11.576 0.449 795 HE1 TYR 120 HE2 TYR 120 0.150 -9.731 3.395 796 HE2 TYR 120 HE1 TYR 120 -3.952 -10.049 2.277 797 HH TYR 120 HH TYR 120 -3.105 -9.188 4.366 798 H ALA 121 H ALA 121 2.141 -12.548 -0.282 799 HA ALA 121 HA ALA 121 3.831 -13.280 -2.224 800 HB1 ALA 121 3HB ALA 121 3.408 -14.917 0.265 801 HB2 ALA 121 1HB ALA 121 4.316 -13.407 0.175 802 HB3 ALA 121 2HB ALA 121 4.880 -14.828 -0.704 803 H GLY 122 H GLY 122 1.233 -15.470 -1.117 804 HA2 GLY 122 2HA GLY 122 1.551 -16.917 -3.633 805 HA3 GLY 122 3HA GLY 122 1.734 -17.836 -2.145 806 H GLU 123 H GLU 123 -0.485 -15.202 -2.923 807 HA GLU 123 HA GLU 123 -2.703 -17.044 -2.282 808 HB2 GLU 123 2HB GLU 123 -2.178 -15.107 -0.692 809 HB3 GLU 123 3HB GLU 123 -2.784 -14.055 -1.963 810 HG2 GLU 123 2HG GLU 123 -4.562 -14.412 -0.451 811 HG3 GLU 123 3HG GLU 123 -4.920 -15.367 -1.889 812 H GLY 124 H GLY 124 -2.176 -13.923 -3.912 813 HA2 GLY 124 2HA GLY 124 -2.576 -14.101 -6.422 814 HA3 GLY 124 3HA GLY 124 -4.144 -14.739 -5.935 815 HA PRO 125 HA PRO 125 -4.368 -10.089 -6.067 816 HB2 PRO 125 2HB PRO 125 -5.910 -9.752 -8.250 817 HB3 PRO 125 3HB PRO 125 -4.150 -9.884 -8.353 818 HG2 PRO 125 2HG PRO 125 -6.244 -11.897 -8.993 819 HG3 PRO 125 3HG PRO 125 -4.662 -11.635 -9.746 820 HD2 PRO 125 2HD PRO 125 -5.273 -13.613 -7.859 821 HD3 PRO 125 3HD PRO 125 -3.644 -13.078 -8.312 822 H ILE 126 H ILE 126 -5.752 -9.557 -4.521 823 HA ILE 126 HA ILE 126 -8.573 -10.348 -4.790 824 HB ILE 126 HB ILE 126 -8.718 -10.448 -2.316 825 HG12 ILE 126 2HG1 ILE 126 -5.693 -10.269 -2.404 826 HG13 ILE 126 3HG1 ILE 126 -6.757 -8.989 -1.839 827 HG21 ILE 126 1HG2 ILE 126 -8.441 -12.500 -3.598 828 HG22 ILE 126 2HG2 ILE 126 -7.599 -12.622 -2.052 829 HG23 ILE 126 3HG2 ILE 126 -6.688 -12.324 -3.531 830 HD11 ILE 126 3HD1 ILE 126 -6.410 -11.710 -0.606 831 HD12 ILE 126 1HD1 ILE 126 -7.543 -10.477 -0.046 832 HD13 ILE 126 2HD1 ILE 126 -5.804 -10.181 0.026 833 H GLY 127 H GLY 127 -10.073 -8.867 -3.617 834 HA2 GLY 127 2HA GLY 127 -9.475 -6.163 -4.341 835 HA3 GLY 127 3HA GLY 127 -10.940 -6.737 -3.557 836 H PHE 128 H PHE 128 -8.970 -4.435 -3.117 837 HA PHE 128 HA PHE 128 -8.438 -4.939 -0.273 838 HB2 PHE 128 2HB PHE 128 -6.392 -4.567 -1.557 839 HB3 PHE 128 3HB PHE 128 -7.047 -3.069 -2.202 840 HD1 PHE 128 HD1 PHE 128 -5.708 -4.719 0.796 841 HD2 PHE 128 HD2 PHE 128 -7.018 -1.053 -0.921 842 HE1 PHE 128 HE1 PHE 128 -4.718 -3.485 2.676 843 HE2 PHE 128 HE2 PHE 128 -6.030 0.181 0.962 844 HZ PHE 128 HZ PHE 128 -4.871 -1.034 2.757 845 H LYS 129 H LYS 129 -9.400 -3.683 1.189 846 HA LYS 129 HA LYS 129 -10.552 -1.118 0.372 847 HB2 LYS 129 2HB LYS 129 -12.369 -2.750 0.444 848 HB3 LYS 129 3HB LYS 129 -11.876 -3.259 2.049 849 HG2 LYS 129 2HG LYS 129 -12.459 -1.036 2.917 850 HG3 LYS 129 3HG LYS 129 -12.967 -0.550 1.295 851 HD2 LYS 129 2HD LYS 129 -14.646 -2.331 1.289 852 HD3 LYS 129 3HD LYS 129 -14.143 -2.812 2.912 853 HE2 LYS 129 2HE LYS 129 -14.808 -0.618 3.763 854 HE3 LYS 129 3HE LYS 129 -15.291 -0.131 2.137 855 HZ1 LYS 129 3HZ LYS 129 -16.970 -1.845 2.148 856 HZ2 LYS 129 1HZ LYS 129 -17.169 -0.838 3.488 857 HZ3 LYS 129 2HZ LYS 129 -16.479 -2.365 3.680 858 H GLY 130 H GLY 130 -9.078 0.156 1.447 859 HA2 GLY 130 2HA GLY 130 -8.626 -0.481 4.276 860 HA3 GLY 130 3HA GLY 130 -7.546 0.465 3.266 861 H THR 131 H THR 131 -8.773 1.098 5.786 862 HA THR 131 HA THR 131 -9.816 3.714 4.993 863 HB THR 131 HB THR 131 -11.869 2.454 5.277 864 HG1 THR 131 HG1 THR 131 -12.347 3.618 7.565 865 HG21 THR 131 3HG2 THR 131 -12.455 1.349 7.379 866 HG22 THR 131 1HG2 THR 131 -10.881 1.780 8.050 867 HG23 THR 131 2HG2 THR 131 -10.983 0.652 6.701 868 H LEU 132 H LEU 132 -9.485 5.318 6.435 869 HA LEU 132 HA LEU 132 -7.385 5.061 8.319 870 HB2 LEU 132 2HB LEU 132 -9.475 7.218 8.015 871 HB3 LEU 132 3HB LEU 132 -8.180 7.310 9.192 872 HG LEU 132 HG LEU 132 -7.739 7.128 6.207 873 HD11 LEU 132 1HD1 LEU 132 -8.873 9.208 6.816 874 HD12 LEU 132 2HD1 LEU 132 -7.204 9.490 6.312 875 HD13 LEU 132 3HD1 LEU 132 -7.626 9.524 8.024 876 HD21 LEU 132 3HD2 LEU 132 -5.884 6.280 7.535 877 HD22 LEU 132 1HD2 LEU 132 -5.885 7.751 8.503 878 HD23 LEU 132 2HD2 LEU 132 -5.463 7.821 6.792 879 H THR 133 H THR 133 -7.337 4.501 10.420 880 HA THR 133 HA THR 133 -9.786 3.578 11.623 881 HB THR 133 HB THR 133 -8.154 3.007 13.551 882 HG1 THR 133 HG1 THR 133 -6.431 4.294 12.922 883 HG21 THR 133 3HG2 THR 133 -9.077 1.356 11.983 884 HG22 THR 133 1HG2 THR 133 -7.401 0.994 12.401 885 HG23 THR 133 2HG2 THR 133 -7.780 1.728 10.845 Start of MODEL 20 1 H1 ALA 2 1H ALA 2 1.080 6.867 10.338 2 H2 ALA 2 2H ALA 2 0.865 5.614 9.228 3 H3 ALA 2 3H ALA 2 1.128 5.259 10.859 4 HA ALA 2 HA ALA 2 -0.958 6.330 11.437 5 HB1 ALA 2 3HB ALA 2 -2.524 6.951 9.664 6 HB2 ALA 2 1HB ALA 2 -1.315 6.545 8.446 7 HB3 ALA 2 2HB ALA 2 -1.040 7.895 9.547 8 H LEU 3 H LEU 3 -2.654 4.925 11.794 9 HA LEU 3 HA LEU 3 -2.053 2.224 10.894 10 HB2 LEU 3 2HB LEU 3 -2.536 3.098 13.361 11 HB3 LEU 3 3HB LEU 3 -4.195 2.876 12.875 12 HG LEU 3 HG LEU 3 -3.406 0.952 14.132 13 HD11 LEU 3 1HD1 LEU 3 -3.932 -0.838 12.572 14 HD12 LEU 3 2HD1 LEU 3 -3.786 0.291 11.225 15 HD13 LEU 3 3HD1 LEU 3 -5.058 0.509 12.428 16 HD21 LEU 3 3HD2 LEU 3 -1.034 1.137 13.619 17 HD22 LEU 3 1HD2 LEU 3 -1.341 0.613 11.963 18 HD23 LEU 3 2HD2 LEU 3 -1.634 -0.491 13.306 19 H TYR 4 H TYR 4 -3.305 1.117 9.555 20 HA TYR 4 HA TYR 4 -5.844 2.334 8.726 21 HB2 TYR 4 2HB TYR 4 -3.685 1.076 7.074 22 HB3 TYR 4 3HB TYR 4 -5.351 1.002 6.523 23 HD1 TYR 4 HD1 TYR 4 -2.698 3.421 7.562 24 HD2 TYR 4 HD2 TYR 4 -6.288 2.792 5.361 25 HE1 TYR 4 HE1 TYR 4 -2.479 5.665 6.560 26 HE2 TYR 4 HE2 TYR 4 -6.077 5.026 4.359 27 HH TYR 4 HH TYR 4 -5.032 7.122 4.730 28 H ASN 5 H ASN 5 -7.552 1.116 8.601 29 HA ASN 5 HA ASN 5 -7.458 -1.582 9.710 30 HB2 ASN 5 2HB ASN 5 -9.191 0.138 10.419 31 HB3 ASN 5 3HB ASN 5 -9.863 0.032 8.798 32 HD21 ASN 5 1HD2 ASN 5 -9.482 -1.520 11.851 33 HD22 ASN 5 2HD2 ASN 5 -10.609 -2.792 11.580 34 H VAL 6 H VAL 6 -7.742 -3.404 8.398 35 HA VAL 6 HA VAL 6 -7.932 -2.746 5.539 36 HB VAL 6 HB VAL 6 -6.274 -4.850 6.910 37 HG11 VAL 6 1HG1 VAL 6 -6.735 -4.475 3.947 38 HG12 VAL 6 2HG1 VAL 6 -7.252 -5.855 4.917 39 HG13 VAL 6 3HG1 VAL 6 -5.533 -5.545 4.669 40 HG21 VAL 6 3HG2 VAL 6 -5.340 -2.615 6.889 41 HG22 VAL 6 1HG2 VAL 6 -5.580 -2.507 5.145 42 HG23 VAL 6 2HG2 VAL 6 -4.432 -3.671 5.807 43 H GLU 7 H GLU 7 -9.478 -3.531 4.441 44 HA GLU 7 HA GLU 7 -10.808 -5.997 5.304 45 HB2 GLU 7 2HB GLU 7 -11.964 -3.537 3.971 46 HB3 GLU 7 3HB GLU 7 -12.845 -5.046 4.190 47 HG2 GLU 7 2HG GLU 7 -12.688 -4.841 6.582 48 HG3 GLU 7 3HG GLU 7 -11.692 -3.399 6.432 49 H ASN 8 H ASN 8 -11.068 -7.542 3.753 50 HA ASN 8 HA ASN 8 -9.888 -6.930 1.131 51 HB2 ASN 8 2HB ASN 8 -9.455 -9.335 2.885 52 HB3 ASN 8 3HB ASN 8 -9.138 -9.386 1.155 53 HD21 ASN 8 1HD2 ASN 8 -8.191 -6.603 1.073 54 HD22 ASN 8 2HD2 ASN 8 -6.624 -6.624 1.794 55 H GLN 9 H GLN 9 -10.759 -7.839 -0.653 56 HA GLN 9 HA GLN 9 -13.209 -9.444 -0.328 57 HB2 GLN 9 2HB GLN 9 -13.858 -7.162 -0.866 58 HB3 GLN 9 3HB GLN 9 -12.726 -7.125 -2.208 59 HG2 GLN 9 2HG GLN 9 -14.033 -8.865 -3.342 60 HG3 GLN 9 3HG GLN 9 -15.184 -8.846 -2.006 61 HE21 GLN 9 1HE2 GLN 9 -16.648 -7.205 -1.855 62 HE22 GLN 9 2HE2 GLN 9 -16.860 -6.011 -3.085 63 H TRP 10 H TRP 10 -13.018 -11.346 -1.380 64 HA TRP 10 HA TRP 10 -11.226 -11.394 -3.700 65 HB2 TRP 10 2HB TRP 10 -10.839 -13.851 -3.088 66 HB3 TRP 10 3HB TRP 10 -10.041 -12.632 -2.109 67 HD1 TRP 10 HD1 TRP 10 -12.963 -15.137 -1.949 68 HE1 TRP 10 HE1 TRP 10 -13.465 -15.631 0.524 69 HE3 TRP 10 HE3 TRP 10 -9.814 -11.738 0.207 70 HZ2 TRP 10 HZ2 TRP 10 -12.630 -14.706 3.063 71 HZ3 TRP 10 HZ3 TRP 10 -9.723 -11.603 2.662 72 HH2 TRP 10 HH2 TRP 10 -11.102 -13.054 4.062 73 H GLY 11 H GLY 11 -11.838 -12.414 -5.483 74 HA2 GLY 11 2HA GLY 11 -13.175 -14.079 -6.640 75 HA3 GLY 11 3HA GLY 11 -14.454 -13.772 -5.471 76 H GLY 12 H GLY 12 -15.248 -11.466 -5.438 77 HA2 GLY 12 2HA GLY 12 -14.950 -9.928 -7.834 78 HA3 GLY 12 3HA GLY 12 -16.480 -10.792 -7.774 79 H SER 13 H SER 13 -16.458 -8.065 -7.857 80 HA SER 13 HA SER 13 -16.445 -6.714 -5.431 81 HB2 SER 13 2HB SER 13 -17.996 -5.103 -6.678 82 HB3 SER 13 3HB SER 13 -16.420 -5.439 -7.405 83 HG SER 13 HG SER 13 -18.790 -5.776 -8.507 84 H SER 14 H SER 14 -18.792 -8.922 -6.626 85 HA SER 14 HA SER 14 -20.982 -7.964 -5.051 86 HB2 SER 14 2HB SER 14 -20.666 -10.688 -6.313 87 HB3 SER 14 3HB SER 14 -22.169 -9.871 -5.880 88 HG SER 14 HG SER 14 -22.009 -9.408 -7.971 89 H ALA 15 H ALA 15 -18.166 -9.519 -4.204 90 HA ALA 15 HA ALA 15 -19.307 -11.291 -2.213 91 HB1 ALA 15 3HB ALA 15 -16.990 -11.909 -1.733 92 HB2 ALA 15 1HB ALA 15 -16.422 -10.635 -2.809 93 HB3 ALA 15 2HB ALA 15 -17.324 -12.000 -3.461 94 HA PRO 16 HA PRO 16 -19.262 -8.417 1.160 95 HB2 PRO 16 2HB PRO 16 -18.752 -10.136 3.223 96 HB3 PRO 16 3HB PRO 16 -20.330 -10.015 2.438 97 HG2 PRO 16 2HG PRO 16 -18.131 -11.998 1.972 98 HG3 PRO 16 3HG PRO 16 -19.875 -12.282 2.129 99 HD2 PRO 16 2HD PRO 16 -18.683 -12.219 -0.267 100 HD3 PRO 16 3HD PRO 16 -20.315 -11.554 -0.029 101 H TRP 17 H TRP 17 -17.820 -7.264 2.435 102 HA TRP 17 HA TRP 17 -15.024 -7.738 1.924 103 HB2 TRP 17 2HB TRP 17 -16.474 -5.566 3.450 104 HB3 TRP 17 3HB TRP 17 -14.727 -5.625 3.264 105 HD1 TRP 17 HD1 TRP 17 -17.907 -4.750 1.380 106 HE1 TRP 17 HE1 TRP 17 -17.283 -3.632 -0.852 107 HE3 TRP 17 HE3 TRP 17 -12.865 -5.601 1.426 108 HZ2 TRP 17 HZ2 TRP 17 -14.960 -3.167 -2.391 109 HZ3 TRP 17 HZ3 TRP 17 -11.514 -4.786 -0.464 110 HH2 TRP 17 HH2 TRP 17 -12.542 -3.596 -2.332 111 H ASN 18 H ASN 18 -13.587 -8.589 3.309 112 HA ASN 18 HA ASN 18 -14.558 -9.281 6.003 113 HB2 ASN 18 2HB ASN 18 -12.764 -10.872 4.160 114 HB3 ASN 18 3HB ASN 18 -13.090 -11.293 5.837 115 HD21 ASN 18 1HD2 ASN 18 -13.665 -12.602 3.206 116 HD22 ASN 18 2HD2 ASN 18 -15.348 -12.991 3.272 117 H GLU 19 H GLU 19 -13.419 -8.363 7.569 118 HA GLU 19 HA GLU 19 -10.804 -7.228 6.968 119 HB2 GLU 19 2HB GLU 19 -11.008 -6.107 9.135 120 HB3 GLU 19 3HB GLU 19 -12.457 -5.844 8.182 121 HG2 GLU 19 2HG GLU 19 -13.277 -7.964 9.546 122 HG3 GLU 19 3HG GLU 19 -12.074 -7.370 10.686 123 H GLY 20 H GLY 20 -8.892 -8.185 7.565 124 HA2 GLY 20 2HA GLY 20 -9.049 -10.271 9.606 125 HA3 GLY 20 3HA GLY 20 -8.372 -10.649 8.030 126 H GLY 21 H GLY 21 -7.930 -7.541 9.556 127 HA2 GLY 21 2HA GLY 21 -5.738 -7.777 11.070 128 HA3 GLY 21 3HA GLY 21 -5.067 -7.954 9.457 129 H GLN 22 H GLN 22 -4.082 -5.964 10.790 130 HA GLN 22 HA GLN 22 -5.301 -3.627 9.547 131 HB2 GLN 22 2HB GLN 22 -4.824 -2.284 11.555 132 HB3 GLN 22 3HB GLN 22 -5.970 -3.569 11.893 133 HG2 GLN 22 2HG GLN 22 -4.069 -4.909 12.822 134 HG3 GLN 22 3HG GLN 22 -3.057 -3.477 12.644 135 HE21 GLN 22 1HE2 GLN 22 -5.365 -1.723 13.327 136 HE22 GLN 22 2HE2 GLN 22 -5.544 -1.851 15.038 137 H TRP 23 H TRP 23 -3.854 -2.159 8.737 138 HA TRP 23 HA TRP 23 -1.018 -3.020 8.760 139 HB2 TRP 23 2HB TRP 23 -2.571 -1.690 6.534 140 HB3 TRP 23 3HB TRP 23 -0.847 -2.008 6.499 141 HD1 TRP 23 HD1 TRP 23 -2.429 -4.962 7.982 142 HE1 TRP 23 HE1 TRP 23 -2.801 -6.789 6.215 143 HE3 TRP 23 HE3 TRP 23 -1.602 -2.190 3.774 144 HZ2 TRP 23 HZ2 TRP 23 -2.729 -7.026 3.416 145 HZ3 TRP 23 HZ3 TRP 23 -1.769 -3.312 1.578 146 HH2 TRP 23 HH2 TRP 23 -2.319 -5.664 1.416 147 H GLU 24 H GLU 24 0.376 -1.095 7.882 148 HA GLU 24 HA GLU 24 -0.703 1.407 8.922 149 HB2 GLU 24 2HB GLU 24 0.772 0.609 10.689 150 HB3 GLU 24 3HB GLU 24 2.093 0.437 9.536 151 HG2 GLU 24 2HG GLU 24 2.218 2.776 9.193 152 HG3 GLU 24 3HG GLU 24 0.716 3.051 10.062 153 H ILE 25 H ILE 25 -0.649 2.935 7.554 154 HA ILE 25 HA ILE 25 1.336 2.883 5.393 155 HB ILE 25 HB ILE 25 -1.617 3.534 5.132 156 HG12 ILE 25 2HG1 ILE 25 -0.008 1.335 3.820 157 HG13 ILE 25 3HG1 ILE 25 -1.010 1.103 5.245 158 HG21 ILE 25 1HG2 ILE 25 -1.153 3.860 2.742 159 HG22 ILE 25 2HG2 ILE 25 0.570 3.646 3.053 160 HG23 ILE 25 3HG2 ILE 25 -0.285 5.025 3.743 161 HD11 ILE 25 3HD1 ILE 25 -1.965 1.961 2.521 162 HD12 ILE 25 1HD1 ILE 25 -2.983 1.758 3.947 163 HD13 ILE 25 2HD1 ILE 25 -2.162 0.365 3.248 164 H GLY 26 H GLY 26 2.334 4.771 5.093 165 HA2 GLY 26 2HA GLY 26 2.551 7.116 5.038 166 HA3 GLY 26 3HA GLY 26 1.079 7.245 5.994 167 H SER 27 H SER 27 4.232 7.803 6.056 168 HA SER 27 HA SER 27 4.448 7.394 8.976 169 HB2 SER 27 2HB SER 27 6.761 7.607 7.052 170 HB3 SER 27 3HB SER 27 6.797 7.072 8.734 171 HG SER 27 HG SER 27 5.601 5.233 8.112 172 H ARG 28 H ARG 28 3.544 9.634 7.042 173 HA ARG 28 HA ARG 28 4.963 11.805 8.348 174 HB2 ARG 28 2HB ARG 28 4.734 11.469 5.348 175 HB3 ARG 28 3HB ARG 28 5.168 12.985 6.125 176 HG2 ARG 28 2HG ARG 28 7.168 11.975 7.056 177 HG3 ARG 28 3HG ARG 28 6.717 10.410 6.382 178 HD2 ARG 28 2HD ARG 28 6.902 11.327 4.125 179 HD3 ARG 28 3HD ARG 28 7.328 12.901 4.797 180 HE ARG 28 HE ARG 28 8.994 10.471 5.072 181 HH11 ARG 28 1HH1 ARG 28 8.679 13.948 4.673 182 HH12 ARG 28 2HH1 ARG 28 10.377 14.237 4.734 183 HH21 ARG 28 1HH2 ARG 28 11.279 10.876 5.144 184 HH22 ARG 28 2HH2 ARG 28 11.844 12.507 5.006 185 H SER 29 H SER 29 3.652 13.597 8.649 186 HA SER 29 HA SER 29 0.827 13.127 8.137 187 HB2 SER 29 2HB SER 29 0.533 15.072 9.705 188 HB3 SER 29 3HB SER 29 1.376 13.689 10.400 189 HG SER 29 HG SER 29 2.215 16.073 10.493 190 H ASP 30 H ASP 30 3.195 14.442 6.451 191 HA ASP 30 HA ASP 30 2.346 17.014 5.697 192 HB2 ASP 30 2HB ASP 30 3.913 14.982 4.102 193 HB3 ASP 30 3HB ASP 30 3.739 16.677 3.668 194 H GLN 31 H GLN 31 1.450 13.848 4.531 195 HA GLN 31 HA GLN 31 -0.904 14.768 3.291 196 HB2 GLN 31 2HB GLN 31 1.400 14.961 1.650 197 HB3 GLN 31 3HB GLN 31 0.446 13.614 1.041 198 HG2 GLN 31 2HG GLN 31 -0.617 16.393 1.520 199 HG3 GLN 31 3HG GLN 31 -0.107 15.761 -0.044 200 HE21 GLN 31 1HE2 GLN 31 -2.747 16.683 0.990 201 HE22 GLN 31 2HE2 GLN 31 -3.818 15.364 0.664 202 H ASN 32 H ASN 32 -2.227 13.092 2.528 203 HA ASN 32 HA ASN 32 -1.436 10.477 3.539 204 HB2 ASN 32 2HB ASN 32 -4.134 11.664 2.910 205 HB3 ASN 32 3HB ASN 32 -3.897 9.949 3.233 206 HD21 ASN 32 1HD2 ASN 32 -3.413 9.264 5.300 207 HD22 ASN 32 2HD2 ASN 32 -3.561 10.298 6.675 208 H VAL 33 H VAL 33 -2.565 8.663 2.309 209 HA VAL 33 HA VAL 33 -1.531 8.820 -0.427 210 HB VAL 33 HB VAL 33 -2.198 6.329 1.122 211 HG11 VAL 33 1HG1 VAL 33 -2.043 6.056 -1.284 212 HG12 VAL 33 2HG1 VAL 33 -0.703 5.257 -0.462 213 HG13 VAL 33 3HG1 VAL 33 -0.442 6.802 -1.273 214 HG21 VAL 33 3HG2 VAL 33 0.206 6.177 1.630 215 HG22 VAL 33 1HG2 VAL 33 -0.559 7.569 2.394 216 HG23 VAL 33 2HG2 VAL 33 0.431 7.790 0.952 217 H VAL 34 H VAL 34 -2.776 8.542 -2.165 218 HA VAL 34 HA VAL 34 -5.466 7.403 -1.790 219 HB VAL 34 HB VAL 34 -6.237 8.743 -3.721 220 HG11 VAL 34 1HG1 VAL 34 -6.660 9.582 -1.509 221 HG12 VAL 34 2HG1 VAL 34 -6.251 10.937 -2.565 222 HG13 VAL 34 3HG1 VAL 34 -5.055 10.304 -1.435 223 HG21 VAL 34 3HG2 VAL 34 -3.537 10.089 -3.528 224 HG22 VAL 34 1HG2 VAL 34 -4.876 10.607 -4.552 225 HG23 VAL 34 2HG2 VAL 34 -4.088 9.058 -4.850 226 H ALA 35 H ALA 35 -2.497 7.435 -3.640 227 HA ALA 35 HA ALA 35 -3.442 5.049 -5.021 228 HB1 ALA 35 3HB ALA 35 -2.358 5.915 -7.141 229 HB2 ALA 35 1HB ALA 35 -2.365 7.502 -6.381 230 HB3 ALA 35 2HB ALA 35 -3.883 6.668 -6.676 231 H ILE 36 H ILE 36 -1.942 3.551 -5.422 232 HA ILE 36 HA ILE 36 0.894 4.063 -5.082 233 HB ILE 36 HB ILE 36 -0.554 1.953 -3.434 234 HG12 ILE 36 2HG1 ILE 36 1.165 4.253 -2.483 235 HG13 ILE 36 3HG1 ILE 36 -0.597 4.241 -2.456 236 HG21 ILE 36 1HG2 ILE 36 1.524 1.075 -4.346 237 HG22 ILE 36 2HG2 ILE 36 1.658 1.307 -2.604 238 HG23 ILE 36 3HG2 ILE 36 2.408 2.461 -3.707 239 HD11 ILE 36 3HD1 ILE 36 -0.612 2.423 -0.892 240 HD12 ILE 36 1HD1 ILE 36 0.426 3.705 -0.272 241 HD13 ILE 36 2HD1 ILE 36 1.140 2.266 -0.994 242 H ASN 37 H ASN 37 1.943 2.963 -6.663 243 HA ASN 37 HA ASN 37 0.740 0.470 -7.646 244 HB2 ASN 37 2HB ASN 37 1.719 2.851 -9.160 245 HB3 ASN 37 3HB ASN 37 2.099 1.270 -9.824 246 HD21 ASN 37 1HD2 ASN 37 -0.836 1.796 -8.022 247 HD22 ASN 37 2HD2 ASN 37 -1.906 1.684 -9.375 248 H VAL 38 H VAL 38 2.079 -1.156 -7.060 249 HA VAL 38 HA VAL 38 4.934 -0.787 -7.300 250 HB VAL 38 HB VAL 38 5.433 -1.562 -4.973 251 HG11 VAL 38 1HG1 VAL 38 5.103 0.615 -3.885 252 HG12 VAL 38 2HG1 VAL 38 4.011 1.082 -5.189 253 HG13 VAL 38 3HG1 VAL 38 5.713 0.772 -5.532 254 HG21 VAL 38 3HG2 VAL 38 3.746 -1.326 -3.237 255 HG22 VAL 38 1HG2 VAL 38 3.234 -2.501 -4.450 256 HG23 VAL 38 2HG2 VAL 38 2.551 -0.876 -4.450 257 H GLU 39 H GLU 39 6.104 -2.699 -7.343 258 HA GLU 39 HA GLU 39 4.623 -5.192 -7.010 259 HB2 GLU 39 2HB GLU 39 4.546 -4.539 -9.407 260 HB3 GLU 39 3HB GLU 39 6.302 -4.498 -9.435 261 HG2 GLU 39 2HG GLU 39 6.416 -6.860 -9.055 262 HG3 GLU 39 3HG GLU 39 4.670 -6.946 -8.817 263 H SER 40 H SER 40 5.930 -6.924 -6.381 264 HA SER 40 HA SER 40 8.207 -6.199 -4.870 265 HB2 SER 40 2HB SER 40 8.363 -8.667 -4.443 266 HB3 SER 40 3HB SER 40 6.789 -7.955 -4.083 267 HG SER 40 HG SER 40 6.978 -8.799 -6.664 268 H GLY 41 H GLY 41 10.334 -6.485 -5.177 269 HA2 GLY 41 2HA GLY 41 11.263 -7.193 -7.846 270 HA3 GLY 41 3HA GLY 41 12.254 -6.598 -6.512 271 H ASP 42 H ASP 42 12.216 -8.117 -4.577 272 HA ASP 42 HA ASP 42 12.879 -10.799 -5.457 273 HB2 ASP 42 2HB ASP 42 13.101 -9.422 -2.763 274 HB3 ASP 42 3HB ASP 42 13.526 -11.113 -3.026 275 H ASP 43 H ASP 43 12.106 -12.321 -3.273 276 HA ASP 43 HA ASP 43 9.320 -12.614 -3.893 277 HB2 ASP 43 2HB ASP 43 11.124 -14.173 -2.047 278 HB3 ASP 43 3HB ASP 43 9.431 -14.569 -2.314 279 H GLY 44 H GLY 44 9.255 -10.255 -2.865 280 HA2 GLY 44 2HA GLY 44 7.541 -9.346 -1.479 281 HA3 GLY 44 3HA GLY 44 7.742 -10.705 -0.388 282 H GLN 45 H GLN 45 10.765 -10.194 -0.645 283 HA GLN 45 HA GLN 45 10.941 -8.742 1.760 284 HB2 GLN 45 2HB GLN 45 13.087 -9.589 -0.162 285 HB3 GLN 45 3HB GLN 45 13.428 -8.754 1.347 286 HG2 GLN 45 2HG GLN 45 12.282 -10.583 2.561 287 HG3 GLN 45 3HG GLN 45 12.104 -11.434 1.027 288 HE21 GLN 45 1HE2 GLN 45 14.256 -10.432 3.512 289 HE22 GLN 45 2HE2 GLN 45 15.624 -11.349 3.006 290 H THR 46 H THR 46 11.311 -7.690 -1.560 291 HA THR 46 HA THR 46 11.348 -4.989 -0.495 292 HB THR 46 HB THR 46 13.690 -5.510 -1.075 293 HG1 THR 46 HG1 THR 46 12.789 -3.371 -1.352 294 HG21 THR 46 3HG2 THR 46 14.341 -5.772 -3.439 295 HG22 THR 46 1HG2 THR 46 12.641 -5.838 -3.892 296 HG23 THR 46 2HG2 THR 46 13.335 -7.111 -2.889 297 H LEU 47 H LEU 47 9.991 -3.632 -1.445 298 HA LEU 47 HA LEU 47 8.613 -4.519 -3.889 299 HB2 LEU 47 2HB LEU 47 7.683 -2.590 -1.757 300 HB3 LEU 47 3HB LEU 47 6.749 -3.130 -3.133 301 HG LEU 47 HG LEU 47 7.638 -4.861 -0.823 302 HD11 LEU 47 1HD1 LEU 47 4.921 -3.785 -1.557 303 HD12 LEU 47 2HD1 LEU 47 5.908 -3.282 -0.188 304 HD13 LEU 47 3HD1 LEU 47 5.262 -4.921 -0.253 305 HD21 LEU 47 3HD2 LEU 47 5.920 -5.496 -3.219 306 HD22 LEU 47 1HD2 LEU 47 6.158 -6.548 -1.823 307 HD23 LEU 47 2HD2 LEU 47 7.521 -6.150 -2.866 308 H ASN 48 H ASN 48 8.715 -3.236 -5.638 309 HA ASN 48 HA ASN 48 9.810 -0.521 -5.283 310 HB2 ASN 48 2HB ASN 48 10.494 -2.467 -7.498 311 HB3 ASN 48 3HB ASN 48 10.934 -0.764 -7.509 312 HD21 ASN 48 1HD2 ASN 48 11.700 -3.882 -6.366 313 HD22 ASN 48 2HD2 ASN 48 13.096 -3.452 -5.443 314 H GLY 49 H GLY 49 8.991 1.099 -6.574 315 HA2 GLY 49 2HA GLY 49 7.519 0.924 -8.852 316 HA3 GLY 49 3HA GLY 49 6.346 0.627 -7.576 317 H THR 50 H THR 50 5.169 2.439 -7.669 318 HA THR 50 HA THR 50 6.542 4.949 -7.027 319 HB THR 50 HB THR 50 4.842 6.131 -8.499 320 HG1 THR 50 HG1 THR 50 4.368 3.433 -9.188 321 HG21 THR 50 3HG2 THR 50 6.117 5.771 -10.561 322 HG22 THR 50 1HG2 THR 50 6.809 4.296 -9.889 323 HG23 THR 50 2HG2 THR 50 7.198 5.860 -9.170 324 H MET 51 H MET 51 5.311 6.456 -5.824 325 HA MET 51 HA MET 51 2.833 5.401 -4.628 326 HB2 MET 51 2HB MET 51 4.780 5.281 -3.097 327 HB3 MET 51 3HB MET 51 5.035 7.006 -3.311 328 HG2 MET 51 2HG MET 51 2.676 7.302 -2.383 329 HG3 MET 51 3HG MET 51 2.781 5.604 -1.928 330 HE1 MET 51 3HE MET 51 2.438 8.308 0.000 331 HE2 MET 51 1HE MET 51 3.303 7.703 1.411 332 HE3 MET 51 2HE MET 51 2.196 6.646 0.532 333 H THR 52 H THR 52 1.146 6.881 -4.520 334 HA THR 52 HA THR 52 1.754 9.613 -5.419 335 HB THR 52 HB THR 52 -0.660 7.951 -6.118 336 HG1 THR 52 HG1 THR 52 0.425 8.424 -8.311 337 HG21 THR 52 3HG2 THR 52 -1.181 10.344 -5.960 338 HG22 THR 52 1HG2 THR 52 -1.236 9.789 -7.632 339 HG23 THR 52 2HG2 THR 52 0.155 10.704 -7.053 340 H TYR 53 H TYR 53 1.206 11.115 -4.013 341 HA TYR 53 HA TYR 53 -0.499 10.558 -1.739 342 HB2 TYR 53 2HB TYR 53 1.016 13.048 -2.558 343 HB3 TYR 53 3HB TYR 53 0.081 12.902 -1.077 344 HD1 TYR 53 HD2 TYR 53 0.859 11.357 0.712 345 HD2 TYR 53 HD1 TYR 53 3.207 12.142 -2.748 346 HE1 TYR 53 HE2 TYR 53 2.849 10.491 1.869 347 HE2 TYR 53 HE1 TYR 53 5.199 11.279 -1.602 348 HH TYR 53 HH TYR 53 5.051 9.479 1.216 349 H ALA 54 H ALA 54 -2.174 12.233 -1.149 350 HA ALA 54 HA ALA 54 -4.077 12.428 -3.257 351 HB1 ALA 54 3HB ALA 54 -5.490 13.561 -1.647 352 HB2 ALA 54 1HB ALA 54 -4.111 13.815 -0.578 353 HB3 ALA 54 2HB ALA 54 -4.701 12.182 -0.880 354 H GLY 55 H GLY 55 -3.877 13.806 -4.926 355 HA2 GLY 55 2HA GLY 55 -3.924 15.877 -5.941 356 HA3 GLY 55 3HA GLY 55 -3.628 16.623 -4.383 357 H GLU 56 H GLU 56 -1.409 14.133 -5.240 358 HA GLU 56 HA GLU 56 0.452 16.129 -6.322 359 HB2 GLU 56 2HB GLU 56 1.045 14.162 -4.115 360 HB3 GLU 56 3HB GLU 56 2.286 15.039 -4.995 361 HG2 GLU 56 2HG GLU 56 1.359 17.153 -4.212 362 HG3 GLU 56 3HG GLU 56 0.092 16.284 -3.348 363 H GLY 57 H GLY 57 2.359 15.140 -7.373 364 HA2 GLY 57 2HA GLY 57 1.461 13.064 -9.153 365 HA3 GLY 57 3HA GLY 57 2.977 13.947 -9.251 366 HA PRO 58 HA PRO 58 3.342 9.515 -7.356 367 HB2 PRO 58 2HB PRO 58 4.384 8.726 -10.000 368 HB3 PRO 58 3HB PRO 58 3.205 7.909 -8.969 369 HG2 PRO 58 2HG PRO 58 2.477 9.145 -11.240 370 HG3 PRO 58 3HG PRO 58 1.432 9.121 -9.806 371 HD2 PRO 58 2HD PRO 58 3.181 11.311 -10.842 372 HD3 PRO 58 3HD PRO 58 1.554 11.400 -10.144 373 H ILE 59 H ILE 59 5.207 8.924 -6.477 374 HA ILE 59 HA ILE 59 7.730 9.914 -7.628 375 HB ILE 59 HB ILE 59 8.635 10.156 -5.350 376 HG12 ILE 59 2HG1 ILE 59 5.800 9.676 -4.394 377 HG13 ILE 59 3HG1 ILE 59 7.117 8.516 -4.257 378 HG21 ILE 59 1HG2 ILE 59 7.414 12.192 -4.705 379 HG22 ILE 59 2HG2 ILE 59 6.127 11.758 -5.834 380 HG23 ILE 59 3HG2 ILE 59 7.745 12.125 -6.436 381 HD11 ILE 59 3HD1 ILE 59 6.731 9.676 -2.161 382 HD12 ILE 59 1HD1 ILE 59 7.012 11.226 -2.954 383 HD13 ILE 59 2HD1 ILE 59 8.326 10.060 -2.809 384 H GLY 60 H GLY 60 9.641 8.614 -6.682 385 HA2 GLY 60 2HA GLY 60 9.124 5.871 -7.332 386 HA3 GLY 60 3HA GLY 60 10.660 6.534 -6.788 387 H PHE 61 H PHE 61 8.923 4.123 -6.033 388 HA PHE 61 HA PHE 61 9.008 4.592 -3.122 389 HB2 PHE 61 2HB PHE 61 6.685 4.575 -3.903 390 HB3 PHE 61 3HB PHE 61 6.943 3.021 -4.684 391 HD1 PHE 61 HD2 PHE 61 7.226 0.977 -3.306 392 HD2 PHE 61 HD1 PHE 61 6.260 4.740 -1.566 393 HE1 PHE 61 HE2 PHE 61 6.500 -0.163 -1.255 394 HE2 PHE 61 HE1 PHE 61 5.532 3.601 0.487 395 HZ PHE 61 HZ PHE 61 5.650 1.149 0.645 396 H ARG 62 H ARG 62 10.259 3.199 -2.073 397 HA ARG 62 HA ARG 62 10.487 0.468 -3.070 398 HB2 ARG 62 2HB ARG 62 12.506 1.460 -3.913 399 HB3 ARG 62 3HB ARG 62 12.836 2.239 -2.373 400 HG2 ARG 62 2HG ARG 62 13.247 0.087 -1.336 401 HG3 ARG 62 3HG ARG 62 12.822 -0.739 -2.834 402 HD2 ARG 62 2HD ARG 62 15.243 -0.597 -2.525 403 HD3 ARG 62 3HD ARG 62 14.715 0.281 -3.961 404 HE ARG 62 HE ARG 62 15.461 2.215 -3.020 405 HH11 ARG 62 1HH1 ARG 62 15.187 -0.152 -0.420 406 HH12 ARG 62 2HH1 ARG 62 16.021 0.849 0.725 407 HH21 ARG 62 1HH2 ARG 62 16.626 3.475 -1.512 408 HH22 ARG 62 2HH2 ARG 62 16.853 2.900 0.103 409 H ALA 63 H ALA 63 10.351 -1.015 -1.528 410 HA ALA 63 HA ALA 63 10.610 -0.121 1.266 411 HB1 ALA 63 3HB ALA 63 8.496 -2.000 0.214 412 HB2 ALA 63 1HB ALA 63 8.231 -0.312 0.656 413 HB3 ALA 63 2HB ALA 63 8.702 -1.484 1.887 414 H THR 64 H THR 64 11.726 -1.445 2.589 415 HA THR 64 HA THR 64 12.499 -4.084 1.541 416 HB THR 64 HB THR 64 14.190 -2.209 3.227 417 HG1 THR 64 HG1 THR 64 15.355 -2.729 0.929 418 HG21 THR 64 3HG2 THR 64 14.852 -4.872 1.953 419 HG22 THR 64 1HG2 THR 64 14.656 -4.569 3.679 420 HG23 THR 64 2HG2 THR 64 15.994 -3.830 2.800 421 H LEU 65 H LEU 65 12.147 -5.774 2.888 422 HA LEU 65 HA LEU 65 10.483 -5.522 5.099 423 HB2 LEU 65 2HB LEU 65 11.841 -7.666 3.742 424 HB3 LEU 65 3HB LEU 65 11.805 -7.932 5.473 425 HG LEU 65 HG LEU 65 9.445 -7.494 3.699 426 HD11 LEU 65 1HD1 LEU 65 10.477 -9.713 3.489 427 HD12 LEU 65 2HD1 LEU 65 8.872 -9.780 4.212 428 HD13 LEU 65 3HD1 LEU 65 10.304 -9.925 5.232 429 HD21 LEU 65 3HD2 LEU 65 8.122 -7.991 5.701 430 HD22 LEU 65 1HD2 LEU 65 9.005 -6.470 5.801 431 HD23 LEU 65 2HD2 LEU 65 9.605 -7.892 6.653 432 H LEU 66 H LEU 66 10.783 -4.982 7.159 433 HA LEU 66 HA LEU 66 13.372 -4.951 8.333 434 HB2 LEU 66 2HB LEU 66 10.589 -4.778 9.501 435 HB3 LEU 66 3HB LEU 66 12.061 -4.575 10.428 436 HG LEU 66 HG LEU 66 11.175 -2.773 8.177 437 HD11 LEU 66 1HD1 LEU 66 9.683 -2.594 10.074 438 HD12 LEU 66 2HD1 LEU 66 10.717 -1.166 9.984 439 HD13 LEU 66 3HD1 LEU 66 11.056 -2.426 11.166 440 HD21 LEU 66 3HD2 LEU 66 12.946 -1.290 9.053 441 HD22 LEU 66 1HD2 LEU 66 13.583 -2.808 8.419 442 HD23 LEU 66 2HD2 LEU 66 13.437 -2.570 10.160 443 H GLY 67 H GLY 67 10.583 -7.077 8.080 444 HA2 GLY 67 2HA GLY 67 12.131 -9.330 8.811 445 HA3 GLY 67 3HA GLY 67 11.029 -8.853 10.095 446 H ASN 68 H ASN 68 8.537 -8.645 9.237 447 HA ASN 68 HA ASN 68 8.203 -10.864 7.393 448 HB2 ASN 68 2HB ASN 68 6.629 -10.374 9.939 449 HB3 ASN 68 3HB ASN 68 6.314 -11.641 8.762 450 HD21 ASN 68 1HD2 ASN 68 7.736 -13.391 8.630 451 HD22 ASN 68 2HD2 ASN 68 8.828 -13.766 9.912 452 H ASN 69 H ASN 69 5.951 -8.796 9.210 453 HA ASN 69 HA ASN 69 4.754 -8.028 6.642 454 HB2 ASN 69 2HB ASN 69 3.662 -7.729 9.450 455 HB3 ASN 69 3HB ASN 69 2.803 -7.327 7.971 456 HD21 ASN 69 1HD2 ASN 69 3.913 -9.740 6.584 457 HD22 ASN 69 2HD2 ASN 69 3.003 -11.056 7.236 458 H SER 70 H SER 70 6.913 -6.858 8.840 459 HA SER 70 HA SER 70 6.084 -4.070 8.650 460 HB2 SER 70 2HB SER 70 8.469 -5.217 10.105 461 HB3 SER 70 3HB SER 70 7.717 -3.642 10.353 462 HG SER 70 HG SER 70 6.876 -4.873 11.931 463 H TYR 71 H TYR 71 6.869 -2.803 7.107 464 HA TYR 71 HA TYR 71 9.376 -3.579 5.767 465 HB2 TYR 71 2HB TYR 71 6.942 -2.182 4.650 466 HB3 TYR 71 3HB TYR 71 8.468 -2.315 3.795 467 HD1 TYR 71 HD1 TYR 71 5.495 -4.112 4.953 468 HD2 TYR 71 HD2 TYR 71 9.156 -4.420 2.812 469 HE1 TYR 71 HE1 TYR 71 4.746 -6.252 3.991 470 HE2 TYR 71 HE2 TYR 71 8.421 -6.554 1.847 471 HH TYR 71 HH TYR 71 5.430 -7.561 1.675 472 H GLU 72 H GLU 72 10.828 -1.966 5.232 473 HA GLU 72 HA GLU 72 10.355 0.645 6.478 474 HB2 GLU 72 2HB GLU 72 12.410 -0.635 7.166 475 HB3 GLU 72 3HB GLU 72 12.966 -0.539 5.500 476 HG2 GLU 72 2HG GLU 72 13.060 1.871 5.632 477 HG3 GLU 72 3HG GLU 72 12.399 1.832 7.264 478 H VAL 73 H VAL 73 10.020 2.319 5.172 479 HA VAL 73 HA VAL 73 10.160 1.798 2.301 480 HB VAL 73 HB VAL 73 8.439 3.680 3.908 481 HG11 VAL 73 1HG1 VAL 73 7.383 4.326 1.795 482 HG12 VAL 73 2HG1 VAL 73 8.577 3.381 0.908 483 HG13 VAL 73 3HG1 VAL 73 9.084 4.792 1.836 484 HG21 VAL 73 3HG2 VAL 73 7.736 1.356 3.947 485 HG22 VAL 73 1HG2 VAL 73 7.788 1.292 2.183 486 HG23 VAL 73 2HG2 VAL 73 6.609 2.324 2.992 487 H GLU 74 H GLU 74 11.323 2.935 1.010 488 HA GLU 74 HA GLU 74 12.488 5.482 1.855 489 HB2 GLU 74 2HB GLU 74 13.825 3.237 0.320 490 HB3 GLU 74 3HB GLU 74 14.508 4.844 0.531 491 HG2 GLU 74 2HG GLU 74 14.614 4.501 2.945 492 HG3 GLU 74 3HG GLU 74 13.886 2.907 2.758 493 H ASN 75 H ASN 75 11.951 7.058 0.445 494 HA ASN 75 HA ASN 75 10.799 6.202 -2.122 495 HB2 ASN 75 2HB ASN 75 10.043 8.522 -0.355 496 HB3 ASN 75 3HB ASN 75 9.529 8.402 -2.034 497 HD21 ASN 75 1HD2 ASN 75 7.835 8.475 0.245 498 HD22 ASN 75 2HD2 ASN 75 6.963 6.984 0.279 499 H GLN 76 H GLN 76 11.041 7.541 -3.926 500 HA GLN 76 HA GLN 76 13.558 9.072 -3.854 501 HB2 GLN 76 2HB GLN 76 13.566 6.924 -5.149 502 HB3 GLN 76 3HB GLN 76 12.344 7.620 -6.202 503 HG2 GLN 76 2HG GLN 76 13.900 9.376 -6.849 504 HG3 GLN 76 3HG GLN 76 15.127 8.673 -5.795 505 HE21 GLN 76 1HE2 GLN 76 16.566 8.163 -7.332 506 HE22 GLN 76 2HE2 GLN 76 16.300 6.988 -8.574 507 H TRP 77 H TRP 77 13.220 11.183 -4.060 508 HA TRP 77 HA TRP 77 11.319 12.112 -6.044 509 HB2 TRP 77 2HB TRP 77 10.228 13.689 -4.566 510 HB3 TRP 77 3HB TRP 77 10.083 12.082 -3.869 511 HD1 TRP 77 HD1 TRP 77 12.115 15.347 -3.375 512 HE1 TRP 77 HE1 TRP 77 12.784 15.511 -0.898 513 HE3 TRP 77 HE3 TRP 77 10.371 10.818 -1.755 514 HZ2 TRP 77 HZ2 TRP 77 12.597 13.940 1.430 515 HZ3 TRP 77 HZ3 TRP 77 10.657 10.232 0.621 516 HH2 TRP 77 HH2 TRP 77 11.745 11.759 2.174 517 H GLY 78 H GLY 78 11.619 14.418 -6.556 518 HA2 GLY 78 2HA GLY 78 12.954 16.366 -6.621 519 HA3 GLY 78 3HA GLY 78 14.220 15.499 -5.763 520 H GLY 79 H GLY 79 13.285 13.372 -7.981 521 HA2 GLY 79 2HA GLY 79 13.749 13.731 -10.478 522 HA3 GLY 79 3HA GLY 79 15.326 14.255 -9.901 523 H ASP 80 H ASP 80 14.679 11.967 -11.670 524 HA ASP 80 HA ASP 80 14.791 9.544 -10.321 525 HB2 ASP 80 2HB ASP 80 14.178 9.757 -12.670 526 HB3 ASP 80 3HB ASP 80 15.798 10.316 -13.062 527 H SER 81 H SER 81 17.358 11.705 -11.357 528 HA SER 81 HA SER 81 19.485 9.916 -10.855 529 HB2 SER 81 2HB SER 81 20.874 12.016 -10.943 530 HB3 SER 81 3HB SER 81 19.855 11.730 -12.349 531 HG SER 81 HG SER 81 19.698 13.886 -11.639 532 H ALA 82 H ALA 82 17.488 11.667 -8.734 533 HA ALA 82 HA ALA 82 19.398 12.105 -6.642 534 HB1 ALA 82 3HB ALA 82 16.378 12.125 -6.526 535 HB2 ALA 82 1HB ALA 82 17.398 13.518 -6.883 536 HB3 ALA 82 2HB ALA 82 17.471 12.758 -5.295 537 HA PRO 83 HA PRO 83 19.253 8.037 -4.869 538 HB2 PRO 83 2HB PRO 83 20.236 8.567 -2.434 539 HB3 PRO 83 3HB PRO 83 21.252 8.684 -3.879 540 HG2 PRO 83 2HG PRO 83 19.844 10.872 -2.386 541 HG3 PRO 83 3HG PRO 83 21.519 10.819 -2.962 542 HD2 PRO 83 2HD PRO 83 19.557 12.094 -4.332 543 HD3 PRO 83 3HD PRO 83 20.918 11.294 -5.145 544 H TRP 84 H TRP 84 18.056 6.795 -3.354 545 HA TRP 84 HA TRP 84 15.519 7.697 -2.734 546 HB2 TRP 84 2HB TRP 84 17.054 5.415 -1.476 547 HB3 TRP 84 3HB TRP 84 15.315 5.650 -1.397 548 HD1 TRP 84 HD1 TRP 84 18.074 4.508 -3.762 549 HE1 TRP 84 HE1 TRP 84 17.009 3.314 -5.775 550 HE3 TRP 84 HE3 TRP 84 13.164 5.560 -2.826 551 HZ2 TRP 84 HZ2 TRP 84 14.437 2.879 -6.829 552 HZ3 TRP 84 HZ3 TRP 84 11.463 4.715 -4.389 553 HH2 TRP 84 HH2 TRP 84 12.085 3.404 -6.347 554 H HIS 85 H HIS 85 14.606 8.512 -1.032 555 HA HIS 85 HA HIS 85 16.285 9.245 1.293 556 HB2 HIS 85 2HB HIS 85 13.854 10.689 0.205 557 HB3 HIS 85 3HB HIS 85 14.699 11.131 1.682 558 HD1 HIS 85 HD1 HIS 85 17.256 11.953 1.317 559 HD2 HIS 85 HD2 HIS 85 14.862 11.793 -2.078 560 HE1 HIS 85 HE1 HIS 85 18.439 13.345 -0.402 561 H SER 86 H SER 86 15.434 8.946 3.390 562 HA SER 86 HA SER 86 13.874 6.646 3.670 563 HB2 SER 86 2HB SER 86 13.863 7.352 6.121 564 HB3 SER 86 3HB SER 86 15.442 7.128 5.369 565 HG SER 86 HG SER 86 14.200 9.439 6.268 566 H GLY 87 H GLY 87 11.790 6.324 3.708 567 HA2 GLY 87 2HA GLY 87 9.990 8.641 3.707 568 HA3 GLY 87 3HA GLY 87 9.578 7.012 3.181 569 H GLY 88 H GLY 88 10.281 5.453 5.232 570 HA2 GLY 88 2HA GLY 88 10.029 5.980 7.822 571 HA3 GLY 88 3HA GLY 88 8.370 6.229 7.290 572 H ASN 89 H ASN 89 8.048 4.400 8.869 573 HA ASN 89 HA ASN 89 8.638 1.827 7.575 574 HB2 ASN 89 2HB ASN 89 8.020 2.429 10.469 575 HB3 ASN 89 3HB ASN 89 8.188 0.804 9.811 576 HD21 ASN 89 1HD2 ASN 89 10.225 0.167 8.998 577 HD22 ASN 89 2HD2 ASN 89 11.674 0.917 9.561 578 H TRP 90 H TRP 90 7.003 0.316 7.189 579 HA TRP 90 HA TRP 90 4.245 1.216 7.618 580 HB2 TRP 90 2HB TRP 90 5.468 0.309 4.992 581 HB3 TRP 90 3HB TRP 90 3.741 0.319 5.286 582 HD1 TRP 90 HD1 TRP 90 5.621 3.319 6.619 583 HE1 TRP 90 HE1 TRP 90 5.128 5.354 5.161 584 HE3 TRP 90 HE3 TRP 90 3.205 0.977 2.768 585 HZ2 TRP 90 HZ2 TRP 90 3.875 5.912 2.685 586 HZ3 TRP 90 HZ3 TRP 90 2.394 2.332 0.897 587 HH2 TRP 90 HH2 TRP 90 2.719 4.747 0.853 588 H ILE 91 H ILE 91 2.731 -0.571 7.403 589 HA ILE 91 HA ILE 91 3.972 -3.238 7.721 590 HB ILE 91 HB ILE 91 1.453 -2.192 9.066 591 HG12 ILE 91 2HG1 ILE 91 4.046 -3.133 10.310 592 HG13 ILE 91 3HG1 ILE 91 3.632 -1.443 10.051 593 HG21 ILE 91 1HG2 ILE 91 2.699 -4.937 9.212 594 HG22 ILE 91 2HG2 ILE 91 1.180 -4.525 8.415 595 HG23 ILE 91 3HG2 ILE 91 1.325 -4.380 10.166 596 HD11 ILE 91 3HD1 ILE 91 3.236 -2.114 12.349 597 HD12 ILE 91 1HD1 ILE 91 2.135 -3.380 11.804 598 HD13 ILE 91 2HD1 ILE 91 1.726 -1.683 11.551 599 H LEU 92 H LEU 92 3.406 -4.622 6.122 600 HA LEU 92 HA LEU 92 0.885 -4.135 4.680 601 HB2 LEU 92 2HB LEU 92 3.552 -4.585 3.338 602 HB3 LEU 92 3HB LEU 92 2.010 -4.469 2.519 603 HG LEU 92 HG LEU 92 3.328 -2.230 4.068 604 HD11 LEU 92 1HD1 LEU 92 4.540 -2.779 2.027 605 HD12 LEU 92 2HD1 LEU 92 3.725 -1.224 1.891 606 HD13 LEU 92 3HD1 LEU 92 3.049 -2.643 1.095 607 HD21 LEU 92 3HD2 LEU 92 0.894 -2.064 4.088 608 HD22 LEU 92 1HD2 LEU 92 0.856 -2.255 2.335 609 HD23 LEU 92 2HD2 LEU 92 1.599 -0.824 3.050 610 H GLY 93 H GLY 93 0.103 -6.003 5.833 611 HA2 GLY 93 2HA GLY 93 -0.086 -8.286 4.351 612 HA3 GLY 93 3HA GLY 93 1.292 -8.579 5.398 613 H SER 94 H SER 94 -1.991 -9.039 5.111 614 HA SER 94 HA SER 94 -2.563 -8.871 7.954 615 HB2 SER 94 2HB SER 94 -4.299 -9.825 5.661 616 HB3 SER 94 3HB SER 94 -4.833 -9.548 7.320 617 HG SER 94 HG SER 94 -5.310 -7.754 6.045 618 H ARG 95 H ARG 95 -0.932 -10.982 6.103 619 HA ARG 95 HA ARG 95 -1.780 -13.290 7.711 620 HB2 ARG 95 2HB ARG 95 -0.696 -13.266 4.888 621 HB3 ARG 95 3HB ARG 95 -0.892 -14.718 5.848 622 HG2 ARG 95 2HG ARG 95 -3.325 -14.336 5.901 623 HG3 ARG 95 3HG ARG 95 -3.105 -12.892 4.905 624 HD2 ARG 95 2HD ARG 95 -2.066 -14.294 3.156 625 HD3 ARG 95 3HD ARG 95 -2.372 -15.722 4.136 626 HE ARG 95 HE ARG 95 -4.808 -14.400 3.717 627 HH11 ARG 95 1HH1 ARG 95 -2.398 -16.260 1.971 628 HH12 ARG 95 2HH1 ARG 95 -3.456 -16.720 0.682 629 HH21 ARG 95 1HH2 ARG 95 -6.272 -15.048 1.981 630 HH22 ARG 95 2HH2 ARG 95 -5.662 -16.036 0.705 631 H GLU 96 H GLU 96 -0.037 -14.713 8.324 632 HA GLU 96 HA GLU 96 2.129 -13.221 9.379 633 HB2 GLU 96 2HB GLU 96 1.150 -15.124 10.539 634 HB3 GLU 96 3HB GLU 96 1.688 -16.200 9.259 635 HG2 GLU 96 2HG GLU 96 4.016 -15.668 9.816 636 HG3 GLU 96 3HG GLU 96 3.451 -14.633 11.126 637 H ASN 97 H ASN 97 2.275 -16.057 7.223 638 HA ASN 97 HA ASN 97 4.923 -15.133 6.339 639 HB2 ASN 97 2HB ASN 97 3.716 -17.900 6.450 640 HB3 ASN 97 3HB ASN 97 5.235 -17.540 5.638 641 HD21 ASN 97 1HD2 ASN 97 4.627 -19.231 7.968 642 HD22 ASN 97 2HD2 ASN 97 5.640 -18.648 9.240 643 H GLN 98 H GLN 98 2.618 -14.036 5.167 644 HA GLN 98 HA GLN 98 2.641 -15.286 2.492 645 HB2 GLN 98 2HB GLN 98 0.435 -14.821 3.857 646 HB3 GLN 98 3HB GLN 98 0.656 -13.187 3.248 647 HG2 GLN 98 2HG GLN 98 -0.697 -14.089 1.641 648 HG3 GLN 98 3HG GLN 98 0.901 -14.382 0.952 649 HE21 GLN 98 1HE2 GLN 98 0.261 -16.134 -0.255 650 HE22 GLN 98 2HE2 GLN 98 -0.179 -17.648 0.459 651 H ASN 99 H ASN 99 2.200 -12.070 3.918 652 HA ASN 99 HA ASN 99 3.131 -10.057 3.573 653 HB2 ASN 99 2HB ASN 99 5.219 -11.598 2.029 654 HB3 ASN 99 3HB ASN 99 5.301 -9.864 2.324 655 HD21 ASN 99 1HD2 ASN 99 7.252 -11.650 3.187 656 HD22 ASN 99 2HD2 ASN 99 7.256 -11.664 4.918 657 H VAL 100 H VAL 100 3.139 -8.341 2.180 658 HA VAL 100 HA VAL 100 1.467 -8.756 -0.171 659 HB VAL 100 HB VAL 100 2.561 -6.207 1.040 660 HG11 VAL 100 1HG1 VAL 100 2.309 -5.976 -1.401 661 HG12 VAL 100 2HG1 VAL 100 1.140 -5.000 -0.513 662 HG13 VAL 100 3HG1 VAL 100 0.631 -6.513 -1.264 663 HG21 VAL 100 3HG2 VAL 100 0.214 -5.827 1.633 664 HG22 VAL 100 1HG2 VAL 100 0.839 -7.310 2.350 665 HG23 VAL 100 2HG2 VAL 100 -0.208 -7.390 0.935 666 H VAL 101 H VAL 101 2.056 -8.731 -2.208 667 HA VAL 101 HA VAL 101 4.889 -8.142 -2.815 668 HB VAL 101 HB VAL 101 4.825 -9.707 -4.713 669 HG11 VAL 101 1HG1 VAL 101 5.717 -10.432 -2.586 670 HG12 VAL 101 2HG1 VAL 101 4.894 -11.767 -3.393 671 HG13 VAL 101 3HG1 VAL 101 4.109 -10.925 -2.056 672 HG21 VAL 101 3HG2 VAL 101 2.427 -9.683 -5.165 673 HG22 VAL 101 1HG2 VAL 101 2.119 -10.499 -3.634 674 HG23 VAL 101 2HG2 VAL 101 3.001 -11.331 -4.917 675 H ALA 102 H ALA 102 1.624 -7.425 -3.687 676 HA ALA 102 HA ALA 102 2.675 -5.368 -5.467 677 HB1 ALA 102 3HB ALA 102 1.329 -5.925 -7.365 678 HB2 ALA 102 1HB ALA 102 0.550 -7.245 -6.494 679 HB3 ALA 102 2HB ALA 102 2.255 -7.356 -6.920 680 H ILE 103 H ILE 103 1.435 -3.546 -5.598 681 HA ILE 103 HA ILE 103 -1.221 -3.609 -4.357 682 HB ILE 103 HB ILE 103 0.962 -1.618 -3.698 683 HG12 ILE 103 2HG1 ILE 103 0.988 -3.737 -2.406 684 HG13 ILE 103 3HG1 ILE 103 0.677 -2.324 -1.404 685 HG21 ILE 103 1HG2 ILE 103 -1.100 -0.409 -4.040 686 HG22 ILE 103 2HG2 ILE 103 -0.691 -0.437 -2.326 687 HG23 ILE 103 3HG2 ILE 103 -1.953 -1.499 -2.949 688 HD11 ILE 103 3HD1 ILE 103 -1.367 -4.315 -2.373 689 HD12 ILE 103 1HD1 ILE 103 -1.725 -2.865 -1.437 690 HD13 ILE 103 2HD1 ILE 103 -0.750 -4.150 -0.731 691 H ASN 104 H ASN 104 -2.673 -2.725 -5.612 692 HA ASN 104 HA ASN 104 -1.906 -0.463 -7.330 693 HB2 ASN 104 2HB ASN 104 -2.144 -2.486 -8.734 694 HB3 ASN 104 3HB ASN 104 -3.778 -2.711 -8.117 695 HD21 ASN 104 1HD2 ASN 104 -4.609 -2.588 -10.215 696 HD22 ASN 104 2HD2 ASN 104 -4.740 -1.080 -11.053 697 H VAL 105 H VAL 105 -2.768 1.081 -6.226 698 HA VAL 105 HA VAL 105 -5.662 1.002 -5.639 699 HB VAL 105 HB VAL 105 -5.276 2.292 -3.497 700 HG11 VAL 105 1HG1 VAL 105 -5.866 -0.055 -3.423 701 HG12 VAL 105 2HG1 VAL 105 -4.668 0.287 -2.177 702 HG13 VAL 105 3HG1 VAL 105 -4.182 -0.520 -3.666 703 HG21 VAL 105 3HG2 VAL 105 -3.010 3.041 -3.914 704 HG22 VAL 105 1HG2 VAL 105 -2.445 1.370 -3.945 705 HG23 VAL 105 2HG2 VAL 105 -3.067 2.062 -2.447 706 H GLU 106 H GLU 106 -6.799 2.755 -6.157 707 HA GLU 106 HA GLU 106 -5.352 5.287 -6.731 708 HB2 GLU 106 2HB GLU 106 -7.253 3.849 -8.586 709 HB3 GLU 106 3HB GLU 106 -6.745 5.512 -8.820 710 HG2 GLU 106 2HG GLU 106 -4.461 4.825 -9.112 711 HG3 GLU 106 3HG GLU 106 -4.878 3.154 -8.730 712 H SER 107 H SER 107 -7.039 4.418 -4.732 713 HA SER 107 HA SER 107 -9.209 6.448 -4.913 714 HB2 SER 107 2HB SER 107 -9.699 3.639 -4.058 715 HB3 SER 107 3HB SER 107 -10.900 4.931 -3.994 716 HG SER 107 HG SER 107 -9.815 4.883 -6.431 717 H GLY 108 H GLY 108 -10.004 7.414 -3.162 718 HA2 GLY 108 2HA GLY 108 -10.103 6.893 -0.586 719 HA3 GLY 108 3HA GLY 108 -8.380 7.202 -0.764 720 H ASP 109 H ASP 109 -11.190 8.635 0.148 721 HA ASP 109 HA ASP 109 -10.709 11.220 -1.060 722 HB2 ASP 109 2HB ASP 109 -13.018 10.480 -0.542 723 HB3 ASP 109 3HB ASP 109 -12.601 10.415 1.165 724 H ASP 110 H ASP 110 -8.992 12.308 -0.410 725 HA ASP 110 HA ASP 110 -7.368 13.252 0.862 726 HB2 ASP 110 2HB ASP 110 -9.659 13.222 2.801 727 HB3 ASP 110 3HB ASP 110 -8.070 13.759 3.327 728 H GLY 111 H GLY 111 -7.853 10.267 0.863 729 HA2 GLY 111 2HA GLY 111 -6.435 8.539 1.510 730 HA3 GLY 111 3HA GLY 111 -5.624 9.662 2.587 731 H GLN 112 H GLN 112 -9.012 9.646 2.959 732 HA GLN 112 HA GLN 112 -8.932 8.637 5.595 733 HB2 GLN 112 2HB GLN 112 -10.722 10.126 4.684 734 HB3 GLN 112 3HB GLN 112 -11.320 8.769 3.739 735 HG2 GLN 112 2HG GLN 112 -11.744 7.538 5.835 736 HG3 GLN 112 3HG GLN 112 -11.224 8.959 6.741 737 HE21 GLN 112 1HE2 GLN 112 -13.775 7.667 6.836 738 HE22 GLN 112 2HE2 GLN 112 -14.946 8.836 6.343 739 H THR 113 H THR 113 -9.618 7.243 2.520 740 HA THR 113 HA THR 113 -9.345 4.576 3.661 741 HB THR 113 HB THR 113 -11.064 3.679 2.152 742 HG1 THR 113 HG1 THR 113 -12.080 6.205 1.545 743 HG21 THR 113 3HG2 THR 113 -12.114 5.962 3.834 744 HG22 THR 113 1HG2 THR 113 -11.797 4.320 4.389 745 HG23 THR 113 2HG2 THR 113 -13.080 4.620 3.217 746 H LEU 114 H LEU 114 -8.742 3.013 1.960 747 HA LEU 114 HA LEU 114 -7.522 4.255 -0.398 748 HB2 LEU 114 2HB LEU 114 -5.825 3.860 1.410 749 HB3 LEU 114 3HB LEU 114 -6.205 2.154 1.333 750 HG LEU 114 HG LEU 114 -5.387 2.090 -0.997 751 HD11 LEU 114 1HD1 LEU 114 -4.145 4.018 -1.872 752 HD12 LEU 114 2HD1 LEU 114 -4.653 4.969 -0.476 753 HD13 LEU 114 3HD1 LEU 114 -5.852 4.386 -1.631 754 HD21 LEU 114 3HD2 LEU 114 -3.008 2.373 -0.463 755 HD22 LEU 114 1HD2 LEU 114 -3.870 1.550 0.837 756 HD23 LEU 114 2HD2 LEU 114 -3.448 3.253 0.998 757 H ASN 115 H ASN 115 -8.481 3.303 -2.130 758 HA ASN 115 HA ASN 115 -9.368 0.507 -1.767 759 HB2 ASN 115 2HB ASN 115 -10.762 2.251 -3.790 760 HB3 ASN 115 3HB ASN 115 -11.329 0.821 -2.973 761 HD21 ASN 115 1HD2 ASN 115 -10.532 1.828 -0.326 762 HD22 ASN 115 2HD2 ASN 115 -11.703 3.039 0.081 763 H GLY 116 H GLY 116 -9.057 -0.970 -3.338 764 HA2 GLY 116 2HA GLY 116 -8.542 -0.610 -5.997 765 HA3 GLY 116 3HA GLY 116 -6.974 -0.434 -5.224 766 H THR 117 H THR 117 -5.979 -2.195 -5.790 767 HA THR 117 HA THR 117 -7.125 -4.773 -4.996 768 HB THR 117 HB THR 117 -5.963 -5.796 -6.997 769 HG1 THR 117 HG1 THR 117 -5.852 -3.060 -7.804 770 HG21 THR 117 3HG2 THR 117 -8.186 -3.825 -7.573 771 HG22 THR 117 1HG2 THR 117 -8.393 -5.472 -6.977 772 HG23 THR 117 2HG2 THR 117 -7.743 -5.194 -8.593 773 H MET 118 H MET 118 -5.529 -6.390 -4.533 774 HA MET 118 HA MET 118 -2.794 -5.473 -4.171 775 HB2 MET 118 2HB MET 118 -2.736 -6.078 -1.830 776 HB3 MET 118 3HB MET 118 -3.929 -4.817 -2.103 777 HG2 MET 118 2HG MET 118 -5.724 -6.293 -1.820 778 HG3 MET 118 3HG MET 118 -4.693 -7.709 -2.002 779 HE1 MET 118 3HE MET 118 -2.186 -6.928 -0.191 780 HE2 MET 118 1HE MET 118 -2.969 -8.507 -0.291 781 HE3 MET 118 2HE MET 118 -2.682 -7.764 1.279 782 H THR 119 H THR 119 -1.325 -7.194 -3.792 783 HA THR 119 HA THR 119 -2.466 -9.872 -4.187 784 HB THR 119 HB THR 119 -0.008 -8.868 -5.638 785 HG1 THR 119 HG1 THR 119 -1.441 -8.968 -7.490 786 HG21 THR 119 3HG2 THR 119 -0.253 -10.937 -6.938 787 HG22 THR 119 1HG2 THR 119 -1.635 -11.399 -5.944 788 HG23 THR 119 2HG2 THR 119 -0.030 -11.285 -5.223 789 H TYR 120 H TYR 120 -1.709 -11.339 -2.826 790 HA TYR 120 HA TYR 120 0.621 -10.784 -1.139 791 HB2 TYR 120 2HB TYR 120 -1.547 -12.879 -1.053 792 HB3 TYR 120 3HB TYR 120 -0.099 -13.010 -0.082 793 HD1 TYR 120 HD2 TYR 120 0.354 -11.206 1.621 794 HD2 TYR 120 HD1 TYR 120 -3.386 -11.625 -0.352 795 HE1 TYR 120 HE2 TYR 120 -0.719 -9.932 3.413 796 HE2 TYR 120 HE1 TYR 120 -4.481 -10.352 1.450 797 HH TYR 120 HH TYR 120 -4.200 -9.570 3.578 798 H ALA 121 H ALA 121 2.276 -12.451 -0.880 799 HA ALA 121 HA ALA 121 3.134 -13.592 -3.339 800 HB1 ALA 121 3HB ALA 121 4.700 -13.010 -1.533 801 HB2 ALA 121 1HB ALA 121 4.864 -14.701 -2.009 802 HB3 ALA 121 2HB ALA 121 4.007 -14.279 -0.527 803 H GLY 122 H GLY 122 2.799 -15.595 -4.212 804 HA2 GLY 122 2HA GLY 122 1.916 -17.698 -4.507 805 HA3 GLY 122 3HA GLY 122 2.017 -17.884 -2.765 806 H GLU 123 H GLU 123 0.140 -15.276 -4.058 807 HA GLU 123 HA GLU 123 -2.364 -16.761 -3.662 808 HB2 GLU 123 2HB GLU 123 -1.658 -15.495 -1.565 809 HB3 GLU 123 3HB GLU 123 -1.814 -14.024 -2.508 810 HG2 GLU 123 2HG GLU 123 -3.789 -14.204 -1.245 811 HG3 GLU 123 3HG GLU 123 -4.222 -14.655 -2.893 812 H GLY 124 H GLY 124 -4.224 -15.541 -4.633 813 HA2 GLY 124 2HA GLY 124 -3.353 -14.213 -7.072 814 HA3 GLY 124 3HA GLY 124 -4.987 -14.755 -6.708 815 HA PRO 125 HA PRO 125 -4.230 -10.034 -5.879 816 HB2 PRO 125 2HB PRO 125 -5.800 -9.732 -8.376 817 HB3 PRO 125 3HB PRO 125 -4.384 -8.828 -7.825 818 HG2 PRO 125 2HG PRO 125 -4.205 -10.614 -9.804 819 HG3 PRO 125 3HG PRO 125 -2.901 -10.414 -8.621 820 HD2 PRO 125 2HD PRO 125 -4.979 -12.555 -8.810 821 HD3 PRO 125 3HD PRO 125 -3.268 -12.675 -8.360 822 H ILE 126 H ILE 126 -5.725 -9.154 -4.629 823 HA ILE 126 HA ILE 126 -8.546 -9.864 -5.011 824 HB ILE 126 HB ILE 126 -8.840 -10.016 -2.560 825 HG12 ILE 126 2HG1 ILE 126 -5.817 -9.931 -2.440 826 HG13 ILE 126 3HG1 ILE 126 -6.890 -8.632 -1.925 827 HG21 ILE 126 1HG2 ILE 126 -6.800 -11.939 -3.677 828 HG22 ILE 126 2HG2 ILE 126 -8.553 -12.062 -3.831 829 HG23 ILE 126 3HG2 ILE 126 -7.795 -12.218 -2.245 830 HD11 ILE 126 3HD1 ILE 126 -7.835 -10.127 -0.218 831 HD12 ILE 126 1HD1 ILE 126 -6.099 -9.884 -0.020 832 HD13 ILE 126 2HD1 ILE 126 -6.705 -11.384 -0.722 833 H GLY 127 H GLY 127 -10.004 -8.370 -3.756 834 HA2 GLY 127 2HA GLY 127 -9.307 -5.664 -4.377 835 HA3 GLY 127 3HA GLY 127 -10.794 -6.218 -3.619 836 H PHE 128 H PHE 128 -8.789 -4.023 -3.068 837 HA PHE 128 HA PHE 128 -8.279 -4.679 -0.240 838 HB2 PHE 128 2HB PHE 128 -6.178 -4.404 -1.423 839 HB3 PHE 128 3HB PHE 128 -6.701 -2.852 -2.063 840 HD1 PHE 128 HD1 PHE 128 -5.949 -4.628 1.103 841 HD2 PHE 128 HD2 PHE 128 -6.274 -0.887 -0.891 842 HE1 PHE 128 HE1 PHE 128 -4.989 -3.499 3.071 843 HE2 PHE 128 HE2 PHE 128 -5.318 0.248 1.066 844 HZ PHE 128 HZ PHE 128 -4.671 -1.053 3.052 845 H LYS 129 H LYS 129 -9.142 -3.405 1.286 846 HA LYS 129 HA LYS 129 -10.093 -0.757 0.549 847 HB2 LYS 129 2HB LYS 129 -12.040 -2.195 0.449 848 HB3 LYS 129 3HB LYS 129 -11.645 -2.901 2.005 849 HG2 LYS 129 2HG LYS 129 -12.139 -0.812 3.121 850 HG3 LYS 129 3HG LYS 129 -12.429 -0.025 1.564 851 HD2 LYS 129 2HD LYS 129 -14.288 -1.555 1.129 852 HD3 LYS 129 3HD LYS 129 -13.991 -2.361 2.667 853 HE2 LYS 129 2HE LYS 129 -14.662 0.565 2.426 854 HE3 LYS 129 3HE LYS 129 -15.873 -0.695 2.657 855 HZ1 LYS 129 3HZ LYS 129 -14.621 -1.342 4.701 856 HZ2 LYS 129 1HZ LYS 129 -15.357 0.183 4.771 857 HZ3 LYS 129 2HZ LYS 129 -13.690 0.067 4.523 858 H GLY 130 H GLY 130 -8.647 0.371 1.694 859 HA2 GLY 130 2HA GLY 130 -8.129 -0.388 4.492 860 HA3 GLY 130 3HA GLY 130 -7.166 0.739 3.541 861 H THR 131 H THR 131 -8.695 0.915 6.187 862 HA THR 131 HA THR 131 -9.944 3.496 5.550 863 HB THR 131 HB THR 131 -11.138 1.427 7.419 864 HG1 THR 131 HG1 THR 131 -11.296 1.702 4.770 865 HG21 THR 131 3HG2 THR 131 -13.059 2.967 7.498 866 HG22 THR 131 1HG2 THR 131 -12.173 4.118 6.500 867 HG23 THR 131 2HG2 THR 131 -11.596 3.731 8.120 868 H LEU 132 H LEU 132 -9.319 5.099 6.891 869 HA LEU 132 HA LEU 132 -7.329 4.751 8.868 870 HB2 LEU 132 2HB LEU 132 -9.271 7.020 8.454 871 HB3 LEU 132 3HB LEU 132 -8.025 7.056 9.682 872 HG LEU 132 HG LEU 132 -7.503 6.838 6.718 873 HD11 LEU 132 1HD1 LEU 132 -6.864 9.149 6.811 874 HD12 LEU 132 2HD1 LEU 132 -7.154 9.204 8.550 875 HD13 LEU 132 3HD1 LEU 132 -8.507 9.006 7.441 876 HD21 LEU 132 3HD2 LEU 132 -5.668 7.279 9.073 877 HD22 LEU 132 1HD2 LEU 132 -5.191 7.353 7.378 878 HD23 LEU 132 2HD2 LEU 132 -5.748 5.833 8.068 879 H THR 133 H THR 133 -7.379 4.213 10.949 880 HA THR 133 HA THR 133 -10.016 3.803 12.137 881 HB THR 133 HB THR 133 -8.845 1.718 11.955 882 HG1 THR 133 HG1 THR 133 -8.459 1.332 14.341 883 HG21 THR 133 3HG2 THR 133 -6.563 2.457 11.728 884 HG22 THR 133 1HG2 THR 133 -6.681 1.311 13.061 885 HG23 THR 133 2HG2 THR 133 -6.548 3.038 13.393
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