NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
603348 | 2n3e | 25643 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 -9.562 -1.486 -11.204 2 H2 GLY 1 HT2 GLY 1 -7.978 -0.926 -10.949 3 H3 GLY 1 HT3 GLY 1 -8.241 -2.496 -11.543 4 HA2 GLY 1 HA2 GLY 1 -7.951 -1.654 -13.567 5 HA3 GLY 1 HA1 GLY 1 -9.548 -0.939 -13.346 6 H MET 2 HN MET 2 -9.690 1.279 -13.147 7 HA MET 2 HA MET 2 -7.517 2.930 -13.926 8 HB2 MET 2 HB2 MET 2 -10.031 3.632 -12.383 9 HB3 MET 2 HB1 MET 2 -8.937 4.816 -13.096 10 HG2 MET 2 HG2 MET 2 -9.298 3.713 -15.324 11 HG3 MET 2 HG1 MET 2 -10.512 2.682 -14.567 12 HE1 MET 2 HE1 MET 2 -10.259 7.067 -14.223 13 HE2 MET 2 HE2 MET 2 -10.277 6.761 -15.958 14 HE3 MET 2 HE3 MET 2 -9.093 5.947 -14.940 15 H GLY 3 HN GLY 3 -8.678 1.991 -10.712 16 HA2 GLY 3 HA2 GLY 3 -7.376 1.926 -8.722 17 HA3 GLY 3 HA1 GLY 3 -6.074 2.748 -9.580 18 H GLN 4 HN GLN 4 -9.056 4.272 -10.081 19 HA GLN 4 HA GLN 4 -8.338 6.344 -8.051 20 HB2 GLN 4 HB2 GLN 4 -8.299 7.121 -10.393 21 HB3 GLN 4 HB1 GLN 4 -9.973 6.604 -10.592 22 HG2 GLN 4 HG2 GLN 4 -10.641 8.160 -8.768 23 HG3 GLN 4 HG1 GLN 4 -8.969 8.712 -8.655 24 HE21 GLN 4 HE21 GLN 4 -8.650 10.623 -9.793 25 HE22 GLN 4 HE22 GLN 4 -9.471 11.068 -11.211 26 H ALA 5 HN ALA 5 -10.119 7.365 -6.900 27 HA ALA 5 HA ALA 5 -12.758 6.078 -7.052 28 HB1 ALA 5 HB1 ALA 5 -12.039 6.029 -4.284 29 HB2 ALA 5 HB2 ALA 5 -10.793 5.172 -5.191 30 HB3 ALA 5 HB3 ALA 5 -12.479 4.671 -5.321 31 H ASN 6 HN ASN 6 -14.372 7.292 -5.864 32 HA ASN 6 HA ASN 6 -14.140 10.075 -5.933 33 HB2 ASN 6 HB2 ASN 6 -15.825 8.451 -4.001 34 HB3 ASN 6 HB1 ASN 6 -16.090 10.141 -4.430 35 HD21 ASN 6 HD21 ASN 6 -18.070 8.103 -4.940 36 HD22 ASN 6 HD22 ASN 6 -18.243 7.968 -6.623 37 H THR 7 HN THR 7 -13.199 7.851 -3.363 38 HA THR 7 HA THR 7 -11.952 10.172 -1.954 39 HB THR 7 HB THR 7 -14.040 9.201 -0.820 40 HG1 THR 7 HG1 THR 7 -12.494 10.391 0.315 41 HG21 THR 7 HG21 THR 7 -13.689 6.854 -1.244 42 HG22 THR 7 HG22 THR 7 -13.568 7.112 0.497 43 HG23 THR 7 HG23 THR 7 -12.106 6.900 -0.467 44 HA PRO 8 HA PRO 8 -8.172 7.875 -2.249 45 HB2 PRO 8 HB2 PRO 8 -6.927 8.644 0.031 46 HB3 PRO 8 HB1 PRO 8 -7.084 9.687 -1.387 47 HG2 PRO 8 HG2 PRO 8 -8.756 9.610 1.106 48 HG3 PRO 8 HG1 PRO 8 -8.084 11.013 0.267 49 HD2 PRO 8 HD2 PRO 8 -10.646 10.319 -0.066 50 HD3 PRO 8 HD1 PRO 8 -9.696 10.937 -1.417 51 H TRP 9 HN TRP 9 -10.003 7.629 0.788 52 HA TRP 9 HA TRP 9 -8.602 5.115 1.460 53 HB2 TRP 9 HB2 TRP 9 -9.946 5.144 3.505 54 HB3 TRP 9 HB1 TRP 9 -9.194 6.721 3.261 55 HD1 TRP 9 HD1 TRP 9 -12.561 4.938 3.081 56 HE1 TRP 9 HE1 TRP 9 -14.435 6.709 3.036 57 HE3 TRP 9 HE3 TRP 9 -9.753 9.182 2.631 58 HZ2 TRP 9 HZ2 TRP 9 -14.706 9.548 2.837 59 HZ3 TRP 9 HZ3 TRP 9 -10.846 11.403 2.517 60 HH2 TRP 9 HH2 TRP 9 -13.316 11.590 2.618 61 H SER 10 HN SER 10 -10.433 5.475 -0.937 62 HA SER 10 HA SER 10 -12.491 3.426 -0.251 63 HB2 SER 10 HB1 SER 10 -12.431 5.725 -2.043 64 HB3 SER 10 HB2 SER 10 -12.909 4.254 -2.890 65 HG SER 10 HG SER 10 -14.696 4.188 -1.789 66 H SER 11 HN SER 11 -9.750 4.149 -2.331 67 HA SER 11 HA SER 11 -9.831 1.325 -3.315 68 HB2 SER 11 HB1 SER 11 -10.013 3.357 -4.969 69 HB3 SER 11 HB2 SER 11 -8.278 3.505 -4.689 70 HG SER 11 HG SER 11 -9.014 2.097 -6.476 71 H LYS 12 HN LYS 12 -7.639 0.360 -3.629 72 HA LYS 12 HA LYS 12 -5.974 0.832 -1.304 73 HB2 LYS 12 HB1 LYS 12 -6.372 -1.354 -2.731 74 HB3 LYS 12 HB2 LYS 12 -5.020 -0.734 -3.676 75 HG2 LYS 12 HG2 LYS 12 -3.614 -0.646 -1.687 76 HG3 LYS 12 HG1 LYS 12 -4.972 -1.128 -0.670 77 HD2 LYS 12 HD2 LYS 12 -3.707 -3.122 -1.056 78 HD3 LYS 12 HD1 LYS 12 -5.116 -3.237 -2.109 79 HE2 LYS 12 HE2 LYS 12 -2.576 -1.986 -3.125 80 HE3 LYS 12 HE1 LYS 12 -2.749 -3.741 -3.104 81 HZ1 LYS 12 HZ1 LYS 12 -3.854 -1.878 -4.911 82 HZ2 LYS 12 HZ2 LYS 12 -5.110 -2.711 -4.128 83 HZ3 LYS 12 HZ3 LYS 12 -3.908 -3.572 -4.966 84 H ALA 13 HN ALA 13 -5.638 1.525 -4.780 85 HA ALA 13 HA ALA 13 -2.984 2.684 -4.456 86 HB1 ALA 13 HB1 ALA 13 -3.794 1.673 -6.597 87 HB2 ALA 13 HB2 ALA 13 -3.203 3.322 -6.798 88 HB3 ALA 13 HB3 ALA 13 -4.938 3.005 -6.754 89 H ASN 14 HN ASN 14 -6.294 3.884 -4.467 90 HA ASN 14 HA ASN 14 -5.577 6.680 -4.684 91 HB2 ASN 14 HB1 ASN 14 -7.904 5.420 -4.983 92 HB3 ASN 14 HB2 ASN 14 -8.075 5.829 -3.277 93 HD21 ASN 14 HD21 ASN 14 -9.883 7.283 -4.208 94 HD22 ASN 14 HD22 ASN 14 -9.438 8.832 -4.742 95 H ALA 15 HN ALA 15 -5.973 4.426 -1.995 96 HA ALA 15 HA ALA 15 -5.906 6.470 0.057 97 HB1 ALA 15 HB1 ALA 15 -5.269 3.512 0.245 98 HB2 ALA 15 HB2 ALA 15 -6.864 4.230 0.469 99 HB3 ALA 15 HB3 ALA 15 -5.567 4.588 1.610 100 H ASP 16 HN ASP 16 -3.456 4.440 -1.496 101 HA ASP 16 HA ASP 16 -1.280 4.982 0.224 102 HB2 ASP 16 HB2 ASP 16 -1.314 4.575 -2.780 103 HB3 ASP 16 HB1 ASP 16 0.148 4.562 -1.795 104 H ALA 17 HN ALA 17 -2.096 6.732 -2.806 105 HA ALA 17 HA ALA 17 -0.165 8.759 -2.592 106 HB1 ALA 17 HB1 ALA 17 -1.210 9.454 -4.456 107 HB2 ALA 17 HB2 ALA 17 -2.619 9.932 -3.510 108 HB3 ALA 17 HB3 ALA 17 -2.499 8.292 -4.145 109 H PHE 18 HN PHE 18 -3.398 8.618 -1.109 110 HA PHE 18 HA PHE 18 -3.404 11.208 0.050 111 HB2 PHE 18 HB2 PHE 18 -5.352 9.622 -0.025 112 HB3 PHE 18 HB1 PHE 18 -4.584 8.690 1.259 113 HD1 PHE 18 HD1 PHE 18 -4.269 9.676 3.515 114 HD2 PHE 18 HD2 PHE 18 -6.381 11.760 0.410 115 HE1 PHE 18 HE1 PHE 18 -5.216 11.228 5.202 116 HE2 PHE 18 HE2 PHE 18 -7.328 13.312 2.095 117 HZ PHE 18 HZ PHE 18 -6.746 13.047 4.490 118 H ILE 19 HN ILE 19 -2.075 8.138 1.259 119 HA ILE 19 HA ILE 19 -1.270 9.176 3.819 120 HB ILE 19 HB ILE 19 -0.072 6.876 2.247 121 HG12 ILE 19 HG12 ILE 19 -2.414 6.441 2.473 122 HG13 ILE 19 HG11 ILE 19 -1.627 5.531 3.762 123 HG21 ILE 19 HG21 ILE 19 1.333 6.719 3.998 124 HG22 ILE 19 HG22 ILE 19 -0.061 6.434 5.040 125 HG23 ILE 19 HG23 ILE 19 0.538 8.075 4.798 126 HD11 ILE 19 HD11 ILE 19 -2.047 7.947 4.987 127 HD12 ILE 19 HD12 ILE 19 -3.139 6.568 5.111 128 HD13 ILE 19 HD13 ILE 19 -3.457 7.841 3.934 129 H ASN 20 HN ASN 20 0.541 8.641 0.784 130 HA ASN 20 HA ASN 20 3.024 9.689 1.707 131 HB2 ASN 20 HB1 ASN 20 1.903 9.785 -1.109 132 HB3 ASN 20 HB2 ASN 20 3.603 9.910 -0.659 133 HD21 ASN 20 HD21 ASN 20 1.603 7.737 -2.003 134 HD22 ASN 20 HD22 ASN 20 2.280 6.301 -1.403 135 H SER 21 HN SER 21 0.385 11.305 -0.087 136 HA SER 21 HA SER 21 1.606 13.878 -0.159 137 HB2 SER 21 HB2 SER 21 -0.485 13.016 -1.415 138 HB3 SER 21 HB1 SER 21 -1.374 13.463 0.041 139 HG SER 21 HG SER 21 -1.032 15.517 -0.347 140 H PHE 22 HN PHE 22 -0.247 12.247 2.352 141 HA PHE 22 HA PHE 22 -0.792 14.579 3.940 142 HB2 PHE 22 HB1 PHE 22 -1.997 12.498 4.335 143 HB3 PHE 22 HB2 PHE 22 -0.494 11.671 4.744 144 HD1 PHE 22 HD1 PHE 22 0.856 12.522 6.745 145 HD2 PHE 22 HD2 PHE 22 -3.194 13.721 5.967 146 HE1 PHE 22 HE1 PHE 22 0.627 13.276 9.097 147 HE2 PHE 22 HE2 PHE 22 -3.424 14.473 8.318 148 HZ PHE 22 HZ PHE 22 -1.513 14.251 9.883 149 H ILE 23 HN ILE 23 1.881 12.214 4.012 150 HA ILE 23 HA ILE 23 3.212 13.481 6.244 151 HB ILE 23 HB ILE 23 4.390 11.695 4.095 152 HG12 ILE 23 HG12 ILE 23 2.416 10.693 5.235 153 HG13 ILE 23 HG11 ILE 23 3.913 9.850 5.636 154 HG21 ILE 23 HG21 ILE 23 6.306 11.728 5.298 155 HG22 ILE 23 HG22 ILE 23 5.437 11.526 6.820 156 HG23 ILE 23 HG23 ILE 23 5.637 13.135 6.125 157 HD11 ILE 23 HD11 ILE 23 3.638 11.967 7.507 158 HD12 ILE 23 HD12 ILE 23 3.505 10.235 7.815 159 HD13 ILE 23 HD13 ILE 23 2.068 11.172 7.406 160 H SER 24 HN SER 24 4.008 13.429 2.749 161 HA SER 24 HA SER 24 6.111 15.307 2.851 162 HB2 SER 24 HB2 SER 24 4.094 14.981 0.609 163 HB3 SER 24 HB1 SER 24 5.721 15.648 0.468 164 HG SER 24 HG SER 24 5.672 13.462 -0.141 165 H ALA 25 HN ALA 25 2.609 15.836 2.650 166 HA ALA 25 HA ALA 25 2.888 18.723 2.349 167 HB1 ALA 25 HB1 ALA 25 0.464 17.101 3.182 168 HB2 ALA 25 HB2 ALA 25 0.904 17.463 1.514 169 HB3 ALA 25 HB3 ALA 25 0.459 18.770 2.611 170 H ALA 26 HN ALA 26 1.976 16.543 5.029 171 HA ALA 26 HA ALA 26 1.570 18.597 6.967 172 HB1 ALA 26 HB1 ALA 26 1.903 16.788 8.636 173 HB2 ALA 26 HB2 ALA 26 2.491 15.733 7.351 174 HB3 ALA 26 HB3 ALA 26 0.819 16.292 7.337 175 H SER 27 HN SER 27 4.495 16.874 5.944 176 HA SER 27 HA SER 27 6.189 17.896 8.030 177 HB2 SER 27 HB2 SER 27 8.039 17.157 6.636 178 HB3 SER 27 HB1 SER 27 6.756 15.949 6.560 179 HG SER 27 HG SER 27 7.734 17.630 4.610 180 H ASN 28 HN ASN 28 4.935 19.305 5.112 181 HA ASN 28 HA ASN 28 6.879 21.557 5.344 182 HB2 ASN 28 HB2 ASN 28 4.983 20.780 3.109 183 HB3 ASN 28 HB1 ASN 28 6.011 22.212 3.090 184 HD21 ASN 28 HD21 ASN 28 6.355 20.193 1.118 185 HD22 ASN 28 HD22 ASN 28 7.848 19.431 1.379 186 H THR 29 HN THR 29 4.025 20.802 6.671 187 HA THR 29 HA THR 29 2.770 23.456 6.178 188 HB THR 29 HB THR 29 1.598 21.180 7.783 189 HG1 THR 29 HG1 THR 29 1.810 20.240 5.871 190 HG21 THR 29 HG21 THR 29 -0.360 22.379 7.704 191 HG22 THR 29 HG22 THR 29 0.016 23.086 6.133 192 HG23 THR 29 HG23 THR 29 0.771 23.727 7.591 193 H GLY 30 HN GLY 30 2.887 21.401 9.106 194 HA2 GLY 30 HA2 GLY 30 3.204 23.835 10.730 195 HA3 GLY 30 HA1 GLY 30 2.944 22.205 11.347 196 H SER 31 HN SER 31 4.707 21.114 12.104 197 HA SER 31 HA SER 31 7.399 22.208 11.392 198 HB2 SER 31 HB1 SER 31 6.135 22.024 13.961 199 HB3 SER 31 HB2 SER 31 7.521 20.932 13.931 200 HG SER 31 HG SER 31 8.399 22.835 14.446 201 H PHE 32 HN PHE 32 6.064 19.334 13.083 202 HA PHE 32 HA PHE 32 6.772 17.088 12.928 203 HB2 PHE 32 HB1 PHE 32 6.417 18.025 10.086 204 HB3 PHE 32 HB2 PHE 32 6.926 16.372 10.432 205 HD1 PHE 32 HD1 PHE 32 5.511 15.151 12.317 206 HD2 PHE 32 HD2 PHE 32 4.120 18.479 9.984 207 HE1 PHE 32 HE1 PHE 32 3.165 14.517 12.809 208 HE2 PHE 32 HE2 PHE 32 1.776 17.845 10.476 209 HZ PHE 32 HZ PHE 32 1.298 15.862 11.890 210 H SER 33 HN SER 33 8.908 17.887 13.874 211 HA SER 33 HA SER 33 11.176 18.447 12.253 212 HB2 SER 33 HB1 SER 33 11.130 17.005 14.921 213 HB3 SER 33 HB2 SER 33 12.508 17.843 14.212 214 HG SER 33 HG SER 33 10.031 18.991 14.977 215 H GLN 34 HN GLN 34 13.064 16.916 11.943 216 HA GLN 34 HA GLN 34 12.363 14.676 10.399 217 HB2 GLN 34 HB1 GLN 34 14.899 15.210 11.975 218 HB3 GLN 34 HB2 GLN 34 14.733 13.915 10.791 219 HG2 GLN 34 HG2 GLN 34 14.132 15.613 9.068 220 HG3 GLN 34 HG1 GLN 34 14.407 16.884 10.259 221 HE21 GLN 34 HE21 GLN 34 15.985 16.829 7.911 222 HE22 GLN 34 HE22 GLN 34 17.581 16.451 8.347 223 H ASP 35 HN ASP 35 12.767 14.972 13.871 224 HA ASP 35 HA ASP 35 12.882 12.156 14.457 225 HB2 ASP 35 HB2 ASP 35 12.001 14.537 16.112 226 HB3 ASP 35 HB1 ASP 35 12.133 12.900 16.756 227 H GLN 36 HN GLN 36 10.218 14.456 14.028 228 HA GLN 36 HA GLN 36 8.159 12.624 14.909 229 HB2 GLN 36 HB1 GLN 36 7.837 14.949 12.993 230 HB3 GLN 36 HB2 GLN 36 6.600 14.233 14.025 231 HG2 GLN 36 HG1 GLN 36 8.106 14.872 16.003 232 HG3 GLN 36 HG2 GLN 36 9.005 15.866 14.856 233 HE21 GLN 36 HE21 GLN 36 8.226 17.788 16.118 234 HE22 GLN 36 HE22 GLN 36 6.660 18.379 15.838 235 H MET 37 HN MET 37 9.726 13.305 11.826 236 HA MET 37 HA MET 37 7.882 11.894 10.154 237 HB2 MET 37 HB2 MET 37 10.865 12.335 9.813 238 HB3 MET 37 HB1 MET 37 9.771 11.782 8.544 239 HG2 MET 37 HG2 MET 37 8.474 13.852 8.723 240 HG3 MET 37 HG1 MET 37 9.491 14.398 10.056 241 HE1 MET 37 HE1 MET 37 9.733 16.361 6.711 242 HE2 MET 37 HE2 MET 37 10.394 16.894 8.254 243 HE3 MET 37 HE3 MET 37 8.832 16.080 8.207 244 H GLU 38 HN GLU 38 10.495 10.828 12.242 245 HA GLU 38 HA GLU 38 10.912 8.224 11.200 246 HB2 GLU 38 HB1 GLU 38 12.236 9.303 13.056 247 HB3 GLU 38 HB2 GLU 38 10.878 8.983 14.136 248 HG2 GLU 38 HG2 GLU 38 11.060 6.564 13.626 249 HG3 GLU 38 HG1 GLU 38 12.444 6.898 12.583 250 H ASN 39 HN ASN 39 8.397 9.497 13.341 251 HA ASN 39 HA ASN 39 7.182 7.036 14.077 252 HB2 ASN 39 HB2 ASN 39 5.910 9.747 13.590 253 HB3 ASN 39 HB1 ASN 39 5.120 8.396 14.404 254 HD21 ASN 39 HD21 ASN 39 6.657 11.213 15.125 255 HD22 ASN 39 HD22 ASN 39 7.408 10.795 16.589 256 H MET 40 HN MET 40 6.998 8.936 11.127 257 HA MET 40 HA MET 40 4.720 7.768 9.929 258 HB2 MET 40 HB1 MET 40 5.908 9.663 8.912 259 HB3 MET 40 HB2 MET 40 7.314 8.641 8.616 260 HG2 MET 40 HG1 MET 40 5.778 7.132 7.257 261 HG3 MET 40 HG2 MET 40 4.563 8.405 7.375 262 HE1 MET 40 HE1 MET 40 8.712 8.832 6.614 263 HE2 MET 40 HE2 MET 40 8.369 8.055 5.070 264 HE3 MET 40 HE3 MET 40 7.882 7.271 6.571 265 H SER 41 HN SER 41 7.986 6.537 10.342 266 HA SER 41 HA SER 41 7.929 4.381 8.511 267 HB2 SER 41 HB1 SER 41 9.575 3.302 9.989 268 HB3 SER 41 HB2 SER 41 9.937 5.020 9.822 269 HG SER 41 HG SER 41 10.022 4.419 11.991 270 H LEU 42 HN LEU 42 6.215 4.866 11.501 271 HA LEU 42 HA LEU 42 5.297 2.026 11.441 272 HB2 LEU 42 HB1 LEU 42 5.249 4.131 13.615 273 HB3 LEU 42 HB2 LEU 42 4.373 2.607 13.742 274 HG LEU 42 HG LEU 42 6.636 1.486 13.183 275 HD11 LEU 42 HD21 LEU 42 8.126 3.626 14.443 276 HD12 LEU 42 HD22 LEU 42 7.379 4.193 12.950 277 HD13 LEU 42 HD23 LEU 42 8.453 2.794 12.924 278 HD21 LEU 42 HD11 LEU 42 7.266 1.464 15.524 279 HD22 LEU 42 HD12 LEU 42 5.506 1.531 15.433 280 HD23 LEU 42 HD13 LEU 42 6.427 2.988 15.808 281 H ILE 43 HN ILE 43 4.297 5.342 11.052 282 HA ILE 43 HA ILE 43 1.514 4.366 10.549 283 HB ILE 43 HB ILE 43 2.413 7.003 11.743 284 HG12 ILE 43 HG11 ILE 43 0.548 4.919 12.894 285 HG13 ILE 43 HG12 ILE 43 2.286 4.890 13.189 286 HG21 ILE 43 HG21 ILE 43 0.077 7.638 11.756 287 HG22 ILE 43 HG22 ILE 43 -0.400 6.068 11.109 288 HG23 ILE 43 HG23 ILE 43 0.511 7.196 10.104 289 HD11 ILE 43 HD11 ILE 43 0.520 7.287 13.761 290 HD12 ILE 43 HD12 ILE 43 2.212 7.083 14.213 291 HD13 ILE 43 HD13 ILE 43 0.970 6.088 14.974 292 H GLY 44 HN GLY 44 0.424 5.375 8.772 293 HA2 GLY 44 HA2 GLY 44 0.292 6.782 6.836 294 HA3 GLY 44 HA1 GLY 44 1.968 7.263 7.101 295 H ASN 45 HN ASN 45 3.507 6.257 5.856 296 HA ASN 45 HA ASN 45 2.854 4.568 3.696 297 HB2 ASN 45 HB2 ASN 45 5.466 4.815 5.222 298 HB3 ASN 45 HB1 ASN 45 5.297 3.972 3.682 299 HD21 ASN 45 HD21 ASN 45 7.020 6.147 3.699 300 HD22 ASN 45 HD22 ASN 45 6.320 7.458 2.879 301 H THR 46 HN THR 46 3.278 3.842 7.059 302 HA THR 46 HA THR 46 3.802 1.019 6.806 303 HB THR 46 HB THR 46 2.407 2.464 9.079 304 HG1 THR 46 HG1 THR 46 5.143 1.827 8.955 305 HG21 THR 46 HG21 THR 46 4.015 0.394 10.037 306 HG22 THR 46 HG22 THR 46 3.249 -0.281 8.599 307 HG23 THR 46 HG23 THR 46 2.257 0.373 9.902 308 H LEU 47 HN LEU 47 0.874 2.984 6.900 309 HA LEU 47 HA LEU 47 -1.076 1.004 7.303 310 HB2 LEU 47 HB2 LEU 47 -1.402 3.531 6.982 311 HB3 LEU 47 HB1 LEU 47 -1.361 3.208 5.249 312 HG LEU 47 HG LEU 47 -3.683 3.246 6.236 313 HD11 LEU 47 HD21 LEU 47 -2.609 1.610 4.305 314 HD12 LEU 47 HD22 LEU 47 -4.332 1.754 4.650 315 HD13 LEU 47 HD23 LEU 47 -3.395 0.444 5.370 316 HD21 LEU 47 HD11 LEU 47 -4.344 1.756 7.869 317 HD22 LEU 47 HD12 LEU 47 -2.651 1.937 8.328 318 HD23 LEU 47 HD13 LEU 47 -3.163 0.538 7.384 319 H MET 48 HN MET 48 0.793 1.766 4.402 320 HA MET 48 HA MET 48 -0.670 0.218 2.525 321 HB2 MET 48 HB1 MET 48 2.310 0.763 2.706 322 HB3 MET 48 HB2 MET 48 1.516 0.049 1.302 323 HG2 MET 48 HG2 MET 48 0.089 2.055 1.091 324 HG3 MET 48 HG1 MET 48 0.890 2.770 2.491 325 HE1 MET 48 HE1 MET 48 0.528 4.308 0.430 326 HE2 MET 48 HE2 MET 48 1.743 4.599 -0.812 327 HE3 MET 48 HE3 MET 48 2.055 5.099 0.848 328 H ALA 49 HN ALA 49 1.792 -0.705 4.899 329 HA ALA 49 HA ALA 49 2.174 -3.395 4.024 330 HB1 ALA 49 HB1 ALA 49 3.727 -2.639 5.629 331 HB2 ALA 49 HB2 ALA 49 2.712 -3.751 6.547 332 HB3 ALA 49 HB3 ALA 49 2.465 -2.010 6.686 333 H ALA 50 HN ALA 50 -0.339 -1.876 5.957 334 HA ALA 50 HA ALA 50 -1.517 -4.305 6.959 335 HB1 ALA 50 HB1 ALA 50 -2.543 -1.494 6.548 336 HB2 ALA 50 HB2 ALA 50 -2.176 -2.314 8.066 337 HB3 ALA 50 HB3 ALA 50 -3.599 -2.779 7.134 338 H MET 51 HN MET 51 -1.923 -2.432 3.990 339 HA MET 51 HA MET 51 -4.249 -3.778 3.015 340 HB2 MET 51 HB2 MET 51 -1.960 -2.572 1.429 341 HB3 MET 51 HB1 MET 51 -3.573 -2.933 0.810 342 HG2 MET 51 HG2 MET 51 -4.558 -1.337 2.394 343 HG3 MET 51 HG1 MET 51 -2.965 -1.007 3.076 344 HE1 MET 51 HE1 MET 51 -4.580 1.919 1.175 345 HE2 MET 51 HE2 MET 51 -3.089 2.038 2.106 346 HE3 MET 51 HE3 MET 51 -4.406 1.025 2.692 347 H ASP 52 HN ASP 52 -0.833 -4.621 2.994 348 HA ASP 52 HA ASP 52 -0.838 -6.648 1.026 349 HB2 ASP 52 HB2 ASP 52 0.690 -6.455 3.636 350 HB3 ASP 52 HB1 ASP 52 1.016 -7.676 2.407 351 H ASN 53 HN ASN 53 -2.093 -6.647 4.302 352 HA ASN 53 HA ASN 53 -2.422 -9.502 4.538 353 HB2 ASN 53 HB2 ASN 53 -3.958 -7.255 5.880 354 HB3 ASN 53 HB1 ASN 53 -3.963 -8.945 6.385 355 HD21 ASN 53 HD21 ASN 53 -1.245 -9.615 6.153 356 HD22 ASN 53 HD22 ASN 53 -0.343 -8.680 7.245 357 H MET 54 HN MET 54 -4.224 -6.974 2.958 358 HA MET 54 HA MET 54 -6.741 -8.356 2.758 359 HB2 MET 54 HB2 MET 54 -5.497 -6.232 0.986 360 HB3 MET 54 HB1 MET 54 -7.172 -6.768 0.874 361 HG2 MET 54 HG2 MET 54 -5.854 -5.492 3.290 362 HG3 MET 54 HG1 MET 54 -7.053 -4.740 2.237 363 HE1 MET 54 HE1 MET 54 -8.822 -7.327 1.587 364 HE2 MET 54 HE2 MET 54 -9.422 -5.689 1.829 365 HE3 MET 54 HE3 MET 54 -10.154 -7.026 2.711 366 H GLY 55 HN GLY 55 -3.748 -8.490 0.926 367 HA2 GLY 55 HA2 GLY 55 -3.095 -10.326 -0.463 368 HA3 GLY 55 HA1 GLY 55 -4.772 -10.873 -0.486 369 H GLY 56 HN GLY 56 -4.586 -7.547 -1.047 370 HA2 GLY 56 HA2 GLY 56 -4.204 -6.385 -3.167 371 HA3 GLY 56 HA1 GLY 56 -4.423 -7.923 -4.001 372 H ARG 57 HN ARG 57 -6.631 -7.345 -1.438 373 HA ARG 57 HA ARG 57 -8.687 -6.405 -3.394 374 HB2 ARG 57 HB2 ARG 57 -10.315 -7.902 -2.383 375 HB3 ARG 57 HB1 ARG 57 -8.914 -8.848 -2.884 376 HG2 ARG 57 HG2 ARG 57 -8.058 -8.404 -0.455 377 HG3 ARG 57 HG1 ARG 57 -9.747 -8.029 -0.109 378 HD2 ARG 57 HD2 ARG 57 -10.408 -10.240 -1.016 379 HD3 ARG 57 HD1 ARG 57 -8.711 -10.615 -1.313 380 HE ARG 57 HE ARG 57 -8.604 -11.234 0.946 381 HH11 ARG 57 HH11 ARG 57 -11.273 -9.153 0.387 382 HH12 ARG 57 HH12 ARG 57 -11.603 -8.892 2.067 383 HH21 ARG 57 HH21 ARG 57 -8.879 -10.738 3.161 384 HH22 ARG 57 HH22 ARG 57 -10.246 -9.789 3.639 385 H ILE 58 HN ILE 58 -9.251 -4.394 -2.727 386 HA ILE 58 HA ILE 58 -9.497 -3.928 0.218 387 HB ILE 58 HB ILE 58 -9.038 -1.836 -1.924 388 HG12 ILE 58 HG12 ILE 58 -7.079 -3.225 -1.921 389 HG13 ILE 58 HG11 ILE 58 -6.690 -1.808 -0.947 390 HG21 ILE 58 HG21 ILE 58 -9.114 -1.868 1.088 391 HG22 ILE 58 HG22 ILE 58 -9.948 -0.783 -0.025 392 HG23 ILE 58 HG23 ILE 58 -8.209 -0.626 0.224 393 HD11 ILE 58 HD11 ILE 58 -7.779 -3.508 0.925 394 HD12 ILE 58 HD12 ILE 58 -6.051 -3.311 0.631 395 HD13 ILE 58 HD13 ILE 58 -6.933 -4.629 -0.141 396 H THR 59 HN THR 59 -11.306 -2.579 0.886 397 HA THR 59 HA THR 59 -13.434 -2.205 -1.160 398 HB THR 59 HB THR 59 -15.016 -3.483 -0.058 399 HG1 THR 59 HG1 THR 59 -15.263 -3.154 1.981 400 HG21 THR 59 HG21 THR 59 -13.998 -5.583 0.714 401 HG22 THR 59 HG22 THR 59 -12.435 -4.779 0.862 402 HG23 THR 59 HG23 THR 59 -13.173 -4.989 -0.727 403 HA PRO 60 HA PRO 60 -14.234 1.625 0.907 404 HB2 PRO 60 HB2 PRO 60 -16.932 1.790 0.889 405 HB3 PRO 60 HB1 PRO 60 -15.948 1.996 -0.561 406 HG2 PRO 60 HG2 PRO 60 -17.456 -0.412 0.384 407 HG3 PRO 60 HG1 PRO 60 -17.342 0.258 -1.246 408 HD2 PRO 60 HD2 PRO 60 -15.882 -1.882 -0.467 409 HD3 PRO 60 HD1 PRO 60 -15.277 -0.710 -1.638 410 H SER 61 HN SER 61 -16.209 -1.089 2.103 411 HA SER 61 HA SER 61 -16.795 0.191 4.639 412 HB2 SER 61 HB2 SER 61 -18.170 -1.658 3.633 413 HB3 SER 61 HB1 SER 61 -16.841 -2.767 3.973 414 HG SER 61 HG SER 61 -17.046 -2.242 6.170 415 H LYS 62 HN LYS 62 -14.260 -1.941 3.433 416 HA LYS 62 HA LYS 62 -13.129 -2.476 6.056 417 HB2 LYS 62 HB2 LYS 62 -12.009 -2.769 3.255 418 HB3 LYS 62 HB1 LYS 62 -11.154 -3.283 4.709 419 HG2 LYS 62 HG2 LYS 62 -13.129 -4.723 5.286 420 HG3 LYS 62 HG1 LYS 62 -13.840 -4.294 3.731 421 HD2 LYS 62 HD2 LYS 62 -11.781 -5.188 2.610 422 HD3 LYS 62 HD1 LYS 62 -11.214 -5.738 4.186 423 HE2 LYS 62 HE2 LYS 62 -13.980 -6.537 3.538 424 HE3 LYS 62 HE1 LYS 62 -12.752 -7.245 2.489 425 HZ1 LYS 62 HZ1 LYS 62 -13.368 -7.864 5.184 426 HZ2 LYS 62 HZ2 LYS 62 -11.741 -7.392 5.050 427 HZ3 LYS 62 HZ3 LYS 62 -12.336 -8.676 4.110 428 H LEU 63 HN LEU 63 -12.142 -0.369 3.330 429 HA LEU 63 HA LEU 63 -9.981 0.866 4.750 430 HB2 LEU 63 HB2 LEU 63 -11.658 1.845 2.424 431 HB3 LEU 63 HB1 LEU 63 -10.231 2.688 3.026 432 HG LEU 63 HG LEU 63 -10.319 -0.136 1.933 433 HD11 LEU 63 HD11 LEU 63 -8.489 1.240 0.468 434 HD12 LEU 63 HD12 LEU 63 -9.637 2.528 0.837 435 HD13 LEU 63 HD13 LEU 63 -10.182 1.072 0.002 436 HD21 LEU 63 HD21 LEU 63 -7.804 0.048 2.200 437 HD22 LEU 63 HD22 LEU 63 -8.700 -0.071 3.714 438 HD23 LEU 63 HD23 LEU 63 -8.087 1.491 3.173 439 H GLN 64 HN GLN 64 -13.436 1.411 4.733 440 HA GLN 64 HA GLN 64 -13.532 4.059 5.729 441 HB2 GLN 64 HB2 GLN 64 -15.503 2.608 5.034 442 HB3 GLN 64 HB1 GLN 64 -15.371 1.817 6.605 443 HG2 GLN 64 HG2 GLN 64 -15.715 3.949 7.746 444 HG3 GLN 64 HG1 GLN 64 -15.733 4.803 6.203 445 HE21 GLN 64 HE21 GLN 64 -17.997 5.122 7.733 446 HE22 GLN 64 HE22 GLN 64 -19.286 4.216 7.101 447 H ALA 65 HN ALA 65 -13.233 0.973 7.485 448 HA ALA 65 HA ALA 65 -13.087 2.230 10.092 449 HB1 ALA 65 HB1 ALA 65 -13.067 -0.452 9.008 450 HB2 ALA 65 HB2 ALA 65 -13.452 0.076 10.647 451 HB3 ALA 65 HB3 ALA 65 -11.781 -0.272 10.201 452 H LEU 66 HN LEU 66 -10.664 0.949 7.815 453 HA LEU 66 HA LEU 66 -8.400 1.539 9.498 454 HB2 LEU 66 HB2 LEU 66 -8.419 -0.066 7.548 455 HB3 LEU 66 HB1 LEU 66 -8.443 1.333 6.476 456 HG LEU 66 HG LEU 66 -6.363 2.119 7.825 457 HD11 LEU 66 HD21 LEU 66 -6.642 0.399 9.610 458 HD12 LEU 66 HD22 LEU 66 -5.064 0.303 8.829 459 HD13 LEU 66 HD23 LEU 66 -6.324 -0.858 8.414 460 HD21 LEU 66 HD11 LEU 66 -6.534 -0.076 5.785 461 HD22 LEU 66 HD12 LEU 66 -4.956 0.360 6.440 462 HD23 LEU 66 HD13 LEU 66 -5.929 1.571 5.604 463 H ASP 67 HN ASP 67 -10.026 3.317 6.885 464 HA ASP 67 HA ASP 67 -8.271 5.453 6.514 465 HB2 ASP 67 HB1 ASP 67 -10.497 5.080 5.353 466 HB3 ASP 67 HB2 ASP 67 -11.271 5.778 6.775 467 H MET 68 HN MET 68 -10.704 5.062 9.087 468 HA MET 68 HA MET 68 -10.214 7.586 10.350 469 HB2 MET 68 HB2 MET 68 -11.230 4.972 11.507 470 HB3 MET 68 HB1 MET 68 -11.288 6.526 12.339 471 HG2 MET 68 HG2 MET 68 -12.599 7.428 10.377 472 HG3 MET 68 HG1 MET 68 -12.680 5.781 9.751 473 HE1 MET 68 HE1 MET 68 -13.940 3.799 10.876 474 HE2 MET 68 HE2 MET 68 -14.467 3.834 12.556 475 HE3 MET 68 HE3 MET 68 -12.760 4.038 12.172 476 H ALA 69 HN ALA 69 -8.721 4.391 10.721 477 HA ALA 69 HA ALA 69 -7.200 4.877 13.054 478 HB1 ALA 69 HB1 ALA 69 -7.148 2.979 10.839 479 HB2 ALA 69 HB2 ALA 69 -6.732 2.729 12.533 480 HB3 ALA 69 HB3 ALA 69 -5.526 3.362 11.414 481 H PHE 70 HN PHE 70 -6.384 5.567 9.647 482 HA PHE 70 HA PHE 70 -3.772 6.541 10.013 483 HB2 PHE 70 HB1 PHE 70 -4.779 6.268 7.790 484 HB3 PHE 70 HB2 PHE 70 -5.909 7.580 8.125 485 HD1 PHE 70 HD2 PHE 70 -2.295 6.762 7.740 486 HD2 PHE 70 HD1 PHE 70 -5.271 9.858 7.862 487 HE1 PHE 70 HE2 PHE 70 -0.612 8.411 6.969 488 HE2 PHE 70 HE1 PHE 70 -3.585 11.507 7.091 489 HZ PHE 70 HZ PHE 70 -1.255 10.782 6.645 490 H ALA 71 HN ALA 71 -6.870 8.233 10.458 491 HA ALA 71 HA ALA 71 -5.729 10.809 11.001 492 HB1 ALA 71 HB1 ALA 71 -7.947 11.234 12.144 493 HB2 ALA 71 HB2 ALA 71 -8.358 9.549 11.826 494 HB3 ALA 71 HB3 ALA 71 -8.079 10.657 10.483 495 H SER 72 HN SER 72 -6.692 8.124 13.141 496 HA SER 72 HA SER 72 -5.968 9.493 15.574 497 HB2 SER 72 HB2 SER 72 -6.218 7.334 16.645 498 HB3 SER 72 HB1 SER 72 -7.494 7.495 15.436 499 HG SER 72 HG SER 72 -5.997 6.370 13.993 500 H SER 73 HN SER 73 -4.229 7.318 13.376 501 HA SER 73 HA SER 73 -1.894 7.071 15.053 502 HB2 SER 73 HB2 SER 73 -0.804 6.198 13.019 503 HB3 SER 73 HB1 SER 73 -2.388 5.463 13.251 504 HG SER 73 HG SER 73 -1.778 7.648 11.551 505 H VAL 74 HN VAL 74 -2.704 9.164 12.295 506 HA VAL 74 HA VAL 74 -0.188 10.551 12.253 507 HB VAL 74 HB VAL 74 -1.305 12.168 10.835 508 HG11 VAL 74 HG21 VAL 74 -2.843 10.281 9.556 509 HG12 VAL 74 HG22 VAL 74 -1.755 9.274 10.513 510 HG13 VAL 74 HG23 VAL 74 -1.097 10.445 9.369 511 HG21 VAL 74 HG11 VAL 74 -3.304 12.445 12.308 512 HG22 VAL 74 HG12 VAL 74 -3.903 10.887 11.739 513 HG23 VAL 74 HG13 VAL 74 -3.736 12.233 10.612 514 H ALA 75 HN ALA 75 -3.201 11.061 14.024 515 HA ALA 75 HA ALA 75 -2.505 13.662 15.056 516 HB1 ALA 75 HB1 ALA 75 -4.272 11.735 16.540 517 HB2 ALA 75 HB2 ALA 75 -4.813 12.418 15.007 518 HB3 ALA 75 HB3 ALA 75 -4.437 13.482 16.363 519 H GLN 76 HN GLN 76 -2.230 10.367 16.411 520 HA GLN 76 HA GLN 76 -1.142 11.109 18.924 521 HB2 GLN 76 HB2 GLN 76 -0.705 8.630 17.241 522 HB3 GLN 76 HB1 GLN 76 -0.147 8.793 18.906 523 HG2 GLN 76 HG1 GLN 76 -2.452 9.173 19.662 524 HG3 GLN 76 HG2 GLN 76 -3.028 9.081 17.998 525 HE21 GLN 76 HE21 GLN 76 -4.004 7.250 19.949 526 HE22 GLN 76 HE22 GLN 76 -3.413 5.699 19.590 527 H ILE 77 HN ILE 77 0.425 10.644 15.782 528 HA ILE 77 HA ILE 77 3.122 10.793 16.777 529 HB ILE 77 HB ILE 77 2.024 11.467 14.033 530 HG12 ILE 77 HG12 ILE 77 3.407 8.924 14.902 531 HG13 ILE 77 HG11 ILE 77 1.655 9.107 14.997 532 HG21 ILE 77 HG21 ILE 77 4.313 11.169 13.258 533 HG22 ILE 77 HG22 ILE 77 4.846 10.759 14.889 534 HG23 ILE 77 HG23 ILE 77 4.294 12.394 14.526 535 HD11 ILE 77 HD11 ILE 77 3.254 8.481 12.699 536 HD12 ILE 77 HD12 ILE 77 2.472 10.041 12.430 537 HD13 ILE 77 HD13 ILE 77 1.497 8.619 12.805 538 H ALA 78 HN ALA 78 1.125 13.222 15.099 539 HA ALA 78 HA ALA 78 3.017 15.352 15.700 540 HB1 ALA 78 HB1 ALA 78 1.529 15.250 13.664 541 HB2 ALA 78 HB2 ALA 78 1.479 16.784 14.532 542 HB3 ALA 78 HB3 ALA 78 0.168 15.618 14.721 543 H ALA 79 HN ALA 79 -0.174 14.384 16.963 544 HA ALA 79 HA ALA 79 -0.597 16.611 18.664 545 HB1 ALA 79 HB1 ALA 79 -2.242 14.741 18.170 546 HB2 ALA 79 HB2 ALA 79 -2.158 15.230 19.863 547 HB3 ALA 79 HB3 ALA 79 -1.352 13.754 19.329 548 H SER 80 HN SER 80 1.504 13.828 19.014 549 HA SER 80 HA SER 80 2.035 14.342 21.848 550 HB2 SER 80 HB2 SER 80 3.659 12.546 21.666 551 HB3 SER 80 HB1 SER 80 2.193 12.057 20.814 552 HG SER 80 HG SER 80 4.684 12.835 19.798 553 H GLN 81 HN GLN 81 3.236 15.468 18.809 554 HA GLN 81 HA GLN 81 5.759 16.438 20.019 555 HB2 GLN 81 HB2 GLN 81 4.669 16.635 17.197 556 HB3 GLN 81 HB1 GLN 81 6.239 17.255 17.708 557 HG2 GLN 81 HG2 GLN 81 5.498 14.399 18.267 558 HG3 GLN 81 HG1 GLN 81 6.096 14.856 16.672 559 HE21 GLN 81 HE21 GLN 81 7.252 13.477 19.353 560 HE22 GLN 81 HE22 GLN 81 8.806 14.156 19.432 561 H GLY 82 HN GLY 82 5.724 18.350 21.047 562 HA2 GLY 82 HA1 GLY 82 5.303 20.636 21.432 563 HA3 GLY 82 HA2 GLY 82 4.550 20.710 19.838 564 H GLY 83 HN GLY 83 3.976 20.481 23.224 565 HA2 GLY 83 HA1 GLY 83 1.461 19.347 23.488 566 HA3 GLY 83 HA2 GLY 83 1.950 20.779 24.394 567 H ASP 84 HN ASP 84 2.252 22.495 22.074 568 HA ASP 84 HA ASP 84 -0.440 23.449 21.827 569 HB2 ASP 84 HB2 ASP 84 2.157 24.068 20.443 570 HB3 ASP 84 HB1 ASP 84 0.653 24.757 19.831 571 H LEU 85 HN LEU 85 -1.757 21.755 21.022 572 HA LEU 85 HA LEU 85 -1.076 20.340 18.571 573 HB2 LEU 85 HB2 LEU 85 -3.314 20.362 20.513 574 HB3 LEU 85 HB1 LEU 85 -3.746 19.915 18.862 575 HG LEU 85 HG LEU 85 -1.841 18.265 18.895 576 HD11 LEU 85 HD21 LEU 85 -1.345 17.699 21.477 577 HD12 LEU 85 HD22 LEU 85 -1.604 19.437 21.625 578 HD13 LEU 85 HD23 LEU 85 -0.345 18.821 20.554 579 HD21 LEU 85 HD11 LEU 85 -4.416 18.094 20.030 580 HD22 LEU 85 HD12 LEU 85 -3.343 17.272 21.162 581 HD23 LEU 85 HD13 LEU 85 -3.410 16.756 19.476 582 H GLY 86 HN GLY 86 -2.246 23.439 19.200 583 HA2 GLY 86 HA1 GLY 86 -4.207 23.860 17.215 584 HA3 GLY 86 HA2 GLY 86 -3.080 25.099 17.766 585 H VAL 87 HN VAL 87 -0.649 23.982 16.916 586 HA VAL 87 HA VAL 87 -0.711 24.662 14.108 587 HB VAL 87 HB VAL 87 1.250 24.995 15.691 588 HG11 VAL 87 HG11 VAL 87 2.722 23.123 16.105 589 HG12 VAL 87 HG12 VAL 87 1.736 22.064 15.096 590 HG13 VAL 87 HG13 VAL 87 1.105 22.658 16.632 591 HG21 VAL 87 HG21 VAL 87 2.883 23.970 13.829 592 HG22 VAL 87 HG22 VAL 87 1.899 25.400 13.517 593 HG23 VAL 87 HG23 VAL 87 1.361 23.819 12.951 594 H THR 88 HN THR 88 -0.177 21.555 15.833 595 HA THR 88 HA THR 88 0.175 19.926 13.563 596 HB THR 88 HB THR 88 -1.318 19.277 16.124 597 HG1 THR 88 HG1 THR 88 1.314 18.616 15.320 598 HG21 THR 88 HG21 THR 88 -0.884 16.928 15.497 599 HG22 THR 88 HG22 THR 88 -0.181 17.472 13.972 600 HG23 THR 88 HG23 THR 88 -1.895 17.734 14.297 601 H THR 89 HN THR 89 -2.765 21.256 14.983 602 HA THR 89 HA THR 89 -4.693 19.816 13.487 603 HB THR 89 HB THR 89 -4.827 22.763 14.198 604 HG1 THR 89 HG1 THR 89 -5.835 20.674 15.777 605 HG21 THR 89 HG21 THR 89 -6.697 22.305 12.872 606 HG22 THR 89 HG22 THR 89 -7.309 21.983 14.495 607 HG23 THR 89 HG23 THR 89 -6.823 20.645 13.454 608 H ASN 90 HN ASN 90 -3.010 22.865 12.706 609 HA ASN 90 HA ASN 90 -4.118 23.024 10.040 610 HB2 ASN 90 HB2 ASN 90 -3.105 24.941 11.412 611 HB3 ASN 90 HB1 ASN 90 -1.530 24.287 10.961 612 HD21 ASN 90 HD21 ASN 90 -1.182 26.331 9.701 613 HD22 ASN 90 HD22 ASN 90 -1.922 26.525 8.187 614 H ALA 91 HN ALA 91 -1.153 21.695 11.442 615 HA ALA 91 HA ALA 91 0.146 21.097 8.951 616 HB1 ALA 91 HB1 ALA 91 1.123 21.100 11.355 617 HB2 ALA 91 HB2 ALA 91 1.693 19.863 10.235 618 HB3 ALA 91 HB3 ALA 91 0.487 19.459 11.458 619 H ILE 92 HN ILE 92 -1.552 18.891 11.212 620 HA ILE 92 HA ILE 92 -1.632 16.692 9.389 621 HB ILE 92 HB ILE 92 -3.474 17.385 11.699 622 HG12 ILE 92 HG12 ILE 92 -1.042 15.585 11.480 623 HG13 ILE 92 HG11 ILE 92 -1.134 17.106 12.368 624 HG21 ILE 92 HG21 ILE 92 -3.096 14.572 10.867 625 HG22 ILE 92 HG22 ILE 92 -4.007 15.566 9.730 626 HG23 ILE 92 HG23 ILE 92 -4.559 15.402 11.397 627 HD11 ILE 92 HD11 ILE 92 -2.857 14.673 12.933 628 HD12 ILE 92 HD12 ILE 92 -2.824 16.170 13.864 629 HD13 ILE 92 HD13 ILE 92 -1.414 15.111 13.847 630 H ALA 93 HN ALA 93 -4.096 19.157 10.181 631 HA ALA 93 HA ALA 93 -6.084 18.247 8.366 632 HB1 ALA 93 HB1 ALA 93 -5.466 21.076 9.270 633 HB2 ALA 93 HB2 ALA 93 -6.559 19.946 10.070 634 HB3 ALA 93 HB3 ALA 93 -6.954 20.574 8.471 635 H ASP 94 HN ASP 94 -3.577 20.760 7.885 636 HA ASP 94 HA ASP 94 -4.182 21.368 5.197 637 HB2 ASP 94 HB1 ASP 94 -1.567 21.369 6.712 638 HB3 ASP 94 HB2 ASP 94 -1.683 21.920 5.041 639 H ALA 95 HN ALA 95 -2.015 18.843 6.494 640 HA ALA 95 HA ALA 95 -1.122 17.835 3.989 641 HB1 ALA 95 HB1 ALA 95 -1.205 16.885 6.779 642 HB2 ALA 95 HB2 ALA 95 0.088 16.761 5.588 643 HB3 ALA 95 HB3 ALA 95 -1.234 15.595 5.578 644 H LEU 96 HN LEU 96 -3.956 16.960 5.965 645 HA LEU 96 HA LEU 96 -4.890 14.922 4.142 646 HB2 LEU 96 HB2 LEU 96 -6.601 16.519 6.060 647 HB3 LEU 96 HB1 LEU 96 -6.879 14.880 5.472 648 HG LEU 96 HG LEU 96 -4.305 15.391 6.885 649 HD11 LEU 96 HD21 LEU 96 -7.025 15.584 8.130 650 HD12 LEU 96 HD22 LEU 96 -5.550 16.467 8.526 651 HD13 LEU 96 HD23 LEU 96 -5.736 14.789 9.032 652 HD21 LEU 96 HD11 LEU 96 -6.338 13.152 7.062 653 HD22 LEU 96 HD12 LEU 96 -4.673 13.118 7.642 654 HD23 LEU 96 HD13 LEU 96 -5.002 13.183 5.910 655 H THR 97 HN THR 97 -5.411 18.392 4.444 656 HA THR 97 HA THR 97 -7.631 18.581 2.645 657 HB THR 97 HB THR 97 -5.481 20.633 3.253 658 HG1 THR 97 HG1 THR 97 -6.408 20.523 5.126 659 HG21 THR 97 HG21 THR 97 -8.059 20.686 1.749 660 HG22 THR 97 HG22 THR 97 -6.567 21.575 1.449 661 HG23 THR 97 HG23 THR 97 -7.653 22.089 2.738 662 H SER 98 HN SER 98 -4.119 19.018 2.088 663 HA SER 98 HA SER 98 -4.390 19.462 -0.739 664 HB2 SER 98 HB2 SER 98 -1.988 19.125 -0.839 665 HB3 SER 98 HB1 SER 98 -2.361 20.041 0.621 666 HG SER 98 HG SER 98 -2.137 18.197 1.828 667 H ALA 99 HN ALA 99 -3.838 16.533 1.196 668 HA ALA 99 HA ALA 99 -3.369 14.746 -0.972 669 HB1 ALA 99 HB1 ALA 99 -2.996 14.164 1.417 670 HB2 ALA 99 HB2 ALA 99 -3.998 12.968 0.595 671 HB3 ALA 99 HB3 ALA 99 -4.742 14.153 1.669 672 H PHE 100 HN PHE 100 -6.393 15.834 0.550 673 HA PHE 100 HA PHE 100 -8.210 14.104 -0.720 674 HB2 PHE 100 HB1 PHE 100 -8.320 16.813 0.447 675 HB3 PHE 100 HB2 PHE 100 -9.567 16.484 -0.757 676 HD1 PHE 100 HD2 PHE 100 -10.689 14.066 -0.531 677 HD2 PHE 100 HD1 PHE 100 -8.743 16.200 2.647 678 HE1 PHE 100 HE2 PHE 100 -11.950 12.732 1.137 679 HE2 PHE 100 HE1 PHE 100 -10.003 14.869 4.314 680 HZ PHE 100 HZ PHE 100 -11.604 13.132 3.558 681 H TYR 101 HN TYR 101 -7.195 17.335 -1.879 682 HA TYR 101 HA TYR 101 -8.405 16.952 -4.480 683 HB2 TYR 101 HB2 TYR 101 -6.195 18.922 -3.974 684 HB3 TYR 101 HB1 TYR 101 -7.643 19.105 -4.967 685 HD1 TYR 101 HD2 TYR 101 -9.859 18.395 -3.332 686 HD2 TYR 101 HD1 TYR 101 -6.243 20.401 -2.165 687 HE1 TYR 101 HE2 TYR 101 -11.048 19.417 -1.409 688 HE2 TYR 101 HE1 TYR 101 -7.433 21.425 -0.244 689 HH TYR 101 HH TYR 101 -10.061 21.997 0.198 690 H GLN 102 HN GLN 102 -5.209 16.416 -3.129 691 HA GLN 102 HA GLN 102 -3.876 16.023 -5.659 692 HB2 GLN 102 HB1 GLN 102 -3.220 15.168 -2.831 693 HB3 GLN 102 HB2 GLN 102 -2.162 14.833 -4.201 694 HG2 GLN 102 HG2 GLN 102 -3.135 17.608 -3.467 695 HG3 GLN 102 HG1 GLN 102 -1.584 16.946 -2.950 696 HE21 GLN 102 HE21 GLN 102 -2.741 19.011 -5.188 697 HE22 GLN 102 HE22 GLN 102 -1.736 18.665 -6.510 698 H THR 103 HN THR 103 -6.022 14.054 -3.779 699 HA THR 103 HA THR 103 -5.116 11.642 -5.283 700 HB THR 103 HB THR 103 -6.321 10.336 -3.603 701 HG1 THR 103 HG1 THR 103 -7.070 11.757 -1.758 702 HG21 THR 103 HG21 THR 103 -4.139 12.155 -3.042 703 HG22 THR 103 HG22 THR 103 -4.373 10.496 -2.491 704 HG23 THR 103 HG23 THR 103 -5.072 11.834 -1.580 705 H THR 104 HN THR 104 -8.280 12.981 -4.149 706 HA THR 104 HA THR 104 -9.364 12.096 -6.795 707 HB THR 104 HB THR 104 -10.381 10.530 -5.440 708 HG1 THR 104 HG1 THR 104 -11.943 12.071 -6.347 709 HG21 THR 104 HG21 THR 104 -11.266 11.488 -3.080 710 HG22 THR 104 HG22 THR 104 -9.892 12.562 -3.330 711 HG23 THR 104 HG23 THR 104 -9.649 10.816 -3.291 712 H GLY 105 HN GLY 105 -9.850 14.334 -4.052 713 HA2 GLY 105 HA2 GLY 105 -10.185 16.733 -4.630 714 HA3 GLY 105 HA1 GLY 105 -11.126 16.194 -6.018 715 H VAL 106 HN VAL 106 -11.223 15.163 -2.597 716 HA VAL 106 HA VAL 106 -14.153 15.707 -2.643 717 HB VAL 106 HB VAL 106 -12.629 14.158 -0.538 718 HG11 VAL 106 HG21 VAL 106 -15.491 14.612 -1.293 719 HG12 VAL 106 HG22 VAL 106 -14.756 14.536 0.309 720 HG13 VAL 106 HG23 VAL 106 -15.046 13.052 -0.601 721 HG21 VAL 106 HG11 VAL 106 -13.285 12.120 -1.788 722 HG22 VAL 106 HG12 VAL 106 -12.187 13.129 -2.729 723 HG23 VAL 106 HG13 VAL 106 -13.914 13.131 -3.088 724 H VAL 107 HN VAL 107 -14.982 16.437 -0.367 725 HA VAL 107 HA VAL 107 -13.621 18.922 0.268 726 HB VAL 107 HB VAL 107 -15.386 19.043 2.084 727 HG11 VAL 107 HG21 VAL 107 -17.307 19.017 0.344 728 HG12 VAL 107 HG22 VAL 107 -16.059 18.571 -0.820 729 HG13 VAL 107 HG23 VAL 107 -15.951 20.104 0.046 730 HG21 VAL 107 HG11 VAL 107 -16.361 17.109 2.704 731 HG22 VAL 107 HG12 VAL 107 -15.528 16.247 1.409 732 HG23 VAL 107 HG13 VAL 107 -17.095 17.001 1.104 733 H ASN 108 HN ASN 108 -11.899 19.067 1.600 734 HA ASN 108 HA ASN 108 -11.026 16.859 3.252 735 HB2 ASN 108 HB2 ASN 108 -9.258 18.414 3.982 736 HB3 ASN 108 HB1 ASN 108 -9.441 18.448 2.229 737 HD21 ASN 108 HD21 ASN 108 -8.672 20.581 4.433 738 HD22 ASN 108 HD22 ASN 108 -9.581 21.930 3.955 739 H SER 109 HN SER 109 -12.911 19.750 3.810 740 HA SER 109 HA SER 109 -12.662 19.961 6.622 741 HB2 SER 109 HB2 SER 109 -14.745 21.202 6.561 742 HB3 SER 109 HB1 SER 109 -13.803 21.621 5.130 743 HG SER 109 HG SER 109 -16.120 20.076 5.365 744 H ARG 110 HN ARG 110 -14.938 17.998 4.693 745 HA ARG 110 HA ARG 110 -16.496 17.015 6.839 746 HB2 ARG 110 HB2 ARG 110 -17.028 16.645 4.444 747 HB3 ARG 110 HB1 ARG 110 -15.669 15.528 4.329 748 HG2 ARG 110 HG2 ARG 110 -16.700 14.094 6.055 749 HG3 ARG 110 HG1 ARG 110 -18.061 15.211 6.169 750 HD2 ARG 110 HD2 ARG 110 -18.764 13.451 4.702 751 HD3 ARG 110 HD1 ARG 110 -18.411 14.837 3.670 752 HE ARG 110 HE ARG 110 -16.259 13.738 3.092 753 HH11 ARG 110 HH11 ARG 110 -17.275 11.877 5.598 754 HH12 ARG 110 HH12 ARG 110 -17.255 10.361 4.759 755 HH21 ARG 110 HH21 ARG 110 -16.822 11.793 1.632 756 HH22 ARG 110 HH22 ARG 110 -16.997 10.313 2.515 757 H PHE 111 HN PHE 111 -13.618 15.473 5.350 758 HA PHE 111 HA PHE 111 -13.482 13.454 7.438 759 HB2 PHE 111 HB2 PHE 111 -12.619 13.143 5.099 760 HB3 PHE 111 HB1 PHE 111 -11.320 14.271 5.482 761 HD1 PHE 111 HD2 PHE 111 -12.932 11.135 6.758 762 HD2 PHE 111 HD1 PHE 111 -9.336 13.465 6.437 763 HE1 PHE 111 HE2 PHE 111 -11.643 9.290 7.799 764 HE2 PHE 111 HE1 PHE 111 -8.049 11.619 7.477 765 HZ PHE 111 HZ PHE 111 -9.201 9.532 8.159 766 H ILE 112 HN ILE 112 -11.394 16.242 6.614 767 HA ILE 112 HA ILE 112 -9.661 16.052 8.833 768 HB ILE 112 HB ILE 112 -10.627 18.488 7.314 769 HG12 ILE 112 HG12 ILE 112 -8.127 16.778 7.144 770 HG13 ILE 112 HG11 ILE 112 -9.417 16.867 5.943 771 HG21 ILE 112 HG21 ILE 112 -9.769 19.483 9.230 772 HG22 ILE 112 HG22 ILE 112 -8.299 19.314 8.272 773 HG23 ILE 112 HG23 ILE 112 -8.657 18.150 9.547 774 HD11 ILE 112 HD11 ILE 112 -7.741 18.320 5.108 775 HD12 ILE 112 HD12 ILE 112 -7.415 18.997 6.704 776 HD13 ILE 112 HD13 ILE 112 -8.913 19.398 5.866 777 H SER 113 HN SER 113 -12.887 17.490 8.598 778 HA SER 113 HA SER 113 -12.915 18.943 11.024 779 HB2 SER 113 HB2 SER 113 -14.789 19.145 9.536 780 HB3 SER 113 HB1 SER 113 -15.109 17.413 9.606 781 HG SER 113 HG SER 113 -16.031 17.633 11.498 782 H GLU 114 HN GLU 114 -13.583 15.487 10.444 783 HA GLU 114 HA GLU 114 -14.181 14.921 13.217 784 HB2 GLU 114 HB2 GLU 114 -13.282 13.076 10.983 785 HB3 GLU 114 HB1 GLU 114 -13.928 12.550 12.537 786 HG2 GLU 114 HG2 GLU 114 -16.033 13.766 12.063 787 HG3 GLU 114 HG1 GLU 114 -15.386 14.262 10.499 788 H ILE 115 HN ILE 115 -11.241 14.822 11.244 789 HA ILE 115 HA ILE 115 -9.610 13.582 13.297 790 HB ILE 115 HB ILE 115 -8.749 15.307 10.954 791 HG12 ILE 115 HG11 ILE 115 -9.125 12.303 11.172 792 HG13 ILE 115 HG12 ILE 115 -10.126 13.401 10.221 793 HG21 ILE 115 HG21 ILE 115 -7.257 13.186 12.527 794 HG22 ILE 115 HG22 ILE 115 -7.045 14.924 12.739 795 HG23 ILE 115 HG23 ILE 115 -6.608 14.161 11.209 796 HD11 ILE 115 HD11 ILE 115 -8.602 13.513 8.547 797 HD12 ILE 115 HD12 ILE 115 -7.889 12.078 9.284 798 HD13 ILE 115 HD13 ILE 115 -7.255 13.677 9.672 799 H ARG 116 HN ARG 116 -10.196 16.932 12.260 800 HA ARG 116 HA ARG 116 -8.322 18.247 13.898 801 HB2 ARG 116 HB2 ARG 116 -9.494 19.597 12.346 802 HB3 ARG 116 HB1 ARG 116 -11.065 19.022 12.902 803 HG2 ARG 116 HG2 ARG 116 -10.975 20.309 14.874 804 HG3 ARG 116 HG1 ARG 116 -9.229 20.534 14.755 805 HD2 ARG 116 HD2 ARG 116 -10.012 22.603 14.011 806 HD3 ARG 116 HD1 ARG 116 -9.833 21.731 12.488 807 HE ARG 116 HE ARG 116 -12.147 22.029 12.230 808 HH11 ARG 116 HH11 ARG 116 -12.909 19.999 14.228 809 HH12 ARG 116 HH12 ARG 116 -13.825 20.911 15.380 810 HH21 ARG 116 HH21 ARG 116 -12.641 23.982 14.293 811 HH22 ARG 116 HH22 ARG 116 -13.674 23.165 15.417 812 H SER 117 HN SER 117 -11.591 17.086 14.695 813 HA SER 117 HA SER 117 -11.520 18.120 17.404 814 HB2 SER 117 HB2 SER 117 -13.630 17.589 16.151 815 HB3 SER 117 HB1 SER 117 -13.232 15.878 16.293 816 HG SER 117 HG SER 117 -13.461 15.986 18.461 817 H LEU 118 HN LEU 118 -10.635 15.071 15.865 818 HA LEU 118 HA LEU 118 -10.296 13.583 18.313 819 HB2 LEU 118 HB2 LEU 118 -9.177 13.212 15.524 820 HB3 LEU 118 HB1 LEU 118 -8.896 12.068 16.836 821 HG LEU 118 HG LEU 118 -11.706 12.928 16.221 822 HD11 LEU 118 HD21 LEU 118 -11.486 10.596 14.826 823 HD12 LEU 118 HD22 LEU 118 -9.919 11.329 14.486 824 HD13 LEU 118 HD23 LEU 118 -11.402 12.192 14.082 825 HD21 LEU 118 HD11 LEU 118 -10.825 11.431 18.190 826 HD22 LEU 118 HD12 LEU 118 -10.735 10.179 16.952 827 HD23 LEU 118 HD13 LEU 118 -12.280 10.946 17.319 828 H ILE 119 HN ILE 119 -8.028 15.404 16.242 829 HA ILE 119 HA ILE 119 -5.654 14.791 17.663 830 HB ILE 119 HB ILE 119 -6.357 17.404 16.293 831 HG12 ILE 119 HG12 ILE 119 -4.940 14.979 15.157 832 HG13 ILE 119 HG11 ILE 119 -6.656 15.303 14.913 833 HG21 ILE 119 HG21 ILE 119 -4.363 17.730 17.551 834 HG22 ILE 119 HG22 ILE 119 -3.813 17.357 15.917 835 HG23 ILE 119 HG23 ILE 119 -3.766 16.115 17.168 836 HD11 ILE 119 HD11 ILE 119 -6.260 17.116 13.536 837 HD12 ILE 119 HD12 ILE 119 -4.815 16.168 13.179 838 HD13 ILE 119 HD13 ILE 119 -4.730 17.509 14.322 839 H GLY 120 HN GLY 120 -7.941 17.497 18.148 840 HA2 GLY 120 HA2 GLY 120 -6.560 18.707 20.321 841 HA3 GLY 120 HA1 GLY 120 -8.293 18.852 20.032 842 H MET 121 HN MET 121 -8.594 15.863 20.174 843 HA MET 121 HA MET 121 -9.172 15.680 22.987 844 HB2 MET 121 HB1 MET 121 -10.355 14.395 21.170 845 HB3 MET 121 HB2 MET 121 -8.909 13.396 21.012 846 HG2 MET 121 HG1 MET 121 -9.102 12.843 23.454 847 HG3 MET 121 HG2 MET 121 -10.635 13.714 23.485 848 HE1 MET 121 HE1 MET 121 -12.165 12.478 20.442 849 HE2 MET 121 HE2 MET 121 -12.235 13.552 21.836 850 HE3 MET 121 HE3 MET 121 -13.141 12.042 21.851 851 H PHE 122 HN PHE 122 -6.557 14.355 20.962 852 HA PHE 122 HA PHE 122 -5.290 12.808 22.984 853 HB2 PHE 122 HB1 PHE 122 -4.095 14.264 20.608 854 HB3 PHE 122 HB2 PHE 122 -3.231 13.078 21.587 855 HD1 PHE 122 HD1 PHE 122 -3.898 10.706 21.575 856 HD2 PHE 122 HD2 PHE 122 -5.871 13.600 19.091 857 HE1 PHE 122 HE1 PHE 122 -4.913 8.873 20.249 858 HE2 PHE 122 HE2 PHE 122 -6.888 11.768 17.763 859 HZ PHE 122 HZ PHE 122 -6.408 9.404 18.343 860 H ALA 123 HN ALA 123 -5.184 16.259 22.286 861 HA ALA 123 HA ALA 123 -2.908 16.944 23.848 862 HB1 ALA 123 HB1 ALA 123 -3.650 19.169 23.696 863 HB2 ALA 123 HB2 ALA 123 -5.350 18.701 23.724 864 HB3 ALA 123 HB3 ALA 123 -4.382 18.420 22.277 865 H GLN 124 HN GLN 124 -6.272 16.365 24.755 866 HA GLN 124 HA GLN 124 -5.975 17.259 27.488 867 HB2 GLN 124 HB2 GLN 124 -7.985 15.410 26.171 868 HB3 GLN 124 HB1 GLN 124 -8.104 15.958 27.843 869 HG2 GLN 124 HG2 GLN 124 -8.165 18.295 27.092 870 HG3 GLN 124 HG1 GLN 124 -7.986 17.775 25.416 871 HE21 GLN 124 HE21 GLN 124 -10.284 19.267 26.345 872 HE22 GLN 124 HE22 GLN 124 -11.644 18.261 26.213 873 H ALA 125 HN ALA 125 -5.662 14.117 25.868 874 HA ALA 125 HA ALA 125 -5.293 12.612 28.307 875 HB1 ALA 125 HB1 ALA 125 -5.837 11.181 26.583 876 HB2 ALA 125 HB2 ALA 125 -4.080 11.045 26.504 877 HB3 ALA 125 HB3 ALA 125 -4.934 12.110 25.387 878 H SER 126 HN SER 126 -3.076 14.174 26.011 879 HA SER 126 HA SER 126 -0.661 13.179 27.205 880 HB2 SER 126 HB2 SER 126 0.473 14.879 25.918 881 HB3 SER 126 HB1 SER 126 -0.849 14.259 24.928 882 HG SER 126 HG SER 126 -1.048 16.421 24.817 883 H ALA 127 HN ALA 127 -2.856 15.749 28.066 884 HA ALA 127 HA ALA 127 -1.070 17.291 29.697 885 HB1 ALA 127 HB1 ALA 127 -2.938 18.488 30.299 886 HB2 ALA 127 HB2 ALA 127 -3.921 17.040 30.521 887 HB3 ALA 127 HB3 ALA 127 -3.614 17.658 28.898 888 H ASN 128 HN ASN 128 -2.744 14.271 30.211 889 HA ASN 128 HA ASN 128 -2.506 14.286 33.105 890 HB2 ASN 128 HB2 ASN 128 -2.920 12.013 31.138 891 HB3 ASN 128 HB1 ASN 128 -3.031 11.852 32.891 892 HD21 ASN 128 HD21 ASN 128 -5.298 11.333 31.223 893 HD22 ASN 128 HD22 ASN 128 -6.460 12.543 31.488 894 H ASP 129 HN ASP 129 -0.466 13.269 30.429 895 HA ASP 129 HA ASP 129 1.353 11.635 31.905 896 HB2 ASP 129 HB2 ASP 129 1.228 11.865 29.379 897 HB3 ASP 129 HB1 ASP 129 2.068 13.405 29.555 898 H VAL 130 HN VAL 130 1.410 15.126 31.161 899 HA VAL 130 HA VAL 130 3.866 15.668 32.530 900 HB VAL 130 HB VAL 130 2.976 17.301 30.984 901 HG11 VAL 130 HG11 VAL 130 0.840 18.566 31.885 902 HG12 VAL 130 HG12 VAL 130 0.552 17.048 32.735 903 HG13 VAL 130 HG13 VAL 130 0.658 17.066 30.974 904 HG21 VAL 130 HG21 VAL 130 2.934 18.185 33.877 905 HG22 VAL 130 HG22 VAL 130 2.811 19.324 32.536 906 HG23 VAL 130 HG23 VAL 130 4.257 18.331 32.722 907 H TYR 131 HN TYR 131 0.532 15.386 33.624 908 HA TYR 131 HA TYR 131 1.252 14.887 36.327 909 HB2 TYR 131 HB2 TYR 131 0.735 16.948 37.438 910 HB3 TYR 131 HB1 TYR 131 1.878 17.349 36.157 911 HD1 TYR 131 HD1 TYR 131 1.078 18.398 34.044 912 HD2 TYR 131 HD2 TYR 131 -1.542 17.727 37.381 913 HE1 TYR 131 HE1 TYR 131 -0.571 19.974 33.067 914 HE2 TYR 131 HE2 TYR 131 -3.190 19.302 36.404 915 HH TYR 131 HH TYR 131 -2.639 21.506 34.366 916 H ALA 132 HN ALA 132 -0.819 15.235 37.789 917 HA ALA 132 HA ALA 132 -3.041 14.012 36.324 918 HB1 ALA 132 HB1 ALA 132 -3.690 13.260 38.363 919 HB2 ALA 132 HB2 ALA 132 -3.570 14.864 39.084 920 HB3 ALA 132 HB3 ALA 132 -2.131 13.856 38.929 921 H SER 133 HN SER 133 -4.668 15.163 35.407 922 HA SER 133 HA SER 133 -4.829 17.952 35.299 923 HB2 SER 133 HB2 SER 133 -7.185 16.042 35.224 924 HB3 SER 133 HB1 SER 133 -7.135 17.668 34.542 925 HG SER 133 HG SER 133 -6.506 16.617 32.829 926 H ALA 134 HN ALA 134 -6.176 19.495 36.417 927 HA ALA 134 HA ALA 134 -6.895 18.618 39.185 928 HB1 ALA 134 HB1 ALA 134 -6.631 21.501 38.792 929 HB2 ALA 134 HB2 ALA 134 -5.151 20.636 38.380 930 HB3 ALA 134 HB3 ALA 134 -5.856 20.460 39.986 931 H GLY 135 HN GLY 135 -8.851 19.525 40.090 932 HA2 GLY 135 HA2 GLY 135 -11.092 19.560 38.387 933 HA3 GLY 135 HA1 GLY 135 -11.074 20.275 39.999 934 H SER 136 HN SER 136 -8.895 22.156 39.269 935 HA SER 136 HA SER 136 -10.520 24.011 37.574 936 HB2 SER 136 HB2 SER 136 -10.256 24.700 39.965 937 HB3 SER 136 HB1 SER 136 -8.508 24.731 39.728 938 HG SER 136 HG SER 136 -10.240 26.636 39.199 939 H GLY 137 HN GLY 137 -9.467 25.061 35.881 940 HA2 GLY 137 HA2 GLY 137 -7.158 23.850 34.742 941 HA3 GLY 137 HA1 GLY 137 -7.809 25.417 34.261 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 -19.664 2.246 -13.809 2 H2 GLY 1 HT2 GLY 1 -19.168 3.261 -12.540 3 H3 GLY 1 HT3 GLY 1 -18.053 2.768 -13.722 4 HA2 GLY 1 HA2 GLY 1 -19.882 3.915 -15.275 5 HA3 GLY 1 HA1 GLY 1 -20.039 4.880 -13.806 6 H MET 2 HN MET 2 -18.484 6.415 -13.402 7 HA MET 2 HA MET 2 -16.645 7.190 -15.424 8 HB2 MET 2 HB1 MET 2 -16.622 7.800 -12.452 9 HB3 MET 2 HB2 MET 2 -15.640 8.637 -13.655 10 HG2 MET 2 HG1 MET 2 -18.671 8.519 -13.598 11 HG3 MET 2 HG2 MET 2 -17.682 9.922 -13.192 12 HE1 MET 2 HE1 MET 2 -15.325 9.640 -15.923 13 HE2 MET 2 HE2 MET 2 -15.812 10.559 -14.501 14 HE3 MET 2 HE3 MET 2 -16.108 11.214 -16.110 15 H GLY 3 HN GLY 3 -16.253 5.095 -12.602 16 HA2 GLY 3 HA2 GLY 3 -14.621 3.366 -12.396 17 HA3 GLY 3 HA1 GLY 3 -13.772 4.036 -13.789 18 H GLN 4 HN GLN 4 -14.689 6.340 -11.421 19 HA GLN 4 HA GLN 4 -11.850 6.465 -10.498 20 HB2 GLN 4 HB2 GLN 4 -13.946 8.654 -10.396 21 HB3 GLN 4 HB1 GLN 4 -12.218 8.824 -10.084 22 HG2 GLN 4 HG1 GLN 4 -13.468 8.014 -12.728 23 HG3 GLN 4 HG2 GLN 4 -12.772 9.592 -12.361 24 HE21 GLN 4 HE21 GLN 4 -11.983 7.033 -14.133 25 HE22 GLN 4 HE22 GLN 4 -10.313 6.925 -13.846 26 H ALA 5 HN ALA 5 -11.425 6.577 -8.266 27 HA ALA 5 HA ALA 5 -13.432 5.404 -6.531 28 HB1 ALA 5 HB1 ALA 5 -10.953 6.757 -5.496 29 HB2 ALA 5 HB2 ALA 5 -10.810 5.259 -6.415 30 HB3 ALA 5 HB3 ALA 5 -11.741 5.289 -4.917 31 H ASN 6 HN ASN 6 -14.731 6.431 -5.023 32 HA ASN 6 HA ASN 6 -15.244 9.252 -5.370 33 HB2 ASN 6 HB2 ASN 6 -16.161 7.354 -3.188 34 HB3 ASN 6 HB1 ASN 6 -16.831 8.956 -3.494 35 HD21 ASN 6 HD21 ASN 6 -18.421 6.549 -3.686 36 HD22 ASN 6 HD22 ASN 6 -18.903 6.386 -5.305 37 H THR 7 HN THR 7 -13.090 7.444 -3.359 38 HA THR 7 HA THR 7 -12.023 9.935 -2.240 39 HB THR 7 HB THR 7 -13.599 9.670 -0.516 40 HG1 THR 7 HG1 THR 7 -11.598 7.966 0.468 41 HG21 THR 7 HG21 THR 7 -13.353 6.958 0.312 42 HG22 THR 7 HG22 THR 7 -13.622 6.960 -1.432 43 HG23 THR 7 HG23 THR 7 -14.772 7.762 -0.362 44 HA PRO 8 HA PRO 8 -8.218 7.684 -2.413 45 HB2 PRO 8 HB2 PRO 8 -6.895 8.653 -0.259 46 HB3 PRO 8 HB1 PRO 8 -7.125 9.566 -1.752 47 HG2 PRO 8 HG2 PRO 8 -8.694 9.685 0.803 48 HG3 PRO 8 HG1 PRO 8 -8.075 11.019 -0.176 49 HD2 PRO 8 HD2 PRO 8 -10.637 10.281 -0.351 50 HD3 PRO 8 HD1 PRO 8 -9.743 10.775 -1.789 51 H TRP 9 HN TRP 9 -9.799 7.675 0.800 52 HA TRP 9 HA TRP 9 -8.310 5.253 1.553 53 HB2 TRP 9 HB2 TRP 9 -9.597 5.349 3.640 54 HB3 TRP 9 HB1 TRP 9 -8.894 6.923 3.280 55 HD1 TRP 9 HD1 TRP 9 -12.220 5.079 3.422 56 HE1 TRP 9 HE1 TRP 9 -14.134 6.804 3.299 57 HE3 TRP 9 HE3 TRP 9 -9.536 9.286 2.398 58 HZ2 TRP 9 HZ2 TRP 9 -14.473 9.613 2.826 59 HZ3 TRP 9 HZ3 TRP 9 -10.666 11.467 2.118 60 HH2 TRP 9 HH2 TRP 9 -13.134 11.642 2.330 61 H SER 10 HN SER 10 -10.526 5.578 -0.675 62 HA SER 10 HA SER 10 -12.246 3.307 0.199 63 HB2 SER 10 HB1 SER 10 -12.522 5.504 -1.817 64 HB3 SER 10 HB2 SER 10 -13.345 3.977 -2.133 65 HG SER 10 HG SER 10 -14.274 4.171 -0.028 66 H SER 11 HN SER 11 -9.615 4.163 -1.850 67 HA SER 11 HA SER 11 -9.803 1.501 -3.204 68 HB2 SER 11 HB1 SER 11 -8.555 4.080 -4.203 69 HB3 SER 11 HB2 SER 11 -8.471 2.530 -5.042 70 HG SER 11 HG SER 11 -10.654 2.564 -5.327 71 H LYS 12 HN LYS 12 -7.705 0.456 -3.587 72 HA LYS 12 HA LYS 12 -5.937 0.713 -1.297 73 HB2 LYS 12 HB1 LYS 12 -6.538 -1.357 -2.895 74 HB3 LYS 12 HB2 LYS 12 -5.070 -0.812 -3.703 75 HG2 LYS 12 HG2 LYS 12 -3.816 -0.962 -1.617 76 HG3 LYS 12 HG1 LYS 12 -5.282 -1.382 -0.732 77 HD2 LYS 12 HD1 LYS 12 -3.934 -3.394 -1.256 78 HD3 LYS 12 HD2 LYS 12 -5.504 -3.445 -2.059 79 HE2 LYS 12 HE2 LYS 12 -4.590 -3.187 -4.149 80 HE3 LYS 12 HE1 LYS 12 -3.290 -2.148 -3.564 81 HZ1 LYS 12 HZ1 LYS 12 -2.893 -4.621 -2.399 82 HZ2 LYS 12 HZ2 LYS 12 -1.972 -3.907 -3.636 83 HZ3 LYS 12 HZ3 LYS 12 -3.265 -4.940 -4.023 84 H ALA 13 HN ALA 13 -5.720 1.547 -4.744 85 HA ALA 13 HA ALA 13 -2.981 2.518 -4.485 86 HB1 ALA 13 HB1 ALA 13 -3.026 2.592 -6.752 87 HB2 ALA 13 HB2 ALA 13 -4.536 3.504 -6.776 88 HB3 ALA 13 HB3 ALA 13 -4.568 1.748 -6.609 89 H ASN 14 HN ASN 14 -6.218 3.950 -4.522 90 HA ASN 14 HA ASN 14 -5.267 6.690 -4.573 91 HB2 ASN 14 HB1 ASN 14 -7.693 5.574 -4.996 92 HB3 ASN 14 HB2 ASN 14 -7.894 6.093 -3.324 93 HD21 ASN 14 HD21 ASN 14 -8.996 7.223 -5.975 94 HD22 ASN 14 HD22 ASN 14 -8.598 8.873 -5.907 95 H ALA 15 HN ALA 15 -5.902 4.342 -2.043 96 HA ALA 15 HA ALA 15 -5.925 6.246 0.132 97 HB1 ALA 15 HB1 ALA 15 -5.451 3.260 0.040 98 HB2 ALA 15 HB2 ALA 15 -6.940 4.093 0.486 99 HB3 ALA 15 HB3 ALA 15 -5.529 4.183 1.540 100 H ASP 16 HN ASP 16 -3.427 3.985 -1.042 101 HA ASP 16 HA ASP 16 -1.385 4.716 0.756 102 HB2 ASP 16 HB2 ASP 16 0.142 3.694 -0.751 103 HB3 ASP 16 HB1 ASP 16 -1.380 2.842 -1.000 104 H ALA 17 HN ALA 17 -2.146 6.147 -2.432 105 HA ALA 17 HA ALA 17 -0.056 8.067 -2.452 106 HB1 ALA 17 HB1 ALA 17 -1.110 8.945 -4.297 107 HB2 ALA 17 HB2 ALA 17 -2.705 8.879 -3.547 108 HB3 ALA 17 HB3 ALA 17 -1.984 7.415 -4.213 109 H PHE 18 HN PHE 18 -3.317 8.220 -1.036 110 HA PHE 18 HA PHE 18 -3.192 10.961 -0.229 111 HB2 PHE 18 HB1 PHE 18 -5.262 9.516 -0.276 112 HB3 PHE 18 HB2 PHE 18 -4.677 8.736 1.194 113 HD1 PHE 18 HD2 PHE 18 -5.942 11.878 -0.272 114 HD2 PHE 18 HD1 PHE 18 -4.630 9.921 3.320 115 HE1 PHE 18 HE2 PHE 18 -6.846 13.751 1.078 116 HE2 PHE 18 HE1 PHE 18 -5.536 11.793 4.668 117 HZ PHE 18 HZ PHE 18 -6.640 13.709 3.546 118 H ILE 19 HN ILE 19 -2.112 7.973 1.351 119 HA ILE 19 HA ILE 19 -1.441 9.255 3.860 120 HB ILE 19 HB ILE 19 -0.302 6.696 2.698 121 HG12 ILE 19 HG11 ILE 19 -2.694 6.483 2.663 122 HG13 ILE 19 HG12 ILE 19 -2.133 5.637 4.105 123 HG21 ILE 19 HG21 ILE 19 0.268 8.134 5.058 124 HG22 ILE 19 HG22 ILE 19 0.757 6.483 4.676 125 HG23 ILE 19 HG23 ILE 19 -0.742 6.777 5.557 126 HD11 ILE 19 HD11 ILE 19 -2.466 8.181 5.067 127 HD12 ILE 19 HD12 ILE 19 -3.682 6.908 5.185 128 HD13 ILE 19 HD13 ILE 19 -3.763 8.087 3.875 129 H ASN 20 HN ASN 20 0.345 8.532 0.888 130 HA ASN 20 HA ASN 20 2.933 9.271 1.903 131 HB2 ASN 20 HB1 ASN 20 1.923 9.360 -0.955 132 HB3 ASN 20 HB2 ASN 20 3.612 9.327 -0.445 133 HD21 ASN 20 HD21 ASN 20 1.562 7.308 -1.854 134 HD22 ASN 20 HD22 ASN 20 1.888 5.846 -1.055 135 H SER 21 HN SER 21 0.553 11.085 -0.061 136 HA SER 21 HA SER 21 2.071 13.509 -0.136 137 HB2 SER 21 HB2 SER 21 -0.071 12.750 -1.475 138 HB3 SER 21 HB1 SER 21 -0.928 13.549 -0.157 139 HG SER 21 HG SER 21 1.032 14.666 -1.871 140 H PHE 22 HN PHE 22 -0.153 12.191 2.257 141 HA PHE 22 HA PHE 22 -0.624 14.604 3.716 142 HB2 PHE 22 HB1 PHE 22 -1.949 12.578 4.104 143 HB3 PHE 22 HB2 PHE 22 -0.519 11.739 4.706 144 HD1 PHE 22 HD1 PHE 22 0.589 12.512 6.816 145 HD2 PHE 22 HD2 PHE 22 -3.159 14.129 5.477 146 HE1 PHE 22 HE1 PHE 22 0.180 13.440 9.080 147 HE2 PHE 22 HE2 PHE 22 -3.567 15.057 7.740 148 HZ PHE 22 HZ PHE 22 -1.899 14.712 9.542 149 H ILE 23 HN ILE 23 1.793 12.019 4.277 150 HA ILE 23 HA ILE 23 3.090 13.295 6.465 151 HB ILE 23 HB ILE 23 4.329 11.476 4.381 152 HG12 ILE 23 HG12 ILE 23 2.995 10.792 7.019 153 HG13 ILE 23 HG11 ILE 23 2.267 10.545 5.432 154 HG21 ILE 23 HG21 ILE 23 6.207 11.709 5.599 155 HG22 ILE 23 HG22 ILE 23 5.350 11.092 7.012 156 HG23 ILE 23 HG23 ILE 23 5.381 12.825 6.686 157 HD11 ILE 23 HD11 ILE 23 3.331 8.568 5.273 158 HD12 ILE 23 HD12 ILE 23 4.112 8.847 6.829 159 HD13 ILE 23 HD13 ILE 23 4.876 9.414 5.344 160 H SER 24 HN SER 24 4.105 13.228 3.025 161 HA SER 24 HA SER 24 6.238 15.084 3.319 162 HB2 SER 24 HB2 SER 24 4.480 14.653 0.883 163 HB3 SER 24 HB1 SER 24 6.090 15.372 0.890 164 HG SER 24 HG SER 24 6.325 13.235 0.377 165 H ALA 25 HN ALA 25 2.778 15.582 2.873 166 HA ALA 25 HA ALA 25 3.045 18.440 2.371 167 HB1 ALA 25 HB1 ALA 25 1.102 17.255 1.507 168 HB2 ALA 25 HB2 ALA 25 0.564 18.443 2.693 169 HB3 ALA 25 HB3 ALA 25 0.654 16.738 3.133 170 H ALA 26 HN ALA 26 2.079 16.453 5.180 171 HA ALA 26 HA ALA 26 1.630 18.692 6.927 172 HB1 ALA 26 HB1 ALA 26 2.571 16.084 8.035 173 HB2 ALA 26 HB2 ALA 26 1.049 16.098 7.145 174 HB3 ALA 26 HB3 ALA 26 1.248 17.118 8.572 175 H SER 27 HN SER 27 4.505 16.815 6.113 176 HA SER 27 HA SER 27 6.170 17.744 8.241 177 HB2 SER 27 HB2 SER 27 6.928 16.923 5.422 178 HB3 SER 27 HB1 SER 27 8.052 17.085 6.771 179 HG SER 27 HG SER 27 6.310 15.582 7.777 180 H ASN 28 HN ASN 28 5.159 19.242 5.238 181 HA ASN 28 HA ASN 28 7.068 21.479 5.737 182 HB2 ASN 28 HB2 ASN 28 5.453 20.771 3.271 183 HB3 ASN 28 HB1 ASN 28 6.507 22.177 3.411 184 HD21 ASN 28 HD21 ASN 28 6.739 19.654 1.678 185 HD22 ASN 28 HD22 ASN 28 8.297 19.068 2.009 186 H THR 29 HN THR 29 4.074 20.726 6.711 187 HA THR 29 HA THR 29 2.809 23.312 6.023 188 HB THR 29 HB THR 29 1.707 21.084 7.755 189 HG1 THR 29 HG1 THR 29 1.961 20.165 5.817 190 HG21 THR 29 HG21 THR 29 0.294 23.247 6.180 191 HG22 THR 29 HG22 THR 29 0.674 23.381 7.897 192 HG23 THR 29 HG23 THR 29 -0.423 22.123 7.333 193 H GLY 30 HN GLY 30 2.777 21.604 9.157 194 HA2 GLY 30 HA2 GLY 30 3.057 24.188 10.523 195 HA3 GLY 30 HA1 GLY 30 2.788 22.629 11.300 196 H SER 31 HN SER 31 4.546 21.566 12.143 197 HA SER 31 HA SER 31 7.255 22.578 11.392 198 HB2 SER 31 HB1 SER 31 6.516 21.784 14.213 199 HB3 SER 31 HB2 SER 31 7.939 22.671 13.667 200 HG SER 31 HG SER 31 6.752 24.449 13.373 201 H PHE 32 HN PHE 32 5.731 20.011 13.385 202 HA PHE 32 HA PHE 32 6.374 17.752 13.616 203 HB2 PHE 32 HB2 PHE 32 6.199 18.319 10.673 204 HB3 PHE 32 HB1 PHE 32 6.756 16.734 11.210 205 HD1 PHE 32 HD2 PHE 32 5.226 16.135 13.567 206 HD2 PHE 32 HD1 PHE 32 3.960 18.169 9.996 207 HE1 PHE 32 HE2 PHE 32 2.884 15.454 14.008 208 HE2 PHE 32 HE1 PHE 32 1.618 17.486 10.442 209 HZ PHE 32 HZ PHE 32 1.081 16.128 12.447 210 H SER 33 HN SER 33 8.389 17.951 14.697 211 HA SER 33 HA SER 33 10.850 18.671 13.470 212 HB2 SER 33 HB2 SER 33 11.908 17.830 15.422 213 HB3 SER 33 HB1 SER 33 10.324 18.376 15.974 214 HG SER 33 HG SER 33 11.128 15.732 15.359 215 H GLN 34 HN GLN 34 12.666 17.203 12.928 216 HA GLN 34 HA GLN 34 12.018 15.286 10.977 217 HB2 GLN 34 HB1 GLN 34 14.494 15.465 12.720 218 HB3 GLN 34 HB2 GLN 34 14.365 14.468 11.270 219 HG2 GLN 34 HG2 GLN 34 13.889 16.482 9.925 220 HG3 GLN 34 HG1 GLN 34 14.009 17.480 11.374 221 HE21 GLN 34 HE21 GLN 34 15.770 17.972 9.219 222 HE22 GLN 34 HE22 GLN 34 17.341 17.503 9.658 223 H ASP 35 HN ASP 35 12.682 14.810 14.442 224 HA ASP 35 HA ASP 35 12.602 11.974 14.467 225 HB2 ASP 35 HB2 ASP 35 13.228 13.504 16.398 226 HB3 ASP 35 HB1 ASP 35 11.502 13.768 16.646 227 H GLN 36 HN GLN 36 9.993 14.369 14.499 228 HA GLN 36 HA GLN 36 7.881 12.462 14.996 229 HB2 GLN 36 HB1 GLN 36 7.811 15.196 13.680 230 HB3 GLN 36 HB2 GLN 36 6.389 14.284 14.189 231 HG2 GLN 36 HG1 GLN 36 8.627 15.279 15.980 232 HG3 GLN 36 HG2 GLN 36 6.976 15.895 15.928 233 HE21 GLN 36 HE21 GLN 36 8.829 14.086 17.888 234 HE22 GLN 36 HE22 GLN 36 7.694 12.956 18.451 235 H MET 37 HN MET 37 9.514 13.647 12.109 236 HA MET 37 HA MET 37 7.660 12.634 10.179 237 HB2 MET 37 HB1 MET 37 10.657 13.061 10.009 238 HB3 MET 37 HB2 MET 37 9.626 12.696 8.626 239 HG2 MET 37 HG2 MET 37 8.272 14.726 9.145 240 HG3 MET 37 HG1 MET 37 9.392 15.107 10.454 241 HE1 MET 37 HE1 MET 37 9.958 17.682 7.571 242 HE2 MET 37 HE2 MET 37 10.125 17.596 9.323 243 HE3 MET 37 HE3 MET 37 8.635 17.045 8.559 244 H GLU 38 HN GLU 38 10.261 11.131 12.015 245 HA GLU 38 HA GLU 38 10.445 8.709 10.494 246 HB2 GLU 38 HB1 GLU 38 12.069 9.480 12.276 247 HB3 GLU 38 HB2 GLU 38 10.870 9.005 13.480 248 HG2 GLU 38 HG1 GLU 38 10.902 6.699 12.619 249 HG3 GLU 38 HG2 GLU 38 12.074 7.166 11.388 250 H ASN 39 HN ASN 39 8.482 9.585 13.344 251 HA ASN 39 HA ASN 39 7.223 7.087 13.739 252 HB2 ASN 39 HB2 ASN 39 5.992 9.838 14.078 253 HB3 ASN 39 HB1 ASN 39 5.423 8.349 14.834 254 HD21 ASN 39 HD21 ASN 39 7.907 7.197 15.600 255 HD22 ASN 39 HD22 ASN 39 8.685 8.208 16.719 256 H MET 40 HN MET 40 6.436 9.715 11.499 257 HA MET 40 HA MET 40 3.970 8.705 10.522 258 HB2 MET 40 HB1 MET 40 6.149 10.227 9.056 259 HB3 MET 40 HB2 MET 40 4.516 9.978 8.440 260 HG2 MET 40 HG1 MET 40 3.631 11.092 10.507 261 HG3 MET 40 HG2 MET 40 5.293 11.455 10.972 262 HE1 MET 40 HE1 MET 40 4.646 13.806 11.229 263 HE2 MET 40 HE2 MET 40 3.014 13.756 10.565 264 HE3 MET 40 HE3 MET 40 4.170 14.939 9.956 265 H SER 41 HN SER 41 7.293 7.801 9.839 266 HA SER 41 HA SER 41 6.700 6.145 7.546 267 HB2 SER 41 HB2 SER 41 8.954 5.433 7.681 268 HB3 SER 41 HB1 SER 41 8.988 7.088 8.291 269 HG SER 41 HG SER 41 10.106 5.504 9.606 270 H LEU 42 HN LEU 42 6.455 5.713 10.987 271 HA LEU 42 HA LEU 42 6.312 2.774 10.766 272 HB2 LEU 42 HB2 LEU 42 6.104 4.728 13.060 273 HB3 LEU 42 HB1 LEU 42 5.721 3.019 13.263 274 HG LEU 42 HG LEU 42 8.036 2.614 12.129 275 HD11 LEU 42 HD21 LEU 42 9.145 4.487 11.547 276 HD12 LEU 42 HD22 LEU 42 9.295 4.866 13.263 277 HD13 LEU 42 HD23 LEU 42 7.936 5.500 12.336 278 HD21 LEU 42 HD11 LEU 42 8.959 2.332 14.244 279 HD22 LEU 42 HD12 LEU 42 7.247 2.451 14.654 280 HD23 LEU 42 HD13 LEU 42 8.299 3.854 14.846 281 H ILE 43 HN ILE 43 4.178 5.516 10.820 282 HA ILE 43 HA ILE 43 1.868 3.622 10.746 283 HB ILE 43 HB ILE 43 2.152 6.204 12.292 284 HG12 ILE 43 HG11 ILE 43 1.076 3.486 13.093 285 HG13 ILE 43 HG12 ILE 43 2.751 3.985 13.332 286 HG21 ILE 43 HG21 ILE 43 -0.458 5.231 12.641 287 HG22 ILE 43 HG22 ILE 43 -0.186 5.182 10.900 288 HG23 ILE 43 HG23 ILE 43 0.009 6.697 11.780 289 HD11 ILE 43 HD11 ILE 43 0.266 5.215 14.548 290 HD12 ILE 43 HD12 ILE 43 1.845 5.999 14.598 291 HD13 ILE 43 HD13 ILE 43 1.608 4.442 15.392 292 H GLY 44 HN GLY 44 0.290 4.142 9.216 293 HA2 GLY 44 HA1 GLY 44 -0.797 5.634 7.640 294 HA3 GLY 44 HA2 GLY 44 0.630 6.672 7.684 295 H ASN 45 HN ASN 45 2.575 5.895 6.579 296 HA ASN 45 HA ASN 45 2.045 4.674 4.049 297 HB2 ASN 45 HB2 ASN 45 4.639 5.046 5.581 298 HB3 ASN 45 HB1 ASN 45 4.560 4.456 3.920 299 HD21 ASN 45 HD21 ASN 45 5.914 6.866 4.378 300 HD22 ASN 45 HD22 ASN 45 4.995 8.174 3.808 301 H THR 46 HN THR 46 2.837 3.397 7.193 302 HA THR 46 HA THR 46 3.657 0.770 6.335 303 HB THR 46 HB THR 46 2.391 1.603 8.963 304 HG1 THR 46 HG1 THR 46 4.303 2.759 8.401 305 HG21 THR 46 HG21 THR 46 4.372 -0.607 8.712 306 HG22 THR 46 HG22 THR 46 2.741 -0.919 8.118 307 HG23 THR 46 HG23 THR 46 2.992 -0.450 9.799 308 H LEU 47 HN LEU 47 0.564 2.282 7.084 309 HA LEU 47 HA LEU 47 -1.101 0.018 7.232 310 HB2 LEU 47 HB2 LEU 47 -1.699 2.686 5.913 311 HB3 LEU 47 HB1 LEU 47 -2.905 1.507 6.432 312 HG LEU 47 HG LEU 47 -0.937 2.981 8.208 313 HD11 LEU 47 HD11 LEU 47 -2.735 4.440 7.725 314 HD12 LEU 47 HD12 LEU 47 -3.195 3.692 9.253 315 HD13 LEU 47 HD13 LEU 47 -3.915 3.130 7.746 316 HD21 LEU 47 HD21 LEU 47 -1.250 0.669 8.980 317 HD22 LEU 47 HD22 LEU 47 -3.001 0.861 8.884 318 HD23 LEU 47 HD23 LEU 47 -2.075 1.790 10.064 319 H MET 48 HN MET 48 0.209 1.679 4.382 320 HA MET 48 HA MET 48 -1.261 0.396 2.358 321 HB2 MET 48 HB2 MET 48 0.446 2.205 2.005 322 HB3 MET 48 HB1 MET 48 1.709 1.002 2.266 323 HG2 MET 48 HG2 MET 48 0.789 -0.332 0.379 324 HG3 MET 48 HG1 MET 48 -0.409 0.930 0.095 325 HE1 MET 48 HE1 MET 48 0.261 0.836 -2.196 326 HE2 MET 48 HE2 MET 48 1.804 -0.012 -2.269 327 HE3 MET 48 HE3 MET 48 1.669 1.615 -2.930 328 H ALA 49 HN ALA 49 1.602 -0.757 4.127 329 HA ALA 49 HA ALA 49 1.972 -3.170 2.647 330 HB1 ALA 49 HB1 ALA 49 3.412 -2.030 4.562 331 HB2 ALA 49 HB2 ALA 49 3.476 -3.775 4.311 332 HB3 ALA 49 HB3 ALA 49 2.476 -3.105 5.600 333 H ALA 50 HN ALA 50 -0.249 -2.282 5.217 334 HA ALA 50 HA ALA 50 -1.100 -4.946 5.893 335 HB1 ALA 50 HB1 ALA 50 -2.498 -2.263 6.116 336 HB2 ALA 50 HB2 ALA 50 -1.621 -3.113 7.390 337 HB3 ALA 50 HB3 ALA 50 -3.144 -3.764 6.783 338 H MET 51 HN MET 51 -2.167 -2.580 3.478 339 HA MET 51 HA MET 51 -4.516 -3.890 2.595 340 HB2 MET 51 HB2 MET 51 -2.508 -2.362 0.909 341 HB3 MET 51 HB1 MET 51 -4.188 -2.688 0.479 342 HG2 MET 51 HG2 MET 51 -4.966 -1.382 2.393 343 HG3 MET 51 HG1 MET 51 -3.305 -1.129 2.928 344 HE1 MET 51 HE1 MET 51 -4.755 2.303 1.617 345 HE2 MET 51 HE2 MET 51 -3.848 1.580 2.942 346 HE3 MET 51 HE3 MET 51 -5.457 0.977 2.553 347 H ASP 52 HN ASP 52 -1.126 -4.588 1.981 348 HA ASP 52 HA ASP 52 -1.440 -6.328 -0.252 349 HB2 ASP 52 HB2 ASP 52 0.581 -6.325 2.006 350 HB3 ASP 52 HB1 ASP 52 0.703 -7.378 0.597 351 H ASN 53 HN ASN 53 -2.019 -6.786 3.173 352 HA ASN 53 HA ASN 53 -2.137 -9.661 3.142 353 HB2 ASN 53 HB2 ASN 53 -1.992 -8.153 5.195 354 HB3 ASN 53 HB1 ASN 53 -3.711 -7.829 4.970 355 HD21 ASN 53 HD21 ASN 53 -4.198 -8.963 7.017 356 HD22 ASN 53 HD22 ASN 53 -4.101 -10.654 7.124 357 H MET 54 HN MET 54 -4.351 -7.146 2.181 358 HA MET 54 HA MET 54 -6.793 -8.626 2.282 359 HB2 MET 54 HB2 MET 54 -5.898 -6.384 0.448 360 HB3 MET 54 HB1 MET 54 -7.547 -7.003 0.511 361 HG2 MET 54 HG1 MET 54 -6.017 -5.816 2.846 362 HG3 MET 54 HG2 MET 54 -7.303 -5.010 1.946 363 HE1 MET 54 HE1 MET 54 -9.142 -7.573 1.308 364 HE2 MET 54 HE2 MET 54 -9.676 -5.935 1.673 365 HE3 MET 54 HE3 MET 54 -10.364 -7.296 2.556 366 H GLY 55 HN GLY 55 -4.115 -8.650 0.028 367 HA2 GLY 55 HA2 GLY 55 -3.675 -10.469 -1.480 368 HA3 GLY 55 HA1 GLY 55 -5.365 -10.955 -1.349 369 H GLY 56 HN GLY 56 -5.135 -7.618 -1.758 370 HA2 GLY 56 HA2 GLY 56 -4.925 -6.354 -3.846 371 HA3 GLY 56 HA1 GLY 56 -5.290 -7.836 -4.729 372 H ARG 57 HN ARG 57 -7.224 -7.469 -1.960 373 HA ARG 57 HA ARG 57 -9.426 -6.291 -3.611 374 HB2 ARG 57 HB2 ARG 57 -10.991 -7.802 -2.504 375 HB3 ARG 57 HB1 ARG 57 -9.699 -8.749 -3.239 376 HG2 ARG 57 HG2 ARG 57 -8.540 -8.509 -0.907 377 HG3 ARG 57 HG1 ARG 57 -10.162 -8.120 -0.333 378 HD2 ARG 57 HD2 ARG 57 -10.973 -10.248 -1.407 379 HD3 ARG 57 HD1 ARG 57 -9.292 -10.649 -1.759 380 HE ARG 57 HE ARG 57 -9.135 -10.254 0.903 381 HH11 ARG 57 HH21 ARG 57 -10.003 -12.837 -0.850 382 HH12 ARG 57 HH22 ARG 57 -11.101 -13.536 0.293 383 HH21 ARG 57 HH11 ARG 57 -11.202 -10.725 2.319 384 HH22 ARG 57 HH12 ARG 57 -11.780 -12.340 2.086 385 H ILE 58 HN ILE 58 -9.839 -4.308 -2.761 386 HA ILE 58 HA ILE 58 -9.767 -4.040 0.218 387 HB ILE 58 HB ILE 58 -9.437 -1.813 -1.807 388 HG12 ILE 58 HG11 ILE 58 -7.574 -3.328 -2.103 389 HG13 ILE 58 HG12 ILE 58 -7.005 -1.951 -1.162 390 HG21 ILE 58 HG21 ILE 58 -9.208 -2.079 1.182 391 HG22 ILE 58 HG22 ILE 58 -10.064 -0.855 0.243 392 HG23 ILE 58 HG23 ILE 58 -8.302 -0.828 0.330 393 HD11 ILE 58 HD11 ILE 58 -7.978 -3.722 0.761 394 HD12 ILE 58 HD12 ILE 58 -6.280 -3.452 0.365 395 HD13 ILE 58 HD13 ILE 58 -7.169 -4.766 -0.407 396 H THR 59 HN THR 59 -11.483 -2.847 1.193 397 HA THR 59 HA THR 59 -13.754 -2.120 -0.591 398 HB THR 59 HB THR 59 -14.983 -3.173 1.673 399 HG1 THR 59 HG1 THR 59 -13.902 -4.884 2.278 400 HG21 THR 59 HG21 THR 59 -15.898 -4.757 0.163 401 HG22 THR 59 HG22 THR 59 -14.445 -4.761 -0.837 402 HG23 THR 59 HG23 THR 59 -15.512 -3.357 -0.837 403 HA PRO 60 HA PRO 60 -14.114 1.486 1.942 404 HB2 PRO 60 HB2 PRO 60 -16.796 1.808 2.131 405 HB3 PRO 60 HB1 PRO 60 -15.886 2.145 0.655 406 HG2 PRO 60 HG2 PRO 60 -17.461 -0.298 1.395 407 HG3 PRO 60 HG1 PRO 60 -17.445 0.589 -0.133 408 HD2 PRO 60 HD2 PRO 60 -16.045 -1.685 0.175 409 HD3 PRO 60 HD1 PRO 60 -15.429 -0.353 -0.807 410 H SER 61 HN SER 61 -16.584 -0.912 2.944 411 HA SER 61 HA SER 61 -16.965 -0.112 5.575 412 HB2 SER 61 HB2 SER 61 -16.648 -2.994 4.684 413 HB3 SER 61 HB1 SER 61 -17.548 -2.419 6.088 414 HG SER 61 HG SER 61 -18.695 -1.093 4.391 415 H LYS 62 HN LYS 62 -14.424 -2.379 4.451 416 HA LYS 62 HA LYS 62 -13.121 -2.321 7.072 417 HB2 LYS 62 HB2 LYS 62 -12.348 -3.538 4.410 418 HB3 LYS 62 HB1 LYS 62 -11.358 -3.677 5.862 419 HG2 LYS 62 HG2 LYS 62 -13.358 -4.655 7.041 420 HG3 LYS 62 HG1 LYS 62 -14.197 -4.670 5.489 421 HD2 LYS 62 HD2 LYS 62 -12.313 -6.048 4.560 422 HD3 LYS 62 HD1 LYS 62 -11.636 -6.137 6.186 423 HE2 LYS 62 HE2 LYS 62 -14.443 -6.814 6.250 424 HE3 LYS 62 HE1 LYS 62 -13.610 -7.818 5.064 425 HZ1 LYS 62 HZ1 LYS 62 -13.315 -8.966 7.032 426 HZ2 LYS 62 HZ2 LYS 62 -13.097 -7.556 7.956 427 HZ3 LYS 62 HZ3 LYS 62 -11.869 -8.088 6.909 428 H LEU 63 HN LEU 63 -12.183 -1.231 3.785 429 HA LEU 63 HA LEU 63 -9.756 0.014 4.520 430 HB2 LEU 63 HB2 LEU 63 -10.744 -0.358 2.167 431 HB3 LEU 63 HB1 LEU 63 -11.607 1.157 2.426 432 HG LEU 63 HG LEU 63 -9.495 2.333 2.782 433 HD11 LEU 63 HD21 LEU 63 -7.944 0.951 3.763 434 HD12 LEU 63 HD22 LEU 63 -7.426 0.758 2.089 435 HD13 LEU 63 HD23 LEU 63 -8.461 -0.458 2.838 436 HD21 LEU 63 HD11 LEU 63 -10.263 1.005 0.351 437 HD22 LEU 63 HD12 LEU 63 -8.503 1.110 0.416 438 HD23 LEU 63 HD13 LEU 63 -9.478 2.574 0.544 439 H GLN 64 HN GLN 64 -13.065 1.343 4.515 440 HA GLN 64 HA GLN 64 -12.424 4.010 5.207 441 HB2 GLN 64 HB2 GLN 64 -14.807 2.289 5.943 442 HB3 GLN 64 HB1 GLN 64 -14.711 4.009 6.320 443 HG2 GLN 64 HG2 GLN 64 -14.468 4.558 3.957 444 HG3 GLN 64 HG1 GLN 64 -14.418 2.848 3.533 445 HE21 GLN 64 HE21 GLN 64 -16.423 4.597 2.458 446 HE22 GLN 64 HE22 GLN 64 -17.930 4.137 3.090 447 H ALA 65 HN ALA 65 -12.504 1.094 7.174 448 HA ALA 65 HA ALA 65 -12.406 2.417 9.731 449 HB1 ALA 65 HB1 ALA 65 -11.514 -0.335 8.827 450 HB2 ALA 65 HB2 ALA 65 -13.003 0.083 9.675 451 HB3 ALA 65 HB3 ALA 65 -11.453 0.196 10.508 452 H LEU 66 HN LEU 66 -10.011 1.615 7.304 453 HA LEU 66 HA LEU 66 -7.706 2.064 9.014 454 HB2 LEU 66 HB2 LEU 66 -7.629 0.709 6.910 455 HB3 LEU 66 HB1 LEU 66 -7.889 2.190 5.989 456 HG LEU 66 HG LEU 66 -5.667 2.153 7.992 457 HD11 LEU 66 HD11 LEU 66 -5.897 0.272 5.805 458 HD12 LEU 66 HD12 LEU 66 -4.612 0.423 7.004 459 HD13 LEU 66 HD13 LEU 66 -4.550 1.374 5.520 460 HD21 LEU 66 HD21 LEU 66 -4.645 3.457 5.991 461 HD22 LEU 66 HD22 LEU 66 -5.945 4.227 6.901 462 HD23 LEU 66 HD23 LEU 66 -6.287 3.465 5.347 463 H ASP 67 HN ASP 67 -9.443 4.012 6.580 464 HA ASP 67 HA ASP 67 -7.853 6.307 6.551 465 HB2 ASP 67 HB1 ASP 67 -10.138 5.779 5.366 466 HB3 ASP 67 HB2 ASP 67 -10.839 6.590 6.766 467 H MET 68 HN MET 68 -10.313 5.390 8.955 468 HA MET 68 HA MET 68 -10.117 7.779 10.525 469 HB2 MET 68 HB2 MET 68 -10.865 4.962 11.366 470 HB3 MET 68 HB1 MET 68 -11.146 6.414 12.325 471 HG2 MET 68 HG2 MET 68 -12.521 7.335 10.456 472 HG3 MET 68 HG1 MET 68 -12.305 5.816 9.587 473 HE1 MET 68 HE1 MET 68 -13.435 6.291 13.742 474 HE2 MET 68 HE2 MET 68 -14.789 7.113 12.969 475 HE3 MET 68 HE3 MET 68 -13.137 7.591 12.580 476 H ALA 69 HN ALA 69 -8.462 4.624 10.803 477 HA ALA 69 HA ALA 69 -6.978 5.169 13.146 478 HB1 ALA 69 HB1 ALA 69 -5.228 3.613 11.951 479 HB2 ALA 69 HB2 ALA 69 -6.498 3.430 10.741 480 HB3 ALA 69 HB3 ALA 69 -6.798 2.956 12.413 481 H PHE 70 HN PHE 70 -6.133 5.825 9.741 482 HA PHE 70 HA PHE 70 -3.573 6.922 10.133 483 HB2 PHE 70 HB1 PHE 70 -4.607 6.517 7.908 484 HB3 PHE 70 HB2 PHE 70 -5.687 7.885 8.181 485 HD1 PHE 70 HD2 PHE 70 -2.186 6.860 7.607 486 HD2 PHE 70 HD1 PHE 70 -4.879 10.170 8.081 487 HE1 PHE 70 HE2 PHE 70 -0.430 8.406 6.783 488 HE2 PHE 70 HE1 PHE 70 -3.125 11.717 7.257 489 HZ PHE 70 HZ PHE 70 -0.900 10.835 6.608 490 H ALA 71 HN ALA 71 -6.756 8.443 10.505 491 HA ALA 71 HA ALA 71 -5.725 11.092 11.016 492 HB1 ALA 71 HB1 ALA 71 -7.982 11.071 10.386 493 HB2 ALA 71 HB2 ALA 71 -8.081 11.320 12.128 494 HB3 ALA 71 HB3 ALA 71 -8.366 9.717 11.449 495 H SER 72 HN SER 72 -6.639 8.362 13.103 496 HA SER 72 HA SER 72 -6.269 9.792 15.577 497 HB2 SER 72 HB1 SER 72 -7.552 7.647 15.345 498 HB3 SER 72 HB2 SER 72 -6.021 6.808 15.095 499 HG SER 72 HG SER 72 -6.888 6.907 17.316 500 H SER 73 HN SER 73 -4.130 7.746 13.601 501 HA SER 73 HA SER 73 -1.925 7.837 15.461 502 HB2 SER 73 HB1 SER 73 -1.733 7.437 12.468 503 HB3 SER 73 HB2 SER 73 -0.625 6.846 13.706 504 HG SER 73 HG SER 73 -2.178 5.443 14.420 505 H VAL 74 HN VAL 74 -2.651 9.649 12.482 506 HA VAL 74 HA VAL 74 -0.340 11.291 12.485 507 HB VAL 74 HB VAL 74 -1.641 12.836 11.093 508 HG11 VAL 74 HG21 VAL 74 -1.131 11.200 9.600 509 HG12 VAL 74 HG22 VAL 74 -2.834 10.761 9.733 510 HG13 VAL 74 HG23 VAL 74 -1.627 9.917 10.704 511 HG21 VAL 74 HG11 VAL 74 -4.025 11.164 11.949 512 HG22 VAL 74 HG12 VAL 74 -4.057 12.474 10.769 513 HG23 VAL 74 HG13 VAL 74 -3.704 12.821 12.461 514 H ALA 75 HN ALA 75 -3.385 11.589 14.260 515 HA ALA 75 HA ALA 75 -2.833 14.248 15.269 516 HB1 ALA 75 HB1 ALA 75 -4.707 12.058 16.205 517 HB2 ALA 75 HB2 ALA 75 -5.122 13.477 15.243 518 HB3 ALA 75 HB3 ALA 75 -4.646 13.663 16.931 519 H GLN 76 HN GLN 76 -2.186 10.964 16.410 520 HA GLN 76 HA GLN 76 -1.252 11.810 19.027 521 HB2 GLN 76 HB2 GLN 76 -2.091 9.495 18.488 522 HB3 GLN 76 HB1 GLN 76 -0.616 9.235 17.557 523 HG2 GLN 76 HG2 GLN 76 0.713 9.765 19.613 524 HG3 GLN 76 HG1 GLN 76 -0.797 9.865 20.519 525 HE21 GLN 76 HE21 GLN 76 -1.411 7.932 21.495 526 HE22 GLN 76 HE22 GLN 76 -0.916 6.386 20.996 527 H ILE 77 HN ILE 77 0.349 10.906 15.970 528 HA ILE 77 HA ILE 77 3.028 11.099 16.840 529 HB ILE 77 HB ILE 77 1.830 11.834 14.154 530 HG12 ILE 77 HG12 ILE 77 3.230 9.303 15.065 531 HG13 ILE 77 HG11 ILE 77 1.479 9.481 14.963 532 HG21 ILE 77 HG21 ILE 77 4.697 11.062 14.714 533 HG22 ILE 77 HG22 ILE 77 4.171 12.746 14.725 534 HG23 ILE 77 HG23 ILE 77 4.026 11.786 13.253 535 HD11 ILE 77 HD11 ILE 77 2.555 10.406 12.498 536 HD12 ILE 77 HD12 ILE 77 1.578 8.963 12.775 537 HD13 ILE 77 HD13 ILE 77 3.338 8.866 12.858 538 H ALA 78 HN ALA 78 0.912 13.638 15.523 539 HA ALA 78 HA ALA 78 2.915 15.716 15.952 540 HB1 ALA 78 HB1 ALA 78 0.904 15.616 14.244 541 HB2 ALA 78 HB2 ALA 78 1.404 17.160 14.934 542 HB3 ALA 78 HB3 ALA 78 0.001 16.314 15.587 543 H ALA 79 HN ALA 79 -0.262 14.984 17.450 544 HA ALA 79 HA ALA 79 -0.111 16.954 19.485 545 HB1 ALA 79 HB1 ALA 79 -1.342 14.245 19.968 546 HB2 ALA 79 HB2 ALA 79 -2.075 15.373 18.827 547 HB3 ALA 79 HB3 ALA 79 -1.899 15.824 20.523 548 H SER 80 HN SER 80 1.395 13.805 19.206 549 HA SER 80 HA SER 80 2.168 13.560 21.979 550 HB2 SER 80 HB2 SER 80 2.181 11.584 20.583 551 HB3 SER 80 HB1 SER 80 3.294 12.339 19.442 552 HG SER 80 HG SER 80 3.766 11.285 21.977 553 H GLN 81 HN GLN 81 3.339 15.430 19.320 554 HA GLN 81 HA GLN 81 6.068 15.747 19.956 555 HB2 GLN 81 HB2 GLN 81 4.076 17.760 18.872 556 HB3 GLN 81 HB1 GLN 81 5.817 18.036 18.928 557 HG2 GLN 81 HG2 GLN 81 6.122 15.927 17.592 558 HG3 GLN 81 HG1 GLN 81 4.369 15.839 17.422 559 HE21 GLN 81 HE21 GLN 81 3.304 17.540 16.134 560 HE22 GLN 81 HE22 GLN 81 4.198 18.486 15.045 561 H GLY 82 HN GLY 82 3.217 17.066 21.523 562 HA2 GLY 82 HA2 GLY 82 3.094 17.965 23.715 563 HA3 GLY 82 HA1 GLY 82 4.852 17.875 23.817 564 H GLY 83 HN GLY 83 3.753 19.349 20.948 565 HA2 GLY 83 HA2 GLY 83 4.571 22.001 22.020 566 HA3 GLY 83 HA1 GLY 83 4.520 21.563 20.312 567 H ASP 84 HN ASP 84 3.206 23.506 19.959 568 HA ASP 84 HA ASP 84 0.644 23.835 21.258 569 HB2 ASP 84 HB2 ASP 84 1.938 25.673 20.106 570 HB3 ASP 84 HB1 ASP 84 1.500 24.934 18.565 571 H LEU 85 HN LEU 85 -0.637 21.989 21.048 572 HA LEU 85 HA LEU 85 -0.886 20.375 18.731 573 HB2 LEU 85 HB1 LEU 85 -1.762 19.819 21.025 574 HB3 LEU 85 HB2 LEU 85 -3.075 20.962 20.744 575 HG LEU 85 HG LEU 85 -2.556 18.856 18.679 576 HD11 LEU 85 HD11 LEU 85 -4.497 18.090 20.750 577 HD12 LEU 85 HD12 LEU 85 -2.829 18.103 21.318 578 HD13 LEU 85 HD13 LEU 85 -3.281 17.108 19.933 579 HD21 LEU 85 HD21 LEU 85 -4.446 20.874 19.101 580 HD22 LEU 85 HD22 LEU 85 -5.292 19.388 19.532 581 HD23 LEU 85 HD23 LEU 85 -4.570 19.559 17.932 582 H GLY 86 HN GLY 86 -1.995 23.568 19.319 583 HA2 GLY 86 HA2 GLY 86 -4.313 23.596 17.630 584 HA3 GLY 86 HA1 GLY 86 -3.357 25.010 18.067 585 H VAL 87 HN VAL 87 -0.857 24.121 16.967 586 HA VAL 87 HA VAL 87 -1.255 24.888 14.211 587 HB VAL 87 HB VAL 87 0.837 25.268 15.651 588 HG11 VAL 87 HG11 VAL 87 2.422 23.529 15.866 589 HG12 VAL 87 HG12 VAL 87 1.623 22.533 14.650 590 HG13 VAL 87 HG13 VAL 87 0.888 22.743 16.238 591 HG21 VAL 87 HG21 VAL 87 1.116 25.919 13.436 592 HG22 VAL 87 HG22 VAL 87 0.771 24.307 12.812 593 HG23 VAL 87 HG23 VAL 87 2.333 24.648 13.557 594 H THR 88 HN THR 88 -0.683 21.780 15.836 595 HA THR 88 HA THR 88 -0.178 20.165 13.594 596 HB THR 88 HB THR 88 -1.855 19.534 16.042 597 HG1 THR 88 HG1 THR 88 0.123 19.745 16.786 598 HG21 THR 88 HG21 THR 88 -2.265 18.051 14.031 599 HG22 THR 88 HG22 THR 88 -1.639 17.214 15.453 600 HG23 THR 88 HG23 THR 88 -0.562 17.599 14.109 601 H THR 89 HN THR 89 -3.187 21.612 14.696 602 HA THR 89 HA THR 89 -4.990 20.131 13.057 603 HB THR 89 HB THR 89 -5.226 23.077 13.734 604 HG1 THR 89 HG1 THR 89 -5.263 22.435 15.717 605 HG21 THR 89 HG21 THR 89 -6.869 21.332 12.292 606 HG22 THR 89 HG22 THR 89 -7.335 22.895 12.963 607 HG23 THR 89 HG23 THR 89 -7.610 21.420 13.890 608 H ASN 90 HN ASN 90 -3.196 23.151 12.442 609 HA ASN 90 HA ASN 90 -4.096 23.377 9.702 610 HB2 ASN 90 HB2 ASN 90 -1.647 24.566 11.046 611 HB3 ASN 90 HB1 ASN 90 -2.317 25.073 9.495 612 HD21 ASN 90 HD21 ASN 90 -5.066 25.126 10.033 613 HD22 ASN 90 HD22 ASN 90 -5.396 26.259 11.253 614 H ALA 91 HN ALA 91 -1.365 21.844 11.318 615 HA ALA 91 HA ALA 91 0.117 21.267 8.902 616 HB1 ALA 91 HB1 ALA 91 0.746 19.319 10.848 617 HB2 ALA 91 HB2 ALA 91 0.405 20.803 11.739 618 HB3 ALA 91 HB3 ALA 91 1.646 20.792 10.486 619 H ILE 92 HN ILE 92 -1.738 19.093 11.067 620 HA ILE 92 HA ILE 92 -1.732 16.892 9.243 621 HB ILE 92 HB ILE 92 -3.651 17.597 11.482 622 HG12 ILE 92 HG12 ILE 92 -1.267 15.727 11.331 623 HG13 ILE 92 HG11 ILE 92 -1.326 17.259 12.203 624 HG21 ILE 92 HG21 ILE 92 -4.001 15.705 9.445 625 HG22 ILE 92 HG22 ILE 92 -4.849 15.747 10.992 626 HG23 ILE 92 HG23 ILE 92 -3.387 14.777 10.813 627 HD11 ILE 92 HD11 ILE 92 -3.269 16.320 13.526 628 HD12 ILE 92 HD12 ILE 92 -1.730 15.505 13.810 629 HD13 ILE 92 HD13 ILE 92 -2.944 14.761 12.769 630 H ALA 93 HN ALA 93 -4.101 19.491 9.805 631 HA ALA 93 HA ALA 93 -6.076 18.521 7.980 632 HB1 ALA 93 HB1 ALA 93 -5.447 21.395 8.723 633 HB2 ALA 93 HB2 ALA 93 -6.503 20.318 9.638 634 HB3 ALA 93 HB3 ALA 93 -6.952 20.817 8.007 635 H ASP 94 HN ASP 94 -3.521 20.988 7.476 636 HA ASP 94 HA ASP 94 -4.025 21.460 4.738 637 HB2 ASP 94 HB1 ASP 94 -2.339 22.617 6.335 638 HB3 ASP 94 HB2 ASP 94 -1.225 21.337 5.852 639 H ALA 95 HN ALA 95 -1.780 19.088 6.200 640 HA ALA 95 HA ALA 95 -0.879 17.908 3.795 641 HB1 ALA 95 HB1 ALA 95 -0.447 15.879 5.189 642 HB2 ALA 95 HB2 ALA 95 -1.363 16.623 6.500 643 HB3 ALA 95 HB3 ALA 95 0.140 17.361 5.946 644 H LEU 96 HN LEU 96 -3.719 17.084 5.797 645 HA LEU 96 HA LEU 96 -4.593 14.941 4.067 646 HB2 LEU 96 HB2 LEU 96 -5.396 16.054 6.547 647 HB3 LEU 96 HB1 LEU 96 -6.792 16.160 5.474 648 HG LEU 96 HG LEU 96 -5.539 13.622 5.065 649 HD11 LEU 96 HD11 LEU 96 -5.490 14.584 7.832 650 HD12 LEU 96 HD12 LEU 96 -4.690 13.186 7.115 651 HD13 LEU 96 HD13 LEU 96 -6.369 13.068 7.644 652 HD21 LEU 96 HD21 LEU 96 -7.987 13.531 6.610 653 HD22 LEU 96 HD22 LEU 96 -7.723 13.086 4.926 654 HD23 LEU 96 HD23 LEU 96 -8.102 14.756 5.346 655 H THR 97 HN THR 97 -5.218 18.412 4.189 656 HA THR 97 HA THR 97 -7.407 18.392 2.317 657 HB THR 97 HB THR 97 -5.451 20.610 2.991 658 HG1 THR 97 HG1 THR 97 -6.603 20.845 4.716 659 HG21 THR 97 HG21 THR 97 -7.777 21.827 2.321 660 HG22 THR 97 HG22 THR 97 -7.845 20.425 1.254 661 HG23 THR 97 HG23 THR 97 -6.475 21.531 1.169 662 H SER 98 HN SER 98 -3.921 19.097 1.908 663 HA SER 98 HA SER 98 -4.045 19.525 -0.911 664 HB2 SER 98 HB2 SER 98 -1.639 19.235 -0.893 665 HB3 SER 98 HB1 SER 98 -2.098 20.104 0.571 666 HG SER 98 HG SER 98 -0.623 18.147 0.668 667 H ALA 99 HN ALA 99 -3.729 16.577 1.008 668 HA ALA 99 HA ALA 99 -3.088 14.856 -1.218 669 HB1 ALA 99 HB1 ALA 99 -4.390 14.181 1.438 670 HB2 ALA 99 HB2 ALA 99 -2.655 14.206 1.127 671 HB3 ALA 99 HB3 ALA 99 -3.678 13.020 0.318 672 H PHE 100 HN PHE 100 -6.135 15.722 0.405 673 HA PHE 100 HA PHE 100 -7.937 14.014 -0.844 674 HB2 PHE 100 HB1 PHE 100 -8.047 16.733 0.273 675 HB3 PHE 100 HB2 PHE 100 -9.280 16.420 -0.946 676 HD1 PHE 100 HD2 PHE 100 -10.641 14.215 -0.711 677 HD2 PHE 100 HD1 PHE 100 -8.332 15.956 2.468 678 HE1 PHE 100 HE2 PHE 100 -11.954 12.926 0.953 679 HE2 PHE 100 HE1 PHE 100 -9.644 14.668 4.128 680 HZ PHE 100 HZ PHE 100 -11.455 13.151 3.372 681 H TYR 101 HN TYR 101 -6.915 17.194 -2.120 682 HA TYR 101 HA TYR 101 -8.206 16.788 -4.668 683 HB2 TYR 101 HB2 TYR 101 -5.931 18.698 -4.161 684 HB3 TYR 101 HB1 TYR 101 -7.295 18.885 -5.264 685 HD1 TYR 101 HD2 TYR 101 -9.608 18.159 -3.691 686 HD2 TYR 101 HD1 TYR 101 -6.110 20.348 -2.493 687 HE1 TYR 101 HE2 TYR 101 -10.915 19.261 -1.896 688 HE2 TYR 101 HE1 TYR 101 -7.419 21.455 -0.699 689 HH TYR 101 HH TYR 101 -10.911 20.902 -0.365 690 H GLN 102 HN GLN 102 -4.954 16.176 -3.456 691 HA GLN 102 HA GLN 102 -3.881 15.619 -6.117 692 HB2 GLN 102 HB1 GLN 102 -2.740 14.974 -3.383 693 HB3 GLN 102 HB2 GLN 102 -1.859 14.933 -4.911 694 HG2 GLN 102 HG1 GLN 102 -3.277 17.437 -4.017 695 HG3 GLN 102 HG2 GLN 102 -1.655 17.065 -3.435 696 HE21 GLN 102 HE21 GLN 102 -2.922 19.049 -5.580 697 HE22 GLN 102 HE22 GLN 102 -1.834 18.906 -6.875 698 H THR 103 HN THR 103 -5.619 13.828 -3.724 699 HA THR 103 HA THR 103 -4.694 11.258 -4.899 700 HB THR 103 HB THR 103 -5.911 10.230 -2.984 701 HG1 THR 103 HG1 THR 103 -7.097 11.431 -1.717 702 HG21 THR 103 HG21 THR 103 -4.403 11.889 -1.312 703 HG22 THR 103 HG22 THR 103 -3.594 11.978 -2.876 704 HG23 THR 103 HG23 THR 103 -3.850 10.413 -2.102 705 H THR 104 HN THR 104 -7.867 12.663 -3.904 706 HA THR 104 HA THR 104 -9.014 11.235 -6.273 707 HB THR 104 HB THR 104 -10.158 11.539 -3.488 708 HG1 THR 104 HG1 THR 104 -9.038 9.731 -3.480 709 HG21 THR 104 HG21 THR 104 -11.878 9.942 -4.963 710 HG22 THR 104 HG22 THR 104 -11.482 11.250 -6.078 711 HG23 THR 104 HG23 THR 104 -12.175 11.617 -4.499 712 H GLY 105 HN GLY 105 -9.453 14.006 -4.049 713 HA2 GLY 105 HA2 GLY 105 -9.883 16.227 -5.040 714 HA3 GLY 105 HA1 GLY 105 -10.760 15.420 -6.336 715 H VAL 106 HN VAL 106 -10.969 15.025 -2.790 716 HA VAL 106 HA VAL 106 -13.884 15.657 -3.026 717 HB VAL 106 HB VAL 106 -12.600 14.041 -0.821 718 HG11 VAL 106 HG21 VAL 106 -14.735 14.529 -0.095 719 HG12 VAL 106 HG22 VAL 106 -15.100 13.108 -1.071 720 HG13 VAL 106 HG23 VAL 106 -15.360 14.722 -1.733 721 HG21 VAL 106 HG11 VAL 106 -12.903 13.324 -3.590 722 HG22 VAL 106 HG12 VAL 106 -14.017 12.360 -2.621 723 HG23 VAL 106 HG13 VAL 106 -12.291 12.338 -2.262 724 H VAL 107 HN VAL 107 -14.752 16.454 -0.786 725 HA VAL 107 HA VAL 107 -13.259 18.849 -0.100 726 HB VAL 107 HB VAL 107 -15.083 18.975 1.739 727 HG11 VAL 107 HG21 VAL 107 -15.024 19.949 -0.716 728 HG12 VAL 107 HG22 VAL 107 -16.520 19.997 0.219 729 HG13 VAL 107 HG23 VAL 107 -16.283 18.747 -1.002 730 HG21 VAL 107 HG11 VAL 107 -16.754 17.386 1.793 731 HG22 VAL 107 HG12 VAL 107 -15.420 16.358 1.268 732 HG23 VAL 107 HG13 VAL 107 -16.570 16.984 0.085 733 H ASN 108 HN ASN 108 -11.581 18.892 1.305 734 HA ASN 108 HA ASN 108 -10.899 16.618 2.953 735 HB2 ASN 108 HB2 ASN 108 -9.052 17.979 3.735 736 HB3 ASN 108 HB1 ASN 108 -9.242 18.256 2.003 737 HD21 ASN 108 HD21 ASN 108 -9.854 20.373 1.311 738 HD22 ASN 108 HD22 ASN 108 -10.125 21.664 2.380 739 H SER 109 HN SER 109 -12.792 19.476 3.419 740 HA SER 109 HA SER 109 -12.681 19.797 6.217 741 HB2 SER 109 HB2 SER 109 -13.873 21.316 4.624 742 HB3 SER 109 HB1 SER 109 -15.142 20.101 4.474 743 HG SER 109 HG SER 109 -14.339 20.982 7.011 744 H ARG 110 HN ARG 110 -14.372 17.362 4.304 745 HA ARG 110 HA ARG 110 -16.119 16.469 6.409 746 HB2 ARG 110 HB2 ARG 110 -15.011 14.930 4.042 747 HB3 ARG 110 HB1 ARG 110 -16.382 14.437 5.035 748 HG2 ARG 110 HG1 ARG 110 -16.342 17.128 3.677 749 HG3 ARG 110 HG2 ARG 110 -16.876 15.684 2.815 750 HD2 ARG 110 HD2 ARG 110 -18.504 15.249 4.676 751 HD3 ARG 110 HD1 ARG 110 -18.034 16.791 5.392 752 HE ARG 110 HE ARG 110 -18.880 17.037 2.611 753 HH11 ARG 110 HH11 ARG 110 -21.062 15.675 4.318 754 HH12 ARG 110 HH12 ARG 110 -22.005 17.052 4.778 755 HH21 ARG 110 HH21 ARG 110 -19.566 19.352 3.891 756 HH22 ARG 110 HH22 ARG 110 -21.159 19.134 4.536 757 H PHE 111 HN PHE 111 -13.050 15.058 5.201 758 HA PHE 111 HA PHE 111 -12.905 13.206 7.436 759 HB2 PHE 111 HB2 PHE 111 -11.889 12.759 5.195 760 HB3 PHE 111 HB1 PHE 111 -10.715 14.034 5.512 761 HD1 PHE 111 HD1 PHE 111 -11.607 12.466 8.562 762 HD2 PHE 111 HD2 PHE 111 -9.174 11.924 5.062 763 HE1 PHE 111 HE1 PHE 111 -10.186 10.856 9.799 764 HE2 PHE 111 HE2 PHE 111 -7.753 10.312 6.302 765 HZ PHE 111 HZ PHE 111 -8.260 9.779 8.670 766 H ILE 112 HN ILE 112 -10.942 16.054 6.519 767 HA ILE 112 HA ILE 112 -9.329 16.135 8.831 768 HB ILE 112 HB ILE 112 -10.342 18.369 7.058 769 HG12 ILE 112 HG11 ILE 112 -7.709 16.868 7.207 770 HG13 ILE 112 HG12 ILE 112 -8.936 16.677 5.955 771 HG21 ILE 112 HG21 ILE 112 -8.023 19.291 8.146 772 HG22 ILE 112 HG22 ILE 112 -8.686 18.394 9.513 773 HG23 ILE 112 HG23 ILE 112 -9.622 19.693 8.773 774 HD11 ILE 112 HD11 ILE 112 -7.368 18.177 5.005 775 HD12 ILE 112 HD12 ILE 112 -7.187 19.073 6.515 776 HD13 ILE 112 HD13 ILE 112 -8.672 19.219 5.575 777 H SER 113 HN SER 113 -12.650 17.229 8.383 778 HA SER 113 HA SER 113 -12.868 18.935 10.638 779 HB2 SER 113 HB2 SER 113 -14.727 18.923 9.188 780 HB3 SER 113 HB1 SER 113 -14.848 17.164 9.211 781 HG SER 113 HG SER 113 -15.772 19.041 11.018 782 H GLU 114 HN GLU 114 -13.401 15.404 10.422 783 HA GLU 114 HA GLU 114 -13.961 15.138 13.251 784 HB2 GLU 114 HB2 GLU 114 -14.685 13.505 11.472 785 HB3 GLU 114 HB1 GLU 114 -13.003 12.990 11.338 786 HG2 GLU 114 HG2 GLU 114 -13.011 12.413 13.755 787 HG3 GLU 114 HG1 GLU 114 -14.710 12.875 13.844 788 H ILE 115 HN ILE 115 -11.045 14.783 11.259 789 HA ILE 115 HA ILE 115 -9.338 13.622 13.190 790 HB ILE 115 HB ILE 115 -8.588 15.711 11.126 791 HG12 ILE 115 HG12 ILE 115 -8.783 12.693 10.917 792 HG13 ILE 115 HG11 ILE 115 -9.838 13.853 10.114 793 HG21 ILE 115 HG21 ILE 115 -6.736 15.383 12.574 794 HG22 ILE 115 HG22 ILE 115 -6.424 14.313 11.207 795 HG23 ILE 115 HG23 ILE 115 -7.052 13.654 12.717 796 HD11 ILE 115 HD11 ILE 115 -8.379 13.859 8.397 797 HD12 ILE 115 HD12 ILE 115 -7.209 12.914 9.316 798 HD13 ILE 115 HD13 ILE 115 -7.234 14.671 9.462 799 H ARG 116 HN ARG 116 -10.016 17.077 12.580 800 HA ARG 116 HA ARG 116 -8.261 18.175 14.489 801 HB2 ARG 116 HB1 ARG 116 -11.001 19.092 13.583 802 HB3 ARG 116 HB2 ARG 116 -9.945 20.063 14.610 803 HG2 ARG 116 HG1 ARG 116 -8.146 19.720 12.819 804 HG3 ARG 116 HG2 ARG 116 -9.442 19.123 11.781 805 HD2 ARG 116 HD2 ARG 116 -10.681 21.264 12.182 806 HD3 ARG 116 HD1 ARG 116 -9.284 21.861 13.078 807 HE ARG 116 HE ARG 116 -8.099 21.236 10.745 808 HH11 ARG 116 HH21 ARG 116 -10.951 21.204 9.593 809 HH12 ARG 116 HH22 ARG 116 -11.051 22.805 8.942 810 HH21 ARG 116 HH11 ARG 116 -8.295 23.976 10.689 811 HH22 ARG 116 HH12 ARG 116 -9.548 24.374 9.562 812 H SER 117 HN SER 117 -11.660 17.155 14.958 813 HA SER 117 HA SER 117 -11.791 17.764 17.733 814 HB2 SER 117 HB1 SER 117 -13.176 15.473 16.306 815 HB3 SER 117 HB2 SER 117 -13.686 16.236 17.812 816 HG SER 117 HG SER 117 -14.086 17.020 15.243 817 H LEU 118 HN LEU 118 -10.481 14.993 15.999 818 HA LEU 118 HA LEU 118 -10.102 13.357 18.363 819 HB2 LEU 118 HB2 LEU 118 -8.790 13.219 15.632 820 HB3 LEU 118 HB1 LEU 118 -8.691 11.969 16.872 821 HG LEU 118 HG LEU 118 -11.236 12.971 15.559 822 HD11 LEU 118 HD11 LEU 118 -9.366 11.194 14.568 823 HD12 LEU 118 HD12 LEU 118 -11.070 11.229 14.117 824 HD13 LEU 118 HD13 LEU 118 -10.515 10.129 15.378 825 HD21 LEU 118 HD21 LEU 118 -11.705 12.356 17.843 826 HD22 LEU 118 HD22 LEU 118 -10.716 10.901 17.710 827 HD23 LEU 118 HD23 LEU 118 -12.236 11.018 16.822 828 H ILE 119 HN ILE 119 -7.991 15.561 16.498 829 HA ILE 119 HA ILE 119 -5.590 14.975 17.922 830 HB ILE 119 HB ILE 119 -6.409 17.646 16.740 831 HG12 ILE 119 HG12 ILE 119 -4.841 15.435 15.398 832 HG13 ILE 119 HG11 ILE 119 -6.589 15.594 15.218 833 HG21 ILE 119 HG21 ILE 119 -3.656 16.429 17.098 834 HG22 ILE 119 HG22 ILE 119 -4.376 17.545 18.258 835 HG23 ILE 119 HG23 ILE 119 -4.043 18.079 16.610 836 HD11 ILE 119 HD11 ILE 119 -5.376 16.728 13.375 837 HD12 ILE 119 HD12 ILE 119 -4.559 17.751 14.556 838 HD13 ILE 119 HD13 ILE 119 -6.305 17.874 14.341 839 H GLY 120 HN GLY 120 -8.299 17.111 18.678 840 HA2 GLY 120 HA2 GLY 120 -7.003 18.437 20.893 841 HA3 GLY 120 HA1 GLY 120 -8.742 18.393 20.600 842 H MET 121 HN MET 121 -8.839 15.450 20.539 843 HA MET 121 HA MET 121 -9.279 14.972 23.335 844 HB2 MET 121 HB2 MET 121 -10.437 13.749 21.478 845 HB3 MET 121 HB1 MET 121 -8.921 12.913 21.137 846 HG2 MET 121 HG1 MET 121 -8.906 12.073 23.491 847 HG3 MET 121 HG2 MET 121 -10.482 12.825 23.737 848 HE1 MET 121 HE1 MET 121 -9.164 10.658 20.409 849 HE2 MET 121 HE2 MET 121 -9.237 9.193 21.385 850 HE3 MET 121 HE3 MET 121 -8.286 10.567 21.941 851 H PHE 122 HN PHE 122 -6.642 14.035 21.127 852 HA PHE 122 HA PHE 122 -5.183 12.475 23.030 853 HB2 PHE 122 HB1 PHE 122 -4.184 14.079 20.656 854 HB3 PHE 122 HB2 PHE 122 -3.238 12.874 21.529 855 HD1 PHE 122 HD1 PHE 122 -4.117 10.479 21.640 856 HD2 PHE 122 HD2 PHE 122 -5.720 13.436 18.972 857 HE1 PHE 122 HE1 PHE 122 -5.135 8.685 20.264 858 HE2 PHE 122 HE2 PHE 122 -6.739 11.643 17.595 859 HZ PHE 122 HZ PHE 122 -6.447 9.267 18.241 860 H ALA 123 HN ALA 123 -5.420 15.930 22.481 861 HA ALA 123 HA ALA 123 -3.079 16.685 23.979 862 HB1 ALA 123 HB1 ALA 123 -5.201 18.644 24.170 863 HB2 ALA 123 HB2 ALA 123 -5.101 18.012 22.526 864 HB3 ALA 123 HB3 ALA 123 -3.682 18.741 23.279 865 H GLN 124 HN GLN 124 -6.407 15.953 24.864 866 HA GLN 124 HA GLN 124 -6.247 16.955 27.562 867 HB2 GLN 124 HB2 GLN 124 -8.015 14.807 26.350 868 HB3 GLN 124 HB1 GLN 124 -8.245 15.512 27.950 869 HG2 GLN 124 HG2 GLN 124 -8.551 17.729 26.965 870 HG3 GLN 124 HG1 GLN 124 -8.217 17.086 25.357 871 HE21 GLN 124 HE21 GLN 124 -10.709 18.361 25.923 872 HE22 GLN 124 HE22 GLN 124 -11.944 17.197 25.902 873 H ALA 125 HN ALA 125 -5.357 13.919 26.023 874 HA ALA 125 HA ALA 125 -4.982 12.460 28.502 875 HB1 ALA 125 HB1 ALA 125 -3.339 11.599 26.224 876 HB2 ALA 125 HB2 ALA 125 -5.048 11.780 25.822 877 HB3 ALA 125 HB3 ALA 125 -4.559 10.703 27.129 878 H SER 126 HN SER 126 -3.042 14.653 26.594 879 HA SER 126 HA SER 126 -0.503 13.920 27.802 880 HB2 SER 126 HB2 SER 126 0.367 15.904 26.707 881 HB3 SER 126 HB1 SER 126 -0.732 15.096 25.590 882 HG SER 126 HG SER 126 -0.921 17.501 26.033 883 H ALA 127 HN ALA 127 -3.188 15.898 28.732 884 HA ALA 127 HA ALA 127 -1.853 17.711 30.495 885 HB1 ALA 127 HB1 ALA 127 -4.185 18.052 29.837 886 HB2 ALA 127 HB2 ALA 127 -4.081 17.922 31.593 887 HB3 ALA 127 HB3 ALA 127 -4.654 16.554 30.639 888 H ASN 128 HN ASN 128 -2.721 14.340 30.797 889 HA ASN 128 HA ASN 128 -2.488 14.232 33.689 890 HB2 ASN 128 HB1 ASN 128 -3.743 12.542 32.337 891 HB3 ASN 128 HB2 ASN 128 -2.208 11.981 31.675 892 HD21 ASN 128 HD21 ASN 128 -3.943 12.402 34.795 893 HD22 ASN 128 HD22 ASN 128 -3.099 11.175 35.608 894 H ASP 129 HN ASP 129 -0.235 14.382 31.105 895 HA ASP 129 HA ASP 129 1.935 12.991 32.465 896 HB2 ASP 129 HB2 ASP 129 1.841 14.854 30.080 897 HB3 ASP 129 HB1 ASP 129 3.341 14.152 30.685 898 H VAL 130 HN VAL 130 0.990 16.390 31.997 899 HA VAL 130 HA VAL 130 3.240 17.525 33.361 900 HB VAL 130 HB VAL 130 1.826 18.917 31.961 901 HG11 VAL 130 HG11 VAL 130 -0.300 17.811 33.746 902 HG12 VAL 130 HG12 VAL 130 -0.339 18.111 32.009 903 HG13 VAL 130 HG13 VAL 130 -0.514 19.454 33.139 904 HG21 VAL 130 HG21 VAL 130 2.499 20.557 33.355 905 HG22 VAL 130 HG22 VAL 130 2.362 19.498 34.758 906 HG23 VAL 130 HG23 VAL 130 0.952 20.387 34.183 907 H TYR 131 HN TYR 131 0.226 16.125 34.484 908 HA TYR 131 HA TYR 131 1.165 15.721 37.134 909 HB2 TYR 131 HB2 TYR 131 0.025 17.423 38.394 910 HB3 TYR 131 HB1 TYR 131 0.958 18.251 37.148 911 HD1 TYR 131 HD1 TYR 131 -0.147 19.252 35.197 912 HD2 TYR 131 HD2 TYR 131 -2.408 17.306 38.287 913 HE1 TYR 131 HE1 TYR 131 -2.227 20.280 34.322 914 HE2 TYR 131 HE2 TYR 131 -4.489 18.334 37.412 915 HH TYR 131 HH TYR 131 -4.774 19.640 34.423 916 H ALA 132 HN ALA 132 -0.795 15.186 38.633 917 HA ALA 132 HA ALA 132 -2.591 13.472 37.082 918 HB1 ALA 132 HB1 ALA 132 -2.604 12.293 38.999 919 HB2 ALA 132 HB2 ALA 132 -3.348 13.649 39.848 920 HB3 ALA 132 HB3 ALA 132 -1.592 13.531 39.743 921 H SER 133 HN SER 133 -4.425 14.290 36.202 922 HA SER 133 HA SER 133 -5.510 16.848 36.788 923 HB2 SER 133 HB2 SER 133 -6.969 14.432 35.673 924 HB3 SER 133 HB1 SER 133 -7.474 16.115 35.519 925 HG SER 133 HG SER 133 -6.381 15.813 33.701 926 H ALA 134 HN ALA 134 -7.529 17.369 37.903 927 HA ALA 134 HA ALA 134 -7.725 16.141 40.495 928 HB1 ALA 134 HB1 ALA 134 -8.359 18.523 39.926 929 HB2 ALA 134 HB2 ALA 134 -9.562 17.657 40.880 930 HB3 ALA 134 HB3 ALA 134 -9.806 17.883 39.148 931 H GLY 135 HN GLY 135 -9.518 15.734 37.478 932 HA2 GLY 135 HA2 GLY 135 -10.765 13.802 36.855 933 HA3 GLY 135 HA1 GLY 135 -10.621 13.209 38.510 934 H SER 136 HN SER 136 -13.011 12.771 38.112 935 HA SER 136 HA SER 136 -14.600 15.236 38.713 936 HB2 SER 136 HB2 SER 136 -15.517 12.736 37.256 937 HB3 SER 136 HB1 SER 136 -16.505 14.159 37.592 938 HG SER 136 HG SER 136 -14.964 13.754 35.521 939 H GLY 137 HN GLY 137 -16.223 15.019 40.328 940 HA2 GLY 137 HA2 GLY 137 -15.645 13.009 42.356 941 HA3 GLY 137 HA1 GLY 137 -16.893 14.252 42.458 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 -12.616 10.233 -11.358 2 H2 GLY 1 HT2 GLY 1 -13.176 10.848 -9.877 3 H3 GLY 1 HT3 GLY 1 -13.135 11.844 -11.252 4 HA2 GLY 1 HA2 GLY 1 -15.388 10.974 -10.628 5 HA3 GLY 1 HA1 GLY 1 -14.883 10.689 -12.293 6 H MET 2 HN MET 2 -16.185 8.790 -12.481 7 HA MET 2 HA MET 2 -16.240 6.626 -10.654 8 HB2 MET 2 HB1 MET 2 -16.501 6.618 -13.675 9 HB3 MET 2 HB2 MET 2 -16.894 5.245 -12.641 10 HG2 MET 2 HG2 MET 2 -18.506 6.727 -11.404 11 HG3 MET 2 HG1 MET 2 -18.195 7.984 -12.601 12 HE1 MET 2 HE1 MET 2 -19.526 3.763 -13.459 13 HE2 MET 2 HE2 MET 2 -20.417 4.494 -12.126 14 HE3 MET 2 HE3 MET 2 -18.659 4.430 -12.069 15 H GLY 3 HN GLY 3 -13.947 7.395 -13.243 16 HA2 GLY 3 HA2 GLY 3 -12.504 4.969 -13.314 17 HA3 GLY 3 HA1 GLY 3 -11.795 6.550 -13.647 18 H GLN 4 HN GLN 4 -12.390 7.620 -10.987 19 HA GLN 4 HA GLN 4 -10.387 6.043 -9.418 20 HB2 GLN 4 HB2 GLN 4 -10.966 9.021 -9.370 21 HB3 GLN 4 HB1 GLN 4 -9.802 8.199 -8.331 22 HG2 GLN 4 HG2 GLN 4 -8.530 7.471 -10.299 23 HG3 GLN 4 HG1 GLN 4 -9.716 8.226 -11.365 24 HE21 GLN 4 HE21 GLN 4 -6.948 9.021 -11.374 25 HE22 GLN 4 HE22 GLN 4 -6.863 10.619 -10.809 26 H ALA 5 HN ALA 5 -10.725 6.021 -7.075 27 HA ALA 5 HA ALA 5 -13.466 5.561 -6.347 28 HB1 ALA 5 HB1 ALA 5 -10.967 5.010 -5.228 29 HB2 ALA 5 HB2 ALA 5 -12.533 4.620 -4.516 30 HB3 ALA 5 HB3 ALA 5 -11.716 6.121 -4.082 31 H ASN 6 HN ASN 6 -14.927 6.896 -5.284 32 HA ASN 6 HA ASN 6 -14.803 9.687 -5.602 33 HB2 ASN 6 HB2 ASN 6 -16.267 8.260 -3.364 34 HB3 ASN 6 HB1 ASN 6 -16.682 9.814 -4.084 35 HD21 ASN 6 HD21 ASN 6 -16.534 9.328 -6.808 36 HD22 ASN 6 HD22 ASN 6 -17.623 8.104 -7.252 37 H THR 7 HN THR 7 -13.263 7.691 -3.237 38 HA THR 7 HA THR 7 -12.096 10.124 -1.996 39 HB THR 7 HB THR 7 -13.936 9.530 -0.507 40 HG1 THR 7 HG1 THR 7 -11.383 8.708 0.390 41 HG21 THR 7 HG21 THR 7 -12.687 6.770 -0.509 42 HG22 THR 7 HG22 THR 7 -14.241 7.207 -1.218 43 HG23 THR 7 HG23 THR 7 -14.018 7.279 0.530 44 HA PRO 8 HA PRO 8 -8.325 7.826 -2.336 45 HB2 PRO 8 HB2 PRO 8 -6.956 8.697 -0.168 46 HB3 PRO 8 HB1 PRO 8 -7.199 9.670 -1.621 47 HG2 PRO 8 HG2 PRO 8 -8.731 9.709 0.960 48 HG3 PRO 8 HG1 PRO 8 -8.105 11.073 0.024 49 HD2 PRO 8 HD2 PRO 8 -10.679 10.373 -0.142 50 HD3 PRO 8 HD1 PRO 8 -9.801 10.919 -1.569 51 H TRP 9 HN TRP 9 -9.887 7.714 0.888 52 HA TRP 9 HA TRP 9 -8.410 5.275 1.570 53 HB2 TRP 9 HB2 TRP 9 -9.847 5.233 3.588 54 HB3 TRP 9 HB1 TRP 9 -9.060 6.795 3.372 55 HD1 TRP 9 HD1 TRP 9 -12.453 5.093 3.248 56 HE1 TRP 9 HE1 TRP 9 -14.291 6.899 3.127 57 HE3 TRP 9 HE3 TRP 9 -9.561 9.242 2.572 58 HZ2 TRP 9 HZ2 TRP 9 -14.500 9.737 2.788 59 HZ3 TRP 9 HZ3 TRP 9 -10.600 11.479 2.354 60 HH2 TRP 9 HH2 TRP 9 -13.065 11.732 2.461 61 H SER 10 HN SER 10 -10.682 5.726 -0.663 62 HA SER 10 HA SER 10 -12.373 3.396 0.037 63 HB2 SER 10 HB1 SER 10 -12.493 5.606 -1.956 64 HB3 SER 10 HB2 SER 10 -13.183 4.062 -2.452 65 HG SER 10 HG SER 10 -14.596 4.137 -0.796 66 H SER 11 HN SER 11 -9.577 4.224 -1.805 67 HA SER 11 HA SER 11 -9.470 1.431 -2.837 68 HB2 SER 11 HB1 SER 11 -10.128 3.349 -4.557 69 HB3 SER 11 HB2 SER 11 -8.391 3.650 -4.537 70 HG SER 11 HG SER 11 -9.734 1.720 -5.788 71 H LYS 12 HN LYS 12 -7.360 0.567 -2.841 72 HA LYS 12 HA LYS 12 -5.491 1.646 -0.977 73 HB2 LYS 12 HB1 LYS 12 -4.817 -0.220 -3.262 74 HB3 LYS 12 HB2 LYS 12 -3.962 -0.059 -1.730 75 HG2 LYS 12 HG2 LYS 12 -5.874 -0.941 -0.515 76 HG3 LYS 12 HG1 LYS 12 -6.838 -0.977 -1.989 77 HD2 LYS 12 HD2 LYS 12 -4.444 -2.681 -1.280 78 HD3 LYS 12 HD1 LYS 12 -6.068 -3.211 -1.716 79 HE2 LYS 12 HE2 LYS 12 -4.049 -1.880 -3.551 80 HE3 LYS 12 HE1 LYS 12 -4.590 -3.557 -3.623 81 HZ1 LYS 12 HZ1 LYS 12 -6.838 -1.881 -3.642 82 HZ2 LYS 12 HZ2 LYS 12 -6.294 -2.934 -4.861 83 HZ3 LYS 12 HZ3 LYS 12 -5.754 -1.323 -4.821 84 H ALA 13 HN ALA 13 -5.501 1.698 -4.542 85 HA ALA 13 HA ALA 13 -3.048 3.044 -4.908 86 HB1 ALA 13 HB1 ALA 13 -5.266 3.852 -6.706 87 HB2 ALA 13 HB2 ALA 13 -4.965 2.117 -6.591 88 HB3 ALA 13 HB3 ALA 13 -3.674 3.204 -7.102 89 H ASN 14 HN ASN 14 -6.325 4.447 -4.593 90 HA ASN 14 HA ASN 14 -5.341 7.171 -4.572 91 HB2 ASN 14 HB2 ASN 14 -7.985 6.171 -3.484 92 HB3 ASN 14 HB1 ASN 14 -7.608 7.795 -4.060 93 HD21 ASN 14 HD21 ASN 14 -6.343 7.366 -6.476 94 HD22 ASN 14 HD22 ASN 14 -7.396 6.574 -7.545 95 H ALA 15 HN ALA 15 -6.217 4.819 -2.059 96 HA ALA 15 HA ALA 15 -5.943 6.665 0.140 97 HB1 ALA 15 HB1 ALA 15 -6.374 4.854 1.501 98 HB2 ALA 15 HB2 ALA 15 -5.382 3.762 0.538 99 HB3 ALA 15 HB3 ALA 15 -6.993 4.212 -0.020 100 H ASP 16 HN ASP 16 -3.764 4.140 -1.120 101 HA ASP 16 HA ASP 16 -1.596 4.607 0.617 102 HB2 ASP 16 HB2 ASP 16 -1.822 3.579 -2.197 103 HB3 ASP 16 HB1 ASP 16 -0.224 3.882 -1.518 104 H ALA 17 HN ALA 17 -2.186 6.089 -2.596 105 HA ALA 17 HA ALA 17 0.059 7.849 -2.508 106 HB1 ALA 17 HB1 ALA 17 -2.151 9.113 -3.845 107 HB2 ALA 17 HB2 ALA 17 -2.159 7.392 -4.232 108 HB3 ALA 17 HB3 ALA 17 -0.723 8.363 -4.558 109 H PHE 18 HN PHE 18 -3.273 8.191 -1.350 110 HA PHE 18 HA PHE 18 -3.170 10.910 -0.551 111 HB2 PHE 18 HB1 PHE 18 -5.211 9.419 -0.605 112 HB3 PHE 18 HB2 PHE 18 -4.630 8.677 0.885 113 HD1 PHE 18 HD1 PHE 18 -5.730 11.878 -0.647 114 HD2 PHE 18 HD2 PHE 18 -4.874 9.771 2.994 115 HE1 PHE 18 HE1 PHE 18 -6.739 13.727 0.659 116 HE2 PHE 18 HE2 PHE 18 -5.881 11.623 4.303 117 HZ PHE 18 HZ PHE 18 -6.813 13.601 3.133 118 H ILE 19 HN ILE 19 -2.092 7.960 1.093 119 HA ILE 19 HA ILE 19 -1.482 9.259 3.600 120 HB ILE 19 HB ILE 19 -0.369 6.691 2.431 121 HG12 ILE 19 HG11 ILE 19 -2.743 6.468 2.572 122 HG13 ILE 19 HG12 ILE 19 -2.104 5.691 4.019 123 HG21 ILE 19 HG21 ILE 19 0.711 6.357 4.399 124 HG22 ILE 19 HG22 ILE 19 -0.630 7.002 5.347 125 HG23 ILE 19 HG23 ILE 19 0.542 8.099 4.616 126 HD11 ILE 19 HD11 ILE 19 -3.627 7.017 5.086 127 HD12 ILE 19 HD12 ILE 19 -3.707 8.168 3.752 128 HD13 ILE 19 HD13 ILE 19 -2.378 8.251 4.909 129 H ASN 20 HN ASN 20 0.403 8.537 0.683 130 HA ASN 20 HA ASN 20 2.941 9.332 1.781 131 HB2 ASN 20 HB1 ASN 20 2.078 9.404 -1.123 132 HB3 ASN 20 HB2 ASN 20 3.730 9.317 -0.511 133 HD21 ASN 20 HD21 ASN 20 1.828 7.353 -2.098 134 HD22 ASN 20 HD22 ASN 20 2.062 5.881 -1.286 135 H SER 21 HN SER 21 0.624 11.084 -0.316 136 HA SER 21 HA SER 21 2.099 13.517 -0.411 137 HB2 SER 21 HB2 SER 21 -0.055 12.725 -1.713 138 HB3 SER 21 HB1 SER 21 -0.900 13.542 -0.399 139 HG SER 21 HG SER 21 0.083 14.660 -2.505 140 H PHE 22 HN PHE 22 -0.092 12.227 2.019 141 HA PHE 22 HA PHE 22 -0.542 14.670 3.444 142 HB2 PHE 22 HB1 PHE 22 -1.903 12.663 3.828 143 HB3 PHE 22 HB2 PHE 22 -0.493 11.816 4.467 144 HD1 PHE 22 HD1 PHE 22 0.613 12.649 6.566 145 HD2 PHE 22 HD2 PHE 22 -3.136 14.209 5.168 146 HE1 PHE 22 HE1 PHE 22 0.181 13.616 8.808 147 HE2 PHE 22 HE2 PHE 22 -3.570 15.175 7.409 148 HZ PHE 22 HZ PHE 22 -1.912 14.878 9.230 149 H ILE 23 HN ILE 23 1.862 12.070 3.982 150 HA ILE 23 HA ILE 23 3.136 13.310 6.208 151 HB ILE 23 HB ILE 23 4.363 11.486 4.124 152 HG12 ILE 23 HG12 ILE 23 3.081 10.798 6.785 153 HG13 ILE 23 HG11 ILE 23 2.277 10.615 5.225 154 HG21 ILE 23 HG21 ILE 23 5.552 12.880 6.242 155 HG22 ILE 23 HG22 ILE 23 6.233 11.498 5.386 156 HG23 ILE 23 HG23 ILE 23 5.305 11.250 6.866 157 HD11 ILE 23 HD11 ILE 23 3.228 8.575 5.080 158 HD12 ILE 23 HD12 ILE 23 4.235 8.883 6.494 159 HD13 ILE 23 HD13 ILE 23 4.781 9.390 4.895 160 H SER 24 HN SER 24 4.207 13.270 2.782 161 HA SER 24 HA SER 24 6.352 15.102 3.142 162 HB2 SER 24 HB2 SER 24 4.667 14.796 0.642 163 HB3 SER 24 HB1 SER 24 6.339 15.350 0.738 164 HG SER 24 HG SER 24 5.521 12.903 0.419 165 H ALA 25 HN ALA 25 2.909 15.636 2.631 166 HA ALA 25 HA ALA 25 3.211 18.492 2.142 167 HB1 ALA 25 HB1 ALA 25 0.809 16.775 2.817 168 HB2 ALA 25 HB2 ALA 25 1.276 17.374 1.225 169 HB3 ALA 25 HB3 ALA 25 0.710 18.499 2.459 170 H ALA 26 HN ALA 26 2.209 16.504 4.936 171 HA ALA 26 HA ALA 26 1.738 18.771 6.660 172 HB1 ALA 26 HB1 ALA 26 2.443 15.939 7.475 173 HB2 ALA 26 HB2 ALA 26 0.818 16.460 7.027 174 HB3 ALA 26 HB3 ALA 26 1.603 17.146 8.450 175 H SER 27 HN SER 27 4.596 16.892 5.856 176 HA SER 27 HA SER 27 6.215 17.690 8.075 177 HB2 SER 27 HB1 SER 27 7.080 17.017 5.248 178 HB3 SER 27 HB2 SER 27 8.116 17.017 6.676 179 HG SER 27 HG SER 27 6.861 15.363 7.538 180 H ASN 28 HN ASN 28 5.343 19.318 5.091 181 HA ASN 28 HA ASN 28 7.264 21.504 5.753 182 HB2 ASN 28 HB2 ASN 28 5.777 20.825 3.204 183 HB3 ASN 28 HB1 ASN 28 6.713 22.304 3.417 184 HD21 ASN 28 HD21 ASN 28 7.542 20.512 1.430 185 HD22 ASN 28 HD22 ASN 28 8.969 19.729 1.911 186 H THR 29 HN THR 29 4.212 20.785 6.575 187 HA THR 29 HA THR 29 3.021 23.402 5.899 188 HB THR 29 HB THR 29 1.815 21.208 7.598 189 HG1 THR 29 HG1 THR 29 2.203 20.282 5.661 190 HG21 THR 29 HG21 THR 29 -0.121 22.414 7.495 191 HG22 THR 29 HG22 THR 29 0.216 23.009 5.871 192 HG23 THR 29 HG23 THR 29 0.987 23.763 7.265 193 H GLY 30 HN GLY 30 2.846 21.687 9.021 194 HA2 GLY 30 HA2 GLY 30 3.099 24.248 10.414 195 HA3 GLY 30 HA1 GLY 30 2.843 22.677 11.171 196 H SER 31 HN SER 31 4.605 21.622 12.016 197 HA SER 31 HA SER 31 7.308 22.704 11.343 198 HB2 SER 31 HB2 SER 31 6.512 23.592 13.540 199 HB3 SER 31 HB1 SER 31 6.351 21.934 14.117 200 HG SER 31 HG SER 31 8.349 22.369 14.714 201 H PHE 32 HN PHE 32 5.841 20.078 13.298 202 HA PHE 32 HA PHE 32 6.544 17.832 13.503 203 HB2 PHE 32 HB2 PHE 32 6.328 18.405 10.556 204 HB3 PHE 32 HB1 PHE 32 6.874 16.819 11.105 205 HD1 PHE 32 HD2 PHE 32 5.369 16.168 13.416 206 HD2 PHE 32 HD1 PHE 32 4.065 18.354 9.948 207 HE1 PHE 32 HE2 PHE 32 3.025 15.507 13.878 208 HE2 PHE 32 HE1 PHE 32 1.724 17.687 10.414 209 HZ PHE 32 HZ PHE 32 1.202 16.265 12.379 210 H SER 33 HN SER 33 8.589 18.210 14.545 211 HA SER 33 HA SER 33 10.995 18.914 13.208 212 HB2 SER 33 HB1 SER 33 10.696 17.125 15.639 213 HB3 SER 33 HB2 SER 33 12.147 18.009 15.164 214 HG SER 33 HG SER 33 11.044 19.197 16.701 215 H GLN 34 HN GLN 34 12.843 17.456 12.728 216 HA GLN 34 HA GLN 34 12.214 15.411 10.905 217 HB2 GLN 34 HB1 GLN 34 14.713 15.695 12.605 218 HB3 GLN 34 HB2 GLN 34 14.574 14.687 11.165 219 HG2 GLN 34 HG2 GLN 34 13.887 16.794 9.906 220 HG3 GLN 34 HG1 GLN 34 14.376 17.704 11.336 221 HE21 GLN 34 HE21 GLN 34 16.602 15.734 11.917 222 HE22 GLN 34 HE22 GLN 34 17.811 16.080 10.776 223 H ASP 35 HN ASP 35 12.760 15.220 14.399 224 HA ASP 35 HA ASP 35 12.795 12.360 14.582 225 HB2 ASP 35 HB1 ASP 35 12.001 14.495 16.580 226 HB3 ASP 35 HB2 ASP 35 12.121 12.781 16.982 227 H GLN 36 HN GLN 36 10.167 14.734 14.557 228 HA GLN 36 HA GLN 36 8.100 12.816 15.220 229 HB2 GLN 36 HB1 GLN 36 7.900 15.490 13.798 230 HB3 GLN 36 HB2 GLN 36 6.546 14.584 14.473 231 HG2 GLN 36 HG2 GLN 36 8.914 15.648 16.044 232 HG3 GLN 36 HG1 GLN 36 7.293 16.343 16.037 233 HE21 GLN 36 HE21 GLN 36 9.122 14.654 18.071 234 HE22 GLN 36 HE22 GLN 36 8.002 13.557 18.722 235 H MET 37 HN MET 37 9.569 13.972 12.228 236 HA MET 37 HA MET 37 7.658 12.844 10.421 237 HB2 MET 37 HB2 MET 37 10.630 13.345 10.064 238 HB3 MET 37 HB1 MET 37 9.512 12.957 8.755 239 HG2 MET 37 HG1 MET 37 8.170 14.970 9.343 240 HG3 MET 37 HG2 MET 37 9.357 15.372 10.584 241 HE1 MET 37 HE1 MET 37 9.976 18.034 7.847 242 HE2 MET 37 HE2 MET 37 9.919 17.759 9.586 243 HE3 MET 37 HE3 MET 37 8.516 17.369 8.594 244 H GLU 38 HN GLU 38 10.441 11.488 12.116 245 HA GLU 38 HA GLU 38 10.675 9.053 10.668 246 HB2 GLU 38 HB1 GLU 38 12.255 9.896 12.460 247 HB3 GLU 38 HB2 GLU 38 11.068 9.374 13.655 248 HG2 GLU 38 HG1 GLU 38 11.199 7.072 12.798 249 HG3 GLU 38 HG2 GLU 38 12.354 7.584 11.569 250 H ASN 39 HN ASN 39 8.693 9.843 13.537 251 HA ASN 39 HA ASN 39 7.499 7.305 13.888 252 HB2 ASN 39 HB2 ASN 39 7.268 9.444 15.333 253 HB3 ASN 39 HB1 ASN 39 5.961 9.878 14.232 254 HD21 ASN 39 HD21 ASN 39 5.134 9.477 16.801 255 HD22 ASN 39 HD22 ASN 39 4.356 7.979 16.974 256 H MET 40 HN MET 40 6.606 9.977 11.741 257 HA MET 40 HA MET 40 4.192 8.837 10.730 258 HB2 MET 40 HB2 MET 40 6.170 10.639 9.296 259 HB3 MET 40 HB1 MET 40 4.492 10.366 8.827 260 HG2 MET 40 HG2 MET 40 3.781 11.247 11.062 261 HG3 MET 40 HG1 MET 40 5.466 11.634 11.404 262 HE1 MET 40 HE1 MET 40 2.533 11.837 9.375 263 HE2 MET 40 HE2 MET 40 3.206 12.416 7.853 264 HE3 MET 40 HE3 MET 40 2.346 13.533 8.909 265 H SER 41 HN SER 41 7.574 8.313 9.941 266 HA SER 41 HA SER 41 7.099 6.835 7.505 267 HB2 SER 41 HB2 SER 41 9.464 6.658 9.396 268 HB3 SER 41 HB1 SER 41 9.431 6.146 7.708 269 HG SER 41 HG SER 41 9.417 8.187 7.056 270 H LEU 42 HN LEU 42 6.952 6.044 10.893 271 HA LEU 42 HA LEU 42 7.022 3.139 10.356 272 HB2 LEU 42 HB2 LEU 42 6.907 4.844 12.829 273 HB3 LEU 42 HB1 LEU 42 6.470 3.138 12.916 274 HG LEU 42 HG LEU 42 8.910 3.621 13.391 275 HD11 LEU 42 HD11 LEU 42 7.709 1.600 11.794 276 HD12 LEU 42 HD12 LEU 42 9.201 1.488 12.727 277 HD13 LEU 42 HD13 LEU 42 9.252 1.997 11.040 278 HD21 LEU 42 HD21 LEU 42 9.266 3.976 10.436 279 HD22 LEU 42 HD22 LEU 42 10.316 4.489 11.757 280 HD23 LEU 42 HD23 LEU 42 8.833 5.380 11.410 281 H ILE 43 HN ILE 43 4.696 5.687 10.805 282 HA ILE 43 HA ILE 43 2.535 3.617 10.745 283 HB ILE 43 HB ILE 43 2.656 6.242 12.249 284 HG12 ILE 43 HG12 ILE 43 1.943 3.438 13.157 285 HG13 ILE 43 HG11 ILE 43 3.560 4.132 13.293 286 HG21 ILE 43 HG21 ILE 43 0.256 5.672 12.872 287 HG22 ILE 43 HG22 ILE 43 0.275 4.506 11.548 288 HG23 ILE 43 HG23 ILE 43 0.487 6.224 11.214 289 HD11 ILE 43 HD11 ILE 43 1.215 5.659 14.383 290 HD12 ILE 43 HD12 ILE 43 2.901 5.688 14.899 291 HD13 ILE 43 HD13 ILE 43 1.875 4.316 15.316 292 H GLY 44 HN GLY 44 0.588 4.297 9.577 293 HA2 GLY 44 HA1 GLY 44 -0.594 5.663 8.006 294 HA3 GLY 44 HA2 GLY 44 0.817 6.716 7.897 295 H ASN 45 HN ASN 45 2.648 5.961 6.605 296 HA ASN 45 HA ASN 45 1.871 4.711 4.151 297 HB2 ASN 45 HB2 ASN 45 4.590 5.224 5.386 298 HB3 ASN 45 HB1 ASN 45 4.383 4.547 3.770 299 HD21 ASN 45 HD21 ASN 45 5.656 7.030 3.967 300 HD22 ASN 45 HD22 ASN 45 4.628 8.253 3.393 301 H THR 46 HN THR 46 3.296 3.465 7.126 302 HA THR 46 HA THR 46 4.049 0.887 6.181 303 HB THR 46 HB THR 46 2.976 1.601 8.927 304 HG1 THR 46 HG1 THR 46 5.441 1.970 7.650 305 HG21 THR 46 HG21 THR 46 4.633 -0.678 7.838 306 HG22 THR 46 HG22 THR 46 3.111 -0.768 8.723 307 HG23 THR 46 HG23 THR 46 4.589 -0.282 9.555 308 H LEU 47 HN LEU 47 0.945 2.196 7.240 309 HA LEU 47 HA LEU 47 -0.517 -0.220 7.454 310 HB2 LEU 47 HB2 LEU 47 -1.466 2.478 6.437 311 HB3 LEU 47 HB1 LEU 47 -2.513 1.167 6.984 312 HG LEU 47 HG LEU 47 -0.346 2.042 8.839 313 HD11 LEU 47 HD21 LEU 47 -1.739 4.051 7.710 314 HD12 LEU 47 HD22 LEU 47 -1.259 4.073 9.406 315 HD13 LEU 47 HD23 LEU 47 -2.892 3.582 8.959 316 HD21 LEU 47 HD11 LEU 47 -2.175 1.610 10.484 317 HD22 LEU 47 HD12 LEU 47 -1.846 0.216 9.454 318 HD23 LEU 47 HD13 LEU 47 -3.254 1.232 9.141 319 H MET 48 HN MET 48 0.374 1.694 4.613 320 HA MET 48 HA MET 48 -1.266 0.493 2.670 321 HB2 MET 48 HB2 MET 48 1.648 1.290 2.360 322 HB3 MET 48 HB1 MET 48 0.491 1.071 1.046 323 HG2 MET 48 HG2 MET 48 -0.943 2.849 2.174 324 HG3 MET 48 HG1 MET 48 0.435 3.171 3.226 325 HE1 MET 48 HE1 MET 48 2.621 3.144 2.451 326 HE2 MET 48 HE2 MET 48 2.989 4.698 1.707 327 HE3 MET 48 HE3 MET 48 3.177 3.217 0.773 328 H ALA 49 HN ALA 49 1.786 -0.675 4.067 329 HA ALA 49 HA ALA 49 2.102 -2.946 2.368 330 HB1 ALA 49 HB1 ALA 49 3.064 -3.721 4.875 331 HB2 ALA 49 HB2 ALA 49 3.241 -1.966 4.867 332 HB3 ALA 49 HB3 ALA 49 3.997 -2.934 3.601 333 H ALA 50 HN ALA 50 0.139 -2.388 5.240 334 HA ALA 50 HA ALA 50 -0.568 -5.113 5.757 335 HB1 ALA 50 HB1 ALA 50 -2.689 -3.979 6.749 336 HB2 ALA 50 HB2 ALA 50 -1.880 -2.463 6.347 337 HB3 ALA 50 HB3 ALA 50 -1.127 -3.593 7.472 338 H MET 51 HN MET 51 -1.758 -2.729 3.461 339 HA MET 51 HA MET 51 -4.206 -3.938 2.723 340 HB2 MET 51 HB2 MET 51 -2.191 -2.449 1.012 341 HB3 MET 51 HB1 MET 51 -3.831 -2.843 0.499 342 HG2 MET 51 HG2 MET 51 -4.701 -1.597 2.487 343 HG3 MET 51 HG1 MET 51 -3.048 -1.122 2.871 344 HE1 MET 51 HE1 MET 51 -5.053 1.935 1.616 345 HE2 MET 51 HE2 MET 51 -3.504 1.794 2.442 346 HE3 MET 51 HE3 MET 51 -4.852 0.773 2.934 347 H ASP 52 HN ASP 52 -0.886 -4.745 1.831 348 HA ASP 52 HA ASP 52 -1.403 -6.522 -0.311 349 HB2 ASP 52 HB1 ASP 52 0.729 -6.609 1.844 350 HB3 ASP 52 HB2 ASP 52 0.730 -7.658 0.425 351 H ASN 53 HN ASN 53 -1.865 -6.893 3.136 352 HA ASN 53 HA ASN 53 -2.098 -9.768 3.160 353 HB2 ASN 53 HB2 ASN 53 -3.286 -7.689 5.025 354 HB3 ASN 53 HB1 ASN 53 -3.210 -9.421 5.350 355 HD21 ASN 53 HD21 ASN 53 -0.628 -10.070 4.481 356 HD22 ASN 53 HD22 ASN 53 0.529 -9.199 5.368 357 H MET 54 HN MET 54 -4.231 -7.189 2.216 358 HA MET 54 HA MET 54 -6.756 -8.430 2.547 359 HB2 MET 54 HB2 MET 54 -5.901 -6.672 0.226 360 HB3 MET 54 HB1 MET 54 -7.550 -6.933 0.797 361 HG2 MET 54 HG1 MET 54 -5.309 -5.654 2.397 362 HG3 MET 54 HG2 MET 54 -6.652 -4.795 1.644 363 HE1 MET 54 HE1 MET 54 -8.887 -7.182 2.091 364 HE2 MET 54 HE2 MET 54 -9.125 -5.437 2.045 365 HE3 MET 54 HE3 MET 54 -9.739 -6.366 3.410 366 H GLY 55 HN GLY 55 -4.197 -9.036 0.247 367 HA2 GLY 55 HA1 GLY 55 -3.955 -10.923 -1.162 368 HA3 GLY 55 HA2 GLY 55 -5.556 -11.463 -0.656 369 H GLY 56 HN GLY 56 -5.663 -8.226 -1.579 370 HA2 GLY 56 HA2 GLY 56 -5.919 -7.287 -3.823 371 HA3 GLY 56 HA1 GLY 56 -6.290 -8.907 -4.414 372 H ARG 57 HN ARG 57 -7.717 -7.936 -1.408 373 HA ARG 57 HA ARG 57 -10.286 -7.363 -2.825 374 HB2 ARG 57 HB2 ARG 57 -11.491 -8.700 -1.218 375 HB3 ARG 57 HB1 ARG 57 -10.183 -9.694 -1.859 376 HG2 ARG 57 HG1 ARG 57 -8.836 -8.708 0.180 377 HG3 ARG 57 HG2 ARG 57 -10.443 -8.415 0.844 378 HD2 ARG 57 HD2 ARG 57 -10.994 -10.824 0.419 379 HD3 ARG 57 HD1 ARG 57 -9.321 -11.077 -0.079 380 HE ARG 57 HE ARG 57 -8.887 -10.069 2.358 381 HH11 ARG 57 HH21 ARG 57 -8.813 -12.984 2.251 382 HH12 ARG 57 HH22 ARG 57 -10.073 -13.463 3.338 383 HH21 ARG 57 HH11 ARG 57 -11.612 -10.356 3.347 384 HH22 ARG 57 HH12 ARG 57 -11.657 -11.977 3.958 385 H ILE 58 HN ILE 58 -10.733 -5.268 -2.369 386 HA ILE 58 HA ILE 58 -10.240 -4.328 0.428 387 HB ILE 58 HB ILE 58 -10.356 -2.602 -2.057 388 HG12 ILE 58 HG11 ILE 58 -8.453 -4.110 -2.264 389 HG13 ILE 58 HG12 ILE 58 -7.864 -2.510 -1.812 390 HG21 ILE 58 HG21 ILE 58 -8.950 -1.874 0.477 391 HG22 ILE 58 HG22 ILE 58 -10.713 -1.818 0.475 392 HG23 ILE 58 HG23 ILE 58 -9.798 -0.839 -0.671 393 HD11 ILE 58 HD11 ILE 58 -7.598 -5.010 -0.385 394 HD12 ILE 58 HD12 ILE 58 -8.445 -3.830 0.614 395 HD13 ILE 58 HD13 ILE 58 -6.850 -3.452 -0.034 396 H THR 59 HN THR 59 -11.885 -2.976 1.356 397 HA THR 59 HA THR 59 -14.399 -2.669 -0.180 398 HB THR 59 HB THR 59 -15.755 -3.850 1.362 399 HG1 THR 59 HG1 THR 59 -15.086 -4.371 3.381 400 HG21 THR 59 HG21 THR 59 -14.587 -5.430 -0.024 401 HG22 THR 59 HG22 THR 59 -14.602 -6.088 1.612 402 HG23 THR 59 HG23 THR 59 -13.141 -5.326 0.981 403 HA PRO 60 HA PRO 60 -14.726 1.152 2.028 404 HB2 PRO 60 HB2 PRO 60 -17.387 1.359 2.472 405 HB3 PRO 60 HB1 PRO 60 -16.657 1.581 0.879 406 HG2 PRO 60 HG2 PRO 60 -18.015 -0.833 2.024 407 HG3 PRO 60 HG1 PRO 60 -18.184 -0.124 0.415 408 HD2 PRO 60 HD2 PRO 60 -16.641 -2.291 0.854 409 HD3 PRO 60 HD1 PRO 60 -16.216 -1.078 -0.353 410 H SER 61 HN SER 61 -16.700 -1.441 3.507 411 HA SER 61 HA SER 61 -16.821 -0.268 6.111 412 HB2 SER 61 HB2 SER 61 -18.230 -2.193 5.321 413 HB3 SER 61 HB1 SER 61 -16.804 -3.225 5.431 414 HG SER 61 HG SER 61 -18.457 -2.369 7.383 415 H LYS 62 HN LYS 62 -14.442 -2.385 4.557 416 HA LYS 62 HA LYS 62 -12.854 -2.680 6.988 417 HB2 LYS 62 HB2 LYS 62 -12.274 -3.298 4.077 418 HB3 LYS 62 HB1 LYS 62 -11.158 -3.655 5.395 419 HG2 LYS 62 HG2 LYS 62 -12.958 -5.011 6.486 420 HG3 LYS 62 HG1 LYS 62 -13.976 -4.733 5.072 421 HD2 LYS 62 HD2 LYS 62 -12.152 -5.747 3.657 422 HD3 LYS 62 HD1 LYS 62 -11.309 -6.172 5.146 423 HE2 LYS 62 HE2 LYS 62 -14.145 -7.029 4.505 424 HE3 LYS 62 HE1 LYS 62 -12.726 -8.034 4.216 425 HZ1 LYS 62 HZ1 LYS 62 -13.368 -6.878 6.868 426 HZ2 LYS 62 HZ2 LYS 62 -12.238 -8.094 6.507 427 HZ3 LYS 62 HZ3 LYS 62 -13.901 -8.412 6.380 428 H LEU 63 HN LEU 63 -12.401 -0.922 3.898 429 HA LEU 63 HA LEU 63 -10.022 0.442 4.714 430 HB2 LEU 63 HB2 LEU 63 -11.859 0.514 2.472 431 HB3 LEU 63 HB1 LEU 63 -11.393 2.147 2.946 432 HG LEU 63 HG LEU 63 -9.355 -0.059 2.614 433 HD11 LEU 63 HD11 LEU 63 -9.005 0.619 0.345 434 HD12 LEU 63 HD12 LEU 63 -10.102 1.989 0.518 435 HD13 LEU 63 HD13 LEU 63 -10.739 0.342 0.514 436 HD21 LEU 63 HD21 LEU 63 -9.336 2.717 3.406 437 HD22 LEU 63 HD22 LEU 63 -8.385 2.510 1.935 438 HD23 LEU 63 HD23 LEU 63 -7.998 1.568 3.376 439 H GLN 64 HN GLN 64 -13.462 1.291 4.966 440 HA GLN 64 HA GLN 64 -13.197 3.941 5.901 441 HB2 GLN 64 HB2 GLN 64 -15.371 2.830 5.375 442 HB3 GLN 64 HB1 GLN 64 -15.212 1.879 6.851 443 HG2 GLN 64 HG2 GLN 64 -16.569 3.714 7.487 444 HG3 GLN 64 HG1 GLN 64 -14.958 4.151 8.058 445 HE21 GLN 64 HE21 GLN 64 -14.865 6.402 7.744 446 HE22 GLN 64 HE22 GLN 64 -15.195 7.175 6.269 447 H ALA 65 HN ALA 65 -12.969 0.867 7.668 448 HA ALA 65 HA ALA 65 -12.621 2.125 10.258 449 HB1 ALA 65 HB1 ALA 65 -12.342 -0.636 9.142 450 HB2 ALA 65 HB2 ALA 65 -13.282 -0.077 10.526 451 HB3 ALA 65 HB3 ALA 65 -11.536 -0.281 10.670 452 H LEU 66 HN LEU 66 -10.470 1.034 7.679 453 HA LEU 66 HA LEU 66 -8.031 1.419 9.207 454 HB2 LEU 66 HB2 LEU 66 -8.160 -0.071 7.218 455 HB3 LEU 66 HB1 LEU 66 -8.430 1.344 6.199 456 HG LEU 66 HG LEU 66 -6.196 2.112 7.572 457 HD11 LEU 66 HD21 LEU 66 -4.760 0.335 8.009 458 HD12 LEU 66 HD22 LEU 66 -5.589 -0.746 6.889 459 HD13 LEU 66 HD23 LEU 66 -6.310 -0.378 8.457 460 HD21 LEU 66 HD11 LEU 66 -6.069 2.415 5.288 461 HD22 LEU 66 HD12 LEU 66 -6.715 0.812 4.934 462 HD23 LEU 66 HD13 LEU 66 -5.032 0.996 5.432 463 H ASP 67 HN ASP 67 -9.743 3.339 6.723 464 HA ASP 67 HA ASP 67 -7.999 5.497 6.471 465 HB2 ASP 67 HB1 ASP 67 -10.310 5.121 5.378 466 HB3 ASP 67 HB2 ASP 67 -10.968 5.922 6.802 467 H MET 68 HN MET 68 -10.479 5.046 9.007 468 HA MET 68 HA MET 68 -9.994 7.480 10.392 469 HB2 MET 68 HB2 MET 68 -10.887 4.790 11.474 470 HB3 MET 68 HB1 MET 68 -10.980 6.310 12.362 471 HG2 MET 68 HG2 MET 68 -12.418 7.243 10.555 472 HG3 MET 68 HG1 MET 68 -12.375 5.677 9.744 473 HE1 MET 68 HE1 MET 68 -14.703 6.757 9.911 474 HE2 MET 68 HE2 MET 68 -15.869 6.421 11.186 475 HE3 MET 68 HE3 MET 68 -15.367 5.129 10.100 476 H ALA 69 HN ALA 69 -8.405 4.312 10.639 477 HA ALA 69 HA ALA 69 -6.842 4.778 12.944 478 HB1 ALA 69 HB1 ALA 69 -6.927 2.854 10.848 479 HB2 ALA 69 HB2 ALA 69 -6.093 2.728 12.397 480 HB3 ALA 69 HB3 ALA 69 -5.254 3.393 10.996 481 H PHE 70 HN PHE 70 -6.139 5.603 9.546 482 HA PHE 70 HA PHE 70 -3.548 6.663 9.912 483 HB2 PHE 70 HB1 PHE 70 -4.611 6.343 7.696 484 HB3 PHE 70 HB2 PHE 70 -5.708 7.681 8.040 485 HD1 PHE 70 HD2 PHE 70 -2.133 6.770 7.568 486 HD2 PHE 70 HD1 PHE 70 -5.006 9.952 7.816 487 HE1 PHE 70 HE2 PHE 70 -0.419 8.379 6.777 488 HE2 PHE 70 HE1 PHE 70 -3.293 11.561 7.025 489 HZ PHE 70 HZ PHE 70 -0.999 10.774 6.506 490 H ALA 71 HN ALA 71 -6.711 8.123 10.526 491 HA ALA 71 HA ALA 71 -5.763 10.794 10.983 492 HB1 ALA 71 HB1 ALA 71 -8.096 10.577 10.662 493 HB2 ALA 71 HB2 ALA 71 -7.936 10.930 12.383 494 HB3 ALA 71 HB3 ALA 71 -8.224 9.275 11.845 495 H SER 72 HN SER 72 -6.131 7.975 13.107 496 HA SER 72 HA SER 72 -5.566 9.381 15.556 497 HB2 SER 72 HB1 SER 72 -5.063 6.460 14.915 498 HB3 SER 72 HB2 SER 72 -5.227 7.170 16.522 499 HG SER 72 HG SER 72 -7.168 6.722 14.552 500 H SER 73 HN SER 73 -3.532 7.921 13.078 501 HA SER 73 HA SER 73 -1.094 7.949 14.616 502 HB2 SER 73 HB1 SER 73 0.027 7.610 12.481 503 HB3 SER 73 HB2 SER 73 -1.426 6.617 12.529 504 HG SER 73 HG SER 73 -2.435 7.974 11.175 505 H VAL 74 HN VAL 74 -2.407 10.179 12.173 506 HA VAL 74 HA VAL 74 -0.285 12.061 12.294 507 HB VAL 74 HB VAL 74 -1.928 13.668 11.344 508 HG11 VAL 74 HG11 VAL 74 -0.883 12.169 9.783 509 HG12 VAL 74 HG12 VAL 74 -2.599 12.203 9.379 510 HG13 VAL 74 HG13 VAL 74 -1.931 10.835 10.270 511 HG21 VAL 74 HG21 VAL 74 -3.918 11.422 11.792 512 HG22 VAL 74 HG22 VAL 74 -4.249 12.979 11.034 513 HG23 VAL 74 HG23 VAL 74 -3.850 12.901 12.750 514 H ALA 75 HN ALA 75 -3.178 11.688 14.295 515 HA ALA 75 HA ALA 75 -2.819 14.203 15.695 516 HB1 ALA 75 HB1 ALA 75 -5.018 13.300 15.735 517 HB2 ALA 75 HB2 ALA 75 -4.404 13.076 17.373 518 HB3 ALA 75 HB3 ALA 75 -4.441 11.715 16.252 519 H GLN 76 HN GLN 76 -2.093 10.800 16.522 520 HA GLN 76 HA GLN 76 -0.931 11.389 19.073 521 HB2 GLN 76 HB1 GLN 76 -0.470 9.073 17.172 522 HB3 GLN 76 HB2 GLN 76 0.130 9.130 18.829 523 HG2 GLN 76 HG2 GLN 76 -2.174 9.352 19.667 524 HG3 GLN 76 HG1 GLN 76 -2.787 9.336 18.014 525 HE21 GLN 76 HE21 GLN 76 -3.608 7.336 19.875 526 HE22 GLN 76 HE22 GLN 76 -2.963 5.844 19.383 527 H ILE 77 HN ILE 77 0.615 10.803 15.894 528 HA ILE 77 HA ILE 77 3.286 11.187 16.704 529 HB ILE 77 HB ILE 77 1.942 11.879 14.081 530 HG12 ILE 77 HG12 ILE 77 3.659 9.520 14.911 531 HG13 ILE 77 HG11 ILE 77 1.900 9.487 14.794 532 HG21 ILE 77 HG21 ILE 77 4.291 11.769 13.178 533 HG22 ILE 77 HG22 ILE 77 4.874 11.748 14.843 534 HG23 ILE 77 HG23 ILE 77 3.999 13.152 14.232 535 HD11 ILE 77 HD11 ILE 77 2.244 8.853 12.641 536 HD12 ILE 77 HD12 ILE 77 3.923 9.390 12.660 537 HD13 ILE 77 HD13 ILE 77 2.629 10.551 12.356 538 H ALA 78 HN ALA 78 1.017 13.633 15.443 539 HA ALA 78 HA ALA 78 2.867 15.813 15.954 540 HB1 ALA 78 HB1 ALA 78 1.417 16.936 14.650 541 HB2 ALA 78 HB2 ALA 78 0.120 16.683 15.816 542 HB3 ALA 78 HB3 ALA 78 0.427 15.480 14.565 543 H ALA 79 HN ALA 79 -0.193 14.781 17.506 544 HA ALA 79 HA ALA 79 -0.143 16.675 19.615 545 HB1 ALA 79 HB1 ALA 79 -1.179 13.830 19.783 546 HB2 ALA 79 HB2 ALA 79 -2.072 15.166 19.056 547 HB3 ALA 79 HB3 ALA 79 -1.683 15.198 20.776 548 H SER 80 HN SER 80 1.577 13.639 19.204 549 HA SER 80 HA SER 80 2.470 13.451 21.957 550 HB2 SER 80 HB2 SER 80 4.019 11.748 21.114 551 HB3 SER 80 HB1 SER 80 2.419 11.498 20.414 552 HG SER 80 HG SER 80 4.732 11.963 19.172 553 H GLN 81 HN GLN 81 3.449 15.298 19.203 554 HA GLN 81 HA GLN 81 6.179 15.719 19.606 555 HB2 GLN 81 HB1 GLN 81 4.118 17.841 18.931 556 HB3 GLN 81 HB2 GLN 81 5.851 17.949 18.622 557 HG2 GLN 81 HG2 GLN 81 5.747 16.065 17.092 558 HG3 GLN 81 HG1 GLN 81 4.051 15.788 17.487 559 HE21 GLN 81 HE21 GLN 81 5.852 17.000 15.043 560 HE22 GLN 81 HE22 GLN 81 4.803 18.204 14.465 561 H GLY 82 HN GLY 82 3.466 17.191 21.353 562 HA2 GLY 82 HA1 GLY 82 3.560 17.863 23.658 563 HA3 GLY 82 HA2 GLY 82 5.320 17.825 23.571 564 H GLY 83 HN GLY 83 4.159 19.372 20.842 565 HA2 GLY 83 HA1 GLY 83 4.777 22.021 22.050 566 HA3 GLY 83 HA2 GLY 83 4.833 21.650 20.327 567 H ASP 84 HN ASP 84 3.424 23.496 19.940 568 HA ASP 84 HA ASP 84 0.826 23.742 21.139 569 HB2 ASP 84 HB2 ASP 84 2.076 25.555 19.881 570 HB3 ASP 84 HB1 ASP 84 1.641 24.721 18.390 571 H LEU 85 HN LEU 85 -0.551 22.007 20.990 572 HA LEU 85 HA LEU 85 -0.634 20.215 18.738 573 HB2 LEU 85 HB2 LEU 85 -1.416 19.607 21.026 574 HB3 LEU 85 HB1 LEU 85 -2.767 20.723 20.834 575 HG LEU 85 HG LEU 85 -3.656 19.445 18.992 576 HD11 LEU 85 HD21 LEU 85 -2.089 18.514 17.640 577 HD12 LEU 85 HD22 LEU 85 -2.154 17.142 18.748 578 HD13 LEU 85 HD23 LEU 85 -0.915 18.381 18.950 579 HD21 LEU 85 HD11 LEU 85 -4.561 18.244 20.689 580 HD22 LEU 85 HD12 LEU 85 -3.030 18.168 21.561 581 HD23 LEU 85 HD13 LEU 85 -3.370 17.011 20.274 582 H GLY 86 HN GLY 86 -1.875 23.358 19.214 583 HA2 GLY 86 HA2 GLY 86 -4.233 23.149 17.554 584 HA3 GLY 86 HA1 GLY 86 -3.423 24.650 18.002 585 H VAL 87 HN VAL 87 -0.819 23.777 16.929 586 HA VAL 87 HA VAL 87 -1.188 24.670 14.204 587 HB VAL 87 HB VAL 87 0.893 24.977 15.673 588 HG11 VAL 87 HG11 VAL 87 0.876 22.383 16.102 589 HG12 VAL 87 HG12 VAL 87 2.416 23.224 15.933 590 HG13 VAL 87 HG13 VAL 87 1.753 22.316 14.574 591 HG21 VAL 87 HG21 VAL 87 2.430 24.592 13.643 592 HG22 VAL 87 HG22 VAL 87 1.042 25.652 13.397 593 HG23 VAL 87 HG23 VAL 87 0.992 23.987 12.819 594 H THR 88 HN THR 88 -0.718 21.495 15.714 595 HA THR 88 HA THR 88 -0.167 19.954 13.432 596 HB THR 88 HB THR 88 -1.989 19.242 15.752 597 HG1 THR 88 HG1 THR 88 -0.179 18.547 16.708 598 HG21 THR 88 HG21 THR 88 -1.642 16.937 15.102 599 HG22 THR 88 HG22 THR 88 -0.527 17.421 13.823 600 HG23 THR 88 HG23 THR 88 -2.241 17.818 13.695 601 H THR 89 HN THR 89 -3.180 21.425 14.488 602 HA THR 89 HA THR 89 -4.967 20.059 12.744 603 HB THR 89 HB THR 89 -5.080 22.977 13.579 604 HG1 THR 89 HG1 THR 89 -6.290 20.739 14.813 605 HG21 THR 89 HG21 THR 89 -7.160 21.010 12.594 606 HG22 THR 89 HG22 THR 89 -6.662 22.514 11.818 607 HG23 THR 89 HG23 THR 89 -7.558 22.560 13.337 608 H ASN 90 HN ASN 90 -3.035 23.013 12.266 609 HA ASN 90 HA ASN 90 -3.845 23.356 9.513 610 HB2 ASN 90 HB2 ASN 90 -1.417 24.400 11.002 611 HB3 ASN 90 HB1 ASN 90 -1.941 24.950 9.411 612 HD21 ASN 90 HD21 ASN 90 -1.812 26.741 11.656 613 HD22 ASN 90 HD22 ASN 90 -3.394 27.215 12.048 614 H ALA 91 HN ALA 91 -1.126 21.775 11.140 615 HA ALA 91 HA ALA 91 0.342 21.150 8.743 616 HB1 ALA 91 HB1 ALA 91 1.853 20.410 10.239 617 HB2 ALA 91 HB2 ALA 91 0.725 19.196 10.843 618 HB3 ALA 91 HB3 ALA 91 0.708 20.826 11.515 619 H ILE 92 HN ILE 92 -1.701 19.062 10.823 620 HA ILE 92 HA ILE 92 -1.684 16.863 8.977 621 HB ILE 92 HB ILE 92 -3.622 17.585 11.194 622 HG12 ILE 92 HG12 ILE 92 -1.301 15.636 11.060 623 HG13 ILE 92 HG11 ILE 92 -1.303 17.172 11.927 624 HG21 ILE 92 HG21 ILE 92 -3.400 14.770 10.444 625 HG22 ILE 92 HG22 ILE 92 -4.024 15.763 9.127 626 HG23 ILE 92 HG23 ILE 92 -4.845 15.752 10.687 627 HD11 ILE 92 HD11 ILE 92 -3.281 16.326 13.248 628 HD12 ILE 92 HD12 ILE 92 -1.791 15.427 13.529 629 HD13 ILE 92 HD13 ILE 92 -3.043 14.753 12.485 630 H ALA 93 HN ALA 93 -4.035 19.487 9.553 631 HA ALA 93 HA ALA 93 -5.956 18.577 7.633 632 HB1 ALA 93 HB1 ALA 93 -5.383 21.412 8.541 633 HB2 ALA 93 HB2 ALA 93 -6.461 20.281 9.358 634 HB3 ALA 93 HB3 ALA 93 -6.854 20.863 7.740 635 H ASP 94 HN ASP 94 -3.385 21.052 7.341 636 HA ASP 94 HA ASP 94 -3.815 21.716 4.635 637 HB2 ASP 94 HB1 ASP 94 -1.279 21.619 6.277 638 HB3 ASP 94 HB2 ASP 94 -1.327 22.257 4.634 639 H ALA 95 HN ALA 95 -1.830 19.085 6.005 640 HA ALA 95 HA ALA 95 -0.868 18.160 3.452 641 HB1 ALA 95 HB1 ALA 95 0.245 17.536 5.553 642 HB2 ALA 95 HB2 ALA 95 -0.278 16.090 4.690 643 HB3 ALA 95 HB3 ALA 95 -1.200 16.671 6.076 644 H LEU 96 HN LEU 96 -3.641 17.281 5.481 645 HA LEU 96 HA LEU 96 -4.545 15.134 3.775 646 HB2 LEU 96 HB2 LEU 96 -5.230 16.091 6.278 647 HB3 LEU 96 HB1 LEU 96 -6.630 16.524 5.295 648 HG LEU 96 HG LEU 96 -5.722 13.860 4.626 649 HD11 LEU 96 HD11 LEU 96 -5.184 13.034 6.650 650 HD12 LEU 96 HD12 LEU 96 -6.830 13.383 7.179 651 HD13 LEU 96 HD13 LEU 96 -5.554 14.577 7.421 652 HD21 LEU 96 HD21 LEU 96 -8.262 14.927 5.901 653 HD22 LEU 96 HD22 LEU 96 -8.079 13.337 5.161 654 HD23 LEU 96 HD23 LEU 96 -7.962 14.791 4.168 655 H THR 97 HN THR 97 -5.176 18.609 3.902 656 HA THR 97 HA THR 97 -7.389 18.591 2.070 657 HB THR 97 HB THR 97 -5.402 20.771 2.770 658 HG1 THR 97 HG1 THR 97 -6.564 20.680 4.511 659 HG21 THR 97 HG21 THR 97 -7.722 21.993 1.933 660 HG22 THR 97 HG22 THR 97 -7.585 20.643 0.807 661 HG23 THR 97 HG23 THR 97 -6.269 21.807 0.951 662 H SER 98 HN SER 98 -3.920 19.323 1.556 663 HA SER 98 HA SER 98 -4.098 19.702 -1.256 664 HB2 SER 98 HB1 SER 98 -2.114 20.261 0.191 665 HB3 SER 98 HB2 SER 98 -1.745 18.537 0.258 666 HG SER 98 HG SER 98 -0.672 19.804 -1.434 667 H ALA 99 HN ALA 99 -3.747 16.759 0.673 668 HA ALA 99 HA ALA 99 -3.199 15.026 -1.567 669 HB1 ALA 99 HB1 ALA 99 -2.701 14.412 0.789 670 HB2 ALA 99 HB2 ALA 99 -3.698 13.200 -0.015 671 HB3 ALA 99 HB3 ALA 99 -4.433 14.336 1.115 672 H PHE 100 HN PHE 100 -6.186 15.896 0.168 673 HA PHE 100 HA PHE 100 -8.023 14.188 -1.027 674 HB2 PHE 100 HB1 PHE 100 -8.113 16.877 0.142 675 HB3 PHE 100 HB2 PHE 100 -9.371 16.604 -1.063 676 HD1 PHE 100 HD2 PHE 100 -10.552 14.206 -0.885 677 HD2 PHE 100 HD1 PHE 100 -8.543 16.220 2.334 678 HE1 PHE 100 HE2 PHE 100 -11.841 12.865 0.759 679 HE2 PHE 100 HE1 PHE 100 -9.829 14.880 3.974 680 HZ PHE 100 HZ PHE 100 -11.477 13.202 3.188 681 H TYR 101 HN TYR 101 -7.078 17.388 -2.334 682 HA TYR 101 HA TYR 101 -8.468 16.960 -4.828 683 HB2 TYR 101 HB2 TYR 101 -6.202 18.903 -4.429 684 HB3 TYR 101 HB1 TYR 101 -7.628 19.072 -5.456 685 HD1 TYR 101 HD2 TYR 101 -9.851 18.339 -3.787 686 HD2 TYR 101 HD1 TYR 101 -6.303 20.513 -2.723 687 HE1 TYR 101 HE2 TYR 101 -11.074 19.413 -1.915 688 HE2 TYR 101 HE1 TYR 101 -7.526 21.592 -0.854 689 HH TYR 101 HH TYR 101 -10.834 21.608 -0.588 690 H GLN 102 HN GLN 102 -5.164 16.395 -3.749 691 HA GLN 102 HA GLN 102 -4.141 15.894 -6.424 692 HB2 GLN 102 HB2 GLN 102 -3.050 15.210 -3.680 693 HB3 GLN 102 HB1 GLN 102 -2.169 14.965 -5.187 694 HG2 GLN 102 HG2 GLN 102 -3.288 17.643 -4.322 695 HG3 GLN 102 HG1 GLN 102 -1.631 17.134 -4.004 696 HE21 GLN 102 HE21 GLN 102 -3.133 19.137 -6.015 697 HE22 GLN 102 HE22 GLN 102 -2.287 18.869 -7.463 698 H THR 103 HN THR 103 -5.929 14.017 -4.124 699 HA THR 103 HA THR 103 -5.093 11.511 -5.504 700 HB THR 103 HB THR 103 -6.055 10.324 -3.608 701 HG1 THR 103 HG1 THR 103 -7.017 11.501 -1.940 702 HG21 THR 103 HG21 THR 103 -4.690 12.443 -2.092 703 HG22 THR 103 HG22 THR 103 -3.813 11.912 -3.526 704 HG23 THR 103 HG23 THR 103 -4.263 10.743 -2.286 705 H THR 104 HN THR 104 -8.185 12.879 -4.222 706 HA THR 104 HA THR 104 -9.478 11.670 -6.638 707 HB THR 104 HB THR 104 -11.365 11.013 -5.315 708 HG1 THR 104 HG1 THR 104 -11.044 11.485 -2.924 709 HG21 THR 104 HG21 THR 104 -8.737 10.081 -4.813 710 HG22 THR 104 HG22 THR 104 -10.250 9.201 -4.595 711 HG23 THR 104 HG23 THR 104 -9.565 10.124 -3.257 712 H GLY 105 HN GLY 105 -9.762 14.229 -4.157 713 HA2 GLY 105 HA2 GLY 105 -10.208 16.534 -4.931 714 HA3 GLY 105 HA1 GLY 105 -11.181 15.851 -6.228 715 H VAL 106 HN VAL 106 -11.163 15.159 -2.720 716 HA VAL 106 HA VAL 106 -14.091 15.757 -2.732 717 HB VAL 106 HB VAL 106 -12.592 14.202 -0.619 718 HG11 VAL 106 HG21 VAL 106 -15.003 13.186 -0.530 719 HG12 VAL 106 HG22 VAL 106 -15.464 14.652 -1.395 720 HG13 VAL 106 HG23 VAL 106 -14.716 14.766 0.199 721 HG21 VAL 106 HG11 VAL 106 -12.551 12.342 -1.911 722 HG22 VAL 106 HG12 VAL 106 -12.786 13.432 -3.278 723 HG23 VAL 106 HG13 VAL 106 -14.175 12.645 -2.530 724 H VAL 107 HN VAL 107 -14.829 16.558 -0.451 725 HA VAL 107 HA VAL 107 -13.378 19.009 0.097 726 HB VAL 107 HB VAL 107 -15.079 19.194 1.984 727 HG11 VAL 107 HG21 VAL 107 -16.335 20.227 0.425 728 HG12 VAL 107 HG22 VAL 107 -16.841 18.679 -0.252 729 HG13 VAL 107 HG23 VAL 107 -15.355 19.445 -0.815 730 HG21 VAL 107 HG11 VAL 107 -16.879 17.213 0.996 731 HG22 VAL 107 HG12 VAL 107 -16.166 17.323 2.605 732 HG23 VAL 107 HG13 VAL 107 -15.344 16.414 1.337 733 H ASN 108 HN ASN 108 -11.620 19.145 1.389 734 HA ASN 108 HA ASN 108 -10.743 16.939 3.042 735 HB2 ASN 108 HB2 ASN 108 -8.895 18.372 3.642 736 HB3 ASN 108 HB1 ASN 108 -9.234 18.631 1.931 737 HD21 ASN 108 HD21 ASN 108 -9.750 20.755 1.288 738 HD22 ASN 108 HD22 ASN 108 -10.111 22.022 2.357 739 H SER 109 HN SER 109 -12.713 19.745 3.579 740 HA SER 109 HA SER 109 -12.385 20.065 6.380 741 HB2 SER 109 HB2 SER 109 -14.890 20.476 4.720 742 HB3 SER 109 HB1 SER 109 -14.596 21.146 6.324 743 HG SER 109 HG SER 109 -12.666 21.593 4.375 744 H ARG 110 HN ARG 110 -14.256 17.701 4.545 745 HA ARG 110 HA ARG 110 -15.878 16.817 6.752 746 HB2 ARG 110 HB2 ARG 110 -16.289 16.342 4.297 747 HB3 ARG 110 HB1 ARG 110 -14.991 15.152 4.385 748 HG2 ARG 110 HG2 ARG 110 -16.210 13.981 6.202 749 HG3 ARG 110 HG1 ARG 110 -17.520 15.154 6.062 750 HD2 ARG 110 HD1 ARG 110 -16.556 13.330 3.837 751 HD3 ARG 110 HD2 ARG 110 -18.020 13.087 4.791 752 HE ARG 110 HE ARG 110 -17.603 15.381 2.919 753 HH11 ARG 110 HH11 ARG 110 -19.406 13.034 2.257 754 HH12 ARG 110 HH12 ARG 110 -20.962 13.667 2.680 755 HH21 ARG 110 HH21 ARG 110 -19.677 16.291 4.549 756 HH22 ARG 110 HH22 ARG 110 -21.115 15.512 3.978 757 H PHE 111 HN PHE 111 -12.942 15.333 5.302 758 HA PHE 111 HA PHE 111 -12.699 13.450 7.509 759 HB2 PHE 111 HB1 PHE 111 -11.842 13.135 5.104 760 HB3 PHE 111 HB2 PHE 111 -10.497 14.175 5.574 761 HD1 PHE 111 HD2 PHE 111 -12.249 10.986 6.340 762 HD2 PHE 111 HD1 PHE 111 -8.740 13.377 6.997 763 HE1 PHE 111 HE2 PHE 111 -11.139 9.057 7.432 764 HE2 PHE 111 HE1 PHE 111 -7.632 11.447 8.090 765 HZ PHE 111 HZ PHE 111 -8.831 9.288 8.308 766 H ILE 112 HN ILE 112 -10.818 16.315 6.496 767 HA ILE 112 HA ILE 112 -8.971 16.319 8.629 768 HB ILE 112 HB ILE 112 -10.167 18.630 7.079 769 HG12 ILE 112 HG12 ILE 112 -7.594 17.044 6.830 770 HG13 ILE 112 HG11 ILE 112 -8.942 17.047 5.693 771 HG21 ILE 112 HG21 ILE 112 -9.083 19.138 9.390 772 HG22 ILE 112 HG22 ILE 112 -8.518 20.048 7.991 773 HG23 ILE 112 HG23 ILE 112 -7.567 18.696 8.604 774 HD11 ILE 112 HD11 ILE 112 -7.196 18.518 4.846 775 HD12 ILE 112 HD12 ILE 112 -7.150 19.396 6.374 776 HD13 ILE 112 HD13 ILE 112 -8.575 19.497 5.342 777 H SER 113 HN SER 113 -12.258 17.687 8.496 778 HA SER 113 HA SER 113 -12.163 19.074 10.981 779 HB2 SER 113 HB2 SER 113 -14.433 17.776 9.464 780 HB3 SER 113 HB1 SER 113 -14.693 18.636 10.981 781 HG SER 113 HG SER 113 -13.628 20.444 9.986 782 H GLU 114 HN GLU 114 -12.871 15.674 10.237 783 HA GLU 114 HA GLU 114 -13.635 14.948 12.914 784 HB2 GLU 114 HB1 GLU 114 -12.477 13.266 10.671 785 HB3 GLU 114 HB2 GLU 114 -13.188 12.619 12.150 786 HG2 GLU 114 HG1 GLU 114 -15.326 13.751 11.600 787 HG3 GLU 114 HG2 GLU 114 -14.611 14.349 10.103 788 H ILE 115 HN ILE 115 -10.527 14.956 11.190 789 HA ILE 115 HA ILE 115 -9.044 13.732 13.351 790 HB ILE 115 HB ILE 115 -8.070 15.507 11.091 791 HG12 ILE 115 HG12 ILE 115 -8.117 12.485 11.289 792 HG13 ILE 115 HG11 ILE 115 -9.319 13.428 10.408 793 HG21 ILE 115 HG21 ILE 115 -6.112 15.390 12.215 794 HG22 ILE 115 HG22 ILE 115 -6.092 13.678 11.793 795 HG23 ILE 115 HG23 ILE 115 -6.751 14.196 13.344 796 HD11 ILE 115 HD11 ILE 115 -6.617 14.239 9.702 797 HD12 ILE 115 HD12 ILE 115 -7.927 13.699 8.654 798 HD13 ILE 115 HD13 ILE 115 -6.862 12.517 9.414 799 H ARG 116 HN ARG 116 -9.605 17.095 12.336 800 HA ARG 116 HA ARG 116 -7.912 18.399 14.171 801 HB2 ARG 116 HB2 ARG 116 -8.973 19.743 12.522 802 HB3 ARG 116 HB1 ARG 116 -10.578 19.170 12.971 803 HG2 ARG 116 HG2 ARG 116 -10.578 20.417 14.989 804 HG3 ARG 116 HG1 ARG 116 -8.838 20.691 14.915 805 HD2 ARG 116 HD2 ARG 116 -9.254 21.985 12.764 806 HD3 ARG 116 HD1 ARG 116 -10.975 21.893 13.141 807 HE ARG 116 HE ARG 116 -9.090 23.096 15.116 808 HH11 ARG 116 HH21 ARG 116 -12.248 22.863 14.998 809 HH12 ARG 116 HH22 ARG 116 -12.633 24.530 14.725 810 HH21 ARG 116 HH11 ARG 116 -9.381 25.418 13.903 811 HH22 ARG 116 HH12 ARG 116 -11.008 25.977 14.105 812 H SER 117 HN SER 117 -11.249 17.232 14.632 813 HA SER 117 HA SER 117 -11.414 18.186 17.365 814 HB2 SER 117 HB2 SER 117 -13.038 15.983 16.061 815 HB3 SER 117 HB1 SER 117 -13.483 16.936 17.477 816 HG SER 117 HG SER 117 -14.269 17.532 15.216 817 H LEU 118 HN LEU 118 -10.417 15.166 15.832 818 HA LEU 118 HA LEU 118 -10.327 13.612 18.258 819 HB2 LEU 118 HB2 LEU 118 -8.898 13.302 15.604 820 HB3 LEU 118 HB1 LEU 118 -8.817 12.113 16.904 821 HG LEU 118 HG LEU 118 -11.504 13.072 15.976 822 HD11 LEU 118 HD21 LEU 118 -10.349 12.492 13.896 823 HD12 LEU 118 HD22 LEU 118 -11.519 11.232 14.294 824 HD13 LEU 118 HD23 LEU 118 -9.802 10.970 14.600 825 HD21 LEU 118 HD11 LEU 118 -12.087 10.728 16.608 826 HD22 LEU 118 HD12 LEU 118 -11.366 11.629 17.942 827 HD23 LEU 118 HD13 LEU 118 -10.400 10.457 17.046 828 H ILE 119 HN ILE 119 -7.880 15.521 16.502 829 HA ILE 119 HA ILE 119 -5.646 14.840 18.107 830 HB ILE 119 HB ILE 119 -6.250 17.518 16.815 831 HG12 ILE 119 HG12 ILE 119 -4.604 15.254 15.677 832 HG13 ILE 119 HG11 ILE 119 -6.334 15.394 15.360 833 HG21 ILE 119 HG21 ILE 119 -4.401 17.669 18.391 834 HG22 ILE 119 HG22 ILE 119 -3.749 17.675 16.753 835 HG23 ILE 119 HG23 ILE 119 -3.671 16.207 17.727 836 HD11 ILE 119 HD11 ILE 119 -5.303 16.529 13.549 837 HD12 ILE 119 HD12 ILE 119 -4.131 17.318 14.605 838 HD13 ILE 119 HD13 ILE 119 -5.823 17.815 14.639 839 H GLY 120 HN GLY 120 -8.159 17.307 18.596 840 HA2 GLY 120 HA2 GLY 120 -6.943 18.462 20.941 841 HA3 GLY 120 HA1 GLY 120 -8.635 18.637 20.475 842 H MET 121 HN MET 121 -8.984 15.665 20.393 843 HA MET 121 HA MET 121 -9.816 15.313 23.132 844 HB2 MET 121 HB2 MET 121 -10.917 14.211 21.177 845 HB3 MET 121 HB1 MET 121 -9.484 13.202 20.981 846 HG2 MET 121 HG1 MET 121 -9.795 12.381 23.321 847 HG3 MET 121 HG2 MET 121 -11.290 13.313 23.416 848 HE1 MET 121 HE1 MET 121 -12.157 11.341 24.254 849 HE2 MET 121 HE2 MET 121 -11.421 9.830 23.726 850 HE3 MET 121 HE3 MET 121 -13.083 10.196 23.273 851 H PHE 122 HN PHE 122 -7.016 14.212 21.261 852 HA PHE 122 HA PHE 122 -5.991 12.397 23.224 853 HB2 PHE 122 HB2 PHE 122 -4.625 13.999 21.047 854 HB3 PHE 122 HB1 PHE 122 -3.787 12.807 22.041 855 HD1 PHE 122 HD2 PHE 122 -4.625 10.410 22.054 856 HD2 PHE 122 HD1 PHE 122 -5.998 13.336 19.225 857 HE1 PHE 122 HE2 PHE 122 -5.472 8.597 20.591 858 HE2 PHE 122 HE1 PHE 122 -6.846 11.522 17.761 859 HZ PHE 122 HZ PHE 122 -6.584 9.153 18.444 860 H ALA 123 HN ALA 123 -5.643 15.891 22.787 861 HA ALA 123 HA ALA 123 -3.557 16.282 24.705 862 HB1 ALA 123 HB1 ALA 123 -5.200 17.915 23.063 863 HB2 ALA 123 HB2 ALA 123 -3.787 18.407 23.996 864 HB3 ALA 123 HB3 ALA 123 -5.394 18.499 24.717 865 H GLN 124 HN GLN 124 -7.044 15.924 25.023 866 HA GLN 124 HA GLN 124 -7.180 16.776 27.782 867 HB2 GLN 124 HB2 GLN 124 -9.016 15.032 26.113 868 HB3 GLN 124 HB1 GLN 124 -9.394 15.580 27.746 869 HG2 GLN 124 HG2 GLN 124 -9.203 17.923 27.017 870 HG3 GLN 124 HG1 GLN 124 -8.794 17.389 25.387 871 HE21 GLN 124 HE21 GLN 124 -11.098 19.002 25.824 872 HE22 GLN 124 HE22 GLN 124 -12.479 18.066 25.510 873 H ALA 125 HN ALA 125 -6.646 13.669 26.174 874 HA ALA 125 HA ALA 125 -6.861 12.049 28.539 875 HB1 ALA 125 HB1 ALA 125 -6.179 10.295 27.193 876 HB2 ALA 125 HB2 ALA 125 -4.992 11.278 26.336 877 HB3 ALA 125 HB3 ALA 125 -6.705 11.429 25.950 878 H SER 126 HN SER 126 -4.227 13.897 27.097 879 HA SER 126 HA SER 126 -2.063 12.789 28.570 880 HB2 SER 126 HB2 SER 126 -1.868 14.423 26.664 881 HB3 SER 126 HB1 SER 126 -2.390 15.694 27.769 882 HG SER 126 HG SER 126 0.005 15.100 27.432 883 H ALA 127 HN ALA 127 -4.525 15.144 29.466 884 HA ALA 127 HA ALA 127 -3.258 16.058 31.880 885 HB1 ALA 127 HB1 ALA 127 -5.265 17.163 32.327 886 HB2 ALA 127 HB2 ALA 127 -6.244 15.880 31.614 887 HB3 ALA 127 HB3 ALA 127 -5.347 16.987 30.573 888 H ASN 128 HN ASN 128 -4.858 13.120 31.045 889 HA ASN 128 HA ASN 128 -5.712 12.387 33.714 890 HB2 ASN 128 HB1 ASN 128 -6.556 11.385 31.525 891 HB3 ASN 128 HB2 ASN 128 -5.038 10.489 31.455 892 HD21 ASN 128 HD21 ASN 128 -5.147 8.459 32.421 893 HD22 ASN 128 HD22 ASN 128 -6.194 8.032 33.687 894 H ASP 129 HN ASP 129 -2.703 12.196 31.950 895 HA ASP 129 HA ASP 129 -1.439 10.173 33.546 896 HB2 ASP 129 HB2 ASP 129 -0.282 12.478 31.955 897 HB3 ASP 129 HB1 ASP 129 0.690 11.204 32.689 898 H VAL 130 HN VAL 130 -1.382 13.743 33.759 899 HA VAL 130 HA VAL 130 0.298 13.924 36.039 900 HB VAL 130 HB VAL 130 -0.884 16.129 36.427 901 HG11 VAL 130 HG21 VAL 130 1.053 15.761 34.825 902 HG12 VAL 130 HG22 VAL 130 0.029 17.146 34.448 903 HG13 VAL 130 HG23 VAL 130 -0.139 15.650 33.530 904 HG21 VAL 130 HG11 VAL 130 -3.043 15.023 35.341 905 HG22 VAL 130 HG12 VAL 130 -2.340 15.655 33.853 906 HG23 VAL 130 HG13 VAL 130 -2.734 16.751 35.176 907 H TYR 131 HN TYR 131 -3.133 13.198 35.747 908 HA TYR 131 HA TYR 131 -3.278 11.955 38.305 909 HB2 TYR 131 HB2 TYR 131 -4.460 13.566 39.632 910 HB3 TYR 131 HB1 TYR 131 -3.037 14.394 39.001 911 HD1 TYR 131 HD1 TYR 131 -3.243 15.994 37.114 912 HD2 TYR 131 HD2 TYR 131 -6.685 14.156 38.909 913 HE1 TYR 131 HE1 TYR 131 -4.706 17.684 36.038 914 HE2 TYR 131 HE2 TYR 131 -8.148 15.846 37.833 915 HH TYR 131 HH TYR 131 -6.774 18.492 35.887 916 H ALA 132 HN ALA 132 -5.855 12.007 38.968 917 HA ALA 132 HA ALA 132 -7.177 10.948 36.570 918 HB1 ALA 132 HB1 ALA 132 -7.999 11.136 39.479 919 HB2 ALA 132 HB2 ALA 132 -7.509 9.692 38.592 920 HB3 ALA 132 HB3 ALA 132 -9.047 10.472 38.225 921 H SER 133 HN SER 133 -8.354 12.242 35.253 922 HA SER 133 HA SER 133 -8.878 14.967 35.651 923 HB2 SER 133 HB2 SER 133 -10.703 13.094 34.121 924 HB3 SER 133 HB1 SER 133 -10.444 14.814 33.828 925 HG SER 133 HG SER 133 -8.582 14.402 32.897 926 H ALA 134 HN ALA 134 -10.840 12.165 36.589 927 HA ALA 134 HA ALA 134 -13.191 13.509 37.390 928 HB1 ALA 134 HB1 ALA 134 -12.821 11.503 39.299 929 HB2 ALA 134 HB2 ALA 134 -11.946 10.917 37.885 930 HB3 ALA 134 HB3 ALA 134 -13.656 11.329 37.755 931 H GLY 135 HN GLY 135 -10.081 13.176 39.025 932 HA2 GLY 135 HA2 GLY 135 -9.255 14.727 40.657 933 HA3 GLY 135 HA1 GLY 135 -10.901 15.319 40.891 934 H SER 136 HN SER 136 -10.912 11.960 40.842 935 HA SER 136 HA SER 136 -11.711 11.714 43.565 936 HB2 SER 136 HB2 SER 136 -10.542 9.556 41.781 937 HB3 SER 136 HB1 SER 136 -11.538 9.302 43.214 938 HG SER 136 HG SER 136 -13.189 10.516 42.115 939 H GLY 137 HN GLY 137 -8.555 11.428 42.006 940 HA2 GLY 137 HA2 GLY 137 -6.917 12.177 44.046 941 HA3 GLY 137 HA1 GLY 137 -7.272 10.506 44.484 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -20.864 6.751 -5.700 2 H2 GLY 1 HT2 GLY 1 -19.324 7.466 -5.692 3 H3 GLY 1 HT3 GLY 1 -19.567 5.976 -6.471 4 HA2 GLY 1 HA2 GLY 1 -21.385 7.770 -7.578 5 HA3 GLY 1 HA1 GLY 1 -19.812 8.567 -7.529 6 H MET 2 HN MET 2 -20.358 8.194 -10.001 7 HA MET 2 HA MET 2 -20.135 5.624 -11.178 8 HB2 MET 2 HB2 MET 2 -19.235 8.323 -12.230 9 HB3 MET 2 HB1 MET 2 -19.348 6.860 -13.209 10 HG2 MET 2 HG2 MET 2 -21.772 6.693 -12.559 11 HG3 MET 2 HG1 MET 2 -21.616 8.259 -11.762 12 HE1 MET 2 HE1 MET 2 -21.820 6.224 -14.927 13 HE2 MET 2 HE2 MET 2 -20.140 6.731 -15.090 14 HE3 MET 2 HE3 MET 2 -21.344 7.310 -16.239 15 H GLY 3 HN GLY 3 -17.635 7.902 -10.116 16 HA2 GLY 3 HA1 GLY 3 -15.386 6.558 -11.227 17 HA3 GLY 3 HA2 GLY 3 -15.332 7.585 -9.795 18 H GLN 4 HN GLN 4 -14.059 4.903 -10.392 19 HA GLN 4 HA GLN 4 -15.321 2.850 -8.878 20 HB2 GLN 4 HB2 GLN 4 -12.378 3.376 -9.387 21 HB3 GLN 4 HB1 GLN 4 -13.016 1.885 -8.693 22 HG2 GLN 4 HG1 GLN 4 -14.356 1.493 -10.710 23 HG3 GLN 4 HG2 GLN 4 -13.789 3.013 -11.401 24 HE21 GLN 4 HE21 GLN 4 -13.303 0.508 -12.715 25 HE22 GLN 4 HE22 GLN 4 -11.635 0.199 -12.677 26 H ALA 5 HN ALA 5 -13.211 5.513 -7.901 27 HA ALA 5 HA ALA 5 -14.152 5.203 -5.148 28 HB1 ALA 5 HB1 ALA 5 -11.816 3.852 -5.863 29 HB2 ALA 5 HB2 ALA 5 -12.323 4.255 -4.222 30 HB3 ALA 5 HB3 ALA 5 -11.240 5.335 -5.100 31 H ASN 6 HN ASN 6 -14.818 7.331 -5.052 32 HA ASN 6 HA ASN 6 -13.056 9.468 -6.069 33 HB2 ASN 6 HB1 ASN 6 -15.727 9.681 -4.647 34 HB3 ASN 6 HB2 ASN 6 -14.905 10.966 -5.533 35 HD21 ASN 6 HD21 ASN 6 -17.559 9.398 -6.016 36 HD22 ASN 6 HD22 ASN 6 -17.449 8.978 -7.657 37 H THR 7 HN THR 7 -12.509 7.718 -3.589 38 HA THR 7 HA THR 7 -11.890 10.016 -1.788 39 HB THR 7 HB THR 7 -12.335 7.539 -0.329 40 HG1 THR 7 HG1 THR 7 -14.759 8.035 -0.710 41 HG21 THR 7 HG21 THR 7 -14.129 9.311 0.632 42 HG22 THR 7 HG22 THR 7 -13.043 10.417 -0.211 43 HG23 THR 7 HG23 THR 7 -12.416 9.356 1.050 44 HA PRO 8 HA PRO 8 -7.774 8.373 -1.770 45 HB2 PRO 8 HB2 PRO 8 -6.946 9.119 0.695 46 HB3 PRO 8 HB1 PRO 8 -7.134 10.256 -0.642 47 HG2 PRO 8 HG1 PRO 8 -9.006 9.668 1.624 48 HG3 PRO 8 HG2 PRO 8 -8.528 11.234 0.958 49 HD2 PRO 8 HD2 PRO 8 -10.876 10.086 0.312 50 HD3 PRO 8 HD1 PRO 8 -9.965 11.043 -0.856 51 H TRP 9 HN TRP 9 -9.896 7.574 0.959 52 HA TRP 9 HA TRP 9 -8.220 5.196 1.558 53 HB2 TRP 9 HB2 TRP 9 -9.728 4.908 3.505 54 HB3 TRP 9 HB1 TRP 9 -8.988 6.510 3.484 55 HD1 TRP 9 HD1 TRP 9 -12.305 4.730 2.752 56 HE1 TRP 9 HE1 TRP 9 -14.206 6.470 2.833 57 HE3 TRP 9 HE3 TRP 9 -9.566 9.007 3.285 58 HZ2 TRP 9 HZ2 TRP 9 -14.523 9.302 3.091 59 HZ3 TRP 9 HZ3 TRP 9 -10.691 11.208 3.445 60 HH2 TRP 9 HH2 TRP 9 -13.163 11.362 3.349 61 H SER 10 HN SER 10 -10.985 6.082 -0.233 62 HA SER 10 HA SER 10 -12.464 3.610 -0.009 63 HB2 SER 10 HB1 SER 10 -12.431 5.834 -2.058 64 HB3 SER 10 HB2 SER 10 -13.470 4.419 -2.227 65 HG SER 10 HG SER 10 -14.467 6.208 -1.136 66 H SER 11 HN SER 11 -9.468 4.291 -1.378 67 HA SER 11 HA SER 11 -9.600 1.768 -2.953 68 HB2 SER 11 HB1 SER 11 -9.803 3.994 -4.344 69 HB3 SER 11 HB2 SER 11 -8.069 4.110 -4.046 70 HG SER 11 HG SER 11 -9.515 2.129 -5.424 71 H LYS 12 HN LYS 12 -7.546 0.694 -3.110 72 HA LYS 12 HA LYS 12 -5.804 1.133 -0.843 73 HB2 LYS 12 HB1 LYS 12 -6.330 -1.040 -2.323 74 HB3 LYS 12 HB2 LYS 12 -4.874 -0.501 -3.160 75 HG2 LYS 12 HG2 LYS 12 -3.703 -0.396 -0.948 76 HG3 LYS 12 HG1 LYS 12 -5.142 -1.081 -0.193 77 HD2 LYS 12 HD2 LYS 12 -3.442 -2.823 -0.710 78 HD3 LYS 12 HD1 LYS 12 -4.947 -3.089 -1.591 79 HE2 LYS 12 HE1 LYS 12 -3.197 -1.348 -3.102 80 HE3 LYS 12 HE2 LYS 12 -2.357 -2.841 -2.685 81 HZ1 LYS 12 HZ1 LYS 12 -4.806 -2.469 -4.269 82 HZ2 LYS 12 HZ2 LYS 12 -4.566 -3.929 -3.434 83 HZ3 LYS 12 HZ3 LYS 12 -3.444 -3.423 -4.604 84 H ALA 13 HN ALA 13 -5.542 1.784 -4.326 85 HA ALA 13 HA ALA 13 -2.821 2.792 -4.121 86 HB1 ALA 13 HB1 ALA 13 -3.869 3.886 -6.431 87 HB2 ALA 13 HB2 ALA 13 -4.838 2.427 -6.224 88 HB3 ALA 13 HB3 ALA 13 -3.081 2.312 -6.322 89 H ASN 14 HN ASN 14 -6.055 4.200 -4.040 90 HA ASN 14 HA ASN 14 -5.157 6.948 -4.176 91 HB2 ASN 14 HB2 ASN 14 -7.729 5.798 -3.049 92 HB3 ASN 14 HB1 ASN 14 -7.444 7.494 -3.437 93 HD21 ASN 14 HD21 ASN 14 -9.541 6.229 -4.769 94 HD22 ASN 14 HD22 ASN 14 -9.123 5.992 -6.397 95 H ALA 15 HN ALA 15 -5.572 4.608 -1.597 96 HA ALA 15 HA ALA 15 -5.494 6.502 0.577 97 HB1 ALA 15 HB1 ALA 15 -4.462 4.165 1.614 98 HB2 ALA 15 HB2 ALA 15 -5.420 3.584 0.252 99 HB3 ALA 15 HB3 ALA 15 -6.179 4.554 1.514 100 H ASP 16 HN ASP 16 -3.005 4.615 -1.109 101 HA ASP 16 HA ASP 16 -0.814 5.282 0.572 102 HB2 ASP 16 HB1 ASP 16 -0.831 3.602 -1.341 103 HB3 ASP 16 HB2 ASP 16 -0.664 4.973 -2.438 104 H ALA 17 HN ALA 17 -1.794 6.867 -2.496 105 HA ALA 17 HA ALA 17 0.024 9.026 -2.346 106 HB1 ALA 17 HB1 ALA 17 -2.796 9.315 -3.393 107 HB2 ALA 17 HB2 ALA 17 -1.573 8.392 -4.267 108 HB3 ALA 17 HB3 ALA 17 -1.332 10.114 -3.966 109 H PHE 18 HN PHE 18 -3.141 8.577 -0.823 110 HA PHE 18 HA PHE 18 -3.361 11.264 0.196 111 HB2 PHE 18 HB2 PHE 18 -5.263 9.622 0.028 112 HB3 PHE 18 HB1 PHE 18 -4.549 8.734 1.374 113 HD1 PHE 18 HD2 PHE 18 -5.919 12.052 0.367 114 HD2 PHE 18 HD1 PHE 18 -4.844 9.459 3.618 115 HE1 PHE 18 HE2 PHE 18 -6.998 13.610 1.965 116 HE2 PHE 18 HE1 PHE 18 -5.923 11.018 5.217 117 HZ PHE 18 HZ PHE 18 -7.001 13.093 4.391 118 H ILE 19 HN ILE 19 -2.243 8.207 1.680 119 HA ILE 19 HA ILE 19 -1.479 9.417 4.174 120 HB ILE 19 HB ILE 19 -0.476 6.885 2.837 121 HG12 ILE 19 HG12 ILE 19 -2.639 7.405 4.899 122 HG13 ILE 19 HG11 ILE 19 -2.881 6.835 3.248 123 HG21 ILE 19 HG21 ILE 19 0.267 8.262 5.311 124 HG22 ILE 19 HG22 ILE 19 1.065 6.918 4.495 125 HG23 ILE 19 HG23 ILE 19 -0.279 6.609 5.595 126 HD11 ILE 19 HD11 ILE 19 -2.971 4.883 4.621 127 HD12 ILE 19 HD12 ILE 19 -1.549 5.379 5.539 128 HD13 ILE 19 HD13 ILE 19 -1.380 4.858 3.863 129 H ASN 20 HN ASN 20 0.345 8.625 1.215 130 HA ASN 20 HA ASN 20 2.866 9.610 2.210 131 HB2 ASN 20 HB2 ASN 20 3.009 8.155 0.360 132 HB3 ASN 20 HB1 ASN 20 1.764 9.016 -0.535 133 HD21 ASN 20 HD21 ASN 20 2.847 9.852 -2.340 134 HD22 ASN 20 HD22 ASN 20 4.269 10.778 -2.263 135 H SER 21 HN SER 21 0.420 11.048 0.026 136 HA SER 21 HA SER 21 1.689 13.574 -0.262 137 HB2 SER 21 HB2 SER 21 -0.289 12.803 -1.594 138 HB3 SER 21 HB1 SER 21 -1.297 13.034 -0.165 139 HG SER 21 HG SER 21 -0.330 15.251 -0.202 140 H PHE 22 HN PHE 22 -0.243 12.199 2.311 141 HA PHE 22 HA PHE 22 -0.693 14.691 3.720 142 HB2 PHE 22 HB1 PHE 22 -2.163 12.851 4.203 143 HB3 PHE 22 HB2 PHE 22 -0.805 11.791 4.584 144 HD1 PHE 22 HD1 PHE 22 0.674 12.374 6.580 145 HD2 PHE 22 HD2 PHE 22 -3.119 14.249 5.852 146 HE1 PHE 22 HE1 PHE 22 0.595 13.129 8.941 147 HE2 PHE 22 HE2 PHE 22 -3.200 15.004 8.215 148 HZ PHE 22 HZ PHE 22 -1.341 14.445 9.758 149 H ILE 23 HN ILE 23 1.585 11.976 4.234 150 HA ILE 23 HA ILE 23 2.986 13.207 6.397 151 HB ILE 23 HB ILE 23 4.042 11.232 4.355 152 HG12 ILE 23 HG12 ILE 23 2.855 10.664 7.082 153 HG13 ILE 23 HG11 ILE 23 1.908 10.593 5.596 154 HG21 ILE 23 HG21 ILE 23 5.948 11.210 5.560 155 HG22 ILE 23 HG22 ILE 23 5.047 10.995 7.061 156 HG23 ILE 23 HG23 ILE 23 5.343 12.617 6.434 157 HD11 ILE 23 HD11 ILE 23 3.202 8.449 6.590 158 HD12 ILE 23 HD12 ILE 23 4.498 9.125 5.601 159 HD13 ILE 23 HD13 ILE 23 2.959 8.687 4.859 160 H SER 24 HN SER 24 3.929 12.966 2.940 161 HA SER 24 HA SER 24 6.195 14.659 3.118 162 HB2 SER 24 HB2 SER 24 4.302 14.408 0.762 163 HB3 SER 24 HB1 SER 24 5.984 14.935 0.705 164 HG SER 24 HG SER 24 5.715 12.714 0.171 165 H ALA 25 HN ALA 25 2.766 15.443 2.747 166 HA ALA 25 HA ALA 25 3.266 18.282 2.307 167 HB1 ALA 25 HB1 ALA 25 0.771 16.701 2.973 168 HB2 ALA 25 HB2 ALA 25 1.227 17.379 1.410 169 HB3 ALA 25 HB3 ALA 25 0.768 18.449 2.735 170 H ALA 26 HN ALA 26 2.064 16.340 5.062 171 HA ALA 26 HA ALA 26 1.802 18.526 6.877 172 HB1 ALA 26 HB1 ALA 26 0.997 16.071 7.116 173 HB2 ALA 26 HB2 ALA 26 1.553 16.903 8.569 174 HB3 ALA 26 HB3 ALA 26 2.613 15.756 7.749 175 H SER 27 HN SER 27 4.579 16.526 5.995 176 HA SER 27 HA SER 27 6.320 17.390 8.094 177 HB2 SER 27 HB2 SER 27 7.094 16.592 5.273 178 HB3 SER 27 HB1 SER 27 8.124 16.543 6.704 179 HG SER 27 HG SER 27 6.232 14.775 5.847 180 H ASN 28 HN ASN 28 5.336 18.881 5.080 181 HA ASN 28 HA ASN 28 7.335 21.052 5.520 182 HB2 ASN 28 HB2 ASN 28 5.675 20.319 3.091 183 HB3 ASN 28 HB1 ASN 28 6.724 21.735 3.181 184 HD21 ASN 28 HD21 ASN 28 7.234 19.673 1.272 185 HD22 ASN 28 HD22 ASN 28 8.687 18.904 1.696 186 H THR 29 HN THR 29 4.323 20.421 6.533 187 HA THR 29 HA THR 29 3.137 23.037 5.823 188 HB THR 29 HB THR 29 1.987 20.897 7.630 189 HG1 THR 29 HG1 THR 29 2.230 19.919 5.705 190 HG21 THR 29 HG21 THR 29 1.148 23.413 7.406 191 HG22 THR 29 HG22 THR 29 0.006 22.076 7.513 192 HG23 THR 29 HG23 THR 29 0.394 22.779 5.944 193 H GLY 30 HN GLY 30 3.160 21.366 8.979 194 HA2 GLY 30 HA1 GLY 30 3.534 23.971 10.297 195 HA3 GLY 30 HA2 GLY 30 3.219 22.436 11.107 196 H SER 31 HN SER 31 4.948 21.322 11.936 197 HA SER 31 HA SER 31 7.681 22.192 11.107 198 HB2 SER 31 HB2 SER 31 7.725 23.230 13.151 199 HB3 SER 31 HB1 SER 31 6.438 22.217 13.806 200 HG SER 31 HG SER 31 9.016 21.976 14.201 201 H PHE 32 HN PHE 32 6.039 19.767 13.181 202 HA PHE 32 HA PHE 32 6.571 17.486 13.484 203 HB2 PHE 32 HB2 PHE 32 6.408 17.990 10.534 204 HB3 PHE 32 HB1 PHE 32 6.945 16.405 11.088 205 HD1 PHE 32 HD2 PHE 32 5.431 15.748 13.396 206 HD2 PHE 32 HD1 PHE 32 4.152 17.967 9.941 207 HE1 PHE 32 HE2 PHE 32 3.083 15.104 13.848 208 HE2 PHE 32 HE1 PHE 32 1.805 17.321 10.398 209 HZ PHE 32 HZ PHE 32 1.269 15.888 12.351 210 H SER 33 HN SER 33 8.607 17.759 14.573 211 HA SER 33 HA SER 33 11.094 18.247 13.288 212 HB2 SER 33 HB1 SER 33 10.619 16.555 15.761 213 HB3 SER 33 HB2 SER 33 12.124 17.354 15.308 214 HG SER 33 HG SER 33 9.964 18.352 16.581 215 H GLN 34 HN GLN 34 12.861 16.621 12.970 216 HA GLN 34 HA GLN 34 12.157 14.587 11.162 217 HB2 GLN 34 HB1 GLN 34 14.576 14.726 12.990 218 HB3 GLN 34 HB2 GLN 34 14.428 13.660 11.592 219 HG2 GLN 34 HG2 GLN 34 14.154 15.618 10.120 220 HG3 GLN 34 HG1 GLN 34 14.278 16.690 11.514 221 HE21 GLN 34 HE21 GLN 34 16.154 16.844 9.350 222 HE22 GLN 34 HE22 GLN 34 17.673 16.357 9.931 223 H ASP 35 HN ASP 35 12.542 14.422 14.685 224 HA ASP 35 HA ASP 35 12.324 11.590 14.947 225 HB2 ASP 35 HB2 ASP 35 11.507 13.830 16.820 226 HB3 ASP 35 HB1 ASP 35 11.506 12.125 17.274 227 H GLN 36 HN GLN 36 9.869 14.137 14.703 228 HA GLN 36 HA GLN 36 7.619 12.414 15.233 229 HB2 GLN 36 HB1 GLN 36 7.728 14.989 13.630 230 HB3 GLN 36 HB2 GLN 36 6.271 14.237 14.280 231 HG2 GLN 36 HG1 GLN 36 7.246 14.454 16.576 232 HG3 GLN 36 HG2 GLN 36 8.606 15.331 15.876 233 HE21 GLN 36 HE21 GLN 36 8.193 17.452 16.643 234 HE22 GLN 36 HE22 GLN 36 6.740 18.289 16.382 235 H MET 37 HN MET 37 9.395 13.305 12.308 236 HA MET 37 HA MET 37 7.560 12.165 10.424 237 HB2 MET 37 HB2 MET 37 10.567 12.542 10.271 238 HB3 MET 37 HB1 MET 37 9.546 12.097 8.903 239 HG2 MET 37 HG1 MET 37 8.221 14.183 9.267 240 HG3 MET 37 HG2 MET 37 9.343 14.637 10.549 241 HE1 MET 37 HE1 MET 37 10.137 17.000 9.293 242 HE2 MET 37 HE2 MET 37 8.657 16.470 8.498 243 HE3 MET 37 HE3 MET 37 10.026 17.004 7.528 244 H GLU 38 HN GLU 38 10.231 10.799 12.310 245 HA GLU 38 HA GLU 38 10.386 8.268 11.031 246 HB2 GLU 38 HB1 GLU 38 11.967 9.126 12.795 247 HB3 GLU 38 HB2 GLU 38 10.721 8.798 13.998 248 HG2 GLU 38 HG2 GLU 38 10.692 6.418 13.293 249 HG3 GLU 38 HG1 GLU 38 11.981 6.759 12.139 250 H ASN 39 HN ASN 39 8.360 9.333 13.776 251 HA ASN 39 HA ASN 39 7.034 6.858 14.208 252 HB2 ASN 39 HB2 ASN 39 6.043 9.699 14.581 253 HB3 ASN 39 HB1 ASN 39 5.203 8.271 15.185 254 HD21 ASN 39 HD21 ASN 39 6.202 10.267 16.980 255 HD22 ASN 39 HD22 ASN 39 7.504 9.624 17.857 256 H MET 40 HN MET 40 6.299 9.536 12.003 257 HA MET 40 HA MET 40 3.838 8.453 11.001 258 HB2 MET 40 HB2 MET 40 5.820 10.243 9.559 259 HB3 MET 40 HB1 MET 40 4.118 10.029 9.153 260 HG2 MET 40 HG2 MET 40 3.457 10.973 11.317 261 HG3 MET 40 HG1 MET 40 5.150 11.126 11.787 262 HE1 MET 40 HE1 MET 40 2.175 12.428 9.977 263 HE2 MET 40 HE2 MET 40 3.004 11.873 8.527 264 HE3 MET 40 HE3 MET 40 2.754 13.598 8.783 265 H SER 41 HN SER 41 7.215 7.918 10.195 266 HA SER 41 HA SER 41 6.729 6.494 7.730 267 HB2 SER 41 HB2 SER 41 9.087 6.306 9.631 268 HB3 SER 41 HB1 SER 41 9.061 5.748 7.959 269 HG SER 41 HG SER 41 8.314 8.381 8.468 270 H LEU 42 HN LEU 42 6.578 5.631 11.101 271 HA LEU 42 HA LEU 42 6.548 2.737 10.448 272 HB2 LEU 42 HB2 LEU 42 6.288 4.101 13.144 273 HB3 LEU 42 HB1 LEU 42 6.566 2.383 12.858 274 HG LEU 42 HG LEU 42 8.441 4.632 12.059 275 HD11 LEU 42 HD11 LEU 42 8.880 2.447 14.104 276 HD12 LEU 42 HD12 LEU 42 8.240 4.032 14.537 277 HD13 LEU 42 HD13 LEU 42 9.853 3.892 13.840 278 HD21 LEU 42 HD21 LEU 42 8.210 1.823 11.274 279 HD22 LEU 42 HD22 LEU 42 9.788 2.200 11.966 280 HD23 LEU 42 HD23 LEU 42 9.197 3.104 10.571 281 H ILE 43 HN ILE 43 4.375 5.351 10.969 282 HA ILE 43 HA ILE 43 2.129 3.383 11.151 283 HB ILE 43 HB ILE 43 2.330 6.111 12.465 284 HG12 ILE 43 HG12 ILE 43 2.070 3.329 13.648 285 HG13 ILE 43 HG11 ILE 43 3.564 4.264 13.593 286 HG21 ILE 43 HG21 ILE 43 0.062 4.095 12.458 287 HG22 ILE 43 HG22 ILE 43 0.057 5.636 11.602 288 HG23 ILE 43 HG23 ILE 43 0.095 5.607 13.365 289 HD11 ILE 43 HD11 ILE 43 1.122 5.525 14.787 290 HD12 ILE 43 HD12 ILE 43 2.821 5.801 15.169 291 HD13 ILE 43 HD13 ILE 43 2.014 4.340 15.740 292 H GLY 44 HN GLY 44 0.091 4.212 10.169 293 HA2 GLY 44 HA1 GLY 44 -1.110 5.389 8.512 294 HA3 GLY 44 HA2 GLY 44 0.211 6.556 8.440 295 H ASN 45 HN ASN 45 2.163 5.891 7.218 296 HA ASN 45 HA ASN 45 1.505 4.740 4.679 297 HB2 ASN 45 HB2 ASN 45 3.412 6.333 5.127 298 HB3 ASN 45 HB1 ASN 45 4.271 4.998 5.894 299 HD21 ASN 45 HD21 ASN 45 5.694 5.814 3.826 300 HD22 ASN 45 HD22 ASN 45 5.448 4.900 2.418 301 H THR 46 HN THR 46 3.014 3.412 7.600 302 HA THR 46 HA THR 46 3.776 0.889 6.509 303 HB THR 46 HB THR 46 2.851 1.513 9.331 304 HG1 THR 46 HG1 THR 46 5.523 1.281 8.574 305 HG21 THR 46 HG21 THR 46 4.603 -0.431 9.686 306 HG22 THR 46 HG22 THR 46 4.181 -0.831 8.021 307 HG23 THR 46 HG23 THR 46 2.933 -0.808 9.267 308 H LEU 47 HN LEU 47 0.710 2.099 7.773 309 HA LEU 47 HA LEU 47 -0.713 -0.338 7.967 310 HB2 LEU 47 HB2 LEU 47 -1.573 1.901 8.692 311 HB3 LEU 47 HB1 LEU 47 -1.803 2.322 6.994 312 HG LEU 47 HG LEU 47 -3.402 0.528 6.701 313 HD11 LEU 47 HD21 LEU 47 -3.977 -0.635 9.071 314 HD12 LEU 47 HD22 LEU 47 -2.251 -0.354 9.298 315 HD13 LEU 47 HD23 LEU 47 -2.816 -1.316 7.933 316 HD21 LEU 47 HD11 LEU 47 -4.030 2.731 7.939 317 HD22 LEU 47 HD12 LEU 47 -4.133 1.712 9.375 318 HD23 LEU 47 HD13 LEU 47 -5.175 1.391 7.989 319 H MET 48 HN MET 48 0.037 1.673 5.151 320 HA MET 48 HA MET 48 -1.652 0.442 3.249 321 HB2 MET 48 HB2 MET 48 1.157 1.529 2.888 322 HB3 MET 48 HB1 MET 48 0.049 1.151 1.569 323 HG2 MET 48 HG2 MET 48 -0.432 3.176 3.777 324 HG3 MET 48 HG1 MET 48 -0.055 3.547 2.095 325 HE1 MET 48 HE1 MET 48 -2.422 1.123 0.559 326 HE2 MET 48 HE2 MET 48 -1.040 2.200 0.362 327 HE3 MET 48 HE3 MET 48 -2.659 2.774 -0.031 328 H ALA 49 HN ALA 49 1.410 -0.635 4.629 329 HA ALA 49 HA ALA 49 1.964 -2.739 2.782 330 HB1 ALA 49 HB1 ALA 49 2.578 -2.519 5.746 331 HB2 ALA 49 HB2 ALA 49 3.633 -2.040 4.416 332 HB3 ALA 49 HB3 ALA 49 3.260 -3.744 4.676 333 H ALA 50 HN ALA 50 -0.134 -2.567 5.625 334 HA ALA 50 HA ALA 50 -0.742 -5.358 5.795 335 HB1 ALA 50 HB1 ALA 50 -2.327 -2.897 6.576 336 HB2 ALA 50 HB2 ALA 50 -1.350 -3.918 7.631 337 HB3 ALA 50 HB3 ALA 50 -2.849 -4.541 6.944 338 H MET 51 HN MET 51 -2.083 -2.726 3.852 339 HA MET 51 HA MET 51 -4.394 -4.002 2.854 340 HB2 MET 51 HB2 MET 51 -2.536 -2.245 1.226 341 HB3 MET 51 HB1 MET 51 -4.270 -2.471 0.991 342 HG2 MET 51 HG2 MET 51 -2.899 -1.123 3.335 343 HG3 MET 51 HG1 MET 51 -3.963 -0.372 2.146 344 HE1 MET 51 HE1 MET 51 -7.166 -1.034 2.529 345 HE2 MET 51 HE2 MET 51 -6.869 -2.764 2.383 346 HE3 MET 51 HE3 MET 51 -5.909 -1.631 1.435 347 H ASP 52 HN ASP 52 -1.002 -4.392 1.963 348 HA ASP 52 HA ASP 52 -1.351 -5.872 -0.438 349 HB2 ASP 52 HB2 ASP 52 0.801 -6.064 1.692 350 HB3 ASP 52 HB1 ASP 52 0.897 -6.853 0.117 351 H ASN 53 HN ASN 53 -1.706 -6.783 2.928 352 HA ASN 53 HA ASN 53 -1.589 -9.611 2.656 353 HB2 ASN 53 HB2 ASN 53 -3.267 -7.907 4.522 354 HB3 ASN 53 HB1 ASN 53 -3.031 -9.646 4.698 355 HD21 ASN 53 HD21 ASN 53 -2.153 -7.880 6.748 356 HD22 ASN 53 HD22 ASN 53 -0.456 -7.874 6.779 357 H MET 54 HN MET 54 -4.117 -7.293 1.901 358 HA MET 54 HA MET 54 -6.323 -9.060 1.669 359 HB2 MET 54 HB2 MET 54 -5.590 -6.508 0.229 360 HB3 MET 54 HB1 MET 54 -7.082 -7.374 -0.132 361 HG2 MET 54 HG1 MET 54 -6.251 -6.338 2.596 362 HG3 MET 54 HG2 MET 54 -7.484 -5.627 1.557 363 HE1 MET 54 HE1 MET 54 -10.172 -8.366 1.296 364 HE2 MET 54 HE2 MET 54 -8.780 -8.141 0.239 365 HE3 MET 54 HE3 MET 54 -9.652 -6.736 0.847 366 H GLY 55 HN GLY 55 -3.633 -8.418 -0.519 367 HA2 GLY 55 HA2 GLY 55 -2.879 -10.145 -2.071 368 HA3 GLY 55 HA1 GLY 55 -4.539 -10.736 -2.159 369 H GLY 56 HN GLY 56 -4.279 -7.331 -2.205 370 HA2 GLY 56 HA2 GLY 56 -4.032 -5.852 -4.113 371 HA3 GLY 56 HA1 GLY 56 -4.234 -7.243 -5.177 372 H ARG 57 HN ARG 57 -6.412 -7.163 -2.537 373 HA ARG 57 HA ARG 57 -8.505 -5.862 -4.221 374 HB2 ARG 57 HB2 ARG 57 -10.078 -7.625 -3.731 375 HB3 ARG 57 HB1 ARG 57 -8.615 -8.388 -4.353 376 HG2 ARG 57 HG2 ARG 57 -7.892 -8.583 -1.879 377 HG3 ARG 57 HG1 ARG 57 -9.577 -8.234 -1.496 378 HD2 ARG 57 HD2 ARG 57 -10.249 -10.144 -2.979 379 HD3 ARG 57 HD1 ARG 57 -8.541 -10.536 -3.174 380 HE ARG 57 HE ARG 57 -9.035 -10.406 -0.396 381 HH11 ARG 57 HH11 ARG 57 -10.698 -11.978 -2.926 382 HH12 ARG 57 HH12 ARG 57 -10.705 -13.531 -2.160 383 HH21 ARG 57 HH21 ARG 57 -8.740 -12.515 0.511 384 HH22 ARG 57 HH22 ARG 57 -9.595 -13.835 -0.214 385 H ILE 58 HN ILE 58 -9.126 -4.116 -3.031 386 HA ILE 58 HA ILE 58 -9.360 -4.484 -0.073 387 HB ILE 58 HB ILE 58 -9.056 -1.864 -1.566 388 HG12 ILE 58 HG12 ILE 58 -7.047 -3.228 -1.903 389 HG13 ILE 58 HG11 ILE 58 -6.704 -1.938 -0.750 390 HG21 ILE 58 HG21 ILE 58 -8.589 -0.963 0.636 391 HG22 ILE 58 HG22 ILE 58 -8.617 -2.575 1.349 392 HG23 ILE 58 HG23 ILE 58 -10.104 -1.861 0.727 393 HD11 ILE 58 HD11 ILE 58 -5.891 -3.640 0.531 394 HD12 ILE 58 HD12 ILE 58 -6.831 -4.863 -0.324 395 HD13 ILE 58 HD13 ILE 58 -7.592 -3.883 0.931 396 H THR 59 HN THR 59 -11.293 -3.864 0.918 397 HA THR 59 HA THR 59 -13.555 -3.386 -0.964 398 HB THR 59 HB THR 59 -14.690 -3.882 1.494 399 HG1 THR 59 HG1 THR 59 -13.486 -5.645 2.309 400 HG21 THR 59 HG21 THR 59 -13.828 -5.903 -0.595 401 HG22 THR 59 HG22 THR 59 -15.292 -4.923 -0.658 402 HG23 THR 59 HG23 THR 59 -15.102 -6.144 0.600 403 HA PRO 60 HA PRO 60 -14.282 0.713 0.543 404 HB2 PRO 60 HB2 PRO 60 -16.980 0.825 0.626 405 HB3 PRO 60 HB1 PRO 60 -16.068 0.823 -0.886 406 HG2 PRO 60 HG2 PRO 60 -17.478 -1.435 0.484 407 HG3 PRO 60 HG1 PRO 60 -17.444 -1.024 -1.233 408 HD2 PRO 60 HD2 PRO 60 -15.910 -2.993 -0.183 409 HD3 PRO 60 HD1 PRO 60 -15.389 -2.025 -1.562 410 H SER 61 HN SER 61 -16.301 -1.742 2.182 411 HA SER 61 HA SER 61 -16.758 -0.145 4.532 412 HB2 SER 61 HB2 SER 61 -18.111 -2.159 3.848 413 HB3 SER 61 HB1 SER 61 -16.751 -3.170 4.335 414 HG SER 61 HG SER 61 -17.719 -1.251 6.122 415 H LYS 62 HN LYS 62 -14.312 -2.587 3.687 416 HA LYS 62 HA LYS 62 -13.061 -2.699 6.256 417 HB2 LYS 62 HB2 LYS 62 -12.638 -4.326 4.409 418 HB3 LYS 62 HB1 LYS 62 -11.763 -3.066 3.538 419 HG2 LYS 62 HG2 LYS 62 -10.229 -2.847 5.509 420 HG3 LYS 62 HG1 LYS 62 -11.053 -4.216 6.254 421 HD2 LYS 62 HD2 LYS 62 -10.502 -5.534 4.143 422 HD3 LYS 62 HD1 LYS 62 -9.448 -4.195 3.687 423 HE2 LYS 62 HE2 LYS 62 -9.228 -5.578 6.368 424 HE3 LYS 62 HE1 LYS 62 -8.337 -6.131 4.950 425 HZ1 LYS 62 HZ1 LYS 62 -8.038 -3.655 6.486 426 HZ2 LYS 62 HZ2 LYS 62 -7.701 -3.612 4.822 427 HZ3 LYS 62 HZ3 LYS 62 -6.848 -4.674 5.838 428 H LEU 63 HN LEU 63 -12.188 -0.795 3.346 429 HA LEU 63 HA LEU 63 -10.051 0.651 4.519 430 HB2 LEU 63 HB2 LEU 63 -11.900 1.092 2.224 431 HB3 LEU 63 HB1 LEU 63 -11.005 2.493 2.814 432 HG LEU 63 HG LEU 63 -9.539 -0.087 2.381 433 HD11 LEU 63 HD11 LEU 63 -10.767 1.646 0.302 434 HD12 LEU 63 HD12 LEU 63 -10.358 -0.066 0.238 435 HD13 LEU 63 HD13 LEU 63 -9.097 1.150 0.029 436 HD21 LEU 63 HD21 LEU 63 -8.021 2.024 1.476 437 HD22 LEU 63 HD22 LEU 63 -7.960 1.375 3.115 438 HD23 LEU 63 HD23 LEU 63 -8.969 2.778 2.758 439 H GLN 64 HN GLN 64 -13.527 1.076 4.768 440 HA GLN 64 HA GLN 64 -13.654 3.707 5.770 441 HB2 GLN 64 HB2 GLN 64 -15.627 2.222 5.271 442 HB3 GLN 64 HB1 GLN 64 -15.291 1.357 6.770 443 HG2 GLN 64 HG2 GLN 64 -15.545 3.466 8.037 444 HG3 GLN 64 HG1 GLN 64 -15.900 4.321 6.536 445 HE21 GLN 64 HE21 GLN 64 -17.910 4.470 8.375 446 HE22 GLN 64 HE22 GLN 64 -19.177 3.395 8.031 447 H ALA 65 HN ALA 65 -13.060 0.650 7.505 448 HA ALA 65 HA ALA 65 -12.686 1.949 10.072 449 HB1 ALA 65 HB1 ALA 65 -12.786 -0.730 9.069 450 HB2 ALA 65 HB2 ALA 65 -12.822 -0.197 10.750 451 HB3 ALA 65 HB3 ALA 65 -11.279 -0.539 9.965 452 H LEU 66 HN LEU 66 -10.642 1.157 7.338 453 HA LEU 66 HA LEU 66 -8.125 1.559 8.731 454 HB2 LEU 66 HB2 LEU 66 -8.898 1.481 5.806 455 HB3 LEU 66 HB1 LEU 66 -7.241 1.764 6.339 456 HG LEU 66 HG LEU 66 -8.484 -0.508 7.699 457 HD11 LEU 66 HD21 LEU 66 -8.444 -0.364 4.700 458 HD12 LEU 66 HD22 LEU 66 -9.651 -1.087 5.764 459 HD13 LEU 66 HD23 LEU 66 -8.110 -1.903 5.496 460 HD21 LEU 66 HD11 LEU 66 -6.131 -0.220 7.863 461 HD22 LEU 66 HD12 LEU 66 -5.963 0.044 6.127 462 HD23 LEU 66 HD13 LEU 66 -6.339 -1.566 6.742 463 H ASP 67 HN ASP 67 -9.932 3.552 6.353 464 HA ASP 67 HA ASP 67 -8.309 5.822 6.373 465 HB2 ASP 67 HB2 ASP 67 -10.147 7.023 5.531 466 HB3 ASP 67 HB1 ASP 67 -10.542 5.358 5.106 467 H MET 68 HN MET 68 -10.735 4.873 8.787 468 HA MET 68 HA MET 68 -10.564 7.291 10.336 469 HB2 MET 68 HB2 MET 68 -11.390 4.476 11.103 470 HB3 MET 68 HB1 MET 68 -11.571 5.879 12.156 471 HG2 MET 68 HG2 MET 68 -12.942 6.983 10.385 472 HG3 MET 68 HG1 MET 68 -12.831 5.509 9.422 473 HE1 MET 68 HE1 MET 68 -15.023 6.135 13.403 474 HE2 MET 68 HE2 MET 68 -14.442 7.387 12.308 475 HE3 MET 68 HE3 MET 68 -13.286 6.394 13.192 476 H ALA 69 HN ALA 69 -8.964 4.110 10.697 477 HA ALA 69 HA ALA 69 -7.494 4.683 13.037 478 HB1 ALA 69 HB1 ALA 69 -6.263 3.119 10.779 479 HB2 ALA 69 HB2 ALA 69 -7.672 2.484 11.629 480 HB3 ALA 69 HB3 ALA 69 -6.182 2.811 12.514 481 H PHE 70 HN PHE 70 -6.636 5.321 9.632 482 HA PHE 70 HA PHE 70 -4.041 6.345 10.036 483 HB2 PHE 70 HB1 PHE 70 -5.075 5.970 7.803 484 HB3 PHE 70 HB2 PHE 70 -6.114 7.370 8.072 485 HD1 PHE 70 HD1 PHE 70 -2.564 6.286 7.778 486 HD2 PHE 70 HD2 PHE 70 -5.313 9.586 7.728 487 HE1 PHE 70 HE1 PHE 70 -0.756 7.780 6.973 488 HE2 PHE 70 HE2 PHE 70 -3.504 11.079 6.921 489 HZ PHE 70 HZ PHE 70 -1.226 10.175 6.543 490 H ALA 71 HN ALA 71 -7.184 7.976 10.340 491 HA ALA 71 HA ALA 71 -6.205 10.609 10.778 492 HB1 ALA 71 HB1 ALA 71 -8.440 10.552 12.331 493 HB2 ALA 71 HB2 ALA 71 -8.719 9.138 11.314 494 HB3 ALA 71 HB3 ALA 71 -8.478 10.722 10.576 495 H SER 72 HN SER 72 -6.763 7.931 13.050 496 HA SER 72 HA SER 72 -6.100 9.458 15.406 497 HB2 SER 72 HB1 SER 72 -7.383 7.326 15.463 498 HB3 SER 72 HB2 SER 72 -5.928 6.461 14.970 499 HG SER 72 HG SER 72 -4.916 7.305 16.861 500 H SER 73 HN SER 73 -4.204 7.648 13.062 501 HA SER 73 HA SER 73 -1.794 7.521 14.640 502 HB2 SER 73 HB2 SER 73 -2.323 7.324 11.671 503 HB3 SER 73 HB1 SER 73 -0.709 7.156 12.362 504 HG SER 73 HG SER 73 -2.324 5.242 12.071 505 H VAL 74 HN VAL 74 -2.814 9.714 12.019 506 HA VAL 74 HA VAL 74 -0.487 11.367 12.111 507 HB VAL 74 HB VAL 74 -1.771 12.972 10.836 508 HG11 VAL 74 HG21 VAL 74 -3.177 10.960 9.499 509 HG12 VAL 74 HG22 VAL 74 -1.834 10.115 10.269 510 HG13 VAL 74 HG23 VAL 74 -1.517 11.463 9.177 511 HG21 VAL 74 HG11 VAL 74 -4.227 12.731 10.596 512 HG22 VAL 74 HG12 VAL 74 -3.766 13.030 12.273 513 HG23 VAL 74 HG13 VAL 74 -4.198 11.401 11.755 514 H ALA 75 HN ALA 75 -3.559 11.529 13.886 515 HA ALA 75 HA ALA 75 -2.927 14.054 15.166 516 HB1 ALA 75 HB1 ALA 75 -4.936 11.882 15.819 517 HB2 ALA 75 HB2 ALA 75 -5.246 13.405 14.986 518 HB3 ALA 75 HB3 ALA 75 -4.826 13.406 16.700 519 H GLN 76 HN GLN 76 -2.838 10.652 16.269 520 HA GLN 76 HA GLN 76 -1.877 11.182 18.888 521 HB2 GLN 76 HB1 GLN 76 -2.728 8.970 18.051 522 HB3 GLN 76 HB2 GLN 76 -1.204 8.766 17.187 523 HG2 GLN 76 HG2 GLN 76 0.033 8.935 19.310 524 HG3 GLN 76 HG1 GLN 76 -1.481 9.172 20.182 525 HE21 GLN 76 HE21 GLN 76 -0.034 6.995 21.007 526 HE22 GLN 76 HE22 GLN 76 -0.708 5.550 20.426 527 H ILE 77 HN ILE 77 -0.078 10.622 15.857 528 HA ILE 77 HA ILE 77 2.527 10.651 17.017 529 HB ILE 77 HB ILE 77 1.597 11.484 14.257 530 HG12 ILE 77 HG12 ILE 77 2.927 8.941 15.242 531 HG13 ILE 77 HG11 ILE 77 1.200 9.106 14.928 532 HG21 ILE 77 HG21 ILE 77 4.372 11.029 15.388 533 HG22 ILE 77 HG22 ILE 77 3.746 12.511 14.664 534 HG23 ILE 77 HG23 ILE 77 4.021 11.088 13.660 535 HD11 ILE 77 HD11 ILE 77 3.384 8.689 13.044 536 HD12 ILE 77 HD12 ILE 77 2.428 10.110 12.622 537 HD13 ILE 77 HD13 ILE 77 1.645 8.538 12.787 538 H ALA 78 HN ALA 78 0.777 13.299 15.389 539 HA ALA 78 HA ALA 78 2.729 15.277 16.237 540 HB1 ALA 78 HB1 ALA 78 1.273 15.418 14.161 541 HB2 ALA 78 HB2 ALA 78 1.310 16.877 15.150 542 HB3 ALA 78 HB3 ALA 78 -0.077 15.789 15.230 543 H ALA 79 HN ALA 79 -0.630 14.529 17.228 544 HA ALA 79 HA ALA 79 -0.865 16.556 19.194 545 HB1 ALA 79 HB1 ALA 79 -2.730 15.362 20.017 546 HB2 ALA 79 HB2 ALA 79 -2.047 13.804 19.553 547 HB3 ALA 79 HB3 ALA 79 -2.656 14.903 18.316 548 H SER 80 HN SER 80 0.948 13.585 19.220 549 HA SER 80 HA SER 80 1.281 13.589 22.142 550 HB2 SER 80 HB2 SER 80 2.598 11.977 19.932 551 HB3 SER 80 HB1 SER 80 2.941 11.756 21.647 552 HG SER 80 HG SER 80 1.349 10.347 21.278 553 H GLN 81 HN GLN 81 2.723 14.975 19.364 554 HA GLN 81 HA GLN 81 4.858 16.146 21.069 555 HB2 GLN 81 HB2 GLN 81 6.170 14.587 19.937 556 HB3 GLN 81 HB1 GLN 81 5.131 14.595 18.514 557 HG2 GLN 81 HG2 GLN 81 7.255 15.695 18.010 558 HG3 GLN 81 HG1 GLN 81 5.936 16.860 17.953 559 HE21 GLN 81 HE21 GLN 81 6.840 18.787 18.750 560 HE22 GLN 81 HE22 GLN 81 7.766 18.908 20.166 561 H GLY 82 HN GLY 82 4.091 18.243 21.097 562 HA2 GLY 82 HA2 GLY 82 4.367 19.959 18.890 563 HA3 GLY 82 HA1 GLY 82 2.678 19.451 18.897 564 H GLY 83 HN GLY 83 4.989 21.547 20.316 565 HA2 GLY 83 HA1 GLY 83 3.829 22.094 22.844 566 HA3 GLY 83 HA2 GLY 83 4.743 23.267 21.895 567 H ASP 84 HN ASP 84 3.075 23.425 19.628 568 HA ASP 84 HA ASP 84 0.683 24.751 20.826 569 HB2 ASP 84 HB2 ASP 84 2.077 25.190 18.167 570 HB3 ASP 84 HB1 ASP 84 0.615 26.031 18.681 571 H LEU 85 HN LEU 85 -0.448 22.664 20.902 572 HA LEU 85 HA LEU 85 -0.879 20.833 18.878 573 HB2 LEU 85 HB2 LEU 85 -1.933 20.683 21.108 574 HB3 LEU 85 HB1 LEU 85 -3.019 22.004 20.679 575 HG LEU 85 HG LEU 85 -3.526 20.429 18.589 576 HD11 LEU 85 HD11 LEU 85 -2.457 18.442 18.784 577 HD12 LEU 85 HD12 LEU 85 -3.602 18.081 20.076 578 HD13 LEU 85 HD13 LEU 85 -2.020 18.758 20.463 579 HD21 LEU 85 HD21 LEU 85 -4.761 19.559 21.179 580 HD22 LEU 85 HD22 LEU 85 -5.538 19.925 19.639 581 HD23 LEU 85 HD23 LEU 85 -4.957 21.234 20.667 582 H GLY 86 HN GLY 86 -1.974 24.149 18.978 583 HA2 GLY 86 HA2 GLY 86 -4.035 24.006 17.014 584 HA3 GLY 86 HA1 GLY 86 -3.092 25.450 17.382 585 H VAL 87 HN VAL 87 -0.514 24.189 16.705 586 HA VAL 87 HA VAL 87 -0.527 24.767 13.875 587 HB VAL 87 HB VAL 87 1.429 25.019 15.546 588 HG11 VAL 87 HG11 VAL 87 2.920 23.059 15.683 589 HG12 VAL 87 HG12 VAL 87 1.735 22.094 14.803 590 HG13 VAL 87 HG13 VAL 87 1.353 22.707 16.411 591 HG21 VAL 87 HG21 VAL 87 3.044 24.139 13.624 592 HG22 VAL 87 HG22 VAL 87 2.025 25.557 13.376 593 HG23 VAL 87 HG23 VAL 87 1.526 23.990 12.739 594 H THR 88 HN THR 88 -0.263 21.718 15.733 595 HA THR 88 HA THR 88 0.130 19.963 13.573 596 HB THR 88 HB THR 88 -1.616 19.520 16.015 597 HG1 THR 88 HG1 THR 88 0.327 19.734 16.839 598 HG21 THR 88 HG21 THR 88 -2.024 17.922 14.144 599 HG22 THR 88 HG22 THR 88 -1.308 17.144 15.555 600 HG23 THR 88 HG23 THR 88 -0.307 17.520 14.151 601 H THR 89 HN THR 89 -2.799 21.585 14.671 602 HA THR 89 HA THR 89 -4.703 20.189 13.094 603 HB THR 89 HB THR 89 -4.900 23.168 13.378 604 HG1 THR 89 HG1 THR 89 -5.742 22.342 15.608 605 HG21 THR 89 HG21 THR 89 -6.798 20.847 13.818 606 HG22 THR 89 HG22 THR 89 -6.765 21.915 12.416 607 HG23 THR 89 HG23 THR 89 -7.227 22.548 13.996 608 H ASN 90 HN ASN 90 -2.753 23.077 12.322 609 HA ASN 90 HA ASN 90 -3.635 23.188 9.571 610 HB2 ASN 90 HB2 ASN 90 -1.130 24.347 10.831 611 HB3 ASN 90 HB1 ASN 90 -1.831 24.822 9.283 612 HD21 ASN 90 HD21 ASN 90 -1.512 26.211 12.103 613 HD22 ASN 90 HD22 ASN 90 -3.048 26.886 12.355 614 H ALA 91 HN ALA 91 -0.809 21.825 11.232 615 HA ALA 91 HA ALA 91 0.613 21.007 8.893 616 HB1 ALA 91 HB1 ALA 91 0.923 19.179 11.141 617 HB2 ALA 91 HB2 ALA 91 1.013 20.866 11.650 618 HB3 ALA 91 HB3 ALA 91 2.109 20.260 10.408 619 H ILE 92 HN ILE 92 -1.536 19.103 11.037 620 HA ILE 92 HA ILE 92 -1.515 16.808 9.273 621 HB ILE 92 HB ILE 92 -3.343 17.590 11.560 622 HG12 ILE 92 HG12 ILE 92 -1.081 15.579 11.345 623 HG13 ILE 92 HG11 ILE 92 -0.982 17.143 12.155 624 HG21 ILE 92 HG21 ILE 92 -3.113 14.947 10.087 625 HG22 ILE 92 HG22 ILE 92 -4.472 16.063 9.966 626 HG23 ILE 92 HG23 ILE 92 -4.124 15.261 11.496 627 HD11 ILE 92 HD11 ILE 92 -1.447 15.606 13.901 628 HD12 ILE 92 HD12 ILE 92 -2.631 14.733 12.928 629 HD13 ILE 92 HD13 ILE 92 -3.008 16.343 13.541 630 H ALA 93 HN ALA 93 -3.960 19.332 9.957 631 HA ALA 93 HA ALA 93 -5.913 18.398 8.116 632 HB1 ALA 93 HB1 ALA 93 -6.858 20.646 8.234 633 HB2 ALA 93 HB2 ALA 93 -5.344 21.275 8.886 634 HB3 ALA 93 HB3 ALA 93 -6.317 20.153 9.838 635 H ASP 94 HN ASP 94 -3.296 20.790 7.625 636 HA ASP 94 HA ASP 94 -3.895 21.477 4.956 637 HB2 ASP 94 HB1 ASP 94 -1.262 21.260 6.422 638 HB3 ASP 94 HB2 ASP 94 -1.366 21.843 4.762 639 H ALA 95 HN ALA 95 -1.725 18.870 6.106 640 HA ALA 95 HA ALA 95 -1.061 17.845 3.549 641 HB1 ALA 95 HB1 ALA 95 -1.196 15.625 5.255 642 HB2 ALA 95 HB2 ALA 95 -0.827 16.987 6.313 643 HB3 ALA 95 HB3 ALA 95 0.220 16.627 4.941 644 H LEU 96 HN LEU 96 -3.806 17.072 5.682 645 HA LEU 96 HA LEU 96 -4.863 14.998 3.974 646 HB2 LEU 96 HB2 LEU 96 -6.422 16.725 5.911 647 HB3 LEU 96 HB1 LEU 96 -6.822 15.096 5.368 648 HG LEU 96 HG LEU 96 -4.173 15.537 6.688 649 HD11 LEU 96 HD21 LEU 96 -5.406 16.616 8.350 650 HD12 LEU 96 HD22 LEU 96 -5.522 14.933 8.866 651 HD13 LEU 96 HD23 LEU 96 -6.866 15.688 8.009 652 HD21 LEU 96 HD11 LEU 96 -6.241 13.316 6.741 653 HD22 LEU 96 HD12 LEU 96 -4.654 13.249 7.508 654 HD23 LEU 96 HD13 LEU 96 -4.781 13.340 5.752 655 H THR 97 HN THR 97 -5.464 18.484 4.259 656 HA THR 97 HA THR 97 -7.678 18.624 2.476 657 HB THR 97 HB THR 97 -5.537 20.724 2.908 658 HG1 THR 97 HG1 THR 97 -6.348 20.941 4.814 659 HG21 THR 97 HG21 THR 97 -6.822 21.638 1.235 660 HG22 THR 97 HG22 THR 97 -7.835 22.080 2.609 661 HG23 THR 97 HG23 THR 97 -8.231 20.661 1.641 662 H SER 98 HN SER 98 -4.206 19.220 1.789 663 HA SER 98 HA SER 98 -4.562 19.546 -1.025 664 HB2 SER 98 HB2 SER 98 -2.110 18.492 0.413 665 HB3 SER 98 HB1 SER 98 -2.152 19.222 -1.192 666 HG SER 98 HG SER 98 -3.211 21.047 0.072 667 H ALA 99 HN ALA 99 -3.947 16.663 0.950 668 HA ALA 99 HA ALA 99 -3.491 14.849 -1.207 669 HB1 ALA 99 HB1 ALA 99 -4.881 14.101 1.368 670 HB2 ALA 99 HB2 ALA 99 -3.155 14.458 1.316 671 HB3 ALA 99 HB3 ALA 99 -3.805 13.112 0.380 672 H PHE 100 HN PHE 100 -6.497 15.740 0.495 673 HA PHE 100 HA PHE 100 -8.316 14.025 -0.728 674 HB2 PHE 100 HB1 PHE 100 -8.435 16.757 0.395 675 HB3 PHE 100 HB2 PHE 100 -9.735 16.357 -0.728 676 HD1 PHE 100 HD1 PHE 100 -10.769 13.922 -0.381 677 HD2 PHE 100 HD2 PHE 100 -8.713 16.185 2.634 678 HE1 PHE 100 HE1 PHE 100 -11.896 12.594 1.383 679 HE2 PHE 100 HE2 PHE 100 -9.841 14.861 4.398 680 HZ PHE 100 HZ PHE 100 -11.429 13.061 3.771 681 H TYR 101 HN TYR 101 -7.414 17.259 -1.957 682 HA TYR 101 HA TYR 101 -8.739 16.853 -4.492 683 HB2 TYR 101 HB2 TYR 101 -6.519 18.835 -4.066 684 HB3 TYR 101 HB1 TYR 101 -7.984 19.004 -5.034 685 HD1 TYR 101 HD2 TYR 101 -10.117 18.159 -3.270 686 HD2 TYR 101 HD1 TYR 101 -6.594 20.438 -2.352 687 HE1 TYR 101 HE2 TYR 101 -11.283 19.172 -1.329 688 HE2 TYR 101 HE1 TYR 101 -7.759 21.456 -0.413 689 HH TYR 101 HH TYR 101 -10.924 21.535 -0.006 690 H GLN 102 HN GLN 102 -5.468 16.343 -3.312 691 HA GLN 102 HA GLN 102 -4.357 15.893 -5.965 692 HB2 GLN 102 HB1 GLN 102 -3.301 15.226 -3.202 693 HB3 GLN 102 HB2 GLN 102 -2.379 15.052 -4.695 694 HG2 GLN 102 HG2 GLN 102 -3.670 17.674 -3.942 695 HG3 GLN 102 HG1 GLN 102 -2.063 17.241 -3.360 696 HE21 GLN 102 HE21 GLN 102 -3.322 19.135 -5.639 697 HE22 GLN 102 HE22 GLN 102 -2.237 18.884 -6.920 698 H THR 103 HN THR 103 -6.137 13.973 -3.697 699 HA THR 103 HA THR 103 -5.208 11.484 -5.050 700 HB THR 103 HB THR 103 -6.312 10.304 -3.169 701 HG1 THR 103 HG1 THR 103 -6.793 11.952 -1.392 702 HG21 THR 103 HG21 THR 103 -3.958 10.914 -2.959 703 HG22 THR 103 HG22 THR 103 -4.756 11.103 -1.397 704 HG23 THR 103 HG23 THR 103 -4.401 12.522 -2.383 705 H THR 104 HN THR 104 -8.357 12.763 -3.821 706 HA THR 104 HA THR 104 -9.570 11.559 -6.278 707 HB THR 104 HB THR 104 -11.439 10.780 -5.019 708 HG1 THR 104 HG1 THR 104 -11.596 12.604 -3.652 709 HG21 THR 104 HG21 THR 104 -9.495 10.088 -2.934 710 HG22 THR 104 HG22 THR 104 -8.874 9.865 -4.569 711 HG23 THR 104 HG23 THR 104 -10.350 9.040 -4.066 712 H GLY 105 HN GLY 105 -9.972 14.052 -3.748 713 HA2 GLY 105 HA2 GLY 105 -10.478 16.361 -4.488 714 HA3 GLY 105 HA1 GLY 105 -11.422 15.670 -5.804 715 H VAL 106 HN VAL 106 -11.391 14.922 -2.308 716 HA VAL 106 HA VAL 106 -14.343 15.369 -2.312 717 HB VAL 106 HB VAL 106 -12.695 13.893 -0.245 718 HG11 VAL 106 HG21 VAL 106 -14.752 14.353 0.743 719 HG12 VAL 106 HG22 VAL 106 -15.089 12.807 -0.036 720 HG13 VAL 106 HG23 VAL 106 -15.614 14.309 -0.795 721 HG21 VAL 106 HG11 VAL 106 -14.293 12.162 -1.884 722 HG22 VAL 106 HG12 VAL 106 -12.546 12.139 -1.644 723 HG23 VAL 106 HG13 VAL 106 -13.247 13.126 -2.927 724 H VAL 107 HN VAL 107 -15.119 16.160 -0.033 725 HA VAL 107 HA VAL 107 -13.813 18.694 0.476 726 HB VAL 107 HB VAL 107 -15.469 18.840 2.364 727 HG11 VAL 107 HG21 VAL 107 -17.424 18.963 0.908 728 HG12 VAL 107 HG22 VAL 107 -16.640 17.920 -0.278 729 HG13 VAL 107 HG23 VAL 107 -16.011 19.539 0.027 730 HG21 VAL 107 HG11 VAL 107 -16.115 16.836 3.205 731 HG22 VAL 107 HG12 VAL 107 -15.611 15.976 1.750 732 HG23 VAL 107 HG13 VAL 107 -17.198 16.742 1.817 733 H ASN 108 HN ASN 108 -12.010 18.931 1.683 734 HA ASN 108 HA ASN 108 -10.964 16.801 3.341 735 HB2 ASN 108 HB2 ASN 108 -9.184 18.388 3.881 736 HB3 ASN 108 HB1 ASN 108 -9.524 18.448 2.152 737 HD21 ASN 108 HD21 ASN 108 -8.593 20.564 4.291 738 HD22 ASN 108 HD22 ASN 108 -9.614 21.886 3.995 739 H SER 109 HN SER 109 -12.833 19.701 3.928 740 HA SER 109 HA SER 109 -12.457 19.979 6.712 741 HB2 SER 109 HB2 SER 109 -13.706 21.561 5.186 742 HB3 SER 109 HB1 SER 109 -15.066 20.441 5.249 743 HG SER 109 HG SER 109 -15.554 21.240 7.106 744 H ARG 110 HN ARG 110 -14.842 17.966 4.963 745 HA ARG 110 HA ARG 110 -16.244 17.023 7.232 746 HB2 ARG 110 HB2 ARG 110 -16.961 16.604 4.899 747 HB3 ARG 110 HB1 ARG 110 -15.604 15.495 4.690 748 HG2 ARG 110 HG2 ARG 110 -16.478 14.079 6.512 749 HG3 ARG 110 HG1 ARG 110 -17.832 15.188 6.730 750 HD2 ARG 110 HD1 ARG 110 -18.411 14.777 4.287 751 HD3 ARG 110 HD2 ARG 110 -17.218 13.477 4.308 752 HE ARG 110 HE ARG 110 -19.865 13.357 5.472 753 HH11 ARG 110 HH21 ARG 110 -17.601 11.301 4.517 754 HH12 ARG 110 HH22 ARG 110 -17.531 10.322 5.944 755 HH21 ARG 110 HH11 ARG 110 -19.348 12.550 7.883 756 HH22 ARG 110 HH12 ARG 110 -18.520 11.028 7.849 757 H PHE 111 HN PHE 111 -13.476 15.455 5.574 758 HA PHE 111 HA PHE 111 -13.204 13.463 7.668 759 HB2 PHE 111 HB2 PHE 111 -12.488 13.128 5.286 760 HB3 PHE 111 HB1 PHE 111 -11.170 14.265 5.572 761 HD1 PHE 111 HD1 PHE 111 -12.610 11.000 6.614 762 HD2 PHE 111 HD2 PHE 111 -9.207 13.616 6.777 763 HE1 PHE 111 HE1 PHE 111 -11.253 9.174 7.598 764 HE2 PHE 111 HE2 PHE 111 -7.850 11.789 7.761 765 HZ PHE 111 HZ PHE 111 -8.872 9.567 8.172 766 H ILE 112 HN ILE 112 -11.163 16.242 6.697 767 HA ILE 112 HA ILE 112 -9.310 16.064 8.819 768 HB ILE 112 HB ILE 112 -10.342 18.535 7.400 769 HG12 ILE 112 HG11 ILE 112 -8.001 16.678 6.896 770 HG13 ILE 112 HG12 ILE 112 -9.394 16.931 5.846 771 HG21 ILE 112 HG21 ILE 112 -9.134 19.620 8.984 772 HG22 ILE 112 HG22 ILE 112 -7.716 18.978 8.154 773 HG23 ILE 112 HG23 ILE 112 -8.382 18.129 9.549 774 HD11 ILE 112 HD11 ILE 112 -8.713 19.379 5.729 775 HD12 ILE 112 HD12 ILE 112 -7.611 18.253 4.935 776 HD13 ILE 112 HD13 ILE 112 -7.208 18.912 6.520 777 H SER 113 HN SER 113 -12.505 17.619 8.734 778 HA SER 113 HA SER 113 -12.363 19.014 11.190 779 HB2 SER 113 HB2 SER 113 -14.664 17.663 9.769 780 HB3 SER 113 HB1 SER 113 -14.891 18.540 11.281 781 HG SER 113 HG SER 113 -14.787 19.539 8.866 782 H GLU 114 HN GLU 114 -13.407 15.644 10.590 783 HA GLU 114 HA GLU 114 -13.952 14.954 13.283 784 HB2 GLU 114 HB2 GLU 114 -12.792 13.204 11.089 785 HB3 GLU 114 HB1 GLU 114 -13.543 12.619 12.574 786 HG2 GLU 114 HG2 GLU 114 -15.652 13.774 11.931 787 HG3 GLU 114 HG1 GLU 114 -14.894 14.272 10.417 788 H ILE 115 HN ILE 115 -10.901 14.858 11.456 789 HA ILE 115 HA ILE 115 -9.350 13.789 13.652 790 HB ILE 115 HB ILE 115 -8.526 15.317 11.165 791 HG12 ILE 115 HG12 ILE 115 -8.324 12.367 11.827 792 HG13 ILE 115 HG11 ILE 115 -9.630 13.069 10.873 793 HG21 ILE 115 HG21 ILE 115 -6.925 15.362 13.186 794 HG22 ILE 115 HG22 ILE 115 -6.271 14.767 11.659 795 HG23 ILE 115 HG23 ILE 115 -6.741 13.628 12.920 796 HD11 ILE 115 HD11 ILE 115 -6.819 13.704 10.075 797 HD12 ILE 115 HD12 ILE 115 -8.254 13.515 9.068 798 HD13 ILE 115 HD13 ILE 115 -7.435 12.092 9.711 799 H ARG 116 HN ARG 116 -10.176 17.035 12.534 800 HA ARG 116 HA ARG 116 -8.345 18.566 14.028 801 HB2 ARG 116 HB2 ARG 116 -10.200 19.318 12.365 802 HB3 ARG 116 HB1 ARG 116 -11.244 19.359 13.785 803 HG2 ARG 116 HG1 ARG 116 -9.259 20.743 14.834 804 HG3 ARG 116 HG2 ARG 116 -8.847 21.047 13.147 805 HD2 ARG 116 HD2 ARG 116 -10.935 22.093 12.714 806 HD3 ARG 116 HD1 ARG 116 -11.648 21.463 14.197 807 HE ARG 116 HE ARG 116 -9.357 23.259 14.598 808 HH11 ARG 116 HH21 ARG 116 -12.078 22.514 16.114 809 HH12 ARG 116 HH22 ARG 116 -12.769 24.101 16.189 810 HH21 ARG 116 HH11 ARG 116 -10.537 25.467 13.913 811 HH22 ARG 116 HH12 ARG 116 -11.896 25.774 14.942 812 H SER 117 HN SER 117 -11.513 17.265 15.042 813 HA SER 117 HA SER 117 -11.271 18.300 17.743 814 HB2 SER 117 HB2 SER 117 -13.262 17.017 18.214 815 HB3 SER 117 HB1 SER 117 -13.448 17.709 16.603 816 HG SER 117 HG SER 117 -12.737 15.715 15.751 817 H LEU 118 HN LEU 118 -10.452 15.266 16.135 818 HA LEU 118 HA LEU 118 -9.938 13.744 18.514 819 HB2 LEU 118 HB2 LEU 118 -8.846 13.506 15.696 820 HB3 LEU 118 HB1 LEU 118 -8.529 12.326 16.969 821 HG LEU 118 HG LEU 118 -11.362 13.131 16.379 822 HD11 LEU 118 HD21 LEU 118 -11.315 11.022 14.844 823 HD12 LEU 118 HD22 LEU 118 -9.583 11.342 14.732 824 HD13 LEU 118 HD23 LEU 118 -10.741 12.554 14.186 825 HD21 LEU 118 HD11 LEU 118 -9.944 11.165 17.963 826 HD22 LEU 118 HD12 LEU 118 -11.048 10.368 16.843 827 HD23 LEU 118 HD13 LEU 118 -11.660 11.570 17.978 828 H ILE 119 HN ILE 119 -7.859 15.808 16.489 829 HA ILE 119 HA ILE 119 -5.391 15.249 17.765 830 HB ILE 119 HB ILE 119 -6.371 17.857 16.565 831 HG12 ILE 119 HG12 ILE 119 -4.634 15.683 15.365 832 HG13 ILE 119 HG11 ILE 119 -6.367 15.825 15.072 833 HG21 ILE 119 HG21 ILE 119 -4.429 18.214 18.019 834 HG22 ILE 119 HG22 ILE 119 -3.946 18.355 16.330 835 HG23 ILE 119 HG23 ILE 119 -3.575 16.887 17.233 836 HD11 ILE 119 HD11 ILE 119 -5.899 18.225 14.321 837 HD12 ILE 119 HD12 ILE 119 -5.306 16.955 13.251 838 HD13 ILE 119 HD13 ILE 119 -4.189 17.791 14.329 839 H GLY 120 HN GLY 120 -8.002 17.469 18.668 840 HA2 GLY 120 HA2 GLY 120 -6.549 18.694 20.848 841 HA3 GLY 120 HA1 GLY 120 -8.295 18.769 20.606 842 H MET 121 HN MET 121 -8.647 15.867 20.547 843 HA MET 121 HA MET 121 -9.033 15.388 23.339 844 HB2 MET 121 HB2 MET 121 -10.291 14.245 21.495 845 HB3 MET 121 HB1 MET 121 -8.833 13.320 21.129 846 HG2 MET 121 HG1 MET 121 -8.834 12.463 23.474 847 HG3 MET 121 HG2 MET 121 -10.348 13.320 23.758 848 HE1 MET 121 HE1 MET 121 -11.449 11.316 24.560 849 HE2 MET 121 HE2 MET 121 -10.143 10.171 24.267 850 HE3 MET 121 HE3 MET 121 -11.764 9.817 23.674 851 H PHE 122 HN PHE 122 -6.441 14.449 21.106 852 HA PHE 122 HA PHE 122 -5.067 12.758 23.001 853 HB2 PHE 122 HB2 PHE 122 -4.133 14.189 20.499 854 HB3 PHE 122 HB1 PHE 122 -3.114 13.087 21.425 855 HD1 PHE 122 HD2 PHE 122 -4.091 10.717 21.906 856 HD2 PHE 122 HD1 PHE 122 -5.571 13.345 18.848 857 HE1 PHE 122 HE2 PHE 122 -5.129 8.785 20.748 858 HE2 PHE 122 HE1 PHE 122 -6.610 11.413 17.691 859 HZ PHE 122 HZ PHE 122 -6.388 9.133 18.641 860 H ALA 123 HN ALA 123 -4.837 16.196 22.147 861 HA ALA 123 HA ALA 123 -2.501 16.768 23.700 862 HB1 ALA 123 HB1 ALA 123 -4.783 18.694 23.221 863 HB2 ALA 123 HB2 ALA 123 -3.630 18.268 21.958 864 HB3 ALA 123 HB3 ALA 123 -3.072 19.070 23.426 865 H GLN 124 HN GLN 124 -5.910 16.504 24.534 866 HA GLN 124 HA GLN 124 -5.679 17.690 27.156 867 HB2 GLN 124 HB2 GLN 124 -7.689 15.742 25.988 868 HB3 GLN 124 HB1 GLN 124 -7.849 16.480 27.583 869 HG2 GLN 124 HG2 GLN 124 -7.809 18.721 26.557 870 HG3 GLN 124 HG1 GLN 124 -7.629 17.993 24.961 871 HE21 GLN 124 HE21 GLN 124 -9.887 19.649 25.610 872 HE22 GLN 124 HE22 GLN 124 -11.275 18.672 25.574 873 H ALA 125 HN ALA 125 -5.293 14.406 25.897 874 HA ALA 125 HA ALA 125 -5.151 13.095 28.449 875 HB1 ALA 125 HB1 ALA 125 -5.477 11.651 26.614 876 HB2 ALA 125 HB2 ALA 125 -3.792 11.373 27.053 877 HB3 ALA 125 HB3 ALA 125 -4.185 12.405 25.678 878 H SER 126 HN SER 126 -2.775 14.778 26.458 879 HA SER 126 HA SER 126 -0.412 13.895 27.768 880 HB2 SER 126 HB1 SER 126 -0.499 15.275 25.664 881 HB3 SER 126 HB2 SER 126 -0.923 16.670 26.657 882 HG SER 126 HG SER 126 1.183 16.845 26.723 883 H ALA 127 HN ALA 127 -2.770 16.381 28.636 884 HA ALA 127 HA ALA 127 -1.260 17.595 30.742 885 HB1 ALA 127 HB1 ALA 127 -3.381 18.511 29.732 886 HB2 ALA 127 HB2 ALA 127 -3.371 18.511 31.495 887 HB3 ALA 127 HB3 ALA 127 -4.273 17.275 30.618 888 H ASN 128 HN ASN 128 -2.889 14.551 30.511 889 HA ASN 128 HA ASN 128 -3.289 14.149 33.355 890 HB2 ASN 128 HB2 ASN 128 -3.142 12.207 31.032 891 HB3 ASN 128 HB1 ASN 128 -3.552 11.736 32.682 892 HD21 ASN 128 HD21 ASN 128 -5.458 11.375 30.616 893 HD22 ASN 128 HD22 ASN 128 -6.716 12.500 30.788 894 H ASP 129 HN ASP 129 -0.634 13.656 31.119 895 HA ASP 129 HA ASP 129 0.911 11.874 32.757 896 HB2 ASP 129 HB2 ASP 129 1.310 12.393 30.305 897 HB3 ASP 129 HB1 ASP 129 2.000 13.933 30.820 898 H VAL 130 HN VAL 130 0.813 15.425 32.494 899 HA VAL 130 HA VAL 130 2.914 15.849 34.438 900 HB VAL 130 HB VAL 130 2.374 17.605 32.843 901 HG11 VAL 130 HG11 VAL 130 -0.374 17.223 33.987 902 HG12 VAL 130 HG12 VAL 130 0.119 17.392 32.301 903 HG13 VAL 130 HG13 VAL 130 0.078 18.807 33.355 904 HG21 VAL 130 HG21 VAL 130 1.719 18.207 35.732 905 HG22 VAL 130 HG22 VAL 130 1.808 19.479 34.513 906 HG23 VAL 130 HG23 VAL 130 3.231 18.501 34.873 907 H TYR 131 HN TYR 131 -0.572 15.432 34.605 908 HA TYR 131 HA TYR 131 -0.567 14.702 37.349 909 HB2 TYR 131 HB2 TYR 131 -1.427 16.660 38.451 910 HB3 TYR 131 HB1 TYR 131 0.019 17.163 37.575 911 HD1 TYR 131 HD2 TYR 131 -0.146 18.495 35.518 912 HD2 TYR 131 HD1 TYR 131 -3.647 17.345 37.724 913 HE1 TYR 131 HE2 TYR 131 -1.487 20.156 34.255 914 HE2 TYR 131 HE1 TYR 131 -4.989 19.005 36.461 915 HH TYR 131 HH TYR 131 -4.015 21.451 35.036 916 H ALA 132 HN ALA 132 -2.894 14.686 38.225 917 HA ALA 132 HA ALA 132 -4.643 13.691 36.127 918 HB1 ALA 132 HB1 ALA 132 -4.519 13.595 39.006 919 HB2 ALA 132 HB2 ALA 132 -5.450 12.577 37.908 920 HB3 ALA 132 HB3 ALA 132 -6.135 14.091 38.501 921 H SER 133 HN SER 133 -5.860 15.001 34.860 922 HA SER 133 HA SER 133 -6.204 17.801 35.347 923 HB2 SER 133 HB2 SER 133 -7.609 17.804 33.413 924 HB3 SER 133 HB1 SER 133 -6.384 16.573 33.110 925 HG SER 133 HG SER 133 -8.521 15.853 32.658 926 H ALA 134 HN ALA 134 -8.392 18.858 35.620 927 HA ALA 134 HA ALA 134 -9.666 17.906 38.007 928 HB1 ALA 134 HB1 ALA 134 -10.746 19.899 35.991 929 HB2 ALA 134 HB2 ALA 134 -9.613 20.302 37.283 930 HB3 ALA 134 HB3 ALA 134 -11.238 19.739 37.677 931 H GLY 135 HN GLY 135 -10.316 17.427 34.595 932 HA2 GLY 135 HA2 GLY 135 -11.618 15.596 33.744 933 HA3 GLY 135 HA1 GLY 135 -12.375 15.430 35.328 934 H SER 136 HN SER 136 -12.194 18.664 34.289 935 HA SER 136 HA SER 136 -14.996 19.068 34.272 936 HB2 SER 136 HB2 SER 136 -12.938 20.689 32.745 937 HB3 SER 136 HB1 SER 136 -14.525 21.239 33.283 938 HG SER 136 HG SER 136 -12.284 20.532 34.855 939 H GLY 137 HN GLY 137 -12.788 18.191 31.656 940 HA2 GLY 137 HA2 GLY 137 -13.526 16.921 29.732 941 HA3 GLY 137 HA1 GLY 137 -15.161 17.530 29.995 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 -6.669 -1.633 -12.822 2 H2 GLY 1 HT2 GLY 1 -6.222 -1.804 -14.451 3 H3 GLY 1 HT3 GLY 1 -7.138 -0.462 -13.956 4 HA2 GLY 1 HA2 GLY 1 -4.516 -0.916 -12.719 5 HA3 GLY 1 HA1 GLY 1 -4.588 -0.231 -14.343 6 H MET 2 HN MET 2 -6.684 1.438 -14.338 7 HA MET 2 HA MET 2 -6.259 3.227 -11.977 8 HB2 MET 2 HB2 MET 2 -6.502 4.012 -14.898 9 HB3 MET 2 HB1 MET 2 -6.462 5.151 -13.552 10 HG2 MET 2 HG2 MET 2 -4.242 4.184 -12.882 11 HG3 MET 2 HG1 MET 2 -4.276 3.205 -14.349 12 HE1 MET 2 HE1 MET 2 -3.948 6.556 -12.679 13 HE2 MET 2 HE2 MET 2 -5.428 6.919 -13.562 14 HE3 MET 2 HE3 MET 2 -3.937 7.762 -13.973 15 H GLY 3 HN GLY 3 -8.107 4.653 -11.526 16 HA2 GLY 3 HA2 GLY 3 -10.608 4.391 -12.929 17 HA3 GLY 3 HA1 GLY 3 -10.601 3.360 -11.498 18 H GLN 4 HN GLN 4 -12.436 5.028 -11.042 19 HA GLN 4 HA GLN 4 -11.235 7.400 -9.667 20 HB2 GLN 4 HB2 GLN 4 -13.995 7.087 -10.890 21 HB3 GLN 4 HB1 GLN 4 -13.444 8.501 -9.990 22 HG2 GLN 4 HG2 GLN 4 -11.657 8.874 -11.632 23 HG3 GLN 4 HG1 GLN 4 -12.148 7.429 -12.517 24 HE21 GLN 4 HE21 GLN 4 -12.167 10.003 -13.773 25 HE22 GLN 4 HE22 GLN 4 -13.776 10.457 -14.065 26 H ALA 5 HN ALA 5 -12.035 7.876 -7.562 27 HA ALA 5 HA ALA 5 -13.879 5.857 -6.373 28 HB1 ALA 5 HB1 ALA 5 -12.440 5.327 -4.622 29 HB2 ALA 5 HB2 ALA 5 -11.525 6.826 -4.783 30 HB3 ALA 5 HB3 ALA 5 -11.291 5.521 -5.946 31 H ASN 6 HN ASN 6 -14.810 6.650 -4.282 32 HA ASN 6 HA ASN 6 -15.543 9.466 -4.519 33 HB2 ASN 6 HB2 ASN 6 -16.198 7.487 -2.317 34 HB3 ASN 6 HB1 ASN 6 -17.006 9.026 -2.613 35 HD21 ASN 6 HD21 ASN 6 -17.455 9.051 -5.324 36 HD22 ASN 6 HD22 ASN 6 -18.416 7.729 -5.782 37 H THR 7 HN THR 7 -13.088 7.714 -2.895 38 HA THR 7 HA THR 7 -12.018 10.150 -1.720 39 HB THR 7 HB THR 7 -13.534 9.798 0.073 40 HG1 THR 7 HG1 THR 7 -11.821 9.980 1.265 41 HG21 THR 7 HG21 THR 7 -13.504 7.125 -0.861 42 HG22 THR 7 HG22 THR 7 -14.546 7.821 0.380 43 HG23 THR 7 HG23 THR 7 -13.012 7.076 0.832 44 HA PRO 8 HA PRO 8 -8.232 7.907 -2.218 45 HB2 PRO 8 HB2 PRO 8 -6.787 8.736 -0.071 46 HB3 PRO 8 HB1 PRO 8 -7.071 9.734 -1.501 47 HG2 PRO 8 HG2 PRO 8 -8.552 9.715 1.117 48 HG3 PRO 8 HG1 PRO 8 -7.923 11.100 0.215 49 HD2 PRO 8 HD2 PRO 8 -10.499 10.474 0.037 50 HD3 PRO 8 HD1 PRO 8 -9.615 10.965 -1.407 51 H TRP 9 HN TRP 9 -9.770 7.707 0.988 52 HA TRP 9 HA TRP 9 -8.282 5.246 1.615 53 HB2 TRP 9 HB2 TRP 9 -9.633 5.213 3.676 54 HB3 TRP 9 HB1 TRP 9 -8.902 6.799 3.435 55 HD1 TRP 9 HD1 TRP 9 -12.259 4.984 2.867 56 HE1 TRP 9 HE1 TRP 9 -14.147 6.738 2.977 57 HE3 TRP 9 HE3 TRP 9 -9.480 9.227 3.360 58 HZ2 TRP 9 HZ2 TRP 9 -14.434 9.577 3.243 59 HZ3 TRP 9 HZ3 TRP 9 -10.572 11.437 3.543 60 HH2 TRP 9 HH2 TRP 9 -13.048 11.624 3.484 61 H SER 10 HN SER 10 -10.527 5.764 -0.592 62 HA SER 10 HA SER 10 -12.243 3.435 0.101 63 HB2 SER 10 HB1 SER 10 -13.597 5.220 -0.650 64 HB3 SER 10 HB2 SER 10 -12.456 5.666 -1.919 65 HG SER 10 HG SER 10 -14.405 3.712 -1.880 66 H SER 11 HN SER 11 -9.633 4.440 -1.943 67 HA SER 11 HA SER 11 -9.786 1.822 -3.382 68 HB2 SER 11 HB1 SER 11 -8.589 4.449 -4.313 69 HB3 SER 11 HB2 SER 11 -8.522 2.933 -5.210 70 HG SER 11 HG SER 11 -10.957 3.046 -4.822 71 H LYS 12 HN LYS 12 -7.676 0.831 -3.819 72 HA LYS 12 HA LYS 12 -5.898 1.037 -1.534 73 HB2 LYS 12 HB1 LYS 12 -6.476 -0.991 -3.157 74 HB3 LYS 12 HB2 LYS 12 -5.069 -0.384 -4.028 75 HG2 LYS 12 HG2 LYS 12 -3.715 -0.534 -1.985 76 HG3 LYS 12 HG1 LYS 12 -5.122 -1.090 -1.077 77 HD2 LYS 12 HD2 LYS 12 -3.935 -3.074 -1.651 78 HD3 LYS 12 HD1 LYS 12 -5.271 -2.995 -2.798 79 HE2 LYS 12 HE2 LYS 12 -3.844 -2.146 -4.531 80 HE3 LYS 12 HE1 LYS 12 -2.523 -1.873 -3.395 81 HZ1 LYS 12 HZ1 LYS 12 -3.580 -4.436 -4.411 82 HZ2 LYS 12 HZ2 LYS 12 -2.683 -4.367 -2.970 83 HZ3 LYS 12 HZ3 LYS 12 -1.983 -3.864 -4.433 84 H ALA 13 HN ALA 13 -5.694 1.993 -4.952 85 HA ALA 13 HA ALA 13 -2.966 2.989 -4.661 86 HB1 ALA 13 HB1 ALA 13 -4.791 2.489 -6.810 87 HB2 ALA 13 HB2 ALA 13 -3.068 2.856 -6.904 88 HB3 ALA 13 HB3 ALA 13 -4.251 4.164 -6.921 89 H ASN 14 HN ASN 14 -6.217 4.374 -4.586 90 HA ASN 14 HA ASN 14 -5.306 7.127 -4.562 91 HB2 ASN 14 HB2 ASN 14 -7.921 6.073 -3.461 92 HB3 ASN 14 HB1 ASN 14 -7.585 7.695 -4.066 93 HD21 ASN 14 HD21 ASN 14 -9.642 6.780 -5.411 94 HD22 ASN 14 HD22 ASN 14 -9.234 6.105 -6.914 95 H ALA 15 HN ALA 15 -5.928 4.699 -2.082 96 HA ALA 15 HA ALA 15 -5.822 6.550 0.138 97 HB1 ALA 15 HB1 ALA 15 -5.475 4.446 1.491 98 HB2 ALA 15 HB2 ALA 15 -5.465 3.550 -0.028 99 HB3 ALA 15 HB3 ALA 15 -6.912 4.426 0.469 100 H ASP 16 HN ASP 16 -3.448 4.300 -1.272 101 HA ASP 16 HA ASP 16 -1.322 4.797 0.507 102 HB2 ASP 16 HB2 ASP 16 -1.157 4.295 -2.481 103 HB3 ASP 16 HB1 ASP 16 0.167 4.092 -1.333 104 H ALA 17 HN ALA 17 -1.874 6.432 -2.647 105 HA ALA 17 HA ALA 17 0.182 8.347 -2.382 106 HB1 ALA 17 HB1 ALA 17 -0.849 9.515 -4.134 107 HB2 ALA 17 HB2 ALA 17 -2.473 9.087 -3.592 108 HB3 ALA 17 HB3 ALA 17 -1.452 7.876 -4.369 109 H PHE 18 HN PHE 18 -3.123 8.362 -1.105 110 HA PHE 18 HA PHE 18 -3.125 11.042 -0.120 111 HB2 PHE 18 HB2 PHE 18 -5.147 9.595 -0.276 112 HB3 PHE 18 HB1 PHE 18 -4.522 8.617 1.051 113 HD1 PHE 18 HD1 PHE 18 -5.453 12.125 0.144 114 HD2 PHE 18 HD2 PHE 18 -4.920 9.244 3.285 115 HE1 PHE 18 HE1 PHE 18 -6.419 13.723 1.775 116 HE2 PHE 18 HE2 PHE 18 -5.884 10.844 4.917 117 HZ PHE 18 HZ PHE 18 -6.636 13.081 4.159 118 H ILE 19 HN ILE 19 -2.049 7.982 1.342 119 HA ILE 19 HA ILE 19 -1.380 9.144 3.899 120 HB ILE 19 HB ILE 19 -0.227 6.658 2.594 121 HG12 ILE 19 HG12 ILE 19 -2.597 6.375 2.616 122 HG13 ILE 19 HG11 ILE 19 -2.007 5.530 4.046 123 HG21 ILE 19 HG21 ILE 19 -0.609 7.129 5.541 124 HG22 ILE 19 HG22 ILE 19 0.820 7.764 4.723 125 HG23 ILE 19 HG23 ILE 19 0.505 6.028 4.727 126 HD11 ILE 19 HD11 ILE 19 -3.637 8.000 3.844 127 HD12 ILE 19 HD12 ILE 19 -2.378 8.012 5.080 128 HD13 ILE 19 HD13 ILE 19 -3.621 6.760 5.099 129 H ASN 20 HN ASN 20 0.594 8.268 1.052 130 HA ASN 20 HA ASN 20 3.074 9.223 2.090 131 HB2 ASN 20 HB1 ASN 20 2.222 9.235 -0.817 132 HB3 ASN 20 HB2 ASN 20 3.865 9.136 -0.188 133 HD21 ASN 20 HD21 ASN 20 1.285 7.260 -1.320 134 HD22 ASN 20 HD22 ASN 20 1.671 5.778 -0.588 135 H SER 21 HN SER 21 0.698 10.819 -0.044 136 HA SER 21 HA SER 21 2.043 13.303 -0.269 137 HB2 SER 21 HB1 SER 21 -0.288 14.216 -0.699 138 HB3 SER 21 HB2 SER 21 0.183 12.851 -1.714 139 HG SER 21 HG SER 21 -1.456 12.824 0.594 140 H PHE 22 HN PHE 22 -0.108 12.078 2.262 141 HA PHE 22 HA PHE 22 -0.449 14.590 3.610 142 HB2 PHE 22 HB1 PHE 22 -1.922 12.670 4.047 143 HB3 PHE 22 HB2 PHE 22 -0.564 11.776 4.733 144 HD1 PHE 22 HD2 PHE 22 0.678 12.841 6.731 145 HD2 PHE 22 HD1 PHE 22 -3.192 14.135 5.387 146 HE1 PHE 22 HE2 PHE 22 0.281 13.933 8.924 147 HE2 PHE 22 HE1 PHE 22 -3.587 15.226 7.579 148 HZ PHE 22 HZ PHE 22 -1.850 15.124 9.346 149 H ILE 23 HN ILE 23 2.000 12.048 3.854 150 HA ILE 23 HA ILE 23 3.271 13.115 6.216 151 HB ILE 23 HB ILE 23 4.472 11.402 4.028 152 HG12 ILE 23 HG12 ILE 23 3.125 10.574 6.615 153 HG13 ILE 23 HG11 ILE 23 2.375 10.469 5.022 154 HG21 ILE 23 HG21 ILE 23 6.226 10.962 5.482 155 HG22 ILE 23 HG22 ILE 23 5.261 11.318 6.916 156 HG23 ILE 23 HG23 ILE 23 5.873 12.635 5.915 157 HD11 ILE 23 HD11 ILE 23 5.029 9.161 5.653 158 HD12 ILE 23 HD12 ILE 23 3.977 8.863 4.270 159 HD13 ILE 23 HD13 ILE 23 3.489 8.331 5.879 160 H SER 24 HN SER 24 4.290 13.234 2.778 161 HA SER 24 HA SER 24 6.446 15.048 3.226 162 HB2 SER 24 HB2 SER 24 4.798 14.753 0.698 163 HB3 SER 24 HB1 SER 24 6.441 15.380 0.817 164 HG SER 24 HG SER 24 5.847 12.832 1.819 165 H ALA 25 HN ALA 25 3.008 15.587 2.628 166 HA ALA 25 HA ALA 25 3.326 18.460 2.257 167 HB1 ALA 25 HB1 ALA 25 1.406 17.591 1.212 168 HB2 ALA 25 HB2 ALA 25 0.759 18.366 2.658 169 HB3 ALA 25 HB3 ALA 25 0.972 16.616 2.616 170 H ALA 26 HN ALA 26 2.214 16.374 4.940 171 HA ALA 26 HA ALA 26 1.705 18.602 6.715 172 HB1 ALA 26 HB1 ALA 26 2.287 15.732 7.486 173 HB2 ALA 26 HB2 ALA 26 0.706 16.299 6.947 174 HB3 ALA 26 HB3 ALA 26 1.411 16.933 8.434 175 H SER 27 HN SER 27 4.542 16.661 5.994 176 HA SER 27 HA SER 27 6.080 17.262 8.307 177 HB2 SER 27 HB1 SER 27 6.551 15.659 6.277 178 HB3 SER 27 HB2 SER 27 7.362 17.071 5.601 179 HG SER 27 HG SER 27 8.683 15.633 6.924 180 H ASN 28 HN ASN 28 5.434 19.177 5.419 181 HA ASN 28 HA ASN 28 7.317 21.257 6.433 182 HB2 ASN 28 HB2 ASN 28 6.021 20.888 3.720 183 HB3 ASN 28 HB1 ASN 28 7.048 22.256 4.152 184 HD21 ASN 28 HD21 ASN 28 9.022 20.894 5.705 185 HD22 ASN 28 HD22 ASN 28 9.866 19.817 4.702 186 H THR 29 HN THR 29 4.186 20.555 6.927 187 HA THR 29 HA THR 29 3.120 23.259 6.380 188 HB THR 29 HB THR 29 1.697 20.985 7.776 189 HG1 THR 29 HG1 THR 29 2.259 20.157 5.838 190 HG21 THR 29 HG21 THR 29 0.860 23.444 7.733 191 HG22 THR 29 HG22 THR 29 -0.268 22.169 7.276 192 HG23 THR 29 HG23 THR 29 0.522 23.135 6.030 193 H GLY 30 HN GLY 30 2.772 21.216 9.301 194 HA2 GLY 30 HA1 GLY 30 2.675 23.586 10.979 195 HA3 GLY 30 HA2 GLY 30 2.651 21.918 11.546 196 H SER 31 HN SER 31 4.506 21.095 12.399 197 HA SER 31 HA SER 31 7.106 22.355 11.769 198 HB2 SER 31 HB2 SER 31 5.811 22.375 14.497 199 HB3 SER 31 HB1 SER 31 7.561 22.485 14.302 200 HG SER 31 HG SER 31 5.841 24.433 14.145 201 H PHE 32 HN PHE 32 5.488 19.635 11.837 202 HA PHE 32 HA PHE 32 6.525 17.729 13.507 203 HB2 PHE 32 HB1 PHE 32 6.203 17.574 10.499 204 HB3 PHE 32 HB2 PHE 32 6.564 16.174 11.507 205 HD1 PHE 32 HD1 PHE 32 4.973 15.777 13.552 206 HD2 PHE 32 HD2 PHE 32 3.967 18.192 10.143 207 HE1 PHE 32 HE1 PHE 32 2.565 15.512 14.072 208 HE2 PHE 32 HE2 PHE 32 1.562 17.927 10.667 209 HZ PHE 32 HZ PHE 32 0.860 16.583 12.628 210 H SER 33 HN SER 33 8.607 17.654 14.248 211 HA SER 33 HA SER 33 10.857 18.509 12.642 212 HB2 SER 33 HB1 SER 33 12.225 17.809 14.516 213 HB3 SER 33 HB2 SER 33 10.778 18.588 15.159 214 HG SER 33 HG SER 33 9.920 16.322 15.150 215 H GLN 34 HN GLN 34 12.721 17.013 12.153 216 HA GLN 34 HA GLN 34 11.971 14.892 10.462 217 HB2 GLN 34 HB1 GLN 34 14.574 15.214 11.989 218 HB3 GLN 34 HB2 GLN 34 14.334 14.172 10.587 219 HG2 GLN 34 HG2 GLN 34 13.545 16.295 9.361 220 HG3 GLN 34 HG1 GLN 34 14.248 17.190 10.709 221 HE21 GLN 34 HE21 GLN 34 16.403 15.062 11.031 222 HE22 GLN 34 HE22 GLN 34 17.486 15.330 9.752 223 H ASP 35 HN ASP 35 12.715 14.860 13.921 224 HA ASP 35 HA ASP 35 12.741 11.992 14.194 225 HB2 ASP 35 HB2 ASP 35 12.234 14.226 16.177 226 HB3 ASP 35 HB1 ASP 35 12.305 12.525 16.638 227 H GLN 36 HN GLN 36 10.192 14.441 14.738 228 HA GLN 36 HA GLN 36 8.167 12.555 15.487 229 HB2 GLN 36 HB1 GLN 36 7.854 15.273 14.174 230 HB3 GLN 36 HB2 GLN 36 6.580 14.376 15.002 231 HG2 GLN 36 HG1 GLN 36 7.607 14.634 17.112 232 HG3 GLN 36 HG2 GLN 36 9.169 15.042 16.400 233 HE21 GLN 36 HE21 GLN 36 7.870 16.744 18.339 234 HE22 GLN 36 HE22 GLN 36 7.479 18.201 17.560 235 H MET 37 HN MET 37 9.282 13.762 12.359 236 HA MET 37 HA MET 37 7.116 12.728 10.794 237 HB2 MET 37 HB2 MET 37 10.016 13.268 10.098 238 HB3 MET 37 HB1 MET 37 8.804 12.794 8.908 239 HG2 MET 37 HG2 MET 37 8.710 15.256 10.681 240 HG3 MET 37 HG1 MET 37 9.017 15.234 8.944 241 HE1 MET 37 HE1 MET 37 6.666 12.828 8.063 242 HE2 MET 37 HE2 MET 37 7.653 14.099 7.344 243 HE3 MET 37 HE3 MET 37 5.896 14.206 7.264 244 H GLU 38 HN GLU 38 10.000 11.249 12.152 245 HA GLU 38 HA GLU 38 10.100 8.884 10.597 246 HB2 GLU 38 HB1 GLU 38 11.772 9.592 12.357 247 HB3 GLU 38 HB2 GLU 38 10.620 9.052 13.578 248 HG2 GLU 38 HG1 GLU 38 10.644 6.786 12.605 249 HG3 GLU 38 HG2 GLU 38 11.783 7.323 11.371 250 H ASN 39 HN ASN 39 8.115 9.702 13.427 251 HA ASN 39 HA ASN 39 6.935 7.153 13.836 252 HB2 ASN 39 HB2 ASN 39 5.708 9.902 14.214 253 HB3 ASN 39 HB1 ASN 39 5.071 8.404 14.892 254 HD21 ASN 39 HD21 ASN 39 5.996 10.641 16.516 255 HD22 ASN 39 HD22 ASN 39 7.382 10.144 17.361 256 H MET 40 HN MET 40 6.005 9.813 11.675 257 HA MET 40 HA MET 40 3.595 8.694 10.683 258 HB2 MET 40 HB1 MET 40 5.656 10.406 9.261 259 HB3 MET 40 HB2 MET 40 4.036 10.076 8.646 260 HG2 MET 40 HG2 MET 40 3.011 11.204 10.497 261 HG3 MET 40 HG1 MET 40 4.541 11.299 11.368 262 HE1 MET 40 HE1 MET 40 3.397 13.365 11.702 263 HE2 MET 40 HE2 MET 40 2.892 14.515 10.468 264 HE3 MET 40 HE3 MET 40 4.481 14.671 11.209 265 H SER 41 HN SER 41 6.958 8.171 9.731 266 HA SER 41 HA SER 41 6.340 6.459 7.487 267 HB2 SER 41 HB1 SER 41 8.683 5.991 7.416 268 HB3 SER 41 HB2 SER 41 8.548 7.672 7.933 269 HG SER 41 HG SER 41 8.471 6.498 10.145 270 H LEU 42 HN LEU 42 6.523 5.987 10.927 271 HA LEU 42 HA LEU 42 6.758 3.058 10.689 272 HB2 LEU 42 HB2 LEU 42 7.828 4.245 12.583 273 HB3 LEU 42 HB1 LEU 42 6.243 4.806 13.117 274 HG LEU 42 HG LEU 42 5.507 2.487 13.438 275 HD11 LEU 42 HD21 LEU 42 7.408 0.727 13.296 276 HD12 LEU 42 HD22 LEU 42 8.227 1.904 12.271 277 HD13 LEU 42 HD23 LEU 42 6.661 1.253 11.788 278 HD21 LEU 42 HD11 LEU 42 8.184 2.521 14.768 279 HD22 LEU 42 HD12 LEU 42 6.594 2.193 15.458 280 HD23 LEU 42 HD13 LEU 42 7.079 3.853 15.107 281 H ILE 43 HN ILE 43 4.279 5.397 10.636 282 HA ILE 43 HA ILE 43 2.261 3.228 11.018 283 HB ILE 43 HB ILE 43 2.137 6.059 12.097 284 HG12 ILE 43 HG12 ILE 43 2.140 3.350 13.464 285 HG13 ILE 43 HG11 ILE 43 3.481 4.497 13.449 286 HG21 ILE 43 HG21 ILE 43 -0.059 5.154 13.087 287 HG22 ILE 43 HG22 ILE 43 0.065 3.867 11.890 288 HG23 ILE 43 HG23 ILE 43 -0.071 5.546 11.367 289 HD11 ILE 43 HD11 ILE 43 1.377 4.393 15.313 290 HD12 ILE 43 HD12 ILE 43 1.030 5.795 14.300 291 HD13 ILE 43 HD13 ILE 43 2.575 5.676 15.143 292 H GLY 44 HN GLY 44 0.093 3.918 10.017 293 HA2 GLY 44 HA1 GLY 44 -1.118 4.704 8.162 294 HA3 GLY 44 HA2 GLY 44 0.016 6.053 8.090 295 H ASN 45 HN ASN 45 2.280 5.371 7.239 296 HA ASN 45 HA ASN 45 1.997 4.309 4.605 297 HB2 ASN 45 HB1 ASN 45 3.870 5.776 5.227 298 HB3 ASN 45 HB2 ASN 45 4.485 4.544 6.329 299 HD21 ASN 45 HD21 ASN 45 5.913 5.605 3.969 300 HD22 ASN 45 HD22 ASN 45 6.130 4.311 2.893 301 H THR 46 HN THR 46 3.003 2.829 7.668 302 HA THR 46 HA THR 46 3.785 0.295 6.606 303 HB THR 46 HB THR 46 2.540 0.895 9.308 304 HG1 THR 46 HG1 THR 46 5.275 0.733 8.601 305 HG21 THR 46 HG21 THR 46 4.331 -1.363 8.370 306 HG22 THR 46 HG22 THR 46 2.610 -1.502 8.730 307 HG23 THR 46 HG23 THR 46 3.752 -1.126 10.020 308 H LEU 47 HN LEU 47 0.649 1.634 7.531 309 HA LEU 47 HA LEU 47 -0.916 -0.709 7.509 310 HB2 LEU 47 HB2 LEU 47 -1.476 2.158 6.793 311 HB3 LEU 47 HB1 LEU 47 -2.716 0.933 6.528 312 HG LEU 47 HG LEU 47 -2.679 0.303 8.867 313 HD11 LEU 47 HD21 LEU 47 -1.176 1.564 10.450 314 HD12 LEU 47 HD22 LEU 47 -0.359 2.247 9.045 315 HD13 LEU 47 HD23 LEU 47 -0.311 0.507 9.334 316 HD21 LEU 47 HD11 LEU 47 -3.811 2.518 8.024 317 HD22 LEU 47 HD12 LEU 47 -2.560 3.304 8.985 318 HD23 LEU 47 HD13 LEU 47 -3.704 2.207 9.757 319 H MET 48 HN MET 48 0.272 1.252 4.803 320 HA MET 48 HA MET 48 -1.199 0.112 2.696 321 HB2 MET 48 HB2 MET 48 1.670 1.071 2.815 322 HB3 MET 48 HB1 MET 48 0.899 0.562 1.312 323 HG2 MET 48 HG2 MET 48 -0.955 2.231 1.855 324 HG3 MET 48 HG1 MET 48 0.102 2.855 3.122 325 HE1 MET 48 HE1 MET 48 3.002 4.255 1.802 326 HE2 MET 48 HE2 MET 48 3.253 2.640 1.144 327 HE3 MET 48 HE3 MET 48 2.489 2.833 2.720 328 H ALA 49 HN ALA 49 1.702 -1.122 4.337 329 HA ALA 49 HA ALA 49 2.146 -3.367 2.631 330 HB1 ALA 49 HB1 ALA 49 3.187 -4.364 4.773 331 HB2 ALA 49 HB2 ALA 49 2.768 -2.831 5.538 332 HB3 ALA 49 HB3 ALA 49 3.881 -2.858 4.171 333 H ALA 50 HN ALA 50 -0.056 -2.833 5.329 334 HA ALA 50 HA ALA 50 -0.851 -5.552 5.724 335 HB1 ALA 50 HB1 ALA 50 -2.910 -4.557 6.726 336 HB2 ALA 50 HB2 ALA 50 -2.404 -2.977 6.126 337 HB3 ALA 50 HB3 ALA 50 -1.434 -3.812 7.341 338 H MET 51 HN MET 51 -1.653 -3.187 3.289 339 HA MET 51 HA MET 51 -4.103 -4.194 2.325 340 HB2 MET 51 HB2 MET 51 -1.786 -3.118 0.684 341 HB3 MET 51 HB1 MET 51 -3.466 -3.223 0.156 342 HG2 MET 51 HG2 MET 51 -4.103 -1.737 2.071 343 HG3 MET 51 HG1 MET 51 -2.390 -1.554 2.449 344 HE1 MET 51 HE1 MET 51 -0.612 -0.672 0.762 345 HE2 MET 51 HE2 MET 51 -0.968 -0.066 -0.853 346 HE3 MET 51 HE3 MET 51 -1.206 -1.774 -0.488 347 H ASP 52 HN ASP 52 -0.845 -5.464 2.003 348 HA ASP 52 HA ASP 52 -1.251 -7.266 -0.148 349 HB2 ASP 52 HB2 ASP 52 0.495 -7.478 2.320 350 HB3 ASP 52 HB1 ASP 52 0.556 -8.636 0.992 351 H ASN 53 HN ASN 53 -2.220 -7.433 3.222 352 HA ASN 53 HA ASN 53 -2.865 -10.226 3.297 353 HB2 ASN 53 HB2 ASN 53 -4.052 -7.893 4.832 354 HB3 ASN 53 HB1 ASN 53 -4.328 -9.591 5.218 355 HD21 ASN 53 HD21 ASN 53 -3.041 -7.831 7.084 356 HD22 ASN 53 HD22 ASN 53 -1.420 -8.306 7.245 357 H MET 54 HN MET 54 -4.565 -7.397 2.099 358 HA MET 54 HA MET 54 -7.176 -8.515 1.880 359 HB2 MET 54 HB2 MET 54 -5.789 -6.476 0.112 360 HB3 MET 54 HB1 MET 54 -7.521 -6.809 0.095 361 HG2 MET 54 HG2 MET 54 -5.914 -5.786 2.457 362 HG3 MET 54 HG1 MET 54 -7.073 -4.858 1.505 363 HE1 MET 54 HE1 MET 54 -9.151 -7.251 0.900 364 HE2 MET 54 HE2 MET 54 -9.553 -5.559 1.184 365 HE3 MET 54 HE3 MET 54 -10.384 -6.820 2.094 366 H GLY 55 HN GLY 55 -4.288 -8.911 -0.071 367 HA2 GLY 55 HA2 GLY 55 -3.891 -10.724 -1.574 368 HA3 GLY 55 HA1 GLY 55 -5.613 -11.109 -1.524 369 H GLY 56 HN GLY 56 -5.030 -7.792 -1.970 370 HA2 GLY 56 HA2 GLY 56 -4.716 -6.553 -4.033 371 HA3 GLY 56 HA1 GLY 56 -5.066 -8.028 -4.935 372 H ARG 57 HN ARG 57 -7.123 -7.383 -2.248 373 HA ARG 57 HA ARG 57 -9.192 -6.257 -4.088 374 HB2 ARG 57 HB2 ARG 57 -10.874 -7.670 -3.046 375 HB3 ARG 57 HB1 ARG 57 -9.564 -8.691 -3.637 376 HG2 ARG 57 HG2 ARG 57 -8.579 -8.373 -1.232 377 HG3 ARG 57 HG1 ARG 57 -10.229 -7.919 -0.807 378 HD2 ARG 57 HD2 ARG 57 -11.030 -10.065 -1.809 379 HD3 ARG 57 HD1 ARG 57 -9.351 -10.523 -2.091 380 HE ARG 57 HE ARG 57 -9.172 -10.170 0.513 381 HH11 ARG 57 HH11 ARG 57 -11.210 -12.100 -1.372 382 HH12 ARG 57 HH12 ARG 57 -12.128 -12.720 -0.040 383 HH21 ARG 57 HH21 ARG 57 -10.646 -10.632 2.297 384 HH22 ARG 57 HH22 ARG 57 -11.809 -11.889 2.037 385 H ILE 58 HN ILE 58 -9.592 -4.232 -3.347 386 HA ILE 58 HA ILE 58 -9.713 -3.841 -0.384 387 HB ILE 58 HB ILE 58 -9.160 -1.706 -2.460 388 HG12 ILE 58 HG12 ILE 58 -7.316 -3.226 -2.617 389 HG13 ILE 58 HG11 ILE 58 -6.778 -1.914 -1.568 390 HG21 ILE 58 HG21 ILE 58 -9.467 -0.364 -0.675 391 HG22 ILE 58 HG22 ILE 58 -8.039 -1.102 0.049 392 HG23 ILE 58 HG23 ILE 58 -9.641 -1.751 0.398 393 HD11 ILE 58 HD11 ILE 58 -7.208 -4.753 -0.942 394 HD12 ILE 58 HD12 ILE 58 -7.953 -3.655 0.221 395 HD13 ILE 58 HD13 ILE 58 -6.223 -3.554 -0.104 396 H THR 59 HN THR 59 -11.465 -2.583 0.419 397 HA THR 59 HA THR 59 -13.542 -1.781 -1.553 398 HB THR 59 HB THR 59 -14.478 -3.845 -1.017 399 HG1 THR 59 HG1 THR 59 -16.198 -3.314 0.145 400 HG21 THR 59 HG21 THR 59 -12.668 -4.448 0.583 401 HG22 THR 59 HG22 THR 59 -14.263 -4.931 1.160 402 HG23 THR 59 HG23 THR 59 -13.482 -3.496 1.824 403 HA PRO 60 HA PRO 60 -13.997 1.752 1.077 404 HB2 PRO 60 HB2 PRO 60 -16.613 2.333 0.724 405 HB3 PRO 60 HB1 PRO 60 -15.389 2.627 -0.514 406 HG2 PRO 60 HG2 PRO 60 -17.321 0.351 -0.256 407 HG3 PRO 60 HG1 PRO 60 -16.868 1.267 -1.698 408 HD2 PRO 60 HD1 PRO 60 -15.828 -1.170 -1.165 409 HD3 PRO 60 HD2 PRO 60 -14.900 0.084 -1.988 410 H SER 61 HN SER 61 -15.694 -1.165 1.688 411 HA SER 61 HA SER 61 -17.054 -0.194 4.102 412 HB2 SER 61 HB2 SER 61 -17.917 -2.082 2.643 413 HB3 SER 61 HB1 SER 61 -16.587 -3.066 3.254 414 HG SER 61 HG SER 61 -18.429 -1.723 4.929 415 H LYS 62 HN LYS 62 -14.469 -2.605 3.489 416 HA LYS 62 HA LYS 62 -13.663 -2.549 6.298 417 HB2 LYS 62 HB2 LYS 62 -13.451 -4.600 4.905 418 HB3 LYS 62 HB1 LYS 62 -12.264 -3.770 3.898 419 HG2 LYS 62 HG2 LYS 62 -10.834 -3.434 5.905 420 HG3 LYS 62 HG1 LYS 62 -12.006 -4.334 6.868 421 HD2 LYS 62 HD2 LYS 62 -11.689 -6.286 5.327 422 HD3 LYS 62 HD1 LYS 62 -10.412 -5.383 4.510 423 HE2 LYS 62 HE2 LYS 62 -10.408 -5.984 7.481 424 HE3 LYS 62 HE1 LYS 62 -9.578 -6.976 6.282 425 HZ1 LYS 62 HZ1 LYS 62 -8.763 -4.476 5.666 426 HZ2 LYS 62 HZ2 LYS 62 -7.884 -5.584 6.607 427 HZ3 LYS 62 HZ3 LYS 62 -8.854 -4.408 7.358 428 H LEU 63 HN LEU 63 -12.379 -1.304 3.222 429 HA LEU 63 HA LEU 63 -9.925 -0.273 4.172 430 HB2 LEU 63 HB2 LEU 63 -10.834 -0.338 1.760 431 HB3 LEU 63 HB1 LEU 63 -11.648 1.175 2.157 432 HG LEU 63 HG LEU 63 -9.528 2.236 2.690 433 HD11 LEU 63 HD21 LEU 63 -7.490 0.592 1.953 434 HD12 LEU 63 HD22 LEU 63 -8.607 -0.579 2.652 435 HD13 LEU 63 HD23 LEU 63 -8.036 0.779 3.619 436 HD21 LEU 63 HD11 LEU 63 -10.214 1.191 0.122 437 HD22 LEU 63 HD12 LEU 63 -8.459 1.114 0.282 438 HD23 LEU 63 HD13 LEU 63 -9.296 2.652 0.489 439 H GLN 64 HN GLN 64 -13.198 1.073 4.362 440 HA GLN 64 HA GLN 64 -12.566 3.686 5.234 441 HB2 GLN 64 HB2 GLN 64 -14.875 2.837 4.718 442 HB3 GLN 64 HB1 GLN 64 -14.851 1.972 6.256 443 HG2 GLN 64 HG2 GLN 64 -14.420 4.159 7.410 444 HG3 GLN 64 HG1 GLN 64 -14.625 4.971 5.858 445 HE21 GLN 64 HE21 GLN 64 -16.690 5.860 5.762 446 HE22 GLN 64 HE22 GLN 64 -18.102 5.120 6.347 447 H ALA 65 HN ALA 65 -12.442 0.619 6.936 448 HA ALA 65 HA ALA 65 -12.269 1.677 9.601 449 HB1 ALA 65 HB1 ALA 65 -11.638 -0.496 10.256 450 HB2 ALA 65 HB2 ALA 65 -10.846 -0.827 8.715 451 HB3 ALA 65 HB3 ALA 65 -12.606 -0.782 8.809 452 H LEU 66 HN LEU 66 -9.852 1.005 7.093 453 HA LEU 66 HA LEU 66 -7.564 1.605 8.749 454 HB2 LEU 66 HB2 LEU 66 -7.439 0.326 6.605 455 HB3 LEU 66 HB1 LEU 66 -7.829 1.807 5.732 456 HG LEU 66 HG LEU 66 -5.582 1.964 7.676 457 HD11 LEU 66 HD11 LEU 66 -4.623 0.084 6.802 458 HD12 LEU 66 HD12 LEU 66 -4.241 1.149 5.448 459 HD13 LEU 66 HD13 LEU 66 -5.658 0.101 5.374 460 HD21 LEU 66 HD21 LEU 66 -6.413 3.846 6.207 461 HD22 LEU 66 HD22 LEU 66 -5.863 2.917 4.812 462 HD23 LEU 66 HD23 LEU 66 -4.699 3.479 6.012 463 H ASP 67 HN ASP 67 -9.631 3.520 6.599 464 HA ASP 67 HA ASP 67 -8.178 5.908 6.459 465 HB2 ASP 67 HB1 ASP 67 -10.406 5.433 5.366 466 HB3 ASP 67 HB2 ASP 67 -11.168 5.747 6.924 467 H MET 68 HN MET 68 -10.454 4.910 9.034 468 HA MET 68 HA MET 68 -10.079 7.235 10.658 469 HB2 MET 68 HB2 MET 68 -10.838 4.409 11.461 470 HB3 MET 68 HB1 MET 68 -11.002 5.831 12.491 471 HG2 MET 68 HG1 MET 68 -12.517 6.858 10.831 472 HG3 MET 68 HG2 MET 68 -12.357 5.431 9.805 473 HE1 MET 68 HE1 MET 68 -12.542 6.156 13.506 474 HE2 MET 68 HE2 MET 68 -14.094 5.521 14.050 475 HE3 MET 68 HE3 MET 68 -14.045 6.963 13.038 476 H ALA 69 HN ALA 69 -8.391 4.102 10.589 477 HA ALA 69 HA ALA 69 -6.793 4.430 12.894 478 HB1 ALA 69 HB1 ALA 69 -5.117 2.983 11.614 479 HB2 ALA 69 HB2 ALA 69 -6.240 3.052 10.258 480 HB3 ALA 69 HB3 ALA 69 -6.741 2.316 11.780 481 H PHE 70 HN PHE 70 -6.106 5.462 9.538 482 HA PHE 70 HA PHE 70 -3.557 6.587 9.998 483 HB2 PHE 70 HB1 PHE 70 -4.595 6.314 7.752 484 HB3 PHE 70 HB2 PHE 70 -5.700 7.637 8.125 485 HD1 PHE 70 HD1 PHE 70 -2.128 6.742 7.632 486 HD2 PHE 70 HD2 PHE 70 -4.987 9.923 8.034 487 HE1 PHE 70 HE1 PHE 70 -0.405 8.379 6.923 488 HE2 PHE 70 HE2 PHE 70 -3.264 11.560 7.325 489 HZ PHE 70 HZ PHE 70 -0.974 10.789 6.769 490 H ALA 71 HN ALA 71 -6.777 7.933 10.594 491 HA ALA 71 HA ALA 71 -5.899 10.607 11.173 492 HB1 ALA 71 HB1 ALA 71 -8.357 9.009 11.875 493 HB2 ALA 71 HB2 ALA 71 -8.213 10.384 10.780 494 HB3 ALA 71 HB3 ALA 71 -8.117 10.632 12.523 495 H SER 72 HN SER 72 -6.262 7.701 13.171 496 HA SER 72 HA SER 72 -5.785 9.033 15.684 497 HB2 SER 72 HB1 SER 72 -5.262 6.132 14.972 498 HB3 SER 72 HB2 SER 72 -5.480 6.795 16.592 499 HG SER 72 HG SER 72 -7.345 5.813 15.209 500 H SER 73 HN SER 73 -3.677 7.524 13.273 501 HA SER 73 HA SER 73 -1.287 7.631 14.888 502 HB2 SER 73 HB1 SER 73 -0.116 7.037 12.905 503 HB3 SER 73 HB2 SER 73 -1.682 6.238 12.772 504 HG SER 73 HG SER 73 -0.591 8.016 11.132 505 H VAL 74 HN VAL 74 -2.509 9.717 12.271 506 HA VAL 74 HA VAL 74 -0.405 11.611 12.339 507 HB VAL 74 HB VAL 74 -1.866 13.071 11.128 508 HG11 VAL 74 HG21 VAL 74 -3.292 10.881 10.019 509 HG12 VAL 74 HG22 VAL 74 -1.732 10.256 10.559 510 HG13 VAL 74 HG23 VAL 74 -1.798 11.605 9.424 511 HG21 VAL 74 HG11 VAL 74 -3.726 12.922 12.831 512 HG22 VAL 74 HG12 VAL 74 -4.198 11.392 12.090 513 HG23 VAL 74 HG13 VAL 74 -4.276 12.885 11.156 514 H ALA 75 HN ALA 75 -3.306 11.315 14.337 515 HA ALA 75 HA ALA 75 -2.973 13.882 15.642 516 HB1 ALA 75 HB1 ALA 75 -4.647 13.042 17.234 517 HB2 ALA 75 HB2 ALA 75 -4.462 11.411 16.586 518 HB3 ALA 75 HB3 ALA 75 -5.146 12.688 15.580 519 H GLN 76 HN GLN 76 -1.976 10.555 16.396 520 HA GLN 76 HA GLN 76 -0.938 11.165 19.012 521 HB2 GLN 76 HB2 GLN 76 -1.468 8.855 18.173 522 HB3 GLN 76 HB1 GLN 76 -0.045 8.958 17.135 523 HG2 GLN 76 HG2 GLN 76 1.355 9.364 19.162 524 HG3 GLN 76 HG1 GLN 76 -0.079 9.141 20.164 525 HE21 GLN 76 HE21 GLN 76 -0.342 7.033 20.908 526 HE22 GLN 76 HE22 GLN 76 0.270 5.644 20.148 527 H ILE 77 HN ILE 77 0.679 10.797 15.840 528 HA ILE 77 HA ILE 77 3.307 11.369 16.686 529 HB ILE 77 HB ILE 77 2.013 12.188 14.071 530 HG12 ILE 77 HG12 ILE 77 3.533 9.652 14.736 531 HG13 ILE 77 HG11 ILE 77 1.772 9.753 14.708 532 HG21 ILE 77 HG21 ILE 77 4.413 11.843 13.266 533 HG22 ILE 77 HG22 ILE 77 4.881 11.822 14.966 534 HG23 ILE 77 HG23 ILE 77 4.140 13.265 14.273 535 HD11 ILE 77 HD11 ILE 77 1.879 9.336 12.494 536 HD12 ILE 77 HD12 ILE 77 3.633 9.520 12.487 537 HD13 ILE 77 HD13 ILE 77 2.597 10.937 12.302 538 H ALA 78 HN ALA 78 0.919 13.669 15.367 539 HA ALA 78 HA ALA 78 2.533 15.980 15.966 540 HB1 ALA 78 HB1 ALA 78 0.994 16.842 14.567 541 HB2 ALA 78 HB2 ALA 78 -0.163 16.786 15.896 542 HB3 ALA 78 HB3 ALA 78 -0.046 15.432 14.775 543 H ALA 79 HN ALA 79 -0.367 14.619 17.573 544 HA ALA 79 HA ALA 79 -0.449 16.477 19.715 545 HB1 ALA 79 HB1 ALA 79 -1.178 13.537 19.859 546 HB2 ALA 79 HB2 ALA 79 -2.228 14.784 19.187 547 HB3 ALA 79 HB3 ALA 79 -1.788 14.828 20.895 548 H SER 80 HN SER 80 1.692 13.815 19.091 549 HA SER 80 HA SER 80 2.651 13.633 21.853 550 HB2 SER 80 HB1 SER 80 2.730 11.657 20.395 551 HB3 SER 80 HB2 SER 80 3.785 12.513 19.270 552 HG SER 80 HG SER 80 4.381 12.035 21.999 553 H GLN 81 HN GLN 81 3.334 15.555 19.061 554 HA GLN 81 HA GLN 81 6.028 16.223 19.326 555 HB2 GLN 81 HB2 GLN 81 3.749 18.156 18.801 556 HB3 GLN 81 HB1 GLN 81 5.445 18.428 18.402 557 HG2 GLN 81 HG2 GLN 81 5.438 16.597 16.826 558 HG3 GLN 81 HG1 GLN 81 3.826 16.098 17.337 559 HE21 GLN 81 HE21 GLN 81 5.150 17.417 14.731 560 HE22 GLN 81 HE22 GLN 81 3.981 18.570 14.300 561 H GLY 82 HN GLY 82 3.303 17.325 21.293 562 HA2 GLY 82 HA1 GLY 82 3.446 18.024 23.573 563 HA3 GLY 82 HA2 GLY 82 5.200 18.110 23.410 564 H GLY 83 HN GLY 83 3.663 19.607 20.797 565 HA2 GLY 83 HA1 GLY 83 4.167 22.278 22.034 566 HA3 GLY 83 HA2 GLY 83 4.249 21.945 20.303 567 H ASP 84 HN ASP 84 2.704 23.971 20.590 568 HA ASP 84 HA ASP 84 0.057 23.698 21.536 569 HB2 ASP 84 HB2 ASP 84 1.302 25.774 20.546 570 HB3 ASP 84 HB1 ASP 84 0.660 25.210 19.003 571 H LEU 85 HN LEU 85 -1.557 22.362 20.881 572 HA LEU 85 HA LEU 85 -1.228 20.693 18.519 573 HB2 LEU 85 HB2 LEU 85 -2.821 20.662 20.879 574 HB3 LEU 85 HB1 LEU 85 -3.921 20.632 19.501 575 HG LEU 85 HG LEU 85 -2.653 18.743 18.534 576 HD11 LEU 85 HD21 LEU 85 -0.706 19.598 20.446 577 HD12 LEU 85 HD22 LEU 85 -0.549 18.335 19.225 578 HD13 LEU 85 HD23 LEU 85 -1.155 17.937 20.833 579 HD21 LEU 85 HD11 LEU 85 -3.503 17.075 19.989 580 HD22 LEU 85 HD12 LEU 85 -4.546 18.471 20.266 581 HD23 LEU 85 HD13 LEU 85 -3.266 18.082 21.416 582 H GLY 86 HN GLY 86 -2.653 23.765 19.164 583 HA2 GLY 86 HA1 GLY 86 -4.729 23.863 17.247 584 HA3 GLY 86 HA2 GLY 86 -3.775 25.260 17.746 585 H VAL 87 HN VAL 87 -1.227 24.285 16.846 586 HA VAL 87 HA VAL 87 -1.393 25.044 14.061 587 HB VAL 87 HB VAL 87 0.575 25.408 15.654 588 HG11 VAL 87 HG11 VAL 87 1.261 22.580 14.817 589 HG12 VAL 87 HG12 VAL 87 0.584 22.981 16.394 590 HG13 VAL 87 HG13 VAL 87 2.159 23.618 15.923 591 HG21 VAL 87 HG21 VAL 87 0.754 24.366 12.846 592 HG22 VAL 87 HG22 VAL 87 2.238 24.737 13.722 593 HG23 VAL 87 HG23 VAL 87 1.038 26.000 13.448 594 H THR 88 HN THR 88 -0.887 21.935 15.737 595 HA THR 88 HA THR 88 -0.298 20.322 13.511 596 HB THR 88 HB THR 88 -2.016 19.684 15.930 597 HG1 THR 88 HG1 THR 88 0.697 19.561 15.270 598 HG21 THR 88 HG21 THR 88 -2.412 18.217 13.888 599 HG22 THR 88 HG22 THR 88 -1.845 17.370 15.329 600 HG23 THR 88 HG23 THR 88 -0.722 17.730 14.017 601 H THR 89 HN THR 89 -3.383 21.685 14.552 602 HA THR 89 HA THR 89 -5.091 20.179 12.839 603 HB THR 89 HB THR 89 -6.684 21.997 13.071 604 HG1 THR 89 HG1 THR 89 -6.046 23.984 13.276 605 HG21 THR 89 HG21 THR 89 -6.143 22.539 15.649 606 HG22 THR 89 HG22 THR 89 -5.021 21.200 15.405 607 HG23 THR 89 HG23 THR 89 -6.746 20.968 15.120 608 H ASN 90 HN ASN 90 -3.310 23.214 12.289 609 HA ASN 90 HA ASN 90 -4.120 23.436 9.520 610 HB2 ASN 90 HB1 ASN 90 -1.734 24.639 10.960 611 HB3 ASN 90 HB2 ASN 90 -2.331 25.134 9.375 612 HD21 ASN 90 HD21 ASN 90 -5.102 25.179 9.777 613 HD22 ASN 90 HD22 ASN 90 -5.485 26.343 10.952 614 H ALA 91 HN ALA 91 -1.351 22.041 11.227 615 HA ALA 91 HA ALA 91 0.186 21.388 8.886 616 HB1 ALA 91 HB1 ALA 91 0.253 19.720 11.387 617 HB2 ALA 91 HB2 ALA 91 0.858 21.376 11.423 618 HB3 ALA 91 HB3 ALA 91 1.586 20.195 10.335 619 H ILE 92 HN ILE 92 -1.789 19.273 10.988 620 HA ILE 92 HA ILE 92 -1.760 17.033 9.225 621 HB ILE 92 HB ILE 92 -3.922 17.798 11.210 622 HG12 ILE 92 HG12 ILE 92 -1.562 17.798 12.127 623 HG13 ILE 92 HG11 ILE 92 -2.643 16.626 12.880 624 HG21 ILE 92 HG21 ILE 92 -4.852 15.819 10.686 625 HG22 ILE 92 HG22 ILE 92 -3.330 14.991 11.017 626 HG23 ILE 92 HG23 ILE 92 -3.657 15.625 9.404 627 HD11 ILE 92 HD11 ILE 92 -1.758 14.924 11.201 628 HD12 ILE 92 HD12 ILE 92 -0.606 15.452 12.425 629 HD13 ILE 92 HD13 ILE 92 -0.517 16.106 10.790 630 H ALA 93 HN ALA 93 -4.103 19.692 9.606 631 HA ALA 93 HA ALA 93 -5.968 18.717 7.663 632 HB1 ALA 93 HB1 ALA 93 -6.912 20.964 7.708 633 HB2 ALA 93 HB2 ALA 93 -5.445 21.594 8.457 634 HB3 ALA 93 HB3 ALA 93 -6.480 20.480 9.349 635 H ASP 94 HN ASP 94 -3.261 21.046 7.341 636 HA ASP 94 HA ASP 94 -3.701 21.758 4.646 637 HB2 ASP 94 HB1 ASP 94 -1.925 22.660 6.277 638 HB3 ASP 94 HB2 ASP 94 -0.938 21.290 5.766 639 H ALA 95 HN ALA 95 -1.594 19.120 5.861 640 HA ALA 95 HA ALA 95 -1.035 18.059 3.260 641 HB1 ALA 95 HB1 ALA 95 -1.092 16.027 5.345 642 HB2 ALA 95 HB2 ALA 95 -0.266 17.487 5.891 643 HB3 ALA 95 HB3 ALA 95 0.284 16.655 4.437 644 H LEU 96 HN LEU 96 -3.620 17.467 5.593 645 HA LEU 96 HA LEU 96 -4.766 15.211 4.201 646 HB2 LEU 96 HB2 LEU 96 -5.166 16.305 6.647 647 HB3 LEU 96 HB1 LEU 96 -6.545 16.982 5.785 648 HG LEU 96 HG LEU 96 -7.109 14.660 5.007 649 HD11 LEU 96 HD11 LEU 96 -6.030 12.813 6.385 650 HD12 LEU 96 HD12 LEU 96 -4.834 14.004 6.896 651 HD13 LEU 96 HD13 LEU 96 -4.974 13.570 5.192 652 HD21 LEU 96 HD21 LEU 96 -7.212 15.677 7.773 653 HD22 LEU 96 HD22 LEU 96 -7.451 13.934 7.634 654 HD23 LEU 96 HD23 LEU 96 -8.509 15.041 6.759 655 H THR 97 HN THR 97 -5.365 18.713 4.131 656 HA THR 97 HA THR 97 -7.622 18.561 2.346 657 HB THR 97 HB THR 97 -5.695 20.798 3.020 658 HG1 THR 97 HG1 THR 97 -7.052 21.100 4.573 659 HG21 THR 97 HG21 THR 97 -7.932 20.640 1.047 660 HG22 THR 97 HG22 THR 97 -6.425 21.553 0.962 661 HG23 THR 97 HG23 THR 97 -7.748 22.126 1.977 662 H SER 98 HN SER 98 -4.192 19.423 1.763 663 HA SER 98 HA SER 98 -4.414 19.644 -1.065 664 HB2 SER 98 HB2 SER 98 -1.988 18.696 0.486 665 HB3 SER 98 HB1 SER 98 -1.997 19.456 -1.106 666 HG SER 98 HG SER 98 -1.581 20.790 0.889 667 H ALA 99 HN ALA 99 -3.885 16.837 1.020 668 HA ALA 99 HA ALA 99 -3.240 14.996 -1.095 669 HB1 ALA 99 HB1 ALA 99 -3.740 13.247 0.562 670 HB2 ALA 99 HB2 ALA 99 -4.500 14.446 1.608 671 HB3 ALA 99 HB3 ALA 99 -2.768 14.526 1.289 672 H PHE 100 HN PHE 100 -6.286 15.961 0.441 673 HA PHE 100 HA PHE 100 -8.030 14.066 -0.687 674 HB2 PHE 100 HB1 PHE 100 -8.251 16.780 0.414 675 HB3 PHE 100 HB2 PHE 100 -9.484 16.414 -0.791 676 HD1 PHE 100 HD1 PHE 100 -10.683 14.096 -0.553 677 HD2 PHE 100 HD2 PHE 100 -8.531 16.044 2.616 678 HE1 PHE 100 HE1 PHE 100 -11.918 12.741 1.119 679 HE2 PHE 100 HE2 PHE 100 -9.763 14.688 4.283 680 HZ PHE 100 HZ PHE 100 -11.460 13.043 3.538 681 H TYR 101 HN TYR 101 -7.162 17.259 -2.039 682 HA TYR 101 HA TYR 101 -8.520 16.773 -4.536 683 HB2 TYR 101 HB2 TYR 101 -6.290 18.756 -4.179 684 HB3 TYR 101 HB1 TYR 101 -7.740 18.893 -5.176 685 HD1 TYR 101 HD1 TYR 101 -9.876 18.053 -3.366 686 HD2 TYR 101 HD2 TYR 101 -6.418 20.476 -2.572 687 HE1 TYR 101 HE1 TYR 101 -11.071 19.134 -1.476 688 HE2 TYR 101 HE2 TYR 101 -7.613 21.562 -0.690 689 HH TYR 101 HH TYR 101 -10.954 21.278 -0.223 690 H GLN 102 HN GLN 102 -5.224 16.253 -3.417 691 HA GLN 102 HA GLN 102 -4.205 15.714 -6.099 692 HB2 GLN 102 HB2 GLN 102 -3.012 15.068 -3.386 693 HB3 GLN 102 HB1 GLN 102 -2.160 15.003 -4.929 694 HG2 GLN 102 HG2 GLN 102 -3.539 17.525 -4.021 695 HG3 GLN 102 HG1 GLN 102 -1.899 17.146 -3.494 696 HE21 GLN 102 HE21 GLN 102 -3.272 19.089 -5.643 697 HE22 GLN 102 HE22 GLN 102 -2.250 18.911 -6.986 698 H THR 103 HN THR 103 -5.893 13.882 -3.697 699 HA THR 103 HA THR 103 -4.977 11.340 -4.943 700 HB THR 103 HB THR 103 -6.083 10.260 -2.999 701 HG1 THR 103 HG1 THR 103 -6.895 11.593 -1.384 702 HG21 THR 103 HG21 THR 103 -4.524 12.127 -1.476 703 HG22 THR 103 HG22 THR 103 -3.749 11.872 -3.038 704 HG23 THR 103 HG23 THR 103 -4.093 10.496 -1.989 705 H THR 104 HN THR 104 -8.125 12.685 -3.797 706 HA THR 104 HA THR 104 -9.339 11.310 -6.163 707 HB THR 104 HB THR 104 -10.360 11.484 -3.323 708 HG1 THR 104 HG1 THR 104 -9.403 9.617 -3.399 709 HG21 THR 104 HG21 THR 104 -12.298 11.943 -4.590 710 HG22 THR 104 HG22 THR 104 -12.344 10.195 -4.365 711 HG23 THR 104 HG23 THR 104 -11.799 10.872 -5.899 712 H GLY 105 HN GLY 105 -9.719 13.995 -3.836 713 HA2 GLY 105 HA2 GLY 105 -10.217 16.245 -4.711 714 HA3 GLY 105 HA1 GLY 105 -11.116 15.482 -6.018 715 H VAL 106 HN VAL 106 -11.196 14.962 -2.482 716 HA VAL 106 HA VAL 106 -14.137 15.482 -2.611 717 HB VAL 106 HB VAL 106 -12.699 13.908 -0.468 718 HG11 VAL 106 HG21 VAL 106 -15.128 12.887 -0.492 719 HG12 VAL 106 HG22 VAL 106 -15.545 14.397 -1.299 720 HG13 VAL 106 HG23 VAL 106 -14.836 14.427 0.316 721 HG21 VAL 106 HG11 VAL 106 -12.736 12.004 -1.730 722 HG22 VAL 106 HG12 VAL 106 -12.693 13.136 -3.082 723 HG23 VAL 106 HG13 VAL 106 -14.231 12.459 -2.548 724 H VAL 107 HN VAL 107 -14.964 16.237 -0.350 725 HA VAL 107 HA VAL 107 -13.581 18.701 0.286 726 HB VAL 107 HB VAL 107 -15.336 18.771 2.154 727 HG11 VAL 107 HG21 VAL 107 -17.212 18.670 0.185 728 HG12 VAL 107 HG22 VAL 107 -15.740 18.769 -0.781 729 HG13 VAL 107 HG23 VAL 107 -16.103 20.024 0.403 730 HG21 VAL 107 HG11 VAL 107 -16.711 16.562 0.685 731 HG22 VAL 107 HG12 VAL 107 -16.874 17.057 2.370 732 HG23 VAL 107 HG13 VAL 107 -15.471 16.117 1.858 733 H ASN 108 HN ASN 108 -11.882 18.875 1.646 734 HA ASN 108 HA ASN 108 -10.940 16.658 3.233 735 HB2 ASN 108 HB2 ASN 108 -9.203 18.163 3.969 736 HB3 ASN 108 HB1 ASN 108 -9.500 18.492 2.261 737 HD21 ASN 108 HD21 ASN 108 -9.616 20.700 1.853 738 HD22 ASN 108 HD22 ASN 108 -10.271 21.858 2.907 739 H SER 109 HN SER 109 -13.107 19.297 3.838 740 HA SER 109 HA SER 109 -12.900 19.609 6.623 741 HB2 SER 109 HB2 SER 109 -15.209 20.385 6.559 742 HB3 SER 109 HB1 SER 109 -14.357 20.970 5.130 743 HG SER 109 HG SER 109 -15.927 20.049 4.098 744 H ARG 110 HN ARG 110 -14.392 16.974 4.801 745 HA ARG 110 HA ARG 110 -15.876 15.877 7.008 746 HB2 ARG 110 HB2 ARG 110 -14.709 14.385 4.641 747 HB3 ARG 110 HB1 ARG 110 -16.053 13.864 5.658 748 HG2 ARG 110 HG1 ARG 110 -17.302 15.926 4.952 749 HG3 ARG 110 HG2 ARG 110 -15.990 16.278 3.827 750 HD2 ARG 110 HD1 ARG 110 -17.865 15.077 2.719 751 HD3 ARG 110 HD2 ARG 110 -16.369 14.145 2.678 752 HE ARG 110 HE ARG 110 -18.710 13.553 4.418 753 HH11 ARG 110 HH21 ARG 110 -17.150 11.958 2.153 754 HH12 ARG 110 HH22 ARG 110 -16.476 10.698 3.132 755 HH21 ARG 110 HH11 ARG 110 -17.175 12.293 6.131 756 HH22 ARG 110 HH12 ARG 110 -16.490 10.888 5.384 757 H PHE 111 HN PHE 111 -12.733 14.843 5.615 758 HA PHE 111 HA PHE 111 -12.213 13.058 7.852 759 HB2 PHE 111 HB2 PHE 111 -11.304 12.966 5.397 760 HB3 PHE 111 HB1 PHE 111 -10.072 14.070 6.004 761 HD1 PHE 111 HD1 PHE 111 -11.821 11.233 7.708 762 HD2 PHE 111 HD2 PHE 111 -8.107 12.799 6.221 763 HE1 PHE 111 HE1 PHE 111 -10.608 9.324 8.725 764 HE2 PHE 111 HE2 PHE 111 -6.894 10.890 7.238 765 HZ PHE 111 HZ PHE 111 -8.145 9.152 8.491 766 H ILE 112 HN ILE 112 -10.779 16.149 6.786 767 HA ILE 112 HA ILE 112 -8.970 16.479 8.921 768 HB ILE 112 HB ILE 112 -10.468 18.490 7.234 769 HG12 ILE 112 HG12 ILE 112 -7.592 17.525 7.272 770 HG13 ILE 112 HG11 ILE 112 -8.819 17.048 6.098 771 HG21 ILE 112 HG21 ILE 112 -9.955 19.797 9.112 772 HG22 ILE 112 HG22 ILE 112 -8.516 20.004 8.112 773 HG23 ILE 112 HG23 ILE 112 -8.492 18.879 9.470 774 HD11 ILE 112 HD11 ILE 112 -9.068 19.645 5.743 775 HD12 ILE 112 HD12 ILE 112 -7.746 18.779 4.962 776 HD13 ILE 112 HD13 ILE 112 -7.449 19.699 6.437 777 H SER 113 HN SER 113 -12.404 17.454 8.737 778 HA SER 113 HA SER 113 -12.497 18.838 11.219 779 HB2 SER 113 HB2 SER 113 -14.619 17.244 9.760 780 HB3 SER 113 HB1 SER 113 -14.949 18.211 11.196 781 HG SER 113 HG SER 113 -13.698 19.869 9.794 782 H GLU 114 HN GLU 114 -12.702 15.383 10.483 783 HA GLU 114 HA GLU 114 -13.453 14.609 13.172 784 HB2 GLU 114 HB2 GLU 114 -12.167 13.011 10.938 785 HB3 GLU 114 HB1 GLU 114 -12.826 12.322 12.422 786 HG2 GLU 114 HG2 GLU 114 -15.046 13.266 11.862 787 HG3 GLU 114 HG1 GLU 114 -14.381 13.926 10.367 788 H ILE 115 HN ILE 115 -10.351 14.605 11.393 789 HA ILE 115 HA ILE 115 -8.797 13.636 13.604 790 HB ILE 115 HB ILE 115 -7.983 15.302 11.205 791 HG12 ILE 115 HG12 ILE 115 -7.651 12.334 11.714 792 HG13 ILE 115 HG11 ILE 115 -8.997 13.015 10.799 793 HG21 ILE 115 HG21 ILE 115 -5.856 13.702 12.184 794 HG22 ILE 115 HG22 ILE 115 -6.531 14.550 13.576 795 HG23 ILE 115 HG23 ILE 115 -5.960 15.464 12.179 796 HD11 ILE 115 HD11 ILE 115 -6.090 12.883 10.087 797 HD12 ILE 115 HD12 ILE 115 -7.041 14.242 9.486 798 HD13 ILE 115 HD13 ILE 115 -7.504 12.591 9.074 799 H ARG 116 HN ARG 116 -9.595 16.916 12.483 800 HA ARG 116 HA ARG 116 -7.921 18.392 14.207 801 HB2 ARG 116 HB2 ARG 116 -9.140 19.598 12.552 802 HB3 ARG 116 HB1 ARG 116 -10.684 18.958 13.114 803 HG2 ARG 116 HG2 ARG 116 -10.655 20.295 15.067 804 HG3 ARG 116 HG1 ARG 116 -8.932 20.630 14.915 805 HD2 ARG 116 HD2 ARG 116 -9.881 22.621 14.130 806 HD3 ARG 116 HD1 ARG 116 -9.620 21.725 12.633 807 HE ARG 116 HE ARG 116 -12.276 21.651 13.997 808 HH11 ARG 116 HH11 ARG 116 -10.783 23.567 11.768 809 HH12 ARG 116 HH12 ARG 116 -11.835 23.199 10.443 810 HH21 ARG 116 HH21 ARG 116 -13.414 20.580 12.078 811 HH22 ARG 116 HH22 ARG 116 -13.324 21.508 10.618 812 H SER 117 HN SER 117 -11.208 17.135 14.834 813 HA SER 117 HA SER 117 -11.265 18.126 17.555 814 HB2 SER 117 HB2 SER 117 -13.321 17.611 16.245 815 HB3 SER 117 HB1 SER 117 -12.897 15.899 16.296 816 HG SER 117 HG SER 117 -13.278 15.839 18.416 817 H LEU 118 HN LEU 118 -10.290 15.092 16.033 818 HA LEU 118 HA LEU 118 -10.042 13.593 18.483 819 HB2 LEU 118 HB2 LEU 118 -8.818 13.268 15.735 820 HB3 LEU 118 HB1 LEU 118 -8.505 12.138 17.052 821 HG LEU 118 HG LEU 118 -11.209 12.826 15.865 822 HD11 LEU 118 HD11 LEU 118 -9.629 10.237 15.952 823 HD12 LEU 118 HD12 LEU 118 -9.816 11.268 14.533 824 HD13 LEU 118 HD13 LEU 118 -11.220 10.453 15.221 825 HD21 LEU 118 HD21 LEU 118 -11.462 10.634 17.573 826 HD22 LEU 118 HD22 LEU 118 -12.025 12.273 17.899 827 HD23 LEU 118 HD23 LEU 118 -10.438 11.757 18.467 828 H ILE 119 HN ILE 119 -7.743 15.522 16.563 829 HA ILE 119 HA ILE 119 -5.414 14.931 18.081 830 HB ILE 119 HB ILE 119 -6.158 17.498 16.644 831 HG12 ILE 119 HG12 ILE 119 -4.371 15.263 15.672 832 HG13 ILE 119 HG11 ILE 119 -6.106 15.269 15.354 833 HG21 ILE 119 HG21 ILE 119 -4.327 17.941 18.147 834 HG22 ILE 119 HG22 ILE 119 -3.639 17.747 16.535 835 HG23 ILE 119 HG23 ILE 119 -3.527 16.433 17.705 836 HD11 ILE 119 HD11 ILE 119 -4.463 16.362 13.613 837 HD12 ILE 119 HD12 ILE 119 -4.480 17.721 14.738 838 HD13 ILE 119 HD13 ILE 119 -5.984 17.169 13.999 839 H GLY 120 HN GLY 120 -7.882 17.465 18.523 840 HA2 GLY 120 HA2 GLY 120 -6.646 18.792 20.713 841 HA3 GLY 120 HA1 GLY 120 -8.381 18.777 20.402 842 H MET 121 HN MET 121 -8.749 15.933 20.609 843 HA MET 121 HA MET 121 -9.246 15.632 23.367 844 HB2 MET 121 HB1 MET 121 -10.246 14.198 21.598 845 HB3 MET 121 HB2 MET 121 -8.680 13.420 21.368 846 HG2 MET 121 HG1 MET 121 -8.705 12.711 23.748 847 HG3 MET 121 HG2 MET 121 -10.299 13.442 23.934 848 HE1 MET 121 HE1 MET 121 -9.053 10.387 20.921 849 HE2 MET 121 HE2 MET 121 -8.629 9.832 22.538 850 HE3 MET 121 HE3 MET 121 -8.075 11.410 21.983 851 H PHE 122 HN PHE 122 -6.434 14.530 21.467 852 HA PHE 122 HA PHE 122 -5.081 13.193 23.578 853 HB2 PHE 122 HB2 PHE 122 -3.926 14.714 21.222 854 HB3 PHE 122 HB1 PHE 122 -3.026 13.587 22.238 855 HD1 PHE 122 HD2 PHE 122 -3.497 11.178 22.180 856 HD2 PHE 122 HD1 PHE 122 -5.617 13.930 19.652 857 HE1 PHE 122 HE2 PHE 122 -4.327 9.283 20.812 858 HE2 PHE 122 HE1 PHE 122 -6.446 12.034 18.284 859 HZ PHE 122 HZ PHE 122 -5.801 9.711 18.865 860 H ALA 123 HN ALA 123 -5.104 16.617 22.634 861 HA ALA 123 HA ALA 123 -3.042 17.533 24.344 862 HB1 ALA 123 HB1 ALA 123 -3.825 19.674 23.901 863 HB2 ALA 123 HB2 ALA 123 -5.516 19.184 23.997 864 HB3 ALA 123 HB3 ALA 123 -4.564 18.786 22.568 865 H GLN 124 HN GLN 124 -6.401 16.725 25.026 866 HA GLN 124 HA GLN 124 -6.432 17.846 27.690 867 HB2 GLN 124 HB2 GLN 124 -8.128 15.621 26.517 868 HB3 GLN 124 HB1 GLN 124 -8.485 16.529 27.987 869 HG2 GLN 124 HG2 GLN 124 -8.432 18.634 26.562 870 HG3 GLN 124 HG1 GLN 124 -8.376 17.580 25.149 871 HE21 GLN 124 HE21 GLN 124 -10.125 15.519 26.487 872 HE22 GLN 124 HE22 GLN 124 -11.689 16.177 26.504 873 H ALA 125 HN ALA 125 -5.458 14.753 26.325 874 HA ALA 125 HA ALA 125 -5.290 13.361 28.857 875 HB1 ALA 125 HB1 ALA 125 -3.563 12.647 26.507 876 HB2 ALA 125 HB2 ALA 125 -5.310 12.435 26.387 877 HB3 ALA 125 HB3 ALA 125 -4.403 11.583 27.637 878 H SER 126 HN SER 126 -3.130 15.442 27.030 879 HA SER 126 HA SER 126 -0.759 14.772 28.573 880 HB2 SER 126 HB1 SER 126 0.278 16.636 27.427 881 HB3 SER 126 HB2 SER 126 -0.722 15.771 26.260 882 HG SER 126 HG SER 126 -1.084 18.004 26.140 883 H ALA 127 HN ALA 127 -3.500 16.816 29.063 884 HA ALA 127 HA ALA 127 -2.322 18.764 30.805 885 HB1 ALA 127 HB1 ALA 127 -5.004 18.170 31.629 886 HB2 ALA 127 HB2 ALA 127 -4.931 18.108 29.868 887 HB3 ALA 127 HB3 ALA 127 -4.424 19.565 30.722 888 H ASN 128 HN ASN 128 -3.365 15.453 31.293 889 HA ASN 128 HA ASN 128 -3.446 15.569 34.181 890 HB2 ASN 128 HB1 ASN 128 -4.505 13.774 32.732 891 HB3 ASN 128 HB2 ASN 128 -2.884 13.130 32.475 892 HD21 ASN 128 HD21 ASN 128 -2.142 11.675 34.043 893 HD22 ASN 128 HD22 ASN 128 -2.827 11.479 35.583 894 H ASP 129 HN ASP 129 -0.887 15.830 32.022 895 HA ASP 129 HA ASP 129 1.105 14.370 33.584 896 HB2 ASP 129 HB2 ASP 129 1.290 14.799 31.104 897 HB3 ASP 129 HB1 ASP 129 1.564 16.500 31.478 898 H VAL 130 HN VAL 130 0.088 17.753 33.222 899 HA VAL 130 HA VAL 130 2.143 18.903 34.839 900 HB VAL 130 HB VAL 130 0.730 20.303 33.436 901 HG11 VAL 130 HG11 VAL 130 -1.410 19.528 33.275 902 HG12 VAL 130 HG12 VAL 130 -1.695 20.597 34.649 903 HG13 VAL 130 HG13 VAL 130 -1.401 18.880 34.916 904 HG21 VAL 130 HG21 VAL 130 1.559 21.589 35.211 905 HG22 VAL 130 HG22 VAL 130 0.601 20.724 36.413 906 HG23 VAL 130 HG23 VAL 130 -0.177 21.872 35.324 907 H TYR 131 HN TYR 131 -0.858 17.264 35.648 908 HA TYR 131 HA TYR 131 -0.081 16.686 38.311 909 HB2 TYR 131 HB2 TYR 131 -1.361 18.246 39.629 910 HB3 TYR 131 HB1 TYR 131 -0.362 19.196 38.531 911 HD1 TYR 131 HD1 TYR 131 -3.784 17.972 39.214 912 HD2 TYR 131 HD2 TYR 131 -1.337 20.463 36.711 913 HE1 TYR 131 HE1 TYR 131 -5.821 19.033 38.278 914 HE2 TYR 131 HE2 TYR 131 -3.374 21.523 35.776 915 HH TYR 131 HH TYR 131 -6.538 20.936 37.128 916 H ALA 132 HN ALA 132 -1.859 15.635 39.519 917 HA ALA 132 HA ALA 132 -3.610 14.163 37.765 918 HB1 ALA 132 HB1 ALA 132 -4.200 12.935 39.649 919 HB2 ALA 132 HB2 ALA 132 -4.127 14.340 40.714 920 HB3 ALA 132 HB3 ALA 132 -2.638 13.575 40.158 921 H SER 133 HN SER 133 -5.451 14.961 36.889 922 HA SER 133 HA SER 133 -6.661 17.423 37.755 923 HB2 SER 133 HB2 SER 133 -8.371 16.949 36.106 924 HB3 SER 133 HB1 SER 133 -6.815 16.463 35.432 925 HG SER 133 HG SER 133 -8.747 14.952 35.380 926 H ALA 134 HN ALA 134 -7.201 14.050 38.558 927 HA ALA 134 HA ALA 134 -9.758 14.572 39.887 928 HB1 ALA 134 HB1 ALA 134 -8.029 12.134 40.312 929 HB2 ALA 134 HB2 ALA 134 -8.962 12.344 38.829 930 HB3 ALA 134 HB3 ALA 134 -9.787 12.260 40.386 931 H GLY 135 HN GLY 135 -10.073 14.464 42.197 932 HA2 GLY 135 HA2 GLY 135 -9.395 14.591 44.470 933 HA3 GLY 135 HA1 GLY 135 -7.720 14.424 43.951 934 H SER 136 HN SER 136 -9.506 16.781 42.223 935 HA SER 136 HA SER 136 -8.216 18.927 43.861 936 HB2 SER 136 HB2 SER 136 -8.045 20.242 41.810 937 HB3 SER 136 HB1 SER 136 -7.293 18.668 41.554 938 HG SER 136 HG SER 136 -9.186 17.983 40.534 939 H GLY 137 HN GLY 137 -9.445 20.889 44.140 940 HA2 GLY 137 HA2 GLY 137 -11.889 21.636 43.131 941 HA3 GLY 137 HA1 GLY 137 -12.324 20.414 44.327 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -16.088 13.844 -16.825 2 H2 GLY 1 HT2 GLY 1 -17.453 13.101 -16.139 3 H3 GLY 1 HT3 GLY 1 -17.106 12.890 -17.789 4 HA2 GLY 1 HA2 GLY 1 -16.339 10.918 -16.941 5 HA3 GLY 1 HA1 GLY 1 -14.883 11.913 -16.925 6 H MET 2 HN MET 2 -15.576 9.669 -15.135 7 HA MET 2 HA MET 2 -15.579 11.168 -12.544 8 HB2 MET 2 HB2 MET 2 -16.690 8.408 -13.137 9 HB3 MET 2 HB1 MET 2 -16.602 9.136 -11.533 10 HG2 MET 2 HG2 MET 2 -17.983 11.051 -12.402 11 HG3 MET 2 HG1 MET 2 -18.181 10.159 -13.911 12 HE1 MET 2 HE1 MET 2 -18.089 9.169 -10.097 13 HE2 MET 2 HE2 MET 2 -19.817 9.135 -9.756 14 HE3 MET 2 HE3 MET 2 -19.060 10.637 -10.281 15 H GLY 3 HN GLY 3 -14.214 10.234 -10.868 16 HA2 GLY 3 HA2 GLY 3 -11.769 9.051 -11.979 17 HA3 GLY 3 HA1 GLY 3 -12.004 9.567 -10.309 18 H GLN 4 HN GLN 4 -10.787 7.252 -10.368 19 HA GLN 4 HA GLN 4 -12.402 4.910 -10.735 20 HB2 GLN 4 HB2 GLN 4 -9.965 5.370 -8.989 21 HB3 GLN 4 HB1 GLN 4 -10.663 3.788 -9.332 22 HG2 GLN 4 HG2 GLN 4 -10.257 4.090 -11.724 23 HG3 GLN 4 HG1 GLN 4 -9.655 5.724 -11.440 24 HE21 GLN 4 HE21 GLN 4 -8.020 3.686 -12.661 25 HE22 GLN 4 HE22 GLN 4 -6.759 3.302 -11.592 26 H ALA 5 HN ALA 5 -12.002 7.146 -8.058 27 HA ALA 5 HA ALA 5 -14.329 5.915 -6.747 28 HB1 ALA 5 HB1 ALA 5 -11.860 6.310 -5.067 29 HB2 ALA 5 HB2 ALA 5 -12.118 4.794 -5.930 30 HB3 ALA 5 HB3 ALA 5 -13.286 5.330 -4.723 31 H ASN 6 HN ASN 6 -15.256 7.344 -5.128 32 HA ASN 6 HA ASN 6 -14.576 10.175 -5.640 33 HB2 ASN 6 HB2 ASN 6 -16.829 8.928 -4.033 34 HB3 ASN 6 HB1 ASN 6 -16.662 10.646 -4.393 35 HD21 ASN 6 HD21 ASN 6 -18.940 9.143 -5.291 36 HD22 ASN 6 HD22 ASN 6 -18.873 9.005 -6.981 37 H THR 7 HN THR 7 -13.243 7.998 -3.705 38 HA THR 7 HA THR 7 -12.610 10.017 -1.635 39 HB THR 7 HB THR 7 -12.885 7.529 -0.276 40 HG1 THR 7 HG1 THR 7 -15.260 7.456 -0.597 41 HG21 THR 7 HG21 THR 7 -14.498 10.091 -0.193 42 HG22 THR 7 HG22 THR 7 -13.057 9.730 0.757 43 HG23 THR 7 HG23 THR 7 -14.546 8.828 1.037 44 HA PRO 8 HA PRO 8 -8.574 8.285 -2.269 45 HB2 PRO 8 HB2 PRO 8 -7.368 9.113 0.001 46 HB3 PRO 8 HB1 PRO 8 -7.740 10.195 -1.342 47 HG2 PRO 8 HG2 PRO 8 -9.209 9.785 1.226 48 HG3 PRO 8 HG1 PRO 8 -8.864 11.289 0.372 49 HD2 PRO 8 HD2 PRO 8 -11.284 10.057 0.255 50 HD3 PRO 8 HD1 PRO 8 -10.642 11.024 -1.071 51 H TRP 9 HN TRP 9 -10.182 7.691 0.866 52 HA TRP 9 HA TRP 9 -8.459 5.346 1.331 53 HB2 TRP 9 HB2 TRP 9 -9.917 5.016 3.351 54 HB3 TRP 9 HB1 TRP 9 -9.117 6.589 3.303 55 HD1 TRP 9 HD1 TRP 9 -12.522 4.930 2.916 56 HE1 TRP 9 HE1 TRP 9 -14.354 6.744 3.019 57 HE3 TRP 9 HE3 TRP 9 -9.610 9.116 2.903 58 HZ2 TRP 9 HZ2 TRP 9 -14.552 9.600 3.089 59 HZ3 TRP 9 HZ3 TRP 9 -10.640 11.368 2.986 60 HH2 TRP 9 HH2 TRP 9 -13.106 11.617 3.081 61 H SER 10 HN SER 10 -11.614 6.081 0.021 62 HA SER 10 HA SER 10 -12.787 3.483 0.257 63 HB2 SER 10 HB2 SER 10 -14.318 4.197 -1.478 64 HB3 SER 10 HB1 SER 10 -14.002 5.577 -0.427 65 HG SER 10 HG SER 10 -13.727 6.341 -2.447 66 H SER 11 HN SER 11 -10.102 4.534 -1.550 67 HA SER 11 HA SER 11 -10.244 2.034 -3.177 68 HB2 SER 11 HB2 SER 11 -9.282 3.170 -5.070 69 HB3 SER 11 HB1 SER 11 -10.660 4.132 -4.536 70 HG SER 11 HG SER 11 -9.331 5.701 -4.229 71 H LYS 12 HN LYS 12 -8.208 1.012 -3.519 72 HA LYS 12 HA LYS 12 -6.296 1.409 -1.373 73 HB2 LYS 12 HB2 LYS 12 -6.950 -0.773 -2.632 74 HB3 LYS 12 HB1 LYS 12 -5.763 -0.249 -3.824 75 HG2 LYS 12 HG2 LYS 12 -4.114 -0.001 -1.909 76 HG3 LYS 12 HG1 LYS 12 -5.302 -0.803 -0.882 77 HD2 LYS 12 HD2 LYS 12 -3.526 -2.320 -1.921 78 HD3 LYS 12 HD1 LYS 12 -5.200 -2.813 -2.171 79 HE2 LYS 12 HE2 LYS 12 -5.195 -2.147 -4.418 80 HE3 LYS 12 HE1 LYS 12 -3.841 -1.041 -4.187 81 HZ1 LYS 12 HZ1 LYS 12 -3.784 -3.998 -4.299 82 HZ2 LYS 12 HZ2 LYS 12 -2.487 -3.090 -3.683 83 HZ3 LYS 12 HZ3 LYS 12 -2.971 -2.895 -5.300 84 H ALA 13 HN ALA 13 -6.356 2.143 -4.846 85 HA ALA 13 HA ALA 13 -3.603 2.966 -5.009 86 HB1 ALA 13 HB1 ALA 13 -4.331 2.787 -7.157 87 HB2 ALA 13 HB2 ALA 13 -4.875 4.450 -6.941 88 HB3 ALA 13 HB3 ALA 13 -6.005 3.116 -6.712 89 H ASN 14 HN ASN 14 -6.627 4.831 -4.634 90 HA ASN 14 HA ASN 14 -5.231 7.339 -4.243 91 HB2 ASN 14 HB2 ASN 14 -8.044 6.710 -3.328 92 HB3 ASN 14 HB1 ASN 14 -7.379 8.274 -3.800 93 HD21 ASN 14 HD21 ASN 14 -6.012 7.467 -6.196 94 HD22 ASN 14 HD22 ASN 14 -7.184 7.019 -7.339 95 H ALA 15 HN ALA 15 -6.307 4.737 -2.135 96 HA ALA 15 HA ALA 15 -6.216 6.174 0.335 97 HB1 ALA 15 HB1 ALA 15 -7.222 4.111 0.604 98 HB2 ALA 15 HB2 ALA 15 -5.601 3.731 1.187 99 HB3 ALA 15 HB3 ALA 15 -6.072 3.296 -0.457 100 H ASP 16 HN ASP 16 -3.716 4.321 -1.387 101 HA ASP 16 HA ASP 16 -1.685 4.745 0.615 102 HB2 ASP 16 HB2 ASP 16 -1.551 2.953 -1.104 103 HB3 ASP 16 HB1 ASP 16 -1.353 4.186 -2.349 104 H ALA 17 HN ALA 17 -2.288 6.339 -2.538 105 HA ALA 17 HA ALA 17 -0.215 8.252 -2.368 106 HB1 ALA 17 HB1 ALA 17 -1.152 9.127 -4.245 107 HB2 ALA 17 HB2 ALA 17 -2.744 9.261 -3.500 108 HB3 ALA 17 HB3 ALA 17 -2.210 7.719 -4.168 109 H PHE 18 HN PHE 18 -3.539 8.391 -1.093 110 HA PHE 18 HA PHE 18 -3.454 11.063 -0.127 111 HB2 PHE 18 HB1 PHE 18 -5.528 9.729 -0.194 112 HB3 PHE 18 HB2 PHE 18 -4.888 8.664 1.058 113 HD1 PHE 18 HD2 PHE 18 -6.124 12.068 0.319 114 HD2 PHE 18 HD1 PHE 18 -4.742 9.380 3.372 115 HE1 PHE 18 HE2 PHE 18 -6.940 13.629 2.065 116 HE2 PHE 18 HE1 PHE 18 -5.558 10.941 5.116 117 HZ PHE 18 HZ PHE 18 -6.657 13.067 4.464 118 H ILE 19 HN ILE 19 -2.308 8.030 1.291 119 HA ILE 19 HA ILE 19 -1.607 9.225 3.842 120 HB ILE 19 HB ILE 19 -0.768 6.629 2.523 121 HG12 ILE 19 HG12 ILE 19 -2.796 7.304 4.675 122 HG13 ILE 19 HG11 ILE 19 -3.154 6.751 3.040 123 HG21 ILE 19 HG21 ILE 19 0.858 6.626 4.104 124 HG22 ILE 19 HG22 ILE 19 -0.451 6.345 5.252 125 HG23 ILE 19 HG23 ILE 19 0.135 7.983 4.968 126 HD11 ILE 19 HD11 ILE 19 -3.307 4.791 4.360 127 HD12 ILE 19 HD12 ILE 19 -1.877 5.213 5.302 128 HD13 ILE 19 HD13 ILE 19 -1.707 4.692 3.625 129 H ASN 20 HN ASN 20 0.137 8.519 0.829 130 HA ASN 20 HA ASN 20 2.734 9.197 1.869 131 HB2 ASN 20 HB2 ASN 20 3.424 8.495 -0.157 132 HB3 ASN 20 HB1 ASN 20 1.742 8.118 -0.499 133 HD21 ASN 20 HD21 ASN 20 0.472 9.840 -1.667 134 HD22 ASN 20 HD22 ASN 20 1.286 10.974 -2.630 135 H SER 21 HN SER 21 0.410 11.059 -0.108 136 HA SER 21 HA SER 21 1.921 13.473 -0.161 137 HB2 SER 21 HB2 SER 21 0.015 13.173 -1.643 138 HB3 SER 21 HB1 SER 21 -1.077 13.022 -0.266 139 HG SER 21 HG SER 21 -1.263 15.095 -0.454 140 H PHE 22 HN PHE 22 -0.147 12.045 2.266 141 HA PHE 22 HA PHE 22 -0.553 14.401 3.860 142 HB2 PHE 22 HB1 PHE 22 -1.919 12.390 4.167 143 HB3 PHE 22 HB2 PHE 22 -0.494 11.480 4.671 144 HD1 PHE 22 HD2 PHE 22 0.818 12.359 6.717 145 HD2 PHE 22 HD1 PHE 22 -3.168 13.615 5.736 146 HE1 PHE 22 HE2 PHE 22 0.496 13.152 9.045 147 HE2 PHE 22 HE1 PHE 22 -3.492 14.407 8.064 148 HZ PHE 22 HZ PHE 22 -1.659 14.175 9.718 149 H ILE 23 HN ILE 23 1.813 11.733 4.190 150 HA ILE 23 HA ILE 23 3.201 12.908 6.402 151 HB ILE 23 HB ILE 23 4.385 11.078 4.302 152 HG12 ILE 23 HG12 ILE 23 2.230 10.178 5.118 153 HG13 ILE 23 HG11 ILE 23 3.583 9.221 5.712 154 HG21 ILE 23 HG21 ILE 23 5.046 10.772 7.158 155 HG22 ILE 23 HG22 ILE 23 5.563 12.306 6.458 156 HG23 ILE 23 HG23 ILE 23 6.111 10.784 5.752 157 HD11 ILE 23 HD11 ILE 23 3.249 11.248 7.621 158 HD12 ILE 23 HD12 ILE 23 2.785 9.556 7.794 159 HD13 ILE 23 HD13 ILE 23 1.611 10.736 7.214 160 H SER 24 HN SER 24 4.123 12.802 2.938 161 HA SER 24 HA SER 24 6.364 14.534 3.184 162 HB2 SER 24 HB2 SER 24 5.862 13.126 1.185 163 HB3 SER 24 HB1 SER 24 4.540 14.221 0.782 164 HG SER 24 HG SER 24 5.924 15.733 0.219 165 H ALA 25 HN ALA 25 2.925 15.241 2.748 166 HA ALA 25 HA ALA 25 3.376 18.078 2.267 167 HB1 ALA 25 HB1 ALA 25 0.847 16.625 3.098 168 HB2 ALA 25 HB2 ALA 25 1.352 16.918 1.434 169 HB3 ALA 25 HB3 ALA 25 0.934 18.275 2.482 170 H ALA 26 HN ALA 26 2.290 16.143 5.068 171 HA ALA 26 HA ALA 26 1.950 18.392 6.818 172 HB1 ALA 26 HB1 ALA 26 2.199 15.437 7.152 173 HB2 ALA 26 HB2 ALA 26 0.925 16.528 7.699 174 HB3 ALA 26 HB3 ALA 26 2.452 16.444 8.578 175 H SER 27 HN SER 27 4.758 16.435 5.972 176 HA SER 27 HA SER 27 6.463 17.287 8.103 177 HB2 SER 27 HB2 SER 27 7.238 16.527 5.271 178 HB3 SER 27 HB1 SER 27 8.306 16.537 6.675 179 HG SER 27 HG SER 27 7.635 14.595 7.013 180 H ASN 28 HN ASN 28 5.509 18.836 5.101 181 HA ASN 28 HA ASN 28 7.477 21.015 5.631 182 HB2 ASN 28 HB2 ASN 28 5.877 20.343 3.146 183 HB3 ASN 28 HB1 ASN 28 6.957 21.729 3.294 184 HD21 ASN 28 HD21 ASN 28 9.076 20.495 4.780 185 HD22 ASN 28 HD22 ASN 28 9.801 19.311 3.803 186 H THR 29 HN THR 29 4.438 20.358 6.554 187 HA THR 29 HA THR 29 3.264 22.979 5.847 188 HB THR 29 HB THR 29 2.073 20.825 7.611 189 HG1 THR 29 HG1 THR 29 2.351 19.839 5.706 190 HG21 THR 29 HG21 THR 29 -0.024 21.907 7.083 191 HG22 THR 29 HG22 THR 29 0.773 22.992 5.944 192 HG23 THR 29 HG23 THR 29 1.092 23.136 7.673 193 H GLY 30 HN GLY 30 3.192 21.289 8.991 194 HA2 GLY 30 HA2 GLY 30 3.504 23.871 10.349 195 HA3 GLY 30 HA1 GLY 30 3.226 22.314 11.129 196 H SER 31 HN SER 31 4.974 21.246 11.969 197 HA SER 31 HA SER 31 7.695 22.179 11.175 198 HB2 SER 31 HB2 SER 31 7.007 23.266 13.321 199 HB3 SER 31 HB1 SER 31 6.794 21.664 14.027 200 HG SER 31 HG SER 31 8.859 21.526 14.274 201 H PHE 32 HN PHE 32 6.067 19.760 13.264 202 HA PHE 32 HA PHE 32 6.634 17.497 13.618 203 HB2 PHE 32 HB2 PHE 32 6.578 17.920 10.641 204 HB3 PHE 32 HB1 PHE 32 7.006 16.338 11.294 205 HD1 PHE 32 HD2 PHE 32 5.373 15.821 13.516 206 HD2 PHE 32 HD1 PHE 32 4.340 18.043 9.984 207 HE1 PHE 32 HE2 PHE 32 2.976 15.320 13.901 208 HE2 PHE 32 HE1 PHE 32 1.944 17.541 10.372 209 HZ PHE 32 HZ PHE 32 1.261 16.180 12.330 210 H SER 33 HN SER 33 8.636 17.738 14.736 211 HA SER 33 HA SER 33 11.145 18.283 13.514 212 HB2 SER 33 HB1 SER 33 10.630 16.539 15.942 213 HB3 SER 33 HB2 SER 33 12.141 17.353 15.537 214 HG SER 33 HG SER 33 9.692 18.447 16.378 215 H GLN 34 HN GLN 34 12.896 16.751 13.036 216 HA GLN 34 HA GLN 34 12.185 14.677 11.277 217 HB2 GLN 34 HB1 GLN 34 14.697 14.957 12.955 218 HB3 GLN 34 HB2 GLN 34 14.522 13.852 11.592 219 HG2 GLN 34 HG2 GLN 34 14.066 15.756 10.096 220 HG3 GLN 34 HG1 GLN 34 14.214 16.868 11.457 221 HE21 GLN 34 HE21 GLN 34 15.954 17.089 9.203 222 HE22 GLN 34 HE22 GLN 34 17.525 16.674 9.692 223 H ASP 35 HN ASP 35 12.540 14.624 14.775 224 HA ASP 35 HA ASP 35 12.521 11.741 15.025 225 HB2 ASP 35 HB2 ASP 35 11.873 13.960 16.984 226 HB3 ASP 35 HB1 ASP 35 11.896 12.252 17.423 227 H GLN 36 HN GLN 36 10.026 14.254 14.972 228 HA GLN 36 HA GLN 36 7.867 12.456 15.691 229 HB2 GLN 36 HB1 GLN 36 7.721 15.095 14.202 230 HB3 GLN 36 HB2 GLN 36 6.393 14.284 15.030 231 HG2 GLN 36 HG2 GLN 36 8.926 15.301 16.354 232 HG3 GLN 36 HG1 GLN 36 7.349 16.088 16.428 233 HE21 GLN 36 HE21 GLN 36 9.264 14.331 18.367 234 HE22 GLN 36 HE22 GLN 36 8.131 13.356 19.171 235 H MET 37 HN MET 37 9.393 13.463 12.683 236 HA MET 37 HA MET 37 7.396 12.457 10.892 237 HB2 MET 37 HB2 MET 37 10.394 12.770 10.551 238 HB3 MET 37 HB1 MET 37 9.284 12.376 9.237 239 HG2 MET 37 HG2 MET 37 8.015 14.474 9.750 240 HG3 MET 37 HG1 MET 37 9.246 14.882 10.946 241 HE1 MET 37 HE1 MET 37 9.564 17.247 7.889 242 HE2 MET 37 HE2 MET 37 10.181 17.308 9.538 243 HE3 MET 37 HE3 MET 37 8.523 16.789 9.245 244 H GLU 38 HN GLU 38 9.997 10.917 12.685 245 HA GLU 38 HA GLU 38 10.165 8.468 11.270 246 HB2 GLU 38 HB1 GLU 38 11.639 9.214 13.196 247 HB3 GLU 38 HB2 GLU 38 10.326 8.756 14.281 248 HG2 GLU 38 HG1 GLU 38 10.393 6.454 13.411 249 HG3 GLU 38 HG2 GLU 38 11.679 6.906 12.292 250 H ASN 39 HN ASN 39 7.960 9.444 13.901 251 HA ASN 39 HA ASN 39 6.602 6.987 14.215 252 HB2 ASN 39 HB1 ASN 39 5.498 9.805 14.399 253 HB3 ASN 39 HB2 ASN 39 4.682 8.364 15.006 254 HD21 ASN 39 HD21 ASN 39 5.526 10.555 16.718 255 HD22 ASN 39 HD22 ASN 39 6.765 9.994 17.733 256 H MET 40 HN MET 40 6.046 9.619 11.905 257 HA MET 40 HA MET 40 3.711 8.549 10.680 258 HB2 MET 40 HB2 MET 40 5.940 10.212 9.464 259 HB3 MET 40 HB1 MET 40 4.368 9.930 8.713 260 HG2 MET 40 HG1 MET 40 3.273 10.949 10.709 261 HG3 MET 40 HG2 MET 40 4.867 11.306 11.371 262 HE1 MET 40 HE1 MET 40 4.107 13.455 11.740 263 HE2 MET 40 HE2 MET 40 2.711 13.873 10.751 264 HE3 MET 40 HE3 MET 40 4.198 14.806 10.603 265 H SER 41 HN SER 41 7.121 7.813 10.280 266 HA SER 41 HA SER 41 6.818 6.238 7.877 267 HB2 SER 41 HB2 SER 41 9.079 5.614 8.195 268 HB3 SER 41 HB1 SER 41 8.983 7.232 8.890 269 HG SER 41 HG SER 41 8.938 4.745 10.239 270 H LEU 42 HN LEU 42 6.272 5.628 11.261 271 HA LEU 42 HA LEU 42 6.238 2.698 10.854 272 HB2 LEU 42 HB2 LEU 42 5.570 4.319 13.329 273 HB3 LEU 42 HB1 LEU 42 5.820 2.575 13.258 274 HG LEU 42 HG LEU 42 7.896 4.679 12.572 275 HD11 LEU 42 HD11 LEU 42 7.318 4.439 15.014 276 HD12 LEU 42 HD12 LEU 42 8.986 4.013 14.631 277 HD13 LEU 42 HD13 LEU 42 7.794 2.744 14.904 278 HD21 LEU 42 HD21 LEU 42 9.225 2.321 12.902 279 HD22 LEU 42 HD22 LEU 42 8.694 2.934 11.335 280 HD23 LEU 42 HD23 LEU 42 7.713 1.747 12.196 281 H ILE 43 HN ILE 43 4.053 5.378 10.861 282 HA ILE 43 HA ILE 43 1.782 3.439 10.705 283 HB ILE 43 HB ILE 43 1.866 6.128 12.097 284 HG12 ILE 43 HG12 ILE 43 2.685 4.313 13.477 285 HG13 ILE 43 HG11 ILE 43 1.053 4.710 14.017 286 HG21 ILE 43 HG21 ILE 43 -0.613 5.201 12.606 287 HG22 ILE 43 HG22 ILE 43 -0.388 4.527 10.993 288 HG23 ILE 43 HG23 ILE 43 -0.265 6.267 11.246 289 HD11 ILE 43 HD11 ILE 43 2.064 2.258 12.713 290 HD12 ILE 43 HD12 ILE 43 0.527 2.851 12.082 291 HD13 ILE 43 HD13 ILE 43 0.689 2.471 13.796 292 H GLY 44 HN GLY 44 0.085 4.064 9.243 293 HA2 GLY 44 HA2 GLY 44 -0.882 5.359 7.486 294 HA3 GLY 44 HA1 GLY 44 0.462 6.495 7.620 295 H ASN 45 HN ASN 45 2.509 5.892 6.623 296 HA ASN 45 HA ASN 45 2.254 4.637 4.076 297 HB2 ASN 45 HB2 ASN 45 4.081 6.228 4.663 298 HB3 ASN 45 HB1 ASN 45 4.775 5.006 5.728 299 HD21 ASN 45 HD21 ASN 45 6.518 5.703 3.813 300 HD22 ASN 45 HD22 ASN 45 6.550 4.617 2.509 301 H THR 46 HN THR 46 3.137 3.404 7.253 302 HA THR 46 HA THR 46 4.121 0.848 6.425 303 HB THR 46 HB THR 46 2.661 1.590 8.981 304 HG1 THR 46 HG1 THR 46 4.667 2.739 8.320 305 HG21 THR 46 HG21 THR 46 4.362 -0.352 9.699 306 HG22 THR 46 HG22 THR 46 4.098 -0.837 8.025 307 HG23 THR 46 HG23 THR 46 2.729 -0.703 9.130 308 H LEU 47 HN LEU 47 0.878 2.108 7.009 309 HA LEU 47 HA LEU 47 -0.577 -0.322 6.995 310 HB2 LEU 47 HB2 LEU 47 -1.366 2.374 5.842 311 HB3 LEU 47 HB1 LEU 47 -2.482 1.051 6.188 312 HG LEU 47 HG LEU 47 -0.763 2.542 8.194 313 HD11 LEU 47 HD11 LEU 47 -3.118 2.969 9.154 314 HD12 LEU 47 HD12 LEU 47 -3.719 2.438 7.582 315 HD13 LEU 47 HD13 LEU 47 -2.676 3.855 7.694 316 HD21 LEU 47 HD21 LEU 47 -2.107 1.082 9.828 317 HD22 LEU 47 HD22 LEU 47 -0.812 0.283 8.937 318 HD23 LEU 47 HD23 LEU 47 -2.489 0.072 8.434 319 H MET 48 HN MET 48 0.760 1.592 4.340 320 HA MET 48 HA MET 48 -0.534 0.390 2.152 321 HB2 MET 48 HB2 MET 48 2.398 1.160 2.307 322 HB3 MET 48 HB1 MET 48 1.444 0.986 0.835 323 HG2 MET 48 HG2 MET 48 0.022 2.843 1.463 324 HG3 MET 48 HG1 MET 48 0.781 2.945 3.051 325 HE1 MET 48 HE1 MET 48 1.638 5.733 2.652 326 HE2 MET 48 HE2 MET 48 0.292 5.218 1.639 327 HE3 MET 48 HE3 MET 48 1.636 6.105 0.922 328 H ALA 49 HN ALA 49 2.259 -0.764 4.024 329 HA ALA 49 HA ALA 49 2.833 -3.054 2.421 330 HB1 ALA 49 HB1 ALA 49 3.341 -3.761 5.101 331 HB2 ALA 49 HB2 ALA 49 3.605 -2.019 5.015 332 HB3 ALA 49 HB3 ALA 49 4.497 -3.101 3.944 333 H ALA 50 HN ALA 50 0.460 -2.458 4.955 334 HA ALA 50 HA ALA 50 -0.349 -5.179 5.356 335 HB1 ALA 50 HB1 ALA 50 -1.739 -2.524 5.744 336 HB2 ALA 50 HB2 ALA 50 -1.085 -3.601 6.977 337 HB3 ALA 50 HB3 ALA 50 -2.544 -4.053 6.096 338 H MET 51 HN MET 51 -1.285 -2.698 3.019 339 HA MET 51 HA MET 51 -3.570 -3.925 1.908 340 HB2 MET 51 HB2 MET 51 -1.392 -2.341 0.510 341 HB3 MET 51 HB1 MET 51 -2.972 -2.709 -0.182 342 HG2 MET 51 HG2 MET 51 -4.068 -1.515 1.679 343 HG3 MET 51 HG1 MET 51 -2.490 -1.151 2.377 344 HE1 MET 51 HE1 MET 51 -4.635 1.515 1.302 345 HE2 MET 51 HE2 MET 51 -3.048 2.250 1.515 346 HE3 MET 51 HE3 MET 51 -3.545 0.924 2.564 347 H ASP 52 HN ASP 52 -0.136 -4.607 1.398 348 HA ASP 52 HA ASP 52 -0.415 -6.328 -0.857 349 HB2 ASP 52 HB2 ASP 52 1.599 -6.330 1.409 350 HB3 ASP 52 HB1 ASP 52 1.742 -7.349 -0.023 351 H ASN 53 HN ASN 53 -1.132 -6.782 2.519 352 HA ASN 53 HA ASN 53 -1.158 -9.675 2.483 353 HB2 ASN 53 HB2 ASN 53 -1.060 -8.175 4.549 354 HB3 ASN 53 HB1 ASN 53 -2.782 -7.885 4.307 355 HD21 ASN 53 HD21 ASN 53 -4.055 -9.285 5.519 356 HD22 ASN 53 HD22 ASN 53 -3.656 -10.890 5.901 357 H MET 54 HN MET 54 -3.450 -7.168 1.614 358 HA MET 54 HA MET 54 -5.823 -8.768 1.615 359 HB2 MET 54 HB2 MET 54 -5.063 -6.362 -0.067 360 HB3 MET 54 HB1 MET 54 -6.681 -7.060 -0.010 361 HG2 MET 54 HG1 MET 54 -5.143 -5.887 2.328 362 HG3 MET 54 HG2 MET 54 -6.557 -5.179 1.548 363 HE1 MET 54 HE1 MET 54 -8.171 -7.867 0.882 364 HE2 MET 54 HE2 MET 54 -8.848 -6.319 1.383 365 HE3 MET 54 HE3 MET 54 -9.330 -7.794 2.217 366 H GLY 55 HN GLY 55 -3.183 -8.427 -0.675 367 HA2 GLY 55 HA1 GLY 55 -2.627 -10.040 -2.351 368 HA3 GLY 55 HA2 GLY 55 -4.228 -10.757 -2.157 369 H GLY 56 HN GLY 56 -4.242 -7.347 -2.405 370 HA2 GLY 56 HA2 GLY 56 -4.439 -5.954 -4.369 371 HA3 GLY 56 HA1 GLY 56 -4.614 -7.409 -5.350 372 H ARG 57 HN ARG 57 -6.446 -7.468 -2.468 373 HA ARG 57 HA ARG 57 -8.879 -6.583 -3.970 374 HB2 ARG 57 HB2 ARG 57 -10.137 -8.378 -2.945 375 HB3 ARG 57 HB1 ARG 57 -8.703 -9.083 -3.691 376 HG2 ARG 57 HG2 ARG 57 -7.609 -8.725 -1.348 377 HG3 ARG 57 HG1 ARG 57 -9.273 -8.606 -0.774 378 HD2 ARG 57 HD2 ARG 57 -9.747 -10.808 -1.877 379 HD3 ARG 57 HD1 ARG 57 -8.032 -10.935 -2.270 380 HE ARG 57 HE ARG 57 -7.556 -11.139 0.114 381 HH11 ARG 57 HH11 ARG 57 -10.141 -9.588 0.863 382 HH12 ARG 57 HH12 ARG 57 -11.037 -10.849 1.642 383 HH21 ARG 57 HH21 ARG 57 -9.027 -13.396 0.418 384 HH22 ARG 57 HH22 ARG 57 -10.406 -13.004 1.390 385 H ILE 58 HN ILE 58 -9.545 -4.723 -2.992 386 HA ILE 58 HA ILE 58 -9.399 -4.627 -0.007 387 HB ILE 58 HB ILE 58 -9.482 -2.219 -1.834 388 HG12 ILE 58 HG12 ILE 58 -7.471 -3.392 -2.441 389 HG13 ILE 58 HG11 ILE 58 -6.994 -2.107 -1.331 390 HG21 ILE 58 HG21 ILE 58 -10.112 -2.021 0.606 391 HG22 ILE 58 HG22 ILE 58 -8.719 -1.045 0.138 392 HG23 ILE 58 HG23 ILE 58 -8.481 -2.561 1.006 393 HD11 ILE 58 HD11 ILE 58 -5.992 -3.723 -0.106 394 HD12 ILE 58 HD12 ILE 58 -6.804 -5.006 -1.003 395 HD13 ILE 58 HD13 ILE 58 -7.619 -4.228 0.355 396 H THR 59 HN THR 59 -11.189 -3.579 1.067 397 HA THR 59 HA THR 59 -13.667 -3.436 -0.606 398 HB THR 59 HB THR 59 -14.919 -4.541 1.101 399 HG1 THR 59 HG1 THR 59 -13.548 -5.207 3.026 400 HG21 THR 59 HG21 THR 59 -14.023 -6.376 0.100 401 HG22 THR 59 HG22 THR 59 -13.126 -6.536 1.610 402 HG23 THR 59 HG23 THR 59 -12.377 -5.755 0.218 403 HA PRO 60 HA PRO 60 -14.419 0.530 1.212 404 HB2 PRO 60 HB2 PRO 60 -17.107 0.534 1.485 405 HB3 PRO 60 HB1 PRO 60 -16.302 0.665 -0.080 406 HG2 PRO 60 HG2 PRO 60 -17.541 -1.728 1.222 407 HG3 PRO 60 HG1 PRO 60 -17.636 -1.205 -0.462 408 HD2 PRO 60 HD2 PRO 60 -15.968 -3.180 0.350 409 HD3 PRO 60 HD1 PRO 60 -15.578 -2.105 -0.992 410 H SER 61 HN SER 61 -15.921 -2.235 2.852 411 HA SER 61 HA SER 61 -16.492 -0.810 5.300 412 HB2 SER 61 HB2 SER 61 -16.937 -2.988 6.248 413 HB3 SER 61 HB1 SER 61 -17.557 -2.988 4.597 414 HG SER 61 HG SER 61 -15.460 -3.904 4.013 415 H LYS 62 HN LYS 62 -13.826 -2.955 4.283 416 HA LYS 62 HA LYS 62 -12.376 -2.833 6.742 417 HB2 LYS 62 HB2 LYS 62 -11.931 -4.460 4.889 418 HB3 LYS 62 HB1 LYS 62 -11.244 -3.141 3.944 419 HG2 LYS 62 HG2 LYS 62 -9.607 -2.734 5.794 420 HG3 LYS 62 HG1 LYS 62 -10.248 -4.152 6.626 421 HD2 LYS 62 HD2 LYS 62 -9.730 -5.466 4.496 422 HD3 LYS 62 HD1 LYS 62 -8.823 -4.052 3.957 423 HE2 LYS 62 HE2 LYS 62 -7.197 -5.412 5.012 424 HE3 LYS 62 HE1 LYS 62 -7.606 -4.208 6.234 425 HZ1 LYS 62 HZ1 LYS 62 -9.441 -6.179 6.616 426 HZ2 LYS 62 HZ2 LYS 62 -8.039 -5.932 7.545 427 HZ3 LYS 62 HZ3 LYS 62 -8.024 -7.041 6.257 428 H LEU 63 HN LEU 63 -11.980 -0.943 3.730 429 HA LEU 63 HA LEU 63 -9.934 0.780 4.727 430 HB2 LEU 63 HB2 LEU 63 -11.895 0.860 2.479 431 HB3 LEU 63 HB1 LEU 63 -11.102 2.370 2.925 432 HG LEU 63 HG LEU 63 -8.956 1.531 2.433 433 HD11 LEU 63 HD21 LEU 63 -10.140 -1.262 2.315 434 HD12 LEU 63 HD22 LEU 63 -9.260 -0.612 3.698 435 HD13 LEU 63 HD23 LEU 63 -8.436 -0.836 2.157 436 HD21 LEU 63 HD11 LEU 63 -10.855 1.563 0.507 437 HD22 LEU 63 HD12 LEU 63 -10.329 -0.113 0.379 438 HD23 LEU 63 HD13 LEU 63 -9.162 1.194 0.179 439 H GLN 64 HN GLN 64 -13.464 1.001 4.831 440 HA GLN 64 HA GLN 64 -13.726 3.641 5.790 441 HB2 GLN 64 HB2 GLN 64 -15.618 2.072 5.191 442 HB3 GLN 64 HB1 GLN 64 -15.362 1.272 6.742 443 HG2 GLN 64 HG2 GLN 64 -15.710 3.478 7.877 444 HG3 GLN 64 HG1 GLN 64 -16.100 4.182 6.308 445 HE21 GLN 64 HE21 GLN 64 -18.305 4.196 5.860 446 HE22 GLN 64 HE22 GLN 64 -19.442 3.116 6.509 447 H ALA 65 HN ALA 65 -13.186 0.624 7.622 448 HA ALA 65 HA ALA 65 -12.992 1.991 10.175 449 HB1 ALA 65 HB1 ALA 65 -12.080 -0.765 9.292 450 HB2 ALA 65 HB2 ALA 65 -13.588 -0.371 10.118 451 HB3 ALA 65 HB3 ALA 65 -12.049 -0.194 10.961 452 H LEU 66 HN LEU 66 -10.652 0.801 7.775 453 HA LEU 66 HA LEU 66 -8.306 1.454 9.302 454 HB2 LEU 66 HB2 LEU 66 -8.307 -0.066 7.321 455 HB3 LEU 66 HB1 LEU 66 -8.606 1.329 6.285 456 HG LEU 66 HG LEU 66 -6.506 2.349 6.974 457 HD11 LEU 66 HD21 LEU 66 -6.399 -0.006 8.870 458 HD12 LEU 66 HD22 LEU 66 -6.351 1.710 9.272 459 HD13 LEU 66 HD23 LEU 66 -4.973 0.953 8.472 460 HD21 LEU 66 HD11 LEU 66 -5.295 1.076 5.542 461 HD22 LEU 66 HD12 LEU 66 -6.731 0.057 5.439 462 HD23 LEU 66 HD13 LEU 66 -5.439 -0.354 6.566 463 H ASP 67 HN ASP 67 -9.926 3.205 6.626 464 HA ASP 67 HA ASP 67 -8.329 5.477 6.503 465 HB2 ASP 67 HB1 ASP 67 -10.390 4.996 5.119 466 HB3 ASP 67 HB2 ASP 67 -11.355 5.563 6.479 467 H MET 68 HN MET 68 -10.706 4.631 8.974 468 HA MET 68 HA MET 68 -10.672 7.216 10.279 469 HB2 MET 68 HB2 MET 68 -11.490 4.459 11.236 470 HB3 MET 68 HB1 MET 68 -11.685 5.923 12.200 471 HG2 MET 68 HG2 MET 68 -13.025 6.912 10.323 472 HG3 MET 68 HG1 MET 68 -12.923 5.361 9.489 473 HE1 MET 68 HE1 MET 68 -14.942 6.185 13.533 474 HE2 MET 68 HE2 MET 68 -14.580 7.431 12.341 475 HE3 MET 68 HE3 MET 68 -13.263 6.546 13.109 476 H ALA 69 HN ALA 69 -8.848 4.204 10.676 477 HA ALA 69 HA ALA 69 -7.498 4.975 13.094 478 HB1 ALA 69 HB1 ALA 69 -5.786 3.292 11.587 479 HB2 ALA 69 HB2 ALA 69 -7.436 2.773 11.237 480 HB3 ALA 69 HB3 ALA 69 -6.862 2.825 12.904 481 H PHE 70 HN PHE 70 -6.651 5.312 9.649 482 HA PHE 70 HA PHE 70 -4.040 6.340 9.951 483 HB2 PHE 70 HB1 PHE 70 -5.033 5.780 7.759 484 HB3 PHE 70 HB2 PHE 70 -6.133 7.150 7.907 485 HD1 PHE 70 HD2 PHE 70 -2.574 6.160 7.559 486 HD2 PHE 70 HD1 PHE 70 -5.390 9.402 7.512 487 HE1 PHE 70 HE2 PHE 70 -0.835 7.657 6.623 488 HE2 PHE 70 HE1 PHE 70 -3.650 10.900 6.574 489 HZ PHE 70 HZ PHE 70 -1.371 10.027 6.129 490 H ALA 71 HN ALA 71 -7.169 7.989 10.210 491 HA ALA 71 HA ALA 71 -6.049 10.641 10.454 492 HB1 ALA 71 HB1 ALA 71 -8.674 9.407 10.532 493 HB2 ALA 71 HB2 ALA 71 -8.238 11.067 10.130 494 HB3 ALA 71 HB3 ALA 71 -8.509 10.609 11.811 495 H SER 72 HN SER 72 -7.089 8.191 12.824 496 HA SER 72 HA SER 72 -6.591 9.845 15.128 497 HB2 SER 72 HB1 SER 72 -6.821 7.808 16.415 498 HB3 SER 72 HB2 SER 72 -8.008 7.764 15.112 499 HG SER 72 HG SER 72 -5.874 6.144 15.585 500 H SER 73 HN SER 73 -4.552 7.736 13.180 501 HA SER 73 HA SER 73 -2.371 7.606 15.064 502 HB2 SER 73 HB2 SER 73 -2.559 7.170 12.081 503 HB3 SER 73 HB1 SER 73 -1.037 7.011 12.959 504 HG SER 73 HG SER 73 -2.996 5.245 12.738 505 H VAL 74 HN VAL 74 -2.937 9.627 12.182 506 HA VAL 74 HA VAL 74 -0.561 11.168 12.368 507 HB VAL 74 HB VAL 74 -1.796 12.875 11.056 508 HG11 VAL 74 HG21 VAL 74 -2.224 9.974 10.298 509 HG12 VAL 74 HG22 VAL 74 -0.885 11.016 9.819 510 HG13 VAL 74 HG23 VAL 74 -2.505 11.317 9.192 511 HG21 VAL 74 HG11 VAL 74 -4.147 12.635 10.602 512 HG22 VAL 74 HG12 VAL 74 -3.950 12.541 12.352 513 HG23 VAL 74 HG13 VAL 74 -4.201 11.069 11.414 514 H ALA 75 HN ALA 75 -3.666 11.486 14.023 515 HA ALA 75 HA ALA 75 -3.130 14.073 15.175 516 HB1 ALA 75 HB1 ALA 75 -4.950 11.852 16.157 517 HB2 ALA 75 HB2 ALA 75 -5.408 13.134 15.036 518 HB3 ALA 75 HB3 ALA 75 -4.991 13.528 16.704 519 H GLN 76 HN GLN 76 -2.550 10.743 16.270 520 HA GLN 76 HA GLN 76 -1.604 11.524 18.893 521 HB2 GLN 76 HB2 GLN 76 -2.449 9.230 18.299 522 HB3 GLN 76 HB1 GLN 76 -0.976 8.982 17.363 523 HG2 GLN 76 HG2 GLN 76 0.354 9.460 19.434 524 HG3 GLN 76 HG1 GLN 76 -1.157 9.542 20.340 525 HE21 GLN 76 HE21 GLN 76 -1.784 7.586 21.263 526 HE22 GLN 76 HE22 GLN 76 -1.299 6.052 20.722 527 H ILE 77 HN ILE 77 0.026 10.684 15.831 528 HA ILE 77 HA ILE 77 2.693 10.811 16.719 529 HB ILE 77 HB ILE 77 1.560 11.739 14.064 530 HG12 ILE 77 HG12 ILE 77 2.768 9.075 14.865 531 HG13 ILE 77 HG11 ILE 77 1.037 9.378 14.722 532 HG21 ILE 77 HG21 ILE 77 3.741 12.576 14.060 533 HG22 ILE 77 HG22 ILE 77 3.981 10.963 13.390 534 HG23 ILE 77 HG23 ILE 77 4.348 11.276 15.086 535 HD11 ILE 77 HD11 ILE 77 2.922 8.751 12.642 536 HD12 ILE 77 HD12 ILE 77 2.246 10.353 12.343 537 HD13 ILE 77 HD13 ILE 77 1.175 8.962 12.515 538 H ALA 78 HN ALA 78 0.749 13.470 15.352 539 HA ALA 78 HA ALA 78 2.758 15.461 16.020 540 HB1 ALA 78 HB1 ALA 78 -0.161 15.834 15.290 541 HB2 ALA 78 HB2 ALA 78 1.167 15.742 14.134 542 HB3 ALA 78 HB3 ALA 78 1.081 17.085 15.273 543 H ALA 79 HN ALA 79 -0.472 14.664 17.346 544 HA ALA 79 HA ALA 79 -0.463 16.586 19.431 545 HB1 ALA 79 HB1 ALA 79 -2.401 15.100 18.709 546 HB2 ALA 79 HB2 ALA 79 -2.201 15.289 20.451 547 HB3 ALA 79 HB3 ALA 79 -1.655 13.813 19.656 548 H SER 80 HN SER 80 1.351 13.657 19.076 549 HA SER 80 HA SER 80 1.936 13.392 21.938 550 HB2 SER 80 HB2 SER 80 3.426 11.592 21.262 551 HB3 SER 80 HB1 SER 80 1.913 11.434 20.369 552 HG SER 80 HG SER 80 4.445 12.039 19.480 553 H GLN 81 HN GLN 81 3.177 15.157 19.245 554 HA GLN 81 HA GLN 81 5.891 15.479 19.874 555 HB2 GLN 81 HB2 GLN 81 3.992 17.644 18.917 556 HB3 GLN 81 HB1 GLN 81 5.747 17.658 18.752 557 HG2 GLN 81 HG1 GLN 81 5.704 15.768 17.268 558 HG3 GLN 81 HG2 GLN 81 3.999 15.470 17.601 559 HE21 GLN 81 HE21 GLN 81 5.956 16.720 15.248 560 HE22 GLN 81 HE22 GLN 81 4.914 17.879 14.576 561 H GLY 82 HN GLY 82 3.063 16.922 21.404 562 HA2 GLY 82 HA1 GLY 82 3.005 17.692 23.672 563 HA3 GLY 82 HA2 GLY 82 4.768 17.717 23.683 564 H GLY 83 HN GLY 83 3.627 19.135 20.855 565 HA2 GLY 83 HA2 GLY 83 4.173 21.833 21.976 566 HA3 GLY 83 HA1 GLY 83 4.214 21.410 20.264 567 H ASP 84 HN ASP 84 2.794 23.531 20.459 568 HA ASP 84 HA ASP 84 0.109 23.342 21.420 569 HB2 ASP 84 HB2 ASP 84 1.437 25.435 20.666 570 HB3 ASP 84 HB1 ASP 84 0.915 25.007 19.037 571 H LEU 85 HN LEU 85 -1.517 22.092 20.641 572 HA LEU 85 HA LEU 85 -1.221 20.580 18.190 573 HB2 LEU 85 HB2 LEU 85 -3.216 20.821 20.359 574 HB3 LEU 85 HB1 LEU 85 -3.883 20.386 18.784 575 HG LEU 85 HG LEU 85 -2.338 18.506 18.604 576 HD11 LEU 85 HD21 LEU 85 -1.245 19.612 21.202 577 HD12 LEU 85 HD22 LEU 85 -0.378 19.373 19.685 578 HD13 LEU 85 HD23 LEU 85 -0.895 17.980 20.633 579 HD21 LEU 85 HD11 LEU 85 -3.624 17.178 19.920 580 HD22 LEU 85 HD12 LEU 85 -4.458 18.667 20.360 581 HD23 LEU 85 HD13 LEU 85 -3.168 18.043 21.388 582 H GLY 86 HN GLY 86 -2.337 23.741 18.902 583 HA2 GLY 86 HA1 GLY 86 -4.336 24.161 16.955 584 HA3 GLY 86 HA2 GLY 86 -3.210 25.406 17.497 585 H VAL 87 HN VAL 87 -0.790 24.433 16.615 586 HA VAL 87 HA VAL 87 -0.903 25.029 13.788 587 HB VAL 87 HB VAL 87 1.037 25.504 15.373 588 HG11 VAL 87 HG11 VAL 87 1.654 22.586 14.827 589 HG12 VAL 87 HG12 VAL 87 1.038 23.197 16.363 590 HG13 VAL 87 HG13 VAL 87 2.621 23.710 15.782 591 HG21 VAL 87 HG21 VAL 87 2.731 24.587 13.533 592 HG22 VAL 87 HG22 VAL 87 1.622 25.908 13.170 593 HG23 VAL 87 HG23 VAL 87 1.235 24.265 12.657 594 H THR 88 HN THR 88 -0.252 22.028 15.634 595 HA THR 88 HA THR 88 0.241 20.311 13.463 596 HB THR 88 HB THR 88 -1.223 19.808 16.067 597 HG1 THR 88 HG1 THR 88 0.711 19.361 16.759 598 HG21 THR 88 HG21 THR 88 -1.954 18.227 14.260 599 HG22 THR 88 HG22 THR 88 -1.096 17.433 15.582 600 HG23 THR 88 HG23 THR 88 -0.268 17.751 14.057 601 H THR 89 HN THR 89 -2.812 21.578 14.704 602 HA THR 89 HA THR 89 -4.612 19.990 13.206 603 HB THR 89 HB THR 89 -4.875 22.959 13.786 604 HG1 THR 89 HG1 THR 89 -6.138 21.934 15.598 605 HG21 THR 89 HG21 THR 89 -6.491 21.799 12.163 606 HG22 THR 89 HG22 THR 89 -7.216 22.641 13.533 607 HG23 THR 89 HG23 THR 89 -7.058 20.884 13.560 608 H ASN 90 HN ASN 90 -2.948 23.015 12.327 609 HA ASN 90 HA ASN 90 -3.970 23.049 9.621 610 HB2 ASN 90 HB2 ASN 90 -1.528 24.389 10.825 611 HB3 ASN 90 HB1 ASN 90 -2.213 24.761 9.242 612 HD21 ASN 90 HD21 ASN 90 -2.052 26.736 11.338 613 HD22 ASN 90 HD22 ASN 90 -3.637 27.136 11.795 614 H ALA 91 HN ALA 91 -0.970 21.906 11.141 615 HA ALA 91 HA ALA 91 0.379 21.147 8.742 616 HB1 ALA 91 HB1 ALA 91 0.561 20.201 11.603 617 HB2 ALA 91 HB2 ALA 91 1.698 21.212 10.711 618 HB3 ALA 91 HB3 ALA 91 1.562 19.495 10.334 619 H ILE 92 HN ILE 92 -1.387 19.049 11.052 620 HA ILE 92 HA ILE 92 -1.382 16.766 9.322 621 HB ILE 92 HB ILE 92 -3.284 17.495 11.571 622 HG12 ILE 92 HG12 ILE 92 -0.732 15.858 11.492 623 HG13 ILE 92 HG11 ILE 92 -0.964 17.397 12.322 624 HG21 ILE 92 HG21 ILE 92 -2.980 14.706 11.334 625 HG22 ILE 92 HG22 ILE 92 -3.235 15.292 9.691 626 HG23 ILE 92 HG23 ILE 92 -4.418 15.650 10.949 627 HD11 ILE 92 HD11 ILE 92 -1.137 15.272 13.761 628 HD12 ILE 92 HD12 ILE 92 -2.669 14.979 12.938 629 HD13 ILE 92 HD13 ILE 92 -2.453 16.436 13.908 630 H ALA 93 HN ALA 93 -3.772 19.353 9.849 631 HA ALA 93 HA ALA 93 -5.775 18.244 8.113 632 HB1 ALA 93 HB1 ALA 93 -6.759 20.496 8.134 633 HB2 ALA 93 HB2 ALA 93 -5.271 21.149 8.821 634 HB3 ALA 93 HB3 ALA 93 -6.258 20.028 9.760 635 H ASP 94 HN ASP 94 -3.177 20.627 7.530 636 HA ASP 94 HA ASP 94 -3.801 21.253 4.849 637 HB2 ASP 94 HB1 ASP 94 -1.964 22.263 6.321 638 HB3 ASP 94 HB2 ASP 94 -0.976 20.879 5.855 639 H ALA 95 HN ALA 95 -1.653 18.654 6.059 640 HA ALA 95 HA ALA 95 -0.993 17.529 3.558 641 HB1 ALA 95 HB1 ALA 95 -0.561 16.866 6.227 642 HB2 ALA 95 HB2 ALA 95 0.024 15.964 4.829 643 HB3 ALA 95 HB3 ALA 95 -1.491 15.502 5.602 644 H LEU 96 HN LEU 96 -3.799 16.881 5.657 645 HA LEU 96 HA LEU 96 -4.955 14.904 3.891 646 HB2 LEU 96 HB2 LEU 96 -6.451 16.645 5.866 647 HB3 LEU 96 HB1 LEU 96 -6.900 15.040 5.291 648 HG LEU 96 HG LEU 96 -4.250 15.376 6.646 649 HD11 LEU 96 HD21 LEU 96 -5.106 15.528 8.785 650 HD12 LEU 96 HD22 LEU 96 -6.637 14.776 8.338 651 HD13 LEU 96 HD23 LEU 96 -6.331 16.464 7.927 652 HD21 LEU 96 HD11 LEU 96 -5.033 13.232 5.592 653 HD22 LEU 96 HD12 LEU 96 -6.352 13.196 6.763 654 HD23 LEU 96 HD13 LEU 96 -4.679 13.087 7.313 655 H THR 97 HN THR 97 -5.338 18.405 4.286 656 HA THR 97 HA THR 97 -7.530 18.737 2.495 657 HB THR 97 HB THR 97 -5.274 20.623 3.219 658 HG1 THR 97 HG1 THR 97 -6.412 20.448 4.998 659 HG21 THR 97 HG21 THR 97 -7.418 22.177 2.510 660 HG22 THR 97 HG22 THR 97 -7.532 20.861 1.342 661 HG23 THR 97 HG23 THR 97 -6.053 21.817 1.452 662 H SER 98 HN SER 98 -4.010 18.910 1.910 663 HA SER 98 HA SER 98 -4.314 19.415 -0.919 664 HB2 SER 98 HB2 SER 98 -1.916 18.156 0.430 665 HB3 SER 98 HB1 SER 98 -1.943 19.104 -1.057 666 HG SER 98 HG SER 98 -1.688 20.784 0.141 667 H ALA 99 HN ALA 99 -3.505 16.473 0.943 668 HA ALA 99 HA ALA 99 -3.265 14.682 -1.212 669 HB1 ALA 99 HB1 ALA 99 -4.416 14.208 1.552 670 HB2 ALA 99 HB2 ALA 99 -2.739 13.987 1.055 671 HB3 ALA 99 HB3 ALA 99 -3.993 12.923 0.420 672 H PHE 100 HN PHE 100 -6.220 15.665 0.536 673 HA PHE 100 HA PHE 100 -8.114 14.025 -0.682 674 HB2 PHE 100 HB1 PHE 100 -8.117 16.732 0.483 675 HB3 PHE 100 HB2 PHE 100 -9.402 16.458 -0.693 676 HD1 PHE 100 HD2 PHE 100 -10.595 14.064 -0.452 677 HD2 PHE 100 HD1 PHE 100 -8.527 16.140 2.692 678 HE1 PHE 100 HE2 PHE 100 -11.865 12.769 1.239 679 HE2 PHE 100 HE1 PHE 100 -9.795 14.843 4.380 680 HZ PHE 100 HZ PHE 100 -11.462 13.156 3.655 681 H TYR 101 HN TYR 101 -7.040 17.203 -1.910 682 HA TYR 101 HA TYR 101 -8.368 16.867 -4.457 683 HB2 TYR 101 HB2 TYR 101 -6.049 18.730 -4.037 684 HB3 TYR 101 HB1 TYR 101 -7.518 18.980 -4.983 685 HD1 TYR 101 HD2 TYR 101 -9.655 18.220 -3.156 686 HD2 TYR 101 HD1 TYR 101 -6.023 20.367 -2.349 687 HE1 TYR 101 HE2 TYR 101 -10.733 19.301 -1.197 688 HE2 TYR 101 HE1 TYR 101 -7.098 21.450 -0.394 689 HH TYR 101 HH TYR 101 -9.942 21.890 0.130 690 H GLN 102 HN GLN 102 -5.154 16.168 -3.230 691 HA GLN 102 HA GLN 102 -4.005 15.654 -5.853 692 HB2 GLN 102 HB1 GLN 102 -3.093 14.925 -3.056 693 HB3 GLN 102 HB2 GLN 102 -2.145 14.623 -4.511 694 HG2 GLN 102 HG2 GLN 102 -2.538 17.176 -4.971 695 HG3 GLN 102 HG1 GLN 102 -2.885 17.247 -3.245 696 HE21 GLN 102 HE21 GLN 102 -0.642 18.635 -4.023 697 HE22 GLN 102 HE22 GLN 102 0.769 17.803 -3.578 698 H THR 103 HN THR 103 -5.994 13.859 -3.666 699 HA THR 103 HA THR 103 -5.204 11.304 -4.988 700 HB THR 103 HB THR 103 -6.343 10.198 -3.123 701 HG1 THR 103 HG1 THR 103 -6.940 11.888 -1.410 702 HG21 THR 103 HG21 THR 103 -4.987 11.479 -1.226 703 HG22 THR 103 HG22 THR 103 -4.285 12.307 -2.616 704 HG23 THR 103 HG23 THR 103 -4.152 10.554 -2.475 705 H THR 104 HN THR 104 -8.284 12.788 -3.820 706 HA THR 104 HA THR 104 -9.545 11.657 -6.290 707 HB THR 104 HB THR 104 -10.592 11.692 -3.452 708 HG1 THR 104 HG1 THR 104 -9.592 9.831 -3.748 709 HG21 THR 104 HG21 THR 104 -12.657 11.971 -4.299 710 HG22 THR 104 HG22 THR 104 -12.457 10.423 -5.121 711 HG23 THR 104 HG23 THR 104 -12.045 11.923 -5.952 712 H GLY 105 HN GLY 105 -9.800 14.176 -3.771 713 HA2 GLY 105 HA2 GLY 105 -10.145 16.514 -4.496 714 HA3 GLY 105 HA1 GLY 105 -11.106 15.898 -5.837 715 H VAL 106 HN VAL 106 -11.192 15.088 -2.362 716 HA VAL 106 HA VAL 106 -14.107 15.718 -2.405 717 HB VAL 106 HB VAL 106 -12.606 14.146 -0.298 718 HG11 VAL 106 HG21 VAL 106 -14.693 14.653 0.588 719 HG12 VAL 106 HG22 VAL 106 -15.059 13.147 -0.255 720 HG13 VAL 106 HG23 VAL 106 -15.470 14.693 -0.994 721 HG21 VAL 106 HG11 VAL 106 -12.959 12.157 -1.482 722 HG22 VAL 106 HG12 VAL 106 -12.500 13.274 -2.768 723 HG23 VAL 106 HG13 VAL 106 -14.199 12.875 -2.511 724 H VAL 107 HN VAL 107 -14.872 16.508 -0.127 725 HA VAL 107 HA VAL 107 -13.423 18.953 0.460 726 HB VAL 107 HB VAL 107 -15.146 19.190 2.268 727 HG11 VAL 107 HG21 VAL 107 -15.620 18.895 -0.610 728 HG12 VAL 107 HG22 VAL 107 -16.153 20.167 0.489 729 HG13 VAL 107 HG23 VAL 107 -17.082 18.674 0.352 730 HG21 VAL 107 HG11 VAL 107 -15.995 17.252 3.064 731 HG22 VAL 107 HG12 VAL 107 -15.396 16.347 1.674 732 HG23 VAL 107 HG13 VAL 107 -16.955 17.170 1.587 733 H ASN 108 HN ASN 108 -11.680 19.063 1.782 734 HA ASN 108 HA ASN 108 -10.842 16.823 3.404 735 HB2 ASN 108 HB1 ASN 108 -8.959 18.161 3.978 736 HB3 ASN 108 HB2 ASN 108 -9.357 18.595 2.316 737 HD21 ASN 108 HD21 ASN 108 -9.421 20.816 1.975 738 HD22 ASN 108 HD22 ASN 108 -9.872 21.971 3.132 739 H SER 109 HN SER 109 -12.688 19.727 4.005 740 HA SER 109 HA SER 109 -12.430 19.940 6.808 741 HB2 SER 109 HB2 SER 109 -13.626 21.562 5.307 742 HB3 SER 109 HB1 SER 109 -14.967 20.418 5.221 743 HG SER 109 HG SER 109 -14.591 22.225 7.041 744 H ARG 110 HN ARG 110 -14.729 17.944 4.926 745 HA ARG 110 HA ARG 110 -16.210 16.938 7.115 746 HB2 ARG 110 HB2 ARG 110 -16.799 16.564 4.729 747 HB3 ARG 110 HB1 ARG 110 -15.439 15.451 4.586 748 HG2 ARG 110 HG2 ARG 110 -16.425 14.036 6.365 749 HG3 ARG 110 HG1 ARG 110 -17.798 15.137 6.469 750 HD2 ARG 110 HD1 ARG 110 -18.280 14.699 4.058 751 HD3 ARG 110 HD2 ARG 110 -16.970 13.518 4.041 752 HE ARG 110 HE ARG 110 -18.476 12.009 5.019 753 HH11 ARG 110 HH21 ARG 110 -20.701 14.028 4.335 754 HH12 ARG 110 HH22 ARG 110 -21.504 14.146 5.865 755 HH21 ARG 110 HH11 ARG 110 -18.907 12.684 7.638 756 HH22 ARG 110 HH12 ARG 110 -20.488 13.384 7.736 757 H PHE 111 HN PHE 111 -13.365 15.423 5.535 758 HA PHE 111 HA PHE 111 -13.143 13.419 7.634 759 HB2 PHE 111 HB2 PHE 111 -12.368 13.055 5.284 760 HB3 PHE 111 HB1 PHE 111 -11.088 14.235 5.562 761 HD1 PHE 111 HD2 PHE 111 -12.427 10.937 6.616 762 HD2 PHE 111 HD1 PHE 111 -9.130 13.681 6.832 763 HE1 PHE 111 HE2 PHE 111 -11.024 9.170 7.645 764 HE2 PHE 111 HE1 PHE 111 -7.727 11.914 7.861 765 HZ PHE 111 HZ PHE 111 -8.674 9.659 8.267 766 H ILE 112 HN ILE 112 -11.152 16.239 6.707 767 HA ILE 112 HA ILE 112 -9.305 16.095 8.838 768 HB ILE 112 HB ILE 112 -10.392 18.512 7.368 769 HG12 ILE 112 HG12 ILE 112 -7.977 16.720 7.009 770 HG13 ILE 112 HG11 ILE 112 -9.286 17.006 5.861 771 HG21 ILE 112 HG21 ILE 112 -9.129 19.826 8.694 772 HG22 ILE 112 HG22 ILE 112 -7.719 18.800 8.428 773 HG23 ILE 112 HG23 ILE 112 -8.845 18.429 9.733 774 HD11 ILE 112 HD11 ILE 112 -7.120 18.929 6.731 775 HD12 ILE 112 HD12 ILE 112 -8.581 19.469 5.903 776 HD13 ILE 112 HD13 ILE 112 -7.473 18.356 5.101 777 H SER 113 HN SER 113 -12.557 17.512 8.755 778 HA SER 113 HA SER 113 -12.436 18.916 11.224 779 HB2 SER 113 HB2 SER 113 -14.323 19.165 9.675 780 HB3 SER 113 HB1 SER 113 -14.793 17.489 9.952 781 HG SER 113 HG SER 113 -14.649 18.437 12.319 782 H GLU 114 HN GLU 114 -12.824 15.494 10.526 783 HA GLU 114 HA GLU 114 -13.675 14.762 13.200 784 HB2 GLU 114 HB2 GLU 114 -14.040 13.344 11.157 785 HB3 GLU 114 HB1 GLU 114 -12.306 13.024 11.127 786 HG2 GLU 114 HG2 GLU 114 -12.462 12.093 13.427 787 HG3 GLU 114 HG1 GLU 114 -14.205 12.362 13.399 788 H ILE 115 HN ILE 115 -10.541 14.832 11.512 789 HA ILE 115 HA ILE 115 -9.068 13.762 13.765 790 HB ILE 115 HB ILE 115 -8.147 15.349 11.351 791 HG12 ILE 115 HG11 ILE 115 -7.888 12.386 11.906 792 HG13 ILE 115 HG12 ILE 115 -9.247 13.069 11.014 793 HG21 ILE 115 HG21 ILE 115 -6.147 15.465 12.380 794 HG22 ILE 115 HG22 ILE 115 -6.094 13.701 12.391 795 HG23 ILE 115 HG23 ILE 115 -6.773 14.573 13.767 796 HD11 ILE 115 HD11 ILE 115 -7.997 13.395 9.151 797 HD12 ILE 115 HD12 ILE 115 -6.836 12.299 9.900 798 HD13 ILE 115 HD13 ILE 115 -6.642 14.043 10.075 799 H ARG 116 HN ARG 116 -9.768 17.034 12.572 800 HA ARG 116 HA ARG 116 -8.079 18.511 14.279 801 HB2 ARG 116 HB2 ARG 116 -9.280 19.697 12.587 802 HB3 ARG 116 HB1 ARG 116 -10.833 19.112 13.182 803 HG2 ARG 116 HG2 ARG 116 -10.776 20.514 15.073 804 HG3 ARG 116 HG1 ARG 116 -9.033 20.756 14.953 805 HD2 ARG 116 HD2 ARG 116 -9.432 21.965 12.775 806 HD3 ARG 116 HD1 ARG 116 -11.162 21.863 13.100 807 HE ARG 116 HE ARG 116 -9.258 23.303 14.906 808 HH11 ARG 116 HH21 ARG 116 -12.395 22.450 15.015 809 HH12 ARG 116 HH22 ARG 116 -13.067 24.045 14.951 810 HH21 ARG 116 HH11 ARG 116 -10.069 25.561 14.095 811 HH22 ARG 116 HH12 ARG 116 -11.750 25.805 14.431 812 H SER 117 HN SER 117 -11.340 17.223 14.902 813 HA SER 117 HA SER 117 -11.480 18.298 17.588 814 HB2 SER 117 HB2 SER 117 -13.489 16.999 17.810 815 HB3 SER 117 HB1 SER 117 -13.456 17.595 16.150 816 HG SER 117 HG SER 117 -12.546 15.574 15.547 817 H LEU 118 HN LEU 118 -10.362 15.261 16.175 818 HA LEU 118 HA LEU 118 -10.115 13.839 18.670 819 HB2 LEU 118 HB2 LEU 118 -8.834 13.488 15.953 820 HB3 LEU 118 HB1 LEU 118 -8.473 12.417 17.308 821 HG LEU 118 HG LEU 118 -11.345 12.955 16.663 822 HD11 LEU 118 HD21 LEU 118 -11.341 11.147 14.990 823 HD12 LEU 118 HD22 LEU 118 -9.590 11.007 15.137 824 HD13 LEU 118 HD23 LEU 118 -10.304 12.474 14.467 825 HD21 LEU 118 HD11 LEU 118 -11.362 11.468 18.382 826 HD22 LEU 118 HD12 LEU 118 -9.688 10.988 18.101 827 HD23 LEU 118 HD13 LEU 118 -10.983 10.272 17.142 828 H ILE 119 HN ILE 119 -7.791 15.720 16.714 829 HA ILE 119 HA ILE 119 -5.512 15.290 18.345 830 HB ILE 119 HB ILE 119 -6.231 17.816 16.825 831 HG12 ILE 119 HG12 ILE 119 -4.592 15.463 15.858 832 HG13 ILE 119 HG11 ILE 119 -6.319 15.613 15.534 833 HG21 ILE 119 HG21 ILE 119 -3.599 17.704 16.621 834 HG22 ILE 119 HG22 ILE 119 -3.735 16.731 18.087 835 HG23 ILE 119 HG23 ILE 119 -4.346 18.386 18.066 836 HD11 ILE 119 HD11 ILE 119 -4.123 17.521 14.689 837 HD12 ILE 119 HD12 ILE 119 -5.841 17.893 14.546 838 HD13 ILE 119 HD13 ILE 119 -5.152 16.545 13.640 839 H GLY 120 HN GLY 120 -8.030 17.811 18.554 840 HA2 GLY 120 HA1 GLY 120 -6.931 19.269 20.720 841 HA3 GLY 120 HA2 GLY 120 -8.655 19.169 20.362 842 H MET 121 HN MET 121 -8.801 16.273 20.671 843 HA MET 121 HA MET 121 -9.284 16.143 23.503 844 HB2 MET 121 HB2 MET 121 -10.469 14.764 21.763 845 HB3 MET 121 HB1 MET 121 -8.989 13.823 21.574 846 HG2 MET 121 HG1 MET 121 -9.079 13.338 24.048 847 HG3 MET 121 HG2 MET 121 -10.664 14.111 24.084 848 HE1 MET 121 HE1 MET 121 -12.811 12.002 21.723 849 HE2 MET 121 HE2 MET 121 -12.024 13.575 21.616 850 HE3 MET 121 HE3 MET 121 -12.853 13.112 23.100 851 H PHE 122 HN PHE 122 -6.679 14.868 21.434 852 HA PHE 122 HA PHE 122 -5.289 13.485 23.523 853 HB2 PHE 122 HB2 PHE 122 -4.305 14.689 20.921 854 HB3 PHE 122 HB1 PHE 122 -3.312 13.678 21.971 855 HD1 PHE 122 HD2 PHE 122 -4.240 11.345 22.598 856 HD2 PHE 122 HD1 PHE 122 -5.745 13.706 19.341 857 HE1 PHE 122 HE2 PHE 122 -5.237 9.312 21.586 858 HE2 PHE 122 HE1 PHE 122 -6.742 11.672 18.328 859 HZ PHE 122 HZ PHE 122 -6.488 9.476 19.451 860 H ALA 123 HN ALA 123 -5.279 16.844 22.458 861 HA ALA 123 HA ALA 123 -2.926 17.683 23.850 862 HB1 ALA 123 HB1 ALA 123 -4.845 18.904 22.242 863 HB2 ALA 123 HB2 ALA 123 -3.478 19.709 23.012 864 HB3 ALA 123 HB3 ALA 123 -5.052 19.686 23.809 865 H GLN 124 HN GLN 124 -6.265 17.223 24.883 866 HA GLN 124 HA GLN 124 -5.956 18.507 27.452 867 HB2 GLN 124 HB2 GLN 124 -7.923 16.389 26.530 868 HB3 GLN 124 HB1 GLN 124 -8.056 17.308 28.029 869 HG2 GLN 124 HG1 GLN 124 -8.025 18.482 25.231 870 HG3 GLN 124 HG2 GLN 124 -9.445 18.322 26.265 871 HE21 GLN 124 HE21 GLN 124 -7.517 20.688 25.225 872 HE22 GLN 124 HE22 GLN 124 -7.394 21.655 26.614 873 H ALA 125 HN ALA 125 -5.476 15.213 26.263 874 HA ALA 125 HA ALA 125 -5.145 13.979 28.836 875 HB1 ALA 125 HB1 ALA 125 -5.395 12.358 27.217 876 HB2 ALA 125 HB2 ALA 125 -3.633 12.399 27.279 877 HB3 ALA 125 HB3 ALA 125 -4.491 13.275 26.012 878 H SER 126 HN SER 126 -2.927 15.658 26.650 879 HA SER 126 HA SER 126 -0.496 14.959 27.981 880 HB2 SER 126 HB2 SER 126 0.489 16.825 26.803 881 HB3 SER 126 HB1 SER 126 -0.686 16.074 25.723 882 HG SER 126 HG SER 126 -0.611 18.574 26.550 883 H ALA 127 HN ALA 127 -3.054 17.156 28.809 884 HA ALA 127 HA ALA 127 -1.574 18.897 30.549 885 HB1 ALA 127 HB1 ALA 127 -3.935 19.120 31.654 886 HB2 ALA 127 HB2 ALA 127 -4.474 18.134 30.295 887 HB3 ALA 127 HB3 ALA 127 -3.710 19.697 30.003 888 H ASN 128 HN ASN 128 -2.759 15.643 30.896 889 HA ASN 128 HA ASN 128 -2.824 15.538 33.766 890 HB2 ASN 128 HB2 ASN 128 -3.800 13.819 32.176 891 HB3 ASN 128 HB1 ASN 128 -2.154 13.248 31.900 892 HD21 ASN 128 HD21 ASN 128 -1.526 11.589 33.286 893 HD22 ASN 128 HD22 ASN 128 -2.148 11.327 34.843 894 H ASP 129 HN ASP 129 -0.240 15.830 31.562 895 HA ASP 129 HA ASP 129 1.770 14.431 33.128 896 HB2 ASP 129 HB2 ASP 129 1.913 16.448 30.878 897 HB3 ASP 129 HB1 ASP 129 3.356 15.805 31.660 898 H VAL 130 HN VAL 130 0.856 17.857 32.716 899 HA VAL 130 HA VAL 130 2.800 18.937 34.499 900 HB VAL 130 HB VAL 130 1.176 20.853 34.705 901 HG11 VAL 130 HG21 VAL 130 1.092 21.239 32.146 902 HG12 VAL 130 HG22 VAL 130 1.908 19.680 32.023 903 HG13 VAL 130 HG23 VAL 130 2.679 21.013 32.884 904 HG21 VAL 130 HG11 VAL 130 -0.557 19.476 32.691 905 HG22 VAL 130 HG12 VAL 130 -0.975 20.739 33.848 906 HG23 VAL 130 HG13 VAL 130 -0.777 19.073 34.394 907 H TYR 131 HN TYR 131 -0.296 17.382 35.060 908 HA TYR 131 HA TYR 131 0.266 16.736 37.765 909 HB2 TYR 131 HB2 TYR 131 -1.111 18.305 38.993 910 HB3 TYR 131 HB1 TYR 131 0.035 19.235 38.026 911 HD1 TYR 131 HD1 TYR 131 -0.698 20.409 35.981 912 HD2 TYR 131 HD2 TYR 131 -3.482 18.295 38.478 913 HE1 TYR 131 HE1 TYR 131 -2.583 21.562 34.856 914 HE2 TYR 131 HE2 TYR 131 -5.367 19.448 37.352 915 HH TYR 131 HH TYR 131 -5.628 20.567 34.890 916 H ALA 132 HN ALA 132 -2.018 16.253 38.927 917 HA ALA 132 HA ALA 132 -3.409 14.463 37.113 918 HB1 ALA 132 HB1 ALA 132 -3.304 13.683 39.338 919 HB2 ALA 132 HB2 ALA 132 -4.968 14.246 39.182 920 HB3 ALA 132 HB3 ALA 132 -3.771 15.247 40.003 921 H SER 133 HN SER 133 -4.937 15.149 35.704 922 HA SER 133 HA SER 133 -6.406 17.664 36.313 923 HB2 SER 133 HB2 SER 133 -5.268 17.476 34.111 924 HB3 SER 133 HB1 SER 133 -6.264 16.071 33.734 925 HG SER 133 HG SER 133 -6.891 18.735 33.704 926 H ALA 134 HN ALA 134 -8.678 17.696 36.392 927 HA ALA 134 HA ALA 134 -10.158 15.181 35.946 928 HB1 ALA 134 HB1 ALA 134 -9.430 15.008 38.296 929 HB2 ALA 134 HB2 ALA 134 -11.175 15.238 38.199 930 HB3 ALA 134 HB3 ALA 134 -10.129 16.591 38.632 931 H GLY 135 HN GLY 135 -12.469 15.557 35.796 932 HA2 GLY 135 HA2 GLY 135 -14.412 16.896 35.537 933 HA3 GLY 135 HA1 GLY 135 -13.479 18.298 36.062 934 H SER 136 HN SER 136 -14.821 19.137 34.092 935 HA SER 136 HA SER 136 -14.182 18.393 31.429 936 HB2 SER 136 HB2 SER 136 -14.850 21.170 32.454 937 HB3 SER 136 HB1 SER 136 -15.011 20.606 30.791 938 HG SER 136 HG SER 136 -16.277 19.232 32.887 939 H GLY 137 HN GLY 137 -12.506 20.507 33.709 940 HA2 GLY 137 HA2 GLY 137 -9.946 20.324 33.117 941 HA3 GLY 137 HA1 GLY 137 -10.466 21.120 31.631 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 -13.512 10.562 -12.480 2 H2 GLY 1 HT2 GLY 1 -14.325 11.726 -13.414 3 H3 GLY 1 HT3 GLY 1 -13.610 10.379 -14.164 4 HA2 GLY 1 HA2 GLY 1 -16.050 10.496 -12.509 5 HA3 GLY 1 HA1 GLY 1 -15.847 9.823 -14.126 6 H MET 2 HN MET 2 -16.180 7.649 -13.921 7 HA MET 2 HA MET 2 -15.751 6.111 -11.576 8 HB2 MET 2 HB2 MET 2 -15.740 5.260 -14.487 9 HB3 MET 2 HB1 MET 2 -15.796 4.142 -13.125 10 HG2 MET 2 HG1 MET 2 -17.876 5.313 -12.335 11 HG3 MET 2 HG2 MET 2 -17.849 6.263 -13.821 12 HE1 MET 2 HE1 MET 2 -17.433 1.914 -13.488 13 HE2 MET 2 HE2 MET 2 -18.989 2.220 -12.720 14 HE3 MET 2 HE3 MET 2 -17.561 3.099 -12.181 15 H GLY 3 HN GLY 3 -13.571 6.956 -14.222 16 HA2 GLY 3 HA2 GLY 3 -11.473 5.144 -13.765 17 HA3 GLY 3 HA1 GLY 3 -11.230 6.792 -14.345 18 H GLN 4 HN GLN 4 -12.387 8.018 -11.936 19 HA GLN 4 HA GLN 4 -10.084 7.525 -10.100 20 HB2 GLN 4 HB2 GLN 4 -11.879 9.953 -10.398 21 HB3 GLN 4 HB1 GLN 4 -10.556 9.809 -9.240 22 HG2 GLN 4 HG2 GLN 4 -8.957 9.512 -11.089 23 HG3 GLN 4 HG1 GLN 4 -10.274 9.618 -12.257 24 HE21 GLN 4 HE21 GLN 4 -8.130 11.497 -12.334 25 HE22 GLN 4 HE22 GLN 4 -8.734 13.021 -11.897 26 H ALA 5 HN ALA 5 -10.485 7.201 -7.879 27 HA ALA 5 HA ALA 5 -13.082 6.050 -7.237 28 HB1 ALA 5 HB1 ALA 5 -10.807 5.303 -6.318 29 HB2 ALA 5 HB2 ALA 5 -12.110 5.459 -5.140 30 HB3 ALA 5 HB3 ALA 5 -10.883 6.720 -5.271 31 H ASN 6 HN ASN 6 -14.658 6.923 -5.850 32 HA ASN 6 HA ASN 6 -14.951 9.766 -5.820 33 HB2 ASN 6 HB1 ASN 6 -16.296 7.680 -4.073 34 HB3 ASN 6 HB2 ASN 6 -16.839 9.345 -4.276 35 HD21 ASN 6 HD21 ASN 6 -16.499 9.703 -7.052 36 HD22 ASN 6 HD22 ASN 6 -17.515 8.632 -7.888 37 H THR 7 HN THR 7 -13.356 7.557 -3.644 38 HA THR 7 HA THR 7 -12.693 9.885 -1.890 39 HB THR 7 HB THR 7 -12.505 7.477 -0.379 40 HG1 THR 7 HG1 THR 7 -15.096 7.861 -1.432 41 HG21 THR 7 HG21 THR 7 -14.082 10.012 -0.343 42 HG22 THR 7 HG22 THR 7 -12.949 9.375 0.848 43 HG23 THR 7 HG23 THR 7 -14.575 8.706 0.734 44 HA PRO 8 HA PRO 8 -8.521 8.483 -2.422 45 HB2 PRO 8 HB2 PRO 8 -7.355 9.426 -0.181 46 HB3 PRO 8 HB1 PRO 8 -7.895 10.466 -1.498 47 HG2 PRO 8 HG1 PRO 8 -9.062 10.059 1.172 48 HG3 PRO 8 HG2 PRO 8 -9.201 11.442 0.091 49 HD2 PRO 8 HD2 PRO 8 -11.125 9.401 0.519 50 HD3 PRO 8 HD1 PRO 8 -11.198 10.697 -0.671 51 H TRP 9 HN TRP 9 -9.991 7.656 0.720 52 HA TRP 9 HA TRP 9 -8.003 5.498 1.091 53 HB2 TRP 9 HB2 TRP 9 -9.304 5.058 3.202 54 HB3 TRP 9 HB1 TRP 9 -8.610 6.676 3.104 55 HD1 TRP 9 HD1 TRP 9 -11.940 4.817 2.896 56 HE1 TRP 9 HE1 TRP 9 -13.858 6.527 3.142 57 HE3 TRP 9 HE3 TRP 9 -9.260 9.150 2.798 58 HZ2 TRP 9 HZ2 TRP 9 -14.200 9.371 3.279 59 HZ3 TRP 9 HZ3 TRP 9 -10.396 11.335 2.987 60 HH2 TRP 9 HH2 TRP 9 -12.860 11.459 3.230 61 H SER 10 HN SER 10 -11.246 5.946 -0.076 62 HA SER 10 HA SER 10 -12.256 3.309 0.300 63 HB2 SER 10 HB1 SER 10 -12.792 5.330 -1.895 64 HB3 SER 10 HB2 SER 10 -13.725 3.852 -1.666 65 HG SER 10 HG SER 10 -14.533 5.839 -0.632 66 H SER 11 HN SER 11 -9.658 4.394 -1.633 67 HA SER 11 HA SER 11 -9.672 1.778 -3.072 68 HB2 SER 11 HB1 SER 11 -8.912 4.481 -4.222 69 HB3 SER 11 HB2 SER 11 -8.699 2.936 -5.046 70 HG SER 11 HG SER 11 -11.187 3.841 -4.051 71 H LYS 12 HN LYS 12 -7.529 0.951 -3.533 72 HA LYS 12 HA LYS 12 -5.586 1.592 -1.472 73 HB2 LYS 12 HB1 LYS 12 -5.144 -0.080 -3.956 74 HB3 LYS 12 HB2 LYS 12 -4.248 -0.161 -2.441 75 HG2 LYS 12 HG2 LYS 12 -6.185 -1.003 -1.265 76 HG3 LYS 12 HG1 LYS 12 -7.211 -0.743 -2.676 77 HD2 LYS 12 HD2 LYS 12 -4.959 -2.745 -2.371 78 HD3 LYS 12 HD1 LYS 12 -6.663 -3.083 -2.667 79 HE2 LYS 12 HE1 LYS 12 -6.432 -1.837 -4.858 80 HE3 LYS 12 HE2 LYS 12 -4.692 -1.780 -4.567 81 HZ1 LYS 12 HZ1 LYS 12 -6.408 -4.114 -5.090 82 HZ2 LYS 12 HZ2 LYS 12 -4.956 -4.306 -4.228 83 HZ3 LYS 12 HZ3 LYS 12 -4.934 -3.686 -5.810 84 H ALA 13 HN ALA 13 -5.833 2.204 -4.961 85 HA ALA 13 HA ALA 13 -3.208 3.319 -5.259 86 HB1 ALA 13 HB1 ALA 13 -4.371 4.500 -7.274 87 HB2 ALA 13 HB2 ALA 13 -5.768 3.520 -6.830 88 HB3 ALA 13 HB3 ALA 13 -4.253 2.740 -7.282 89 H ASN 14 HN ASN 14 -6.386 4.894 -4.809 90 HA ASN 14 HA ASN 14 -5.231 7.539 -4.576 91 HB2 ASN 14 HB2 ASN 14 -7.937 6.592 -3.591 92 HB3 ASN 14 HB1 ASN 14 -7.463 8.251 -3.960 93 HD21 ASN 14 HD21 ASN 14 -6.161 7.990 -6.408 94 HD22 ASN 14 HD22 ASN 14 -7.242 7.393 -7.573 95 H ALA 15 HN ALA 15 -5.958 4.940 -2.345 96 HA ALA 15 HA ALA 15 -5.801 6.530 0.061 97 HB1 ALA 15 HB1 ALA 15 -5.541 4.328 1.196 98 HB2 ALA 15 HB2 ALA 15 -5.395 3.560 -0.385 99 HB3 ALA 15 HB3 ALA 15 -6.903 4.350 0.077 100 H ASP 16 HN ASP 16 -3.488 4.244 -1.406 101 HA ASP 16 HA ASP 16 -1.344 4.726 0.360 102 HB2 ASP 16 HB2 ASP 16 0.065 3.722 -1.283 103 HB3 ASP 16 HB1 ASP 16 -1.514 2.965 -1.493 104 H ALA 17 HN ALA 17 -2.108 6.415 -2.706 105 HA ALA 17 HA ALA 17 0.117 8.208 -2.591 106 HB1 ALA 17 HB1 ALA 17 -2.293 7.908 -4.173 107 HB2 ALA 17 HB2 ALA 17 -0.765 8.669 -4.614 108 HB3 ALA 17 HB3 ALA 17 -2.012 9.606 -3.792 109 H PHE 18 HN PHE 18 -3.166 8.404 -1.263 110 HA PHE 18 HA PHE 18 -3.036 11.084 -0.306 111 HB2 PHE 18 HB1 PHE 18 -5.126 9.759 -0.377 112 HB3 PHE 18 HB2 PHE 18 -4.501 8.713 0.897 113 HD1 PHE 18 HD1 PHE 18 -5.591 12.165 0.089 114 HD2 PHE 18 HD2 PHE 18 -4.476 9.416 3.194 115 HE1 PHE 18 HE1 PHE 18 -6.403 13.767 1.800 116 HE2 PHE 18 HE2 PHE 18 -5.286 11.018 4.905 117 HZ PHE 18 HZ PHE 18 -6.249 13.194 4.207 118 H ILE 19 HN ILE 19 -1.924 8.028 1.098 119 HA ILE 19 HA ILE 19 -1.224 9.150 3.668 120 HB ILE 19 HB ILE 19 -0.122 6.679 2.298 121 HG12 ILE 19 HG12 ILE 19 -2.526 6.498 2.419 122 HG13 ILE 19 HG11 ILE 19 -1.857 5.520 3.724 123 HG21 ILE 19 HG21 ILE 19 1.283 7.000 4.121 124 HG22 ILE 19 HG22 ILE 19 -0.013 6.069 4.873 125 HG23 ILE 19 HG23 ILE 19 0.040 7.822 5.065 126 HD11 ILE 19 HD11 ILE 19 -2.093 7.982 4.926 127 HD12 ILE 19 HD12 ILE 19 -3.280 6.685 5.056 128 HD13 ILE 19 HD13 ILE 19 -3.497 7.962 3.859 129 H ASN 20 HN ASN 20 0.636 8.443 0.712 130 HA ASN 20 HA ASN 20 3.174 9.275 1.752 131 HB2 ASN 20 HB1 ASN 20 2.197 9.326 -1.119 132 HB3 ASN 20 HB2 ASN 20 3.881 9.351 -0.593 133 HD21 ASN 20 HD21 ASN 20 1.634 7.265 -1.818 134 HD22 ASN 20 HD22 ASN 20 2.180 5.813 -1.128 135 H SER 21 HN SER 21 0.706 11.039 -0.131 136 HA SER 21 HA SER 21 2.200 13.487 -0.274 137 HB2 SER 21 HB2 SER 21 0.143 12.768 -1.653 138 HB3 SER 21 HB1 SER 21 -0.813 13.321 -0.278 139 HG SER 21 HG SER 21 1.187 14.966 -1.359 140 H PHE 22 HN PHE 22 0.040 12.146 2.162 141 HA PHE 22 HA PHE 22 -0.416 14.583 3.606 142 HB2 PHE 22 HB1 PHE 22 -1.832 12.689 4.057 143 HB3 PHE 22 HB2 PHE 22 -0.447 11.682 4.476 144 HD1 PHE 22 HD2 PHE 22 0.974 12.342 6.498 145 HD2 PHE 22 HD1 PHE 22 -2.887 14.042 5.688 146 HE1 PHE 22 HE2 PHE 22 0.812 13.101 8.856 147 HE2 PHE 22 HE1 PHE 22 -3.049 14.798 8.044 148 HZ PHE 22 HZ PHE 22 -1.199 14.328 9.627 149 H ILE 23 HN ILE 23 2.007 11.995 4.052 150 HA ILE 23 HA ILE 23 3.274 13.194 6.320 151 HB ILE 23 HB ILE 23 4.537 11.398 4.237 152 HG12 ILE 23 HG12 ILE 23 2.380 10.517 5.172 153 HG13 ILE 23 HG11 ILE 23 3.779 9.533 5.600 154 HG21 ILE 23 HG21 ILE 23 5.354 10.964 6.963 155 HG22 ILE 23 HG22 ILE 23 5.564 12.667 6.555 156 HG23 ILE 23 HG23 ILE 23 6.344 11.424 5.578 157 HD11 ILE 23 HD11 ILE 23 3.364 9.858 7.788 158 HD12 ILE 23 HD12 ILE 23 1.923 10.779 7.360 159 HD13 ILE 23 HD13 ILE 23 3.467 11.604 7.566 160 H SER 24 HN SER 24 4.364 13.162 2.899 161 HA SER 24 HA SER 24 6.528 14.967 3.294 162 HB2 SER 24 HB2 SER 24 4.864 14.595 0.786 163 HB3 SER 24 HB1 SER 24 6.492 15.268 0.867 164 HG SER 24 HG SER 24 5.685 12.638 1.549 165 H ALA 25 HN ALA 25 3.097 15.540 2.741 166 HA ALA 25 HA ALA 25 3.447 18.393 2.256 167 HB1 ALA 25 HB1 ALA 25 0.922 18.411 2.615 168 HB2 ALA 25 HB2 ALA 25 1.033 16.665 2.836 169 HB3 ALA 25 HB3 ALA 25 1.501 17.390 1.298 170 H ALA 26 HN ALA 26 2.349 16.422 5.031 171 HA ALA 26 HA ALA 26 1.877 18.673 6.757 172 HB1 ALA 26 HB1 ALA 26 2.133 16.890 8.588 173 HB2 ALA 26 HB2 ALA 26 2.381 15.742 7.272 174 HB3 ALA 26 HB3 ALA 26 0.860 16.629 7.395 175 H SER 27 HN SER 27 4.754 16.733 6.084 176 HA SER 27 HA SER 27 6.364 17.553 8.259 177 HB2 SER 27 HB2 SER 27 7.255 17.042 5.407 178 HB3 SER 27 HB1 SER 27 8.282 16.994 6.841 179 HG SER 27 HG SER 27 6.836 15.330 7.624 180 H ASN 28 HN ASN 28 5.585 19.243 5.256 181 HA ASN 28 HA ASN 28 7.348 21.485 6.128 182 HB2 ASN 28 HB2 ASN 28 6.098 20.851 3.444 183 HB3 ASN 28 HB1 ASN 28 7.018 22.317 3.782 184 HD21 ASN 28 HD21 ASN 28 7.996 20.542 1.823 185 HD22 ASN 28 HD22 ASN 28 9.367 19.732 2.408 186 H THR 29 HN THR 29 4.258 20.646 6.669 187 HA THR 29 HA THR 29 2.998 23.191 5.891 188 HB THR 29 HB THR 29 1.871 20.957 7.603 189 HG1 THR 29 HG1 THR 29 2.271 20.095 5.644 190 HG21 THR 29 HG21 THR 29 0.451 23.082 5.986 191 HG22 THR 29 HG22 THR 29 0.798 23.253 7.706 192 HG23 THR 29 HG23 THR 29 -0.263 21.960 7.144 193 H GLY 30 HN GLY 30 2.701 21.635 9.075 194 HA2 GLY 30 HA2 GLY 30 2.811 24.248 10.364 195 HA3 GLY 30 HA1 GLY 30 2.603 22.697 11.178 196 H SER 31 HN SER 31 4.387 21.720 12.077 197 HA SER 31 HA SER 31 7.056 22.927 11.494 198 HB2 SER 31 HB1 SER 31 6.849 23.881 13.564 199 HB3 SER 31 HB2 SER 31 5.605 22.740 14.076 200 HG SER 31 HG SER 31 8.405 22.415 14.033 201 H PHE 32 HN PHE 32 5.608 20.280 13.436 202 HA PHE 32 HA PHE 32 6.388 18.068 13.715 203 HB2 PHE 32 HB2 PHE 32 6.252 18.613 10.769 204 HB3 PHE 32 HB1 PHE 32 6.921 17.077 11.318 205 HD1 PHE 32 HD2 PHE 32 5.364 16.459 13.702 206 HD2 PHE 32 HD1 PHE 32 4.078 18.182 9.978 207 HE1 PHE 32 HE2 PHE 32 3.075 15.591 14.090 208 HE2 PHE 32 HE1 PHE 32 1.789 17.313 10.371 209 HZ PHE 32 HZ PHE 32 1.288 16.015 12.425 210 H SER 33 HN SER 33 8.353 18.425 14.859 211 HA SER 33 HA SER 33 10.802 19.279 13.694 212 HB2 SER 33 HB1 SER 33 11.855 18.501 15.689 213 HB3 SER 33 HB2 SER 33 10.241 19.014 16.181 214 HG SER 33 HG SER 33 11.354 16.489 16.065 215 H GLN 34 HN GLN 34 12.730 17.907 13.264 216 HA GLN 34 HA GLN 34 12.281 15.935 11.314 217 HB2 GLN 34 HB1 GLN 34 14.667 16.223 13.167 218 HB3 GLN 34 HB2 GLN 34 14.648 15.276 11.680 219 HG2 GLN 34 HG2 GLN 34 14.145 17.302 10.379 220 HG3 GLN 34 HG1 GLN 34 14.118 18.258 11.860 221 HE21 GLN 34 HE21 GLN 34 15.974 18.844 9.758 222 HE22 GLN 34 HE22 GLN 34 17.538 18.511 10.328 223 H ASP 35 HN ASP 35 12.768 15.547 14.816 224 HA ASP 35 HA ASP 35 12.854 12.703 14.866 225 HB2 ASP 35 HB2 ASP 35 11.834 14.700 16.903 226 HB3 ASP 35 HB1 ASP 35 11.994 12.974 17.231 227 H GLN 36 HN GLN 36 10.133 14.965 14.782 228 HA GLN 36 HA GLN 36 8.113 12.919 15.180 229 HB2 GLN 36 HB1 GLN 36 7.859 15.672 13.932 230 HB3 GLN 36 HB2 GLN 36 6.527 14.667 14.501 231 HG2 GLN 36 HG2 GLN 36 8.791 15.712 16.228 232 HG3 GLN 36 HG1 GLN 36 7.160 16.379 16.179 233 HE21 GLN 36 HE21 GLN 36 8.905 14.640 18.227 234 HE22 GLN 36 HE22 GLN 36 7.788 13.474 18.750 235 H MET 37 HN MET 37 9.752 14.321 12.397 236 HA MET 37 HA MET 37 7.999 13.310 10.372 237 HB2 MET 37 HB2 MET 37 10.974 13.901 10.319 238 HB3 MET 37 HB1 MET 37 10.021 13.517 8.885 239 HG2 MET 37 HG2 MET 37 8.501 15.444 9.484 240 HG3 MET 37 HG1 MET 37 9.652 15.879 10.748 241 HE1 MET 37 HE1 MET 37 10.220 18.592 8.037 242 HE2 MET 37 HE2 MET 37 9.878 18.258 9.732 243 HE3 MET 37 HE3 MET 37 8.705 17.804 8.498 244 H GLU 38 HN GLU 38 10.674 11.870 12.168 245 HA GLU 38 HA GLU 38 10.931 9.500 10.566 246 HB2 GLU 38 HB1 GLU 38 12.597 10.251 12.286 247 HB3 GLU 38 HB2 GLU 38 11.446 9.797 13.542 248 HG2 GLU 38 HG2 GLU 38 12.988 7.950 13.223 249 HG3 GLU 38 HG1 GLU 38 11.417 7.473 12.580 250 H ASN 39 HN ASN 39 8.978 10.271 13.446 251 HA ASN 39 HA ASN 39 7.833 7.691 13.798 252 HB2 ASN 39 HB2 ASN 39 6.641 10.424 14.360 253 HB3 ASN 39 HB1 ASN 39 5.986 8.900 14.958 254 HD21 ASN 39 HD21 ASN 39 6.903 10.920 16.768 255 HD22 ASN 39 HD22 ASN 39 8.312 10.370 17.539 256 H MET 40 HN MET 40 6.809 10.447 11.808 257 HA MET 40 HA MET 40 4.407 9.204 10.825 258 HB2 MET 40 HB2 MET 40 6.149 11.379 9.622 259 HB3 MET 40 HB1 MET 40 4.559 10.922 9.010 260 HG2 MET 40 HG2 MET 40 3.618 11.417 11.292 261 HG3 MET 40 HG1 MET 40 5.201 12.044 11.753 262 HE1 MET 40 HE1 MET 40 6.343 14.151 10.733 263 HE2 MET 40 HE2 MET 40 5.793 14.918 9.246 264 HE3 MET 40 HE3 MET 40 6.304 13.233 9.222 265 H SER 41 HN SER 41 7.779 9.123 9.826 266 HA SER 41 HA SER 41 7.314 7.850 7.274 267 HB2 SER 41 HB2 SER 41 9.432 9.041 7.891 268 HB3 SER 41 HB1 SER 41 9.797 7.731 9.014 269 HG SER 41 HG SER 41 9.411 7.502 6.214 270 H LEU 42 HN LEU 42 7.457 6.721 10.564 271 HA LEU 42 HA LEU 42 7.825 3.908 9.752 272 HB2 LEU 42 HB2 LEU 42 8.839 4.710 11.859 273 HB3 LEU 42 HB1 LEU 42 7.238 5.136 12.466 274 HG LEU 42 HG LEU 42 6.621 2.666 12.010 275 HD11 LEU 42 HD11 LEU 42 8.615 1.142 12.159 276 HD12 LEU 42 HD12 LEU 42 9.651 2.551 11.932 277 HD13 LEU 42 HD13 LEU 42 8.541 2.057 10.653 278 HD21 LEU 42 HD21 LEU 42 8.598 3.471 14.161 279 HD22 LEU 42 HD22 LEU 42 7.686 1.963 14.182 280 HD23 LEU 42 HD23 LEU 42 6.838 3.506 14.270 281 H ILE 43 HN ILE 43 5.271 6.141 10.440 282 HA ILE 43 HA ILE 43 3.311 3.885 10.362 283 HB ILE 43 HB ILE 43 3.018 6.652 11.570 284 HG12 ILE 43 HG12 ILE 43 4.458 5.240 12.925 285 HG13 ILE 43 HG11 ILE 43 2.881 5.345 13.708 286 HG21 ILE 43 HG21 ILE 43 0.837 6.112 10.959 287 HG22 ILE 43 HG22 ILE 43 0.927 5.343 12.544 288 HG23 ILE 43 HG23 ILE 43 1.124 4.376 11.083 289 HD11 ILE 43 HD11 ILE 43 3.989 3.058 12.065 290 HD12 ILE 43 HD12 ILE 43 2.280 3.188 12.478 291 HD13 ILE 43 HD13 ILE 43 3.485 3.030 13.755 292 H GLY 44 HN GLY 44 1.244 4.453 9.226 293 HA2 GLY 44 HA2 GLY 44 0.021 5.671 7.559 294 HA3 GLY 44 HA1 GLY 44 1.445 6.680 7.288 295 H ASN 45 HN ASN 45 3.274 5.663 6.122 296 HA ASN 45 HA ASN 45 2.455 4.263 3.782 297 HB2 ASN 45 HB2 ASN 45 5.199 4.466 5.068 298 HB3 ASN 45 HB1 ASN 45 4.902 3.841 3.446 299 HD21 ASN 45 HD21 ASN 45 6.500 6.191 3.892 300 HD22 ASN 45 HD22 ASN 45 5.684 7.503 3.192 301 H THR 46 HN THR 46 3.764 3.128 6.874 302 HA THR 46 HA THR 46 4.123 0.392 6.164 303 HB THR 46 HB THR 46 3.286 1.545 8.843 304 HG1 THR 46 HG1 THR 46 5.182 2.453 8.484 305 HG21 THR 46 HG21 THR 46 2.968 -0.865 8.760 306 HG22 THR 46 HG22 THR 46 4.405 -0.512 9.719 307 HG23 THR 46 HG23 THR 46 4.572 -1.084 8.060 308 H LEU 47 HN LEU 47 1.282 2.231 7.160 309 HA LEU 47 HA LEU 47 -0.502 0.060 7.600 310 HB2 LEU 47 HB2 LEU 47 -1.001 2.444 8.149 311 HB3 LEU 47 HB1 LEU 47 -1.145 2.783 6.424 312 HG LEU 47 HG LEU 47 -2.911 0.939 6.347 313 HD11 LEU 47 HD11 LEU 47 -2.694 -0.306 8.298 314 HD12 LEU 47 HD12 LEU 47 -3.999 0.788 8.759 315 HD13 LEU 47 HD13 LEU 47 -2.348 1.114 9.286 316 HD21 LEU 47 HD21 LEU 47 -3.123 3.624 7.595 317 HD22 LEU 47 HD22 LEU 47 -4.507 2.557 7.831 318 HD23 LEU 47 HD23 LEU 47 -3.973 2.960 6.199 319 H MET 48 HN MET 48 0.586 1.642 4.638 320 HA MET 48 HA MET 48 -1.315 0.590 2.825 321 HB2 MET 48 HB2 MET 48 1.647 0.971 2.295 322 HB3 MET 48 HB1 MET 48 0.353 0.961 1.097 323 HG2 MET 48 HG2 MET 48 0.796 3.001 3.294 324 HG3 MET 48 HG1 MET 48 0.906 3.268 1.554 325 HE1 MET 48 HE1 MET 48 -0.819 2.110 0.160 326 HE2 MET 48 HE2 MET 48 -2.432 2.818 0.144 327 HE3 MET 48 HE3 MET 48 -2.167 1.267 0.936 328 H ALA 49 HN ALA 49 1.389 -0.938 4.445 329 HA ALA 49 HA ALA 49 1.673 -3.225 2.764 330 HB1 ALA 49 HB1 ALA 49 3.322 -3.516 4.273 331 HB2 ALA 49 HB2 ALA 49 2.099 -4.096 5.403 332 HB3 ALA 49 HB3 ALA 49 2.559 -2.392 5.398 333 H ALA 50 HN ALA 50 -0.533 -2.520 5.451 334 HA ALA 50 HA ALA 50 -1.684 -5.100 5.725 335 HB1 ALA 50 HB1 ALA 50 -3.785 -3.272 6.082 336 HB2 ALA 50 HB2 ALA 50 -2.331 -2.383 6.535 337 HB3 ALA 50 HB3 ALA 50 -2.720 -3.904 7.338 338 H MET 51 HN MET 51 -1.968 -2.720 3.226 339 HA MET 51 HA MET 51 -4.463 -3.351 2.080 340 HB2 MET 51 HB2 MET 51 -3.155 -1.517 1.200 341 HB3 MET 51 HB1 MET 51 -1.834 -2.602 0.769 342 HG2 MET 51 HG2 MET 51 -3.576 -3.817 -0.710 343 HG3 MET 51 HG1 MET 51 -4.560 -2.368 -0.505 344 HE1 MET 51 HE1 MET 51 -1.451 -0.261 -0.485 345 HE2 MET 51 HE2 MET 51 -3.188 -0.242 -0.188 346 HE3 MET 51 HE3 MET 51 -2.546 0.472 -1.666 347 H ASP 52 HN ASP 52 -1.316 -4.969 1.700 348 HA ASP 52 HA ASP 52 -2.183 -6.880 -0.251 349 HB2 ASP 52 HB2 ASP 52 0.013 -6.997 1.835 350 HB3 ASP 52 HB1 ASP 52 -0.212 -8.218 0.582 351 H ASN 53 HN ASN 53 -2.569 -6.692 3.216 352 HA ASN 53 HA ASN 53 -3.144 -9.446 3.732 353 HB2 ASN 53 HB2 ASN 53 -2.740 -7.641 5.465 354 HB3 ASN 53 HB1 ASN 53 -4.377 -7.065 5.144 355 HD21 ASN 53 HD21 ASN 53 -5.793 -7.863 6.698 356 HD22 ASN 53 HD22 ASN 53 -5.689 -9.393 7.425 357 H MET 54 HN MET 54 -5.016 -6.890 2.266 358 HA MET 54 HA MET 54 -7.644 -7.830 2.665 359 HB2 MET 54 HB2 MET 54 -6.519 -6.643 0.109 360 HB3 MET 54 HB1 MET 54 -8.216 -6.672 0.588 361 HG2 MET 54 HG1 MET 54 -5.957 -5.204 1.980 362 HG3 MET 54 HG2 MET 54 -7.320 -4.483 1.124 363 HE1 MET 54 HE1 MET 54 -10.370 -5.596 3.223 364 HE2 MET 54 HE2 MET 54 -9.612 -6.595 1.986 365 HE3 MET 54 HE3 MET 54 -9.767 -4.859 1.732 366 H GLY 55 HN GLY 55 -5.131 -8.981 0.470 367 HA2 GLY 55 HA2 GLY 55 -4.991 -11.137 -0.511 368 HA3 GLY 55 HA1 GLY 55 -6.597 -11.497 0.124 369 H GLY 56 HN GLY 56 -6.439 -8.501 -1.486 370 HA2 GLY 56 HA2 GLY 56 -6.763 -8.024 -3.848 371 HA3 GLY 56 HA1 GLY 56 -7.252 -9.702 -4.085 372 H ARG 57 HN ARG 57 -8.464 -7.829 -1.384 373 HA ARG 57 HA ARG 57 -11.048 -7.428 -2.810 374 HB2 ARG 57 HB2 ARG 57 -12.310 -8.389 -0.992 375 HB3 ARG 57 HB1 ARG 57 -11.090 -9.572 -1.467 376 HG2 ARG 57 HG2 ARG 57 -9.611 -8.485 0.358 377 HG3 ARG 57 HG1 ARG 57 -11.107 -7.760 0.947 378 HD2 ARG 57 HD2 ARG 57 -12.111 -10.056 1.053 379 HD3 ARG 57 HD1 ARG 57 -10.536 -10.720 0.618 380 HE ARG 57 HE ARG 57 -10.230 -10.615 2.966 381 HH11 ARG 57 HH21 ARG 57 -12.625 -8.382 2.538 382 HH12 ARG 57 HH22 ARG 57 -11.994 -7.196 3.630 383 HH21 ARG 57 HH11 ARG 57 -8.941 -8.793 4.023 384 HH22 ARG 57 HH12 ARG 57 -9.909 -7.428 4.471 385 H ILE 58 HN ILE 58 -11.350 -5.257 -2.690 386 HA ILE 58 HA ILE 58 -10.634 -3.897 -0.124 387 HB ILE 58 HB ILE 58 -10.911 -2.645 -2.871 388 HG12 ILE 58 HG12 ILE 58 -9.014 -4.164 -2.888 389 HG13 ILE 58 HG11 ILE 58 -8.413 -2.510 -2.767 390 HG21 ILE 58 HG21 ILE 58 -11.239 -0.956 -1.259 391 HG22 ILE 58 HG22 ILE 58 -9.511 -0.860 -1.601 392 HG23 ILE 58 HG23 ILE 58 -10.078 -1.672 -0.142 393 HD11 ILE 58 HD11 ILE 58 -7.295 -3.132 -0.910 394 HD12 ILE 58 HD12 ILE 58 -8.080 -4.711 -0.910 395 HD13 ILE 58 HD13 ILE 58 -8.853 -3.341 -0.113 396 H THR 59 HN THR 59 -12.225 -2.666 0.882 397 HA THR 59 HA THR 59 -14.760 -2.168 -0.552 398 HB THR 59 HB THR 59 -15.122 -4.375 0.451 399 HG1 THR 59 HG1 THR 59 -16.416 -2.671 2.241 400 HG21 THR 59 HG21 THR 59 -15.100 -4.375 3.058 401 HG22 THR 59 HG22 THR 59 -14.021 -2.991 2.884 402 HG23 THR 59 HG23 THR 59 -13.571 -4.553 2.198 403 HA PRO 60 HA PRO 60 -14.600 1.608 1.751 404 HB2 PRO 60 HB2 PRO 60 -17.236 2.203 1.903 405 HB3 PRO 60 HB1 PRO 60 -16.294 2.373 0.419 406 HG2 PRO 60 HG2 PRO 60 -18.102 0.135 1.271 407 HG3 PRO 60 HG1 PRO 60 -18.002 0.942 -0.298 408 HD2 PRO 60 HD2 PRO 60 -16.828 -1.437 0.118 409 HD3 PRO 60 HD1 PRO 60 -16.081 -0.217 -0.915 410 H SER 61 HN SER 61 -16.849 -0.903 2.878 411 HA SER 61 HA SER 61 -17.288 0.244 5.477 412 HB2 SER 61 HB2 SER 61 -18.680 -1.578 4.432 413 HB3 SER 61 HB1 SER 61 -17.349 -2.696 4.735 414 HG SER 61 HG SER 61 -19.153 -2.379 6.376 415 H LYS 62 HN LYS 62 -15.059 -2.332 4.374 416 HA LYS 62 HA LYS 62 -13.715 -2.382 6.975 417 HB2 LYS 62 HB2 LYS 62 -13.058 -3.708 4.330 418 HB3 LYS 62 HB1 LYS 62 -12.177 -3.990 5.830 419 HG2 LYS 62 HG2 LYS 62 -14.337 -4.695 6.895 420 HG3 LYS 62 HG1 LYS 62 -15.113 -4.552 5.318 421 HD2 LYS 62 HD2 LYS 62 -13.495 -6.203 4.400 422 HD3 LYS 62 HD1 LYS 62 -12.792 -6.380 6.007 423 HE2 LYS 62 HE2 LYS 62 -14.523 -7.656 6.756 424 HE3 LYS 62 HE1 LYS 62 -15.728 -6.685 5.909 425 HZ1 LYS 62 HZ1 LYS 62 -14.122 -8.937 4.905 426 HZ2 LYS 62 HZ2 LYS 62 -14.702 -7.765 3.820 427 HZ3 LYS 62 HZ3 LYS 62 -15.790 -8.666 4.766 428 H LEU 63 HN LEU 63 -12.864 -1.302 3.673 429 HA LEU 63 HA LEU 63 -10.240 -0.425 4.279 430 HB2 LEU 63 HB2 LEU 63 -11.415 -0.618 1.982 431 HB3 LEU 63 HB1 LEU 63 -12.038 0.998 2.311 432 HG LEU 63 HG LEU 63 -9.900 1.970 2.256 433 HD11 LEU 63 HD21 LEU 63 -8.647 0.598 3.747 434 HD12 LEU 63 HD22 LEU 63 -7.816 0.465 2.196 435 HD13 LEU 63 HD23 LEU 63 -8.876 -0.835 2.742 436 HD21 LEU 63 HD11 LEU 63 -9.388 1.590 0.072 437 HD22 LEU 63 HD12 LEU 63 -10.767 0.490 0.118 438 HD23 LEU 63 HD13 LEU 63 -9.130 -0.132 0.337 439 H GLN 64 HN GLN 64 -13.304 1.427 4.338 440 HA GLN 64 HA GLN 64 -12.216 3.909 5.136 441 HB2 GLN 64 HB2 GLN 64 -14.862 2.610 5.843 442 HB3 GLN 64 HB1 GLN 64 -14.461 4.277 6.255 443 HG2 GLN 64 HG2 GLN 64 -14.208 4.868 3.930 444 HG3 GLN 64 HG1 GLN 64 -14.333 3.180 3.433 445 HE21 GLN 64 HE21 GLN 64 -16.140 5.084 2.366 446 HE22 GLN 64 HE22 GLN 64 -17.686 4.845 3.025 447 H ALA 65 HN ALA 65 -12.938 1.006 7.015 448 HA ALA 65 HA ALA 65 -12.577 2.127 9.617 449 HB1 ALA 65 HB1 ALA 65 -12.759 -0.531 8.438 450 HB2 ALA 65 HB2 ALA 65 -13.230 0.005 10.050 451 HB3 ALA 65 HB3 ALA 65 -11.565 -0.483 9.734 452 H LEU 66 HN LEU 66 -10.292 0.705 7.295 453 HA LEU 66 HA LEU 66 -7.973 0.995 8.989 454 HB2 LEU 66 HB2 LEU 66 -8.085 -0.513 6.989 455 HB3 LEU 66 HB1 LEU 66 -8.101 0.917 5.958 456 HG LEU 66 HG LEU 66 -5.948 1.289 7.740 457 HD11 LEU 66 HD21 LEU 66 -6.278 -1.249 8.089 458 HD12 LEU 66 HD22 LEU 66 -4.661 -0.702 7.648 459 HD13 LEU 66 HD23 LEU 66 -5.712 -1.421 6.428 460 HD21 LEU 66 HD11 LEU 66 -6.223 1.924 5.298 461 HD22 LEU 66 HD12 LEU 66 -5.826 0.254 4.896 462 HD23 LEU 66 HD13 LEU 66 -4.642 1.269 5.717 463 H ASP 67 HN ASP 67 -9.415 2.995 6.415 464 HA ASP 67 HA ASP 67 -7.519 5.029 6.201 465 HB2 ASP 67 HB1 ASP 67 -9.736 4.843 4.972 466 HB3 ASP 67 HB2 ASP 67 -10.494 5.545 6.400 467 H MET 68 HN MET 68 -9.860 4.497 8.800 468 HA MET 68 HA MET 68 -9.406 7.019 10.122 469 HB2 MET 68 HB2 MET 68 -10.389 4.385 11.261 470 HB3 MET 68 HB1 MET 68 -10.520 5.956 12.051 471 HG2 MET 68 HG2 MET 68 -11.894 6.786 10.177 472 HG3 MET 68 HG1 MET 68 -11.758 5.219 9.380 473 HE1 MET 68 HE1 MET 68 -14.049 6.391 13.134 474 HE2 MET 68 HE2 MET 68 -12.810 7.278 12.249 475 HE3 MET 68 HE3 MET 68 -12.340 5.990 13.355 476 H ALA 69 HN ALA 69 -7.911 3.813 10.405 477 HA ALA 69 HA ALA 69 -6.406 4.230 12.758 478 HB1 ALA 69 HB1 ALA 69 -5.252 2.326 12.170 479 HB2 ALA 69 HB2 ALA 69 -5.077 2.826 10.487 480 HB3 ALA 69 HB3 ALA 69 -6.611 2.169 11.057 481 H PHE 70 HN PHE 70 -5.767 5.293 9.440 482 HA PHE 70 HA PHE 70 -3.088 6.216 9.923 483 HB2 PHE 70 HB1 PHE 70 -3.899 5.876 7.648 484 HB3 PHE 70 HB2 PHE 70 -5.144 7.103 7.879 485 HD1 PHE 70 HD2 PHE 70 -1.428 6.675 8.169 486 HD2 PHE 70 HD1 PHE 70 -4.694 9.295 7.217 487 HE1 PHE 70 HE2 PHE 70 0.182 8.435 7.490 488 HE2 PHE 70 HE1 PHE 70 -3.086 11.056 6.538 489 HZ PHE 70 HZ PHE 70 -0.647 10.626 6.675 490 H ALA 71 HN ALA 71 -6.267 7.730 10.274 491 HA ALA 71 HA ALA 71 -5.251 10.386 10.777 492 HB1 ALA 71 HB1 ALA 71 -7.478 10.574 10.297 493 HB2 ALA 71 HB2 ALA 71 -7.658 10.375 12.040 494 HB3 ALA 71 HB3 ALA 71 -7.858 8.989 10.968 495 H SER 72 HN SER 72 -5.845 7.565 12.798 496 HA SER 72 HA SER 72 -5.697 8.953 15.321 497 HB2 SER 72 HB2 SER 72 -6.659 6.660 15.018 498 HB3 SER 72 HB1 SER 72 -5.026 6.055 14.736 499 HG SER 72 HG SER 72 -4.811 5.982 16.803 500 H SER 73 HN SER 73 -3.276 7.272 13.322 501 HA SER 73 HA SER 73 -1.123 7.620 15.207 502 HB2 SER 73 HB1 SER 73 0.310 6.839 13.464 503 HB3 SER 73 HB2 SER 73 -1.209 5.969 13.270 504 HG SER 73 HG SER 73 -1.564 6.965 11.457 505 H VAL 74 HN VAL 74 -2.051 9.407 12.268 506 HA VAL 74 HA VAL 74 0.061 11.282 12.310 507 HB VAL 74 HB VAL 74 -1.316 12.668 10.898 508 HG11 VAL 74 HG21 VAL 74 -1.045 11.077 9.328 509 HG12 VAL 74 HG22 VAL 74 -2.604 10.402 9.803 510 HG13 VAL 74 HG23 VAL 74 -1.121 9.808 10.550 511 HG21 VAL 74 HG11 VAL 74 -3.308 12.632 12.418 512 HG22 VAL 74 HG12 VAL 74 -3.678 11.011 11.829 513 HG23 VAL 74 HG13 VAL 74 -3.726 12.383 10.722 514 H ALA 75 HN ALA 75 -3.011 11.267 14.079 515 HA ALA 75 HA ALA 75 -2.642 13.930 15.172 516 HB1 ALA 75 HB1 ALA 75 -4.429 11.619 15.966 517 HB2 ALA 75 HB2 ALA 75 -4.884 13.065 15.066 518 HB3 ALA 75 HB3 ALA 75 -4.460 13.186 16.774 519 H GLN 76 HN GLN 76 -1.936 10.642 16.305 520 HA GLN 76 HA GLN 76 -1.119 11.457 18.952 521 HB2 GLN 76 HB2 GLN 76 -0.470 8.981 17.325 522 HB3 GLN 76 HB1 GLN 76 -0.052 9.188 19.027 523 HG2 GLN 76 HG2 GLN 76 -2.410 9.428 19.615 524 HG3 GLN 76 HG1 GLN 76 -2.871 9.353 17.914 525 HE21 GLN 76 HE21 GLN 76 -3.916 7.439 19.729 526 HE22 GLN 76 HE22 GLN 76 -3.227 5.923 19.405 527 H ILE 77 HN ILE 77 0.702 10.720 15.967 528 HA ILE 77 HA ILE 77 3.304 11.094 17.000 529 HB ILE 77 HB ILE 77 2.226 11.741 14.243 530 HG12 ILE 77 HG12 ILE 77 3.770 9.326 15.224 531 HG13 ILE 77 HG11 ILE 77 2.013 9.367 15.080 532 HG21 ILE 77 HG21 ILE 77 4.605 11.549 13.540 533 HG22 ILE 77 HG22 ILE 77 5.074 11.412 15.235 534 HG23 ILE 77 HG23 ILE 77 4.345 12.903 14.639 535 HD11 ILE 77 HD11 ILE 77 4.056 9.109 12.984 536 HD12 ILE 77 HD12 ILE 77 2.839 10.336 12.627 537 HD13 ILE 77 HD13 ILE 77 2.347 8.671 12.947 538 H ALA 78 HN ALA 78 1.071 13.494 15.623 539 HA ALA 78 HA ALA 78 2.927 15.696 16.090 540 HB1 ALA 78 HB1 ALA 78 1.220 15.714 14.268 541 HB2 ALA 78 HB2 ALA 78 1.099 17.118 15.329 542 HB3 ALA 78 HB3 ALA 78 -0.043 15.785 15.496 543 H ALA 79 HN ALA 79 -0.171 14.681 17.576 544 HA ALA 79 HA ALA 79 -0.242 16.677 19.590 545 HB1 ALA 79 HB1 ALA 79 -1.186 13.880 20.157 546 HB2 ALA 79 HB2 ALA 79 -1.998 14.839 18.920 547 HB3 ALA 79 HB3 ALA 79 -1.939 15.415 20.585 548 H SER 80 HN SER 80 1.757 13.862 19.274 549 HA SER 80 HA SER 80 2.455 13.665 22.096 550 HB2 SER 80 HB2 SER 80 3.718 12.557 19.575 551 HB3 SER 80 HB1 SER 80 4.346 12.233 21.192 552 HG SER 80 HG SER 80 2.010 11.621 21.596 553 H GLN 81 HN GLN 81 3.447 15.641 19.440 554 HA GLN 81 HA GLN 81 6.112 16.264 20.133 555 HB2 GLN 81 HB2 GLN 81 3.944 18.019 18.948 556 HB3 GLN 81 HB1 GLN 81 5.642 18.486 19.042 557 HG2 GLN 81 HG2 GLN 81 6.215 16.393 17.775 558 HG3 GLN 81 HG1 GLN 81 4.489 16.108 17.560 559 HE21 GLN 81 HE21 GLN 81 3.288 17.627 16.179 560 HE22 GLN 81 HE22 GLN 81 4.094 18.689 15.129 561 H GLY 82 HN GLY 82 3.077 17.381 21.529 562 HA2 GLY 82 HA2 GLY 82 2.736 18.384 23.643 563 HA3 GLY 82 HA1 GLY 82 4.475 18.285 23.923 564 H GLY 83 HN GLY 83 3.391 19.728 20.968 565 HA2 GLY 83 HA1 GLY 83 4.286 22.378 22.001 566 HA3 GLY 83 HA2 GLY 83 4.300 21.901 20.303 567 H ASP 84 HN ASP 84 3.001 23.692 19.658 568 HA ASP 84 HA ASP 84 0.452 24.272 20.902 569 HB2 ASP 84 HB2 ASP 84 1.735 25.082 18.288 570 HB3 ASP 84 HB1 ASP 84 0.100 25.583 18.717 571 H LEU 85 HN LEU 85 -1.351 23.050 20.687 572 HA LEU 85 HA LEU 85 -1.525 20.847 18.839 573 HB2 LEU 85 HB2 LEU 85 -2.752 21.074 21.061 574 HB3 LEU 85 HB1 LEU 85 -3.844 22.192 20.246 575 HG LEU 85 HG LEU 85 -3.945 20.202 18.464 576 HD11 LEU 85 HD11 LEU 85 -4.131 18.176 20.327 577 HD12 LEU 85 HD12 LEU 85 -2.704 19.056 20.873 578 HD13 LEU 85 HD13 LEU 85 -2.771 18.416 19.231 579 HD21 LEU 85 HD21 LEU 85 -5.776 21.266 19.929 580 HD22 LEU 85 HD22 LEU 85 -5.480 19.940 21.054 581 HD23 LEU 85 HD23 LEU 85 -6.037 19.599 19.417 582 H GLY 86 HN GLY 86 -2.187 24.215 18.554 583 HA2 GLY 86 HA2 GLY 86 -4.184 24.053 16.469 584 HA3 GLY 86 HA1 GLY 86 -3.219 25.477 16.858 585 H VAL 87 HN VAL 87 -0.684 23.922 16.539 586 HA VAL 87 HA VAL 87 -0.267 24.456 13.736 587 HB VAL 87 HB VAL 87 1.424 22.900 15.718 588 HG11 VAL 87 HG21 VAL 87 2.831 22.458 14.019 589 HG12 VAL 87 HG22 VAL 87 2.877 24.164 13.576 590 HG13 VAL 87 HG23 VAL 87 1.635 23.110 12.899 591 HG21 VAL 87 HG11 VAL 87 2.717 25.016 15.827 592 HG22 VAL 87 HG12 VAL 87 1.056 25.237 16.375 593 HG23 VAL 87 HG13 VAL 87 1.533 25.778 14.765 594 H THR 88 HN THR 88 -0.437 21.392 15.593 595 HA THR 88 HA THR 88 -0.106 19.615 13.444 596 HB THR 88 HB THR 88 -2.023 19.252 15.763 597 HG1 THR 88 HG1 THR 88 -0.212 19.426 16.823 598 HG21 THR 88 HG21 THR 88 -1.562 16.855 15.385 599 HG22 THR 88 HG22 THR 88 -0.548 17.273 14.003 600 HG23 THR 88 HG23 THR 88 -2.280 17.602 13.957 601 H THR 89 HN THR 89 -3.148 21.030 14.648 602 HA THR 89 HA THR 89 -4.919 19.859 12.807 603 HB THR 89 HB THR 89 -5.005 22.733 13.780 604 HG1 THR 89 HG1 THR 89 -6.214 21.843 15.485 605 HG21 THR 89 HG21 THR 89 -6.568 21.876 11.892 606 HG22 THR 89 HG22 THR 89 -7.302 22.697 13.270 607 HG23 THR 89 HG23 THR 89 -7.345 20.938 13.168 608 H ASN 90 HN ASN 90 -3.040 22.876 12.446 609 HA ASN 90 HA ASN 90 -3.872 23.305 9.711 610 HB2 ASN 90 HB2 ASN 90 -1.468 24.367 11.227 611 HB3 ASN 90 HB1 ASN 90 -2.035 24.971 9.670 612 HD21 ASN 90 HD21 ASN 90 -1.935 26.620 12.049 613 HD22 ASN 90 HD22 ASN 90 -3.532 27.057 12.423 614 H ALA 91 HN ALA 91 -1.211 21.580 11.248 615 HA ALA 91 HA ALA 91 0.247 21.177 8.756 616 HB1 ALA 91 HB1 ALA 91 1.871 20.284 10.078 617 HB2 ALA 91 HB2 ALA 91 0.725 19.286 10.972 618 HB3 ALA 91 HB3 ALA 91 0.932 20.986 11.395 619 H ILE 92 HN ILE 92 -1.466 18.903 10.928 620 HA ILE 92 HA ILE 92 -1.458 16.726 9.093 621 HB ILE 92 HB ILE 92 -3.391 17.390 11.334 622 HG12 ILE 92 HG11 ILE 92 -0.903 15.663 11.178 623 HG13 ILE 92 HG12 ILE 92 -1.105 17.140 12.121 624 HG21 ILE 92 HG21 ILE 92 -3.994 15.644 9.417 625 HG22 ILE 92 HG22 ILE 92 -4.338 15.291 11.110 626 HG23 ILE 92 HG23 ILE 92 -2.904 14.611 10.340 627 HD11 ILE 92 HD11 ILE 92 -1.425 15.341 13.663 628 HD12 ILE 92 HD12 ILE 92 -2.466 14.470 12.538 629 HD13 ILE 92 HD13 ILE 92 -3.039 15.952 13.302 630 H ALA 93 HN ALA 93 -3.950 19.207 9.724 631 HA ALA 93 HA ALA 93 -5.874 18.208 7.878 632 HB1 ALA 93 HB1 ALA 93 -5.375 21.107 8.615 633 HB2 ALA 93 HB2 ALA 93 -6.316 19.978 9.587 634 HB3 ALA 93 HB3 ALA 93 -6.872 20.430 7.976 635 H ASP 94 HN ASP 94 -3.297 20.649 7.402 636 HA ASP 94 HA ASP 94 -3.875 21.293 4.718 637 HB2 ASP 94 HB1 ASP 94 -2.102 22.332 6.251 638 HB3 ASP 94 HB2 ASP 94 -1.062 20.989 5.775 639 H ALA 95 HN ALA 95 -1.597 18.783 5.899 640 HA ALA 95 HA ALA 95 -0.900 17.718 3.385 641 HB1 ALA 95 HB1 ALA 95 -1.081 15.502 5.085 642 HB2 ALA 95 HB2 ALA 95 -0.760 16.860 6.163 643 HB3 ALA 95 HB3 ALA 95 0.343 16.511 4.831 644 H LEU 96 HN LEU 96 -3.681 16.921 5.467 645 HA LEU 96 HA LEU 96 -4.715 14.876 3.711 646 HB2 LEU 96 HB2 LEU 96 -6.297 16.570 5.657 647 HB3 LEU 96 HB1 LEU 96 -6.694 14.953 5.079 648 HG LEU 96 HG LEU 96 -4.070 15.390 6.463 649 HD11 LEU 96 HD21 LEU 96 -5.428 16.398 8.098 650 HD12 LEU 96 HD22 LEU 96 -5.408 14.705 8.594 651 HD13 LEU 96 HD23 LEU 96 -6.802 15.355 7.731 652 HD21 LEU 96 HD11 LEU 96 -4.490 13.065 7.167 653 HD22 LEU 96 HD12 LEU 96 -4.606 13.223 5.414 654 HD23 LEU 96 HD13 LEU 96 -6.072 13.114 6.389 655 H THR 97 HN THR 97 -5.346 18.356 4.072 656 HA THR 97 HA THR 97 -7.504 18.505 2.207 657 HB THR 97 HB THR 97 -5.430 20.591 2.950 658 HG1 THR 97 HG1 THR 97 -7.184 21.289 4.295 659 HG21 THR 97 HG21 THR 97 -6.349 21.661 1.163 660 HG22 THR 97 HG22 THR 97 -7.691 21.950 2.271 661 HG23 THR 97 HG23 THR 97 -7.761 20.605 1.132 662 H SER 98 HN SER 98 -4.012 19.155 1.731 663 HA SER 98 HA SER 98 -4.208 19.593 -1.086 664 HB2 SER 98 HB2 SER 98 -1.840 18.486 0.451 665 HB3 SER 98 HB1 SER 98 -1.791 19.283 -1.122 666 HG SER 98 HG SER 98 -2.860 21.086 0.077 667 H ALA 99 HN ALA 99 -3.760 16.651 0.832 668 HA ALA 99 HA ALA 99 -3.222 14.933 -1.425 669 HB1 ALA 99 HB1 ALA 99 -2.619 14.269 0.860 670 HB2 ALA 99 HB2 ALA 99 -3.729 13.092 0.160 671 HB3 ALA 99 HB3 ALA 99 -4.319 14.276 1.326 672 H PHE 100 HN PHE 100 -6.192 15.750 0.375 673 HA PHE 100 HA PHE 100 -8.022 13.999 -0.785 674 HB2 PHE 100 HB1 PHE 100 -8.145 16.730 0.326 675 HB3 PHE 100 HB2 PHE 100 -9.446 16.347 -0.800 676 HD1 PHE 100 HD2 PHE 100 -10.643 14.044 -0.453 677 HD2 PHE 100 HD1 PHE 100 -8.292 16.023 2.550 678 HE1 PHE 100 HE2 PHE 100 -11.781 12.720 1.310 679 HE2 PHE 100 HE1 PHE 100 -9.427 14.701 4.309 680 HZ PHE 100 HZ PHE 100 -11.171 13.051 3.689 681 H TYR 101 HN TYR 101 -7.174 17.222 -2.073 682 HA TYR 101 HA TYR 101 -8.554 16.796 -4.569 683 HB2 TYR 101 HB2 TYR 101 -6.318 18.772 -4.180 684 HB3 TYR 101 HB1 TYR 101 -7.778 18.935 -5.160 685 HD1 TYR 101 HD1 TYR 101 -9.907 18.077 -3.380 686 HD2 TYR 101 HD2 TYR 101 -6.417 20.421 -2.499 687 HE1 TYR 101 HE1 TYR 101 -11.087 19.104 -1.456 688 HE2 TYR 101 HE2 TYR 101 -7.598 21.455 -0.579 689 HH TYR 101 HH TYR 101 -11.019 20.854 0.014 690 H GLN 102 HN GLN 102 -5.254 16.269 -3.476 691 HA GLN 102 HA GLN 102 -4.230 15.781 -6.164 692 HB2 GLN 102 HB2 GLN 102 -3.086 15.207 -3.416 693 HB3 GLN 102 HB1 GLN 102 -2.214 14.936 -4.925 694 HG2 GLN 102 HG1 GLN 102 -3.414 17.616 -4.195 695 HG3 GLN 102 HG2 GLN 102 -1.763 17.166 -3.769 696 HE21 GLN 102 HE21 GLN 102 -3.210 19.022 -5.962 697 HE22 GLN 102 HE22 GLN 102 -2.299 18.688 -7.355 698 H THR 103 HN THR 103 -5.926 13.920 -3.795 699 HA THR 103 HA THR 103 -5.021 11.384 -5.062 700 HB THR 103 HB THR 103 -6.137 10.298 -3.129 701 HG1 THR 103 HG1 THR 103 -6.674 11.954 -1.435 702 HG21 THR 103 HG21 THR 103 -4.105 12.475 -2.676 703 HG22 THR 103 HG22 THR 103 -3.849 10.732 -2.761 704 HG23 THR 103 HG23 THR 103 -4.638 11.440 -1.352 705 H THR 104 HN THR 104 -8.175 12.720 -3.910 706 HA THR 104 HA THR 104 -9.378 11.405 -6.316 707 HB THR 104 HB THR 104 -10.202 10.025 -4.647 708 HG1 THR 104 HG1 THR 104 -11.900 11.318 -5.706 709 HG21 THR 104 HG21 THR 104 -9.745 12.414 -2.941 710 HG22 THR 104 HG22 THR 104 -9.384 10.717 -2.623 711 HG23 THR 104 HG23 THR 104 -11.031 11.320 -2.432 712 H GLY 105 HN GLY 105 -9.780 14.009 -3.908 713 HA2 GLY 105 HA2 GLY 105 -10.286 16.282 -4.738 714 HA3 GLY 105 HA1 GLY 105 -11.223 15.540 -6.032 715 H VAL 106 HN VAL 106 -11.197 14.951 -2.506 716 HA VAL 106 HA VAL 106 -14.142 15.456 -2.535 717 HB VAL 106 HB VAL 106 -12.565 13.799 -0.547 718 HG11 VAL 106 HG21 VAL 106 -14.928 12.874 -0.168 719 HG12 VAL 106 HG22 VAL 106 -15.504 14.259 -1.095 720 HG13 VAL 106 HG23 VAL 106 -14.627 14.511 0.414 721 HG21 VAL 106 HG11 VAL 106 -13.133 11.856 -1.765 722 HG22 VAL 106 HG12 VAL 106 -12.623 12.992 -3.014 723 HG23 VAL 106 HG13 VAL 106 -14.340 12.707 -2.731 724 H VAL 107 HN VAL 107 -14.935 16.236 -0.321 725 HA VAL 107 HA VAL 107 -13.562 18.667 0.363 726 HB VAL 107 HB VAL 107 -15.236 18.729 2.263 727 HG11 VAL 107 HG21 VAL 107 -15.563 19.214 -0.402 728 HG12 VAL 107 HG22 VAL 107 -16.803 19.536 0.811 729 HG13 VAL 107 HG23 VAL 107 -16.849 18.040 -0.122 730 HG21 VAL 107 HG11 VAL 107 -16.924 16.994 2.370 731 HG22 VAL 107 HG12 VAL 107 -15.344 16.220 2.483 732 HG23 VAL 107 HG13 VAL 107 -16.239 16.178 0.966 733 H ASN 108 HN ASN 108 -11.791 18.842 1.634 734 HA ASN 108 HA ASN 108 -10.768 16.610 3.158 735 HB2 ASN 108 HB2 ASN 108 -8.959 18.059 3.751 736 HB3 ASN 108 HB1 ASN 108 -9.400 18.486 2.098 737 HD21 ASN 108 HD21 ASN 108 -9.510 20.716 1.820 738 HD22 ASN 108 HD22 ASN 108 -10.022 21.825 2.997 739 H SER 109 HN SER 109 -12.884 19.259 3.869 740 HA SER 109 HA SER 109 -12.521 19.494 6.667 741 HB2 SER 109 HB2 SER 109 -14.750 20.463 6.711 742 HB3 SER 109 HB1 SER 109 -13.916 21.013 5.258 743 HG SER 109 HG SER 109 -15.224 19.873 4.049 744 H ARG 110 HN ARG 110 -14.355 17.087 4.812 745 HA ARG 110 HA ARG 110 -15.825 16.024 7.025 746 HB2 ARG 110 HB2 ARG 110 -14.835 14.577 4.551 747 HB3 ARG 110 HB1 ARG 110 -16.118 14.025 5.626 748 HG2 ARG 110 HG1 ARG 110 -16.250 16.726 4.285 749 HG3 ARG 110 HG2 ARG 110 -16.824 15.270 3.473 750 HD2 ARG 110 HD1 ARG 110 -18.326 14.812 5.393 751 HD3 ARG 110 HD2 ARG 110 -17.773 16.297 6.166 752 HE ARG 110 HE ARG 110 -19.440 16.162 3.703 753 HH11 ARG 110 HH21 ARG 110 -17.316 18.435 4.317 754 HH12 ARG 110 HH22 ARG 110 -18.398 19.677 4.854 755 HH21 ARG 110 HH11 ARG 110 -21.098 17.533 5.224 756 HH22 ARG 110 HH12 ARG 110 -20.539 19.166 5.367 757 H PHE 111 HN PHE 111 -12.807 14.778 5.530 758 HA PHE 111 HA PHE 111 -12.382 12.919 7.731 759 HB2 PHE 111 HB2 PHE 111 -11.576 12.497 5.408 760 HB3 PHE 111 HB1 PHE 111 -10.428 13.821 5.598 761 HD1 PHE 111 HD2 PHE 111 -11.488 10.579 7.129 762 HD2 PHE 111 HD1 PHE 111 -8.333 13.448 6.617 763 HE1 PHE 111 HE2 PHE 111 -9.902 9.035 8.250 764 HE2 PHE 111 HE1 PHE 111 -6.748 11.904 7.736 765 HZ PHE 111 HZ PHE 111 -7.532 9.698 8.553 766 H ILE 112 HN ILE 112 -10.756 15.917 6.672 767 HA ILE 112 HA ILE 112 -8.855 16.062 8.751 768 HB ILE 112 HB ILE 112 -10.275 18.274 7.246 769 HG12 ILE 112 HG12 ILE 112 -7.632 16.835 6.915 770 HG13 ILE 112 HG11 ILE 112 -8.984 16.866 5.782 771 HG21 ILE 112 HG21 ILE 112 -7.676 18.497 8.778 772 HG22 ILE 112 HG22 ILE 112 -9.228 18.919 9.502 773 HG23 ILE 112 HG23 ILE 112 -8.647 19.799 8.090 774 HD11 ILE 112 HD11 ILE 112 -8.672 19.367 5.613 775 HD12 ILE 112 HD12 ILE 112 -7.325 18.425 4.974 776 HD13 ILE 112 HD13 ILE 112 -7.195 19.185 6.560 777 H SER 113 HN SER 113 -12.254 17.089 8.722 778 HA SER 113 HA SER 113 -12.193 18.490 11.218 779 HB2 SER 113 HB2 SER 113 -14.640 18.140 11.239 780 HB3 SER 113 HB1 SER 113 -14.086 18.662 9.648 781 HG SER 113 HG SER 113 -15.357 16.411 10.337 782 H GLU 114 HN GLU 114 -12.565 15.063 10.421 783 HA GLU 114 HA GLU 114 -13.298 14.243 13.095 784 HB2 GLU 114 HB2 GLU 114 -12.021 12.675 10.832 785 HB3 GLU 114 HB1 GLU 114 -12.698 11.967 12.299 786 HG2 GLU 114 HG2 GLU 114 -14.904 12.947 11.741 787 HG3 GLU 114 HG1 GLU 114 -14.222 13.620 10.260 788 H ILE 115 HN ILE 115 -10.215 14.511 11.351 789 HA ILE 115 HA ILE 115 -8.642 13.387 13.512 790 HB ILE 115 HB ILE 115 -7.796 15.180 11.214 791 HG12 ILE 115 HG11 ILE 115 -7.829 12.161 11.506 792 HG13 ILE 115 HG12 ILE 115 -8.867 13.108 10.441 793 HG21 ILE 115 HG21 ILE 115 -5.627 13.711 11.766 794 HG22 ILE 115 HG22 ILE 115 -6.344 13.721 13.376 795 HG23 ILE 115 HG23 ILE 115 -5.940 15.242 12.582 796 HD11 ILE 115 HD11 ILE 115 -6.507 12.015 9.645 797 HD12 ILE 115 HD12 ILE 115 -5.957 13.607 10.165 798 HD13 ILE 115 HD13 ILE 115 -7.198 13.466 8.920 799 H ARG 116 HN ARG 116 -9.438 16.693 12.462 800 HA ARG 116 HA ARG 116 -7.808 18.129 14.256 801 HB2 ARG 116 HB2 ARG 116 -9.006 19.352 12.586 802 HB3 ARG 116 HB1 ARG 116 -10.557 18.725 13.143 803 HG2 ARG 116 HG2 ARG 116 -10.510 20.037 15.111 804 HG3 ARG 116 HG1 ARG 116 -8.782 20.355 14.959 805 HD2 ARG 116 HD2 ARG 116 -9.311 21.593 12.806 806 HD3 ARG 116 HD1 ARG 116 -11.016 21.451 13.233 807 HE ARG 116 HE ARG 116 -9.129 23.300 14.417 808 HH11 ARG 116 HH21 ARG 116 -11.977 23.972 14.239 809 HH12 ARG 116 HH22 ARG 116 -12.537 23.770 15.866 810 HH21 ARG 116 HH11 ARG 116 -9.801 21.885 16.856 811 HH22 ARG 116 HH12 ARG 116 -11.305 22.589 17.348 812 H SER 117 HN SER 117 -11.044 16.735 14.781 813 HA SER 117 HA SER 117 -11.261 17.721 17.495 814 HB2 SER 117 HB2 SER 117 -13.221 17.045 16.090 815 HB3 SER 117 HB1 SER 117 -12.691 15.369 16.221 816 HG SER 117 HG SER 117 -13.480 15.289 18.150 817 H LEU 118 HN LEU 118 -10.015 14.762 16.019 818 HA LEU 118 HA LEU 118 -9.766 13.276 18.473 819 HB2 LEU 118 HB2 LEU 118 -8.376 13.052 15.794 820 HB3 LEU 118 HB1 LEU 118 -8.078 11.932 17.122 821 HG LEU 118 HG LEU 118 -10.884 12.507 16.175 822 HD11 LEU 118 HD21 LEU 118 -9.255 10.164 15.201 823 HD12 LEU 118 HD22 LEU 118 -9.260 11.689 14.316 824 HD13 LEU 118 HD23 LEU 118 -10.765 10.802 14.551 825 HD21 LEU 118 HD11 LEU 118 -9.635 10.056 17.451 826 HD22 LEU 118 HD12 LEU 118 -11.354 10.374 17.219 827 HD23 LEU 118 HD13 LEU 118 -10.425 11.342 18.365 828 H ILE 119 HN ILE 119 -7.519 15.373 16.668 829 HA ILE 119 HA ILE 119 -5.224 14.940 18.282 830 HB ILE 119 HB ILE 119 -6.064 17.523 16.930 831 HG12 ILE 119 HG12 ILE 119 -4.279 15.348 15.821 832 HG13 ILE 119 HG11 ILE 119 -6.013 15.394 15.504 833 HG21 ILE 119 HG21 ILE 119 -3.225 16.805 17.039 834 HG22 ILE 119 HG22 ILE 119 -3.934 17.027 18.638 835 HG23 ILE 119 HG23 ILE 119 -4.012 18.329 17.450 836 HD11 ILE 119 HD11 ILE 119 -3.998 17.559 14.832 837 HD12 ILE 119 HD12 ILE 119 -5.742 17.718 14.619 838 HD13 ILE 119 HD13 ILE 119 -4.845 16.521 13.684 839 H GLY 120 HN GLY 120 -7.923 17.228 18.676 840 HA2 GLY 120 HA1 GLY 120 -6.837 18.543 20.990 841 HA3 GLY 120 HA2 GLY 120 -8.537 18.545 20.520 842 H MET 121 HN MET 121 -8.687 15.586 20.540 843 HA MET 121 HA MET 121 -9.454 15.233 23.290 844 HB2 MET 121 HB2 MET 121 -10.467 13.981 21.383 845 HB3 MET 121 HB1 MET 121 -8.948 13.104 21.189 846 HG2 MET 121 HG1 MET 121 -9.160 12.336 23.570 847 HG3 MET 121 HG2 MET 121 -10.752 13.094 23.628 848 HE1 MET 121 HE1 MET 121 -11.769 12.485 20.508 849 HE2 MET 121 HE2 MET 121 -12.561 12.716 22.064 850 HE3 MET 121 HE3 MET 121 -12.881 11.257 21.128 851 H PHE 122 HN PHE 122 -6.601 14.231 21.422 852 HA PHE 122 HA PHE 122 -5.409 12.594 23.423 853 HB2 PHE 122 HB1 PHE 122 -4.203 14.272 21.211 854 HB3 PHE 122 HB2 PHE 122 -3.239 13.215 22.243 855 HD1 PHE 122 HD2 PHE 122 -3.828 10.740 22.353 856 HD2 PHE 122 HD1 PHE 122 -5.458 13.396 19.395 857 HE1 PHE 122 HE2 PHE 122 -4.459 8.793 20.954 858 HE2 PHE 122 HE1 PHE 122 -6.088 11.449 17.995 859 HZ PHE 122 HZ PHE 122 -5.589 9.147 18.774 860 H ALA 123 HN ALA 123 -4.849 16.062 22.705 861 HA ALA 123 HA ALA 123 -3.063 16.558 24.845 862 HB1 ALA 123 HB1 ALA 123 -3.570 18.893 24.544 863 HB2 ALA 123 HB2 ALA 123 -5.129 18.516 23.811 864 HB3 ALA 123 HB3 ALA 123 -3.636 18.141 22.949 865 H GLN 124 HN GLN 124 -6.597 16.505 24.768 866 HA GLN 124 HA GLN 124 -6.940 17.506 27.459 867 HB2 GLN 124 HB2 GLN 124 -8.761 15.863 25.673 868 HB3 GLN 124 HB1 GLN 124 -9.251 16.548 27.223 869 HG2 GLN 124 HG2 GLN 124 -8.744 18.808 26.405 870 HG3 GLN 124 HG1 GLN 124 -8.196 18.142 24.867 871 HE21 GLN 124 HE21 GLN 124 -10.364 19.991 24.944 872 HE22 GLN 124 HE22 GLN 124 -11.790 19.176 24.512 873 H ALA 125 HN ALA 125 -6.395 14.329 26.061 874 HA ALA 125 HA ALA 125 -7.162 12.751 28.315 875 HB1 ALA 125 HB1 ALA 125 -6.512 11.057 26.975 876 HB2 ALA 125 HB2 ALA 125 -4.860 11.668 26.907 877 HB3 ALA 125 HB3 ALA 125 -6.071 12.274 25.778 878 H SER 126 HN SER 126 -4.166 14.459 27.523 879 HA SER 126 HA SER 126 -2.473 13.331 29.491 880 HB2 SER 126 HB2 SER 126 -2.527 16.242 28.642 881 HB3 SER 126 HB1 SER 126 -1.152 15.359 29.306 882 HG SER 126 HG SER 126 -1.605 15.633 26.836 883 H ALA 127 HN ALA 127 -4.969 15.822 29.766 884 HA ALA 127 HA ALA 127 -4.298 16.548 32.490 885 HB1 ALA 127 HB1 ALA 127 -6.583 17.596 32.471 886 HB2 ALA 127 HB2 ALA 127 -6.832 16.910 30.866 887 HB3 ALA 127 HB3 ALA 127 -5.563 18.106 31.127 888 H ASN 128 HN ASN 128 -5.875 13.857 31.078 889 HA ASN 128 HA ASN 128 -7.721 13.215 33.182 890 HB2 ASN 128 HB2 ASN 128 -6.291 11.481 31.149 891 HB3 ASN 128 HB1 ASN 128 -7.524 10.867 32.251 892 HD21 ASN 128 HD21 ASN 128 -8.037 10.751 29.490 893 HD22 ASN 128 HD22 ASN 128 -9.197 11.913 29.058 894 H ASP 129 HN ASP 129 -4.265 12.788 32.818 895 HA ASP 129 HA ASP 129 -3.922 10.791 34.861 896 HB2 ASP 129 HB2 ASP 129 -2.015 12.922 33.848 897 HB3 ASP 129 HB1 ASP 129 -1.554 11.575 34.888 898 H VAL 130 HN VAL 130 -3.752 14.355 34.926 899 HA VAL 130 HA VAL 130 -3.187 14.503 37.752 900 HB VAL 130 HB VAL 130 -2.682 16.391 36.292 901 HG11 VAL 130 HG11 VAL 130 -5.603 16.132 35.652 902 HG12 VAL 130 HG12 VAL 130 -4.241 16.380 34.561 903 HG13 VAL 130 HG13 VAL 130 -4.840 17.718 35.541 904 HG21 VAL 130 HG21 VAL 130 -3.001 17.588 38.176 905 HG22 VAL 130 HG22 VAL 130 -4.363 16.575 38.653 906 HG23 VAL 130 HG23 VAL 130 -4.622 17.955 37.585 907 H TYR 131 HN TYR 131 -6.130 14.310 35.840 908 HA TYR 131 HA TYR 131 -7.728 13.402 38.005 909 HB2 TYR 131 HB2 TYR 131 -9.038 15.330 38.584 910 HB3 TYR 131 HB1 TYR 131 -7.348 15.809 38.735 911 HD1 TYR 131 HD2 TYR 131 -6.297 17.285 37.081 912 HD2 TYR 131 HD1 TYR 131 -10.435 16.178 36.772 913 HE1 TYR 131 HE2 TYR 131 -6.658 19.097 35.427 914 HE2 TYR 131 HE1 TYR 131 -10.797 17.990 35.118 915 HH TYR 131 HH TYR 131 -9.108 20.484 34.728 916 H ALA 132 HN ALA 132 -10.102 13.382 37.360 917 HA ALA 132 HA ALA 132 -10.322 12.667 34.562 918 HB1 ALA 132 HB1 ALA 132 -11.962 11.457 35.543 919 HB2 ALA 132 HB2 ALA 132 -12.920 12.937 35.537 920 HB3 ALA 132 HB3 ALA 132 -11.977 12.502 36.964 921 H SER 133 HN SER 133 -10.578 14.107 32.935 922 HA SER 133 HA SER 133 -11.024 16.893 33.321 923 HB2 SER 133 HB2 SER 133 -11.591 15.249 30.835 924 HB3 SER 133 HB1 SER 133 -11.350 16.994 30.896 925 HG SER 133 HG SER 133 -9.361 16.375 30.499 926 H ALA 134 HN ALA 134 -12.948 18.140 32.625 927 HA ALA 134 HA ALA 134 -15.503 16.689 32.473 928 HB1 ALA 134 HB1 ALA 134 -16.479 17.770 34.431 929 HB2 ALA 134 HB2 ALA 134 -14.974 18.634 34.740 930 HB3 ALA 134 HB3 ALA 134 -15.037 16.882 34.924 931 H GLY 135 HN GLY 135 -17.245 18.100 31.790 932 HA2 GLY 135 HA2 GLY 135 -16.274 20.406 30.254 933 HA3 GLY 135 HA1 GLY 135 -17.913 19.756 30.222 934 H SER 136 HN SER 136 -17.948 22.383 30.342 935 HA SER 136 HA SER 136 -18.393 23.024 33.232 936 HB2 SER 136 HB2 SER 136 -17.740 25.332 32.758 937 HB3 SER 136 HB1 SER 136 -16.441 24.243 32.270 938 HG SER 136 HG SER 136 -16.799 25.677 30.611 939 H GLY 137 HN GLY 137 -20.201 24.460 33.644 940 HA2 GLY 137 HA2 GLY 137 -22.411 24.036 31.771 941 HA3 GLY 137 HA1 GLY 137 -22.518 24.847 33.334 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 -23.225 11.290 -11.155 2 H2 GLY 1 HT2 GLY 1 -22.683 12.010 -9.715 3 H3 GLY 1 HT3 GLY 1 -23.572 10.564 -9.662 4 HA2 GLY 1 HA2 GLY 1 -21.420 10.041 -11.308 5 HA3 GLY 1 HA1 GLY 1 -20.778 10.931 -9.927 6 H MET 2 HN MET 2 -22.040 7.915 -10.999 7 HA MET 2 HA MET 2 -21.847 6.881 -8.198 8 HB2 MET 2 HB2 MET 2 -23.747 6.006 -10.397 9 HB3 MET 2 HB1 MET 2 -23.570 5.193 -8.841 10 HG2 MET 2 HG2 MET 2 -24.155 7.362 -7.715 11 HG3 MET 2 HG1 MET 2 -24.489 8.045 -9.306 12 HE1 MET 2 HE1 MET 2 -25.865 4.213 -7.776 13 HE2 MET 2 HE2 MET 2 -26.582 5.314 -6.603 14 HE3 MET 2 HE3 MET 2 -24.853 5.394 -6.933 15 H GLY 3 HN GLY 3 -20.896 4.781 -7.997 16 HA2 GLY 3 HA2 GLY 3 -19.810 2.809 -8.846 17 HA3 GLY 3 HA1 GLY 3 -19.814 3.532 -10.455 18 H GLN 4 HN GLN 4 -18.842 5.798 -8.158 19 HA GLN 4 HA GLN 4 -15.965 5.187 -8.709 20 HB2 GLN 4 HB2 GLN 4 -17.197 7.933 -8.349 21 HB3 GLN 4 HB1 GLN 4 -15.537 7.569 -8.823 22 HG2 GLN 4 HG1 GLN 4 -18.021 6.850 -10.412 23 HG3 GLN 4 HG2 GLN 4 -16.911 8.169 -10.788 24 HE21 GLN 4 HE21 GLN 4 -17.607 5.299 -12.019 25 HE22 GLN 4 HE22 GLN 4 -16.064 4.713 -12.413 26 H ALA 5 HN ALA 5 -14.580 5.274 -6.948 27 HA ALA 5 HA ALA 5 -15.638 5.005 -4.323 28 HB1 ALA 5 HB1 ALA 5 -13.494 4.513 -3.778 29 HB2 ALA 5 HB2 ALA 5 -12.897 6.046 -4.413 30 HB3 ALA 5 HB3 ALA 5 -13.152 4.679 -5.500 31 H ASN 6 HN ASN 6 -14.259 7.825 -6.000 32 HA ASN 6 HA ASN 6 -14.297 10.101 -5.423 33 HB2 ASN 6 HB1 ASN 6 -16.805 9.202 -3.967 34 HB3 ASN 6 HB2 ASN 6 -16.386 10.874 -4.345 35 HD21 ASN 6 HD21 ASN 6 -18.754 9.453 -5.364 36 HD22 ASN 6 HD22 ASN 6 -18.603 9.425 -7.055 37 H THR 7 HN THR 7 -12.759 8.321 -3.719 38 HA THR 7 HA THR 7 -12.400 10.099 -1.447 39 HB THR 7 HB THR 7 -12.712 7.581 -0.172 40 HG1 THR 7 HG1 THR 7 -15.075 7.484 -0.636 41 HG21 THR 7 HG21 THR 7 -13.000 9.806 0.847 42 HG22 THR 7 HG22 THR 7 -14.426 8.800 1.106 43 HG23 THR 7 HG23 THR 7 -14.450 10.063 -0.125 44 HA PRO 8 HA PRO 8 -8.330 8.410 -1.977 45 HB2 PRO 8 HB2 PRO 8 -7.226 9.136 0.381 46 HB3 PRO 8 HB1 PRO 8 -7.539 10.278 -0.928 47 HG2 PRO 8 HG1 PRO 8 -9.125 9.748 1.548 48 HG3 PRO 8 HG2 PRO 8 -8.744 11.291 0.782 49 HD2 PRO 8 HD1 PRO 8 -11.154 10.074 0.496 50 HD3 PRO 8 HD2 PRO 8 -10.448 11.092 -0.760 51 H TRP 9 HN TRP 9 -10.079 7.672 1.045 52 HA TRP 9 HA TRP 9 -8.379 5.307 1.498 53 HB2 TRP 9 HB2 TRP 9 -9.960 4.894 3.417 54 HB3 TRP 9 HB1 TRP 9 -9.143 6.455 3.486 55 HD1 TRP 9 HD1 TRP 9 -12.534 4.862 2.814 56 HE1 TRP 9 HE1 TRP 9 -14.351 6.691 2.912 57 HE3 TRP 9 HE3 TRP 9 -9.585 9.005 3.192 58 HZ2 TRP 9 HZ2 TRP 9 -14.526 9.540 3.126 59 HZ3 TRP 9 HZ3 TRP 9 -10.597 11.263 3.343 60 HH2 TRP 9 HH2 TRP 9 -13.063 11.538 3.311 61 H SER 10 HN SER 10 -11.543 6.093 0.186 62 HA SER 10 HA SER 10 -12.690 3.492 0.185 63 HB2 SER 10 HB2 SER 10 -14.089 4.305 -1.667 64 HB3 SER 10 HB1 SER 10 -13.941 5.545 -0.422 65 HG SER 10 HG SER 10 -13.587 6.414 -2.486 66 H SER 11 HN SER 11 -9.975 4.697 -1.515 67 HA SER 11 HA SER 11 -10.012 2.266 -3.252 68 HB2 SER 11 HB1 SER 11 -8.908 5.002 -3.965 69 HB3 SER 11 HB2 SER 11 -8.858 3.569 -4.992 70 HG SER 11 HG SER 11 -10.625 4.817 -5.561 71 H LYS 12 HN LYS 12 -8.041 1.167 -3.396 72 HA LYS 12 HA LYS 12 -6.167 1.580 -1.229 73 HB2 LYS 12 HB2 LYS 12 -6.802 -0.611 -2.482 74 HB3 LYS 12 HB1 LYS 12 -5.590 -0.105 -3.655 75 HG2 LYS 12 HG2 LYS 12 -3.948 0.115 -1.766 76 HG3 LYS 12 HG1 LYS 12 -5.164 -0.575 -0.691 77 HD2 LYS 12 HD2 LYS 12 -3.729 -2.380 -1.412 78 HD3 LYS 12 HD1 LYS 12 -5.273 -2.569 -2.240 79 HE2 LYS 12 HE2 LYS 12 -4.121 -2.586 -4.180 80 HE3 LYS 12 HE1 LYS 12 -3.777 -0.878 -3.902 81 HZ1 LYS 12 HZ1 LYS 12 -2.103 -3.227 -3.330 82 HZ2 LYS 12 HZ2 LYS 12 -1.908 -1.817 -2.401 83 HZ3 LYS 12 HZ3 LYS 12 -1.683 -1.767 -4.085 84 H ALA 13 HN ALA 13 -6.150 2.295 -4.700 85 HA ALA 13 HA ALA 13 -3.388 3.118 -4.797 86 HB1 ALA 13 HB1 ALA 13 -4.895 4.563 -6.733 87 HB2 ALA 13 HB2 ALA 13 -5.602 2.952 -6.615 88 HB3 ALA 13 HB3 ALA 13 -3.889 3.138 -6.992 89 H ASN 14 HN ASN 14 -6.447 4.925 -4.494 90 HA ASN 14 HA ASN 14 -5.134 7.482 -4.163 91 HB2 ASN 14 HB2 ASN 14 -7.918 6.740 -3.229 92 HB3 ASN 14 HB1 ASN 14 -7.320 8.340 -3.669 93 HD21 ASN 14 HD21 ASN 14 -6.071 7.970 -6.085 94 HD22 ASN 14 HD22 ASN 14 -7.166 7.369 -7.235 95 H ALA 15 HN ALA 15 -6.091 4.889 -1.994 96 HA ALA 15 HA ALA 15 -6.017 6.369 0.450 97 HB1 ALA 15 HB1 ALA 15 -5.573 4.123 1.499 98 HB2 ALA 15 HB2 ALA 15 -5.443 3.453 -0.127 99 HB3 ALA 15 HB3 ALA 15 -6.968 4.148 0.421 100 H ASP 16 HN ASP 16 -3.470 4.664 -1.343 101 HA ASP 16 HA ASP 16 -1.415 5.141 0.625 102 HB2 ASP 16 HB2 ASP 16 0.144 4.635 -1.297 103 HB3 ASP 16 HB1 ASP 16 -1.078 3.396 -1.012 104 H ALA 17 HN ALA 17 -2.206 6.781 -2.458 105 HA ALA 17 HA ALA 17 -0.229 8.797 -2.304 106 HB1 ALA 17 HB1 ALA 17 -1.988 10.167 -3.629 107 HB2 ALA 17 HB2 ALA 17 -2.975 8.707 -3.549 108 HB3 ALA 17 HB3 ALA 17 -1.402 8.667 -4.347 109 H PHE 18 HN PHE 18 -3.445 8.617 -0.812 110 HA PHE 18 HA PHE 18 -3.465 11.307 0.197 111 HB2 PHE 18 HB1 PHE 18 -5.480 9.819 0.074 112 HB3 PHE 18 HB2 PHE 18 -4.807 8.863 1.393 113 HD1 PHE 18 HD2 PHE 18 -6.093 12.215 0.448 114 HD2 PHE 18 HD1 PHE 18 -4.865 9.644 3.663 115 HE1 PHE 18 HE2 PHE 18 -7.030 13.821 2.089 116 HE2 PHE 18 HE1 PHE 18 -5.802 11.250 5.305 117 HZ PHE 18 HZ PHE 18 -6.884 13.338 4.518 118 H ILE 19 HN ILE 19 -2.552 8.202 1.713 119 HA ILE 19 HA ILE 19 -1.698 9.337 4.196 120 HB ILE 19 HB ILE 19 -0.831 6.804 2.773 121 HG12 ILE 19 HG12 ILE 19 -2.838 7.361 4.976 122 HG13 ILE 19 HG11 ILE 19 -3.208 6.851 3.330 123 HG21 ILE 19 HG21 ILE 19 0.810 6.751 4.333 124 HG22 ILE 19 HG22 ILE 19 -0.477 6.457 5.501 125 HG23 ILE 19 HG23 ILE 19 0.107 8.097 5.228 126 HD11 ILE 19 HD11 ILE 19 -1.736 4.801 3.809 127 HD12 ILE 19 HD12 ILE 19 -3.297 4.859 4.628 128 HD13 ILE 19 HD13 ILE 19 -1.826 5.275 5.506 129 H ASN 20 HN ASN 20 0.106 8.485 1.238 130 HA ASN 20 HA ASN 20 2.646 9.432 2.211 131 HB2 ASN 20 HB2 ASN 20 2.781 7.963 0.381 132 HB3 ASN 20 HB1 ASN 20 1.510 8.796 -0.508 133 HD21 ASN 20 HD21 ASN 20 2.482 9.697 -2.329 134 HD22 ASN 20 HD22 ASN 20 3.905 10.623 -2.307 135 H SER 21 HN SER 21 0.214 10.892 0.030 136 HA SER 21 HA SER 21 1.509 13.384 -0.334 137 HB2 SER 21 HB1 SER 21 -1.461 12.775 -0.157 138 HB3 SER 21 HB2 SER 21 -0.780 14.280 -0.772 139 HG SER 21 HG SER 21 -0.784 13.227 -2.589 140 H PHE 22 HN PHE 22 -0.324 12.094 2.357 141 HA PHE 22 HA PHE 22 -0.681 14.613 3.734 142 HB2 PHE 22 HB1 PHE 22 -2.141 12.835 4.371 143 HB3 PHE 22 HB2 PHE 22 -0.796 11.721 4.616 144 HD1 PHE 22 HD1 PHE 22 -2.269 14.911 5.885 145 HD2 PHE 22 HD2 PHE 22 0.237 11.528 6.731 146 HE1 PHE 22 HE1 PHE 22 -2.115 15.619 8.253 147 HE2 PHE 22 HE2 PHE 22 0.389 12.235 9.104 148 HZ PHE 22 HZ PHE 22 -0.786 14.281 9.867 149 H ILE 23 HN ILE 23 1.599 11.894 4.232 150 HA ILE 23 HA ILE 23 3.116 13.188 6.275 151 HB ILE 23 HB ILE 23 4.125 11.157 4.263 152 HG12 ILE 23 HG11 ILE 23 2.794 10.680 6.946 153 HG13 ILE 23 HG12 ILE 23 1.990 10.476 5.391 154 HG21 ILE 23 HG21 ILE 23 4.960 11.354 7.136 155 HG22 ILE 23 HG22 ILE 23 5.647 12.486 5.971 156 HG23 ILE 23 HG23 ILE 23 5.866 10.750 5.750 157 HD11 ILE 23 HD11 ILE 23 4.594 9.075 5.983 158 HD12 ILE 23 HD12 ILE 23 3.373 8.664 4.780 159 HD13 ILE 23 HD13 ILE 23 3.055 8.379 6.490 160 H SER 24 HN SER 24 3.886 12.817 2.791 161 HA SER 24 HA SER 24 6.193 14.430 2.760 162 HB2 SER 24 HB2 SER 24 4.100 14.284 0.571 163 HB3 SER 24 HB1 SER 24 5.802 14.706 0.376 164 HG SER 24 HG SER 24 6.153 12.543 1.400 165 H ALA 25 HN ALA 25 2.779 15.415 2.510 166 HA ALA 25 HA ALA 25 3.465 18.225 2.139 167 HB1 ALA 25 HB1 ALA 25 0.904 16.720 2.642 168 HB2 ALA 25 HB2 ALA 25 1.373 17.656 1.224 169 HB3 ALA 25 HB3 ALA 25 0.941 18.482 2.722 170 H ALA 26 HN ALA 26 2.214 16.279 4.865 171 HA ALA 26 HA ALA 26 2.012 18.419 6.728 172 HB1 ALA 26 HB1 ALA 26 1.660 16.788 8.336 173 HB2 ALA 26 HB2 ALA 26 2.870 15.703 7.651 174 HB3 ALA 26 HB3 ALA 26 1.297 15.873 6.873 175 H SER 27 HN SER 27 4.787 16.532 5.671 176 HA SER 27 HA SER 27 6.558 17.258 7.797 177 HB2 SER 27 HB1 SER 27 7.297 16.698 4.912 178 HB3 SER 27 HB2 SER 27 8.345 16.541 6.321 179 HG SER 27 HG SER 27 7.325 14.559 5.529 180 H ASN 28 HN ASN 28 5.582 18.924 4.856 181 HA ASN 28 HA ASN 28 7.508 21.111 5.496 182 HB2 ASN 28 HB1 ASN 28 5.905 20.614 2.971 183 HB3 ASN 28 HB2 ASN 28 7.094 21.895 3.201 184 HD21 ASN 28 HD21 ASN 28 8.952 20.176 4.764 185 HD22 ASN 28 HD22 ASN 28 9.679 19.150 3.626 186 H THR 29 HN THR 29 4.477 20.366 6.364 187 HA THR 29 HA THR 29 3.224 22.959 5.724 188 HB THR 29 HB THR 29 2.143 20.774 7.516 189 HG1 THR 29 HG1 THR 29 2.478 19.818 5.581 190 HG21 THR 29 HG21 THR 29 0.609 22.721 5.809 191 HG22 THR 29 HG22 THR 29 1.164 23.169 7.422 192 HG23 THR 29 HG23 THR 29 0.056 21.814 7.217 193 H GLY 30 HN GLY 30 3.326 21.246 8.857 194 HA2 GLY 30 HA1 GLY 30 3.610 23.854 10.200 195 HA3 GLY 30 HA2 GLY 30 3.311 22.308 10.994 196 H SER 31 HN SER 31 5.054 21.176 11.789 197 HA SER 31 HA SER 31 7.781 22.063 10.986 198 HB2 SER 31 HB2 SER 31 6.625 22.870 13.365 199 HB3 SER 31 HB1 SER 31 7.532 21.436 13.845 200 HG SER 31 HG SER 31 9.344 22.426 13.437 201 H PHE 32 HN PHE 32 6.064 19.739 13.113 202 HA PHE 32 HA PHE 32 6.587 17.480 13.554 203 HB2 PHE 32 HB2 PHE 32 6.636 17.816 10.567 204 HB3 PHE 32 HB1 PHE 32 7.047 16.253 11.274 205 HD1 PHE 32 HD1 PHE 32 5.341 15.810 13.470 206 HD2 PHE 32 HD2 PHE 32 4.420 17.886 9.819 207 HE1 PHE 32 HE1 PHE 32 2.937 15.306 13.789 208 HE2 PHE 32 HE2 PHE 32 2.017 17.379 10.141 209 HZ PHE 32 HZ PHE 32 1.273 16.089 12.124 210 H SER 33 HN SER 33 8.568 17.863 14.731 211 HA SER 33 HA SER 33 11.115 18.270 13.537 212 HB2 SER 33 HB1 SER 33 12.009 17.864 15.656 213 HB3 SER 33 HB2 SER 33 10.355 18.324 16.054 214 HG SER 33 HG SER 33 11.126 16.357 17.066 215 H GLN 34 HN GLN 34 12.892 16.655 13.370 216 HA GLN 34 HA GLN 34 12.259 14.465 11.722 217 HB2 GLN 34 HB1 GLN 34 14.635 14.876 13.561 218 HB3 GLN 34 HB2 GLN 34 14.536 13.588 12.359 219 HG2 GLN 34 HG2 GLN 34 14.222 15.293 10.584 220 HG3 GLN 34 HG1 GLN 34 14.379 16.565 11.795 221 HE21 GLN 34 HE21 GLN 34 16.239 16.472 9.672 222 HE22 GLN 34 HE22 GLN 34 17.753 15.987 10.267 223 H ASP 35 HN ASP 35 12.361 14.682 15.233 224 HA ASP 35 HA ASP 35 12.200 11.833 15.709 225 HB2 ASP 35 HB2 ASP 35 11.512 14.243 17.412 226 HB3 ASP 35 HB1 ASP 35 11.376 12.585 17.997 227 H GLN 36 HN GLN 36 9.820 14.426 15.283 228 HA GLN 36 HA GLN 36 7.547 12.707 15.888 229 HB2 GLN 36 HB1 GLN 36 7.536 15.310 14.334 230 HB3 GLN 36 HB2 GLN 36 6.189 14.578 15.207 231 HG2 GLN 36 HG2 GLN 36 8.750 15.643 16.436 232 HG3 GLN 36 HG1 GLN 36 7.157 16.390 16.543 233 HE21 GLN 36 HE21 GLN 36 9.143 14.860 18.530 234 HE22 GLN 36 HE22 GLN 36 8.082 13.851 19.389 235 H MET 37 HN MET 37 9.284 13.719 12.985 236 HA MET 37 HA MET 37 7.404 12.732 11.067 237 HB2 MET 37 HB2 MET 37 10.425 12.935 10.859 238 HB3 MET 37 HB1 MET 37 9.317 12.733 9.503 239 HG2 MET 37 HG1 MET 37 8.167 14.871 10.309 240 HG3 MET 37 HG2 MET 37 9.559 15.104 11.366 241 HE1 MET 37 HE1 MET 37 8.921 13.739 7.789 242 HE2 MET 37 HE2 MET 37 9.455 15.083 6.782 243 HE3 MET 37 HE3 MET 37 8.079 15.292 7.862 244 H GLU 38 HN GLU 38 10.037 11.170 12.851 245 HA GLU 38 HA GLU 38 10.115 8.715 11.440 246 HB2 GLU 38 HB1 GLU 38 11.692 9.407 13.277 247 HB3 GLU 38 HB2 GLU 38 10.413 9.053 14.439 248 HG2 GLU 38 HG1 GLU 38 10.312 6.723 13.579 249 HG3 GLU 38 HG2 GLU 38 11.641 7.088 12.478 250 H ASN 39 HN ASN 39 8.004 9.769 14.106 251 HA ASN 39 HA ASN 39 6.618 7.313 14.468 252 HB2 ASN 39 HB1 ASN 39 5.631 10.163 14.788 253 HB3 ASN 39 HB2 ASN 39 4.785 8.737 15.388 254 HD21 ASN 39 HD21 ASN 39 7.026 7.229 16.331 255 HD22 ASN 39 HD22 ASN 39 7.772 8.073 17.602 256 H MET 40 HN MET 40 6.151 9.953 12.166 257 HA MET 40 HA MET 40 3.670 9.012 11.075 258 HB2 MET 40 HB2 MET 40 5.863 10.621 9.729 259 HB3 MET 40 HB1 MET 40 4.202 10.463 9.155 260 HG2 MET 40 HG2 MET 40 3.387 11.490 11.253 261 HG3 MET 40 HG1 MET 40 5.051 11.665 11.808 262 HE1 MET 40 HE1 MET 40 2.926 13.869 8.403 263 HE2 MET 40 HE2 MET 40 2.260 12.689 9.530 264 HE3 MET 40 HE3 MET 40 3.341 12.156 8.247 265 H SER 41 HN SER 41 7.041 8.226 10.426 266 HA SER 41 HA SER 41 6.532 6.714 8.018 267 HB2 SER 41 HB2 SER 41 8.783 7.592 8.657 268 HB3 SER 41 HB1 SER 41 8.828 6.427 9.981 269 HG SER 41 HG SER 41 8.374 4.840 8.219 270 H LEU 42 HN LEU 42 6.247 6.045 11.420 271 HA LEU 42 HA LEU 42 6.128 3.127 10.988 272 HB2 LEU 42 HB2 LEU 42 7.173 4.014 13.047 273 HB3 LEU 42 HB1 LEU 42 5.645 4.776 13.489 274 HG LEU 42 HG LEU 42 4.641 2.390 13.250 275 HD11 LEU 42 HD11 LEU 42 7.514 1.932 12.863 276 HD12 LEU 42 HD12 LEU 42 6.149 0.882 12.484 277 HD13 LEU 42 HD13 LEU 42 6.811 0.913 14.119 278 HD21 LEU 42 HD21 LEU 42 5.219 1.883 15.581 279 HD22 LEU 42 HD22 LEU 42 4.935 3.613 15.392 280 HD23 LEU 42 HD23 LEU 42 6.584 2.996 15.501 281 H ILE 43 HN ILE 43 3.990 5.842 11.137 282 HA ILE 43 HA ILE 43 1.667 3.957 11.202 283 HB ILE 43 HB ILE 43 1.930 6.789 12.237 284 HG12 ILE 43 HG12 ILE 43 0.999 4.229 13.568 285 HG13 ILE 43 HG11 ILE 43 2.631 4.882 13.704 286 HG21 ILE 43 HG21 ILE 43 -0.191 6.530 10.971 287 HG22 ILE 43 HG22 ILE 43 -0.480 6.707 12.702 288 HG23 ILE 43 HG23 ILE 43 -0.584 5.115 11.949 289 HD11 ILE 43 HD11 ILE 43 0.993 7.059 14.292 290 HD12 ILE 43 HD12 ILE 43 1.868 6.077 15.465 291 HD13 ILE 43 HD13 ILE 43 0.189 5.702 15.080 292 H GLY 44 HN GLY 44 -0.190 4.673 9.859 293 HA2 GLY 44 HA1 GLY 44 -1.131 5.643 7.922 294 HA3 GLY 44 HA2 GLY 44 0.228 6.768 7.876 295 H ASN 45 HN ASN 45 2.181 6.092 6.810 296 HA ASN 45 HA ASN 45 1.857 4.574 4.455 297 HB2 ASN 45 HB1 ASN 45 3.774 6.165 5.058 298 HB3 ASN 45 HB2 ASN 45 4.484 4.811 5.939 299 HD21 ASN 45 HD21 ASN 45 6.068 5.590 3.910 300 HD22 ASN 45 HD22 ASN 45 5.931 4.574 2.558 301 H THR 46 HN THR 46 2.896 3.566 7.690 302 HA THR 46 HA THR 46 3.732 0.929 7.052 303 HB THR 46 HB THR 46 2.296 1.863 9.557 304 HG1 THR 46 HG1 THR 46 5.073 1.578 9.215 305 HG21 THR 46 HG21 THR 46 3.977 -0.048 10.392 306 HG22 THR 46 HG22 THR 46 3.711 -0.633 8.750 307 HG23 THR 46 HG23 THR 46 2.343 -0.420 9.842 308 H LEU 47 HN LEU 47 0.533 2.317 7.546 309 HA LEU 47 HA LEU 47 -0.955 -0.114 7.661 310 HB2 LEU 47 HB2 LEU 47 -1.782 2.569 6.509 311 HB3 LEU 47 HB1 LEU 47 -2.878 1.272 6.989 312 HG LEU 47 HG LEU 47 -0.973 2.775 8.811 313 HD11 LEU 47 HD11 LEU 47 -3.685 2.859 9.664 314 HD12 LEU 47 HD12 LEU 47 -3.669 3.269 7.948 315 HD13 LEU 47 HD13 LEU 47 -2.694 4.199 9.086 316 HD21 LEU 47 HD21 LEU 47 -2.599 0.288 9.130 317 HD22 LEU 47 HD22 LEU 47 -2.519 1.399 10.499 318 HD23 LEU 47 HD23 LEU 47 -1.039 0.705 9.836 319 H MET 48 HN MET 48 0.265 1.792 4.938 320 HA MET 48 HA MET 48 -1.140 0.593 2.820 321 HB2 MET 48 HB2 MET 48 0.534 2.488 2.651 322 HB3 MET 48 HB1 MET 48 1.811 1.276 2.752 323 HG2 MET 48 HG2 MET 48 0.745 0.118 0.775 324 HG3 MET 48 HG1 MET 48 -0.330 1.508 0.620 325 HE1 MET 48 HE1 MET 48 1.975 3.831 1.669 326 HE2 MET 48 HE2 MET 48 0.483 3.854 0.734 327 HE3 MET 48 HE3 MET 48 1.971 4.467 0.019 328 H ALA 49 HN ALA 49 1.670 -0.604 4.619 329 HA ALA 49 HA ALA 49 2.230 -2.861 2.964 330 HB1 ALA 49 HB1 ALA 49 2.818 -2.063 5.773 331 HB2 ALA 49 HB2 ALA 49 3.918 -2.597 4.503 332 HB3 ALA 49 HB3 ALA 49 2.958 -3.779 5.391 333 H ALA 50 HN ALA 50 -0.174 -2.290 5.462 334 HA ALA 50 HA ALA 50 -0.956 -5.040 5.818 335 HB1 ALA 50 HB1 ALA 50 -1.691 -3.579 7.518 336 HB2 ALA 50 HB2 ALA 50 -3.159 -3.896 6.594 337 HB3 ALA 50 HB3 ALA 50 -2.280 -2.386 6.361 338 H MET 51 HN MET 51 -2.105 -2.425 3.693 339 HA MET 51 HA MET 51 -4.290 -3.843 2.538 340 HB2 MET 51 HB2 MET 51 -2.506 -1.785 1.200 341 HB3 MET 51 HB1 MET 51 -4.141 -2.226 0.710 342 HG2 MET 51 HG2 MET 51 -4.879 -1.529 3.059 343 HG3 MET 51 HG1 MET 51 -3.277 -0.813 3.242 344 HE1 MET 51 HE1 MET 51 -2.226 0.164 1.304 345 HE2 MET 51 HE2 MET 51 -2.697 1.837 1.595 346 HE3 MET 51 HE3 MET 51 -2.980 1.111 0.014 347 H ASP 52 HN ASP 52 -0.831 -3.955 1.928 348 HA ASP 52 HA ASP 52 -0.878 -5.261 -0.604 349 HB2 ASP 52 HB2 ASP 52 1.105 -5.432 1.683 350 HB3 ASP 52 HB1 ASP 52 1.383 -6.144 0.093 351 H ASN 53 HN ASN 53 -1.407 -6.448 2.654 352 HA ASN 53 HA ASN 53 -1.118 -9.248 2.081 353 HB2 ASN 53 HB2 ASN 53 -2.803 -7.833 4.171 354 HB3 ASN 53 HB1 ASN 53 -2.470 -9.565 4.150 355 HD21 ASN 53 HD21 ASN 53 -1.622 -7.853 6.319 356 HD22 ASN 53 HD22 ASN 53 0.075 -7.835 6.325 357 H MET 54 HN MET 54 -3.627 -6.928 1.450 358 HA MET 54 HA MET 54 -5.839 -8.723 1.173 359 HB2 MET 54 HB2 MET 54 -5.238 -6.070 -0.167 360 HB3 MET 54 HB1 MET 54 -6.783 -6.911 -0.300 361 HG2 MET 54 HG2 MET 54 -5.490 -6.008 2.293 362 HG3 MET 54 HG1 MET 54 -6.847 -5.212 1.498 363 HE1 MET 54 HE1 MET 54 -8.352 -7.751 0.285 364 HE2 MET 54 HE2 MET 54 -9.073 -6.297 0.971 365 HE3 MET 54 HE3 MET 54 -9.617 -7.883 1.515 366 H GLY 55 HN GLY 55 -3.218 -7.809 -1.006 367 HA2 GLY 55 HA2 GLY 55 -2.455 -9.284 -2.767 368 HA3 GLY 55 HA1 GLY 55 -4.055 -10.026 -2.799 369 H GLY 56 HN GLY 56 -4.250 -6.650 -2.591 370 HA2 GLY 56 HA2 GLY 56 -4.202 -5.020 -4.418 371 HA3 GLY 56 HA1 GLY 56 -4.376 -6.356 -5.557 372 H ARG 57 HN ARG 57 -6.354 -6.768 -2.838 373 HA ARG 57 HA ARG 57 -8.676 -5.549 -4.281 374 HB2 ARG 57 HB2 ARG 57 -10.043 -7.439 -3.624 375 HB3 ARG 57 HB1 ARG 57 -8.599 -8.063 -4.423 376 HG2 ARG 57 HG2 ARG 57 -7.598 -8.153 -2.016 377 HG3 ARG 57 HG1 ARG 57 -9.279 -8.055 -1.488 378 HD2 ARG 57 HD2 ARG 57 -9.790 -10.019 -2.967 379 HD3 ARG 57 HD1 ARG 57 -8.064 -10.158 -3.305 380 HE ARG 57 HE ARG 57 -8.103 -10.221 -0.576 381 HH11 ARG 57 HH11 ARG 57 -8.762 -12.320 -3.095 382 HH12 ARG 57 HH12 ARG 57 -9.545 -13.526 -2.128 383 HH21 ARG 57 HH21 ARG 57 -9.625 -11.561 0.729 384 HH22 ARG 57 HH22 ARG 57 -10.034 -13.096 0.037 385 H ILE 58 HN ILE 58 -9.340 -3.857 -3.038 386 HA ILE 58 HA ILE 58 -9.330 -4.248 -0.072 387 HB ILE 58 HB ILE 58 -9.298 -1.580 -1.500 388 HG12 ILE 58 HG12 ILE 58 -7.281 -2.716 -2.190 389 HG13 ILE 58 HG11 ILE 58 -6.836 -1.595 -0.902 390 HG21 ILE 58 HG21 ILE 58 -8.620 -0.735 0.655 391 HG22 ILE 58 HG22 ILE 58 -8.406 -2.367 1.288 392 HG23 ILE 58 HG23 ILE 58 -10.024 -1.768 0.923 393 HD11 ILE 58 HD11 ILE 58 -5.929 -3.364 0.169 394 HD12 ILE 58 HD12 ILE 58 -6.674 -4.505 -0.952 395 HD13 ILE 58 HD13 ILE 58 -7.580 -3.919 0.444 396 H THR 59 HN THR 59 -11.246 -3.967 0.993 397 HA THR 59 HA THR 59 -13.631 -3.413 -0.703 398 HB THR 59 HB THR 59 -14.688 -4.214 1.648 399 HG1 THR 59 HG1 THR 59 -13.339 -5.740 2.561 400 HG21 THR 59 HG21 THR 59 -15.372 -5.884 0.310 401 HG22 THR 59 HG22 THR 59 -13.744 -6.561 0.249 402 HG23 THR 59 HG23 THR 59 -14.226 -5.313 -0.902 403 HA PRO 60 HA PRO 60 -14.510 0.475 1.221 404 HB2 PRO 60 HB2 PRO 60 -17.187 0.379 1.573 405 HB3 PRO 60 HB1 PRO 60 -16.435 0.568 -0.013 406 HG2 PRO 60 HG2 PRO 60 -17.539 -1.897 1.283 407 HG3 PRO 60 HG1 PRO 60 -17.717 -1.342 -0.385 408 HD2 PRO 60 HD2 PRO 60 -15.949 -3.268 0.307 409 HD3 PRO 60 HD1 PRO 60 -15.636 -2.134 -1.007 410 H SER 61 HN SER 61 -15.890 -2.364 2.844 411 HA SER 61 HA SER 61 -16.391 -0.991 5.345 412 HB2 SER 61 HB2 SER 61 -15.962 -3.961 4.905 413 HB3 SER 61 HB1 SER 61 -16.806 -3.199 6.253 414 HG SER 61 HG SER 61 -18.447 -2.646 4.941 415 H LYS 62 HN LYS 62 -13.673 -2.808 3.998 416 HA LYS 62 HA LYS 62 -12.174 -2.924 6.466 417 HB2 LYS 62 HB2 LYS 62 -11.376 -3.188 3.558 418 HB3 LYS 62 HB1 LYS 62 -10.226 -3.363 4.885 419 HG2 LYS 62 HG2 LYS 62 -11.753 -5.126 5.857 420 HG3 LYS 62 HG1 LYS 62 -12.700 -5.037 4.372 421 HD2 LYS 62 HD2 LYS 62 -10.617 -5.565 3.080 422 HD3 LYS 62 HD1 LYS 62 -9.775 -5.800 4.613 423 HE2 LYS 62 HE2 LYS 62 -12.334 -7.263 4.351 424 HE3 LYS 62 HE1 LYS 62 -11.052 -7.799 3.264 425 HZ1 LYS 62 HZ1 LYS 62 -9.576 -7.956 5.206 426 HZ2 LYS 62 HZ2 LYS 62 -10.915 -8.997 5.323 427 HZ3 LYS 62 HZ3 LYS 62 -10.876 -7.553 6.218 428 H LEU 63 HN LEU 63 -12.114 -0.721 3.659 429 HA LEU 63 HA LEU 63 -10.005 0.935 4.748 430 HB2 LEU 63 HB2 LEU 63 -11.991 1.211 2.511 431 HB3 LEU 63 HB1 LEU 63 -11.055 2.616 3.026 432 HG LEU 63 HG LEU 63 -9.601 0.043 2.574 433 HD11 LEU 63 HD11 LEU 63 -9.365 1.135 0.131 434 HD12 LEU 63 HD12 LEU 63 -11.009 1.654 0.505 435 HD13 LEU 63 HD13 LEU 63 -10.604 -0.061 0.510 436 HD21 LEU 63 HD21 LEU 63 -7.928 1.501 2.974 437 HD22 LEU 63 HD22 LEU 63 -9.035 2.872 2.901 438 HD23 LEU 63 HD23 LEU 63 -8.302 2.252 1.423 439 H GLN 64 HN GLN 64 -13.518 0.928 4.978 440 HA GLN 64 HA GLN 64 -13.942 3.529 5.991 441 HB2 GLN 64 HB2 GLN 64 -15.730 1.828 5.452 442 HB3 GLN 64 HB1 GLN 64 -15.334 1.016 6.966 443 HG2 GLN 64 HG2 GLN 64 -15.900 3.020 8.236 444 HG3 GLN 64 HG1 GLN 64 -16.176 3.923 6.746 445 HE21 GLN 64 HE21 GLN 64 -18.327 3.826 8.464 446 HE22 GLN 64 HE22 GLN 64 -19.514 2.761 7.882 447 H ALA 65 HN ALA 65 -13.173 0.527 7.773 448 HA ALA 65 HA ALA 65 -12.889 1.900 10.313 449 HB1 ALA 65 HB1 ALA 65 -12.080 -0.843 9.324 450 HB2 ALA 65 HB2 ALA 65 -13.395 -0.431 10.423 451 HB3 ALA 65 HB3 ALA 65 -11.722 -0.289 10.960 452 H LEU 66 HN LEU 66 -10.573 0.601 7.919 453 HA LEU 66 HA LEU 66 -8.201 1.395 9.275 454 HB2 LEU 66 HB1 LEU 66 -8.237 -0.110 7.292 455 HB3 LEU 66 HB2 LEU 66 -8.669 1.267 6.279 456 HG LEU 66 HG LEU 66 -6.524 2.344 7.413 457 HD11 LEU 66 HD21 LEU 66 -5.453 0.886 8.767 458 HD12 LEU 66 HD22 LEU 66 -4.999 0.008 7.306 459 HD13 LEU 66 HD23 LEU 66 -6.441 -0.462 8.207 460 HD21 LEU 66 HD11 LEU 66 -7.075 1.472 4.951 461 HD22 LEU 66 HD12 LEU 66 -5.876 0.250 5.379 462 HD23 LEU 66 HD13 LEU 66 -5.442 1.959 5.406 463 H ASP 67 HN ASP 67 -9.986 3.103 6.673 464 HA ASP 67 HA ASP 67 -8.472 5.439 6.540 465 HB2 ASP 67 HB1 ASP 67 -10.532 4.911 5.178 466 HB3 ASP 67 HB2 ASP 67 -11.502 5.396 6.568 467 H MET 68 HN MET 68 -10.825 4.494 9.007 468 HA MET 68 HA MET 68 -10.806 7.048 10.374 469 HB2 MET 68 HB2 MET 68 -12.635 5.364 10.607 470 HB3 MET 68 HB1 MET 68 -11.513 4.308 11.465 471 HG2 MET 68 HG2 MET 68 -11.147 6.174 13.120 472 HG3 MET 68 HG1 MET 68 -12.442 7.064 12.319 473 HE1 MET 68 HE1 MET 68 -14.639 4.592 11.611 474 HE2 MET 68 HE2 MET 68 -14.600 6.332 11.882 475 HE3 MET 68 HE3 MET 68 -15.600 5.310 12.911 476 H ALA 69 HN ALA 69 -9.048 3.984 10.798 477 HA ALA 69 HA ALA 69 -7.691 4.687 13.205 478 HB1 ALA 69 HB1 ALA 69 -5.915 3.102 11.715 479 HB2 ALA 69 HB2 ALA 69 -7.523 2.604 11.191 480 HB3 ALA 69 HB3 ALA 69 -7.093 2.534 12.899 481 H PHE 70 HN PHE 70 -6.876 5.274 9.796 482 HA PHE 70 HA PHE 70 -4.262 6.277 10.125 483 HB2 PHE 70 HB1 PHE 70 -5.366 5.909 7.922 484 HB3 PHE 70 HB2 PHE 70 -6.380 7.321 8.219 485 HD1 PHE 70 HD2 PHE 70 -2.902 6.166 7.667 486 HD2 PHE 70 HD1 PHE 70 -5.515 9.557 8.002 487 HE1 PHE 70 HE2 PHE 70 -1.101 7.638 6.812 488 HE2 PHE 70 HE1 PHE 70 -3.714 11.029 7.142 489 HZ PHE 70 HZ PHE 70 -1.507 10.068 6.546 490 H ALA 71 HN ALA 71 -7.378 7.969 10.456 491 HA ALA 71 HA ALA 71 -6.195 10.542 11.018 492 HB1 ALA 71 HB1 ALA 71 -8.637 10.709 12.187 493 HB2 ALA 71 HB2 ALA 71 -8.904 9.334 11.115 494 HB3 ALA 71 HB3 ALA 71 -8.385 10.883 10.450 495 H SER 72 HN SER 72 -7.306 7.850 13.042 496 HA SER 72 HA SER 72 -6.969 9.233 15.547 497 HB2 SER 72 HB2 SER 72 -7.221 7.058 16.572 498 HB3 SER 72 HB1 SER 72 -8.329 7.138 15.202 499 HG SER 72 HG SER 72 -7.059 5.191 15.312 500 H SER 73 HN SER 73 -4.873 6.949 13.762 501 HA SER 73 HA SER 73 -2.740 7.079 15.698 502 HB2 SER 73 HB1 SER 73 -2.396 6.412 12.774 503 HB3 SER 73 HB2 SER 73 -1.473 5.802 14.148 504 HG SER 73 HG SER 73 -2.846 4.208 13.938 505 H VAL 74 HN VAL 74 -3.282 8.703 12.578 506 HA VAL 74 HA VAL 74 -0.848 10.150 12.475 507 HB VAL 74 HB VAL 74 -2.635 9.987 10.667 508 HG11 VAL 74 HG11 VAL 74 -4.344 11.810 10.722 509 HG12 VAL 74 HG12 VAL 74 -3.851 12.171 12.377 510 HG13 VAL 74 HG13 VAL 74 -4.576 10.609 11.993 511 HG21 VAL 74 HG21 VAL 74 -1.734 12.809 11.277 512 HG22 VAL 74 HG22 VAL 74 -2.012 12.089 9.691 513 HG23 VAL 74 HG23 VAL 74 -0.642 11.564 10.670 514 H ALA 75 HN ALA 75 -3.864 10.845 14.188 515 HA ALA 75 HA ALA 75 -3.162 13.517 14.955 516 HB1 ALA 75 HB1 ALA 75 -5.076 11.481 16.108 517 HB2 ALA 75 HB2 ALA 75 -5.459 12.903 15.138 518 HB3 ALA 75 HB3 ALA 75 -4.892 13.094 16.798 519 H GLN 76 HN GLN 76 -2.575 10.352 16.437 520 HA GLN 76 HA GLN 76 -1.546 11.392 18.923 521 HB2 GLN 76 HB2 GLN 76 -1.102 8.739 17.524 522 HB3 GLN 76 HB1 GLN 76 -0.556 9.099 19.161 523 HG2 GLN 76 HG1 GLN 76 -2.855 9.502 19.880 524 HG3 GLN 76 HG2 GLN 76 -3.437 9.273 18.230 525 HE21 GLN 76 HE21 GLN 76 -4.560 7.574 20.066 526 HE22 GLN 76 HE22 GLN 76 -3.916 6.011 19.915 527 H ILE 77 HN ILE 77 -0.041 10.517 15.829 528 HA ILE 77 HA ILE 77 2.670 10.680 16.611 529 HB ILE 77 HB ILE 77 1.480 11.583 13.974 530 HG12 ILE 77 HG12 ILE 77 2.585 8.851 14.650 531 HG13 ILE 77 HG11 ILE 77 0.873 9.233 14.825 532 HG21 ILE 77 HG21 ILE 77 3.632 12.072 13.501 533 HG22 ILE 77 HG22 ILE 77 3.962 10.342 13.599 534 HG23 ILE 77 HG23 ILE 77 4.190 11.365 15.018 535 HD11 ILE 77 HD11 ILE 77 1.558 10.212 12.292 536 HD12 ILE 77 HD12 ILE 77 0.640 8.745 12.635 537 HD13 ILE 77 HD13 ILE 77 2.389 8.659 12.408 538 H ALA 78 HN ALA 78 0.666 13.267 15.188 539 HA ALA 78 HA ALA 78 2.676 15.286 15.814 540 HB1 ALA 78 HB1 ALA 78 1.065 15.373 13.851 541 HB2 ALA 78 HB2 ALA 78 1.163 16.849 14.811 542 HB3 ALA 78 HB3 ALA 78 -0.203 15.754 15.016 543 H ALA 79 HN ALA 79 -0.605 14.540 17.040 544 HA ALA 79 HA ALA 79 -0.697 16.576 19.009 545 HB1 ALA 79 HB1 ALA 79 -2.500 15.372 19.978 546 HB2 ALA 79 HB2 ALA 79 -1.877 13.823 19.412 547 HB3 ALA 79 HB3 ALA 79 -2.567 14.970 18.262 548 H SER 80 HN SER 80 1.125 13.624 18.904 549 HA SER 80 HA SER 80 1.607 13.534 21.792 550 HB2 SER 80 HB2 SER 80 1.674 11.445 20.546 551 HB3 SER 80 HB1 SER 80 2.914 12.087 19.469 552 HG SER 80 HG SER 80 4.314 11.459 20.871 553 H GLN 81 HN GLN 81 2.978 15.129 19.043 554 HA GLN 81 HA GLN 81 5.653 15.490 19.662 555 HB2 GLN 81 HB2 GLN 81 3.736 17.684 18.817 556 HB3 GLN 81 HB1 GLN 81 5.490 17.723 18.639 557 HG2 GLN 81 HG2 GLN 81 5.443 15.860 17.100 558 HG3 GLN 81 HG1 GLN 81 3.726 15.592 17.402 559 HE21 GLN 81 HE21 GLN 81 5.837 17.025 15.219 560 HE22 GLN 81 HE22 GLN 81 4.774 18.149 14.522 561 H GLY 82 HN GLY 82 2.889 17.108 21.183 562 HA2 GLY 82 HA2 GLY 82 2.799 17.886 23.436 563 HA3 GLY 82 HA1 GLY 82 4.535 17.608 23.574 564 H GLY 83 HN GLY 83 3.418 19.335 20.791 565 HA2 GLY 83 HA1 GLY 83 4.458 21.863 22.005 566 HA3 GLY 83 HA2 GLY 83 4.630 21.458 20.298 567 H ASP 84 HN ASP 84 3.515 23.527 19.861 568 HA ASP 84 HA ASP 84 0.937 24.215 20.770 569 HB2 ASP 84 HB2 ASP 84 2.292 24.706 18.108 570 HB3 ASP 84 HB1 ASP 84 0.729 25.406 18.528 571 H LEU 85 HN LEU 85 -1.026 23.279 20.462 572 HA LEU 85 HA LEU 85 -1.230 20.940 18.695 573 HB2 LEU 85 HB2 LEU 85 -2.276 21.008 20.976 574 HB3 LEU 85 HB1 LEU 85 -3.374 22.255 20.388 575 HG LEU 85 HG LEU 85 -3.765 20.445 18.451 576 HD11 LEU 85 HD11 LEU 85 -3.890 18.307 20.245 577 HD12 LEU 85 HD12 LEU 85 -2.316 19.039 20.554 578 HD13 LEU 85 HD13 LEU 85 -2.731 18.495 18.930 579 HD21 LEU 85 HD21 LEU 85 -5.207 21.425 20.571 580 HD22 LEU 85 HD22 LEU 85 -5.207 19.695 20.913 581 HD23 LEU 85 HD23 LEU 85 -5.838 20.289 19.377 582 H GLY 86 HN GLY 86 -2.007 24.310 18.591 583 HA2 GLY 86 HA2 GLY 86 -4.123 24.143 16.627 584 HA3 GLY 86 HA1 GLY 86 -3.196 25.592 17.018 585 H VAL 87 HN VAL 87 -0.596 24.418 16.448 586 HA VAL 87 HA VAL 87 -0.509 24.914 13.607 587 HB VAL 87 HB VAL 87 1.364 25.276 15.327 588 HG11 VAL 87 HG11 VAL 87 2.847 23.377 15.724 589 HG12 VAL 87 HG12 VAL 87 1.808 22.332 14.757 590 HG13 VAL 87 HG13 VAL 87 1.224 22.981 16.290 591 HG21 VAL 87 HG21 VAL 87 3.090 24.305 13.545 592 HG22 VAL 87 HG22 VAL 87 2.073 25.696 13.165 593 HG23 VAL 87 HG23 VAL 87 1.620 24.089 12.594 594 H THR 88 HN THR 88 -0.130 21.917 15.546 595 HA THR 88 HA THR 88 0.319 20.132 13.419 596 HB THR 88 HB THR 88 -1.303 19.731 15.951 597 HG1 THR 88 HG1 THR 88 1.364 19.443 15.174 598 HG21 THR 88 HG21 THR 88 -1.970 18.116 14.203 599 HG22 THR 88 HG22 THR 88 -1.079 17.322 15.502 600 HG23 THR 88 HG23 THR 88 -0.278 17.676 13.972 601 H THR 89 HN THR 89 -2.689 21.575 14.579 602 HA THR 89 HA THR 89 -4.533 20.095 13.019 603 HB THR 89 HB THR 89 -4.905 23.056 13.283 604 HG1 THR 89 HG1 THR 89 -5.616 22.296 15.546 605 HG21 THR 89 HG21 THR 89 -6.602 21.291 12.438 606 HG22 THR 89 HG22 THR 89 -7.159 22.467 13.629 607 HG23 THR 89 HG23 THR 89 -6.745 20.829 14.135 608 H ASN 90 HN ASN 90 -2.822 23.129 12.216 609 HA ASN 90 HA ASN 90 -3.715 23.126 9.465 610 HB2 ASN 90 HB2 ASN 90 -1.320 24.523 10.696 611 HB3 ASN 90 HB1 ASN 90 -2.070 24.913 9.149 612 HD21 ASN 90 HD21 ASN 90 -1.858 26.743 11.451 613 HD22 ASN 90 HD22 ASN 90 -3.438 27.100 11.953 614 H ALA 91 HN ALA 91 -0.800 22.019 11.152 615 HA ALA 91 HA ALA 91 0.746 21.327 8.869 616 HB1 ALA 91 HB1 ALA 91 0.922 19.530 11.223 617 HB2 ALA 91 HB2 ALA 91 1.189 21.245 11.542 618 HB3 ALA 91 HB3 ALA 91 2.200 20.398 10.371 619 H ILE 92 HN ILE 92 -1.320 19.217 10.888 620 HA ILE 92 HA ILE 92 -1.144 17.004 9.035 621 HB ILE 92 HB ILE 92 -3.081 17.574 11.298 622 HG12 ILE 92 HG12 ILE 92 -0.574 15.877 11.110 623 HG13 ILE 92 HG11 ILE 92 -0.766 17.359 12.047 624 HG21 ILE 92 HG21 ILE 92 -2.535 14.827 10.254 625 HG22 ILE 92 HG22 ILE 92 -3.638 15.853 9.340 626 HG23 ILE 92 HG23 ILE 92 -3.987 15.465 11.023 627 HD11 ILE 92 HD11 ILE 92 -2.318 16.332 13.539 628 HD12 ILE 92 HD12 ILE 92 -1.017 15.158 13.340 629 HD13 ILE 92 HD13 ILE 92 -2.538 14.945 12.472 630 H ALA 93 HN ALA 93 -3.755 19.325 9.807 631 HA ALA 93 HA ALA 93 -5.649 18.370 7.940 632 HB1 ALA 93 HB1 ALA 93 -6.766 20.465 8.197 633 HB2 ALA 93 HB2 ALA 93 -5.264 21.294 8.611 634 HB3 ALA 93 HB3 ALA 93 -5.979 20.145 9.742 635 H ASP 94 HN ASP 94 -3.125 20.871 7.456 636 HA ASP 94 HA ASP 94 -3.797 21.580 4.809 637 HB2 ASP 94 HB1 ASP 94 -1.983 22.591 6.316 638 HB3 ASP 94 HB2 ASP 94 -0.944 21.282 5.752 639 H ALA 95 HN ALA 95 -1.451 19.074 5.833 640 HA ALA 95 HA ALA 95 -0.876 18.097 3.240 641 HB1 ALA 95 HB1 ALA 95 0.481 16.795 4.466 642 HB2 ALA 95 HB2 ALA 95 -0.915 15.897 5.056 643 HB3 ALA 95 HB3 ALA 95 -0.344 17.315 5.936 644 H LEU 96 HN LEU 96 -3.488 17.207 5.489 645 HA LEU 96 HA LEU 96 -4.537 15.083 3.847 646 HB2 LEU 96 HB1 LEU 96 -6.037 16.810 5.839 647 HB3 LEU 96 HB2 LEU 96 -6.505 15.208 5.271 648 HG LEU 96 HG LEU 96 -3.836 15.644 6.597 649 HD11 LEU 96 HD21 LEU 96 -6.558 15.436 7.854 650 HD12 LEU 96 HD22 LEU 96 -5.196 16.455 8.319 651 HD13 LEU 96 HD23 LEU 96 -5.164 14.726 8.669 652 HD21 LEU 96 HD11 LEU 96 -5.719 13.305 6.205 653 HD22 LEU 96 HD12 LEU 96 -4.289 13.236 7.234 654 HD23 LEU 96 HD13 LEU 96 -4.116 13.518 5.503 655 H THR 97 HN THR 97 -5.292 18.543 4.130 656 HA THR 97 HA THR 97 -7.536 18.607 2.402 657 HB THR 97 HB THR 97 -5.400 20.725 2.762 658 HG1 THR 97 HG1 THR 97 -6.481 21.306 4.519 659 HG21 THR 97 HG21 THR 97 -6.735 21.335 0.892 660 HG22 THR 97 HG22 THR 97 -7.418 22.223 2.255 661 HG23 THR 97 HG23 THR 97 -8.213 20.762 1.667 662 H SER 98 HN SER 98 -4.104 19.256 1.589 663 HA SER 98 HA SER 98 -4.560 19.472 -1.227 664 HB2 SER 98 HB1 SER 98 -2.016 18.549 0.139 665 HB3 SER 98 HB2 SER 98 -2.156 19.283 -1.459 666 HG SER 98 HG SER 98 -2.295 21.181 -0.578 667 H ALA 99 HN ALA 99 -3.544 16.706 0.788 668 HA ALA 99 HA ALA 99 -3.145 14.817 -1.257 669 HB1 ALA 99 HB1 ALA 99 -4.567 14.037 1.274 670 HB2 ALA 99 HB2 ALA 99 -2.899 14.605 1.342 671 HB3 ALA 99 HB3 ALA 99 -3.304 13.172 0.398 672 H PHE 100 HN PHE 100 -6.196 15.684 0.388 673 HA PHE 100 HA PHE 100 -7.955 13.882 -0.806 674 HB2 PHE 100 HB1 PHE 100 -8.165 16.656 0.207 675 HB3 PHE 100 HB2 PHE 100 -9.425 16.183 -0.932 676 HD1 PHE 100 HD2 PHE 100 -10.677 13.983 -0.503 677 HD2 PHE 100 HD1 PHE 100 -8.230 15.927 2.448 678 HE1 PHE 100 HE2 PHE 100 -11.819 12.703 1.289 679 HE2 PHE 100 HE1 PHE 100 -9.370 14.643 4.236 680 HZ PHE 100 HZ PHE 100 -11.163 13.032 3.655 681 H TYR 101 HN TYR 101 -7.018 17.063 -2.121 682 HA TYR 101 HA TYR 101 -8.271 16.577 -4.679 683 HB2 TYR 101 HB2 TYR 101 -6.058 18.566 -4.229 684 HB3 TYR 101 HB1 TYR 101 -7.472 18.703 -5.277 685 HD1 TYR 101 HD2 TYR 101 -9.660 17.842 -3.516 686 HD2 TYR 101 HD1 TYR 101 -6.255 20.319 -2.654 687 HE1 TYR 101 HE2 TYR 101 -10.920 18.928 -1.672 688 HE2 TYR 101 HE1 TYR 101 -7.515 21.405 -0.813 689 HH TYR 101 HH TYR 101 -10.924 20.613 -0.201 690 H GLN 102 HN GLN 102 -5.055 16.073 -3.358 691 HA GLN 102 HA GLN 102 -3.829 15.510 -5.937 692 HB2 GLN 102 HB2 GLN 102 -2.949 14.906 -3.100 693 HB3 GLN 102 HB1 GLN 102 -1.960 14.603 -4.526 694 HG2 GLN 102 HG2 GLN 102 -2.274 17.069 -5.104 695 HG3 GLN 102 HG1 GLN 102 -2.943 17.267 -3.485 696 HE21 GLN 102 HE21 GLN 102 -0.545 18.612 -4.158 697 HE22 GLN 102 HE22 GLN 102 0.724 17.928 -3.264 698 H THR 103 HN THR 103 -5.781 13.705 -3.713 699 HA THR 103 HA THR 103 -4.857 11.152 -4.945 700 HB THR 103 HB THR 103 -5.927 10.034 -3.073 701 HG1 THR 103 HG1 THR 103 -6.583 12.393 -1.798 702 HG21 THR 103 HG21 THR 103 -4.780 11.690 -1.214 703 HG22 THR 103 HG22 THR 103 -3.974 12.206 -2.695 704 HG23 THR 103 HG23 THR 103 -3.894 10.518 -2.189 705 H THR 104 HN THR 104 -8.018 12.551 -3.896 706 HA THR 104 HA THR 104 -9.171 11.256 -6.340 707 HB THR 104 HB THR 104 -10.230 11.342 -3.513 708 HG1 THR 104 HG1 THR 104 -10.004 9.249 -5.406 709 HG21 THR 104 HG21 THR 104 -11.713 11.003 -6.111 710 HG22 THR 104 HG22 THR 104 -12.162 11.957 -4.697 711 HG23 THR 104 HG23 THR 104 -12.274 10.198 -4.644 712 H GLY 105 HN GLY 105 -9.590 13.890 -3.962 713 HA2 GLY 105 HA2 GLY 105 -10.022 16.168 -4.800 714 HA3 GLY 105 HA1 GLY 105 -10.891 15.451 -6.153 715 H VAL 106 HN VAL 106 -11.087 14.839 -2.641 716 HA VAL 106 HA VAL 106 -14.015 15.411 -2.837 717 HB VAL 106 HB VAL 106 -12.547 13.675 -0.828 718 HG11 VAL 106 HG21 VAL 106 -15.406 14.499 -1.232 719 HG12 VAL 106 HG22 VAL 106 -14.491 14.353 0.268 720 HG13 VAL 106 HG23 VAL 106 -15.055 12.904 -0.564 721 HG21 VAL 106 HG11 VAL 106 -12.926 11.870 -2.167 722 HG22 VAL 106 HG12 VAL 106 -13.002 13.071 -3.457 723 HG23 VAL 106 HG13 VAL 106 -14.487 12.484 -2.710 724 H VAL 107 HN VAL 107 -14.918 16.239 -0.675 725 HA VAL 107 HA VAL 107 -13.476 18.612 0.077 726 HB VAL 107 HB VAL 107 -15.244 18.698 1.920 727 HG11 VAL 107 HG21 VAL 107 -15.576 19.861 -0.191 728 HG12 VAL 107 HG22 VAL 107 -17.090 19.081 0.265 729 HG13 VAL 107 HG23 VAL 107 -16.067 18.362 -0.979 730 HG21 VAL 107 HG11 VAL 107 -16.638 16.507 0.437 731 HG22 VAL 107 HG12 VAL 107 -16.817 17.010 2.119 732 HG23 VAL 107 HG13 VAL 107 -15.419 16.049 1.628 733 H ASN 108 HN ASN 108 -11.773 18.703 1.434 734 HA ASN 108 HA ASN 108 -10.913 16.432 2.992 735 HB2 ASN 108 HB2 ASN 108 -9.211 18.030 3.882 736 HB3 ASN 108 HB1 ASN 108 -9.288 18.025 2.121 737 HD21 ASN 108 HD21 ASN 108 -8.465 20.264 3.991 738 HD22 ASN 108 HD22 ASN 108 -9.483 21.564 3.597 739 H SER 109 HN SER 109 -12.976 19.138 3.617 740 HA SER 109 HA SER 109 -12.758 19.437 6.399 741 HB2 SER 109 HB2 SER 109 -14.163 20.863 4.935 742 HB3 SER 109 HB1 SER 109 -15.305 19.530 4.760 743 HG SER 109 HG SER 109 -14.988 21.285 6.803 744 H ARG 110 HN ARG 110 -14.341 16.838 4.587 745 HA ARG 110 HA ARG 110 -15.856 15.820 6.815 746 HB2 ARG 110 HB2 ARG 110 -14.779 14.320 4.409 747 HB3 ARG 110 HB1 ARG 110 -16.061 13.766 5.486 748 HG2 ARG 110 HG1 ARG 110 -17.307 15.913 4.882 749 HG3 ARG 110 HG2 ARG 110 -16.110 16.132 3.604 750 HD2 ARG 110 HD1 ARG 110 -16.696 13.889 2.705 751 HD3 ARG 110 HD2 ARG 110 -17.936 13.734 3.949 752 HE ARG 110 HE ARG 110 -18.454 16.154 2.597 753 HH11 ARG 110 HH21 ARG 110 -19.725 13.165 2.813 754 HH12 ARG 110 HH22 ARG 110 -20.254 13.025 1.170 755 HH21 ARG 110 HH11 ARG 110 -18.506 15.818 0.088 756 HH22 ARG 110 HH12 ARG 110 -19.564 14.526 -0.373 757 H PHE 111 HN PHE 111 -12.773 14.636 5.401 758 HA PHE 111 HA PHE 111 -12.323 12.865 7.666 759 HB2 PHE 111 HB2 PHE 111 -11.467 12.407 5.363 760 HB3 PHE 111 HB1 PHE 111 -10.348 13.757 5.550 761 HD1 PHE 111 HD2 PHE 111 -11.371 10.498 7.050 762 HD2 PHE 111 HD1 PHE 111 -8.301 13.483 6.715 763 HE1 PHE 111 HE2 PHE 111 -9.795 9.011 8.255 764 HE2 PHE 111 HE1 PHE 111 -6.724 11.996 7.921 765 HZ PHE 111 HZ PHE 111 -7.471 9.760 8.691 766 H ILE 112 HN ILE 112 -10.738 15.866 6.538 767 HA ILE 112 HA ILE 112 -8.885 16.113 8.649 768 HB ILE 112 HB ILE 112 -10.320 18.261 7.065 769 HG12 ILE 112 HG12 ILE 112 -7.643 16.868 6.799 770 HG13 ILE 112 HG11 ILE 112 -8.983 16.835 5.653 771 HG21 ILE 112 HG21 ILE 112 -7.870 18.446 8.845 772 HG22 ILE 112 HG22 ILE 112 -9.440 19.180 9.174 773 HG23 ILE 112 HG23 ILE 112 -8.473 19.738 7.808 774 HD11 ILE 112 HD11 ILE 112 -8.690 19.445 5.660 775 HD12 ILE 112 HD12 ILE 112 -7.588 18.454 4.704 776 HD13 ILE 112 HD13 ILE 112 -7.078 19.075 6.274 777 H SER 113 HN SER 113 -12.237 17.369 8.479 778 HA SER 113 HA SER 113 -12.249 18.708 10.969 779 HB2 SER 113 HB2 SER 113 -14.477 17.205 9.567 780 HB3 SER 113 HB1 SER 113 -14.723 18.235 10.975 781 HG SER 113 HG SER 113 -14.610 19.903 9.733 782 H GLU 114 HN GLU 114 -12.761 15.273 10.228 783 HA GLU 114 HA GLU 114 -13.526 14.457 12.855 784 HB2 GLU 114 HB2 GLU 114 -13.644 13.078 10.718 785 HB3 GLU 114 HB1 GLU 114 -11.912 12.801 10.900 786 HG2 GLU 114 HG2 GLU 114 -12.289 11.810 13.119 787 HG3 GLU 114 HG1 GLU 114 -14.019 12.118 12.972 788 H ILE 115 HN ILE 115 -10.306 14.489 11.288 789 HA ILE 115 HA ILE 115 -8.901 13.634 13.653 790 HB ILE 115 HB ILE 115 -7.986 15.106 11.169 791 HG12 ILE 115 HG12 ILE 115 -7.424 12.272 12.065 792 HG13 ILE 115 HG11 ILE 115 -8.811 12.689 11.059 793 HG21 ILE 115 HG21 ILE 115 -6.415 15.702 12.875 794 HG22 ILE 115 HG22 ILE 115 -5.682 14.365 11.987 795 HG23 ILE 115 HG23 ILE 115 -6.436 14.074 13.554 796 HD11 ILE 115 HD11 ILE 115 -7.435 13.425 9.274 797 HD12 ILE 115 HD12 ILE 115 -6.656 11.950 9.846 798 HD13 ILE 115 HD13 ILE 115 -6.009 13.524 10.306 799 H ARG 116 HN ARG 116 -9.827 16.793 12.375 800 HA ARG 116 HA ARG 116 -8.238 18.470 13.982 801 HB2 ARG 116 HB2 ARG 116 -9.957 19.087 12.146 802 HB3 ARG 116 HB1 ARG 116 -11.149 19.051 13.445 803 HG2 ARG 116 HG1 ARG 116 -9.283 20.557 14.651 804 HG3 ARG 116 HG2 ARG 116 -8.913 20.965 12.975 805 HD2 ARG 116 HD2 ARG 116 -11.235 21.628 12.590 806 HD3 ARG 116 HD1 ARG 116 -11.673 21.130 14.224 807 HE ARG 116 HE ARG 116 -9.858 23.428 13.615 808 HH11 ARG 116 HH21 ARG 116 -12.878 23.266 14.612 809 HH12 ARG 116 HH22 ARG 116 -12.647 23.810 16.240 810 HH21 ARG 116 HH11 ARG 116 -9.199 23.454 16.149 811 HH22 ARG 116 HH12 ARG 116 -10.563 23.915 17.110 812 H SER 117 HN SER 117 -11.391 16.981 14.755 813 HA SER 117 HA SER 117 -11.446 18.085 17.439 814 HB2 SER 117 HB2 SER 117 -13.495 17.369 16.193 815 HB3 SER 117 HB1 SER 117 -12.957 15.696 16.339 816 HG SER 117 HG SER 117 -14.447 16.482 17.998 817 H LEU 118 HN LEU 118 -10.300 15.089 15.974 818 HA LEU 118 HA LEU 118 -9.878 13.663 18.439 819 HB2 LEU 118 HB1 LEU 118 -8.582 13.382 15.713 820 HB3 LEU 118 HB2 LEU 118 -8.340 12.250 17.044 821 HG LEU 118 HG LEU 118 -10.972 12.923 15.697 822 HD11 LEU 118 HD11 LEU 118 -9.626 10.232 15.945 823 HD12 LEU 118 HD12 LEU 118 -9.268 11.320 14.604 824 HD13 LEU 118 HD13 LEU 118 -10.909 10.716 14.835 825 HD21 LEU 118 HD21 LEU 118 -11.412 12.613 18.043 826 HD22 LEU 118 HD22 LEU 118 -10.322 11.229 18.122 827 HD23 LEU 118 HD23 LEU 118 -11.843 11.105 17.238 828 H ILE 119 HN ILE 119 -7.706 15.644 16.402 829 HA ILE 119 HA ILE 119 -5.352 15.283 17.941 830 HB ILE 119 HB ILE 119 -6.238 17.761 16.426 831 HG12 ILE 119 HG12 ILE 119 -4.463 15.476 15.523 832 HG13 ILE 119 HG11 ILE 119 -6.178 15.589 15.130 833 HG21 ILE 119 HG21 ILE 119 -4.175 18.637 16.799 834 HG22 ILE 119 HG22 ILE 119 -3.381 17.071 16.630 835 HG23 ILE 119 HG23 ILE 119 -4.126 17.521 18.164 836 HD11 ILE 119 HD11 ILE 119 -4.771 16.511 13.311 837 HD12 ILE 119 HD12 ILE 119 -4.083 17.673 14.444 838 HD13 ILE 119 HD13 ILE 119 -5.794 17.756 14.027 839 H GLY 120 HN GLY 120 -8.112 17.436 18.420 840 HA2 GLY 120 HA1 GLY 120 -6.911 19.007 20.516 841 HA3 GLY 120 HA2 GLY 120 -8.641 18.866 20.208 842 H MET 121 HN MET 121 -8.766 15.989 20.477 843 HA MET 121 HA MET 121 -9.112 15.787 23.320 844 HB2 MET 121 HB1 MET 121 -10.395 14.412 21.716 845 HB3 MET 121 HB2 MET 121 -8.914 13.579 21.246 846 HG2 MET 121 HG1 MET 121 -9.989 12.175 22.865 847 HG3 MET 121 HG2 MET 121 -8.640 12.946 23.700 848 HE1 MET 121 HE1 MET 121 -11.536 11.627 23.885 849 HE2 MET 121 HE2 MET 121 -12.854 12.797 23.926 850 HE3 MET 121 HE3 MET 121 -12.181 12.186 25.435 851 H PHE 122 HN PHE 122 -6.523 14.757 21.125 852 HA PHE 122 HA PHE 122 -5.038 13.267 23.084 853 HB2 PHE 122 HB2 PHE 122 -4.212 14.646 20.518 854 HB3 PHE 122 HB1 PHE 122 -3.104 13.676 21.489 855 HD1 PHE 122 HD1 PHE 122 -3.984 11.278 22.156 856 HD2 PHE 122 HD2 PHE 122 -5.489 13.596 18.867 857 HE1 PHE 122 HE1 PHE 122 -4.878 9.215 21.111 858 HE2 PHE 122 HE2 PHE 122 -6.381 11.532 17.822 859 HZ PHE 122 HZ PHE 122 -6.076 9.341 18.943 860 H ALA 123 HN ALA 123 -5.219 16.685 22.281 861 HA ALA 123 HA ALA 123 -2.842 17.551 23.595 862 HB1 ALA 123 HB1 ALA 123 -3.720 19.325 22.446 863 HB2 ALA 123 HB2 ALA 123 -4.508 19.654 23.989 864 HB3 ALA 123 HB3 ALA 123 -5.384 18.805 22.716 865 H GLN 124 HN GLN 124 -6.079 16.835 24.805 866 HA GLN 124 HA GLN 124 -5.612 17.858 27.468 867 HB2 GLN 124 HB2 GLN 124 -7.605 15.828 26.417 868 HB3 GLN 124 HB1 GLN 124 -7.630 16.486 28.053 869 HG2 GLN 124 HG2 GLN 124 -7.891 18.757 27.155 870 HG3 GLN 124 HG1 GLN 124 -7.809 18.130 25.508 871 HE21 GLN 124 HE21 GLN 124 -10.120 19.543 26.372 872 HE22 GLN 124 HE22 GLN 124 -11.421 18.460 26.509 873 H ALA 125 HN ALA 125 -5.155 14.714 25.910 874 HA ALA 125 HA ALA 125 -4.641 13.204 28.282 875 HB1 ALA 125 HB1 ALA 125 -3.270 12.699 25.641 876 HB2 ALA 125 HB2 ALA 125 -4.987 12.363 25.862 877 HB3 ALA 125 HB3 ALA 125 -3.790 11.523 26.848 878 H SER 126 HN SER 126 -2.667 15.425 26.426 879 HA SER 126 HA SER 126 -0.109 14.622 27.440 880 HB2 SER 126 HB2 SER 126 0.690 16.749 26.637 881 HB3 SER 126 HB1 SER 126 -0.527 16.187 25.491 882 HG SER 126 HG SER 126 -0.599 18.295 27.289 883 H ALA 127 HN ALA 127 -2.696 16.578 28.771 884 HA ALA 127 HA ALA 127 -1.157 17.845 30.848 885 HB1 ALA 127 HB1 ALA 127 -3.227 18.865 30.540 886 HB2 ALA 127 HB2 ALA 127 -3.553 17.872 31.961 887 HB3 ALA 127 HB3 ALA 127 -4.073 17.327 30.367 888 H ASN 128 HN ASN 128 -2.257 14.624 30.402 889 HA ASN 128 HA ASN 128 -2.597 13.814 33.124 890 HB2 ASN 128 HB2 ASN 128 -1.709 12.273 30.670 891 HB3 ASN 128 HB1 ASN 128 -2.050 11.516 32.226 892 HD21 ASN 128 HD21 ASN 128 -3.624 10.856 29.951 893 HD22 ASN 128 HD22 ASN 128 -5.185 11.491 30.150 894 H ASP 129 HN ASP 129 0.261 14.250 31.112 895 HA ASP 129 HA ASP 129 2.092 12.902 32.894 896 HB2 ASP 129 HB2 ASP 129 3.845 14.076 31.601 897 HB3 ASP 129 HB1 ASP 129 2.653 13.333 30.534 898 H VAL 130 HN VAL 130 0.463 15.908 33.057 899 HA VAL 130 HA VAL 130 2.351 17.526 34.418 900 HB VAL 130 HB VAL 130 -0.072 18.064 33.567 901 HG11 VAL 130 HG11 VAL 130 -1.236 16.456 35.003 902 HG12 VAL 130 HG12 VAL 130 -1.737 18.102 35.392 903 HG13 VAL 130 HG13 VAL 130 -0.594 17.258 36.437 904 HG21 VAL 130 HG21 VAL 130 1.737 19.322 35.305 905 HG22 VAL 130 HG22 VAL 130 0.165 19.488 36.084 906 HG23 VAL 130 HG23 VAL 130 0.402 20.086 34.443 907 H TYR 131 HN TYR 131 0.514 14.775 35.484 908 HA TYR 131 HA TYR 131 2.078 14.316 37.800 909 HB2 TYR 131 HB2 TYR 131 0.721 15.083 39.604 910 HB3 TYR 131 HB1 TYR 131 0.860 16.453 38.507 911 HD1 TYR 131 HD2 TYR 131 -1.087 15.228 36.372 912 HD2 TYR 131 HD1 TYR 131 -1.359 15.811 40.618 913 HE1 TYR 131 HE2 TYR 131 -3.542 15.347 36.189 914 HE2 TYR 131 HE1 TYR 131 -3.830 15.925 40.436 915 HH TYR 131 HH TYR 131 -5.564 16.058 39.026 916 H ALA 132 HN ALA 132 0.444 12.942 39.456 917 HA ALA 132 HA ALA 132 -0.671 10.870 37.647 918 HB1 ALA 132 HB1 ALA 132 0.993 10.343 39.528 919 HB2 ALA 132 HB2 ALA 132 -0.467 9.354 39.477 920 HB3 ALA 132 HB3 ALA 132 -0.332 10.668 40.645 921 H SER 133 HN SER 133 -2.845 10.688 37.398 922 HA SER 133 HA SER 133 -4.752 12.460 38.365 923 HB2 SER 133 HB2 SER 133 -5.271 9.505 37.928 924 HB3 SER 133 HB1 SER 133 -6.436 10.822 37.786 925 HG SER 133 HG SER 133 -5.506 10.068 35.770 926 H ALA 134 HN ALA 134 -3.546 9.519 39.940 927 HA ALA 134 HA ALA 134 -5.399 9.434 42.095 928 HB1 ALA 134 HB1 ALA 134 -3.683 7.667 41.521 929 HB2 ALA 134 HB2 ALA 134 -3.773 8.063 43.237 930 HB3 ALA 134 HB3 ALA 134 -2.461 8.708 42.250 931 H GLY 135 HN GLY 135 -2.481 11.364 41.603 932 HA2 GLY 135 HA2 GLY 135 -1.943 13.413 42.671 933 HA3 GLY 135 HA1 GLY 135 -3.350 13.203 43.712 934 H SER 136 HN SER 136 -1.724 13.909 45.404 935 HA SER 136 HA SER 136 0.518 12.313 46.133 936 HB2 SER 136 HB2 SER 136 0.407 13.432 48.284 937 HB3 SER 136 HB1 SER 136 0.002 14.604 47.030 938 HG SER 136 HG SER 136 -2.214 14.148 47.469 939 H GLY 137 HN GLY 137 -2.914 11.897 46.684 940 HA2 GLY 137 HA2 GLY 137 -3.410 9.386 47.030 941 HA3 GLY 137 HA1 GLY 137 -2.322 9.531 48.409 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 -18.953 10.886 -11.533 2 H2 GLY 1 HT2 GLY 1 -18.154 12.225 -10.857 3 H3 GLY 1 HT3 GLY 1 -19.340 11.400 -9.963 4 HA2 GLY 1 HA2 GLY 1 -17.421 10.565 -9.042 5 HA3 GLY 1 HA1 GLY 1 -17.809 9.362 -10.272 6 H MET 2 HN MET 2 -15.448 11.560 -9.185 7 HA MET 2 HA MET 2 -13.924 11.187 -11.734 8 HB2 MET 2 HB2 MET 2 -13.855 13.522 -9.797 9 HB3 MET 2 HB1 MET 2 -12.755 13.322 -11.161 10 HG2 MET 2 HG2 MET 2 -14.743 13.244 -12.685 11 HG3 MET 2 HG1 MET 2 -15.773 13.597 -11.297 12 HE1 MET 2 HE1 MET 2 -13.628 16.113 -9.748 13 HE2 MET 2 HE2 MET 2 -15.104 15.158 -9.635 14 HE3 MET 2 HE3 MET 2 -15.196 16.857 -10.092 15 H GLY 3 HN GLY 3 -11.632 10.820 -11.469 16 HA2 GLY 3 HA1 GLY 3 -9.668 10.280 -10.218 17 HA3 GLY 3 HA2 GLY 3 -10.615 10.385 -8.733 18 H GLN 4 HN GLN 4 -9.088 8.239 -8.735 19 HA GLN 4 HA GLN 4 -10.080 5.934 -10.128 20 HB2 GLN 4 HB1 GLN 4 -8.521 6.165 -7.537 21 HB3 GLN 4 HB2 GLN 4 -8.810 4.650 -8.392 22 HG2 GLN 4 HG1 GLN 4 -7.648 5.518 -10.371 23 HG3 GLN 4 HG2 GLN 4 -7.407 7.070 -9.566 24 HE21 GLN 4 HE21 GLN 4 -5.158 5.568 -10.443 25 HE22 GLN 4 HE22 GLN 4 -4.325 4.972 -9.089 26 H ALA 5 HN ALA 5 -11.191 7.644 -7.332 27 HA ALA 5 HA ALA 5 -13.549 5.940 -7.198 28 HB1 ALA 5 HB1 ALA 5 -11.867 4.643 -5.865 29 HB2 ALA 5 HB2 ALA 5 -13.251 5.171 -4.907 30 HB3 ALA 5 HB3 ALA 5 -11.715 6.028 -4.783 31 H ASN 6 HN ASN 6 -14.960 6.744 -5.247 32 HA ASN 6 HA ASN 6 -15.280 9.583 -5.520 33 HB2 ASN 6 HB2 ASN 6 -16.390 7.728 -3.390 34 HB3 ASN 6 HB1 ASN 6 -16.979 9.350 -3.749 35 HD21 ASN 6 HD21 ASN 6 -18.621 6.960 -4.005 36 HD22 ASN 6 HD22 ASN 6 -19.004 6.773 -5.648 37 H THR 7 HN THR 7 -13.214 7.692 -3.548 38 HA THR 7 HA THR 7 -12.210 10.126 -2.251 39 HB THR 7 HB THR 7 -14.170 8.854 -0.889 40 HG1 THR 7 HG1 THR 7 -13.441 10.628 0.013 41 HG21 THR 7 HG21 THR 7 -11.739 7.698 0.434 42 HG22 THR 7 HG22 THR 7 -12.521 6.809 -0.869 43 HG23 THR 7 HG23 THR 7 -13.428 7.213 0.587 44 HA PRO 8 HA PRO 8 -8.366 7.971 -2.646 45 HB2 PRO 8 HB2 PRO 8 -6.975 8.866 -0.509 46 HB3 PRO 8 HB1 PRO 8 -7.315 9.862 -1.925 47 HG2 PRO 8 HG2 PRO 8 -8.716 9.788 0.720 48 HG3 PRO 8 HG1 PRO 8 -8.236 11.188 -0.244 49 HD2 PRO 8 HD1 PRO 8 -10.769 10.266 -0.231 50 HD3 PRO 8 HD2 PRO 8 -10.050 10.991 -1.668 51 H TRP 9 HN TRP 9 -9.859 7.765 0.597 52 HA TRP 9 HA TRP 9 -8.263 5.387 1.236 53 HB2 TRP 9 HB2 TRP 9 -9.614 5.321 3.319 54 HB3 TRP 9 HB1 TRP 9 -8.860 6.894 3.061 55 HD1 TRP 9 HD1 TRP 9 -12.230 5.128 3.020 56 HE1 TRP 9 HE1 TRP 9 -14.104 6.900 3.014 57 HE3 TRP 9 HE3 TRP 9 -9.441 9.357 2.386 58 HZ2 TRP 9 HZ2 TRP 9 -14.380 9.738 2.776 59 HZ3 TRP 9 HZ3 TRP 9 -10.533 11.575 2.272 60 HH2 TRP 9 HH2 TRP 9 -12.996 11.775 2.468 61 H SER 10 HN SER 10 -10.804 5.829 -0.791 62 HA SER 10 HA SER 10 -12.274 3.378 -0.017 63 HB2 SER 10 HB1 SER 10 -12.653 5.448 -2.189 64 HB3 SER 10 HB2 SER 10 -13.570 3.941 -2.169 65 HG SER 10 HG SER 10 -14.304 6.020 -0.974 66 H SER 11 HN SER 11 -9.873 4.486 -2.307 67 HA SER 11 HA SER 11 -9.949 1.839 -3.676 68 HB2 SER 11 HB1 SER 11 -9.864 4.282 -4.815 69 HB3 SER 11 HB2 SER 11 -8.133 4.001 -4.623 70 HG SER 11 HG SER 11 -9.927 2.146 -5.790 71 H LYS 12 HN LYS 12 -7.918 0.686 -3.937 72 HA LYS 12 HA LYS 12 -6.250 0.803 -1.566 73 HB2 LYS 12 HB1 LYS 12 -6.866 -1.166 -3.335 74 HB3 LYS 12 HB2 LYS 12 -5.271 -0.699 -3.924 75 HG2 LYS 12 HG2 LYS 12 -4.352 -0.977 -1.645 76 HG3 LYS 12 HG1 LYS 12 -5.945 -1.461 -1.065 77 HD2 LYS 12 HD2 LYS 12 -4.356 -3.374 -1.623 78 HD3 LYS 12 HD1 LYS 12 -5.930 -3.442 -2.415 79 HE2 LYS 12 HE2 LYS 12 -3.847 -1.937 -3.885 80 HE3 LYS 12 HE1 LYS 12 -3.556 -3.670 -3.739 81 HZ1 LYS 12 HZ1 LYS 12 -6.013 -2.382 -4.799 82 HZ2 LYS 12 HZ2 LYS 12 -5.805 -4.056 -4.587 83 HZ3 LYS 12 HZ3 LYS 12 -4.843 -3.211 -5.705 84 H ALA 13 HN ALA 13 -5.862 1.789 -4.954 85 HA ALA 13 HA ALA 13 -3.080 2.614 -4.513 86 HB1 ALA 13 HB1 ALA 13 -3.398 1.930 -6.722 87 HB2 ALA 13 HB2 ALA 13 -3.547 3.681 -6.876 88 HB3 ALA 13 HB3 ALA 13 -4.994 2.673 -6.828 89 H ASN 14 HN ASN 14 -6.264 4.143 -4.720 90 HA ASN 14 HA ASN 14 -5.251 6.853 -4.726 91 HB2 ASN 14 HB1 ASN 14 -7.690 5.789 -5.213 92 HB3 ASN 14 HB2 ASN 14 -7.925 6.318 -3.547 93 HD21 ASN 14 HD21 ASN 14 -9.304 7.606 -5.698 94 HD22 ASN 14 HD22 ASN 14 -8.689 9.178 -5.882 95 H ALA 15 HN ALA 15 -5.987 4.507 -2.220 96 HA ALA 15 HA ALA 15 -6.014 6.414 -0.041 97 HB1 ALA 15 HB1 ALA 15 -5.261 3.520 0.289 98 HB2 ALA 15 HB2 ALA 15 -6.920 3.967 -0.112 99 HB3 ALA 15 HB3 ALA 15 -6.183 4.555 1.380 100 H ASP 16 HN ASP 16 -3.537 4.221 -1.348 101 HA ASP 16 HA ASP 16 -1.483 4.775 0.509 102 HB2 ASP 16 HB1 ASP 16 -1.423 3.024 -1.301 103 HB3 ASP 16 HB2 ASP 16 -1.099 4.312 -2.460 104 H ALA 17 HN ALA 17 -2.031 6.366 -2.658 105 HA ALA 17 HA ALA 17 0.005 8.286 -2.488 106 HB1 ALA 17 HB1 ALA 17 -1.532 9.729 -3.901 107 HB2 ALA 17 HB2 ALA 17 -2.768 8.490 -3.688 108 HB3 ALA 17 HB3 ALA 17 -1.264 8.100 -4.521 109 H PHE 18 HN PHE 18 -3.304 8.471 -1.168 110 HA PHE 18 HA PHE 18 -3.169 11.112 -0.159 111 HB2 PHE 18 HB2 PHE 18 -5.234 9.712 -0.205 112 HB3 PHE 18 HB1 PHE 18 -4.574 8.745 1.114 113 HD1 PHE 18 HD2 PHE 18 -5.760 12.127 0.154 114 HD2 PHE 18 HD1 PHE 18 -4.550 9.559 3.377 115 HE1 PHE 18 HE2 PHE 18 -6.602 13.786 1.791 116 HE2 PHE 18 HE1 PHE 18 -5.394 11.219 5.015 117 HZ PHE 18 HZ PHE 18 -6.420 13.332 4.222 118 H ILE 19 HN ILE 19 -2.036 8.058 1.255 119 HA ILE 19 HA ILE 19 -1.293 9.203 3.796 120 HB ILE 19 HB ILE 19 -0.116 6.754 2.453 121 HG12 ILE 19 HG12 ILE 19 -2.536 6.544 2.456 122 HG13 ILE 19 HG11 ILE 19 -1.890 5.531 3.747 123 HG21 ILE 19 HG21 ILE 19 0.503 8.046 4.860 124 HG22 ILE 19 HG22 ILE 19 0.947 6.399 4.412 125 HG23 ILE 19 HG23 ILE 19 -0.527 6.696 5.334 126 HD11 ILE 19 HD11 ILE 19 -3.516 8.010 3.915 127 HD12 ILE 19 HD12 ILE 19 -2.215 7.860 5.098 128 HD13 ILE 19 HD13 ILE 19 -3.466 6.620 5.001 129 H ASN 20 HN ASN 20 0.520 8.553 0.797 130 HA ASN 20 HA ASN 20 3.066 9.399 1.800 131 HB2 ASN 20 HB1 ASN 20 2.057 9.541 -1.056 132 HB3 ASN 20 HB2 ASN 20 3.743 9.513 -0.538 133 HD21 ASN 20 HD21 ASN 20 1.629 7.515 -1.961 134 HD22 ASN 20 HD22 ASN 20 2.039 6.031 -1.247 135 H SER 21 HN SER 21 0.603 11.165 -0.101 136 HA SER 21 HA SER 21 2.007 13.646 -0.173 137 HB2 SER 21 HB2 SER 21 -0.078 12.941 -1.503 138 HB3 SER 21 HB1 SER 21 -1.002 13.404 -0.073 139 HG SER 21 HG SER 21 -0.811 15.373 -0.714 140 H PHE 22 HN PHE 22 -0.043 12.195 2.296 141 HA PHE 22 HA PHE 22 -0.510 14.561 3.834 142 HB2 PHE 22 HB1 PHE 22 -1.777 12.505 4.227 143 HB3 PHE 22 HB2 PHE 22 -0.305 11.670 4.727 144 HD1 PHE 22 HD2 PHE 22 1.015 12.678 6.716 145 HD2 PHE 22 HD1 PHE 22 -3.055 13.699 5.797 146 HE1 PHE 22 HE2 PHE 22 0.703 13.520 9.030 147 HE2 PHE 22 HE1 PHE 22 -3.366 14.537 8.112 148 HZ PHE 22 HZ PHE 22 -1.487 14.450 9.725 149 H ILE 23 HN ILE 23 1.971 12.009 4.247 150 HA ILE 23 HA ILE 23 3.326 13.231 6.418 151 HB ILE 23 HB ILE 23 4.585 11.580 4.215 152 HG12 ILE 23 HG12 ILE 23 2.608 10.424 5.048 153 HG13 ILE 23 HG11 ILE 23 4.044 9.646 5.713 154 HG21 ILE 23 HG21 ILE 23 6.417 11.486 5.540 155 HG22 ILE 23 HG22 ILE 23 5.448 11.194 6.984 156 HG23 ILE 23 HG23 ILE 23 5.713 12.843 6.419 157 HD11 ILE 23 HD11 ILE 23 3.119 9.949 7.751 158 HD12 ILE 23 HD12 ILE 23 1.880 11.024 7.102 159 HD13 ILE 23 HD13 ILE 23 3.461 11.667 7.546 160 H SER 24 HN SER 24 4.216 13.357 2.944 161 HA SER 24 HA SER 24 6.277 15.309 3.318 162 HB2 SER 24 HB1 SER 24 6.281 15.523 0.920 163 HB3 SER 24 HB2 SER 24 5.960 13.829 1.288 164 HG SER 24 HG SER 24 4.091 15.834 0.580 165 H ALA 25 HN ALA 25 2.803 15.586 2.898 166 HA ALA 25 HA ALA 25 2.877 18.442 2.320 167 HB1 ALA 25 HB1 ALA 25 0.416 18.310 2.657 168 HB2 ALA 25 HB2 ALA 25 0.599 16.639 3.189 169 HB3 ALA 25 HB3 ALA 25 1.001 17.086 1.531 170 H ALA 26 HN ALA 26 2.174 16.463 5.210 171 HA ALA 26 HA ALA 26 1.627 18.781 6.872 172 HB1 ALA 26 HB1 ALA 26 1.776 15.862 7.216 173 HB2 ALA 26 HB2 ALA 26 0.686 17.030 7.965 174 HB3 ALA 26 HB3 ALA 26 2.300 16.778 8.630 175 H SER 27 HN SER 27 4.509 16.951 6.056 176 HA SER 27 HA SER 27 6.163 17.834 8.211 177 HB2 SER 27 HB2 SER 27 8.035 17.152 6.822 178 HB3 SER 27 HB1 SER 27 6.729 15.982 6.625 179 HG SER 27 HG SER 27 6.165 17.629 4.819 180 H ASN 28 HN ASN 28 5.152 19.409 5.246 181 HA ASN 28 HA ASN 28 7.047 21.643 5.811 182 HB2 ASN 28 HB2 ASN 28 5.453 20.953 3.329 183 HB3 ASN 28 HB1 ASN 28 6.452 22.396 3.496 184 HD21 ASN 28 HD21 ASN 28 7.088 20.490 1.500 185 HD22 ASN 28 HD22 ASN 28 8.506 19.660 1.930 186 H THR 29 HN THR 29 4.033 20.875 6.750 187 HA THR 29 HA THR 29 2.790 23.479 6.095 188 HB THR 29 HB THR 29 1.639 21.262 7.806 189 HG1 THR 29 HG1 THR 29 1.975 20.326 5.878 190 HG21 THR 29 HG21 THR 29 0.770 23.808 7.484 191 HG22 THR 29 HG22 THR 29 -0.315 22.443 7.739 192 HG23 THR 29 HG23 THR 29 -0.017 23.037 6.107 193 H GLY 30 HN GLY 30 2.722 21.730 9.207 194 HA2 GLY 30 HA2 GLY 30 2.943 24.284 10.618 195 HA3 GLY 30 HA1 GLY 30 2.743 22.701 11.366 196 H SER 31 HN SER 31 4.541 21.703 12.184 197 HA SER 31 HA SER 31 7.206 22.834 11.447 198 HB2 SER 31 HB2 SER 31 6.473 23.725 13.650 199 HB3 SER 31 HB1 SER 31 6.299 22.072 14.242 200 HG SER 31 HG SER 31 8.309 22.649 14.830 201 H PHE 32 HN PHE 32 5.835 20.185 13.442 202 HA PHE 32 HA PHE 32 6.588 17.953 13.631 203 HB2 PHE 32 HB2 PHE 32 6.341 18.502 10.678 204 HB3 PHE 32 HB1 PHE 32 6.858 16.918 11.257 205 HD1 PHE 32 HD1 PHE 32 5.339 16.280 13.540 206 HD2 PHE 32 HD2 PHE 32 4.075 18.536 10.105 207 HE1 PHE 32 HE1 PHE 32 2.985 15.663 14.000 208 HE2 PHE 32 HE2 PHE 32 1.721 17.918 10.570 209 HZ PHE 32 HZ PHE 32 1.175 16.479 12.514 210 H SER 33 HN SER 33 8.656 18.418 14.623 211 HA SER 33 HA SER 33 11.010 19.137 13.202 212 HB2 SER 33 HB1 SER 33 12.209 18.519 15.153 213 HB3 SER 33 HB2 SER 33 10.627 19.023 15.751 214 HG SER 33 HG SER 33 11.810 16.550 15.753 215 H GLN 34 HN GLN 34 12.865 17.709 12.680 216 HA GLN 34 HA GLN 34 12.215 15.603 10.935 217 HB2 GLN 34 HB1 GLN 34 14.764 15.949 12.546 218 HB3 GLN 34 HB2 GLN 34 14.589 14.937 11.113 219 HG2 GLN 34 HG2 GLN 34 13.793 17.070 9.914 220 HG3 GLN 34 HG1 GLN 34 14.426 17.948 11.306 221 HE21 GLN 34 HE21 GLN 34 16.603 15.811 11.619 222 HE22 GLN 34 HE22 GLN 34 17.727 16.156 10.396 223 H ASP 35 HN ASP 35 12.862 15.531 14.411 224 HA ASP 35 HA ASP 35 12.972 12.679 14.673 225 HB2 ASP 35 HB2 ASP 35 12.204 14.861 16.631 226 HB3 ASP 35 HB1 ASP 35 12.355 13.162 17.083 227 H GLN 36 HN GLN 36 10.298 15.002 14.669 228 HA GLN 36 HA GLN 36 8.294 13.045 15.427 229 HB2 GLN 36 HB1 GLN 36 7.965 15.698 13.992 230 HB3 GLN 36 HB2 GLN 36 6.679 14.778 14.772 231 HG2 GLN 36 HG2 GLN 36 9.106 15.980 16.139 232 HG3 GLN 36 HG1 GLN 36 7.444 16.551 16.275 233 HE21 GLN 36 HE21 GLN 36 9.614 14.951 18.086 234 HE22 GLN 36 HE22 GLN 36 8.607 13.849 18.892 235 H MET 37 HN MET 37 9.690 14.178 12.406 236 HA MET 37 HA MET 37 7.743 13.059 10.631 237 HB2 MET 37 HB2 MET 37 10.715 13.538 10.250 238 HB3 MET 37 HB1 MET 37 9.596 13.127 8.950 239 HG2 MET 37 HG2 MET 37 8.244 15.150 9.546 240 HG3 MET 37 HG1 MET 37 9.480 15.583 10.727 241 HE1 MET 37 HE1 MET 37 9.912 17.948 9.605 242 HE2 MET 37 HE2 MET 37 8.516 17.488 8.633 243 HE3 MET 37 HE3 MET 37 9.947 18.150 7.848 244 H GLU 38 HN GLU 38 10.475 11.681 12.365 245 HA GLU 38 HA GLU 38 10.757 9.246 10.942 246 HB2 GLU 38 HB2 GLU 38 11.083 9.852 13.894 247 HB3 GLU 38 HB1 GLU 38 11.565 8.327 13.150 248 HG2 GLU 38 HG2 GLU 38 13.007 9.637 11.561 249 HG3 GLU 38 HG1 GLU 38 12.622 11.091 12.484 250 H ASN 39 HN ASN 39 8.574 10.093 13.633 251 HA ASN 39 HA ASN 39 7.359 7.561 13.960 252 HB2 ASN 39 HB2 ASN 39 6.067 10.295 14.205 253 HB3 ASN 39 HB1 ASN 39 5.434 8.796 14.886 254 HD21 ASN 39 HD21 ASN 39 6.162 11.061 16.531 255 HD22 ASN 39 HD22 ASN 39 7.498 10.617 17.479 256 H MET 40 HN MET 40 6.618 10.180 11.687 257 HA MET 40 HA MET 40 4.294 8.971 10.535 258 HB2 MET 40 HB2 MET 40 6.325 10.865 9.310 259 HB3 MET 40 HB1 MET 40 4.768 10.460 8.587 260 HG2 MET 40 HG2 MET 40 3.644 11.292 10.664 261 HG3 MET 40 HG1 MET 40 5.220 11.805 11.269 262 HE1 MET 40 HE1 MET 40 3.830 13.618 11.702 263 HE2 MET 40 HE2 MET 40 2.935 14.616 10.558 264 HE3 MET 40 HE3 MET 40 4.602 15.025 10.957 265 H SER 41 HN SER 41 7.738 8.534 9.979 266 HA SER 41 HA SER 41 7.460 7.009 7.540 267 HB2 SER 41 HB2 SER 41 9.697 6.944 9.591 268 HB3 SER 41 HB1 SER 41 9.790 6.355 7.931 269 HG SER 41 HG SER 41 9.832 8.938 8.912 270 H LEU 42 HN LEU 42 7.090 6.279 10.920 271 HA LEU 42 HA LEU 42 7.290 3.367 10.475 272 HB2 LEU 42 HB2 LEU 42 8.141 4.336 12.583 273 HB3 LEU 42 HB1 LEU 42 6.527 4.946 12.951 274 HG LEU 42 HG LEU 42 5.775 2.470 12.660 275 HD11 LEU 42 HD11 LEU 42 7.647 0.896 13.346 276 HD12 LEU 42 HD12 LEU 42 8.773 2.210 13.007 277 HD13 LEU 42 HD13 LEU 42 7.781 1.542 11.711 278 HD21 LEU 42 HD21 LEU 42 7.334 2.372 15.081 279 HD22 LEU 42 HD22 LEU 42 5.597 2.621 14.898 280 HD23 LEU 42 HD23 LEU 42 6.695 4.001 14.861 281 H ILE 43 HN ILE 43 4.851 5.853 10.701 282 HA ILE 43 HA ILE 43 2.764 3.726 10.424 283 HB ILE 43 HB ILE 43 2.686 6.335 11.953 284 HG12 ILE 43 HG12 ILE 43 1.948 3.512 12.769 285 HG13 ILE 43 HG11 ILE 43 3.537 4.224 13.045 286 HG21 ILE 43 HG21 ILE 43 0.518 4.841 10.614 287 HG22 ILE 43 HG22 ILE 43 0.550 6.511 11.179 288 HG23 ILE 43 HG23 ILE 43 0.217 5.203 12.313 289 HD11 ILE 43 HD11 ILE 43 1.402 4.400 14.783 290 HD12 ILE 43 HD12 ILE 43 1.316 5.938 13.923 291 HD13 ILE 43 HD13 ILE 43 2.792 5.486 14.777 292 H GLY 44 HN GLY 44 1.063 4.205 8.942 293 HA2 GLY 44 HA2 GLY 44 -0.059 5.735 7.388 294 HA3 GLY 44 HA1 GLY 44 1.440 6.664 7.294 295 H ASN 45 HN ASN 45 3.285 5.628 6.193 296 HA ASN 45 HA ASN 45 2.544 4.367 3.731 297 HB2 ASN 45 HB2 ASN 45 5.225 4.517 5.148 298 HB3 ASN 45 HB1 ASN 45 5.007 3.940 3.496 299 HD21 ASN 45 HD21 ASN 45 6.609 6.215 3.919 300 HD22 ASN 45 HD22 ASN 45 5.804 7.591 3.337 301 H THR 46 HN THR 46 3.413 3.136 6.891 302 HA THR 46 HA THR 46 3.974 0.430 6.142 303 HB THR 46 HB THR 46 2.769 1.458 8.729 304 HG1 THR 46 HG1 THR 46 4.665 2.248 9.061 305 HG21 THR 46 HG21 THR 46 2.817 -0.683 9.405 306 HG22 THR 46 HG22 THR 46 4.535 -0.775 9.020 307 HG23 THR 46 HG23 THR 46 3.335 -1.170 7.791 308 H LEU 47 HN LEU 47 0.984 2.179 6.823 309 HA LEU 47 HA LEU 47 -0.816 0.018 7.032 310 HB2 LEU 47 HB2 LEU 47 -1.295 2.664 5.623 311 HB3 LEU 47 HB1 LEU 47 -2.538 1.583 6.251 312 HG LEU 47 HG LEU 47 -0.429 3.045 7.867 313 HD11 LEU 47 HD11 LEU 47 -2.127 4.597 7.453 314 HD12 LEU 47 HD12 LEU 47 -2.680 3.855 8.955 315 HD13 LEU 47 HD13 LEU 47 -3.384 3.360 7.415 316 HD21 LEU 47 HD21 LEU 47 -1.809 2.032 9.798 317 HD22 LEU 47 HD22 LEU 47 -0.704 0.952 8.948 318 HD23 LEU 47 HD23 LEU 47 -2.431 0.903 8.594 319 H MET 48 HN MET 48 0.651 1.491 4.165 320 HA MET 48 HA MET 48 -0.913 0.312 2.149 321 HB2 MET 48 HB2 MET 48 0.931 1.928 1.723 322 HB3 MET 48 HB1 MET 48 2.101 0.670 2.125 323 HG2 MET 48 HG2 MET 48 1.118 -0.741 0.294 324 HG3 MET 48 HG1 MET 48 0.103 0.630 -0.157 325 HE1 MET 48 HE1 MET 48 4.292 -0.449 -0.828 326 HE2 MET 48 HE2 MET 48 3.279 -0.827 0.563 327 HE3 MET 48 HE3 MET 48 4.363 0.560 0.623 328 H ALA 49 HN ALA 49 1.768 -1.081 4.021 329 HA ALA 49 HA ALA 49 1.934 -3.555 2.602 330 HB1 ALA 49 HB1 ALA 49 2.453 -4.138 5.299 331 HB2 ALA 49 HB2 ALA 49 2.935 -2.453 5.101 332 HB3 ALA 49 HB3 ALA 49 3.643 -3.699 4.072 333 H ALA 50 HN ALA 50 -0.149 -2.435 5.228 334 HA ALA 50 HA ALA 50 -1.382 -4.939 5.838 335 HB1 ALA 50 HB1 ALA 50 -1.766 -3.135 7.353 336 HB2 ALA 50 HB2 ALA 50 -3.324 -3.426 6.578 337 HB3 ALA 50 HB3 ALA 50 -2.320 -2.072 6.059 338 H MET 51 HN MET 51 -1.721 -2.730 3.181 339 HA MET 51 HA MET 51 -4.314 -3.340 2.255 340 HB2 MET 51 HB2 MET 51 -1.784 -2.805 0.667 341 HB3 MET 51 HB1 MET 51 -3.407 -2.816 -0.020 342 HG2 MET 51 HG2 MET 51 -4.064 -1.021 1.577 343 HG3 MET 51 HG1 MET 51 -2.405 -0.977 2.176 344 HE1 MET 51 HE1 MET 51 -3.852 1.829 0.663 345 HE2 MET 51 HE2 MET 51 -2.147 2.231 0.482 346 HE3 MET 51 HE3 MET 51 -2.687 1.336 1.899 347 H ASP 52 HN ASP 52 -1.354 -5.239 2.122 348 HA ASP 52 HA ASP 52 -2.409 -7.165 0.208 349 HB2 ASP 52 HB2 ASP 52 -0.087 -7.344 2.154 350 HB3 ASP 52 HB1 ASP 52 -0.442 -8.536 0.902 351 H ASN 53 HN ASN 53 -3.043 -6.553 3.470 352 HA ASN 53 HA ASN 53 -3.406 -9.263 4.400 353 HB2 ASN 53 HB2 ASN 53 -4.561 -6.639 5.375 354 HB3 ASN 53 HB1 ASN 53 -4.734 -8.175 6.224 355 HD21 ASN 53 HD21 ASN 53 -3.341 -5.958 7.407 356 HD22 ASN 53 HD22 ASN 53 -1.703 -6.380 7.549 357 H MET 54 HN MET 54 -5.534 -6.900 2.849 358 HA MET 54 HA MET 54 -8.005 -8.223 3.246 359 HB2 MET 54 HB2 MET 54 -8.542 -7.159 0.921 360 HB3 MET 54 HB1 MET 54 -8.211 -6.099 2.290 361 HG2 MET 54 HG1 MET 54 -6.394 -5.252 1.265 362 HG3 MET 54 HG2 MET 54 -5.750 -6.871 0.981 363 HE1 MET 54 HE1 MET 54 -4.878 -7.073 -1.255 364 HE2 MET 54 HE2 MET 54 -4.774 -5.319 -1.120 365 HE3 MET 54 HE3 MET 54 -5.369 -6.047 -2.610 366 H GLY 55 HN GLY 55 -5.295 -9.153 1.329 367 HA2 GLY 55 HA2 GLY 55 -5.033 -11.298 0.300 368 HA3 GLY 55 HA1 GLY 55 -6.774 -11.547 0.434 369 H GLY 56 HN GLY 56 -6.315 -8.476 -0.737 370 HA2 GLY 56 HA2 GLY 56 -5.755 -7.830 -3.072 371 HA3 GLY 56 HA1 GLY 56 -6.363 -9.406 -3.577 372 H ARG 57 HN ARG 57 -8.402 -8.444 -1.176 373 HA ARG 57 HA ARG 57 -10.238 -7.137 -3.142 374 HB2 ARG 57 HB2 ARG 57 -12.090 -8.113 -1.833 375 HB3 ARG 57 HB1 ARG 57 -11.012 -9.369 -2.440 376 HG2 ARG 57 HG2 ARG 57 -9.793 -9.126 -0.162 377 HG3 ARG 57 HG1 ARG 57 -11.250 -8.287 0.367 378 HD2 ARG 57 HD2 ARG 57 -12.551 -10.313 -0.510 379 HD3 ARG 57 HD1 ARG 57 -10.995 -11.135 -0.618 380 HE ARG 57 HE ARG 57 -10.794 -10.600 1.891 381 HH11 ARG 57 HH21 ARG 57 -13.553 -9.182 1.718 382 HH12 ARG 57 HH22 ARG 57 -14.557 -10.384 2.458 383 HH21 ARG 57 HH11 ARG 57 -12.184 -12.902 2.209 384 HH22 ARG 57 HH12 ARG 57 -13.783 -12.490 2.736 385 H ILE 58 HN ILE 58 -10.335 -4.985 -2.681 386 HA ILE 58 HA ILE 58 -10.173 -4.143 0.172 387 HB ILE 58 HB ILE 58 -9.977 -2.504 -2.372 388 HG12 ILE 58 HG11 ILE 58 -8.073 -4.068 -1.958 389 HG13 ILE 58 HG12 ILE 58 -7.599 -2.372 -1.856 390 HG21 ILE 58 HG21 ILE 58 -9.957 -0.638 -1.081 391 HG22 ILE 58 HG22 ILE 58 -8.957 -1.403 0.154 392 HG23 ILE 58 HG23 ILE 58 -10.703 -1.652 0.154 393 HD11 ILE 58 HD11 ILE 58 -8.168 -4.258 0.447 394 HD12 ILE 58 HD12 ILE 58 -7.942 -2.519 0.644 395 HD13 ILE 58 HD13 ILE 58 -6.623 -3.518 0.032 396 H THR 59 HN THR 59 -11.849 -2.956 1.117 397 HA THR 59 HA THR 59 -14.236 -2.376 -0.555 398 HB THR 59 HB THR 59 -15.723 -3.585 0.806 399 HG1 THR 59 HG1 THR 59 -13.605 -3.679 2.687 400 HG21 THR 59 HG21 THR 59 -15.004 -5.776 0.586 401 HG22 THR 59 HG22 THR 59 -13.383 -5.412 1.177 402 HG23 THR 59 HG23 THR 59 -13.846 -4.957 -0.463 403 HA PRO 60 HA PRO 60 -14.488 1.355 1.802 404 HB2 PRO 60 HB2 PRO 60 -17.152 1.658 2.171 405 HB3 PRO 60 HB1 PRO 60 -16.360 1.912 0.613 406 HG2 PRO 60 HG2 PRO 60 -17.848 -0.490 1.613 407 HG3 PRO 60 HG1 PRO 60 -17.944 0.296 0.034 408 HD2 PRO 60 HD2 PRO 60 -16.502 -1.947 0.406 409 HD3 PRO 60 HD1 PRO 60 -15.985 -0.691 -0.720 410 H SER 61 HN SER 61 -16.224 -1.435 3.117 411 HA SER 61 HA SER 61 -16.586 -0.284 5.752 412 HB2 SER 61 HB2 SER 61 -17.273 -2.498 6.424 413 HB3 SER 61 HB1 SER 61 -17.912 -2.220 4.804 414 HG SER 61 HG SER 61 -15.514 -3.594 5.438 415 H LYS 62 HN LYS 62 -14.088 -2.242 4.201 416 HA LYS 62 HA LYS 62 -12.608 -2.622 6.698 417 HB2 LYS 62 HB2 LYS 62 -11.882 -3.134 3.798 418 HB3 LYS 62 HB1 LYS 62 -10.851 -3.556 5.166 419 HG2 LYS 62 HG2 LYS 62 -12.680 -4.968 6.081 420 HG3 LYS 62 HG1 LYS 62 -13.665 -4.579 4.671 421 HD2 LYS 62 HD2 LYS 62 -11.886 -5.547 3.211 422 HD3 LYS 62 HD1 LYS 62 -10.994 -6.018 4.657 423 HE2 LYS 62 HE2 LYS 62 -13.861 -6.865 4.225 424 HE3 LYS 62 HE1 LYS 62 -12.515 -7.803 3.577 425 HZ1 LYS 62 HZ1 LYS 62 -11.600 -7.948 5.817 426 HZ2 LYS 62 HZ2 LYS 62 -13.160 -8.616 5.746 427 HZ3 LYS 62 HZ3 LYS 62 -12.922 -7.080 6.429 428 H LEU 63 HN LEU 63 -12.186 -0.673 3.733 429 HA LEU 63 HA LEU 63 -9.795 0.641 4.656 430 HB2 LEU 63 HB2 LEU 63 -11.589 0.804 2.365 431 HB3 LEU 63 HB1 LEU 63 -11.047 2.398 2.888 432 HG LEU 63 HG LEU 63 -9.060 0.157 2.652 433 HD11 LEU 63 HD11 LEU 63 -9.653 1.993 0.345 434 HD12 LEU 63 HD12 LEU 63 -10.541 0.480 0.524 435 HD13 LEU 63 HD13 LEU 63 -8.787 0.457 0.342 436 HD21 LEU 63 HD21 LEU 63 -7.667 1.846 3.171 437 HD22 LEU 63 HD22 LEU 63 -9.034 2.957 3.236 438 HD23 LEU 63 HD23 LEU 63 -8.173 2.707 1.718 439 H GLN 64 HN GLN 64 -13.247 1.436 4.861 440 HA GLN 64 HA GLN 64 -13.042 4.079 5.827 441 HB2 GLN 64 HB2 GLN 64 -15.027 1.865 6.275 442 HB3 GLN 64 HB1 GLN 64 -15.177 3.368 7.185 443 HG2 GLN 64 HG2 GLN 64 -15.348 4.663 5.158 444 HG3 GLN 64 HG1 GLN 64 -14.929 3.265 4.167 445 HE21 GLN 64 HE21 GLN 64 -17.279 4.334 3.406 446 HE22 GLN 64 HE22 GLN 64 -18.621 3.508 4.035 447 H ALA 65 HN ALA 65 -12.736 0.993 7.559 448 HA ALA 65 HA ALA 65 -12.448 2.230 10.167 449 HB1 ALA 65 HB1 ALA 65 -12.506 -0.446 9.078 450 HB2 ALA 65 HB2 ALA 65 -12.768 0.074 10.743 451 HB3 ALA 65 HB3 ALA 65 -11.135 -0.278 10.175 452 H LEU 66 HN LEU 66 -10.224 1.182 7.619 453 HA LEU 66 HA LEU 66 -7.823 1.681 9.178 454 HB2 LEU 66 HB2 LEU 66 -7.885 0.134 7.222 455 HB3 LEU 66 HB1 LEU 66 -8.160 1.521 6.168 456 HG LEU 66 HG LEU 66 -6.023 2.491 6.801 457 HD11 LEU 66 HD21 LEU 66 -4.553 0.817 8.261 458 HD12 LEU 66 HD22 LEU 66 -6.136 0.331 8.868 459 HD13 LEU 66 HD23 LEU 66 -5.606 2.005 9.027 460 HD21 LEU 66 HD11 LEU 66 -5.363 1.159 5.085 461 HD22 LEU 66 HD12 LEU 66 -6.251 -0.231 5.709 462 HD23 LEU 66 HD13 LEU 66 -4.647 0.147 6.339 463 H ASP 67 HN ASP 67 -9.503 3.463 6.572 464 HA ASP 67 HA ASP 67 -7.821 5.665 6.314 465 HB2 ASP 67 HB1 ASP 67 -10.050 5.180 5.122 466 HB3 ASP 67 HB2 ASP 67 -10.819 5.982 6.492 467 H MET 68 HN MET 68 -10.192 5.035 8.878 468 HA MET 68 HA MET 68 -9.850 7.613 10.151 469 HB2 MET 68 HB2 MET 68 -10.963 4.974 11.133 470 HB3 MET 68 HB1 MET 68 -10.957 6.443 12.109 471 HG2 MET 68 HG2 MET 68 -12.205 7.602 10.266 472 HG3 MET 68 HG1 MET 68 -12.315 6.056 9.425 473 HE1 MET 68 HE1 MET 68 -14.475 7.178 9.398 474 HE2 MET 68 HE2 MET 68 -15.640 7.317 10.711 475 HE3 MET 68 HE3 MET 68 -15.493 5.799 9.830 476 H ALA 69 HN ALA 69 -8.276 4.469 10.445 477 HA ALA 69 HA ALA 69 -6.889 4.963 12.896 478 HB1 ALA 69 HB1 ALA 69 -6.192 2.857 12.517 479 HB2 ALA 69 HB2 ALA 69 -5.283 3.384 11.101 480 HB3 ALA 69 HB3 ALA 69 -6.975 2.913 10.938 481 H PHE 70 HN PHE 70 -5.928 5.516 9.500 482 HA PHE 70 HA PHE 70 -3.316 6.458 9.942 483 HB2 PHE 70 HB1 PHE 70 -4.227 6.103 7.691 484 HB3 PHE 70 HB2 PHE 70 -5.347 7.447 7.916 485 HD1 PHE 70 HD2 PHE 70 -1.739 6.547 7.708 486 HD2 PHE 70 HD1 PHE 70 -4.650 9.704 7.612 487 HE1 PHE 70 HE2 PHE 70 0.008 8.135 6.947 488 HE2 PHE 70 HE1 PHE 70 -2.904 11.292 6.851 489 HZ PHE 70 HZ PHE 70 -0.575 10.507 6.519 490 H ALA 71 HN ALA 71 -6.404 8.154 10.305 491 HA ALA 71 HA ALA 71 -5.229 10.756 10.747 492 HB1 ALA 71 HB1 ALA 71 -7.560 10.601 10.102 493 HB2 ALA 71 HB2 ALA 71 -7.487 11.297 11.720 494 HB3 ALA 71 HB3 ALA 71 -7.928 9.603 11.508 495 H SER 72 HN SER 72 -6.100 8.053 12.860 496 HA SER 72 HA SER 72 -5.713 9.484 15.333 497 HB2 SER 72 HB2 SER 72 -5.435 6.508 14.822 498 HB3 SER 72 HB1 SER 72 -5.709 7.283 16.382 499 HG SER 72 HG SER 72 -7.442 7.319 14.139 500 H SER 73 HN SER 73 -3.564 7.635 13.215 501 HA SER 73 HA SER 73 -1.332 7.608 15.043 502 HB2 SER 73 HB2 SER 73 -1.363 7.402 12.019 503 HB3 SER 73 HB1 SER 73 -0.003 6.987 13.060 504 HG SER 73 HG SER 73 -1.088 5.285 13.843 505 H VAL 74 HN VAL 74 -2.111 9.661 12.234 506 HA VAL 74 HA VAL 74 0.156 11.361 12.422 507 HB VAL 74 HB VAL 74 -1.120 12.948 11.090 508 HG11 VAL 74 HG21 VAL 74 -0.578 11.354 9.550 509 HG12 VAL 74 HG22 VAL 74 -2.310 11.025 9.568 510 HG13 VAL 74 HG23 VAL 74 -1.215 10.041 10.540 511 HG21 VAL 74 HG11 VAL 74 -3.192 12.801 12.505 512 HG22 VAL 74 HG12 VAL 74 -3.552 11.255 11.735 513 HG23 VAL 74 HG13 VAL 74 -3.519 12.732 10.773 514 H ALA 75 HN ALA 75 -2.938 11.422 14.132 515 HA ALA 75 HA ALA 75 -2.575 14.009 15.338 516 HB1 ALA 75 HB1 ALA 75 -4.328 11.638 15.824 517 HB2 ALA 75 HB2 ALA 75 -4.771 13.322 15.546 518 HB3 ALA 75 HB3 ALA 75 -4.166 12.818 17.124 519 H GLN 76 HN GLN 76 -1.809 10.703 16.431 520 HA GLN 76 HA GLN 76 -0.804 11.483 19.004 521 HB2 GLN 76 HB2 GLN 76 -0.169 9.074 17.275 522 HB3 GLN 76 HB1 GLN 76 0.332 9.251 18.957 523 HG2 GLN 76 HG2 GLN 76 -2.016 9.424 19.657 524 HG3 GLN 76 HG1 GLN 76 -2.540 9.307 17.977 525 HE21 GLN 76 HE21 GLN 76 -3.374 7.372 19.923 526 HE22 GLN 76 HE22 GLN 76 -2.667 5.882 19.523 527 H ILE 77 HN ILE 77 0.830 10.895 15.886 528 HA ILE 77 HA ILE 77 3.487 11.312 16.725 529 HB ILE 77 HB ILE 77 2.209 12.124 14.098 530 HG12 ILE 77 HG12 ILE 77 3.716 9.595 14.828 531 HG13 ILE 77 HG11 ILE 77 1.957 9.710 14.779 532 HG21 ILE 77 HG21 ILE 77 4.263 13.131 13.899 533 HG22 ILE 77 HG22 ILE 77 4.756 11.489 13.485 534 HG23 ILE 77 HG23 ILE 77 5.004 12.098 15.122 535 HD11 ILE 77 HD11 ILE 77 2.021 9.331 12.561 536 HD12 ILE 77 HD12 ILE 77 3.785 9.305 12.596 537 HD13 ILE 77 HD13 ILE 77 2.929 10.829 12.353 538 H ALA 78 HN ALA 78 1.189 13.726 15.461 539 HA ALA 78 HA ALA 78 2.988 15.934 16.088 540 HB1 ALA 78 HB1 ALA 78 1.358 17.323 15.126 541 HB2 ALA 78 HB2 ALA 78 0.041 16.236 15.567 542 HB3 ALA 78 HB3 ALA 78 1.137 15.804 14.256 543 H ALA 79 HN ALA 79 -0.117 14.765 17.434 544 HA ALA 79 HA ALA 79 -0.314 16.668 19.529 545 HB1 ALA 79 HB1 ALA 79 -1.857 15.127 20.579 546 HB2 ALA 79 HB2 ALA 79 -1.192 13.770 19.670 547 HB3 ALA 79 HB3 ALA 79 -2.102 15.030 18.835 548 H SER 80 HN SER 80 1.745 13.893 19.161 549 HA SER 80 HA SER 80 2.419 13.714 22.005 550 HB2 SER 80 HB2 SER 80 4.100 12.079 21.269 551 HB3 SER 80 HB1 SER 80 2.545 11.733 20.513 552 HG SER 80 HG SER 80 4.084 11.673 18.924 553 H GLN 81 HN GLN 81 3.456 15.567 19.282 554 HA GLN 81 HA GLN 81 6.146 16.119 19.874 555 HB2 GLN 81 HB2 GLN 81 3.997 17.986 18.831 556 HB3 GLN 81 HB1 GLN 81 5.722 18.351 18.812 557 HG2 GLN 81 HG2 GLN 81 6.073 16.227 17.500 558 HG3 GLN 81 HG1 GLN 81 4.321 16.069 17.391 559 HE21 GLN 81 HE21 GLN 81 6.979 18.374 16.613 560 HE22 GLN 81 HE22 GLN 81 6.186 19.074 15.286 561 H GLY 82 HN GLY 82 3.231 17.254 21.475 562 HA2 GLY 82 HA2 GLY 82 3.064 18.188 23.646 563 HA3 GLY 82 HA1 GLY 82 4.824 18.172 23.750 564 H GLY 83 HN GLY 83 3.465 19.581 20.912 565 HA2 GLY 83 HA1 GLY 83 4.255 22.273 21.925 566 HA3 GLY 83 HA2 GLY 83 4.199 21.812 20.223 567 H ASP 84 HN ASP 84 2.831 23.836 20.089 568 HA ASP 84 HA ASP 84 0.282 24.050 21.340 569 HB2 ASP 84 HB2 ASP 84 1.282 25.097 18.677 570 HB3 ASP 84 HB1 ASP 84 -0.277 25.536 19.374 571 H LEU 85 HN LEU 85 -1.676 23.110 20.880 572 HA LEU 85 HA LEU 85 -1.687 20.873 18.976 573 HB2 LEU 85 HB2 LEU 85 -2.766 20.777 21.258 574 HB3 LEU 85 HB1 LEU 85 -3.969 21.924 20.671 575 HG LEU 85 HG LEU 85 -4.159 20.153 18.685 576 HD11 LEU 85 HD11 LEU 85 -2.731 18.759 20.890 577 HD12 LEU 85 HD12 LEU 85 -2.712 18.437 19.155 578 HD13 LEU 85 HD13 LEU 85 -4.063 17.877 20.141 579 HD21 LEU 85 HD21 LEU 85 -5.806 20.920 20.605 580 HD22 LEU 85 HD22 LEU 85 -5.431 19.334 21.277 581 HD23 LEU 85 HD23 LEU 85 -6.153 19.464 19.673 582 H GLY 86 HN GLY 86 -2.641 24.186 19.002 583 HA2 GLY 86 HA2 GLY 86 -4.753 23.998 17.035 584 HA3 GLY 86 HA1 GLY 86 -3.891 25.471 17.478 585 H VAL 87 HN VAL 87 -1.241 24.411 16.859 586 HA VAL 87 HA VAL 87 -1.179 25.036 14.042 587 HB VAL 87 HB VAL 87 0.691 25.386 15.766 588 HG11 VAL 87 HG11 VAL 87 0.640 23.059 16.649 589 HG12 VAL 87 HG12 VAL 87 2.243 23.512 16.067 590 HG13 VAL 87 HG13 VAL 87 1.209 22.475 15.084 591 HG21 VAL 87 HG21 VAL 87 1.345 25.907 13.600 592 HG22 VAL 87 HG22 VAL 87 0.986 24.290 12.993 593 HG23 VAL 87 HG23 VAL 87 2.442 24.570 13.949 594 H THR 88 HN THR 88 -0.735 21.979 15.853 595 HA THR 88 HA THR 88 -0.189 20.289 13.675 596 HB THR 88 HB THR 88 -1.932 19.684 16.084 597 HG1 THR 88 HG1 THR 88 -0.108 19.317 17.101 598 HG21 THR 88 HG21 THR 88 -2.157 18.085 14.171 599 HG22 THR 88 HG22 THR 88 -1.448 17.351 15.609 600 HG23 THR 88 HG23 THR 88 -0.417 17.807 14.251 601 H THR 89 HN THR 89 -3.257 21.645 14.770 602 HA THR 89 HA THR 89 -5.014 20.129 13.140 603 HB THR 89 HB THR 89 -5.251 23.088 13.778 604 HG1 THR 89 HG1 THR 89 -4.952 21.301 15.499 605 HG21 THR 89 HG21 THR 89 -7.124 20.952 12.807 606 HG22 THR 89 HG22 THR 89 -6.958 22.621 12.260 607 HG23 THR 89 HG23 THR 89 -7.750 22.271 13.797 608 H ASN 90 HN ASN 90 -3.221 23.127 12.439 609 HA ASN 90 HA ASN 90 -4.099 23.257 9.684 610 HB2 ASN 90 HB2 ASN 90 -1.699 24.509 11.056 611 HB3 ASN 90 HB1 ASN 90 -2.269 24.922 9.438 612 HD21 ASN 90 HD21 ASN 90 -2.187 26.844 11.602 613 HD22 ASN 90 HD22 ASN 90 -3.788 27.301 11.934 614 H ALA 91 HN ALA 91 -1.249 21.959 11.353 615 HA ALA 91 HA ALA 91 0.213 21.217 9.004 616 HB1 ALA 91 HB1 ALA 91 0.700 21.145 11.709 617 HB2 ALA 91 HB2 ALA 91 1.728 20.401 10.485 618 HB3 ALA 91 HB3 ALA 91 0.516 19.433 11.325 619 H ILE 92 HN ILE 92 -1.704 19.141 11.205 620 HA ILE 92 HA ILE 92 -1.682 16.868 9.473 621 HB ILE 92 HB ILE 92 -3.761 17.634 11.545 622 HG12 ILE 92 HG12 ILE 92 -1.348 17.594 12.330 623 HG13 ILE 92 HG11 ILE 92 -2.410 16.443 13.142 624 HG21 ILE 92 HG21 ILE 92 -4.743 15.676 11.034 625 HG22 ILE 92 HG22 ILE 92 -3.226 14.823 11.321 626 HG23 ILE 92 HG23 ILE 92 -3.593 15.459 9.717 627 HD11 ILE 92 HD11 ILE 92 -0.312 15.340 12.514 628 HD12 ILE 92 HD12 ILE 92 -0.540 15.826 10.833 629 HD13 ILE 92 HD13 ILE 92 -1.646 14.670 11.577 630 H ALA 93 HN ALA 93 -4.184 19.370 9.991 631 HA ALA 93 HA ALA 93 -6.030 18.372 8.068 632 HB1 ALA 93 HB1 ALA 93 -5.556 21.264 8.851 633 HB2 ALA 93 HB2 ALA 93 -6.567 20.129 9.746 634 HB3 ALA 93 HB3 ALA 93 -7.017 20.611 8.110 635 H ASP 94 HN ASP 94 -3.508 20.892 7.687 636 HA ASP 94 HA ASP 94 -3.965 21.455 4.960 637 HB2 ASP 94 HB1 ASP 94 -1.429 21.472 6.606 638 HB3 ASP 94 HB2 ASP 94 -1.465 22.006 4.926 639 H ALA 95 HN ALA 95 -1.906 18.928 6.414 640 HA ALA 95 HA ALA 95 -0.875 17.897 3.965 641 HB1 ALA 95 HB1 ALA 95 -1.339 15.791 5.895 642 HB2 ALA 95 HB2 ALA 95 -0.717 17.230 6.702 643 HB3 ALA 95 HB3 ALA 95 0.190 16.500 5.377 644 H LEU 96 HN LEU 96 -3.798 17.036 5.813 645 HA LEU 96 HA LEU 96 -4.624 14.961 3.980 646 HB2 LEU 96 HB2 LEU 96 -6.439 16.583 5.781 647 HB3 LEU 96 HB1 LEU 96 -6.684 14.934 5.203 648 HG LEU 96 HG LEU 96 -4.184 15.471 6.731 649 HD11 LEU 96 HD21 LEU 96 -6.962 15.635 7.862 650 HD12 LEU 96 HD22 LEU 96 -5.539 16.592 8.269 651 HD13 LEU 96 HD23 LEU 96 -5.672 14.928 8.832 652 HD21 LEU 96 HD11 LEU 96 -4.535 13.209 7.464 653 HD22 LEU 96 HD12 LEU 96 -4.902 13.246 5.740 654 HD23 LEU 96 HD13 LEU 96 -6.212 13.233 6.920 655 H THR 97 HN THR 97 -5.335 18.422 4.274 656 HA THR 97 HA THR 97 -7.392 18.555 2.317 657 HB THR 97 HB THR 97 -5.326 20.617 3.127 658 HG1 THR 97 HG1 THR 97 -7.003 21.354 4.417 659 HG21 THR 97 HG21 THR 97 -6.060 21.610 1.201 660 HG22 THR 97 HG22 THR 97 -7.424 22.056 2.226 661 HG23 THR 97 HG23 THR 97 -7.546 20.661 1.156 662 H SER 98 HN SER 98 -3.881 19.142 1.934 663 HA SER 98 HA SER 98 -3.957 19.559 -0.879 664 HB2 SER 98 HB2 SER 98 -2.000 20.010 0.663 665 HB3 SER 98 HB1 SER 98 -1.685 18.274 0.657 666 HG SER 98 HG SER 98 -0.913 20.049 -1.113 667 H ALA 99 HN ALA 99 -3.352 16.560 0.972 668 HA ALA 99 HA ALA 99 -2.976 14.854 -1.264 669 HB1 ALA 99 HB1 ALA 99 -4.281 14.105 1.366 670 HB2 ALA 99 HB2 ALA 99 -2.538 14.245 1.130 671 HB3 ALA 99 HB3 ALA 99 -3.452 13.022 0.249 672 H PHE 100 HN PHE 100 -5.982 15.793 0.418 673 HA PHE 100 HA PHE 100 -7.827 14.104 -0.801 674 HB2 PHE 100 HB1 PHE 100 -7.898 16.821 0.307 675 HB3 PHE 100 HB2 PHE 100 -9.109 16.558 -0.947 676 HD1 PHE 100 HD2 PHE 100 -10.351 14.192 -0.779 677 HD2 PHE 100 HD1 PHE 100 -8.451 16.238 2.486 678 HE1 PHE 100 HE2 PHE 100 -11.746 12.920 0.829 679 HE2 PHE 100 HE1 PHE 100 -9.844 14.969 4.091 680 HZ PHE 100 HZ PHE 100 -11.490 13.307 3.265 681 H TYR 101 HN TYR 101 -6.707 17.230 -2.105 682 HA TYR 101 HA TYR 101 -7.989 16.832 -4.665 683 HB2 TYR 101 HB2 TYR 101 -5.666 18.687 -4.200 684 HB3 TYR 101 HB1 TYR 101 -7.069 18.914 -5.247 685 HD1 TYR 101 HD1 TYR 101 -9.334 18.248 -3.579 686 HD2 TYR 101 HD2 TYR 101 -5.732 20.336 -2.521 687 HE1 TYR 101 HE1 TYR 101 -10.535 19.371 -1.721 688 HE2 TYR 101 HE2 TYR 101 -6.933 21.465 -0.667 689 HH TYR 101 HH TYR 101 -10.343 21.383 -0.364 690 H GLN 102 HN GLN 102 -4.796 16.131 -3.370 691 HA GLN 102 HA GLN 102 -3.642 15.524 -5.980 692 HB2 GLN 102 HB2 GLN 102 -2.714 14.914 -3.160 693 HB3 GLN 102 HB1 GLN 102 -1.767 14.578 -4.608 694 HG2 GLN 102 HG1 GLN 102 -2.202 17.105 -5.156 695 HG3 GLN 102 HG2 GLN 102 -2.545 17.232 -3.430 696 HE21 GLN 102 HE21 GLN 102 -0.363 18.654 -4.089 697 HE22 GLN 102 HE22 GLN 102 1.058 17.857 -3.615 698 H THR 103 HN THR 103 -5.592 13.802 -3.694 699 HA THR 103 HA THR 103 -4.784 11.213 -4.929 700 HB THR 103 HB THR 103 -5.828 10.144 -3.011 701 HG1 THR 103 HG1 THR 103 -6.687 11.575 -1.371 702 HG21 THR 103 HG21 THR 103 -3.766 10.552 -2.172 703 HG22 THR 103 HG22 THR 103 -4.551 11.820 -1.231 704 HG23 THR 103 HG23 THR 103 -3.765 12.215 -2.759 705 H THR 104 HN THR 104 -7.868 12.741 -3.824 706 HA THR 104 HA THR 104 -9.129 11.417 -6.199 707 HB THR 104 HB THR 104 -10.303 11.798 -3.431 708 HG1 THR 104 HG1 THR 104 -8.835 10.081 -3.608 709 HG21 THR 104 HG21 THR 104 -11.479 11.150 -6.074 710 HG22 THR 104 HG22 THR 104 -12.227 11.888 -4.656 711 HG23 THR 104 HG23 THR 104 -12.003 10.140 -4.726 712 H GLY 105 HN GLY 105 -9.383 14.146 -3.908 713 HA2 GLY 105 HA2 GLY 105 -9.741 16.413 -4.786 714 HA3 GLY 105 HA1 GLY 105 -10.633 15.701 -6.128 715 H VAL 106 HN VAL 106 -10.859 15.199 -2.598 716 HA VAL 106 HA VAL 106 -13.768 15.833 -2.828 717 HB VAL 106 HB VAL 106 -12.463 14.271 -0.593 718 HG11 VAL 106 HG21 VAL 106 -14.921 13.305 -0.740 719 HG12 VAL 106 HG22 VAL 106 -15.246 14.831 -1.564 720 HG13 VAL 106 HG23 VAL 106 -14.616 14.835 0.084 721 HG21 VAL 106 HG11 VAL 106 -12.083 13.294 -2.951 722 HG22 VAL 106 HG12 VAL 106 -13.829 13.038 -2.992 723 HG23 VAL 106 HG13 VAL 106 -12.849 12.239 -1.762 724 H VAL 107 HN VAL 107 -14.628 16.673 -0.612 725 HA VAL 107 HA VAL 107 -13.165 19.096 0.016 726 HB VAL 107 HB VAL 107 -14.980 19.425 1.695 727 HG11 VAL 107 HG21 VAL 107 -15.751 20.299 -0.282 728 HG12 VAL 107 HG22 VAL 107 -16.878 18.948 -0.174 729 HG13 VAL 107 HG23 VAL 107 -15.436 18.814 -1.179 730 HG21 VAL 107 HG11 VAL 107 -15.874 17.536 2.559 731 HG22 VAL 107 HG12 VAL 107 -15.214 16.552 1.251 732 HG23 VAL 107 HG13 VAL 107 -16.764 17.371 1.045 733 H ASN 108 HN ASN 108 -11.493 19.200 1.421 734 HA ASN 108 HA ASN 108 -10.765 16.976 3.114 735 HB2 ASN 108 HB2 ASN 108 -8.898 18.304 3.761 736 HB3 ASN 108 HB1 ASN 108 -9.208 18.716 2.075 737 HD21 ASN 108 HD21 ASN 108 -9.396 20.919 1.650 738 HD22 ASN 108 HD22 ASN 108 -9.813 22.102 2.792 739 H SER 109 HN SER 109 -12.582 19.924 3.587 740 HA SER 109 HA SER 109 -12.465 20.142 6.402 741 HB2 SER 109 HB2 SER 109 -13.494 21.809 4.834 742 HB3 SER 109 HB1 SER 109 -14.877 20.727 4.668 743 HG SER 109 HG SER 109 -14.079 22.298 6.810 744 H ARG 110 HN ARG 110 -14.359 17.939 4.391 745 HA ARG 110 HA ARG 110 -16.151 17.130 6.510 746 HB2 ARG 110 HB2 ARG 110 -16.627 16.771 4.092 747 HB3 ARG 110 HB1 ARG 110 -15.322 15.587 4.035 748 HG2 ARG 110 HG2 ARG 110 -16.491 14.277 5.811 749 HG3 ARG 110 HG1 ARG 110 -17.825 15.429 5.742 750 HD2 ARG 110 HD1 ARG 110 -16.830 13.750 3.417 751 HD3 ARG 110 HD2 ARG 110 -18.289 13.432 4.355 752 HE ARG 110 HE ARG 110 -18.514 16.076 3.405 753 HH11 ARG 110 HH21 ARG 110 -19.521 12.983 2.732 754 HH12 ARG 110 HH22 ARG 110 -19.848 13.248 1.051 755 HH21 ARG 110 HH11 ARG 110 -18.377 16.387 0.986 756 HH22 ARG 110 HH12 ARG 110 -19.201 15.175 0.064 757 H PHE 111 HN PHE 111 -13.298 15.488 5.081 758 HA PHE 111 HA PHE 111 -13.258 13.496 7.202 759 HB2 PHE 111 HB2 PHE 111 -12.384 13.097 4.883 760 HB3 PHE 111 HB1 PHE 111 -11.059 14.202 5.242 761 HD1 PHE 111 HD2 PHE 111 -12.778 11.229 6.765 762 HD2 PHE 111 HD1 PHE 111 -9.077 13.290 6.058 763 HE1 PHE 111 HE2 PHE 111 -11.540 9.384 7.865 764 HE2 PHE 111 HE1 PHE 111 -7.839 11.445 7.158 765 HZ PHE 111 HZ PHE 111 -9.071 9.491 8.063 766 H ILE 112 HN ILE 112 -11.202 16.307 6.391 767 HA ILE 112 HA ILE 112 -9.397 16.094 8.552 768 HB ILE 112 HB ILE 112 -10.470 18.549 7.136 769 HG12 ILE 112 HG11 ILE 112 -8.015 16.809 6.807 770 HG13 ILE 112 HG12 ILE 112 -9.286 17.111 5.623 771 HG21 ILE 112 HG21 ILE 112 -9.217 19.861 8.482 772 HG22 ILE 112 HG22 ILE 112 -7.831 18.779 8.346 773 HG23 ILE 112 HG23 ILE 112 -9.072 18.471 9.560 774 HD11 ILE 112 HD11 ILE 112 -7.488 18.523 4.963 775 HD12 ILE 112 HD12 ILE 112 -7.172 19.025 6.623 776 HD13 ILE 112 HD13 ILE 112 -8.622 19.590 5.792 777 H SER 113 HN SER 113 -12.630 17.558 8.436 778 HA SER 113 HA SER 113 -12.609 18.851 10.951 779 HB2 SER 113 HB2 SER 113 -14.785 17.548 9.323 780 HB3 SER 113 HB1 SER 113 -15.139 18.217 10.916 781 HG SER 113 HG SER 113 -14.279 20.201 10.189 782 H GLU 114 HN GLU 114 -13.235 15.445 10.146 783 HA GLU 114 HA GLU 114 -13.888 14.692 12.867 784 HB2 GLU 114 HB2 GLU 114 -12.945 13.002 10.529 785 HB3 GLU 114 HB1 GLU 114 -13.629 12.374 12.029 786 HG2 GLU 114 HG2 GLU 114 -15.721 13.619 11.590 787 HG3 GLU 114 HG1 GLU 114 -15.037 14.229 10.083 788 H ILE 115 HN ILE 115 -10.923 14.662 10.916 789 HA ILE 115 HA ILE 115 -9.320 13.324 12.920 790 HB ILE 115 HB ILE 115 -8.432 15.173 10.684 791 HG12 ILE 115 HG12 ILE 115 -8.822 12.164 10.738 792 HG13 ILE 115 HG11 ILE 115 -9.794 13.319 9.825 793 HG21 ILE 115 HG21 ILE 115 -6.448 14.888 11.758 794 HG22 ILE 115 HG22 ILE 115 -6.488 13.273 11.051 795 HG23 ILE 115 HG23 ILE 115 -7.050 13.526 12.704 796 HD11 ILE 115 HD11 ILE 115 -8.251 13.452 8.175 797 HD12 ILE 115 HD12 ILE 115 -7.506 12.030 8.903 798 HD13 ILE 115 HD13 ILE 115 -6.931 13.640 9.329 799 H ARG 116 HN ARG 116 -9.831 16.734 12.039 800 HA ARG 116 HA ARG 116 -7.988 17.927 13.803 801 HB2 ARG 116 HB2 ARG 116 -9.069 19.379 12.282 802 HB3 ARG 116 HB1 ARG 116 -10.673 18.807 12.739 803 HG2 ARG 116 HG2 ARG 116 -10.577 19.939 14.843 804 HG3 ARG 116 HG1 ARG 116 -8.852 20.264 14.670 805 HD2 ARG 116 HD2 ARG 116 -9.787 22.316 14.050 806 HD3 ARG 116 HD1 ARG 116 -9.596 21.524 12.486 807 HE ARG 116 HE ARG 116 -11.955 21.373 12.327 808 HH11 ARG 116 HH21 ARG 116 -12.444 20.136 15.012 809 HH12 ARG 116 HH22 ARG 116 -13.357 21.367 15.819 810 HH21 ARG 116 HH11 ARG 116 -12.476 23.860 13.576 811 HH22 ARG 116 HH12 ARG 116 -13.375 23.475 15.006 812 H SER 117 HN SER 117 -11.260 16.709 14.432 813 HA SER 117 HA SER 117 -11.351 17.673 17.161 814 HB2 SER 117 HB2 SER 117 -12.910 15.402 15.893 815 HB3 SER 117 HB1 SER 117 -13.331 16.261 17.375 816 HG SER 117 HG SER 117 -13.955 16.898 14.892 817 H LEU 118 HN LEU 118 -10.266 14.682 15.620 818 HA LEU 118 HA LEU 118 -10.001 13.165 18.056 819 HB2 LEU 118 HB2 LEU 118 -8.566 12.875 15.399 820 HB3 LEU 118 HB1 LEU 118 -8.553 11.677 16.692 821 HG LEU 118 HG LEU 118 -11.115 12.710 15.457 822 HD11 LEU 118 HD11 LEU 118 -9.198 10.624 14.527 823 HD12 LEU 118 HD12 LEU 118 -10.290 11.643 13.590 824 HD13 LEU 118 HD13 LEU 118 -10.915 10.232 14.442 825 HD21 LEU 118 HD21 LEU 118 -11.037 11.561 17.754 826 HD22 LEU 118 HD22 LEU 118 -10.575 10.100 16.881 827 HD23 LEU 118 HD23 LEU 118 -12.132 10.862 16.561 828 H ILE 119 HN ILE 119 -7.770 15.267 16.248 829 HA ILE 119 HA ILE 119 -5.407 14.676 17.699 830 HB ILE 119 HB ILE 119 -6.224 17.391 16.618 831 HG12 ILE 119 HG12 ILE 119 -4.723 15.162 15.216 832 HG13 ILE 119 HG11 ILE 119 -6.435 15.499 14.965 833 HG21 ILE 119 HG21 ILE 119 -3.646 16.123 17.503 834 HG22 ILE 119 HG22 ILE 119 -4.259 17.744 17.834 835 HG23 ILE 119 HG23 ILE 119 -3.621 17.351 16.237 836 HD11 ILE 119 HD11 ILE 119 -5.984 17.261 13.623 837 HD12 ILE 119 HD12 ILE 119 -4.321 16.678 13.587 838 HD13 ILE 119 HD13 ILE 119 -4.798 17.908 14.756 839 H GLY 120 HN GLY 120 -8.109 16.825 18.481 840 HA2 GLY 120 HA2 GLY 120 -6.839 18.028 20.780 841 HA3 GLY 120 HA1 GLY 120 -8.568 18.046 20.438 842 H MET 121 HN MET 121 -8.814 15.140 20.285 843 HA MET 121 HA MET 121 -9.308 14.577 23.052 844 HB2 MET 121 HB2 MET 121 -10.504 13.479 21.154 845 HB3 MET 121 HB1 MET 121 -9.023 12.605 20.765 846 HG2 MET 121 HG2 MET 121 -9.038 11.670 23.098 847 HG3 MET 121 HG1 MET 121 -10.612 12.429 23.341 848 HE1 MET 121 HE1 MET 121 -13.064 10.863 21.255 849 HE2 MET 121 HE2 MET 121 -12.030 11.743 20.134 850 HE3 MET 121 HE3 MET 121 -12.328 12.396 21.743 851 H PHE 122 HN PHE 122 -6.638 13.725 20.872 852 HA PHE 122 HA PHE 122 -5.300 11.948 22.678 853 HB2 PHE 122 HB2 PHE 122 -4.255 13.675 20.419 854 HB3 PHE 122 HB1 PHE 122 -3.271 12.490 21.278 855 HD1 PHE 122 HD2 PHE 122 -4.189 10.064 21.406 856 HD2 PHE 122 HD1 PHE 122 -5.591 13.004 18.606 857 HE1 PHE 122 HE2 PHE 122 -5.106 8.261 19.972 858 HE2 PHE 122 HE1 PHE 122 -6.509 11.200 17.173 859 HZ PHE 122 HZ PHE 122 -6.267 8.829 17.856 860 H ALA 123 HN ALA 123 -5.040 15.462 22.159 861 HA ALA 123 HA ALA 123 -2.876 15.886 23.982 862 HB1 ALA 123 HB1 ALA 123 -3.232 17.778 22.713 863 HB2 ALA 123 HB2 ALA 123 -4.154 18.235 24.146 864 HB3 ALA 123 HB3 ALA 123 -4.984 17.587 22.732 865 H GLN 124 HN GLN 124 -6.333 15.494 24.446 866 HA GLN 124 HA GLN 124 -6.394 16.465 27.169 867 HB2 GLN 124 HB2 GLN 124 -8.241 14.587 25.665 868 HB3 GLN 124 HB1 GLN 124 -8.578 15.237 27.270 869 HG2 GLN 124 HG2 GLN 124 -8.145 16.856 24.740 870 HG3 GLN 124 HG1 GLN 124 -9.685 16.609 25.565 871 HE21 GLN 124 HE21 GLN 124 -7.493 18.974 25.170 872 HE22 GLN 124 HE22 GLN 124 -7.573 19.728 26.689 873 H ALA 125 HN ALA 125 -5.685 13.363 25.668 874 HA ALA 125 HA ALA 125 -5.907 11.705 27.972 875 HB1 ALA 125 HB1 ALA 125 -4.325 10.200 26.784 876 HB2 ALA 125 HB2 ALA 125 -3.998 11.487 25.623 877 HB3 ALA 125 HB3 ALA 125 -5.608 10.776 25.720 878 H SER 126 HN SER 126 -3.261 13.762 26.812 879 HA SER 126 HA SER 126 -1.275 12.889 28.665 880 HB2 SER 126 HB1 SER 126 -0.118 14.946 28.144 881 HB3 SER 126 HB2 SER 126 -0.891 14.380 26.662 882 HG SER 126 HG SER 126 -1.636 16.485 28.371 883 H ALA 127 HN ALA 127 -4.045 14.990 29.025 884 HA ALA 127 HA ALA 127 -3.193 16.284 31.459 885 HB1 ALA 127 HB1 ALA 127 -5.853 15.855 30.112 886 HB2 ALA 127 HB2 ALA 127 -4.978 17.363 30.374 887 HB3 ALA 127 HB3 ALA 127 -5.773 16.558 31.728 888 H ASN 128 HN ASN 128 -4.600 13.171 30.732 889 HA ASN 128 HA ASN 128 -5.708 12.517 33.259 890 HB2 ASN 128 HB2 ASN 128 -4.290 10.721 31.266 891 HB3 ASN 128 HB1 ASN 128 -5.287 10.152 32.605 892 HD21 ASN 128 HD21 ASN 128 -5.971 9.596 29.864 893 HD22 ASN 128 HD22 ASN 128 -7.412 10.418 29.506 894 H ASP 129 HN ASP 129 -2.434 13.016 32.333 895 HA ASP 129 HA ASP 129 -1.172 11.339 34.313 896 HB2 ASP 129 HB2 ASP 129 -0.240 13.796 32.809 897 HB3 ASP 129 HB1 ASP 129 0.795 12.912 33.930 898 H VAL 130 HN VAL 130 -1.940 14.834 34.252 899 HA VAL 130 HA VAL 130 -1.019 15.386 36.896 900 HB VAL 130 HB VAL 130 -1.506 17.190 35.323 901 HG11 VAL 130 HG11 VAL 130 -4.137 17.617 35.118 902 HG12 VAL 130 HG12 VAL 130 -4.186 15.865 35.307 903 HG13 VAL 130 HG13 VAL 130 -3.281 16.583 33.974 904 HG21 VAL 130 HG21 VAL 130 -1.674 18.045 37.485 905 HG22 VAL 130 HG22 VAL 130 -3.068 17.040 37.884 906 HG23 VAL 130 HG23 VAL 130 -3.265 18.444 36.835 907 H TYR 131 HN TYR 131 -4.022 14.038 35.677 908 HA TYR 131 HA TYR 131 -4.743 12.838 38.142 909 HB2 TYR 131 HB2 TYR 131 -6.536 14.261 38.934 910 HB3 TYR 131 HB1 TYR 131 -5.080 15.247 38.803 911 HD1 TYR 131 HD2 TYR 131 -4.817 16.878 36.977 912 HD2 TYR 131 HD1 TYR 131 -8.408 14.563 37.415 913 HE1 TYR 131 HE2 TYR 131 -5.991 18.402 35.413 914 HE2 TYR 131 HE1 TYR 131 -9.583 16.089 35.851 915 HH TYR 131 HH TYR 131 -8.493 17.797 33.786 916 H ALA 132 HN ALA 132 -7.283 12.313 38.035 917 HA ALA 132 HA ALA 132 -7.685 11.048 35.456 918 HB1 ALA 132 HB1 ALA 132 -9.893 10.372 36.447 919 HB2 ALA 132 HB2 ALA 132 -9.505 11.348 37.863 920 HB3 ALA 132 HB3 ALA 132 -8.511 9.948 37.457 921 H SER 133 HN SER 133 -8.514 12.039 33.694 922 HA SER 133 HA SER 133 -9.986 14.590 34.041 923 HB2 SER 133 HB2 SER 133 -9.058 13.224 31.496 924 HB3 SER 133 HB1 SER 133 -9.664 14.874 31.638 925 HG SER 133 HG SER 133 -7.184 13.956 32.026 926 H ALA 134 HN ALA 134 -12.039 14.910 32.898 927 HA ALA 134 HA ALA 134 -13.851 12.694 33.246 928 HB1 ALA 134 HB1 ALA 134 -14.069 15.480 32.851 929 HB2 ALA 134 HB2 ALA 134 -15.385 14.342 33.142 930 HB3 ALA 134 HB3 ALA 134 -14.908 14.738 31.490 931 H GLY 135 HN GLY 135 -12.321 14.185 30.407 932 HA2 GLY 135 HA2 GLY 135 -11.837 13.132 28.337 933 HA3 GLY 135 HA1 GLY 135 -12.679 11.691 28.910 934 H SER 136 HN SER 136 -13.760 11.631 26.799 935 HA SER 136 HA SER 136 -15.934 13.676 26.571 936 HB2 SER 136 HB2 SER 136 -14.661 12.031 24.360 937 HB3 SER 136 HB1 SER 136 -15.933 13.236 24.153 938 HG SER 136 HG SER 136 -14.347 14.683 25.260 939 H GLY 137 HN GLY 137 -18.040 12.884 26.101 940 HA2 GLY 137 HA2 GLY 137 -18.433 9.967 25.879 941 HA3 GLY 137 HA1 GLY 137 -19.090 10.725 27.329 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 -20.940 12.456 -15.717 2 H2 GLY 1 HT2 GLY 1 -20.654 11.779 -17.249 3 H3 GLY 1 HT3 GLY 1 -19.378 12.486 -16.377 4 HA2 GLY 1 HA2 GLY 1 -20.889 10.110 -15.444 5 HA3 GLY 1 HA1 GLY 1 -19.373 10.015 -16.341 6 H MET 2 HN MET 2 -19.002 8.888 -14.051 7 HA MET 2 HA MET 2 -17.850 10.984 -12.251 8 HB2 MET 2 HB2 MET 2 -19.101 8.321 -11.514 9 HB3 MET 2 HB1 MET 2 -18.249 9.368 -10.380 10 HG2 MET 2 HG2 MET 2 -19.854 11.201 -10.930 11 HG3 MET 2 HG1 MET 2 -20.741 10.076 -11.959 12 HE1 MET 2 HE1 MET 2 -22.115 11.665 -9.826 13 HE2 MET 2 HE2 MET 2 -23.086 10.506 -8.920 14 HE3 MET 2 HE3 MET 2 -22.998 10.389 -10.675 15 H GLY 3 HN GLY 3 -15.925 10.199 -11.018 16 HA2 GLY 3 HA1 GLY 3 -14.235 8.524 -12.779 17 HA3 GLY 3 HA2 GLY 3 -13.659 9.526 -11.448 18 H GLN 4 HN GLN 4 -12.501 7.279 -11.167 19 HA GLN 4 HA GLN 4 -14.228 5.352 -9.706 20 HB2 GLN 4 HB1 GLN 4 -11.294 5.103 -10.429 21 HB3 GLN 4 HB2 GLN 4 -12.363 3.815 -9.873 22 HG2 GLN 4 HG2 GLN 4 -12.638 5.373 -12.462 23 HG3 GLN 4 HG1 GLN 4 -12.112 3.696 -12.310 24 HE21 GLN 4 HE21 GLN 4 -14.735 5.308 -13.305 25 HE22 GLN 4 HE22 GLN 4 -15.976 4.297 -12.739 26 H ALA 5 HN ALA 5 -13.588 4.625 -7.567 27 HA ALA 5 HA ALA 5 -13.126 5.207 -5.330 28 HB1 ALA 5 HB1 ALA 5 -10.508 5.742 -6.759 29 HB2 ALA 5 HB2 ALA 5 -10.987 4.266 -5.922 30 HB3 ALA 5 HB3 ALA 5 -10.667 5.736 -5.003 31 H ASN 6 HN ASN 6 -14.601 7.068 -5.342 32 HA ASN 6 HA ASN 6 -13.775 9.710 -6.074 33 HB2 ASN 6 HB2 ASN 6 -15.802 8.883 -3.971 34 HB3 ASN 6 HB1 ASN 6 -15.688 10.467 -4.738 35 HD21 ASN 6 HD21 ASN 6 -15.321 9.825 -7.424 36 HD22 ASN 6 HD22 ASN 6 -16.655 8.949 -8.001 37 H THR 7 HN THR 7 -12.883 7.705 -3.452 38 HA THR 7 HA THR 7 -11.517 10.026 -2.173 39 HB THR 7 HB THR 7 -13.548 9.470 -0.851 40 HG1 THR 7 HG1 THR 7 -11.092 8.689 0.329 41 HG21 THR 7 HG21 THR 7 -13.106 6.908 -1.601 42 HG22 THR 7 HG22 THR 7 -14.082 7.348 -0.200 43 HG23 THR 7 HG23 THR 7 -12.395 6.879 0.012 44 HA PRO 8 HA PRO 8 -7.934 7.433 -2.362 45 HB2 PRO 8 HB2 PRO 8 -6.572 8.268 -0.177 46 HB3 PRO 8 HB1 PRO 8 -6.701 9.215 -1.661 47 HG2 PRO 8 HG2 PRO 8 -8.295 9.440 0.871 48 HG3 PRO 8 HG1 PRO 8 -7.552 10.726 -0.088 49 HD2 PRO 8 HD2 PRO 8 -10.167 10.192 -0.299 50 HD3 PRO 8 HD1 PRO 8 -9.220 10.653 -1.712 51 H TRP 9 HN TRP 9 -9.717 7.489 0.726 52 HA TRP 9 HA TRP 9 -8.370 5.052 1.634 53 HB2 TRP 9 HB2 TRP 9 -9.970 5.129 3.520 54 HB3 TRP 9 HB1 TRP 9 -9.131 6.664 3.305 55 HD1 TRP 9 HD1 TRP 9 -12.529 4.999 2.760 56 HE1 TRP 9 HE1 TRP 9 -14.318 6.840 2.505 57 HE3 TRP 9 HE3 TRP 9 -9.529 9.128 2.652 58 HZ2 TRP 9 HZ2 TRP 9 -14.453 9.694 2.286 59 HZ3 TRP 9 HZ3 TRP 9 -10.511 11.391 2.422 60 HH2 TRP 9 HH2 TRP 9 -12.967 11.678 2.239 61 H SER 10 HN SER 10 -10.666 5.565 -0.692 62 HA SER 10 HA SER 10 -12.288 3.178 -0.042 63 HB2 SER 10 HB2 SER 10 -13.503 3.719 -2.130 64 HB3 SER 10 HB1 SER 10 -13.419 5.119 -1.061 65 HG SER 10 HG SER 10 -11.371 4.748 -2.914 66 H SER 11 HN SER 11 -9.417 3.980 -1.694 67 HA SER 11 HA SER 11 -9.302 1.230 -2.815 68 HB2 SER 11 HB2 SER 11 -8.637 3.764 -4.347 69 HB3 SER 11 HB1 SER 11 -8.285 2.130 -4.907 70 HG SER 11 HG SER 11 -10.217 2.263 -5.712 71 H LYS 12 HN LYS 12 -7.145 0.408 -2.911 72 HA LYS 12 HA LYS 12 -5.331 1.516 -0.956 73 HB2 LYS 12 HB1 LYS 12 -4.678 -0.514 -3.109 74 HB3 LYS 12 HB2 LYS 12 -3.832 -0.274 -1.581 75 HG2 LYS 12 HG2 LYS 12 -5.714 -1.069 -0.323 76 HG3 LYS 12 HG1 LYS 12 -6.748 -1.064 -1.753 77 HD2 LYS 12 HD2 LYS 12 -4.351 -2.848 -1.243 78 HD3 LYS 12 HD1 LYS 12 -6.035 -3.350 -1.353 79 HE2 LYS 12 HE1 LYS 12 -6.021 -2.390 -3.723 80 HE3 LYS 12 HE2 LYS 12 -4.268 -2.277 -3.565 81 HZ1 LYS 12 HZ1 LYS 12 -4.850 -4.351 -4.594 82 HZ2 LYS 12 HZ2 LYS 12 -5.911 -4.740 -3.326 83 HZ3 LYS 12 HZ3 LYS 12 -4.237 -4.665 -3.045 84 H ALA 13 HN ALA 13 -5.440 1.543 -4.499 85 HA ALA 13 HA ALA 13 -2.876 2.708 -4.930 86 HB1 ALA 13 HB1 ALA 13 -3.610 3.153 -7.142 87 HB2 ALA 13 HB2 ALA 13 -5.294 3.297 -6.640 88 HB3 ALA 13 HB3 ALA 13 -4.512 1.716 -6.658 89 H ASN 14 HN ASN 14 -6.080 4.277 -4.660 90 HA ASN 14 HA ASN 14 -4.962 6.947 -4.753 91 HB2 ASN 14 HB2 ASN 14 -7.662 6.019 -3.730 92 HB3 ASN 14 HB1 ASN 14 -7.225 7.677 -4.138 93 HD21 ASN 14 HD21 ASN 14 -9.209 7.194 -5.690 94 HD22 ASN 14 HD22 ASN 14 -8.783 6.641 -7.237 95 H ALA 15 HN ALA 15 -5.774 4.684 -2.169 96 HA ALA 15 HA ALA 15 -5.596 6.567 -0.006 97 HB1 ALA 15 HB1 ALA 15 -6.551 4.650 0.801 98 HB2 ALA 15 HB2 ALA 15 -4.878 4.235 1.174 99 HB3 ALA 15 HB3 ALA 15 -5.634 3.615 -0.294 100 H ASP 16 HN ASP 16 -3.218 4.273 -1.337 101 HA ASP 16 HA ASP 16 -1.077 4.879 0.392 102 HB2 ASP 16 HB2 ASP 16 -1.134 3.047 -1.343 103 HB3 ASP 16 HB1 ASP 16 -0.816 4.277 -2.566 104 H ALA 17 HN ALA 17 -1.670 6.324 -2.846 105 HA ALA 17 HA ALA 17 0.388 8.275 -2.653 106 HB1 ALA 17 HB1 ALA 17 -0.368 8.897 -4.690 107 HB2 ALA 17 HB2 ALA 17 -1.985 9.231 -4.069 108 HB3 ALA 17 HB3 ALA 17 -1.541 7.589 -4.535 109 H PHE 18 HN PHE 18 -2.927 8.258 -1.448 110 HA PHE 18 HA PHE 18 -3.029 11.046 -0.732 111 HB2 PHE 18 HB1 PHE 18 -5.080 9.755 -0.890 112 HB3 PHE 18 HB2 PHE 18 -4.517 8.633 0.348 113 HD1 PHE 18 HD2 PHE 18 -4.937 12.340 -0.114 114 HD2 PHE 18 HD1 PHE 18 -5.316 8.958 2.506 115 HE1 PHE 18 HE2 PHE 18 -5.887 13.809 1.644 116 HE2 PHE 18 HE1 PHE 18 -6.267 10.426 4.265 117 HZ PHE 18 HZ PHE 18 -6.553 12.853 3.834 118 H ILE 19 HN ILE 19 -1.942 8.123 0.940 119 HA ILE 19 HA ILE 19 -1.490 9.455 3.476 120 HB ILE 19 HB ILE 19 -0.477 6.834 2.348 121 HG12 ILE 19 HG12 ILE 19 -2.698 7.593 4.263 122 HG13 ILE 19 HG11 ILE 19 -2.863 6.808 2.692 123 HG21 ILE 19 HG21 ILE 19 0.479 8.324 4.579 124 HG22 ILE 19 HG22 ILE 19 0.905 6.676 4.118 125 HG23 ILE 19 HG23 ILE 19 -0.447 6.964 5.214 126 HD11 ILE 19 HD11 ILE 19 -3.061 5.096 4.384 127 HD12 ILE 19 HD12 ILE 19 -1.596 5.655 5.191 128 HD13 ILE 19 HD13 ILE 19 -1.491 4.893 3.604 129 H ASN 20 HN ASN 20 0.535 8.648 0.675 130 HA ASN 20 HA ASN 20 3.023 9.470 1.867 131 HB2 ASN 20 HB1 ASN 20 2.366 9.570 -1.081 132 HB3 ASN 20 HB2 ASN 20 3.937 9.296 -0.330 133 HD21 ASN 20 HD21 ASN 20 2.041 7.576 -2.145 134 HD22 ASN 20 HD22 ASN 20 1.948 6.089 -1.332 135 H SER 21 HN SER 21 0.808 11.141 -0.385 136 HA SER 21 HA SER 21 2.248 13.585 -0.502 137 HB2 SER 21 HB1 SER 21 0.056 14.576 -1.179 138 HB3 SER 21 HB2 SER 21 0.447 13.100 -2.065 139 HG SER 21 HG SER 21 -1.730 13.227 -1.193 140 H PHE 22 HN PHE 22 -0.074 12.370 1.854 141 HA PHE 22 HA PHE 22 -0.539 14.836 3.229 142 HB2 PHE 22 HB1 PHE 22 -1.985 12.941 3.640 143 HB3 PHE 22 HB2 PHE 22 -0.624 11.962 4.186 144 HD1 PHE 22 HD2 PHE 22 0.696 12.785 6.241 145 HD2 PHE 22 HD1 PHE 22 -3.184 14.282 5.163 146 HE1 PHE 22 HE2 PHE 22 0.384 13.636 8.549 147 HE2 PHE 22 HE1 PHE 22 -3.496 15.132 7.472 148 HZ PHE 22 HZ PHE 22 -1.712 14.809 9.165 149 H ILE 23 HN ILE 23 1.996 12.385 3.527 150 HA ILE 23 HA ILE 23 3.145 13.489 5.940 151 HB ILE 23 HB ILE 23 4.465 11.781 3.815 152 HG12 ILE 23 HG11 ILE 23 3.049 10.942 6.362 153 HG13 ILE 23 HG12 ILE 23 2.349 10.817 4.749 154 HG21 ILE 23 HG21 ILE 23 5.322 11.326 6.526 155 HG22 ILE 23 HG22 ILE 23 5.480 13.041 6.142 156 HG23 ILE 23 HG23 ILE 23 6.284 11.834 5.138 157 HD11 ILE 23 HD11 ILE 23 3.759 8.813 5.916 158 HD12 ILE 23 HD12 ILE 23 5.059 9.653 5.072 159 HD13 ILE 23 HD13 ILE 23 3.673 9.043 4.169 160 H SER 24 HN SER 24 4.282 13.603 2.539 161 HA SER 24 HA SER 24 6.400 15.437 3.012 162 HB2 SER 24 HB1 SER 24 4.733 15.038 0.510 163 HB3 SER 24 HB2 SER 24 6.270 15.901 0.574 164 HG SER 24 HG SER 24 5.935 13.227 1.439 165 H ALA 25 HN ALA 25 2.956 15.967 2.522 166 HA ALA 25 HA ALA 25 3.242 18.841 2.129 167 HB1 ALA 25 HB1 ALA 25 0.854 17.081 2.732 168 HB2 ALA 25 HB2 ALA 25 1.306 17.773 1.175 169 HB3 ALA 25 HB3 ALA 25 0.738 18.822 2.473 170 H ALA 26 HN ALA 26 2.289 16.750 4.866 171 HA ALA 26 HA ALA 26 1.792 18.961 6.655 172 HB1 ALA 26 HB1 ALA 26 2.522 16.107 7.369 173 HB2 ALA 26 HB2 ALA 26 0.889 16.652 6.985 174 HB3 ALA 26 HB3 ALA 26 1.716 17.281 8.410 175 H SER 27 HN SER 27 4.661 17.028 5.915 176 HA SER 27 HA SER 27 6.268 17.874 8.109 177 HB2 SER 27 HB2 SER 27 8.167 17.155 6.782 178 HB3 SER 27 HB1 SER 27 6.839 16.026 6.507 179 HG SER 27 HG SER 27 7.976 17.901 4.806 180 H ASN 28 HN ASN 28 5.364 19.509 5.148 181 HA ASN 28 HA ASN 28 7.303 21.687 5.777 182 HB2 ASN 28 HB2 ASN 28 5.705 21.151 3.257 183 HB3 ASN 28 HB1 ASN 28 6.849 22.475 3.474 184 HD21 ASN 28 HD21 ASN 28 8.865 21.008 4.951 185 HD22 ASN 28 HD22 ASN 28 9.561 19.882 3.889 186 H THR 29 HN THR 29 4.267 20.972 6.658 187 HA THR 29 HA THR 29 3.085 23.612 6.035 188 HB THR 29 HB THR 29 1.874 21.374 7.677 189 HG1 THR 29 HG1 THR 29 2.223 20.511 5.707 190 HG21 THR 29 HG21 THR 29 1.061 23.937 7.466 191 HG22 THR 29 HG22 THR 29 -0.064 22.590 7.623 192 HG23 THR 29 HG23 THR 29 0.285 23.266 6.032 193 H GLY 30 HN GLY 30 2.920 21.810 9.109 194 HA2 GLY 30 HA1 GLY 30 3.201 24.331 10.569 195 HA3 GLY 30 HA2 GLY 30 2.926 22.744 11.286 196 H SER 31 HN SER 31 4.671 21.662 12.116 197 HA SER 31 HA SER 31 7.388 22.710 11.448 198 HB2 SER 31 HB2 SER 31 7.273 23.590 13.568 199 HB3 SER 31 HB1 SER 31 6.058 22.426 14.097 200 HG SER 31 HG SER 31 7.719 21.551 15.045 201 H PHE 32 HN PHE 32 5.855 20.061 13.321 202 HA PHE 32 HA PHE 32 6.512 17.797 13.468 203 HB2 PHE 32 HB2 PHE 32 6.331 18.477 10.549 204 HB3 PHE 32 HB1 PHE 32 6.893 16.874 11.025 205 HD1 PHE 32 HD1 PHE 32 5.376 16.140 13.329 206 HD2 PHE 32 HD2 PHE 32 4.080 18.383 9.895 207 HE1 PHE 32 HE1 PHE 32 3.038 15.428 13.743 208 HE2 PHE 32 HE2 PHE 32 1.744 17.668 10.315 209 HZ PHE 32 HZ PHE 32 1.223 16.190 12.236 210 H SER 33 HN SER 33 8.554 18.286 14.560 211 HA SER 33 HA SER 33 10.991 18.876 13.220 212 HB2 SER 33 HB1 SER 33 10.662 17.211 15.733 213 HB3 SER 33 HB2 SER 33 12.098 18.109 15.243 214 HG SER 33 HG SER 33 11.242 19.702 16.282 215 H GLN 34 HN GLN 34 12.865 17.286 13.038 216 HA GLN 34 HA GLN 34 12.295 15.227 11.212 217 HB2 GLN 34 HB1 GLN 34 14.577 16.272 11.865 218 HB3 GLN 34 HB2 GLN 34 14.616 15.045 13.131 219 HG2 GLN 34 HG2 GLN 34 14.343 13.278 11.433 220 HG3 GLN 34 HG1 GLN 34 14.286 14.501 10.164 221 HE21 GLN 34 HE21 GLN 34 16.320 12.535 10.089 222 HE22 GLN 34 HE22 GLN 34 17.810 13.288 10.391 223 H ASP 35 HN ASP 35 12.685 15.022 14.750 224 HA ASP 35 HA ASP 35 12.443 12.214 15.015 225 HB2 ASP 35 HB2 ASP 35 11.550 14.469 16.829 226 HB3 ASP 35 HB1 ASP 35 11.464 12.771 17.298 227 H GLN 36 HN GLN 36 9.966 14.714 14.620 228 HA GLN 36 HA GLN 36 7.750 12.863 15.000 229 HB2 GLN 36 HB1 GLN 36 7.740 15.579 13.649 230 HB3 GLN 36 HB2 GLN 36 6.346 14.720 14.305 231 HG2 GLN 36 HG2 GLN 36 8.716 15.773 15.880 232 HG3 GLN 36 HG1 GLN 36 7.073 16.414 15.908 233 HE21 GLN 36 HE21 GLN 36 9.028 14.692 17.840 234 HE22 GLN 36 HE22 GLN 36 7.920 13.614 18.541 235 H MET 37 HN MET 37 9.561 14.150 12.249 236 HA MET 37 HA MET 37 7.830 13.180 10.188 237 HB2 MET 37 HB2 MET 37 10.819 13.683 10.215 238 HB3 MET 37 HB1 MET 37 9.904 13.294 8.758 239 HG2 MET 37 HG2 MET 37 8.422 15.269 9.250 240 HG3 MET 37 HG1 MET 37 9.513 15.694 10.569 241 HE1 MET 37 HE1 MET 37 10.009 18.233 7.610 242 HE2 MET 37 HE2 MET 37 10.090 18.202 9.369 243 HE3 MET 37 HE3 MET 37 8.675 17.547 8.549 244 H GLU 38 HN GLU 38 10.544 11.684 11.928 245 HA GLU 38 HA GLU 38 10.743 9.303 10.401 246 HB2 GLU 38 HB1 GLU 38 12.329 9.962 12.214 247 HB3 GLU 38 HB2 GLU 38 11.083 9.586 13.404 248 HG2 GLU 38 HG2 GLU 38 12.501 7.646 13.230 249 HG3 GLU 38 HG1 GLU 38 10.986 7.254 12.416 250 H ASN 39 HN ASN 39 8.629 10.106 13.155 251 HA ASN 39 HA ASN 39 7.386 7.576 13.444 252 HB2 ASN 39 HB2 ASN 39 6.163 10.330 13.807 253 HB3 ASN 39 HB1 ASN 39 5.495 8.825 14.440 254 HD21 ASN 39 HD21 ASN 39 6.480 11.154 16.023 255 HD22 ASN 39 HD22 ASN 39 7.710 10.538 17.018 256 H MET 40 HN MET 40 6.667 10.265 11.253 257 HA MET 40 HA MET 40 4.269 9.240 10.128 258 HB2 MET 40 HB2 MET 40 6.448 10.828 8.735 259 HB3 MET 40 HB1 MET 40 4.779 10.663 8.190 260 HG2 MET 40 HG2 MET 40 5.580 11.832 10.871 261 HG3 MET 40 HG1 MET 40 5.222 12.800 9.441 262 HE1 MET 40 HE1 MET 40 1.613 11.947 8.578 263 HE2 MET 40 HE2 MET 40 2.796 10.692 8.220 264 HE3 MET 40 HE3 MET 40 3.229 12.385 8.005 265 H SER 41 HN SER 41 7.644 8.455 9.544 266 HA SER 41 HA SER 41 7.190 6.900 7.152 267 HB2 SER 41 HB2 SER 41 9.423 7.808 7.851 268 HB3 SER 41 HB1 SER 41 9.445 6.630 9.163 269 HG SER 41 HG SER 41 8.933 5.740 6.566 270 H LEU 42 HN LEU 42 6.829 6.288 10.560 271 HA LEU 42 HA LEU 42 6.683 3.360 10.137 272 HB2 LEU 42 HB2 LEU 42 6.211 4.963 12.670 273 HB3 LEU 42 HB1 LEU 42 6.441 3.218 12.557 274 HG LEU 42 HG LEU 42 8.485 5.330 11.801 275 HD11 LEU 42 HD11 LEU 42 7.816 4.460 14.315 276 HD12 LEU 42 HD12 LEU 42 9.415 5.048 13.858 277 HD13 LEU 42 HD13 LEU 42 9.083 3.316 13.872 278 HD21 LEU 42 HD21 LEU 42 9.160 3.634 10.422 279 HD22 LEU 42 HD22 LEU 42 8.265 2.410 11.323 280 HD23 LEU 42 HD23 LEU 42 9.829 2.973 11.914 281 H ILE 43 HN ILE 43 4.640 6.106 10.194 282 HA ILE 43 HA ILE 43 2.247 4.321 10.405 283 HB ILE 43 HB ILE 43 2.622 7.213 11.228 284 HG12 ILE 43 HG12 ILE 43 1.645 4.779 12.752 285 HG13 ILE 43 HG11 ILE 43 3.287 5.418 12.834 286 HG21 ILE 43 HG21 ILE 43 0.487 7.037 10.060 287 HG22 ILE 43 HG22 ILE 43 0.190 7.145 11.793 288 HG23 ILE 43 HG23 ILE 43 0.072 5.587 10.975 289 HD11 ILE 43 HD11 ILE 43 2.632 7.330 13.981 290 HD12 ILE 43 HD12 ILE 43 1.467 6.164 14.611 291 HD13 ILE 43 HD13 ILE 43 0.992 7.282 13.331 292 H GLY 44 HN GLY 44 0.355 5.203 9.089 293 HA2 GLY 44 HA1 GLY 44 -0.522 5.974 7.049 294 HA3 GLY 44 HA2 GLY 44 0.849 7.080 6.956 295 H ASN 45 HN ASN 45 2.894 6.200 6.113 296 HA ASN 45 HA ASN 45 2.606 4.696 3.741 297 HB2 ASN 45 HB2 ASN 45 5.026 5.089 5.526 298 HB3 ASN 45 HB1 ASN 45 5.101 4.334 3.934 299 HD21 ASN 45 HD21 ASN 45 6.520 6.732 4.360 300 HD22 ASN 45 HD22 ASN 45 5.756 8.010 3.546 301 H THR 46 HN THR 46 3.418 3.631 7.032 302 HA THR 46 HA THR 46 3.967 0.906 6.421 303 HB THR 46 HB THR 46 2.653 2.004 8.926 304 HG1 THR 46 HG1 THR 46 4.810 2.830 8.054 305 HG21 THR 46 HG21 THR 46 2.842 -0.570 8.342 306 HG22 THR 46 HG22 THR 46 3.213 0.010 9.965 307 HG23 THR 46 HG23 THR 46 4.520 -0.334 8.832 308 H LEU 47 HN LEU 47 0.941 2.649 6.934 309 HA LEU 47 HA LEU 47 -0.841 0.471 7.162 310 HB2 LEU 47 HB2 LEU 47 -1.257 3.113 5.727 311 HB3 LEU 47 HB1 LEU 47 -2.544 2.005 6.205 312 HG LEU 47 HG LEU 47 -0.629 3.487 8.028 313 HD11 LEU 47 HD11 LEU 47 -2.667 4.504 8.898 314 HD12 LEU 47 HD12 LEU 47 -3.657 3.485 7.853 315 HD13 LEU 47 HD13 LEU 47 -2.620 4.724 7.148 316 HD21 LEU 47 HD21 LEU 47 -0.923 1.221 8.881 317 HD22 LEU 47 HD22 LEU 47 -2.668 1.331 8.659 318 HD23 LEU 47 HD23 LEU 47 -1.869 2.333 9.870 319 H MET 48 HN MET 48 0.663 1.904 4.294 320 HA MET 48 HA MET 48 -0.827 0.633 2.279 321 HB2 MET 48 HB2 MET 48 0.958 2.290 1.827 322 HB3 MET 48 HB1 MET 48 2.171 1.107 2.314 323 HG2 MET 48 HG2 MET 48 1.295 -0.424 0.518 324 HG3 MET 48 HG1 MET 48 0.256 0.893 -0.027 325 HE1 MET 48 HE1 MET 48 4.579 1.014 0.770 326 HE2 MET 48 HE2 MET 48 4.399 -0.199 -0.495 327 HE3 MET 48 HE3 MET 48 3.448 -0.330 0.983 328 H ALA 49 HN ALA 49 1.930 -0.635 4.152 329 HA ALA 49 HA ALA 49 2.116 -3.142 2.798 330 HB1 ALA 49 HB1 ALA 49 2.884 -3.828 5.285 331 HB2 ALA 49 HB2 ALA 49 2.964 -2.073 5.450 332 HB3 ALA 49 HB3 ALA 49 3.919 -2.888 4.210 333 H ALA 50 HN ALA 50 0.058 -1.989 5.420 334 HA ALA 50 HA ALA 50 -1.081 -4.506 6.156 335 HB1 ALA 50 HB1 ALA 50 -2.095 -1.661 6.295 336 HB2 ALA 50 HB2 ALA 50 -1.495 -2.666 7.614 337 HB3 ALA 50 HB3 ALA 50 -3.056 -3.021 6.875 338 H MET 51 HN MET 51 -1.527 -2.428 3.416 339 HA MET 51 HA MET 51 -4.119 -3.132 2.561 340 HB2 MET 51 HB2 MET 51 -1.630 -2.656 0.892 341 HB3 MET 51 HB1 MET 51 -3.276 -2.678 0.261 342 HG2 MET 51 HG2 MET 51 -2.202 -0.778 2.367 343 HG3 MET 51 HG1 MET 51 -2.573 -0.365 0.693 344 HE1 MET 51 HE1 MET 51 -4.765 0.322 4.140 345 HE2 MET 51 HE2 MET 51 -4.618 1.528 2.864 346 HE3 MET 51 HE3 MET 51 -3.190 0.649 3.405 347 H ASP 52 HN ASP 52 -1.092 -4.928 2.381 348 HA ASP 52 HA ASP 52 -2.158 -7.017 0.660 349 HB2 ASP 52 HB2 ASP 52 0.257 -6.972 2.498 350 HB3 ASP 52 HB1 ASP 52 -0.103 -8.259 1.347 351 H ASN 53 HN ASN 53 -2.685 -6.189 3.883 352 HA ASN 53 HA ASN 53 -2.872 -8.814 5.060 353 HB2 ASN 53 HB2 ASN 53 -4.142 -6.169 5.815 354 HB3 ASN 53 HB1 ASN 53 -4.248 -7.627 6.802 355 HD21 ASN 53 HD21 ASN 53 -2.953 -5.336 7.851 356 HD22 ASN 53 HD22 ASN 53 -1.288 -5.648 7.970 357 H MET 54 HN MET 54 -5.109 -6.791 3.230 358 HA MET 54 HA MET 54 -7.499 -8.235 3.853 359 HB2 MET 54 HB2 MET 54 -8.219 -7.377 1.512 360 HB3 MET 54 HB1 MET 54 -7.853 -6.179 2.754 361 HG2 MET 54 HG2 MET 54 -6.185 -5.326 1.500 362 HG3 MET 54 HG1 MET 54 -5.432 -6.917 1.360 363 HE1 MET 54 HE1 MET 54 -4.744 -5.507 -1.004 364 HE2 MET 54 HE2 MET 54 -5.340 -6.516 -2.321 365 HE3 MET 54 HE3 MET 54 -4.664 -7.270 -0.879 366 H GLY 55 HN GLY 55 -4.735 -9.141 2.069 367 HA2 GLY 55 HA2 GLY 55 -4.299 -11.296 1.163 368 HA3 GLY 55 HA1 GLY 55 -6.007 -11.692 1.356 369 H GLY 56 HN GLY 56 -6.319 -8.855 -0.046 370 HA2 GLY 56 HA2 GLY 56 -5.661 -8.351 -2.484 371 HA3 GLY 56 HA1 GLY 56 -6.188 -10.003 -2.800 372 H ARG 57 HN ARG 57 -8.164 -8.876 -0.400 373 HA ARG 57 HA ARG 57 -10.172 -7.925 -2.399 374 HB2 ARG 57 HB2 ARG 57 -11.896 -8.909 -0.980 375 HB3 ARG 57 HB1 ARG 57 -10.690 -10.137 -1.363 376 HG2 ARG 57 HG2 ARG 57 -9.557 -9.302 0.860 377 HG3 ARG 57 HG1 ARG 57 -11.171 -8.696 1.228 378 HD2 ARG 57 HD2 ARG 57 -12.009 -11.052 0.621 379 HD3 ARG 57 HD1 ARG 57 -10.320 -11.550 0.710 380 HE ARG 57 HE ARG 57 -10.378 -11.204 3.075 381 HH11 ARG 57 HH11 ARG 57 -12.033 -8.632 2.890 382 HH12 ARG 57 HH12 ARG 57 -13.479 -9.115 3.713 383 HH21 ARG 57 HH21 ARG 57 -12.769 -12.504 3.530 384 HH22 ARG 57 HH22 ARG 57 -13.896 -11.306 4.075 385 H ILE 58 HN ILE 58 -10.446 -5.762 -2.168 386 HA ILE 58 HA ILE 58 -10.223 -4.592 0.568 387 HB ILE 58 HB ILE 58 -10.189 -3.238 -2.146 388 HG12 ILE 58 HG12 ILE 58 -8.191 -4.640 -1.656 389 HG13 ILE 58 HG11 ILE 58 -7.807 -2.919 -1.720 390 HG21 ILE 58 HG21 ILE 58 -9.080 -1.671 -0.030 391 HG22 ILE 58 HG22 ILE 58 -10.671 -2.228 0.484 392 HG23 ILE 58 HG23 ILE 58 -10.499 -1.318 -1.015 393 HD11 ILE 58 HD11 ILE 58 -8.362 -4.482 0.821 394 HD12 ILE 58 HD12 ILE 58 -7.895 -2.783 0.727 395 HD13 ILE 58 HD13 ILE 58 -6.757 -4.040 0.238 396 H THR 59 HN THR 59 -11.936 -3.277 1.364 397 HA THR 59 HA THR 59 -14.367 -3.045 -0.301 398 HB THR 59 HB THR 59 -15.598 -3.863 1.927 399 HG1 THR 59 HG1 THR 59 -13.284 -4.247 2.700 400 HG21 THR 59 HG21 THR 59 -15.911 -5.994 0.863 401 HG22 THR 59 HG22 THR 59 -14.375 -5.857 0.006 402 HG23 THR 59 HG23 THR 59 -15.722 -4.802 -0.423 403 HA PRO 60 HA PRO 60 -14.951 0.789 1.811 404 HB2 PRO 60 HB2 PRO 60 -17.624 0.886 2.196 405 HB3 PRO 60 HB1 PRO 60 -16.876 1.078 0.609 406 HG2 PRO 60 HG2 PRO 60 -18.158 -1.340 1.823 407 HG3 PRO 60 HG1 PRO 60 -18.306 -0.712 0.178 408 HD2 PRO 60 HD2 PRO 60 -16.689 -2.795 0.788 409 HD3 PRO 60 HD1 PRO 60 -16.304 -1.648 -0.496 410 H SER 61 HN SER 61 -16.647 -1.944 3.348 411 HA SER 61 HA SER 61 -16.949 -0.622 5.898 412 HB2 SER 61 HB2 SER 61 -18.289 -2.615 5.114 413 HB3 SER 61 HB1 SER 61 -16.852 -3.605 5.373 414 HG SER 61 HG SER 61 -17.677 -1.925 7.437 415 H LYS 62 HN LYS 62 -14.445 -2.678 4.474 416 HA LYS 62 HA LYS 62 -12.967 -2.879 6.994 417 HB2 LYS 62 HB2 LYS 62 -12.254 -3.605 4.139 418 HB3 LYS 62 HB1 LYS 62 -11.192 -3.891 5.517 419 HG2 LYS 62 HG2 LYS 62 -12.946 -5.270 6.580 420 HG3 LYS 62 HG1 LYS 62 -14.001 -4.991 5.195 421 HD2 LYS 62 HD2 LYS 62 -12.945 -7.128 4.851 422 HD3 LYS 62 HD1 LYS 62 -12.181 -5.991 3.739 423 HE2 LYS 62 HE2 LYS 62 -10.280 -6.925 4.651 424 HE3 LYS 62 HE1 LYS 62 -10.549 -5.645 5.834 425 HZ1 LYS 62 HZ1 LYS 62 -11.526 -7.132 7.324 426 HZ2 LYS 62 HZ2 LYS 62 -10.184 -7.977 6.715 427 HZ3 LYS 62 HZ3 LYS 62 -11.744 -8.331 6.144 428 H LEU 63 HN LEU 63 -12.495 -1.158 3.893 429 HA LEU 63 HA LEU 63 -10.123 0.218 4.759 430 HB2 LEU 63 HB2 LEU 63 -12.008 0.395 2.477 431 HB3 LEU 63 HB1 LEU 63 -11.113 1.868 2.852 432 HG LEU 63 HG LEU 63 -8.996 0.632 2.747 433 HD11 LEU 63 HD21 LEU 63 -9.139 -1.759 1.836 434 HD12 LEU 63 HD22 LEU 63 -10.847 -1.712 2.269 435 HD13 LEU 63 HD23 LEU 63 -9.616 -1.541 3.520 436 HD21 LEU 63 HD11 LEU 63 -10.756 0.061 0.343 437 HD22 LEU 63 HD12 LEU 63 -8.993 0.151 0.342 438 HD23 LEU 63 HD13 LEU 63 -9.949 1.597 0.670 439 H GLN 64 HN GLN 64 -13.571 1.118 4.772 440 HA GLN 64 HA GLN 64 -13.299 3.798 5.616 441 HB2 GLN 64 HB2 GLN 64 -15.403 1.703 6.141 442 HB3 GLN 64 HB1 GLN 64 -15.528 3.304 6.869 443 HG2 GLN 64 HG2 GLN 64 -15.581 4.376 4.733 444 HG3 GLN 64 HG1 GLN 64 -15.091 2.900 3.902 445 HE21 GLN 64 HE21 GLN 64 -17.417 4.055 2.978 446 HE22 GLN 64 HE22 GLN 64 -18.777 3.177 3.491 447 H ALA 65 HN ALA 65 -13.181 0.795 7.500 448 HA ALA 65 HA ALA 65 -12.979 2.138 10.062 449 HB1 ALA 65 HB1 ALA 65 -12.116 -0.659 9.252 450 HB2 ALA 65 HB2 ALA 65 -13.710 -0.223 9.867 451 HB3 ALA 65 HB3 ALA 65 -12.293 -0.079 10.908 452 H LEU 66 HN LEU 66 -10.702 0.996 7.624 453 HA LEU 66 HA LEU 66 -8.338 1.475 9.245 454 HB2 LEU 66 HB2 LEU 66 -8.400 -0.096 7.288 455 HB3 LEU 66 HB1 LEU 66 -8.562 1.302 6.225 456 HG LEU 66 HG LEU 66 -6.324 1.277 8.215 457 HD11 LEU 66 HD11 LEU 66 -5.033 0.211 6.139 458 HD12 LEU 66 HD12 LEU 66 -6.610 -0.518 5.839 459 HD13 LEU 66 HD13 LEU 66 -5.783 -0.808 7.369 460 HD21 LEU 66 HD21 LEU 66 -6.224 3.245 7.033 461 HD22 LEU 66 HD22 LEU 66 -7.039 2.562 5.627 462 HD23 LEU 66 HD23 LEU 66 -5.328 2.234 5.900 463 H ASP 67 HN ASP 67 -10.042 3.269 6.676 464 HA ASP 67 HA ASP 67 -8.331 5.437 6.321 465 HB2 ASP 67 HB1 ASP 67 -10.623 5.013 5.246 466 HB3 ASP 67 HB2 ASP 67 -11.313 5.793 6.667 467 H MET 68 HN MET 68 -10.625 4.908 8.990 468 HA MET 68 HA MET 68 -10.176 7.459 10.246 469 HB2 MET 68 HB1 MET 68 -11.137 4.821 11.393 470 HB3 MET 68 HB2 MET 68 -11.176 6.356 12.259 471 HG2 MET 68 HG2 MET 68 -12.573 7.306 10.413 472 HG3 MET 68 HG1 MET 68 -12.612 5.709 9.667 473 HE1 MET 68 HE1 MET 68 -13.279 7.907 12.569 474 HE2 MET 68 HE2 MET 68 -12.792 6.590 13.634 475 HE3 MET 68 HE3 MET 68 -14.477 7.102 13.593 476 H ALA 69 HN ALA 69 -8.507 4.363 10.386 477 HA ALA 69 HA ALA 69 -6.966 4.885 12.751 478 HB1 ALA 69 HB1 ALA 69 -5.433 3.134 11.852 479 HB2 ALA 69 HB2 ALA 69 -6.332 3.163 10.335 480 HB3 ALA 69 HB3 ALA 69 -7.123 2.629 11.819 481 H PHE 70 HN PHE 70 -6.300 5.440 9.294 482 HA PHE 70 HA PHE 70 -3.671 6.429 9.519 483 HB2 PHE 70 HB1 PHE 70 -4.734 6.014 7.350 484 HB3 PHE 70 HB2 PHE 70 -5.876 7.328 7.639 485 HD1 PHE 70 HD1 PHE 70 -2.201 6.630 7.484 486 HD2 PHE 70 HD2 PHE 70 -5.346 9.502 6.938 487 HE1 PHE 70 HE1 PHE 70 -0.561 8.248 6.568 488 HE2 PHE 70 HE2 PHE 70 -3.706 11.122 6.020 489 HZ PHE 70 HZ PHE 70 -1.314 10.493 5.836 490 H ALA 71 HN ALA 71 -6.758 8.188 9.835 491 HA ALA 71 HA ALA 71 -5.508 10.747 10.310 492 HB1 ALA 71 HB1 ALA 71 -8.023 10.788 11.545 493 HB2 ALA 71 HB2 ALA 71 -8.201 9.656 10.204 494 HB3 ALA 71 HB3 ALA 71 -7.655 11.306 9.900 495 H SER 72 HN SER 72 -6.691 8.157 12.431 496 HA SER 72 HA SER 72 -6.289 9.620 14.885 497 HB2 SER 72 HB2 SER 72 -7.736 7.584 14.657 498 HB3 SER 72 HB1 SER 72 -6.272 6.616 14.481 499 HG SER 72 HG SER 72 -7.422 7.337 16.707 500 H SER 73 HN SER 73 -4.229 7.468 12.961 501 HA SER 73 HA SER 73 -2.120 7.309 14.921 502 HB2 SER 73 HB2 SER 73 -0.793 6.338 13.148 503 HB3 SER 73 HB1 SER 73 -2.435 5.713 13.001 504 HG SER 73 HG SER 73 -1.841 6.376 10.991 505 H VAL 74 HN VAL 74 -2.612 9.355 12.051 506 HA VAL 74 HA VAL 74 -0.142 10.782 12.280 507 HB VAL 74 HB VAL 74 -1.107 12.377 10.750 508 HG11 VAL 74 HG21 VAL 74 -1.561 9.491 10.411 509 HG12 VAL 74 HG22 VAL 74 -0.815 10.648 9.309 510 HG13 VAL 74 HG23 VAL 74 -2.571 10.492 9.368 511 HG21 VAL 74 HG11 VAL 74 -3.806 11.145 11.371 512 HG22 VAL 74 HG12 VAL 74 -3.486 12.536 10.334 513 HG23 VAL 74 HG13 VAL 74 -3.232 12.657 12.075 514 H ALA 75 HN ALA 75 -3.315 11.266 13.763 515 HA ALA 75 HA ALA 75 -2.799 13.874 14.834 516 HB1 ALA 75 HB1 ALA 75 -5.066 13.107 14.808 517 HB2 ALA 75 HB2 ALA 75 -4.606 13.206 16.508 518 HB3 ALA 75 HB3 ALA 75 -4.650 11.641 15.696 519 H GLN 76 HN GLN 76 -2.204 10.608 16.102 520 HA GLN 76 HA GLN 76 -1.319 11.483 18.700 521 HB2 GLN 76 HB2 GLN 76 -0.742 8.950 17.137 522 HB3 GLN 76 HB1 GLN 76 -0.283 9.199 18.822 523 HG2 GLN 76 HG2 GLN 76 -2.632 9.523 19.441 524 HG3 GLN 76 HG1 GLN 76 -3.119 9.363 17.753 525 HE21 GLN 76 HE21 GLN 76 -3.969 7.584 19.947 526 HE22 GLN 76 HE22 GLN 76 -3.422 6.031 19.535 527 H ILE 77 HN ILE 77 0.441 10.659 15.701 528 HA ILE 77 HA ILE 77 3.067 10.968 16.663 529 HB ILE 77 HB ILE 77 1.977 11.758 13.946 530 HG12 ILE 77 HG12 ILE 77 3.383 9.196 14.715 531 HG13 ILE 77 HG11 ILE 77 1.630 9.357 14.811 532 HG21 ILE 77 HG21 ILE 77 4.749 11.441 15.072 533 HG22 ILE 77 HG22 ILE 77 4.118 12.707 14.018 534 HG23 ILE 77 HG23 ILE 77 4.448 11.101 13.367 535 HD11 ILE 77 HD11 ILE 77 3.249 8.846 12.494 536 HD12 ILE 77 HD12 ILE 77 2.433 10.397 12.285 537 HD13 ILE 77 HD13 ILE 77 1.490 8.940 12.604 538 H ALA 78 HN ALA 78 0.907 13.458 15.318 539 HA ALA 78 HA ALA 78 2.814 15.593 15.879 540 HB1 ALA 78 HB1 ALA 78 -0.137 15.848 15.250 541 HB2 ALA 78 HB2 ALA 78 1.108 15.646 14.017 542 HB3 ALA 78 HB3 ALA 78 1.108 17.081 15.045 543 H ALA 79 HN ALA 79 -0.342 14.621 17.268 544 HA ALA 79 HA ALA 79 -0.430 16.586 19.310 545 HB1 ALA 79 HB1 ALA 79 -1.486 13.742 19.346 546 HB2 ALA 79 HB2 ALA 79 -2.360 15.169 18.789 547 HB3 ALA 79 HB3 ALA 79 -1.940 15.002 20.494 548 H SER 80 HN SER 80 1.441 13.653 19.045 549 HA SER 80 HA SER 80 2.139 13.559 21.883 550 HB2 SER 80 HB2 SER 80 3.249 12.158 19.437 551 HB3 SER 80 HB1 SER 80 3.861 11.885 21.068 552 HG SER 80 HG SER 80 1.472 11.548 21.520 553 H GLN 81 HN GLN 81 3.258 15.238 19.081 554 HA GLN 81 HA GLN 81 5.963 15.663 19.507 555 HB2 GLN 81 HB2 GLN 81 3.927 17.810 18.837 556 HB3 GLN 81 HB1 GLN 81 5.661 17.905 18.535 557 HG2 GLN 81 HG2 GLN 81 5.566 16.085 16.964 558 HG3 GLN 81 HG1 GLN 81 3.898 15.720 17.401 559 HE21 GLN 81 HE21 GLN 81 5.604 17.091 14.951 560 HE22 GLN 81 HE22 GLN 81 4.499 18.271 14.430 561 H GLY 82 HN GLY 82 3.270 17.137 21.276 562 HA2 GLY 82 HA2 GLY 82 3.382 17.794 23.584 563 HA3 GLY 82 HA1 GLY 82 5.142 17.753 23.482 564 H GLY 83 HN GLY 83 3.880 19.326 20.789 565 HA2 GLY 83 HA1 GLY 83 4.555 21.961 22.002 566 HA3 GLY 83 HA2 GLY 83 4.575 21.605 20.274 567 H ASP 84 HN ASP 84 3.179 23.535 20.051 568 HA ASP 84 HA ASP 84 0.583 23.699 21.259 569 HB2 ASP 84 HB2 ASP 84 1.794 25.595 20.119 570 HB3 ASP 84 HB1 ASP 84 1.420 24.832 18.574 571 H LEU 85 HN LEU 85 -0.607 21.790 21.042 572 HA LEU 85 HA LEU 85 -0.763 20.179 18.710 573 HB2 LEU 85 HB2 LEU 85 -1.586 19.521 20.984 574 HB3 LEU 85 HB1 LEU 85 -2.951 20.615 20.762 575 HG LEU 85 HG LEU 85 -3.756 19.351 18.879 576 HD11 LEU 85 HD21 LEU 85 -0.989 18.331 18.908 577 HD12 LEU 85 HD22 LEU 85 -2.104 18.522 17.554 578 HD13 LEU 85 HD23 LEU 85 -2.211 17.100 18.589 579 HD21 LEU 85 HD11 LEU 85 -3.226 18.089 21.451 580 HD22 LEU 85 HD12 LEU 85 -3.361 16.896 20.159 581 HD23 LEU 85 HD13 LEU 85 -4.682 18.027 20.457 582 H GLY 86 HN GLY 86 -2.045 23.296 19.329 583 HA2 GLY 86 HA2 GLY 86 -4.367 23.183 17.631 584 HA3 GLY 86 HA1 GLY 86 -3.531 24.656 18.121 585 H VAL 87 HN VAL 87 -0.947 23.868 17.039 586 HA VAL 87 HA VAL 87 -1.319 24.766 14.318 587 HB VAL 87 HB VAL 87 0.734 25.121 15.819 588 HG11 VAL 87 HG11 VAL 87 1.692 22.512 14.678 589 HG12 VAL 87 HG12 VAL 87 0.808 22.524 16.202 590 HG13 VAL 87 HG13 VAL 87 2.319 23.420 16.053 591 HG21 VAL 87 HG21 VAL 87 2.278 24.631 13.714 592 HG22 VAL 87 HG22 VAL 87 1.061 25.907 13.664 593 HG23 VAL 87 HG23 VAL 87 0.725 24.339 12.932 594 H THR 88 HN THR 88 -0.763 21.596 15.810 595 HA THR 88 HA THR 88 -0.142 20.093 13.519 596 HB THR 88 HB THR 88 -1.951 19.314 15.830 597 HG1 THR 88 HG1 THR 88 0.807 19.307 15.351 598 HG21 THR 88 HG21 THR 88 -0.467 17.535 13.880 599 HG22 THR 88 HG22 THR 88 -2.187 17.911 13.752 600 HG23 THR 88 HG23 THR 88 -1.580 17.026 15.152 601 H THR 89 HN THR 89 -3.213 21.442 14.580 602 HA THR 89 HA THR 89 -4.947 20.068 12.801 603 HB THR 89 HB THR 89 -5.257 23.007 13.417 604 HG1 THR 89 HG1 THR 89 -4.765 22.208 15.380 605 HG21 THR 89 HG21 THR 89 -6.921 21.834 11.982 606 HG22 THR 89 HG22 THR 89 -7.623 22.416 13.490 607 HG23 THR 89 HG23 THR 89 -7.228 20.708 13.304 608 H ASN 90 HN ASN 90 -3.097 23.086 12.357 609 HA ASN 90 HA ASN 90 -3.865 23.398 9.586 610 HB2 ASN 90 HB2 ASN 90 -1.489 24.530 11.095 611 HB3 ASN 90 HB1 ASN 90 -2.051 25.076 9.515 612 HD21 ASN 90 HD21 ASN 90 -1.972 26.800 11.853 613 HD22 ASN 90 HD22 ASN 90 -3.571 27.212 12.245 614 H ALA 91 HN ALA 91 -1.104 21.931 11.258 615 HA ALA 91 HA ALA 91 0.441 21.372 8.904 616 HB1 ALA 91 HB1 ALA 91 1.920 20.638 10.434 617 HB2 ALA 91 HB2 ALA 91 0.807 19.377 10.966 618 HB3 ALA 91 HB3 ALA 91 0.721 20.987 11.680 619 H ILE 92 HN ILE 92 -1.677 19.240 10.849 620 HA ILE 92 HA ILE 92 -1.543 17.072 8.946 621 HB ILE 92 HB ILE 92 -3.491 17.680 11.188 622 HG12 ILE 92 HG12 ILE 92 -1.154 15.758 10.968 623 HG13 ILE 92 HG11 ILE 92 -1.157 17.266 11.882 624 HG21 ILE 92 HG21 ILE 92 -4.667 15.807 10.684 625 HG22 ILE 92 HG22 ILE 92 -3.212 14.900 10.271 626 HG23 ILE 92 HG23 ILE 92 -3.956 15.964 9.077 627 HD11 ILE 92 HD11 ILE 92 -3.134 16.358 13.181 628 HD12 ILE 92 HD12 ILE 92 -1.622 15.491 13.444 629 HD13 ILE 92 HD13 ILE 92 -2.857 14.809 12.386 630 H ALA 93 HN ALA 93 -3.992 19.589 9.614 631 HA ALA 93 HA ALA 93 -5.862 18.697 7.640 632 HB1 ALA 93 HB1 ALA 93 -6.848 20.935 7.832 633 HB2 ALA 93 HB2 ALA 93 -5.399 21.519 8.649 634 HB3 ALA 93 HB3 ALA 93 -6.428 20.318 9.429 635 H ASP 94 HN ASP 94 -3.278 21.164 7.456 636 HA ASP 94 HA ASP 94 -3.739 22.004 4.801 637 HB2 ASP 94 HB1 ASP 94 -1.206 21.763 6.425 638 HB3 ASP 94 HB2 ASP 94 -1.201 22.417 4.789 639 H ALA 95 HN ALA 95 -1.619 19.346 5.938 640 HA ALA 95 HA ALA 95 -0.920 18.489 3.275 641 HB1 ALA 95 HB1 ALA 95 0.047 16.567 4.334 642 HB2 ALA 95 HB2 ALA 95 -0.981 16.751 5.754 643 HB3 ALA 95 HB3 ALA 95 0.305 17.916 5.441 644 H LEU 96 HN LEU 96 -3.522 17.721 5.508 645 HA LEU 96 HA LEU 96 -4.553 15.458 4.046 646 HB2 LEU 96 HB2 LEU 96 -5.039 16.392 6.498 647 HB3 LEU 96 HB1 LEU 96 -6.356 17.211 5.660 648 HG LEU 96 HG LEU 96 -7.126 15.039 6.487 649 HD11 LEU 96 HD21 LEU 96 -6.685 14.832 3.498 650 HD12 LEU 96 HD22 LEU 96 -7.862 15.928 4.221 651 HD13 LEU 96 HD23 LEU 96 -8.035 14.187 4.433 652 HD21 LEU 96 HD11 LEU 96 -5.091 13.733 4.683 653 HD22 LEU 96 HD12 LEU 96 -6.053 12.995 5.963 654 HD23 LEU 96 HD13 LEU 96 -4.729 14.087 6.372 655 H THR 97 HN THR 97 -5.329 18.931 4.068 656 HA THR 97 HA THR 97 -7.509 18.756 2.219 657 HB THR 97 HB THR 97 -5.630 21.054 2.833 658 HG1 THR 97 HG1 THR 97 -6.736 20.848 4.618 659 HG21 THR 97 HG21 THR 97 -8.016 22.139 2.016 660 HG22 THR 97 HG22 THR 97 -7.863 20.748 0.942 661 HG23 THR 97 HG23 THR 97 -6.590 21.967 0.991 662 H SER 98 HN SER 98 -4.101 19.726 1.670 663 HA SER 98 HA SER 98 -4.302 19.962 -1.149 664 HB2 SER 98 HB2 SER 98 -1.892 19.788 -1.187 665 HB3 SER 98 HB1 SER 98 -2.338 20.667 0.276 666 HG SER 98 HG SER 98 -0.792 18.973 0.619 667 H ALA 99 HN ALA 99 -3.534 17.133 0.871 668 HA ALA 99 HA ALA 99 -2.980 15.304 -1.223 669 HB1 ALA 99 HB1 ALA 99 -4.301 14.783 1.457 670 HB2 ALA 99 HB2 ALA 99 -2.566 14.778 1.141 671 HB3 ALA 99 HB3 ALA 99 -3.599 13.549 0.412 672 H PHE 100 HN PHE 100 -6.092 16.088 0.354 673 HA PHE 100 HA PHE 100 -7.786 14.287 -0.925 674 HB2 PHE 100 HB1 PHE 100 -8.064 16.982 0.213 675 HB3 PHE 100 HB2 PHE 100 -9.254 16.621 -1.038 676 HD1 PHE 100 HD2 PHE 100 -9.811 13.813 -0.787 677 HD2 PHE 100 HD1 PHE 100 -9.035 16.688 2.312 678 HE1 PHE 100 HE2 PHE 100 -11.085 12.420 0.825 679 HE2 PHE 100 HE1 PHE 100 -10.308 15.297 3.917 680 HZ PHE 100 HZ PHE 100 -11.332 13.163 3.178 681 H TYR 101 HN TYR 101 -6.953 17.538 -2.166 682 HA TYR 101 HA TYR 101 -8.143 17.076 -4.746 683 HB2 TYR 101 HB2 TYR 101 -5.918 19.043 -4.307 684 HB3 TYR 101 HB1 TYR 101 -7.365 19.207 -5.302 685 HD1 TYR 101 HD1 TYR 101 -9.511 18.377 -3.473 686 HD2 TYR 101 HD2 TYR 101 -6.026 20.771 -2.712 687 HE1 TYR 101 HE1 TYR 101 -10.687 19.481 -1.583 688 HE2 TYR 101 HE2 TYR 101 -7.200 21.876 -0.828 689 HH TYR 101 HH TYR 101 -10.608 21.363 -0.228 690 H GLN 102 HN GLN 102 -4.936 16.544 -3.416 691 HA GLN 102 HA GLN 102 -3.618 16.095 -5.942 692 HB2 GLN 102 HB2 GLN 102 -2.984 15.331 -3.092 693 HB3 GLN 102 HB1 GLN 102 -1.959 14.824 -4.433 694 HG2 GLN 102 HG2 GLN 102 -1.961 17.325 -5.110 695 HG3 GLN 102 HG1 GLN 102 -2.551 17.619 -3.475 696 HE21 GLN 102 HE21 GLN 102 -1.078 17.269 -1.697 697 HE22 GLN 102 HE22 GLN 102 0.563 16.902 -1.928 698 H THR 103 HN THR 103 -5.783 14.161 -4.039 699 HA THR 103 HA THR 103 -4.955 11.762 -5.619 700 HB THR 103 HB THR 103 -5.946 10.405 -3.843 701 HG1 THR 103 HG1 THR 103 -6.687 11.543 -1.960 702 HG21 THR 103 HG21 THR 103 -3.671 10.875 -3.423 703 HG22 THR 103 HG22 THR 103 -4.477 11.293 -1.911 704 HG23 THR 103 HG23 THR 103 -4.002 12.564 -3.037 705 H THR 104 HN THR 104 -7.988 13.062 -4.142 706 HA THR 104 HA THR 104 -9.350 12.149 -6.647 707 HB THR 104 HB THR 104 -11.253 11.438 -5.361 708 HG1 THR 104 HG1 THR 104 -11.275 11.736 -3.112 709 HG21 THR 104 HG21 THR 104 -10.261 9.680 -3.974 710 HG22 THR 104 HG22 THR 104 -8.725 10.545 -3.949 711 HG23 THR 104 HG23 THR 104 -9.333 9.872 -5.461 712 H GLY 105 HN GLY 105 -9.499 14.448 -3.922 713 HA2 GLY 105 HA2 GLY 105 -9.882 16.827 -4.416 714 HA3 GLY 105 HA1 GLY 105 -10.858 16.335 -5.794 715 H VAL 106 HN VAL 106 -10.900 15.277 -2.377 716 HA VAL 106 HA VAL 106 -13.825 15.823 -2.372 717 HB VAL 106 HB VAL 106 -12.173 14.270 -0.360 718 HG11 VAL 106 HG21 VAL 106 -14.461 13.345 0.205 719 HG12 VAL 106 HG22 VAL 106 -15.146 14.592 -0.839 720 HG13 VAL 106 HG23 VAL 106 -14.241 15.048 0.604 721 HG21 VAL 106 HG11 VAL 106 -12.669 12.299 -1.513 722 HG22 VAL 106 HG12 VAL 106 -12.371 13.423 -2.841 723 HG23 VAL 106 HG13 VAL 106 -14.026 13.029 -2.372 724 H VAL 107 HN VAL 107 -14.715 16.890 -0.437 725 HA VAL 107 HA VAL 107 -13.370 19.294 0.236 726 HB VAL 107 HB VAL 107 -15.073 19.533 1.987 727 HG11 VAL 107 HG21 VAL 107 -15.743 19.963 -0.336 728 HG12 VAL 107 HG22 VAL 107 -17.079 19.230 0.550 729 HG13 VAL 107 HG23 VAL 107 -16.116 18.254 -0.560 730 HG21 VAL 107 HG11 VAL 107 -16.693 17.324 1.809 731 HG22 VAL 107 HG12 VAL 107 -15.501 17.580 3.084 732 HG23 VAL 107 HG13 VAL 107 -15.090 16.597 1.677 733 H ASN 108 HN ASN 108 -11.626 19.576 1.526 734 HA ASN 108 HA ASN 108 -10.554 17.443 3.155 735 HB2 ASN 108 HB2 ASN 108 -8.804 18.972 3.692 736 HB3 ASN 108 HB1 ASN 108 -9.260 19.340 2.030 737 HD21 ASN 108 HD21 ASN 108 -10.164 21.416 1.595 738 HD22 ASN 108 HD22 ASN 108 -10.437 22.589 2.791 739 H SER 109 HN SER 109 -12.699 20.125 3.755 740 HA SER 109 HA SER 109 -12.375 20.310 6.584 741 HB2 SER 109 HB2 SER 109 -14.524 21.461 6.571 742 HB3 SER 109 HB1 SER 109 -13.569 21.988 5.185 743 HG SER 109 HG SER 109 -14.793 20.000 4.228 744 H ARG 110 HN ARG 110 -14.298 18.095 4.600 745 HA ARG 110 HA ARG 110 -15.956 17.131 6.733 746 HB2 ARG 110 HB2 ARG 110 -16.513 16.685 4.397 747 HB3 ARG 110 HB1 ARG 110 -15.035 15.743 4.201 748 HG2 ARG 110 HG2 ARG 110 -15.816 14.119 5.860 749 HG3 ARG 110 HG1 ARG 110 -17.264 15.083 6.152 750 HD2 ARG 110 HD1 ARG 110 -17.701 14.828 3.611 751 HD3 ARG 110 HD2 ARG 110 -16.511 13.528 3.677 752 HE ARG 110 HE ARG 110 -18.296 12.951 5.737 753 HH11 ARG 110 HH11 ARG 110 -17.815 11.525 2.989 754 HH12 ARG 110 HH12 ARG 110 -19.454 11.378 2.449 755 HH21 ARG 110 HH21 ARG 110 -20.702 13.629 4.772 756 HH22 ARG 110 HH22 ARG 110 -21.087 12.569 3.457 757 H PHE 111 HN PHE 111 -13.009 15.649 5.304 758 HA PHE 111 HA PHE 111 -12.845 13.694 7.456 759 HB2 PHE 111 HB2 PHE 111 -11.956 13.352 5.107 760 HB3 PHE 111 HB1 PHE 111 -10.654 14.469 5.520 761 HD1 PHE 111 HD2 PHE 111 -12.282 11.276 6.568 762 HD2 PHE 111 HD1 PHE 111 -8.772 13.746 6.753 763 HE1 PHE 111 HE2 PHE 111 -11.046 9.436 7.677 764 HE2 PHE 111 HE1 PHE 111 -7.536 11.905 7.864 765 HZ PHE 111 HZ PHE 111 -8.673 9.750 8.325 766 H ILE 112 HN ILE 112 -10.885 16.542 6.557 767 HA ILE 112 HA ILE 112 -9.091 16.458 8.730 768 HB ILE 112 HB ILE 112 -10.211 18.884 7.298 769 HG12 ILE 112 HG11 ILE 112 -7.818 17.098 6.797 770 HG13 ILE 112 HG12 ILE 112 -9.199 17.351 5.731 771 HG21 ILE 112 HG21 ILE 112 -8.913 19.087 9.588 772 HG22 ILE 112 HG22 ILE 112 -8.496 20.150 8.244 773 HG23 ILE 112 HG23 ILE 112 -7.505 18.732 8.588 774 HD11 ILE 112 HD11 ILE 112 -7.283 18.679 4.959 775 HD12 ILE 112 HD12 ILE 112 -7.167 19.453 6.540 776 HD13 ILE 112 HD13 ILE 112 -8.575 19.743 5.518 777 H SER 113 HN SER 113 -12.333 17.935 8.548 778 HA SER 113 HA SER 113 -12.306 19.246 11.059 779 HB2 SER 113 HB2 SER 113 -14.158 19.557 9.506 780 HB3 SER 113 HB1 SER 113 -14.595 17.853 9.636 781 HG SER 113 HG SER 113 -14.721 19.851 11.634 782 H GLU 114 HN GLU 114 -12.955 15.849 10.248 783 HA GLU 114 HA GLU 114 -13.739 15.047 12.893 784 HB2 GLU 114 HB2 GLU 114 -12.447 13.433 10.671 785 HB3 GLU 114 HB1 GLU 114 -13.216 12.751 12.105 786 HG2 GLU 114 HG2 GLU 114 -15.350 13.825 11.462 787 HG3 GLU 114 HG1 GLU 114 -14.578 14.483 10.019 788 H ILE 115 HN ILE 115 -10.601 14.858 11.186 789 HA ILE 115 HA ILE 115 -9.107 13.783 13.353 790 HB ILE 115 HB ILE 115 -8.236 15.650 11.125 791 HG12 ILE 115 HG12 ILE 115 -7.900 12.653 11.404 792 HG13 ILE 115 HG11 ILE 115 -9.217 13.401 10.501 793 HG21 ILE 115 HG21 ILE 115 -5.957 14.837 11.637 794 HG22 ILE 115 HG22 ILE 115 -6.592 13.923 13.003 795 HG23 ILE 115 HG23 ILE 115 -6.653 15.684 13.019 796 HD11 ILE 115 HD11 ILE 115 -6.621 12.832 9.557 797 HD12 ILE 115 HD12 ILE 115 -6.683 14.584 9.749 798 HD13 ILE 115 HD13 ILE 115 -7.869 13.765 8.731 799 H ARG 116 HN ARG 116 -10.060 17.088 12.576 800 HA ARG 116 HA ARG 116 -8.401 18.531 14.334 801 HB2 ARG 116 HB2 ARG 116 -10.213 19.369 12.669 802 HB3 ARG 116 HB1 ARG 116 -11.332 19.176 14.018 803 HG2 ARG 116 HG1 ARG 116 -9.373 20.519 15.285 804 HG3 ARG 116 HG2 ARG 116 -9.119 21.133 13.650 805 HD2 ARG 116 HD2 ARG 116 -11.522 21.745 13.527 806 HD3 ARG 116 HD1 ARG 116 -11.738 21.179 15.183 807 HE ARG 116 HE ARG 116 -9.702 23.018 15.420 808 HH11 ARG 116 HH11 ARG 116 -11.881 23.564 12.990 809 HH12 ARG 116 HH12 ARG 116 -12.573 25.002 13.663 810 HH21 ARG 116 HH21 ARG 116 -10.998 24.644 16.731 811 HH22 ARG 116 HH22 ARG 116 -12.073 25.613 15.781 812 H SER 117 HN SER 117 -11.562 17.005 15.026 813 HA SER 117 HA SER 117 -11.463 17.696 17.842 814 HB2 SER 117 HB2 SER 117 -13.433 16.313 18.058 815 HB3 SER 117 HB1 SER 117 -13.573 17.200 16.540 816 HG SER 117 HG SER 117 -13.536 15.386 15.514 817 H LEU 118 HN LEU 118 -10.488 14.915 15.902 818 HA LEU 118 HA LEU 118 -10.021 13.114 18.090 819 HB2 LEU 118 HB2 LEU 118 -8.869 13.271 15.294 820 HB3 LEU 118 HB1 LEU 118 -8.480 11.970 16.419 821 HG LEU 118 HG LEU 118 -11.364 12.625 15.997 822 HD11 LEU 118 HD21 LEU 118 -10.556 12.595 13.706 823 HD12 LEU 118 HD22 LEU 118 -11.381 11.069 14.024 824 HD13 LEU 118 HD23 LEU 118 -9.618 11.133 14.015 825 HD21 LEU 118 HD11 LEU 118 -11.327 10.821 17.379 826 HD22 LEU 118 HD12 LEU 118 -9.667 10.413 16.946 827 HD23 LEU 118 HD13 LEU 118 -10.999 9.899 15.911 828 H ILE 119 HN ILE 119 -7.860 15.354 16.336 829 HA ILE 119 HA ILE 119 -5.473 14.726 17.731 830 HB ILE 119 HB ILE 119 -6.372 17.413 16.640 831 HG12 ILE 119 HG12 ILE 119 -4.598 15.322 15.355 832 HG13 ILE 119 HG11 ILE 119 -6.331 15.434 15.044 833 HG21 ILE 119 HG21 ILE 119 -4.463 17.554 18.222 834 HG22 ILE 119 HG22 ILE 119 -3.977 17.934 16.571 835 HG23 ILE 119 HG23 ILE 119 -3.597 16.355 17.261 836 HD11 ILE 119 HD11 ILE 119 -5.065 16.662 13.326 837 HD12 ILE 119 HD12 ILE 119 -4.298 17.639 14.578 838 HD13 ILE 119 HD13 ILE 119 -6.033 17.776 14.292 839 H GLY 120 HN GLY 120 -8.109 16.958 18.565 840 HA2 GLY 120 HA2 GLY 120 -6.799 18.002 20.924 841 HA3 GLY 120 HA1 GLY 120 -8.515 18.153 20.551 842 H MET 121 HN MET 121 -9.004 15.303 20.300 843 HA MET 121 HA MET 121 -9.652 14.654 22.985 844 HB2 MET 121 HB2 MET 121 -10.662 13.613 20.924 845 HB3 MET 121 HB1 MET 121 -9.179 12.676 20.737 846 HG2 MET 121 HG1 MET 121 -9.529 11.789 23.067 847 HG3 MET 121 HG2 MET 121 -11.094 12.605 23.088 848 HE1 MET 121 HE1 MET 121 -12.012 12.375 20.079 849 HE2 MET 121 HE2 MET 121 -12.997 12.194 21.527 850 HE3 MET 121 HE3 MET 121 -13.077 10.975 20.259 851 H PHE 122 HN PHE 122 -6.845 13.731 21.005 852 HA PHE 122 HA PHE 122 -5.682 11.948 22.920 853 HB2 PHE 122 HB2 PHE 122 -4.363 13.652 20.784 854 HB3 PHE 122 HB1 PHE 122 -3.569 12.343 21.660 855 HD1 PHE 122 HD2 PHE 122 -4.975 10.059 21.693 856 HD2 PHE 122 HD1 PHE 122 -5.336 13.147 18.730 857 HE1 PHE 122 HE2 PHE 122 -5.928 8.417 20.098 858 HE2 PHE 122 HE1 PHE 122 -6.290 11.505 17.136 859 HZ PHE 122 HZ PHE 122 -6.585 9.140 17.819 860 H ALA 123 HN ALA 123 -5.693 15.442 22.635 861 HA ALA 123 HA ALA 123 -3.469 15.976 24.365 862 HB1 ALA 123 HB1 ALA 123 -5.953 17.611 23.774 863 HB2 ALA 123 HB2 ALA 123 -4.394 17.736 22.959 864 HB3 ALA 123 HB3 ALA 123 -4.546 18.219 24.648 865 H GLN 124 HN GLN 124 -6.876 15.300 24.969 866 HA GLN 124 HA GLN 124 -6.808 15.991 27.775 867 HB2 GLN 124 HB2 GLN 124 -8.667 14.163 26.225 868 HB3 GLN 124 HB1 GLN 124 -8.935 14.693 27.886 869 HG2 GLN 124 HG2 GLN 124 -8.996 17.031 27.162 870 HG3 GLN 124 HG1 GLN 124 -8.629 16.549 25.504 871 HE21 GLN 124 HE21 GLN 124 -11.051 17.965 26.215 872 HE22 GLN 124 HE22 GLN 124 -12.360 16.930 25.904 873 H ALA 125 HN ALA 125 -6.159 13.046 25.936 874 HA ALA 125 HA ALA 125 -6.080 11.248 28.167 875 HB1 ALA 125 HB1 ALA 125 -5.822 9.816 26.449 876 HB2 ALA 125 HB2 ALA 125 -4.172 10.402 26.241 877 HB3 ALA 125 HB3 ALA 125 -5.493 11.157 25.351 878 H SER 126 HN SER 126 -3.782 13.567 26.896 879 HA SER 126 HA SER 126 -1.439 12.529 28.194 880 HB2 SER 126 HB1 SER 126 -0.434 14.657 27.716 881 HB3 SER 126 HB2 SER 126 -1.508 14.298 26.365 882 HG SER 126 HG SER 126 -1.580 16.351 28.093 883 H ALA 127 HN ALA 127 -4.126 14.492 29.298 884 HA ALA 127 HA ALA 127 -2.924 15.540 31.672 885 HB1 ALA 127 HB1 ALA 127 -4.952 16.566 31.303 886 HB2 ALA 127 HB2 ALA 127 -5.492 15.323 32.432 887 HB3 ALA 127 HB3 ALA 127 -5.705 15.091 30.696 888 H ASN 128 HN ASN 128 -4.068 12.368 30.841 889 HA ASN 128 HA ASN 128 -4.513 11.389 33.511 890 HB2 ASN 128 HB2 ASN 128 -3.753 9.936 30.959 891 HB3 ASN 128 HB1 ASN 128 -4.240 9.135 32.452 892 HD21 ASN 128 HD21 ASN 128 -5.784 8.830 30.068 893 HD22 ASN 128 HD22 ASN 128 -7.271 9.623 30.271 894 H ASP 129 HN ASP 129 -1.651 11.953 31.607 895 HA ASP 129 HA ASP 129 0.127 10.193 33.026 896 HB2 ASP 129 HB2 ASP 129 0.644 12.767 31.509 897 HB3 ASP 129 HB1 ASP 129 1.918 11.715 32.127 898 H VAL 130 HN VAL 130 -0.558 13.685 33.399 899 HA VAL 130 HA VAL 130 1.132 14.080 35.663 900 HB VAL 130 HB VAL 130 -0.378 16.060 36.110 901 HG11 VAL 130 HG21 VAL 130 0.606 15.610 33.276 902 HG12 VAL 130 HG22 VAL 130 1.538 16.282 34.613 903 HG13 VAL 130 HG23 VAL 130 0.176 17.184 33.945 904 HG21 VAL 130 HG11 VAL 130 -2.386 14.736 35.107 905 HG22 VAL 130 HG12 VAL 130 -1.771 15.292 33.550 906 HG23 VAL 130 HG13 VAL 130 -2.271 16.463 34.770 907 H TYR 131 HN TYR 131 -2.147 12.845 35.351 908 HA TYR 131 HA TYR 131 -2.094 11.495 37.851 909 HB2 TYR 131 HB2 TYR 131 -3.472 12.870 39.258 910 HB3 TYR 131 HB1 TYR 131 -2.174 13.905 38.662 911 HD1 TYR 131 HD1 TYR 131 -2.602 15.536 36.837 912 HD2 TYR 131 HD2 TYR 131 -5.762 13.207 38.582 913 HE1 TYR 131 HE1 TYR 131 -4.281 17.065 35.839 914 HE2 TYR 131 HE2 TYR 131 -7.440 14.736 37.583 915 HH TYR 131 HH TYR 131 -7.334 16.386 35.371 916 H ALA 132 HN ALA 132 -4.426 10.778 38.457 917 HA ALA 132 HA ALA 132 -5.720 9.898 36.000 918 HB1 ALA 132 HB1 ALA 132 -7.295 8.750 37.533 919 HB2 ALA 132 HB2 ALA 132 -6.552 9.581 38.900 920 HB3 ALA 132 HB3 ALA 132 -5.616 8.419 37.960 921 H SER 133 HN SER 133 -7.272 11.025 34.938 922 HA SER 133 HA SER 133 -8.237 13.556 35.712 923 HB2 SER 133 HB2 SER 133 -9.914 13.295 33.972 924 HB3 SER 133 HB1 SER 133 -8.410 12.561 33.411 925 HG SER 133 HG SER 133 -10.770 11.426 33.639 926 H ALA 134 HN ALA 134 -9.377 10.350 36.570 927 HA ALA 134 HA ALA 134 -11.970 11.028 37.522 928 HB1 ALA 134 HB1 ALA 134 -11.681 9.009 39.008 929 HB2 ALA 134 HB2 ALA 134 -10.010 8.909 38.450 930 HB3 ALA 134 HB3 ALA 134 -11.337 8.703 37.305 931 H GLY 135 HN GLY 135 -12.684 11.562 39.661 932 HA2 GLY 135 HA2 GLY 135 -10.799 13.265 41.123 933 HA3 GLY 135 HA1 GLY 135 -12.507 13.043 41.505 934 H SER 136 HN SER 136 -11.292 12.956 43.740 935 HA SER 136 HA SER 136 -9.766 10.703 44.518 936 HB2 SER 136 HB2 SER 136 -11.813 12.175 46.204 937 HB3 SER 136 HB1 SER 136 -10.455 11.220 46.800 938 HG SER 136 HG SER 136 -9.806 13.327 46.801 939 H GLY 137 HN GLY 137 -13.264 11.104 44.184 940 HA2 GLY 137 HA2 GLY 137 -13.814 8.397 43.677 941 HA3 GLY 137 HA1 GLY 137 -13.978 8.604 45.420 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 -16.572 7.745 -11.733 2 H2 GLY 1 HT2 GLY 1 -17.681 8.211 -10.533 3 H3 GLY 1 HT3 GLY 1 -16.621 6.912 -10.257 4 HA2 GLY 1 HA2 GLY 1 -16.203 9.712 -9.877 5 HA3 GLY 1 HA1 GLY 1 -15.269 8.347 -9.264 6 H MET 2 HN MET 2 -14.729 11.019 -10.883 7 HA MET 2 HA MET 2 -13.534 10.254 -13.360 8 HB2 MET 2 HB2 MET 2 -12.837 12.538 -11.487 9 HB3 MET 2 HB1 MET 2 -12.263 12.388 -13.148 10 HG2 MET 2 HG2 MET 2 -15.165 12.573 -12.280 11 HG3 MET 2 HG1 MET 2 -14.235 13.855 -13.054 12 HE1 MET 2 HE1 MET 2 -12.553 11.910 -15.467 13 HE2 MET 2 HE2 MET 2 -12.914 13.563 -14.978 14 HE3 MET 2 HE3 MET 2 -13.564 12.939 -16.490 15 H GLY 3 HN GLY 3 -12.357 10.163 -10.043 16 HA2 GLY 3 HA2 GLY 3 -9.641 9.415 -10.949 17 HA3 GLY 3 HA1 GLY 3 -10.137 9.669 -9.276 18 H GLN 4 HN GLN 4 -8.813 7.492 -9.275 19 HA GLN 4 HA GLN 4 -10.116 5.118 -10.271 20 HB2 GLN 4 HB1 GLN 4 -8.064 5.473 -8.067 21 HB3 GLN 4 HB2 GLN 4 -8.547 3.920 -8.748 22 HG2 GLN 4 HG1 GLN 4 -7.829 4.721 -10.997 23 HG3 GLN 4 HG2 GLN 4 -7.268 6.220 -10.256 24 HE21 GLN 4 HE21 GLN 4 -5.234 6.186 -9.182 25 HE22 GLN 4 HE22 GLN 4 -4.284 4.789 -9.009 26 H ALA 5 HN ALA 5 -10.517 7.073 -7.422 27 HA ALA 5 HA ALA 5 -12.818 5.415 -6.646 28 HB1 ALA 5 HB1 ALA 5 -10.922 6.013 -4.418 29 HB2 ALA 5 HB2 ALA 5 -10.526 4.667 -5.486 30 HB3 ALA 5 HB3 ALA 5 -12.051 4.672 -4.600 31 H ASN 6 HN ASN 6 -14.399 6.690 -5.728 32 HA ASN 6 HA ASN 6 -14.365 9.476 -5.917 33 HB2 ASN 6 HB1 ASN 6 -15.879 7.842 -3.857 34 HB3 ASN 6 HB2 ASN 6 -16.284 9.475 -4.385 35 HD21 ASN 6 HD21 ASN 6 -15.932 9.265 -7.171 36 HD22 ASN 6 HD22 ASN 6 -17.061 8.160 -7.789 37 H THR 7 HN THR 7 -13.164 7.443 -3.305 38 HA THR 7 HA THR 7 -12.054 9.908 -2.039 39 HB THR 7 HB THR 7 -14.095 8.787 -0.854 40 HG1 THR 7 HG1 THR 7 -12.883 10.322 0.174 41 HG21 THR 7 HG21 THR 7 -13.870 6.707 -0.018 42 HG22 THR 7 HG22 THR 7 -12.275 7.071 0.642 43 HG23 THR 7 HG23 THR 7 -12.440 6.558 -1.037 44 HA PRO 8 HA PRO 8 -8.159 7.814 -2.266 45 HB2 PRO 8 HB2 PRO 8 -6.909 8.760 -0.060 46 HB3 PRO 8 HB1 PRO 8 -7.167 9.725 -1.516 47 HG2 PRO 8 HG2 PRO 8 -8.756 9.671 1.028 48 HG3 PRO 8 HG1 PRO 8 -8.204 11.067 0.094 49 HD2 PRO 8 HD2 PRO 8 -10.726 10.175 -0.101 50 HD3 PRO 8 HD1 PRO 8 -9.875 10.821 -1.502 51 H TRP 9 HN TRP 9 -9.842 7.626 0.879 52 HA TRP 9 HA TRP 9 -8.260 5.266 1.626 53 HB2 TRP 9 HB2 TRP 9 -9.692 5.225 3.645 54 HB3 TRP 9 HB1 TRP 9 -8.959 6.807 3.390 55 HD1 TRP 9 HD1 TRP 9 -12.300 4.976 3.194 56 HE1 TRP 9 HE1 TRP 9 -14.193 6.723 3.079 57 HE3 TRP 9 HE3 TRP 9 -9.535 9.234 2.674 58 HZ2 TRP 9 HZ2 TRP 9 -14.493 9.556 2.802 59 HZ3 TRP 9 HZ3 TRP 9 -10.645 11.437 2.486 60 HH2 TRP 9 HH2 TRP 9 -13.118 11.605 2.548 61 H SER 10 HN SER 10 -10.315 5.442 -0.727 62 HA SER 10 HA SER 10 -12.088 3.193 0.060 63 HB2 SER 10 HB1 SER 10 -12.024 5.164 -2.199 64 HB3 SER 10 HB2 SER 10 -12.810 3.608 -2.463 65 HG SER 10 HG SER 10 -14.190 5.299 -1.616 66 H SER 11 HN SER 11 -9.400 4.011 -2.061 67 HA SER 11 HA SER 11 -9.108 1.100 -2.682 68 HB2 SER 11 HB2 SER 11 -8.199 1.694 -4.851 69 HB3 SER 11 HB1 SER 11 -9.749 2.515 -4.669 70 HG SER 11 HG SER 11 -7.974 3.844 -5.437 71 H LYS 12 HN LYS 12 -6.794 0.467 -3.018 72 HA LYS 12 HA LYS 12 -5.124 1.605 -0.929 73 HB2 LYS 12 HB1 LYS 12 -4.265 -0.309 -3.108 74 HB3 LYS 12 HB2 LYS 12 -3.539 -0.101 -1.514 75 HG2 LYS 12 HG2 LYS 12 -5.458 -1.027 -0.422 76 HG3 LYS 12 HG1 LYS 12 -6.409 -0.971 -1.903 77 HD2 LYS 12 HD2 LYS 12 -4.081 -2.791 -1.253 78 HD3 LYS 12 HD1 LYS 12 -5.734 -3.250 -1.664 79 HE2 LYS 12 HE2 LYS 12 -5.360 -2.182 -3.932 80 HE3 LYS 12 HE1 LYS 12 -3.658 -2.021 -3.498 81 HZ1 LYS 12 HZ1 LYS 12 -4.879 -4.230 -4.588 82 HZ2 LYS 12 HZ2 LYS 12 -4.613 -4.643 -2.962 83 HZ3 LYS 12 HZ3 LYS 12 -3.313 -4.152 -3.939 84 H ALA 13 HN ALA 13 -5.099 1.686 -4.482 85 HA ALA 13 HA ALA 13 -2.640 3.120 -4.750 86 HB1 ALA 13 HB1 ALA 13 -3.321 2.287 -6.793 87 HB2 ALA 13 HB2 ALA 13 -3.943 3.931 -6.943 88 HB3 ALA 13 HB3 ALA 13 -5.024 2.617 -6.478 89 H ASN 14 HN ASN 14 -6.019 4.234 -4.514 90 HA ASN 14 HA ASN 14 -5.334 7.038 -4.697 91 HB2 ASN 14 HB1 ASN 14 -7.650 5.731 -4.972 92 HB3 ASN 14 HB2 ASN 14 -7.808 6.170 -3.271 93 HD21 ASN 14 HD21 ASN 14 -9.517 7.744 -3.797 94 HD22 ASN 14 HD22 ASN 14 -9.111 9.244 -4.478 95 H ALA 15 HN ALA 15 -5.945 4.820 -1.980 96 HA ALA 15 HA ALA 15 -5.745 6.846 0.054 97 HB1 ALA 15 HB1 ALA 15 -6.621 4.336 0.128 98 HB2 ALA 15 HB2 ALA 15 -5.971 5.113 1.571 99 HB3 ALA 15 HB3 ALA 15 -4.960 4.019 0.628 100 H ASP 16 HN ASP 16 -3.385 4.673 -1.445 101 HA ASP 16 HA ASP 16 -1.199 5.136 0.277 102 HB2 ASP 16 HB2 ASP 16 -1.180 3.481 -1.569 103 HB3 ASP 16 HB1 ASP 16 -1.134 4.800 -2.739 104 H ALA 17 HN ALA 17 -1.933 6.910 -2.763 105 HA ALA 17 HA ALA 17 0.063 8.887 -2.479 106 HB1 ALA 17 HB1 ALA 17 -0.890 9.271 -4.502 107 HB2 ALA 17 HB2 ALA 17 -2.050 10.262 -3.616 108 HB3 ALA 17 HB3 ALA 17 -2.434 8.584 -3.997 109 H PHE 18 HN PHE 18 -3.184 8.687 -1.084 110 HA PHE 18 HA PHE 18 -3.278 11.308 0.045 111 HB2 PHE 18 HB2 PHE 18 -5.217 9.715 -0.111 112 HB3 PHE 18 HB1 PHE 18 -4.489 8.771 1.188 113 HD1 PHE 18 HD2 PHE 18 -6.113 11.964 0.308 114 HD2 PHE 18 HD1 PHE 18 -4.424 9.605 3.475 115 HE1 PHE 18 HE2 PHE 18 -7.128 13.485 1.983 116 HE2 PHE 18 HE1 PHE 18 -5.440 11.125 5.149 117 HZ PHE 18 HZ PHE 18 -6.792 13.065 4.403 118 H ILE 19 HN ILE 19 -2.148 8.205 1.412 119 HA ILE 19 HA ILE 19 -1.361 9.262 3.949 120 HB ILE 19 HB ILE 19 -0.127 6.931 2.451 121 HG12 ILE 19 HG12 ILE 19 -2.475 6.510 2.543 122 HG13 ILE 19 HG11 ILE 19 -1.781 5.617 3.895 123 HG21 ILE 19 HG21 ILE 19 -0.419 6.948 5.402 124 HG22 ILE 19 HG22 ILE 19 0.755 8.090 4.746 125 HG23 ILE 19 HG23 ILE 19 0.915 6.368 4.406 126 HD11 ILE 19 HD11 ILE 19 -3.168 8.308 4.006 127 HD12 ILE 19 HD12 ILE 19 -2.310 7.590 5.370 128 HD13 ILE 19 HD13 ILE 19 -3.735 6.793 4.704 129 H ASN 20 HN ASN 20 0.479 8.739 0.941 130 HA ASN 20 HA ASN 20 2.951 9.787 1.979 131 HB2 ASN 20 HB2 ASN 20 3.286 8.505 0.081 132 HB3 ASN 20 HB1 ASN 20 1.845 9.115 -0.722 133 HD21 ASN 20 HD21 ASN 20 2.415 10.327 -2.512 134 HD22 ASN 20 HD22 ASN 20 3.691 11.447 -2.568 135 H SER 21 HN SER 21 0.437 11.241 -0.117 136 HA SER 21 HA SER 21 1.576 13.817 -0.329 137 HB2 SER 21 HB2 SER 21 -0.442 13.055 -1.582 138 HB3 SER 21 HB1 SER 21 -1.374 13.143 -0.087 139 HG SER 21 HG SER 21 0.113 15.355 -0.978 140 H PHE 22 HN PHE 22 -0.135 12.279 2.309 141 HA PHE 22 HA PHE 22 -0.608 14.701 3.824 142 HB2 PHE 22 HB1 PHE 22 -1.942 12.729 4.284 143 HB3 PHE 22 HB2 PHE 22 -0.496 11.789 4.654 144 HD1 PHE 22 HD2 PHE 22 0.870 12.336 6.673 145 HD2 PHE 22 HD1 PHE 22 -2.905 14.230 5.891 146 HE1 PHE 22 HE2 PHE 22 0.764 13.094 9.031 147 HE2 PHE 22 HE1 PHE 22 -3.013 14.988 8.251 148 HZ PHE 22 HZ PHE 22 -1.179 14.420 9.821 149 H ILE 23 HN ILE 23 1.823 12.085 4.156 150 HA ILE 23 HA ILE 23 3.274 13.324 6.275 151 HB ILE 23 HB ILE 23 4.349 11.496 4.111 152 HG12 ILE 23 HG11 ILE 23 3.173 10.806 6.821 153 HG13 ILE 23 HG12 ILE 23 2.330 10.603 5.285 154 HG21 ILE 23 HG21 ILE 23 5.439 11.208 6.787 155 HG22 ILE 23 HG22 ILE 23 5.649 12.856 6.195 156 HG23 ILE 23 HG23 ILE 23 6.285 11.498 5.267 157 HD11 ILE 23 HD11 ILE 23 3.689 8.590 6.350 158 HD12 ILE 23 HD12 ILE 23 5.060 9.403 5.595 159 HD13 ILE 23 HD13 ILE 23 3.705 8.857 4.606 160 H SER 24 HN SER 24 4.051 13.257 2.772 161 HA SER 24 HA SER 24 6.233 15.068 2.917 162 HB2 SER 24 HB2 SER 24 4.288 14.755 0.612 163 HB3 SER 24 HB1 SER 24 5.941 15.359 0.519 164 HG SER 24 HG SER 24 6.713 13.370 0.972 165 H ALA 25 HN ALA 25 2.753 15.666 2.619 166 HA ALA 25 HA ALA 25 3.100 18.535 2.235 167 HB1 ALA 25 HB1 ALA 25 0.670 16.874 2.958 168 HB2 ALA 25 HB2 ALA 25 1.104 17.461 1.352 169 HB3 ALA 25 HB3 ALA 25 0.624 18.602 2.609 170 H ALA 26 HN ALA 26 2.085 16.465 4.967 171 HA ALA 26 HA ALA 26 1.695 18.601 6.823 172 HB1 ALA 26 HB1 ALA 26 2.601 15.786 7.476 173 HB2 ALA 26 HB2 ALA 26 0.929 16.220 7.124 174 HB3 ALA 26 HB3 ALA 26 1.737 16.899 8.537 175 H SER 27 HN SER 27 4.591 16.814 5.871 176 HA SER 27 HA SER 27 6.279 17.711 7.997 177 HB2 SER 27 HB1 SER 27 7.043 17.027 5.143 178 HB3 SER 27 HB2 SER 27 8.139 17.085 6.523 179 HG SER 27 HG SER 27 6.916 15.006 5.741 180 H ASN 28 HN ASN 28 5.205 19.262 5.040 181 HA ASN 28 HA ASN 28 7.077 21.523 5.573 182 HB2 ASN 28 HB2 ASN 28 5.513 20.713 3.114 183 HB3 ASN 28 HB1 ASN 28 6.346 22.261 3.250 184 HD21 ASN 28 HD21 ASN 28 7.254 20.558 1.257 185 HD22 ASN 28 HD22 ASN 28 8.719 19.823 1.697 186 H THR 29 HN THR 29 4.098 20.708 6.557 187 HA THR 29 HA THR 29 2.797 23.290 5.924 188 HB THR 29 HB THR 29 1.709 21.049 7.642 189 HG1 THR 29 HG1 THR 29 2.006 20.095 5.731 190 HG21 THR 29 HG21 THR 29 0.789 23.583 7.309 191 HG22 THR 29 HG22 THR 29 -0.262 22.200 7.607 192 HG23 THR 29 HG23 THR 29 -0.009 22.775 5.960 193 H GLY 30 HN GLY 30 2.841 21.509 9.020 194 HA2 GLY 30 HA1 GLY 30 3.048 24.069 10.441 195 HA3 GLY 30 HA2 GLY 30 2.840 22.484 11.186 196 H SER 31 HN SER 31 4.639 21.472 11.994 197 HA SER 31 HA SER 31 7.309 22.553 11.211 198 HB2 SER 31 HB1 SER 31 7.606 21.842 13.874 199 HB3 SER 31 HB2 SER 31 7.433 23.491 13.270 200 HG SER 31 HG SER 31 5.329 21.760 14.060 201 H PHE 32 HN PHE 32 5.839 19.985 13.241 202 HA PHE 32 HA PHE 32 6.525 17.742 13.505 203 HB2 PHE 32 HB1 PHE 32 6.419 18.257 10.542 204 HB3 PHE 32 HB2 PHE 32 6.918 16.677 11.145 205 HD1 PHE 32 HD2 PHE 32 5.326 15.989 13.334 206 HD2 PHE 32 HD1 PHE 32 4.171 18.339 9.925 207 HE1 PHE 32 HE2 PHE 32 2.956 15.375 13.714 208 HE2 PHE 32 HE1 PHE 32 1.800 17.723 10.307 209 HZ PHE 32 HZ PHE 32 1.193 16.241 12.200 210 H SER 33 HN SER 33 8.534 18.096 14.606 211 HA SER 33 HA SER 33 10.988 18.791 13.348 212 HB2 SER 33 HB1 SER 33 12.051 18.089 15.353 213 HB3 SER 33 HB2 SER 33 10.457 18.645 15.862 214 HG SER 33 HG SER 33 11.555 16.180 16.022 215 H GLN 34 HN GLN 34 12.847 17.313 12.940 216 HA GLN 34 HA GLN 34 12.262 15.274 11.094 217 HB2 GLN 34 HB1 GLN 34 14.697 15.605 12.872 218 HB3 GLN 34 HB2 GLN 34 14.612 14.494 11.505 219 HG2 GLN 34 HG2 GLN 34 14.148 16.387 9.992 220 HG3 GLN 34 HG1 GLN 34 14.220 17.501 11.357 221 HE21 GLN 34 HE21 GLN 34 16.030 17.777 9.167 222 HE22 GLN 34 HE22 GLN 34 17.594 17.380 9.693 223 H ASP 35 HN ASP 35 12.825 15.030 14.597 224 HA ASP 35 HA ASP 35 12.775 12.194 14.790 225 HB2 ASP 35 HB1 ASP 35 11.891 14.335 16.743 226 HB3 ASP 35 HB2 ASP 35 11.975 12.622 17.154 227 H GLN 36 HN GLN 36 10.162 14.572 14.609 228 HA GLN 36 HA GLN 36 8.052 12.664 15.167 229 HB2 GLN 36 HB1 GLN 36 7.924 15.328 13.716 230 HB3 GLN 36 HB2 GLN 36 6.545 14.433 14.357 231 HG2 GLN 36 HG2 GLN 36 8.849 15.568 15.970 232 HG3 GLN 36 HG1 GLN 36 7.196 16.181 15.942 233 HE21 GLN 36 HE21 GLN 36 9.145 14.492 17.931 234 HE22 GLN 36 HE22 GLN 36 8.018 13.441 18.645 235 H MET 37 HN MET 37 9.725 13.765 12.268 236 HA MET 37 HA MET 37 7.903 12.682 10.343 237 HB2 MET 37 HB1 MET 37 10.901 13.128 10.210 238 HB3 MET 37 HB2 MET 37 9.906 12.686 8.823 239 HG2 MET 37 HG2 MET 37 8.499 14.722 9.271 240 HG3 MET 37 HG1 MET 37 9.654 15.187 10.519 241 HE1 MET 37 HE1 MET 37 8.731 16.907 8.295 242 HE2 MET 37 HE2 MET 37 10.104 17.559 7.404 243 HE3 MET 37 HE3 MET 37 10.109 17.591 9.165 244 H GLU 38 HN GLU 38 10.535 11.263 12.219 245 HA GLU 38 HA GLU 38 10.788 8.800 10.831 246 HB2 GLU 38 HB1 GLU 38 11.082 9.438 13.781 247 HB3 GLU 38 HB2 GLU 38 11.548 7.898 13.060 248 HG2 GLU 38 HG2 GLU 38 12.652 10.629 12.331 249 HG3 GLU 38 HG1 GLU 38 13.506 9.360 13.207 250 H ASN 39 HN ASN 39 8.604 9.731 13.495 251 HA ASN 39 HA ASN 39 7.310 7.235 13.827 252 HB2 ASN 39 HB2 ASN 39 6.157 10.028 14.081 253 HB3 ASN 39 HB1 ASN 39 5.400 8.564 14.706 254 HD21 ASN 39 HD21 ASN 39 6.402 10.873 16.300 255 HD22 ASN 39 HD22 ASN 39 7.627 10.274 17.309 256 H MET 40 HN MET 40 6.595 9.902 11.593 257 HA MET 40 HA MET 40 4.249 8.793 10.429 258 HB2 MET 40 HB2 MET 40 6.382 10.543 9.163 259 HB3 MET 40 HB1 MET 40 4.785 10.242 8.478 260 HG2 MET 40 HG2 MET 40 3.763 11.175 10.558 261 HG3 MET 40 HG1 MET 40 5.381 11.568 11.141 262 HE1 MET 40 HE1 MET 40 3.886 13.445 11.507 263 HE2 MET 40 HE2 MET 40 3.277 14.595 10.319 264 HE3 MET 40 HE3 MET 40 4.927 14.749 10.920 265 H SER 41 HN SER 41 7.661 8.158 9.870 266 HA SER 41 HA SER 41 7.288 6.627 7.447 267 HB2 SER 41 HB2 SER 41 9.577 6.047 7.656 268 HB3 SER 41 HB1 SER 41 9.473 7.654 8.374 269 HG SER 41 HG SER 41 10.484 6.564 9.910 270 H LEU 42 HN LEU 42 6.906 5.956 10.835 271 HA LEU 42 HA LEU 42 6.944 3.032 10.413 272 HB2 LEU 42 HB1 LEU 42 7.890 3.947 12.493 273 HB3 LEU 42 HB2 LEU 42 6.336 4.685 12.885 274 HG LEU 42 HG LEU 42 5.406 2.253 12.622 275 HD11 LEU 42 HD11 LEU 42 8.377 1.812 13.012 276 HD12 LEU 42 HD12 LEU 42 7.361 1.182 11.715 277 HD13 LEU 42 HD13 LEU 42 7.164 0.581 13.360 278 HD21 LEU 42 HD21 LEU 42 5.528 2.011 14.944 279 HD22 LEU 42 HD22 LEU 42 5.846 3.735 14.748 280 HD23 LEU 42 HD23 LEU 42 7.183 2.617 15.018 281 H ILE 43 HN ILE 43 4.646 5.650 10.644 282 HA ILE 43 HA ILE 43 2.451 3.629 10.422 283 HB ILE 43 HB ILE 43 2.533 6.236 11.952 284 HG12 ILE 43 HG12 ILE 43 1.652 3.447 12.750 285 HG13 ILE 43 HG11 ILE 43 3.264 4.096 13.050 286 HG21 ILE 43 HG21 ILE 43 0.005 5.270 12.334 287 HG22 ILE 43 HG22 ILE 43 0.263 4.871 10.636 288 HG23 ILE 43 HG23 ILE 43 0.407 6.541 11.181 289 HD11 ILE 43 HD11 ILE 43 0.961 4.418 14.660 290 HD12 ILE 43 HD12 ILE 43 1.272 5.992 13.927 291 HD13 ILE 43 HD13 ILE 43 2.530 5.195 14.871 292 H GLY 44 HN GLY 44 0.749 4.191 8.968 293 HA2 GLY 44 HA1 GLY 44 -0.318 5.622 7.338 294 HA3 GLY 44 HA2 GLY 44 1.105 6.666 7.365 295 H ASN 45 HN ASN 45 3.099 5.784 6.361 296 HA ASN 45 HA ASN 45 2.609 4.613 3.801 297 HB2 ASN 45 HB2 ASN 45 5.176 4.782 5.416 298 HB3 ASN 45 HB1 ASN 45 5.092 4.328 3.713 299 HD21 ASN 45 HD21 ASN 45 6.370 6.767 4.950 300 HD22 ASN 45 HD22 ASN 45 5.641 8.084 4.169 301 H THR 46 HN THR 46 3.344 3.263 6.950 302 HA THR 46 HA THR 46 4.004 0.606 6.062 303 HB THR 46 HB THR 46 2.752 1.433 8.696 304 HG1 THR 46 HG1 THR 46 4.870 2.395 7.815 305 HG21 THR 46 HG21 THR 46 2.905 -0.754 9.184 306 HG22 THR 46 HG22 THR 46 4.649 -0.667 8.930 307 HG23 THR 46 HG23 THR 46 3.581 -1.082 7.589 308 H LEU 47 HN LEU 47 0.991 2.273 6.818 309 HA LEU 47 HA LEU 47 -0.796 0.109 6.948 310 HB2 LEU 47 HB2 LEU 47 -1.242 2.790 5.596 311 HB3 LEU 47 HB1 LEU 47 -2.510 1.684 6.127 312 HG LEU 47 HG LEU 47 -0.480 3.095 7.882 313 HD11 LEU 47 HD11 LEU 47 -3.061 3.814 6.938 314 HD12 LEU 47 HD12 LEU 47 -2.093 4.640 8.158 315 HD13 LEU 47 HD13 LEU 47 -3.240 3.390 8.640 316 HD21 LEU 47 HD21 LEU 47 -0.705 1.131 9.063 317 HD22 LEU 47 HD22 LEU 47 -2.267 0.752 8.340 318 HD23 LEU 47 HD23 LEU 47 -2.161 1.948 9.631 319 H MET 48 HN MET 48 0.775 1.563 4.143 320 HA MET 48 HA MET 48 -0.796 0.385 2.096 321 HB2 MET 48 HB2 MET 48 1.046 2.083 1.766 322 HB3 MET 48 HB1 MET 48 2.211 0.785 2.020 323 HG2 MET 48 HG2 MET 48 0.976 -0.470 0.149 324 HG3 MET 48 HG1 MET 48 0.191 1.069 -0.211 325 HE1 MET 48 HE1 MET 48 3.241 2.941 0.694 326 HE2 MET 48 HE2 MET 48 1.568 3.136 0.182 327 HE3 MET 48 HE3 MET 48 2.873 3.495 -0.944 328 H ALA 49 HN ALA 49 2.090 -0.877 3.780 329 HA ALA 49 HA ALA 49 2.150 -3.388 2.401 330 HB1 ALA 49 HB1 ALA 49 3.433 -2.187 4.746 331 HB2 ALA 49 HB2 ALA 49 4.087 -3.336 3.577 332 HB3 ALA 49 HB3 ALA 49 3.135 -3.915 4.945 333 H ALA 50 HN ALA 50 0.248 -2.165 5.062 334 HA ALA 50 HA ALA 50 -0.679 -4.701 6.066 335 HB1 ALA 50 HB1 ALA 50 -1.027 -2.859 7.509 336 HB2 ALA 50 HB2 ALA 50 -2.640 -3.214 6.889 337 HB3 ALA 50 HB3 ALA 50 -1.714 -1.870 6.220 338 H MET 51 HN MET 51 -1.851 -2.483 3.556 339 HA MET 51 HA MET 51 -4.347 -3.680 3.016 340 HB2 MET 51 HB2 MET 51 -2.397 -2.570 0.971 341 HB3 MET 51 HB1 MET 51 -4.140 -2.745 0.765 342 HG2 MET 51 HG2 MET 51 -2.692 -0.920 2.703 343 HG3 MET 51 HG1 MET 51 -3.722 -0.446 1.352 344 HE1 MET 51 HE1 MET 51 -6.397 -0.612 1.356 345 HE2 MET 51 HE2 MET 51 -7.183 -1.820 2.368 346 HE3 MET 51 HE3 MET 51 -5.907 -2.308 1.256 347 H ASP 52 HN ASP 52 -1.097 -4.746 2.248 348 HA ASP 52 HA ASP 52 -1.684 -6.680 0.255 349 HB2 ASP 52 HB2 ASP 52 0.618 -5.966 1.012 350 HB3 ASP 52 HB1 ASP 52 0.386 -6.958 2.452 351 H ASN 53 HN ASN 53 -2.211 -6.689 3.709 352 HA ASN 53 HA ASN 53 -2.593 -9.535 3.999 353 HB2 ASN 53 HB2 ASN 53 -3.752 -7.272 5.655 354 HB3 ASN 53 HB1 ASN 53 -3.637 -8.963 6.142 355 HD21 ASN 53 HD21 ASN 53 -1.053 -9.652 5.360 356 HD22 ASN 53 HD22 ASN 53 0.070 -8.709 6.212 357 H MET 54 HN MET 54 -4.589 -6.910 2.859 358 HA MET 54 HA MET 54 -7.179 -7.933 3.233 359 HB2 MET 54 HB2 MET 54 -6.140 -6.552 0.738 360 HB3 MET 54 HB1 MET 54 -7.826 -6.652 1.248 361 HG2 MET 54 HG2 MET 54 -5.607 -5.333 2.846 362 HG3 MET 54 HG1 MET 54 -6.784 -4.470 1.856 363 HE1 MET 54 HE1 MET 54 -9.323 -6.518 2.368 364 HE2 MET 54 HE2 MET 54 -9.299 -4.784 2.062 365 HE3 MET 54 HE3 MET 54 -10.163 -5.412 3.464 366 H GLY 55 HN GLY 55 -4.625 -9.117 1.201 367 HA2 GLY 55 HA2 GLY 55 -4.536 -11.208 0.092 368 HA3 GLY 55 HA1 GLY 55 -6.224 -11.474 0.530 369 H GLY 56 HN GLY 56 -5.818 -8.416 -0.835 370 HA2 GLY 56 HA2 GLY 56 -5.844 -7.756 -3.175 371 HA3 GLY 56 HA1 GLY 56 -6.304 -9.404 -3.600 372 H ARG 57 HN ARG 57 -7.835 -7.731 -0.927 373 HA ARG 57 HA ARG 57 -10.229 -7.217 -2.626 374 HB2 ARG 57 HB2 ARG 57 -11.694 -8.260 -1.012 375 HB3 ARG 57 HB1 ARG 57 -10.436 -9.426 -1.420 376 HG2 ARG 57 HG2 ARG 57 -9.182 -8.333 0.629 377 HG3 ARG 57 HG1 ARG 57 -10.808 -7.844 1.103 378 HD2 ARG 57 HD2 ARG 57 -11.558 -10.187 0.983 379 HD3 ARG 57 HD1 ARG 57 -9.942 -10.686 0.479 380 HE ARG 57 HE ARG 57 -9.475 -10.761 2.781 381 HH11 ARG 57 HH21 ARG 57 -12.428 -9.311 2.741 382 HH12 ARG 57 HH22 ARG 57 -12.135 -8.203 4.039 383 HH21 ARG 57 HH11 ARG 57 -8.728 -8.836 4.160 384 HH22 ARG 57 HH12 ARG 57 -10.039 -7.934 4.843 385 H ILE 58 HN ILE 58 -10.511 -5.048 -2.435 386 HA ILE 58 HA ILE 58 -10.177 -3.848 0.284 387 HB ILE 58 HB ILE 58 -9.932 -2.403 -2.365 388 HG12 ILE 58 HG12 ILE 58 -8.166 -4.055 -2.284 389 HG13 ILE 58 HG11 ILE 58 -7.461 -2.493 -1.871 390 HG21 ILE 58 HG21 ILE 58 -10.345 -1.399 0.136 391 HG22 ILE 58 HG22 ILE 58 -9.455 -0.545 -1.124 392 HG23 ILE 58 HG23 ILE 58 -8.584 -1.468 0.100 393 HD11 ILE 58 HD11 ILE 58 -7.675 -4.905 -0.249 394 HD12 ILE 58 HD12 ILE 58 -8.359 -3.503 0.573 395 HD13 ILE 58 HD13 ILE 58 -6.687 -3.469 0.013 396 H THR 59 HN THR 59 -11.877 -2.611 1.065 397 HA THR 59 HA THR 59 -14.101 -1.920 -0.759 398 HB THR 59 HB THR 59 -15.734 -2.915 0.941 399 HG1 THR 59 HG1 THR 59 -13.395 -4.340 1.671 400 HG21 THR 59 HG21 THR 59 -14.682 -3.943 -1.326 401 HG22 THR 59 HG22 THR 59 -15.891 -4.788 -0.360 402 HG23 THR 59 HG23 THR 59 -14.182 -5.184 -0.177 403 HA PRO 60 HA PRO 60 -14.396 1.713 1.738 404 HB2 PRO 60 HB2 PRO 60 -17.071 2.138 1.827 405 HB3 PRO 60 HB1 PRO 60 -16.091 2.436 0.388 406 HG2 PRO 60 HG2 PRO 60 -17.773 0.046 1.072 407 HG3 PRO 60 HG1 PRO 60 -17.683 0.937 -0.452 408 HD2 PRO 60 HD2 PRO 60 -16.364 -1.373 -0.130 409 HD3 PRO 60 HD1 PRO 60 -15.658 -0.045 -1.053 410 H SER 61 HN SER 61 -17.013 -0.553 2.685 411 HA SER 61 HA SER 61 -17.325 0.337 5.331 412 HB2 SER 61 HB2 SER 61 -17.485 -2.523 4.329 413 HB3 SER 61 HB1 SER 61 -18.193 -1.917 5.827 414 HG SER 61 HG SER 61 -19.332 -1.959 3.512 415 H LYS 62 HN LYS 62 -15.069 -2.148 4.096 416 HA LYS 62 HA LYS 62 -13.836 -2.466 6.730 417 HB2 LYS 62 HB2 LYS 62 -13.001 -3.477 3.996 418 HB3 LYS 62 HB1 LYS 62 -12.255 -3.954 5.521 419 HG2 LYS 62 HG2 LYS 62 -14.456 -4.806 6.303 420 HG3 LYS 62 HG1 LYS 62 -15.158 -4.377 4.744 421 HD2 LYS 62 HD2 LYS 62 -13.535 -5.888 3.621 422 HD3 LYS 62 HD1 LYS 62 -12.895 -6.346 5.199 423 HE2 LYS 62 HE2 LYS 62 -14.502 -8.029 4.494 424 HE3 LYS 62 HE1 LYS 62 -15.192 -7.122 5.840 425 HZ1 LYS 62 HZ1 LYS 62 -16.429 -5.780 4.285 426 HZ2 LYS 62 HZ2 LYS 62 -16.773 -7.422 4.022 427 HZ3 LYS 62 HZ3 LYS 62 -15.731 -6.591 2.969 428 H LEU 63 HN LEU 63 -12.707 -1.202 3.570 429 HA LEU 63 HA LEU 63 -10.194 -0.256 4.495 430 HB2 LEU 63 HB2 LEU 63 -11.109 -0.432 2.075 431 HB3 LEU 63 HB1 LEU 63 -11.791 1.166 2.368 432 HG LEU 63 HG LEU 63 -9.590 2.077 2.832 433 HD11 LEU 63 HD21 LEU 63 -8.805 -0.830 2.752 434 HD12 LEU 63 HD22 LEU 63 -8.421 0.386 3.970 435 HD13 LEU 63 HD23 LEU 63 -7.612 0.422 2.403 436 HD21 LEU 63 HD11 LEU 63 -8.513 0.860 0.557 437 HD22 LEU 63 HD12 LEU 63 -9.528 2.302 0.584 438 HD23 LEU 63 HD13 LEU 63 -10.258 0.714 0.343 439 H GLN 64 HN GLN 64 -13.398 1.261 4.542 440 HA GLN 64 HA GLN 64 -12.634 3.887 5.260 441 HB2 GLN 64 HB2 GLN 64 -14.964 3.250 4.738 442 HB3 GLN 64 HB1 GLN 64 -15.042 2.314 6.230 443 HG2 GLN 64 HG2 GLN 64 -14.679 4.335 7.557 444 HG3 GLN 64 HG1 GLN 64 -14.482 5.293 6.089 445 HE21 GLN 64 HE21 GLN 64 -16.474 6.271 7.589 446 HE22 GLN 64 HE22 GLN 64 -18.008 5.778 7.058 447 H ALA 65 HN ALA 65 -12.692 0.933 7.142 448 HA ALA 65 HA ALA 65 -12.540 2.137 9.744 449 HB1 ALA 65 HB1 ALA 65 -12.006 -0.023 10.540 450 HB2 ALA 65 HB2 ALA 65 -11.236 -0.486 9.023 451 HB3 ALA 65 HB3 ALA 65 -12.991 -0.336 9.110 452 H LEU 66 HN LEU 66 -10.061 1.155 7.387 453 HA LEU 66 HA LEU 66 -7.817 1.754 9.087 454 HB2 LEU 66 HB2 LEU 66 -7.652 0.351 7.037 455 HB3 LEU 66 HB1 LEU 66 -7.959 1.784 6.056 456 HG LEU 66 HG LEU 66 -5.752 1.878 8.081 457 HD11 LEU 66 HD11 LEU 66 -4.758 0.077 7.128 458 HD12 LEU 66 HD12 LEU 66 -4.476 1.137 5.747 459 HD13 LEU 66 HD13 LEU 66 -5.880 0.071 5.768 460 HD21 LEU 66 HD21 LEU 66 -5.508 3.862 7.041 461 HD22 LEU 66 HD22 LEU 66 -6.738 3.433 5.853 462 HD23 LEU 66 HD23 LEU 66 -5.054 2.988 5.578 463 H ASP 67 HN ASP 67 -9.616 3.651 6.672 464 HA ASP 67 HA ASP 67 -8.033 5.947 6.531 465 HB2 ASP 67 HB1 ASP 67 -10.298 5.465 5.394 466 HB3 ASP 67 HB2 ASP 67 -11.031 6.113 6.861 467 H MET 68 HN MET 68 -10.494 5.186 9.010 468 HA MET 68 HA MET 68 -10.109 7.563 10.550 469 HB2 MET 68 HB1 MET 68 -10.976 4.805 11.473 470 HB3 MET 68 HB2 MET 68 -11.184 6.302 12.384 471 HG2 MET 68 HG2 MET 68 -12.560 7.213 10.525 472 HG3 MET 68 HG1 MET 68 -12.392 5.679 9.670 473 HE1 MET 68 HE1 MET 68 -14.667 6.556 13.545 474 HE2 MET 68 HE2 MET 68 -13.706 7.657 12.561 475 HE3 MET 68 HE3 MET 68 -12.902 6.452 13.565 476 H ALA 69 HN ALA 69 -8.521 4.385 10.661 477 HA ALA 69 HA ALA 69 -6.998 4.788 13.024 478 HB1 ALA 69 HB1 ALA 69 -6.049 2.800 12.477 479 HB2 ALA 69 HB2 ALA 69 -5.585 3.363 10.871 480 HB3 ALA 69 HB3 ALA 69 -7.222 2.773 11.161 481 H PHE 70 HN PHE 70 -6.278 5.649 9.642 482 HA PHE 70 HA PHE 70 -3.637 6.602 10.055 483 HB2 PHE 70 HB1 PHE 70 -4.656 6.283 7.815 484 HB3 PHE 70 HB2 PHE 70 -5.711 7.664 8.112 485 HD1 PHE 70 HD1 PHE 70 -2.116 6.658 7.936 486 HD2 PHE 70 HD2 PHE 70 -4.965 9.863 7.688 487 HE1 PHE 70 HE1 PHE 70 -0.323 8.191 7.171 488 HE2 PHE 70 HE2 PHE 70 -3.172 11.397 6.923 489 HZ PHE 70 HZ PHE 70 -0.852 10.561 6.664 490 H ALA 71 HN ALA 71 -6.766 8.271 10.384 491 HA ALA 71 HA ALA 71 -5.679 10.862 10.931 492 HB1 ALA 71 HB1 ALA 71 -7.942 11.177 12.132 493 HB2 ALA 71 HB2 ALA 71 -8.303 9.531 11.613 494 HB3 ALA 71 HB3 ALA 71 -7.992 10.787 10.413 495 H SER 72 HN SER 72 -6.360 8.076 13.002 496 HA SER 72 HA SER 72 -5.911 9.459 15.494 497 HB2 SER 72 HB2 SER 72 -5.590 6.507 14.874 498 HB3 SER 72 HB1 SER 72 -5.778 7.222 16.475 499 HG SER 72 HG SER 72 -7.825 7.025 16.136 500 H SER 73 HN SER 73 -3.806 7.636 13.288 501 HA SER 73 HA SER 73 -1.495 7.727 15.013 502 HB2 SER 73 HB2 SER 73 -1.573 7.465 11.996 503 HB3 SER 73 HB1 SER 73 -0.245 6.997 13.059 504 HG SER 73 HG SER 73 -2.555 5.679 12.459 505 H VAL 74 HN VAL 74 -2.473 9.668 12.187 506 HA VAL 74 HA VAL 74 -0.250 11.425 12.175 507 HB VAL 74 HB VAL 74 -1.625 12.930 10.880 508 HG11 VAL 74 HG21 VAL 74 -3.049 10.841 9.695 509 HG12 VAL 74 HG22 VAL 74 -1.666 10.046 10.449 510 HG13 VAL 74 HG23 VAL 74 -1.410 11.346 9.284 511 HG21 VAL 74 HG11 VAL 74 -4.037 12.799 10.824 512 HG22 VAL 74 HG12 VAL 74 -3.547 12.880 12.516 513 HG23 VAL 74 HG13 VAL 74 -4.028 11.337 11.809 514 H ALA 75 HN ALA 75 -3.196 11.442 14.124 515 HA ALA 75 HA ALA 75 -2.709 14.057 15.281 516 HB1 ALA 75 HB1 ALA 75 -4.948 13.392 15.458 517 HB2 ALA 75 HB2 ALA 75 -4.339 13.064 17.080 518 HB3 ALA 75 HB3 ALA 75 -4.524 11.745 15.923 519 H GLN 76 HN GLN 76 -2.042 10.710 16.299 520 HA GLN 76 HA GLN 76 -0.969 11.388 18.871 521 HB2 GLN 76 HB1 GLN 76 -0.493 9.020 17.045 522 HB3 GLN 76 HB2 GLN 76 0.167 9.133 18.676 523 HG2 GLN 76 HG1 GLN 76 -2.072 9.299 19.620 524 HG3 GLN 76 HG2 GLN 76 -2.783 9.343 18.006 525 HE21 GLN 76 HE21 GLN 76 -3.402 7.286 19.973 526 HE22 GLN 76 HE22 GLN 76 -2.860 5.808 19.340 527 H ILE 77 HN ILE 77 0.661 10.718 15.756 528 HA ILE 77 HA ILE 77 3.312 11.137 16.597 529 HB ILE 77 HB ILE 77 2.061 11.907 13.944 530 HG12 ILE 77 HG12 ILE 77 3.528 9.375 14.746 531 HG13 ILE 77 HG11 ILE 77 1.772 9.511 14.668 532 HG21 ILE 77 HG21 ILE 77 4.709 11.102 13.569 533 HG22 ILE 77 HG22 ILE 77 4.769 12.114 15.012 534 HG23 ILE 77 HG23 ILE 77 4.109 12.759 13.509 535 HD11 ILE 77 HD11 ILE 77 2.806 10.558 12.232 536 HD12 ILE 77 HD12 ILE 77 1.857 9.089 12.459 537 HD13 ILE 77 HD13 ILE 77 3.619 9.020 12.526 538 H ALA 78 HN ALA 78 1.010 13.537 15.329 539 HA ALA 78 HA ALA 78 2.839 15.745 15.856 540 HB1 ALA 78 HB1 ALA 78 -0.125 15.791 15.219 541 HB2 ALA 78 HB2 ALA 78 1.168 15.818 14.021 542 HB3 ALA 78 HB3 ALA 78 0.977 17.166 15.141 543 H ALA 79 HN ALA 79 -0.292 14.721 17.274 544 HA ALA 79 HA ALA 79 -0.353 16.649 19.352 545 HB1 ALA 79 HB1 ALA 79 -1.363 13.826 19.706 546 HB2 ALA 79 HB2 ALA 79 -2.177 14.964 18.633 547 HB3 ALA 79 HB3 ALA 79 -2.038 15.322 20.354 548 H SER 80 HN SER 80 1.569 13.781 18.986 549 HA SER 80 HA SER 80 2.253 13.603 21.830 550 HB2 SER 80 HB2 SER 80 3.825 11.860 21.119 551 HB3 SER 80 HB1 SER 80 2.252 11.594 20.367 552 HG SER 80 HG SER 80 3.122 12.792 18.541 553 H GLN 81 HN GLN 81 3.374 15.344 19.061 554 HA GLN 81 HA GLN 81 6.089 15.753 19.581 555 HB2 GLN 81 HB2 GLN 81 4.083 17.868 18.738 556 HB3 GLN 81 HB1 GLN 81 5.830 17.954 18.512 557 HG2 GLN 81 HG2 GLN 81 5.745 15.930 17.098 558 HG3 GLN 81 HG1 GLN 81 3.997 15.853 17.317 559 HE21 GLN 81 HE21 GLN 81 6.593 17.950 15.989 560 HE22 GLN 81 HE22 GLN 81 5.590 18.756 14.881 561 H GLY 82 HN GLY 82 3.300 17.142 21.235 562 HA2 GLY 82 HA2 GLY 82 3.274 17.958 23.473 563 HA3 GLY 82 HA1 GLY 82 5.034 17.865 23.499 564 H GLY 83 HN GLY 83 3.955 19.380 20.680 565 HA2 GLY 83 HA2 GLY 83 4.757 22.017 21.783 566 HA3 GLY 83 HA1 GLY 83 4.656 21.610 20.070 567 H ASP 84 HN ASP 84 3.288 23.422 19.616 568 HA ASP 84 HA ASP 84 0.822 23.881 21.060 569 HB2 ASP 84 HB2 ASP 84 2.072 25.597 19.665 570 HB3 ASP 84 HB1 ASP 84 1.465 24.763 18.234 571 H LEU 85 HN LEU 85 -1.088 22.821 20.813 572 HA LEU 85 HA LEU 85 -1.280 20.653 18.859 573 HB2 LEU 85 HB2 LEU 85 -2.202 20.474 21.175 574 HB3 LEU 85 HB1 LEU 85 -3.383 21.719 20.769 575 HG LEU 85 HG LEU 85 -3.851 20.084 18.711 576 HD11 LEU 85 HD11 LEU 85 -2.261 18.511 20.638 577 HD12 LEU 85 HD12 LEU 85 -2.568 18.215 18.927 578 HD13 LEU 85 HD13 LEU 85 -3.766 17.741 20.132 579 HD21 LEU 85 HD21 LEU 85 -5.169 20.771 21.004 580 HD22 LEU 85 HD22 LEU 85 -5.031 19.024 21.206 581 HD23 LEU 85 HD23 LEU 85 -5.827 19.686 19.778 582 H GLY 86 HN GLY 86 -2.181 23.976 18.992 583 HA2 GLY 86 HA2 GLY 86 -4.421 23.850 17.166 584 HA3 GLY 86 HA1 GLY 86 -3.509 25.302 17.573 585 H VAL 87 HN VAL 87 -0.928 24.394 16.757 586 HA VAL 87 HA VAL 87 -1.070 24.966 13.943 587 HB VAL 87 HB VAL 87 0.888 25.381 15.564 588 HG11 VAL 87 HG11 VAL 87 2.545 23.565 15.689 589 HG12 VAL 87 HG12 VAL 87 1.453 22.499 14.805 590 HG13 VAL 87 HG13 VAL 87 1.019 23.063 16.419 591 HG21 VAL 87 HG21 VAL 87 1.065 24.331 12.759 592 HG22 VAL 87 HG22 VAL 87 2.553 24.707 13.629 593 HG23 VAL 87 HG23 VAL 87 1.348 25.966 13.358 594 H THR 88 HN THR 88 -0.478 21.927 15.740 595 HA THR 88 HA THR 88 0.027 20.243 13.542 596 HB THR 88 HB THR 88 -1.555 19.667 16.066 597 HG1 THR 88 HG1 THR 88 0.347 19.445 16.895 598 HG21 THR 88 HG21 THR 88 -0.404 17.749 14.018 599 HG22 THR 88 HG22 THR 88 -2.121 18.074 14.265 600 HG23 THR 88 HG23 THR 88 -1.180 17.293 15.536 601 H THR 89 HN THR 89 -3.013 21.560 14.741 602 HA THR 89 HA THR 89 -4.829 20.043 13.195 603 HB THR 89 HB THR 89 -5.098 23.028 13.605 604 HG1 THR 89 HG1 THR 89 -5.658 22.646 15.677 605 HG21 THR 89 HG21 THR 89 -6.792 21.614 12.297 606 HG22 THR 89 HG22 THR 89 -7.429 22.586 13.623 607 HG23 THR 89 HG23 THR 89 -7.179 20.854 13.841 608 H ASN 90 HN ASN 90 -3.067 23.029 12.369 609 HA ASN 90 HA ASN 90 -3.988 23.070 9.627 610 HB2 ASN 90 HB2 ASN 90 -1.534 24.371 10.844 611 HB3 ASN 90 HB1 ASN 90 -2.285 24.799 9.307 612 HD21 ASN 90 HD21 ASN 90 -5.012 24.791 9.988 613 HD22 ASN 90 HD22 ASN 90 -5.306 26.000 11.142 614 H ALA 91 HN ALA 91 -1.091 21.856 11.278 615 HA ALA 91 HA ALA 91 0.379 21.113 8.948 616 HB1 ALA 91 HB1 ALA 91 1.883 20.295 10.439 617 HB2 ALA 91 HB2 ALA 91 0.669 19.309 11.255 618 HB3 ALA 91 HB3 ALA 91 0.836 21.018 11.659 619 H ILE 92 HN ILE 92 -1.689 19.090 11.060 620 HA ILE 92 HA ILE 92 -1.587 16.830 9.253 621 HB ILE 92 HB ILE 92 -3.521 17.475 11.500 622 HG12 ILE 92 HG11 ILE 92 -1.054 15.712 11.436 623 HG13 ILE 92 HG12 ILE 92 -1.136 17.308 12.182 624 HG21 ILE 92 HG21 ILE 92 -2.912 14.720 10.470 625 HG22 ILE 92 HG22 ILE 92 -4.108 15.712 9.635 626 HG23 ILE 92 HG23 ILE 92 -4.338 15.294 11.333 627 HD11 ILE 92 HD11 ILE 92 -2.716 14.842 12.968 628 HD12 ILE 92 HD12 ILE 92 -3.019 16.451 13.623 629 HD13 ILE 92 HD13 ILE 92 -1.473 15.654 13.921 630 H ALA 93 HN ALA 93 -4.103 19.268 9.983 631 HA ALA 93 HA ALA 93 -6.035 18.305 8.131 632 HB1 ALA 93 HB1 ALA 93 -5.539 21.193 8.913 633 HB2 ALA 93 HB2 ALA 93 -6.471 20.043 9.872 634 HB3 ALA 93 HB3 ALA 93 -7.040 20.524 8.273 635 H ASP 94 HN ASP 94 -3.564 20.860 7.667 636 HA ASP 94 HA ASP 94 -4.144 21.439 4.966 637 HB2 ASP 94 HB1 ASP 94 -1.499 21.442 6.440 638 HB3 ASP 94 HB2 ASP 94 -1.710 22.097 4.817 639 H ALA 95 HN ALA 95 -1.913 18.984 6.294 640 HA ALA 95 HA ALA 95 -0.997 17.969 3.807 641 HB1 ALA 95 HB1 ALA 95 -0.229 16.081 5.021 642 HB2 ALA 95 HB2 ALA 95 -1.504 16.235 6.229 643 HB3 ALA 95 HB3 ALA 95 -0.183 17.403 6.186 644 H LEU 96 HN LEU 96 -3.830 17.058 5.765 645 HA LEU 96 HA LEU 96 -4.698 14.971 3.967 646 HB2 LEU 96 HB2 LEU 96 -6.452 16.570 5.847 647 HB3 LEU 96 HB1 LEU 96 -6.712 14.924 5.270 648 HG LEU 96 HG LEU 96 -4.159 15.490 6.710 649 HD11 LEU 96 HD21 LEU 96 -5.572 14.850 8.840 650 HD12 LEU 96 HD22 LEU 96 -6.903 15.559 7.926 651 HD13 LEU 96 HD23 LEU 96 -5.486 16.533 8.319 652 HD21 LEU 96 HD11 LEU 96 -4.726 13.268 5.733 653 HD22 LEU 96 HD12 LEU 96 -6.132 13.191 6.793 654 HD23 LEU 96 HD13 LEU 96 -4.509 13.200 7.481 655 H THR 97 HN THR 97 -5.296 18.439 4.186 656 HA THR 97 HA THR 97 -7.483 18.513 2.322 657 HB THR 97 HB THR 97 -5.457 20.652 3.045 658 HG1 THR 97 HG1 THR 97 -6.580 20.172 4.838 659 HG21 THR 97 HG21 THR 97 -7.785 21.917 2.339 660 HG22 THR 97 HG22 THR 97 -7.748 20.576 1.195 661 HG23 THR 97 HG23 THR 97 -6.398 21.709 1.270 662 H SER 98 HN SER 98 -4.004 19.261 1.878 663 HA SER 98 HA SER 98 -4.135 19.663 -0.930 664 HB2 SER 98 HB2 SER 98 -1.733 19.341 -0.932 665 HB3 SER 98 HB1 SER 98 -2.169 20.206 0.542 666 HG SER 98 HG SER 98 -0.982 18.625 1.340 667 H ALA 99 HN ALA 99 -3.806 16.698 0.973 668 HA ALA 99 HA ALA 99 -3.243 14.985 -1.281 669 HB1 ALA 99 HB1 ALA 99 -3.413 13.203 0.228 670 HB2 ALA 99 HB2 ALA 99 -4.636 14.019 1.203 671 HB3 ALA 99 HB3 ALA 99 -2.952 14.540 1.282 672 H PHE 100 HN PHE 100 -6.233 15.841 0.454 673 HA PHE 100 HA PHE 100 -8.072 14.153 -0.775 674 HB2 PHE 100 HB1 PHE 100 -8.156 16.841 0.415 675 HB3 PHE 100 HB2 PHE 100 -9.422 16.557 -0.779 676 HD1 PHE 100 HD2 PHE 100 -10.715 14.292 -0.583 677 HD2 PHE 100 HD1 PHE 100 -8.425 16.048 2.599 678 HE1 PHE 100 HE2 PHE 100 -11.974 12.939 1.070 679 HE2 PHE 100 HE1 PHE 100 -9.686 14.697 4.252 680 HZ PHE 100 HZ PHE 100 -11.458 13.141 3.486 681 H TYR 101 HN TYR 101 -7.138 17.382 -1.996 682 HA TYR 101 HA TYR 101 -8.449 16.975 -4.540 683 HB2 TYR 101 HB2 TYR 101 -6.242 18.961 -4.014 684 HB3 TYR 101 HB1 TYR 101 -7.607 19.111 -5.122 685 HD1 TYR 101 HD2 TYR 101 -9.932 18.393 -3.642 686 HD2 TYR 101 HD1 TYR 101 -6.448 20.492 -2.260 687 HE1 TYR 101 HE2 TYR 101 -11.278 19.436 -1.840 688 HE2 TYR 101 HE1 TYR 101 -7.795 21.539 -0.459 689 HH TYR 101 HH TYR 101 -11.293 20.912 -0.179 690 H GLN 102 HN GLN 102 -5.198 16.458 -3.322 691 HA GLN 102 HA GLN 102 -3.985 16.059 -5.918 692 HB2 GLN 102 HB1 GLN 102 -3.170 15.350 -3.099 693 HB3 GLN 102 HB2 GLN 102 -2.193 14.892 -4.492 694 HG2 GLN 102 HG2 GLN 102 -3.086 17.733 -3.933 695 HG3 GLN 102 HG1 GLN 102 -1.527 17.084 -3.427 696 HE21 GLN 102 HE21 GLN 102 -2.622 19.057 -5.714 697 HE22 GLN 102 HE22 GLN 102 -1.699 18.576 -7.055 698 H THR 103 HN THR 103 -5.968 14.072 -3.878 699 HA THR 103 HA THR 103 -5.041 11.637 -5.322 700 HB THR 103 HB THR 103 -6.224 10.372 -3.596 701 HG1 THR 103 HG1 THR 103 -7.081 11.743 -1.831 702 HG21 THR 103 HG21 THR 103 -5.023 11.594 -1.552 703 HG22 THR 103 HG22 THR 103 -4.277 12.513 -2.860 704 HG23 THR 103 HG23 THR 103 -4.094 10.760 -2.798 705 H THR 104 HN THR 104 -8.237 12.952 -4.253 706 HA THR 104 HA THR 104 -9.292 11.933 -6.864 707 HB THR 104 HB THR 104 -10.250 10.414 -5.391 708 HG1 THR 104 HG1 THR 104 -11.870 11.676 -6.475 709 HG21 THR 104 HG21 THR 104 -9.262 11.521 -3.374 710 HG22 THR 104 HG22 THR 104 -10.900 10.923 -3.108 711 HG23 THR 104 HG23 THR 104 -10.621 12.644 -3.374 712 H GLY 105 HN GLY 105 -9.827 14.282 -4.223 713 HA2 GLY 105 HA2 GLY 105 -10.181 16.653 -4.932 714 HA3 GLY 105 HA1 GLY 105 -11.141 16.028 -6.268 715 H VAL 106 HN VAL 106 -11.179 15.143 -2.807 716 HA VAL 106 HA VAL 106 -14.104 15.738 -2.821 717 HB VAL 106 HB VAL 106 -12.584 14.119 -0.766 718 HG11 VAL 106 HG21 VAL 106 -15.069 13.110 -0.817 719 HG12 VAL 106 HG22 VAL 106 -15.435 14.736 -1.394 720 HG13 VAL 106 HG23 VAL 106 -14.654 14.511 0.171 721 HG21 VAL 106 HG11 VAL 106 -12.423 13.283 -3.210 722 HG22 VAL 106 HG12 VAL 106 -14.151 12.959 -3.071 723 HG23 VAL 106 HG13 VAL 106 -13.011 12.144 -1.999 724 H VAL 107 HN VAL 107 -14.877 16.462 -0.521 725 HA VAL 107 HA VAL 107 -13.423 18.897 0.132 726 HB VAL 107 HB VAL 107 -15.182 19.031 1.982 727 HG11 VAL 107 HG21 VAL 107 -17.056 18.888 -0.023 728 HG12 VAL 107 HG22 VAL 107 -15.559 19.043 -0.942 729 HG13 VAL 107 HG23 VAL 107 -15.992 20.267 0.253 730 HG21 VAL 107 HG11 VAL 107 -16.354 17.173 2.471 731 HG22 VAL 107 HG12 VAL 107 -15.447 16.288 1.243 732 HG23 VAL 107 HG13 VAL 107 -16.951 17.103 0.813 733 H ASN 108 HN ASN 108 -11.691 18.954 1.470 734 HA ASN 108 HA ASN 108 -10.932 16.681 3.090 735 HB2 ASN 108 HB1 ASN 108 -9.050 18.036 3.784 736 HB3 ASN 108 HB2 ASN 108 -9.316 18.312 2.062 737 HD21 ASN 108 HD21 ASN 108 -9.759 20.453 1.404 738 HD22 ASN 108 HD22 ASN 108 -10.054 21.738 2.473 739 H SER 109 HN SER 109 -12.823 19.526 3.631 740 HA SER 109 HA SER 109 -12.574 19.814 6.438 741 HB2 SER 109 HB2 SER 109 -15.064 20.247 4.764 742 HB3 SER 109 HB1 SER 109 -14.731 20.956 6.345 743 HG SER 109 HG SER 109 -13.163 22.191 5.483 744 H ARG 110 HN ARG 110 -14.806 17.735 4.565 745 HA ARG 110 HA ARG 110 -16.319 16.768 6.750 746 HB2 ARG 110 HB2 ARG 110 -16.848 16.316 4.359 747 HB3 ARG 110 HB1 ARG 110 -15.477 15.208 4.288 748 HG2 ARG 110 HG2 ARG 110 -16.510 13.873 6.128 749 HG3 ARG 110 HG1 ARG 110 -17.910 14.946 6.086 750 HD2 ARG 110 HD1 ARG 110 -18.207 14.357 3.660 751 HD3 ARG 110 HD2 ARG 110 -16.912 13.173 3.837 752 HE ARG 110 HE ARG 110 -19.564 13.011 5.195 753 HH11 ARG 110 HH21 ARG 110 -16.391 11.797 5.084 754 HH12 ARG 110 HH22 ARG 110 -16.860 10.130 5.129 755 HH21 ARG 110 HH11 ARG 110 -20.252 10.802 4.881 756 HH22 ARG 110 HH12 ARG 110 -19.045 9.568 5.014 757 H PHE 111 HN PHE 111 -13.411 15.267 5.283 758 HA PHE 111 HA PHE 111 -13.208 13.308 7.419 759 HB2 PHE 111 HB2 PHE 111 -12.355 12.937 5.096 760 HB3 PHE 111 HB1 PHE 111 -11.102 14.140 5.404 761 HD1 PHE 111 HD1 PHE 111 -12.531 10.966 6.791 762 HD2 PHE 111 HD2 PHE 111 -9.076 13.488 6.399 763 HE1 PHE 111 HE1 PHE 111 -11.138 9.228 7.881 764 HE2 PHE 111 HE2 PHE 111 -7.683 11.750 7.490 765 HZ PHE 111 HZ PHE 111 -8.714 9.620 8.232 766 H ILE 112 HN ILE 112 -11.254 16.164 6.524 767 HA ILE 112 HA ILE 112 -9.481 16.067 8.732 768 HB ILE 112 HB ILE 112 -10.509 18.450 7.169 769 HG12 ILE 112 HG11 ILE 112 -8.089 16.647 6.918 770 HG13 ILE 112 HG12 ILE 112 -9.369 16.894 5.731 771 HG21 ILE 112 HG21 ILE 112 -8.914 18.324 9.555 772 HG22 ILE 112 HG22 ILE 112 -9.371 19.744 8.617 773 HG23 ILE 112 HG23 ILE 112 -7.898 18.863 8.218 774 HD11 ILE 112 HD11 ILE 112 -7.267 18.884 6.620 775 HD12 ILE 112 HD12 ILE 112 -8.682 19.342 5.673 776 HD13 ILE 112 HD13 ILE 112 -7.502 18.217 5.004 777 H SER 113 HN SER 113 -12.721 17.493 8.465 778 HA SER 113 HA SER 113 -12.737 18.986 10.864 779 HB2 SER 113 HB2 SER 113 -14.914 17.505 9.386 780 HB3 SER 113 HB1 SER 113 -15.252 18.399 10.869 781 HG SER 113 HG SER 113 -15.539 19.682 8.999 782 H GLU 114 HN GLU 114 -13.452 15.528 10.360 783 HA GLU 114 HA GLU 114 -14.059 15.039 13.147 784 HB2 GLU 114 HB2 GLU 114 -13.215 13.110 10.964 785 HB3 GLU 114 HB1 GLU 114 -13.905 12.653 12.522 786 HG2 GLU 114 HG1 GLU 114 -15.958 13.913 11.983 787 HG3 GLU 114 HG2 GLU 114 -15.268 14.376 10.429 788 H ILE 115 HN ILE 115 -11.131 14.791 11.169 789 HA ILE 115 HA ILE 115 -9.506 13.444 13.095 790 HB ILE 115 HB ILE 115 -8.676 15.462 10.989 791 HG12 ILE 115 HG12 ILE 115 -9.005 12.449 10.910 792 HG13 ILE 115 HG11 ILE 115 -9.915 13.636 9.977 793 HG21 ILE 115 HG21 ILE 115 -6.517 14.121 11.121 794 HG22 ILE 115 HG22 ILE 115 -7.157 13.391 12.593 795 HG23 ILE 115 HG23 ILE 115 -6.863 15.129 12.525 796 HD11 ILE 115 HD11 ILE 115 -7.087 14.058 9.593 797 HD12 ILE 115 HD12 ILE 115 -8.318 13.676 8.390 798 HD13 ILE 115 HD13 ILE 115 -7.489 12.376 9.246 799 H ARG 116 HN ARG 116 -10.064 16.920 12.515 800 HA ARG 116 HA ARG 116 -8.216 17.959 14.368 801 HB2 ARG 116 HB1 ARG 116 -10.968 18.954 13.588 802 HB3 ARG 116 HB2 ARG 116 -9.828 19.893 14.554 803 HG2 ARG 116 HG1 ARG 116 -8.156 19.706 12.740 804 HG3 ARG 116 HG2 ARG 116 -9.316 18.798 11.771 805 HD2 ARG 116 HD2 ARG 116 -9.448 21.074 11.020 806 HD3 ARG 116 HD1 ARG 116 -10.889 20.785 11.994 807 HE ARG 116 HE ARG 116 -9.216 21.808 13.863 808 HH11 ARG 116 HH11 ARG 116 -7.808 22.836 11.255 809 HH12 ARG 116 HH12 ARG 116 -8.406 24.462 11.226 810 HH21 ARG 116 HH21 ARG 116 -10.899 23.866 13.561 811 HH22 ARG 116 HH22 ARG 116 -10.156 25.045 12.531 812 H SER 117 HN SER 117 -11.618 17.016 14.951 813 HA SER 117 HA SER 117 -11.649 17.593 17.731 814 HB2 SER 117 HB2 SER 117 -13.552 16.098 17.865 815 HB3 SER 117 HB1 SER 117 -13.648 16.953 16.325 816 HG SER 117 HG SER 117 -12.962 15.171 15.272 817 H LEU 118 HN LEU 118 -10.398 14.849 15.922 818 HA LEU 118 HA LEU 118 -9.923 13.183 18.247 819 HB2 LEU 118 HB2 LEU 118 -8.809 13.114 15.430 820 HB3 LEU 118 HB1 LEU 118 -8.467 11.886 16.650 821 HG LEU 118 HG LEU 118 -11.329 12.586 16.216 822 HD11 LEU 118 HD21 LEU 118 -9.557 11.705 14.073 823 HD12 LEU 118 HD22 LEU 118 -11.243 12.217 13.988 824 HD13 LEU 118 HD23 LEU 118 -10.848 10.542 14.378 825 HD21 LEU 118 HD11 LEU 118 -10.769 9.801 16.157 826 HD22 LEU 118 HD12 LEU 118 -11.485 10.729 17.476 827 HD23 LEU 118 HD13 LEU 118 -9.736 10.506 17.400 828 H ILE 119 HN ILE 119 -7.907 15.454 16.350 829 HA ILE 119 HA ILE 119 -5.451 14.859 17.679 830 HB ILE 119 HB ILE 119 -6.316 17.559 16.602 831 HG12 ILE 119 HG12 ILE 119 -4.893 15.318 15.141 832 HG13 ILE 119 HG11 ILE 119 -6.622 15.629 14.996 833 HG21 ILE 119 HG21 ILE 119 -3.792 17.640 16.127 834 HG22 ILE 119 HG22 ILE 119 -3.656 16.253 17.208 835 HG23 ILE 119 HG23 ILE 119 -4.276 17.788 17.816 836 HD11 ILE 119 HD11 ILE 119 -5.056 16.699 13.230 837 HD12 ILE 119 HD12 ILE 119 -4.598 17.815 14.518 838 HD13 ILE 119 HD13 ILE 119 -6.274 17.733 13.975 839 H GLY 120 HN GLY 120 -8.139 16.987 18.541 840 HA2 GLY 120 HA2 GLY 120 -6.788 18.210 20.790 841 HA3 GLY 120 HA1 GLY 120 -8.526 18.235 20.498 842 H MET 121 HN MET 121 -8.780 15.323 20.354 843 HA MET 121 HA MET 121 -9.244 14.749 23.112 844 HB2 MET 121 HB2 MET 121 -10.366 13.597 21.181 845 HB3 MET 121 HB1 MET 121 -8.855 12.742 20.872 846 HG2 MET 121 HG2 MET 121 -8.937 11.868 23.223 847 HG3 MET 121 HG1 MET 121 -10.525 12.613 23.400 848 HE1 MET 121 HE1 MET 121 -12.253 12.461 21.798 849 HE2 MET 121 HE2 MET 121 -12.864 10.932 21.171 850 HE3 MET 121 HE3 MET 121 -11.777 11.908 20.187 851 H PHE 122 HN PHE 122 -6.593 13.783 20.929 852 HA PHE 122 HA PHE 122 -5.181 12.153 22.780 853 HB2 PHE 122 HB2 PHE 122 -4.151 13.892 20.519 854 HB3 PHE 122 HB1 PHE 122 -3.173 12.699 21.376 855 HD1 PHE 122 HD1 PHE 122 -4.045 10.269 21.444 856 HD2 PHE 122 HD2 PHE 122 -5.518 13.241 18.714 857 HE1 PHE 122 HE1 PHE 122 -4.947 8.479 19.983 858 HE2 PHE 122 HE2 PHE 122 -6.420 11.451 17.252 859 HZ PHE 122 HZ PHE 122 -6.134 9.070 17.888 860 H ALA 123 HN ALA 123 -5.009 15.660 22.174 861 HA ALA 123 HA ALA 123 -2.884 16.200 24.007 862 HB1 ALA 123 HB1 ALA 123 -5.198 17.981 23.182 863 HB2 ALA 123 HB2 ALA 123 -3.656 17.845 22.338 864 HB3 ALA 123 HB3 ALA 123 -3.715 18.528 23.963 865 H GLN 124 HN GLN 124 -6.339 15.735 24.457 866 HA GLN 124 HA GLN 124 -6.463 16.779 27.141 867 HB2 GLN 124 HB2 GLN 124 -8.204 14.741 25.721 868 HB3 GLN 124 HB1 GLN 124 -8.589 15.475 27.279 869 HG2 GLN 124 HG2 GLN 124 -8.663 17.685 26.282 870 HG3 GLN 124 HG1 GLN 124 -8.087 17.054 24.740 871 HE21 GLN 124 HE21 GLN 124 -10.564 18.426 24.839 872 HE22 GLN 124 HE22 GLN 124 -11.835 17.324 24.612 873 H ALA 125 HN ALA 125 -5.585 13.662 25.769 874 HA ALA 125 HA ALA 125 -5.759 12.047 28.085 875 HB1 ALA 125 HB1 ALA 125 -4.775 11.742 25.492 876 HB2 ALA 125 HB2 ALA 125 -4.798 10.501 26.745 877 HB3 ALA 125 HB3 ALA 125 -3.360 11.497 26.516 878 H SER 126 HN SER 126 -3.394 14.473 27.159 879 HA SER 126 HA SER 126 -1.331 13.769 29.002 880 HB2 SER 126 HB1 SER 126 -0.507 16.023 28.683 881 HB3 SER 126 HB2 SER 126 -1.127 15.449 27.135 882 HG SER 126 HG SER 126 -2.372 17.188 28.987 883 H ALA 127 HN ALA 127 -4.366 15.493 29.401 884 HA ALA 127 HA ALA 127 -3.809 16.675 31.950 885 HB1 ALA 127 HB1 ALA 127 -6.569 15.875 31.755 886 HB2 ALA 127 HB2 ALA 127 -6.028 16.486 30.192 887 HB3 ALA 127 HB3 ALA 127 -5.882 17.495 31.630 888 H ASN 128 HN ASN 128 -4.603 13.426 30.971 889 HA ASN 128 HA ASN 128 -5.618 12.400 33.418 890 HB2 ASN 128 HB1 ASN 128 -5.448 11.225 31.138 891 HB3 ASN 128 HB2 ASN 128 -3.778 10.863 31.576 892 HD21 ASN 128 HD21 ASN 128 -4.872 8.547 31.397 893 HD22 ASN 128 HD22 ASN 128 -5.472 7.921 32.857 894 H ASP 129 HN ASP 129 -2.390 13.320 32.477 895 HA ASP 129 HA ASP 129 -0.913 11.815 34.404 896 HB2 ASP 129 HB2 ASP 129 -0.368 14.518 33.144 897 HB3 ASP 129 HB1 ASP 129 0.797 13.651 34.143 898 H VAL 130 HN VAL 130 -2.954 14.613 34.705 899 HA VAL 130 HA VAL 130 -1.882 15.630 37.169 900 HB VAL 130 HB VAL 130 -3.599 16.696 35.498 901 HG11 VAL 130 HG11 VAL 130 -5.935 16.450 36.212 902 HG12 VAL 130 HG12 VAL 130 -5.447 15.259 37.417 903 HG13 VAL 130 HG13 VAL 130 -5.275 14.897 35.699 904 HG21 VAL 130 HG21 VAL 130 -4.277 17.045 38.411 905 HG22 VAL 130 HG22 VAL 130 -4.167 18.271 37.149 906 HG23 VAL 130 HG23 VAL 130 -2.700 17.535 37.794 907 H TYR 131 HN TYR 131 -3.992 12.986 36.381 908 HA TYR 131 HA TYR 131 -3.723 11.676 38.872 909 HB2 TYR 131 HB2 TYR 131 -5.767 12.122 40.021 910 HB3 TYR 131 HB1 TYR 131 -5.112 13.700 39.600 911 HD1 TYR 131 HD2 TYR 131 -5.830 13.361 36.540 912 HD2 TYR 131 HD1 TYR 131 -8.062 12.940 40.186 913 HE1 TYR 131 HE2 TYR 131 -7.904 13.915 35.326 914 HE2 TYR 131 HE1 TYR 131 -10.148 13.491 38.965 915 HH TYR 131 HH TYR 131 -10.754 14.769 36.847 916 H ALA 132 HN ALA 132 -5.605 9.949 39.081 917 HA ALA 132 HA ALA 132 -5.871 8.765 36.408 918 HB1 ALA 132 HB1 ALA 132 -6.847 7.745 39.092 919 HB2 ALA 132 HB2 ALA 132 -5.278 7.372 38.380 920 HB3 ALA 132 HB3 ALA 132 -6.756 6.813 37.598 921 H SER 133 HN SER 133 -7.676 8.910 35.164 922 HA SER 133 HA SER 133 -9.837 10.619 35.741 923 HB2 SER 133 HB2 SER 133 -10.962 9.617 33.849 924 HB3 SER 133 HB1 SER 133 -9.239 9.670 33.478 925 HG SER 133 HG SER 133 -9.093 7.502 34.105 926 H ALA 134 HN ALA 134 -9.365 7.228 36.556 927 HA ALA 134 HA ALA 134 -12.009 6.506 37.234 928 HB1 ALA 134 HB1 ALA 134 -9.694 5.658 38.956 929 HB2 ALA 134 HB2 ALA 134 -9.784 5.117 37.280 930 HB3 ALA 134 HB3 ALA 134 -11.075 4.709 38.408 931 H GLY 135 HN GLY 135 -9.616 8.376 39.054 932 HA2 GLY 135 HA2 GLY 135 -10.067 9.955 40.768 933 HA3 GLY 135 HA1 GLY 135 -11.762 9.469 40.728 934 H SER 136 HN SER 136 -11.408 9.544 43.161 935 HA SER 136 HA SER 136 -9.713 7.727 44.531 936 HB2 SER 136 HB2 SER 136 -11.040 9.602 45.576 937 HB3 SER 136 HB1 SER 136 -12.478 8.593 45.419 938 HG SER 136 HG SER 136 -11.605 7.122 46.799 939 H GLY 137 HN GLY 137 -12.895 7.271 43.066 940 HA2 GLY 137 HA2 GLY 137 -12.625 4.350 43.655 941 HA3 GLY 137 HA1 GLY 137 -14.185 5.170 43.738 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 -10.570 5.466 -19.226 2 H2 GLY 1 HT2 GLY 1 -11.139 4.154 -18.309 3 H3 GLY 1 HT3 GLY 1 -9.473 4.350 -18.575 4 HA2 GLY 1 HA2 GLY 1 -9.326 6.190 -17.165 5 HA3 GLY 1 HA1 GLY 1 -11.077 6.386 -17.153 6 H MET 2 HN MET 2 -8.394 4.531 -15.873 7 HA MET 2 HA MET 2 -10.278 3.364 -13.865 8 HB2 MET 2 HB2 MET 2 -7.877 2.039 -15.161 9 HB3 MET 2 HB1 MET 2 -8.769 1.367 -13.796 10 HG2 MET 2 HG2 MET 2 -10.848 1.421 -15.181 11 HG3 MET 2 HG1 MET 2 -9.885 1.979 -16.550 12 HE1 MET 2 HE1 MET 2 -10.986 -1.677 -17.222 13 HE2 MET 2 HE2 MET 2 -10.395 -0.346 -18.214 14 HE3 MET 2 HE3 MET 2 -11.606 -0.040 -16.972 15 H GLY 3 HN GLY 3 -9.195 2.885 -11.766 16 HA2 GLY 3 HA2 GLY 3 -7.405 3.221 -10.185 17 HA3 GLY 3 HA1 GLY 3 -6.642 4.330 -11.325 18 H GLN 4 HN GLN 4 -9.984 4.855 -11.069 19 HA GLN 4 HA GLN 4 -9.470 7.205 -9.297 20 HB2 GLN 4 HB2 GLN 4 -10.272 7.765 -11.557 21 HB3 GLN 4 HB1 GLN 4 -11.683 6.736 -11.317 22 HG2 GLN 4 HG2 GLN 4 -12.432 8.142 -9.461 23 HG3 GLN 4 HG1 GLN 4 -10.981 9.135 -9.598 24 HE21 GLN 4 HE21 GLN 4 -13.188 10.632 -9.872 25 HE22 GLN 4 HE22 GLN 4 -13.554 10.973 -11.493 26 H ALA 5 HN ALA 5 -11.200 7.766 -7.768 27 HA ALA 5 HA ALA 5 -13.191 5.688 -7.172 28 HB1 ALA 5 HB1 ALA 5 -11.504 6.404 -4.834 29 HB2 ALA 5 HB2 ALA 5 -10.779 5.313 -6.014 30 HB3 ALA 5 HB3 ALA 5 -12.294 4.876 -5.225 31 H ASN 6 HN ASN 6 -14.636 6.417 -5.358 32 HA ASN 6 HA ASN 6 -15.192 9.264 -5.623 33 HB2 ASN 6 HB2 ASN 6 -16.439 7.187 -3.796 34 HB3 ASN 6 HB1 ASN 6 -17.089 8.794 -4.122 35 HD21 ASN 6 HD21 ASN 6 -18.528 6.358 -4.761 36 HD22 ASN 6 HD22 ASN 6 -18.701 6.304 -6.448 37 H THR 7 HN THR 7 -13.113 7.472 -3.669 38 HA THR 7 HA THR 7 -12.629 9.814 -1.953 39 HB THR 7 HB THR 7 -12.771 7.395 -0.314 40 HG1 THR 7 HG1 THR 7 -14.574 6.778 -1.261 41 HG21 THR 7 HG21 THR 7 -13.551 10.268 -0.208 42 HG22 THR 7 HG22 THR 7 -12.616 9.308 0.939 43 HG23 THR 7 HG23 THR 7 -14.372 9.158 0.889 44 HA PRO 8 HA PRO 8 -8.468 8.356 -2.407 45 HB2 PRO 8 HB2 PRO 8 -7.340 9.355 -0.158 46 HB3 PRO 8 HB1 PRO 8 -7.764 10.350 -1.553 47 HG2 PRO 8 HG2 PRO 8 -9.276 9.925 0.997 48 HG3 PRO 8 HG1 PRO 8 -8.969 11.433 0.130 49 HD2 PRO 8 HD1 PRO 8 -11.327 10.154 -0.070 50 HD3 PRO 8 HD2 PRO 8 -10.628 11.016 -1.441 51 H TRP 9 HN TRP 9 -10.047 7.769 0.742 52 HA TRP 9 HA TRP 9 -8.187 5.525 1.244 53 HB2 TRP 9 HB2 TRP 9 -9.459 5.260 3.367 54 HB3 TRP 9 HB1 TRP 9 -8.807 6.887 3.171 55 HD1 TRP 9 HD1 TRP 9 -12.091 4.932 3.068 56 HE1 TRP 9 HE1 TRP 9 -14.050 6.601 3.237 57 HE3 TRP 9 HE3 TRP 9 -9.528 9.329 2.727 58 HZ2 TRP 9 HZ2 TRP 9 -14.470 9.437 3.225 59 HZ3 TRP 9 HZ3 TRP 9 -10.727 11.492 2.801 60 HH2 TRP 9 HH2 TRP 9 -13.191 11.555 3.054 61 H SER 10 HN SER 10 -11.120 6.057 -0.349 62 HA SER 10 HA SER 10 -12.434 3.551 0.242 63 HB2 SER 10 HB1 SER 10 -12.678 5.496 -2.069 64 HB3 SER 10 HB2 SER 10 -13.706 4.075 -1.886 65 HG SER 10 HG SER 10 -14.303 4.902 0.178 66 H SER 11 HN SER 11 -9.611 4.275 -1.468 67 HA SER 11 HA SER 11 -9.643 1.566 -2.688 68 HB2 SER 11 HB1 SER 11 -10.323 3.384 -4.382 69 HB3 SER 11 HB2 SER 11 -8.659 3.954 -4.255 70 HG SER 11 HG SER 11 -9.674 1.616 -5.363 71 H LYS 12 HN LYS 12 -7.433 0.819 -3.209 72 HA LYS 12 HA LYS 12 -5.524 1.674 -1.190 73 HB2 LYS 12 HB1 LYS 12 -4.944 -0.128 -3.549 74 HB3 LYS 12 HB2 LYS 12 -4.137 -0.102 -1.981 75 HG2 LYS 12 HG2 LYS 12 -6.124 -0.936 -0.878 76 HG3 LYS 12 HG1 LYS 12 -7.062 -0.796 -2.364 77 HD2 LYS 12 HD2 LYS 12 -4.781 -2.700 -1.787 78 HD3 LYS 12 HD1 LYS 12 -6.450 -3.107 -2.183 79 HE2 LYS 12 HE2 LYS 12 -6.089 -1.967 -4.419 80 HE3 LYS 12 HE1 LYS 12 -4.377 -1.863 -4.009 81 HZ1 LYS 12 HZ1 LYS 12 -5.651 -4.466 -3.705 82 HZ2 LYS 12 HZ2 LYS 12 -4.086 -4.077 -4.240 83 HZ3 LYS 12 HZ3 LYS 12 -5.411 -3.921 -5.293 84 H ALA 13 HN ALA 13 -5.767 2.024 -4.724 85 HA ALA 13 HA ALA 13 -3.210 3.255 -5.094 86 HB1 ALA 13 HB1 ALA 13 -5.228 4.303 -6.904 87 HB2 ALA 13 HB2 ALA 13 -5.384 2.554 -6.725 88 HB3 ALA 13 HB3 ALA 13 -3.854 3.254 -7.255 89 H ASN 14 HN ASN 14 -6.448 4.716 -4.692 90 HA ASN 14 HA ASN 14 -5.400 7.413 -4.572 91 HB2 ASN 14 HB2 ASN 14 -8.051 6.468 -3.462 92 HB3 ASN 14 HB1 ASN 14 -7.640 8.075 -4.059 93 HD21 ASN 14 HD21 ASN 14 -9.769 7.260 -5.369 94 HD22 ASN 14 HD22 ASN 14 -9.397 6.662 -6.912 95 H ALA 15 HN ALA 15 -6.010 4.876 -2.233 96 HA ALA 15 HA ALA 15 -5.893 6.567 0.103 97 HB1 ALA 15 HB1 ALA 15 -5.463 3.595 -0.270 98 HB2 ALA 15 HB2 ALA 15 -6.928 4.396 0.294 99 HB3 ALA 15 HB3 ALA 15 -5.483 4.387 1.305 100 H ASP 16 HN ASP 16 -3.493 4.340 -1.326 101 HA ASP 16 HA ASP 16 -1.361 4.946 0.415 102 HB2 ASP 16 HB2 ASP 16 -1.448 3.160 -1.419 103 HB3 ASP 16 HB1 ASP 16 -1.001 4.442 -2.546 104 H ALA 17 HN ALA 17 -1.975 6.426 -2.802 105 HA ALA 17 HA ALA 17 0.047 8.390 -2.657 106 HB1 ALA 17 HB1 ALA 17 -1.243 9.630 -4.315 107 HB2 ALA 17 HB2 ALA 17 -2.700 8.729 -3.900 108 HB3 ALA 17 HB3 ALA 17 -1.348 7.908 -4.678 109 H PHE 18 HN PHE 18 -3.233 8.398 -1.319 110 HA PHE 18 HA PHE 18 -3.265 11.128 -0.459 111 HB2 PHE 18 HB2 PHE 18 -5.288 9.707 -0.545 112 HB3 PHE 18 HB1 PHE 18 -4.641 8.712 0.759 113 HD1 PHE 18 HD2 PHE 18 -5.903 12.088 -0.120 114 HD2 PHE 18 HD1 PHE 18 -4.694 9.450 3.046 115 HE1 PHE 18 HE2 PHE 18 -6.848 13.660 1.550 116 HE2 PHE 18 HE1 PHE 18 -5.640 11.021 4.716 117 HZ PHE 18 HZ PHE 18 -6.717 13.125 3.967 118 H ILE 19 HN ILE 19 -2.075 8.155 1.068 119 HA ILE 19 HA ILE 19 -1.429 9.461 3.585 120 HB ILE 19 HB ILE 19 -0.557 6.812 2.396 121 HG12 ILE 19 HG12 ILE 19 -2.620 7.587 4.481 122 HG13 ILE 19 HG11 ILE 19 -2.946 6.923 2.880 123 HG21 ILE 19 HG21 ILE 19 0.444 8.289 4.671 124 HG22 ILE 19 HG22 ILE 19 0.980 6.732 4.039 125 HG23 ILE 19 HG23 ILE 19 -0.337 6.803 5.210 126 HD11 ILE 19 HD11 ILE 19 -1.078 5.229 4.295 127 HD12 ILE 19 HD12 ILE 19 -2.664 4.822 3.640 128 HD13 ILE 19 HD13 ILE 19 -2.526 5.481 5.270 129 H ASN 20 HN ASN 20 0.384 8.617 0.647 130 HA ASN 20 HA ASN 20 2.964 9.350 1.692 131 HB2 ASN 20 HB1 ASN 20 2.094 9.436 -1.207 132 HB3 ASN 20 HB2 ASN 20 3.729 9.212 -0.586 133 HD21 ASN 20 HD21 ASN 20 1.653 7.413 -2.165 134 HD22 ASN 20 HD22 ASN 20 1.829 5.919 -1.379 135 H SER 21 HN SER 21 0.683 11.133 -0.423 136 HA SER 21 HA SER 21 2.242 13.530 -0.517 137 HB2 SER 21 HB2 SER 21 0.221 12.853 -1.976 138 HB3 SER 21 HB1 SER 21 -0.773 13.478 -0.659 139 HG SER 21 HG SER 21 0.530 15.435 -0.859 140 H PHE 22 HN PHE 22 -0.063 12.294 1.824 141 HA PHE 22 HA PHE 22 -0.540 14.740 3.230 142 HB2 PHE 22 HB1 PHE 22 -1.954 12.793 3.597 143 HB3 PHE 22 HB2 PHE 22 -0.578 11.868 4.200 144 HD1 PHE 22 HD2 PHE 22 0.574 12.603 6.324 145 HD2 PHE 22 HD1 PHE 22 -3.139 14.308 5.000 146 HE1 PHE 22 HE2 PHE 22 0.177 13.504 8.601 147 HE2 PHE 22 HE1 PHE 22 -3.537 15.209 7.273 148 HZ PHE 22 HZ PHE 22 -1.879 14.807 9.075 149 H ILE 23 HN ILE 23 1.857 12.145 3.799 150 HA ILE 23 HA ILE 23 3.045 13.390 6.092 151 HB ILE 23 HB ILE 23 4.288 11.480 4.096 152 HG12 ILE 23 HG11 ILE 23 2.953 10.895 6.754 153 HG13 ILE 23 HG12 ILE 23 2.151 10.709 5.194 154 HG21 ILE 23 HG21 ILE 23 5.066 11.607 6.973 155 HG22 ILE 23 HG22 ILE 23 5.656 12.890 5.916 156 HG23 ILE 23 HG23 ILE 23 6.045 11.206 5.562 157 HD11 ILE 23 HD11 ILE 23 3.067 8.554 5.896 158 HD12 ILE 23 HD12 ILE 23 4.664 9.273 6.104 159 HD13 ILE 23 HD13 ILE 23 3.961 9.141 4.493 160 H SER 24 HN SER 24 4.245 13.241 2.713 161 HA SER 24 HA SER 24 6.455 14.952 3.047 162 HB2 SER 24 HB1 SER 24 6.364 15.315 0.648 163 HB3 SER 24 HB2 SER 24 5.916 13.641 0.976 164 HG SER 24 HG SER 24 4.546 15.110 -0.469 165 H ALA 25 HN ALA 25 3.045 15.754 2.607 166 HA ALA 25 HA ALA 25 3.557 18.604 2.271 167 HB1 ALA 25 HB1 ALA 25 1.091 16.926 2.702 168 HB2 ALA 25 HB2 ALA 25 1.539 17.886 1.291 169 HB3 ALA 25 HB3 ALA 25 1.009 18.687 2.771 170 H ALA 26 HN ALA 26 2.313 16.574 4.943 171 HA ALA 26 HA ALA 26 1.983 18.711 6.807 172 HB1 ALA 26 HB1 ALA 26 1.856 17.003 8.501 173 HB2 ALA 26 HB2 ALA 26 2.727 15.855 7.485 174 HB3 ALA 26 HB3 ALA 26 1.094 16.357 7.047 175 H SER 27 HN SER 27 4.812 16.753 5.976 176 HA SER 27 HA SER 27 6.469 17.536 8.157 177 HB2 SER 27 HB1 SER 27 8.333 16.805 6.786 178 HB3 SER 27 HB2 SER 27 6.982 15.703 6.521 179 HG SER 27 HG SER 27 8.222 17.398 4.787 180 H ASN 28 HN ASN 28 5.630 19.193 5.170 181 HA ASN 28 HA ASN 28 7.558 21.360 5.869 182 HB2 ASN 28 HB2 ASN 28 6.088 20.744 3.292 183 HB3 ASN 28 HB1 ASN 28 7.112 22.160 3.534 184 HD21 ASN 28 HD21 ASN 28 7.781 20.207 1.561 185 HD22 ASN 28 HD22 ASN 28 9.199 19.412 2.050 186 H THR 29 HN THR 29 4.481 20.674 6.635 187 HA THR 29 HA THR 29 3.336 23.307 5.936 188 HB THR 29 HB THR 29 2.073 21.111 7.594 189 HG1 THR 29 HG1 THR 29 2.386 20.163 5.690 190 HG21 THR 29 HG21 THR 29 0.152 22.343 7.485 191 HG22 THR 29 HG22 THR 29 0.519 22.956 5.873 192 HG23 THR 29 HG23 THR 29 1.281 23.682 7.287 193 H GLY 30 HN GLY 30 3.069 21.585 9.047 194 HA2 GLY 30 HA1 GLY 30 3.307 24.137 10.455 195 HA3 GLY 30 HA2 GLY 30 3.023 22.565 11.200 196 H SER 31 HN SER 31 4.752 21.498 12.087 197 HA SER 31 HA SER 31 7.480 22.552 11.481 198 HB2 SER 31 HB2 SER 31 7.990 22.183 13.940 199 HB3 SER 31 HB1 SER 31 6.893 23.522 13.604 200 HG SER 31 HG SER 31 6.293 21.927 15.304 201 H PHE 32 HN PHE 32 5.911 19.945 13.385 202 HA PHE 32 HA PHE 32 6.574 17.691 13.612 203 HB2 PHE 32 HB2 PHE 32 6.513 18.282 10.665 204 HB3 PHE 32 HB1 PHE 32 7.043 16.695 11.221 205 HD1 PHE 32 HD1 PHE 32 5.428 15.990 13.438 206 HD2 PHE 32 HD2 PHE 32 4.284 18.235 9.952 207 HE1 PHE 32 HE1 PHE 32 3.069 15.305 13.768 208 HE2 PHE 32 HE2 PHE 32 1.926 17.548 10.288 209 HZ PHE 32 HZ PHE 32 1.318 16.082 12.193 210 H SER 33 HN SER 33 8.558 18.083 14.770 211 HA SER 33 HA SER 33 11.042 18.764 13.570 212 HB2 SER 33 HB1 SER 33 12.021 18.201 15.619 213 HB3 SER 33 HB2 SER 33 10.355 18.539 16.093 214 HG SER 33 HG SER 33 10.757 16.603 16.972 215 H GLN 34 HN GLN 34 12.916 17.281 13.236 216 HA GLN 34 HA GLN 34 12.392 15.236 11.380 217 HB2 GLN 34 HB1 GLN 34 14.762 15.543 13.249 218 HB3 GLN 34 HB2 GLN 34 14.720 14.456 11.860 219 HG2 GLN 34 HG2 GLN 34 14.318 16.380 10.366 220 HG3 GLN 34 HG1 GLN 34 14.356 17.467 11.753 221 HE21 GLN 34 HE21 GLN 34 16.236 17.733 9.604 222 HE22 GLN 34 HE22 GLN 34 17.779 17.371 10.211 223 H ASP 35 HN ASP 35 12.780 15.027 14.905 224 HA ASP 35 HA ASP 35 12.723 12.187 15.120 225 HB2 ASP 35 HB2 ASP 35 13.238 13.849 16.975 226 HB3 ASP 35 HB1 ASP 35 11.501 14.126 17.101 227 H GLN 36 HN GLN 36 10.140 14.586 14.828 228 HA GLN 36 HA GLN 36 8.000 12.677 15.284 229 HB2 GLN 36 HB1 GLN 36 7.903 15.361 13.873 230 HB3 GLN 36 HB2 GLN 36 6.526 14.471 14.524 231 HG2 GLN 36 HG2 GLN 36 8.833 15.662 16.089 232 HG3 GLN 36 HG1 GLN 36 7.144 16.167 16.138 233 HE21 GLN 36 HE21 GLN 36 9.227 14.663 18.084 234 HE22 GLN 36 HE22 GLN 36 8.231 13.481 18.786 235 H MET 37 HN MET 37 9.774 13.862 12.481 236 HA MET 37 HA MET 37 8.021 12.829 10.463 237 HB2 MET 37 HB1 MET 37 11.017 13.303 10.449 238 HB3 MET 37 HB2 MET 37 10.079 12.888 9.015 239 HG2 MET 37 HG2 MET 37 8.629 14.902 9.489 240 HG3 MET 37 HG1 MET 37 9.772 15.350 10.755 241 HE1 MET 37 HE1 MET 37 8.863 17.104 8.564 242 HE2 MET 37 HE2 MET 37 10.229 17.763 7.667 243 HE3 MET 37 HE3 MET 37 10.248 17.787 9.428 244 H GLU 38 HN GLU 38 10.643 11.385 12.345 245 HA GLU 38 HA GLU 38 10.948 8.964 10.905 246 HB2 GLU 38 HB1 GLU 38 11.176 9.542 13.872 247 HB3 GLU 38 HB2 GLU 38 11.650 8.009 13.140 248 HG2 GLU 38 HG2 GLU 38 12.809 10.753 12.588 249 HG3 GLU 38 HG1 GLU 38 13.638 9.356 13.276 250 H ASN 39 HN ASN 39 8.749 9.715 13.624 251 HA ASN 39 HA ASN 39 7.462 7.202 13.762 252 HB2 ASN 39 HB2 ASN 39 6.257 9.951 14.208 253 HB3 ASN 39 HB1 ASN 39 5.559 8.428 14.760 254 HD21 ASN 39 HD21 ASN 39 6.366 10.539 16.578 255 HD22 ASN 39 HD22 ASN 39 7.644 9.940 17.522 256 H MET 40 HN MET 40 6.897 9.956 11.617 257 HA MET 40 HA MET 40 4.487 9.075 10.410 258 HB2 MET 40 HB1 MET 40 6.808 10.595 9.182 259 HB3 MET 40 HB2 MET 40 5.215 10.430 8.442 260 HG2 MET 40 HG1 MET 40 4.213 11.484 10.477 261 HG3 MET 40 HG2 MET 40 5.840 11.739 11.107 262 HE1 MET 40 HE1 MET 40 5.596 15.082 10.677 263 HE2 MET 40 HE2 MET 40 4.713 13.776 11.464 264 HE3 MET 40 HE3 MET 40 3.907 14.771 10.253 265 H SER 41 HN SER 41 7.822 8.084 9.920 266 HA SER 41 HA SER 41 7.352 6.583 7.498 267 HB2 SER 41 HB1 SER 41 9.512 6.166 9.588 268 HB3 SER 41 HB2 SER 41 9.544 5.599 7.918 269 HG SER 41 HG SER 41 10.617 7.709 8.555 270 H LEU 42 HN LEU 42 6.824 5.955 10.882 271 HA LEU 42 HA LEU 42 6.512 3.049 10.415 272 HB2 LEU 42 HB2 LEU 42 6.064 4.688 12.930 273 HB3 LEU 42 HB1 LEU 42 6.090 2.927 12.831 274 HG LEU 42 HG LEU 42 8.396 4.800 12.220 275 HD11 LEU 42 HD11 LEU 42 9.081 4.415 14.335 276 HD12 LEU 42 HD12 LEU 42 8.818 2.679 14.166 277 HD13 LEU 42 HD13 LEU 42 7.485 3.731 14.642 278 HD21 LEU 42 HD21 LEU 42 8.164 1.783 12.020 279 HD22 LEU 42 HD22 LEU 42 9.677 2.681 11.895 280 HD23 LEU 42 HD23 LEU 42 8.417 2.904 10.682 281 H ILE 43 HN ILE 43 4.628 5.928 10.503 282 HA ILE 43 HA ILE 43 2.129 4.283 10.543 283 HB ILE 43 HB ILE 43 2.577 7.180 11.332 284 HG12 ILE 43 HG12 ILE 43 3.288 5.702 13.084 285 HG13 ILE 43 HG11 ILE 43 1.685 6.282 13.537 286 HG21 ILE 43 HG21 ILE 43 0.421 6.970 10.217 287 HG22 ILE 43 HG22 ILE 43 0.157 7.113 11.951 288 HG23 ILE 43 HG23 ILE 43 0.030 5.537 11.168 289 HD11 ILE 43 HD11 ILE 43 1.319 4.034 13.853 290 HD12 ILE 43 HD12 ILE 43 2.549 3.563 12.680 291 HD13 ILE 43 HD13 ILE 43 0.963 4.104 12.128 292 H GLY 44 HN GLY 44 0.352 5.319 9.159 293 HA2 GLY 44 HA1 GLY 44 -0.380 6.171 7.096 294 HA3 GLY 44 HA2 GLY 44 1.088 7.146 7.052 295 H ASN 45 HN ASN 45 2.939 6.297 6.002 296 HA ASN 45 HA ASN 45 2.534 4.633 3.770 297 HB2 ASN 45 HB2 ASN 45 4.528 6.109 4.134 298 HB3 ASN 45 HB1 ASN 45 5.131 4.941 5.310 299 HD21 ASN 45 HD21 ASN 45 4.154 5.205 1.860 300 HD22 ASN 45 HD22 ASN 45 5.123 3.918 1.324 301 H THR 46 HN THR 46 3.581 3.775 7.057 302 HA THR 46 HA THR 46 4.194 1.046 6.572 303 HB THR 46 HB THR 46 2.989 2.314 9.052 304 HG1 THR 46 HG1 THR 46 5.679 1.665 8.460 305 HG21 THR 46 HG21 THR 46 2.710 -0.062 9.203 306 HG22 THR 46 HG22 THR 46 4.132 0.339 10.165 307 HG23 THR 46 HG23 THR 46 4.323 -0.354 8.554 308 H LEU 47 HN LEU 47 1.117 2.674 7.211 309 HA LEU 47 HA LEU 47 -0.538 0.409 7.548 310 HB2 LEU 47 HB2 LEU 47 -1.308 2.751 7.848 311 HB3 LEU 47 HB1 LEU 47 -1.209 2.992 6.103 312 HG LEU 47 HG LEU 47 -2.898 1.285 5.722 313 HD11 LEU 47 HD21 LEU 47 -2.345 0.712 8.593 314 HD12 LEU 47 HD22 LEU 47 -2.698 -0.403 7.273 315 HD13 LEU 47 HD23 LEU 47 -4.007 0.496 8.042 316 HD21 LEU 47 HD11 LEU 47 -4.644 2.642 6.268 317 HD22 LEU 47 HD12 LEU 47 -3.383 3.729 6.850 318 HD23 LEU 47 HD13 LEU 47 -4.217 2.662 7.978 319 H MET 48 HN MET 48 0.824 1.850 4.636 320 HA MET 48 HA MET 48 -0.741 0.567 2.671 321 HB2 MET 48 HB2 MET 48 0.976 2.265 2.142 322 HB3 MET 48 HB1 MET 48 2.242 1.126 2.602 323 HG2 MET 48 HG2 MET 48 1.307 -0.452 0.844 324 HG3 MET 48 HG1 MET 48 0.292 0.883 0.296 325 HE1 MET 48 HE1 MET 48 2.821 0.924 -2.538 326 HE2 MET 48 HE2 MET 48 1.137 0.859 -2.023 327 HE3 MET 48 HE3 MET 48 2.198 -0.513 -1.714 328 H ALA 49 HN ALA 49 1.849 -0.693 4.698 329 HA ALA 49 HA ALA 49 2.334 -3.120 3.277 330 HB1 ALA 49 HB1 ALA 49 2.505 -3.644 6.070 331 HB2 ALA 49 HB2 ALA 49 3.048 -1.984 5.818 332 HB3 ALA 49 HB3 ALA 49 3.828 -3.309 4.953 333 H ALA 50 HN ALA 50 -0.073 -2.237 5.729 334 HA ALA 50 HA ALA 50 -1.217 -4.833 6.069 335 HB1 ALA 50 HB1 ALA 50 -2.356 -2.043 6.349 336 HB2 ALA 50 HB2 ALA 50 -1.831 -3.131 7.634 337 HB3 ALA 50 HB3 ALA 50 -3.296 -3.488 6.719 338 H MET 51 HN MET 51 -1.499 -2.435 3.553 339 HA MET 51 HA MET 51 -3.930 -3.180 2.337 340 HB2 MET 51 HB2 MET 51 -2.604 -1.257 1.572 341 HB3 MET 51 HB1 MET 51 -1.333 -2.341 1.008 342 HG2 MET 51 HG2 MET 51 -3.236 -3.453 -0.390 343 HG3 MET 51 HG1 MET 51 -4.102 -1.943 -0.102 344 HE1 MET 51 HE1 MET 51 -1.420 0.082 0.048 345 HE2 MET 51 HE2 MET 51 -3.116 0.303 -0.375 346 HE3 MET 51 HE3 MET 51 -1.861 0.773 -1.520 347 H ASP 52 HN ASP 52 -0.773 -4.754 2.271 348 HA ASP 52 HA ASP 52 -1.495 -6.636 0.175 349 HB2 ASP 52 HB2 ASP 52 0.709 -6.671 2.259 350 HB3 ASP 52 HB1 ASP 52 0.554 -7.860 0.965 351 H ASN 53 HN ASN 53 -1.877 -6.492 3.646 352 HA ASN 53 HA ASN 53 -2.269 -9.260 4.187 353 HB2 ASN 53 HB2 ASN 53 -2.071 -7.375 5.884 354 HB3 ASN 53 HB1 ASN 53 -3.755 -6.987 5.527 355 HD21 ASN 53 HD21 ASN 53 -5.234 -8.041 6.859 356 HD22 ASN 53 HD22 ASN 53 -4.965 -9.526 7.637 357 H MET 54 HN MET 54 -4.249 -6.959 2.515 358 HA MET 54 HA MET 54 -6.806 -8.196 2.894 359 HB2 MET 54 HB2 MET 54 -5.855 -6.724 0.421 360 HB3 MET 54 HB1 MET 54 -7.519 -6.919 0.970 361 HG2 MET 54 HG2 MET 54 -5.319 -5.362 2.358 362 HG3 MET 54 HG1 MET 54 -6.765 -4.699 1.596 363 HE1 MET 54 HE1 MET 54 -8.772 -7.110 2.393 364 HE2 MET 54 HE2 MET 54 -9.189 -5.402 2.288 365 HE3 MET 54 HE3 MET 54 -9.606 -6.315 3.736 366 H GLY 55 HN GLY 55 -4.279 -8.662 0.424 367 HA2 GLY 55 HA1 GLY 55 -3.794 -10.725 -0.679 368 HA3 GLY 55 HA2 GLY 55 -5.294 -11.393 -0.034 369 H GLY 56 HN GLY 56 -5.735 -8.300 -1.355 370 HA2 GLY 56 HA2 GLY 56 -6.157 -7.732 -3.709 371 HA3 GLY 56 HA1 GLY 56 -6.508 -9.435 -4.006 372 H ARG 57 HN ARG 57 -7.763 -8.188 -1.062 373 HA ARG 57 HA ARG 57 -10.439 -7.821 -2.347 374 HB2 ARG 57 HB2 ARG 57 -11.477 -8.973 -0.482 375 HB3 ARG 57 HB1 ARG 57 -10.222 -10.017 -1.148 376 HG2 ARG 57 HG2 ARG 57 -8.667 -8.934 0.619 377 HG3 ARG 57 HG1 ARG 57 -10.155 -8.383 1.389 378 HD2 ARG 57 HD2 ARG 57 -10.945 -10.810 1.290 379 HD3 ARG 57 HD1 ARG 57 -9.290 -11.233 0.853 380 HE ARG 57 HE ARG 57 -8.676 -10.879 3.100 381 HH11 ARG 57 HH21 ARG 57 -11.953 -10.823 3.052 382 HH12 ARG 57 HH22 ARG 57 -12.168 -9.722 4.371 383 HH21 ARG 57 HH11 ARG 57 -8.822 -8.823 4.515 384 HH22 ARG 57 HH12 ARG 57 -10.396 -8.589 5.199 385 H ILE 58 HN ILE 58 -10.929 -5.692 -2.092 386 HA ILE 58 HA ILE 58 -10.234 -4.423 0.526 387 HB ILE 58 HB ILE 58 -10.727 -2.971 -2.082 388 HG12 ILE 58 HG12 ILE 58 -8.788 -4.460 -2.353 389 HG13 ILE 58 HG11 ILE 58 -8.264 -2.779 -2.243 390 HG21 ILE 58 HG21 ILE 58 -10.868 -1.898 0.306 391 HG22 ILE 58 HG22 ILE 58 -9.950 -1.071 -0.953 392 HG23 ILE 58 HG23 ILE 58 -9.109 -2.023 0.269 393 HD11 ILE 58 HD11 ILE 58 -7.435 -4.944 -0.617 394 HD12 ILE 58 HD12 ILE 58 -8.446 -3.919 0.403 395 HD13 ILE 58 HD13 ILE 58 -7.036 -3.238 -0.409 396 H THR 59 HN THR 59 -11.841 -3.093 1.494 397 HA THR 59 HA THR 59 -14.497 -2.966 0.202 398 HB THR 59 HB THR 59 -15.646 -4.270 1.719 399 HG1 THR 59 HG1 THR 59 -15.358 -3.916 3.752 400 HG21 THR 59 HG21 THR 59 -14.445 -6.307 2.166 401 HG22 THR 59 HG22 THR 59 -12.895 -5.467 2.105 402 HG23 THR 59 HG23 THR 59 -13.847 -5.668 0.633 403 HA PRO 60 HA PRO 60 -14.831 0.903 2.329 404 HB2 PRO 60 HB2 PRO 60 -17.403 0.958 3.159 405 HB3 PRO 60 HB1 PRO 60 -16.938 1.142 1.466 406 HG2 PRO 60 HG2 PRO 60 -17.939 -1.285 2.907 407 HG3 PRO 60 HG1 PRO 60 -18.388 -0.679 1.310 408 HD2 PRO 60 HD2 PRO 60 -16.649 -2.719 1.629 409 HD3 PRO 60 HD1 PRO 60 -16.504 -1.566 0.302 410 H SER 61 HN SER 61 -16.163 -1.854 4.140 411 HA SER 61 HA SER 61 -16.103 -0.547 6.708 412 HB2 SER 61 HB2 SER 61 -15.905 -3.517 6.122 413 HB3 SER 61 HB1 SER 61 -16.430 -2.772 7.631 414 HG SER 61 HG SER 61 -18.131 -3.479 6.146 415 H LYS 62 HN LYS 62 -13.758 -2.433 4.859 416 HA LYS 62 HA LYS 62 -11.836 -2.556 7.052 417 HB2 LYS 62 HB2 LYS 62 -11.911 -4.251 5.220 418 HB3 LYS 62 HB1 LYS 62 -11.402 -3.002 4.083 419 HG2 LYS 62 HG2 LYS 62 -9.390 -4.102 4.702 420 HG3 LYS 62 HG1 LYS 62 -9.404 -2.625 5.667 421 HD2 LYS 62 HD2 LYS 62 -10.290 -3.854 7.590 422 HD3 LYS 62 HD1 LYS 62 -10.380 -5.332 6.630 423 HE2 LYS 62 HE2 LYS 62 -7.756 -4.510 6.271 424 HE3 LYS 62 HE1 LYS 62 -8.070 -4.109 7.959 425 HZ1 LYS 62 HZ1 LYS 62 -7.757 -6.245 8.398 426 HZ2 LYS 62 HZ2 LYS 62 -7.722 -6.659 6.750 427 HZ3 LYS 62 HZ3 LYS 62 -9.203 -6.579 7.578 428 H LEU 63 HN LEU 63 -12.009 -0.744 3.968 429 HA LEU 63 HA LEU 63 -9.688 0.862 4.524 430 HB2 LEU 63 HB2 LEU 63 -11.933 0.930 2.567 431 HB3 LEU 63 HB1 LEU 63 -11.040 2.430 2.820 432 HG LEU 63 HG LEU 63 -8.958 1.379 2.237 433 HD11 LEU 63 HD21 LEU 63 -8.748 -1.000 1.814 434 HD12 LEU 63 HD22 LEU 63 -10.486 -1.230 2.006 435 HD13 LEU 63 HD23 LEU 63 -9.496 -0.792 3.398 436 HD21 LEU 63 HD11 LEU 63 -9.345 1.068 -0.036 437 HD22 LEU 63 HD12 LEU 63 -10.828 1.889 0.448 438 HD23 LEU 63 HD13 LEU 63 -10.819 0.141 0.241 439 H GLN 64 HN GLN 64 -13.184 1.477 4.903 440 HA GLN 64 HA GLN 64 -13.024 4.123 5.867 441 HB2 GLN 64 HB2 GLN 64 -15.172 2.996 5.407 442 HB3 GLN 64 HB1 GLN 64 -14.908 1.922 6.779 443 HG2 GLN 64 HG2 GLN 64 -16.230 3.559 7.768 444 HG3 GLN 64 HG1 GLN 64 -14.621 4.204 8.095 445 HE21 GLN 64 HE21 GLN 64 -14.423 6.373 7.537 446 HE22 GLN 64 HE22 GLN 64 -15.323 7.161 6.333 447 H ALA 65 HN ALA 65 -12.461 1.047 7.509 448 HA ALA 65 HA ALA 65 -12.149 2.221 10.146 449 HB1 ALA 65 HB1 ALA 65 -12.386 -0.354 9.188 450 HB2 ALA 65 HB2 ALA 65 -11.898 0.065 10.830 451 HB3 ALA 65 HB3 ALA 65 -10.674 -0.272 9.606 452 H LEU 66 HN LEU 66 -10.010 1.443 7.440 453 HA LEU 66 HA LEU 66 -7.569 2.094 8.878 454 HB2 LEU 66 HB2 LEU 66 -8.211 1.792 5.935 455 HB3 LEU 66 HB1 LEU 66 -6.598 2.183 6.524 456 HG LEU 66 HG LEU 66 -8.188 -0.346 6.939 457 HD11 LEU 66 HD11 LEU 66 -5.838 -1.237 6.338 458 HD12 LEU 66 HD12 LEU 66 -5.473 0.426 5.876 459 HD13 LEU 66 HD13 LEU 66 -6.761 -0.455 5.053 460 HD21 LEU 66 HD21 LEU 66 -6.053 0.850 8.683 461 HD22 LEU 66 HD22 LEU 66 -6.105 -0.900 8.460 462 HD23 LEU 66 HD23 LEU 66 -7.493 -0.057 9.148 463 H ASP 67 HN ASP 67 -9.494 3.803 6.367 464 HA ASP 67 HA ASP 67 -8.020 6.166 6.214 465 HB2 ASP 67 HB1 ASP 67 -10.221 5.599 5.017 466 HB3 ASP 67 HB2 ASP 67 -11.035 6.187 6.466 467 H MET 68 HN MET 68 -10.315 5.182 8.738 468 HA MET 68 HA MET 68 -10.080 7.661 10.224 469 HB2 MET 68 HB2 MET 68 -11.090 4.899 10.942 470 HB3 MET 68 HB1 MET 68 -11.074 6.231 12.098 471 HG2 MET 68 HG2 MET 68 -12.387 7.588 10.420 472 HG3 MET 68 HG1 MET 68 -12.543 6.124 9.449 473 HE1 MET 68 HE1 MET 68 -15.165 5.978 9.485 474 HE2 MET 68 HE2 MET 68 -14.938 7.610 10.109 475 HE3 MET 68 HE3 MET 68 -16.084 6.527 10.894 476 H ALA 69 HN ALA 69 -8.606 4.420 10.529 477 HA ALA 69 HA ALA 69 -7.035 4.971 12.838 478 HB1 ALA 69 HB1 ALA 69 -7.293 2.692 11.938 479 HB2 ALA 69 HB2 ALA 69 -5.584 3.117 12.054 480 HB3 ALA 69 HB3 ALA 69 -6.399 3.155 10.490 481 H PHE 70 HN PHE 70 -6.293 5.360 9.368 482 HA PHE 70 HA PHE 70 -3.636 6.252 9.576 483 HB2 PHE 70 HB1 PHE 70 -4.688 5.886 7.408 484 HB3 PHE 70 HB2 PHE 70 -5.829 7.197 7.703 485 HD1 PHE 70 HD2 PHE 70 -2.162 6.492 7.490 486 HD2 PHE 70 HD1 PHE 70 -5.300 9.385 7.035 487 HE1 PHE 70 HE2 PHE 70 -0.530 8.112 6.563 488 HE2 PHE 70 HE1 PHE 70 -3.669 11.008 6.106 489 HZ PHE 70 HZ PHE 70 -1.285 10.370 5.870 490 H ALA 71 HN ALA 71 -6.649 8.122 9.919 491 HA ALA 71 HA ALA 71 -5.304 10.637 10.395 492 HB1 ALA 71 HB1 ALA 71 -7.805 10.780 11.636 493 HB2 ALA 71 HB2 ALA 71 -8.041 9.640 10.311 494 HB3 ALA 71 HB3 ALA 71 -7.435 11.262 9.981 495 H SER 72 HN SER 72 -6.587 8.076 12.495 496 HA SER 72 HA SER 72 -6.115 9.490 14.964 497 HB2 SER 72 HB2 SER 72 -6.225 6.493 14.515 498 HB3 SER 72 HB1 SER 72 -6.481 7.339 16.041 499 HG SER 72 HG SER 72 -8.266 8.397 15.010 500 H SER 73 HN SER 73 -4.162 7.280 12.999 501 HA SER 73 HA SER 73 -2.041 7.012 14.934 502 HB2 SER 73 HB1 SER 73 -1.748 6.758 11.936 503 HB3 SER 73 HB2 SER 73 -0.812 5.942 13.190 504 HG SER 73 HG SER 73 -2.281 4.469 12.564 505 H VAL 74 HN VAL 74 -2.511 9.126 12.113 506 HA VAL 74 HA VAL 74 0.018 10.478 12.380 507 HB VAL 74 HB VAL 74 -1.527 10.480 10.341 508 HG11 VAL 74 HG11 VAL 74 -3.193 12.349 10.321 509 HG12 VAL 74 HG12 VAL 74 -2.921 12.554 12.051 510 HG13 VAL 74 HG13 VAL 74 -3.615 11.053 11.440 511 HG21 VAL 74 HG21 VAL 74 -1.079 13.120 10.102 512 HG22 VAL 74 HG22 VAL 74 0.222 11.934 10.006 513 HG23 VAL 74 HG23 VAL 74 -0.074 12.798 11.515 514 H ALA 75 HN ALA 75 -3.212 11.065 13.698 515 HA ALA 75 HA ALA 75 -2.712 13.653 14.763 516 HB1 ALA 75 HB1 ALA 75 -4.476 12.644 16.554 517 HB2 ALA 75 HB2 ALA 75 -4.681 11.483 15.242 518 HB3 ALA 75 HB3 ALA 75 -4.949 13.202 14.950 519 H GLN 76 HN GLN 76 -2.120 10.416 16.102 520 HA GLN 76 HA GLN 76 -1.285 11.358 18.699 521 HB2 GLN 76 HB1 GLN 76 -0.651 8.779 17.232 522 HB3 GLN 76 HB2 GLN 76 -0.304 9.079 18.935 523 HG2 GLN 76 HG2 GLN 76 -2.661 9.353 19.428 524 HG3 GLN 76 HG1 GLN 76 -3.073 9.270 17.714 525 HE21 GLN 76 HE21 GLN 76 -4.142 7.419 19.670 526 HE22 GLN 76 HE22 GLN 76 -3.521 5.876 19.334 527 H ILE 77 HN ILE 77 0.450 10.610 15.688 528 HA ILE 77 HA ILE 77 3.093 10.848 16.680 529 HB ILE 77 HB ILE 77 2.043 11.663 13.955 530 HG12 ILE 77 HG11 ILE 77 3.315 9.038 14.757 531 HG13 ILE 77 HG12 ILE 77 1.569 9.284 14.783 532 HG21 ILE 77 HG21 ILE 77 4.775 11.295 15.135 533 HG22 ILE 77 HG22 ILE 77 4.211 12.502 13.978 534 HG23 ILE 77 HG23 ILE 77 4.515 10.847 13.448 535 HD11 ILE 77 HD11 ILE 77 1.531 8.807 12.581 536 HD12 ILE 77 HD12 ILE 77 3.294 8.753 12.522 537 HD13 ILE 77 HD13 ILE 77 2.449 10.286 12.296 538 H ALA 78 HN ALA 78 0.995 13.351 15.257 539 HA ALA 78 HA ALA 78 2.904 15.469 15.855 540 HB1 ALA 78 HB1 ALA 78 1.262 16.961 14.948 541 HB2 ALA 78 HB2 ALA 78 -0.031 15.788 15.195 542 HB3 ALA 78 HB3 ALA 78 1.199 15.498 13.966 543 H ALA 79 HN ALA 79 -0.272 14.505 17.191 544 HA ALA 79 HA ALA 79 -0.402 16.475 19.228 545 HB1 ALA 79 HB1 ALA 79 -2.330 15.084 18.706 546 HB2 ALA 79 HB2 ALA 79 -1.904 14.847 20.400 547 HB3 ALA 79 HB3 ALA 79 -1.459 13.633 19.201 548 H SER 80 HN SER 80 1.508 13.572 18.980 549 HA SER 80 HA SER 80 2.129 13.426 21.829 550 HB2 SER 80 HB2 SER 80 2.241 11.411 20.428 551 HB3 SER 80 HB1 SER 80 3.487 12.159 19.429 552 HG SER 80 HG SER 80 4.694 11.121 20.841 553 H GLN 81 HN GLN 81 3.308 15.219 19.117 554 HA GLN 81 HA GLN 81 5.995 15.677 19.745 555 HB2 GLN 81 HB2 GLN 81 3.972 17.735 18.808 556 HB3 GLN 81 HB1 GLN 81 5.724 17.885 18.677 557 HG2 GLN 81 HG2 GLN 81 5.743 15.785 17.310 558 HG3 GLN 81 HG1 GLN 81 3.981 15.791 17.348 559 HE21 GLN 81 HE21 GLN 81 2.861 17.468 16.123 560 HE22 GLN 81 HE22 GLN 81 3.670 18.398 14.956 561 H GLY 82 HN GLY 82 3.133 16.793 21.424 562 HA2 GLY 82 HA2 GLY 82 2.971 17.749 23.573 563 HA3 GLY 82 HA1 GLY 82 4.720 17.578 23.726 564 H GLY 83 HN GLY 83 3.938 19.147 20.846 565 HA2 GLY 83 HA2 GLY 83 4.738 21.747 22.036 566 HA3 GLY 83 HA1 GLY 83 4.792 21.347 20.319 567 H ASP 84 HN ASP 84 3.523 23.159 19.686 568 HA ASP 84 HA ASP 84 0.996 23.810 20.901 569 HB2 ASP 84 HB2 ASP 84 2.405 25.320 19.403 570 HB3 ASP 84 HB1 ASP 84 1.796 24.386 18.038 571 H LEU 85 HN LEU 85 -0.893 22.705 20.720 572 HA LEU 85 HA LEU 85 -1.085 20.453 18.856 573 HB2 LEU 85 HB2 LEU 85 -2.023 20.297 21.141 574 HB3 LEU 85 HB1 LEU 85 -3.138 21.612 20.769 575 HG LEU 85 HG LEU 85 -3.681 19.978 18.690 576 HD11 LEU 85 HD11 LEU 85 -2.637 17.990 18.995 577 HD12 LEU 85 HD12 LEU 85 -3.828 17.708 20.266 578 HD13 LEU 85 HD13 LEU 85 -2.243 18.363 20.674 579 HD21 LEU 85 HD21 LEU 85 -5.701 19.547 19.775 580 HD22 LEU 85 HD22 LEU 85 -5.108 20.936 20.684 581 HD23 LEU 85 HD23 LEU 85 -4.925 19.310 21.340 582 H GLY 86 HN GLY 86 -2.047 23.779 18.938 583 HA2 GLY 86 HA2 GLY 86 -4.225 23.581 17.047 584 HA3 GLY 86 HA1 GLY 86 -3.365 25.061 17.473 585 H VAL 87 HN VAL 87 -0.723 24.024 16.749 586 HA VAL 87 HA VAL 87 -0.750 24.711 13.955 587 HB VAL 87 HB VAL 87 1.187 24.934 15.664 588 HG11 VAL 87 HG11 VAL 87 2.708 23.073 15.822 589 HG12 VAL 87 HG12 VAL 87 1.777 22.141 14.649 590 HG13 VAL 87 HG13 VAL 87 1.106 22.468 16.247 591 HG21 VAL 87 HG21 VAL 87 2.844 24.297 13.695 592 HG22 VAL 87 HG22 VAL 87 1.734 25.657 13.527 593 HG23 VAL 87 HG23 VAL 87 1.342 24.105 12.790 594 H THR 88 HN THR 88 -0.432 21.577 15.654 595 HA THR 88 HA THR 88 0.079 19.945 13.421 596 HB THR 88 HB THR 88 -1.723 19.352 15.790 597 HG1 THR 88 HG1 THR 88 0.477 19.837 16.256 598 HG21 THR 88 HG21 THR 88 -2.089 17.871 13.800 599 HG22 THR 88 HG22 THR 88 -1.449 17.012 15.202 600 HG23 THR 88 HG23 THR 88 -0.381 17.437 13.864 601 H THR 89 HN THR 89 -2.916 21.451 14.492 602 HA THR 89 HA THR 89 -4.736 20.102 12.785 603 HB THR 89 HB THR 89 -4.924 23.068 13.302 604 HG1 THR 89 HG1 THR 89 -5.494 20.990 15.143 605 HG21 THR 89 HG21 THR 89 -6.851 20.758 13.047 606 HG22 THR 89 HG22 THR 89 -6.749 22.206 12.047 607 HG23 THR 89 HG23 THR 89 -7.341 22.319 13.704 608 H ASN 90 HN ASN 90 -2.834 23.073 12.215 609 HA ASN 90 HA ASN 90 -3.625 23.282 9.442 610 HB2 ASN 90 HB2 ASN 90 -1.190 24.444 10.830 611 HB3 ASN 90 HB1 ASN 90 -1.852 24.967 9.282 612 HD21 ASN 90 HD21 ASN 90 -4.621 24.983 9.863 613 HD22 ASN 90 HD22 ASN 90 -4.928 26.153 11.053 614 H ALA 91 HN ALA 91 -0.873 21.842 11.148 615 HA ALA 91 HA ALA 91 0.665 21.179 8.823 616 HB1 ALA 91 HB1 ALA 91 1.777 19.526 10.322 617 HB2 ALA 91 HB2 ALA 91 0.542 19.842 11.542 618 HB3 ALA 91 HB3 ALA 91 1.653 21.124 11.059 619 H ILE 92 HN ILE 92 -1.541 19.159 10.787 620 HA ILE 92 HA ILE 92 -1.458 16.952 8.917 621 HB ILE 92 HB ILE 92 -3.330 17.640 11.197 622 HG12 ILE 92 HG12 ILE 92 -1.146 15.555 10.909 623 HG13 ILE 92 HG11 ILE 92 -0.980 17.080 11.779 624 HG21 ILE 92 HG21 ILE 92 -4.742 16.125 10.291 625 HG22 ILE 92 HG22 ILE 92 -3.522 14.910 10.680 626 HG23 ILE 92 HG23 ILE 92 -3.558 15.644 9.077 627 HD11 ILE 92 HD11 ILE 92 -3.068 16.315 13.107 628 HD12 ILE 92 HD12 ILE 92 -1.535 15.524 13.471 629 HD13 ILE 92 HD13 ILE 92 -2.727 14.713 12.454 630 H ALA 93 HN ALA 93 -3.837 19.527 9.587 631 HA ALA 93 HA ALA 93 -5.763 18.658 7.657 632 HB1 ALA 93 HB1 ALA 93 -6.244 20.315 9.445 633 HB2 ALA 93 HB2 ALA 93 -6.698 20.913 7.849 634 HB3 ALA 93 HB3 ALA 93 -5.214 21.482 8.615 635 H ASP 94 HN ASP 94 -3.088 21.014 7.392 636 HA ASP 94 HA ASP 94 -3.594 21.894 4.760 637 HB2 ASP 94 HB1 ASP 94 -1.031 21.526 6.308 638 HB3 ASP 94 HB2 ASP 94 -1.030 22.161 4.664 639 H ALA 95 HN ALA 95 -1.602 19.106 5.808 640 HA ALA 95 HA ALA 95 -1.047 18.266 3.095 641 HB1 ALA 95 HB1 ALA 95 -0.045 16.332 4.080 642 HB2 ALA 95 HB2 ALA 95 -0.994 16.507 5.557 643 HB3 ALA 95 HB3 ALA 95 0.288 17.661 5.190 644 H LEU 96 HN LEU 96 -3.538 17.529 5.468 645 HA LEU 96 HA LEU 96 -4.679 15.290 4.047 646 HB2 LEU 96 HB2 LEU 96 -5.015 16.212 6.530 647 HB3 LEU 96 HB1 LEU 96 -6.371 17.044 5.774 648 HG LEU 96 HG LEU 96 -7.056 14.793 4.802 649 HD11 LEU 96 HD11 LEU 96 -6.140 12.850 6.221 650 HD12 LEU 96 HD12 LEU 96 -4.846 13.955 6.683 651 HD13 LEU 96 HD13 LEU 96 -5.064 13.511 4.991 652 HD21 LEU 96 HD21 LEU 96 -7.623 13.963 7.313 653 HD22 LEU 96 HD22 LEU 96 -8.465 15.305 6.540 654 HD23 LEU 96 HD23 LEU 96 -7.138 15.622 7.657 655 H THR 97 HN THR 97 -5.180 18.785 3.940 656 HA THR 97 HA THR 97 -7.593 18.702 2.368 657 HB THR 97 HB THR 97 -5.503 20.881 2.626 658 HG1 THR 97 HG1 THR 97 -6.332 20.827 4.563 659 HG21 THR 97 HG21 THR 97 -8.029 20.655 1.123 660 HG22 THR 97 HG22 THR 97 -6.678 21.766 0.893 661 HG23 THR 97 HG23 THR 97 -7.898 22.103 2.122 662 H SER 98 HN SER 98 -4.205 19.396 1.413 663 HA SER 98 HA SER 98 -4.742 19.493 -1.389 664 HB2 SER 98 HB2 SER 98 -2.148 18.610 -0.099 665 HB3 SER 98 HB1 SER 98 -2.356 19.341 -1.691 666 HG SER 98 HG SER 98 -2.413 21.230 -0.802 667 H ALA 99 HN ALA 99 -4.040 16.795 0.775 668 HA ALA 99 HA ALA 99 -3.526 14.834 -1.246 669 HB1 ALA 99 HB1 ALA 99 -4.786 14.401 1.478 670 HB2 ALA 99 HB2 ALA 99 -3.051 14.521 1.187 671 HB3 ALA 99 HB3 ALA 99 -3.971 13.185 0.493 672 H PHE 100 HN PHE 100 -6.519 16.084 0.147 673 HA PHE 100 HA PHE 100 -8.304 14.100 -0.865 674 HB2 PHE 100 HB1 PHE 100 -8.504 16.874 0.141 675 HB3 PHE 100 HB2 PHE 100 -9.788 16.394 -0.967 676 HD1 PHE 100 HD1 PHE 100 -10.679 13.876 -0.512 677 HD2 PHE 100 HD2 PHE 100 -8.860 16.464 2.396 678 HE1 PHE 100 HE1 PHE 100 -11.782 12.603 1.312 679 HE2 PHE 100 HE2 PHE 100 -9.959 15.191 4.215 680 HZ PHE 100 HZ PHE 100 -11.417 13.260 3.672 681 H TYR 101 HN TYR 101 -7.504 17.306 -2.237 682 HA TYR 101 HA TYR 101 -8.808 16.741 -4.754 683 HB2 TYR 101 HB2 TYR 101 -6.666 18.821 -4.429 684 HB3 TYR 101 HB1 TYR 101 -8.148 18.894 -5.385 685 HD1 TYR 101 HD2 TYR 101 -10.285 18.176 -3.657 686 HD2 TYR 101 HD1 TYR 101 -6.726 20.378 -2.686 687 HE1 TYR 101 HE2 TYR 101 -11.465 19.236 -1.747 688 HE2 TYR 101 HE1 TYR 101 -7.906 21.441 -0.780 689 HH TYR 101 HH TYR 101 -9.838 20.956 0.685 690 H GLN 102 HN GLN 102 -5.536 16.397 -3.537 691 HA GLN 102 HA GLN 102 -4.316 15.936 -6.116 692 HB2 GLN 102 HB2 GLN 102 -3.463 15.231 -3.297 693 HB3 GLN 102 HB1 GLN 102 -2.459 14.936 -4.716 694 HG2 GLN 102 HG2 GLN 102 -3.607 17.662 -4.084 695 HG3 GLN 102 HG1 GLN 102 -2.036 17.137 -3.477 696 HE21 GLN 102 HE21 GLN 102 -3.270 18.968 -5.887 697 HE22 GLN 102 HE22 GLN 102 -2.133 18.669 -7.111 698 H THR 103 HN THR 103 -6.276 13.991 -4.033 699 HA THR 103 HA THR 103 -5.370 11.541 -5.484 700 HB THR 103 HB THR 103 -6.416 10.290 -3.613 701 HG1 THR 103 HG1 THR 103 -6.770 11.918 -1.758 702 HG21 THR 103 HG21 THR 103 -4.225 12.269 -3.270 703 HG22 THR 103 HG22 THR 103 -4.194 10.514 -3.099 704 HG23 THR 103 HG23 THR 103 -4.842 11.516 -1.799 705 H THR 104 HN THR 104 -8.457 12.799 -4.080 706 HA THR 104 HA THR 104 -9.779 11.685 -6.526 707 HB THR 104 HB THR 104 -11.632 10.937 -5.197 708 HG1 THR 104 HG1 THR 104 -11.811 11.446 -3.055 709 HG21 THR 104 HG21 THR 104 -9.447 10.148 -3.345 710 HG22 THR 104 HG22 THR 104 -9.191 9.804 -5.056 711 HG23 THR 104 HG23 THR 104 -10.597 9.140 -4.223 712 H GLY 105 HN GLY 105 -10.063 14.119 -3.919 713 HA2 GLY 105 HA2 GLY 105 -10.559 16.451 -4.576 714 HA3 GLY 105 HA1 GLY 105 -11.542 15.813 -5.889 715 H VAL 106 HN VAL 106 -11.462 14.940 -2.422 716 HA VAL 106 HA VAL 106 -14.404 15.409 -2.359 717 HB VAL 106 HB VAL 106 -12.695 13.997 -0.296 718 HG11 VAL 106 HG21 VAL 106 -14.731 14.492 0.731 719 HG12 VAL 106 HG22 VAL 106 -15.071 12.911 0.026 720 HG13 VAL 106 HG23 VAL 106 -15.633 14.376 -0.780 721 HG21 VAL 106 HG11 VAL 106 -12.831 13.073 -2.781 722 HG22 VAL 106 HG12 VAL 106 -14.426 12.536 -2.252 723 HG23 VAL 106 HG13 VAL 106 -12.982 11.980 -1.405 724 H VAL 107 HN VAL 107 -15.142 16.264 -0.091 725 HA VAL 107 HA VAL 107 -13.858 18.825 0.311 726 HB VAL 107 HB VAL 107 -15.488 19.036 2.192 727 HG11 VAL 107 HG21 VAL 107 -17.221 17.896 0.117 728 HG12 VAL 107 HG22 VAL 107 -15.976 18.963 -0.534 729 HG13 VAL 107 HG23 VAL 107 -17.100 19.561 0.687 730 HG21 VAL 107 HG11 VAL 107 -15.568 16.127 1.730 731 HG22 VAL 107 HG12 VAL 107 -17.162 16.872 1.889 732 HG23 VAL 107 HG13 VAL 107 -15.974 17.046 3.182 733 H ASN 108 HN ASN 108 -12.053 19.149 1.497 734 HA ASN 108 HA ASN 108 -10.935 17.099 3.211 735 HB2 ASN 108 HB2 ASN 108 -9.193 18.756 3.686 736 HB3 ASN 108 HB1 ASN 108 -9.543 18.734 1.958 737 HD21 ASN 108 HD21 ASN 108 -8.614 20.977 3.918 738 HD22 ASN 108 HD22 ASN 108 -9.678 22.256 3.583 739 H SER 109 HN SER 109 -12.832 20.012 3.741 740 HA SER 109 HA SER 109 -12.432 20.339 6.518 741 HB2 SER 109 HB2 SER 109 -14.996 20.815 4.973 742 HB3 SER 109 HB1 SER 109 -14.557 21.544 6.517 743 HG SER 109 HG SER 109 -12.982 22.697 5.544 744 H ARG 110 HN ARG 110 -14.558 18.075 4.802 745 HA ARG 110 HA ARG 110 -16.064 17.292 7.127 746 HB2 ARG 110 HB2 ARG 110 -16.864 16.794 4.868 747 HB3 ARG 110 HB1 ARG 110 -15.461 15.765 4.576 748 HG2 ARG 110 HG2 ARG 110 -16.168 14.270 6.403 749 HG3 ARG 110 HG1 ARG 110 -17.559 15.306 6.720 750 HD2 ARG 110 HD1 ARG 110 -18.276 14.915 4.324 751 HD3 ARG 110 HD2 ARG 110 -16.997 13.707 4.208 752 HE ARG 110 HE ARG 110 -19.537 13.365 5.575 753 HH11 ARG 110 HH21 ARG 110 -17.707 11.288 4.215 754 HH12 ARG 110 HH22 ARG 110 -17.262 10.318 5.580 755 HH21 ARG 110 HH11 ARG 110 -18.318 12.652 7.917 756 HH22 ARG 110 HH12 ARG 110 -17.608 11.091 7.675 757 H PHE 111 HN PHE 111 -13.333 15.642 5.476 758 HA PHE 111 HA PHE 111 -13.033 13.746 7.663 759 HB2 PHE 111 HB2 PHE 111 -12.386 13.343 5.237 760 HB3 PHE 111 HB1 PHE 111 -10.994 14.385 5.524 761 HD1 PHE 111 HD1 PHE 111 -12.752 11.533 7.230 762 HD2 PHE 111 HD2 PHE 111 -9.010 13.322 6.109 763 HE1 PHE 111 HE1 PHE 111 -11.535 9.623 8.242 764 HE2 PHE 111 HE2 PHE 111 -7.794 11.412 7.121 765 HZ PHE 111 HZ PHE 111 -9.055 9.563 8.187 766 H ILE 112 HN ILE 112 -11.176 16.582 6.547 767 HA ILE 112 HA ILE 112 -9.134 16.502 8.493 768 HB ILE 112 HB ILE 112 -10.466 18.874 7.159 769 HG12 ILE 112 HG12 ILE 112 -8.014 17.204 6.591 770 HG13 ILE 112 HG11 ILE 112 -9.401 17.480 5.541 771 HG21 ILE 112 HG21 ILE 112 -8.692 18.827 9.386 772 HG22 ILE 112 HG22 ILE 112 -9.221 20.230 8.457 773 HG23 ILE 112 HG23 ILE 112 -7.761 19.361 7.987 774 HD11 ILE 112 HD11 ILE 112 -7.538 18.858 4.781 775 HD12 ILE 112 HD12 ILE 112 -7.347 19.542 6.396 776 HD13 ILE 112 HD13 ILE 112 -8.791 19.903 5.449 777 H SER 113 HN SER 113 -12.327 18.108 8.669 778 HA SER 113 HA SER 113 -12.026 19.263 11.233 779 HB2 SER 113 HB2 SER 113 -14.484 18.097 9.893 780 HB3 SER 113 HB1 SER 113 -14.535 19.040 11.382 781 HG SER 113 HG SER 113 -14.680 20.634 10.011 782 H GLU 114 HN GLU 114 -13.030 15.978 10.307 783 HA GLU 114 HA GLU 114 -13.665 15.018 12.906 784 HB2 GLU 114 HB2 GLU 114 -14.053 13.822 10.702 785 HB3 GLU 114 HB1 GLU 114 -12.338 13.412 10.705 786 HG2 GLU 114 HG2 GLU 114 -12.620 12.288 12.893 787 HG3 GLU 114 HG1 GLU 114 -14.340 12.677 12.863 788 H ILE 115 HN ILE 115 -10.558 15.051 11.150 789 HA ILE 115 HA ILE 115 -9.050 13.805 13.261 790 HB ILE 115 HB ILE 115 -8.205 15.623 10.985 791 HG12 ILE 115 HG12 ILE 115 -7.949 12.627 11.377 792 HG13 ILE 115 HG11 ILE 115 -9.177 13.405 10.380 793 HG21 ILE 115 HG21 ILE 115 -6.330 15.846 12.287 794 HG22 ILE 115 HG22 ILE 115 -5.968 14.246 11.639 795 HG23 ILE 115 HG23 ILE 115 -6.695 14.407 13.238 796 HD11 ILE 115 HD11 ILE 115 -7.163 14.562 9.205 797 HD12 ILE 115 HD12 ILE 115 -7.489 12.871 8.828 798 HD13 ILE 115 HD13 ILE 115 -6.196 13.290 9.952 799 H ARG 116 HN ARG 116 -9.922 17.142 12.524 800 HA ARG 116 HA ARG 116 -8.171 18.530 14.235 801 HB2 ARG 116 HB2 ARG 116 -9.971 19.454 12.634 802 HB3 ARG 116 HB1 ARG 116 -11.097 19.233 13.971 803 HG2 ARG 116 HG1 ARG 116 -9.268 20.537 15.345 804 HG3 ARG 116 HG2 ARG 116 -8.757 21.098 13.753 805 HD2 ARG 116 HD2 ARG 116 -11.088 21.855 13.305 806 HD3 ARG 116 HD1 ARG 116 -11.535 21.371 14.941 807 HE ARG 116 HE ARG 116 -10.238 23.824 14.257 808 HH11 ARG 116 HH21 ARG 116 -11.582 22.674 16.881 809 HH12 ARG 116 HH22 ARG 116 -10.298 22.982 18.002 810 HH21 ARG 116 HH11 ARG 116 -7.938 23.602 15.539 811 HH22 ARG 116 HH12 ARG 116 -8.235 23.508 17.243 812 H SER 117 HN SER 117 -11.371 17.133 15.025 813 HA SER 117 HA SER 117 -11.193 17.813 17.828 814 HB2 SER 117 HB2 SER 117 -13.164 16.449 18.097 815 HB3 SER 117 HB1 SER 117 -13.326 17.301 16.562 816 HG SER 117 HG SER 117 -13.782 15.213 16.115 817 H LEU 118 HN LEU 118 -10.263 15.000 15.906 818 HA LEU 118 HA LEU 118 -9.760 13.236 18.118 819 HB2 LEU 118 HB2 LEU 118 -8.584 13.313 15.323 820 HB3 LEU 118 HB1 LEU 118 -8.338 11.992 16.468 821 HG LEU 118 HG LEU 118 -11.139 12.891 15.891 822 HD11 LEU 118 HD21 LEU 118 -9.273 11.835 13.915 823 HD12 LEU 118 HD22 LEU 118 -10.913 12.444 13.688 824 HD13 LEU 118 HD23 LEU 118 -10.651 10.761 14.148 825 HD21 LEU 118 HD11 LEU 118 -11.698 10.778 16.671 826 HD22 LEU 118 HD12 LEU 118 -10.213 11.064 17.578 827 HD23 LEU 118 HD13 LEU 118 -10.180 10.062 16.127 828 H ILE 119 HN ILE 119 -7.632 15.444 16.286 829 HA ILE 119 HA ILE 119 -5.213 14.814 17.621 830 HB ILE 119 HB ILE 119 -6.130 17.497 16.539 831 HG12 ILE 119 HG12 ILE 119 -4.419 15.373 15.221 832 HG13 ILE 119 HG11 ILE 119 -6.153 15.525 14.946 833 HG21 ILE 119 HG21 ILE 119 -3.728 16.655 17.919 834 HG22 ILE 119 HG22 ILE 119 -4.175 18.265 17.354 835 HG23 ILE 119 HG23 ILE 119 -3.345 17.148 16.270 836 HD11 ILE 119 HD11 ILE 119 -4.938 16.719 13.189 837 HD12 ILE 119 HD12 ILE 119 -4.056 17.649 14.400 838 HD13 ILE 119 HD13 ILE 119 -5.794 17.879 14.205 839 H GLY 120 HN GLY 120 -7.758 17.162 18.470 840 HA2 GLY 120 HA2 GLY 120 -6.387 18.121 20.832 841 HA3 GLY 120 HA1 GLY 120 -8.091 18.378 20.456 842 H MET 121 HN MET 121 -8.777 15.581 20.211 843 HA MET 121 HA MET 121 -9.466 14.963 22.885 844 HB2 MET 121 HB2 MET 121 -10.534 13.978 20.841 845 HB3 MET 121 HB1 MET 121 -9.096 12.980 20.621 846 HG2 MET 121 HG1 MET 121 -9.453 12.043 22.912 847 HG3 MET 121 HG2 MET 121 -10.955 12.963 23.018 848 HE1 MET 121 HE1 MET 121 -9.958 9.383 20.353 849 HE2 MET 121 HE2 MET 121 -8.963 10.155 21.585 850 HE3 MET 121 HE3 MET 121 -9.212 10.955 20.035 851 H PHE 122 HN PHE 122 -6.691 13.890 20.933 852 HA PHE 122 HA PHE 122 -5.648 12.020 22.820 853 HB2 PHE 122 HB2 PHE 122 -4.255 13.726 20.738 854 HB3 PHE 122 HB1 PHE 122 -3.461 12.438 21.644 855 HD1 PHE 122 HD2 PHE 122 -4.896 10.148 21.699 856 HD2 PHE 122 HD1 PHE 122 -5.118 13.167 18.652 857 HE1 PHE 122 HE2 PHE 122 -5.792 8.473 20.105 858 HE2 PHE 122 HE1 PHE 122 -6.015 11.492 17.057 859 HZ PHE 122 HZ PHE 122 -6.352 9.145 17.784 860 H ALA 123 HN ALA 123 -4.826 15.468 22.304 861 HA ALA 123 HA ALA 123 -2.990 15.644 24.482 862 HB1 ALA 123 HB1 ALA 123 -3.240 17.352 22.662 863 HB2 ALA 123 HB2 ALA 123 -3.247 18.054 24.280 864 HB3 ALA 123 HB3 ALA 123 -4.762 17.854 23.398 865 H GLN 124 HN GLN 124 -6.498 15.899 24.327 866 HA GLN 124 HA GLN 124 -6.834 16.945 27.002 867 HB2 GLN 124 HB2 GLN 124 -8.707 15.460 25.141 868 HB3 GLN 124 HB1 GLN 124 -9.204 16.100 26.709 869 HG2 GLN 124 HG2 GLN 124 -8.596 18.362 26.021 870 HG3 GLN 124 HG1 GLN 124 -7.969 17.757 24.488 871 HE21 GLN 124 HE21 GLN 124 -10.050 19.675 24.470 872 HE22 GLN 124 HE22 GLN 124 -11.467 18.937 23.897 873 H ALA 125 HN ALA 125 -6.560 13.707 25.631 874 HA ALA 125 HA ALA 125 -7.483 12.192 27.840 875 HB1 ALA 125 HB1 ALA 125 -6.712 11.401 25.489 876 HB2 ALA 125 HB2 ALA 125 -6.381 10.348 26.866 877 HB3 ALA 125 HB3 ALA 125 -5.098 11.355 26.196 878 H SER 126 HN SER 126 -4.299 13.639 27.213 879 HA SER 126 HA SER 126 -2.904 12.480 29.399 880 HB2 SER 126 HB2 SER 126 -2.548 15.278 28.282 881 HB3 SER 126 HB1 SER 126 -1.351 14.348 29.184 882 HG SER 126 HG SER 126 -2.493 13.233 26.888 883 H ALA 127 HN ALA 127 -5.141 15.202 29.253 884 HA ALA 127 HA ALA 127 -4.591 16.133 31.945 885 HB1 ALA 127 HB1 ALA 127 -6.573 16.720 29.810 886 HB2 ALA 127 HB2 ALA 127 -5.640 17.829 30.815 887 HB3 ALA 127 HB3 ALA 127 -7.089 17.059 31.462 888 H ASN 128 HN ASN 128 -6.331 13.484 30.650 889 HA ASN 128 HA ASN 128 -8.371 13.219 32.655 890 HB2 ASN 128 HB1 ASN 128 -8.267 11.981 30.441 891 HB3 ASN 128 HB2 ASN 128 -7.017 10.962 31.154 892 HD21 ASN 128 HD21 ASN 128 -9.198 9.536 30.455 893 HD22 ASN 128 HD22 ASN 128 -10.171 9.163 31.796 894 H ASP 129 HN ASP 129 -4.988 12.212 32.494 895 HA ASP 129 HA ASP 129 -5.029 10.498 34.796 896 HB2 ASP 129 HB2 ASP 129 -2.776 12.131 33.589 897 HB3 ASP 129 HB1 ASP 129 -2.560 10.900 34.833 898 H VAL 130 HN VAL 130 -4.071 13.932 34.447 899 HA VAL 130 HA VAL 130 -3.624 14.364 37.241 900 HB VAL 130 HB VAL 130 -2.772 15.938 35.591 901 HG11 VAL 130 HG11 VAL 130 -4.550 17.472 34.492 902 HG12 VAL 130 HG12 VAL 130 -5.696 16.194 34.893 903 HG13 VAL 130 HG13 VAL 130 -4.337 15.855 33.822 904 HG21 VAL 130 HG21 VAL 130 -3.190 16.928 37.745 905 HG22 VAL 130 HG22 VAL 130 -4.916 17.069 37.408 906 HG23 VAL 130 HG23 VAL 130 -3.761 18.076 36.534 907 H TYR 131 HN TYR 131 -6.522 14.524 35.233 908 HA TYR 131 HA TYR 131 -8.281 14.149 37.452 909 HB2 TYR 131 HB2 TYR 131 -9.272 16.331 37.693 910 HB3 TYR 131 HB1 TYR 131 -7.530 16.533 37.877 911 HD1 TYR 131 HD1 TYR 131 -10.414 17.036 35.621 912 HD2 TYR 131 HD2 TYR 131 -6.207 17.679 36.198 913 HE1 TYR 131 HE1 TYR 131 -10.399 18.638 33.729 914 HE2 TYR 131 HE2 TYR 131 -6.192 19.280 34.305 915 HH TYR 131 HH TYR 131 -7.776 19.569 32.128 916 H ALA 132 HN ALA 132 -10.629 14.516 36.719 917 HA ALA 132 HA ALA 132 -10.918 13.414 34.046 918 HB1 ALA 132 HB1 ALA 132 -12.900 14.333 36.139 919 HB2 ALA 132 HB2 ALA 132 -12.504 12.678 35.677 920 HB3 ALA 132 HB3 ALA 132 -13.403 13.712 34.566 921 H SER 133 HN SER 133 -10.785 14.671 32.258 922 HA SER 133 HA SER 133 -10.937 17.531 32.295 923 HB2 SER 133 HB2 SER 133 -9.784 16.174 30.529 924 HB3 SER 133 HB1 SER 133 -11.367 15.687 29.925 925 HG SER 133 HG SER 133 -10.042 17.846 29.305 926 H ALA 134 HN ALA 134 -12.627 18.897 31.429 927 HA ALA 134 HA ALA 134 -15.332 17.643 31.643 928 HB1 ALA 134 HB1 ALA 134 -15.522 19.299 33.202 929 HB2 ALA 134 HB2 ALA 134 -15.805 20.323 31.794 930 HB3 ALA 134 HB3 ALA 134 -14.196 20.235 32.513 931 H GLY 135 HN GLY 135 -16.885 18.131 30.026 932 HA2 GLY 135 HA2 GLY 135 -15.842 18.536 27.376 933 HA3 GLY 135 HA1 GLY 135 -17.552 18.499 27.803 934 H SER 136 HN SER 136 -16.104 20.363 25.992 935 HA SER 136 HA SER 136 -16.741 22.910 27.429 936 HB2 SER 136 HB2 SER 136 -14.701 22.481 25.225 937 HB3 SER 136 HB1 SER 136 -15.046 24.011 26.030 938 HG SER 136 HG SER 136 -13.448 23.305 27.238 939 H GLY 137 HN GLY 137 -17.879 24.493 26.204 940 HA2 GLY 137 HA2 GLY 137 -18.955 25.319 24.208 941 HA3 GLY 137 HA1 GLY 137 -18.740 23.733 23.468 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 -11.261 13.405 -13.069 2 H2 GLY 1 HT2 GLY 1 -9.812 12.835 -13.748 3 H3 GLY 1 HT3 GLY 1 -9.771 13.902 -12.427 4 HA2 GLY 1 HA2 GLY 1 -9.290 11.618 -11.748 5 HA3 GLY 1 HA1 GLY 1 -10.753 12.250 -10.992 6 H MET 2 HN MET 2 -10.904 9.683 -10.921 7 HA MET 2 HA MET 2 -12.431 8.838 -13.354 8 HB2 MET 2 HB2 MET 2 -10.742 7.155 -11.478 9 HB3 MET 2 HB1 MET 2 -11.756 6.504 -12.766 10 HG2 MET 2 HG2 MET 2 -10.477 7.881 -14.412 11 HG3 MET 2 HG1 MET 2 -9.415 8.404 -13.104 12 HE1 MET 2 HE1 MET 2 -8.138 6.761 -15.763 13 HE2 MET 2 HE2 MET 2 -6.886 6.222 -14.646 14 HE3 MET 2 HE3 MET 2 -7.601 7.820 -14.451 15 H GLY 3 HN GLY 3 -14.303 7.492 -12.928 16 HA2 GLY 3 HA2 GLY 3 -15.621 8.194 -10.398 17 HA3 GLY 3 HA1 GLY 3 -16.366 7.349 -11.753 18 H GLN 4 HN GLN 4 -13.434 5.886 -11.145 19 HA GLN 4 HA GLN 4 -14.613 3.459 -10.201 20 HB2 GLN 4 HB2 GLN 4 -11.736 4.415 -10.117 21 HB3 GLN 4 HB1 GLN 4 -12.245 2.766 -9.755 22 HG2 GLN 4 HG2 GLN 4 -13.199 2.548 -12.010 23 HG3 GLN 4 HG1 GLN 4 -12.741 4.212 -12.376 24 HE21 GLN 4 HE21 GLN 4 -11.709 2.077 -13.948 25 HE22 GLN 4 HE22 GLN 4 -10.051 1.897 -13.629 26 H ALA 5 HN ALA 5 -13.295 6.247 -8.531 27 HA ALA 5 HA ALA 5 -14.444 5.259 -6.027 28 HB1 ALA 5 HB1 ALA 5 -11.851 5.998 -5.221 29 HB2 ALA 5 HB2 ALA 5 -11.623 4.928 -6.605 30 HB3 ALA 5 HB3 ALA 5 -12.541 4.375 -5.204 31 H ASN 6 HN ASN 6 -14.746 6.965 -4.517 32 HA ASN 6 HA ASN 6 -13.996 9.675 -5.544 33 HB2 ASN 6 HB1 ASN 6 -16.078 10.533 -4.699 34 HB3 ASN 6 HB2 ASN 6 -16.467 9.089 -5.633 35 HD21 ASN 6 HD21 ASN 6 -18.233 9.994 -3.585 36 HD22 ASN 6 HD22 ASN 6 -18.215 8.864 -2.318 37 H THR 7 HN THR 7 -12.663 7.790 -3.576 38 HA THR 7 HA THR 7 -12.304 9.812 -1.440 39 HB THR 7 HB THR 7 -12.285 7.307 -0.120 40 HG1 THR 7 HG1 THR 7 -14.819 7.654 -1.223 41 HG21 THR 7 HG21 THR 7 -14.251 8.321 1.073 42 HG22 THR 7 HG22 THR 7 -14.238 9.621 -0.120 43 HG23 THR 7 HG23 THR 7 -12.857 9.395 0.953 44 HA PRO 8 HA PRO 8 -8.073 8.580 -1.959 45 HB2 PRO 8 HB2 PRO 8 -7.055 9.324 0.430 46 HB3 PRO 8 HB1 PRO 8 -7.496 10.481 -0.826 47 HG2 PRO 8 HG1 PRO 8 -8.989 9.684 1.630 48 HG3 PRO 8 HG2 PRO 8 -8.809 11.283 0.909 49 HD2 PRO 8 HD2 PRO 8 -11.051 9.760 0.610 50 HD3 PRO 8 HD1 PRO 8 -10.517 10.936 -0.591 51 H TRP 9 HN TRP 9 -9.730 7.554 1.012 52 HA TRP 9 HA TRP 9 -7.806 5.347 1.381 53 HB2 TRP 9 HB2 TRP 9 -9.294 4.766 3.327 54 HB3 TRP 9 HB1 TRP 9 -8.631 6.400 3.408 55 HD1 TRP 9 HD1 TRP 9 -11.869 4.505 2.662 56 HE1 TRP 9 HE1 TRP 9 -13.848 6.148 2.843 57 HE3 TRP 9 HE3 TRP 9 -9.323 8.879 3.295 58 HZ2 TRP 9 HZ2 TRP 9 -14.290 8.953 3.211 59 HZ3 TRP 9 HZ3 TRP 9 -10.542 11.020 3.560 60 HH2 TRP 9 HH2 TRP 9 -13.021 11.063 3.519 61 H SER 10 HN SER 10 -11.051 5.911 0.171 62 HA SER 10 HA SER 10 -12.053 3.271 0.155 63 HB2 SER 10 HB1 SER 10 -13.378 5.271 -0.487 64 HB3 SER 10 HB2 SER 10 -12.442 5.393 -1.977 65 HG SER 10 HG SER 10 -14.541 3.813 -1.407 66 H SER 11 HN SER 11 -9.563 4.732 -1.808 67 HA SER 11 HA SER 11 -9.463 2.234 -3.451 68 HB2 SER 11 HB1 SER 11 -9.743 4.674 -4.477 69 HB3 SER 11 HB2 SER 11 -7.993 4.711 -4.258 70 HG SER 11 HG SER 11 -9.143 2.443 -5.404 71 H LYS 12 HN LYS 12 -7.594 1.036 -3.385 72 HA LYS 12 HA LYS 12 -5.709 1.471 -1.266 73 HB2 LYS 12 HB2 LYS 12 -6.358 -0.693 -2.664 74 HB3 LYS 12 HB1 LYS 12 -4.979 -0.196 -3.642 75 HG2 LYS 12 HG2 LYS 12 -3.632 -0.057 -1.509 76 HG3 LYS 12 HG1 LYS 12 -4.999 -0.792 -0.672 77 HD2 LYS 12 HD1 LYS 12 -3.441 -2.553 -1.271 78 HD3 LYS 12 HD2 LYS 12 -4.870 -2.712 -2.292 79 HE2 LYS 12 HE2 LYS 12 -3.408 -2.721 -4.027 80 HE3 LYS 12 HE1 LYS 12 -3.285 -0.984 -3.751 81 HZ1 LYS 12 HZ1 LYS 12 -1.398 -1.299 -2.377 82 HZ2 LYS 12 HZ2 LYS 12 -1.124 -2.196 -3.794 83 HZ3 LYS 12 HZ3 LYS 12 -1.593 -2.983 -2.362 84 H ALA 13 HN ALA 13 -5.647 2.176 -4.739 85 HA ALA 13 HA ALA 13 -2.889 3.048 -4.770 86 HB1 ALA 13 HB1 ALA 13 -3.498 2.709 -6.946 87 HB2 ALA 13 HB2 ALA 13 -4.029 4.388 -6.857 88 HB3 ALA 13 HB3 ALA 13 -5.193 3.083 -6.630 89 H ASN 14 HN ASN 14 -6.016 4.717 -4.480 90 HA ASN 14 HA ASN 14 -4.842 7.352 -4.262 91 HB2 ASN 14 HB2 ASN 14 -7.554 6.423 -3.274 92 HB3 ASN 14 HB1 ASN 14 -7.072 8.079 -3.635 93 HD21 ASN 14 HD21 ASN 14 -5.623 7.524 -6.086 94 HD22 ASN 14 HD22 ASN 14 -6.779 7.100 -7.254 95 H ALA 15 HN ALA 15 -5.590 4.773 -1.993 96 HA ALA 15 HA ALA 15 -5.498 6.345 0.399 97 HB1 ALA 15 HB1 ALA 15 -5.645 3.553 -0.295 98 HB2 ALA 15 HB2 ALA 15 -6.125 4.345 1.206 99 HB3 ALA 15 HB3 ALA 15 -4.465 3.784 0.997 100 H ASP 16 HN ASP 16 -2.943 4.580 -1.349 101 HA ASP 16 HA ASP 16 -0.868 5.175 0.537 102 HB2 ASP 16 HB2 ASP 16 0.691 4.657 -1.335 103 HB3 ASP 16 HB1 ASP 16 -0.563 3.432 -1.147 104 H ALA 17 HN ALA 17 -1.746 6.799 -2.538 105 HA ALA 17 HA ALA 17 0.162 8.909 -2.278 106 HB1 ALA 17 HB1 ALA 17 -1.976 8.218 -4.052 107 HB2 ALA 17 HB2 ALA 17 -0.676 9.381 -4.314 108 HB3 ALA 17 HB3 ALA 17 -2.188 9.902 -3.568 109 H PHE 18 HN PHE 18 -3.070 8.439 -0.969 110 HA PHE 18 HA PHE 18 -3.410 11.147 -0.009 111 HB2 PHE 18 HB1 PHE 18 -5.341 9.680 -0.288 112 HB3 PHE 18 HB2 PHE 18 -4.671 8.530 0.867 113 HD1 PHE 18 HD1 PHE 18 -4.606 9.038 3.268 114 HD2 PHE 18 HD2 PHE 18 -6.299 11.796 0.445 115 HE1 PHE 18 HE1 PHE 18 -5.676 10.284 5.127 116 HE2 PHE 18 HE2 PHE 18 -7.368 13.042 2.302 117 HZ PHE 18 HZ PHE 18 -7.058 12.286 4.643 118 H ILE 19 HN ILE 19 -2.250 8.121 1.455 119 HA ILE 19 HA ILE 19 -1.724 9.325 4.044 120 HB ILE 19 HB ILE 19 -0.816 6.747 2.736 121 HG12 ILE 19 HG12 ILE 19 -2.810 7.408 4.923 122 HG13 ILE 19 HG11 ILE 19 -3.186 6.827 3.300 123 HG21 ILE 19 HG21 ILE 19 -0.447 6.471 5.465 124 HG22 ILE 19 HG22 ILE 19 0.141 8.106 5.154 125 HG23 ILE 19 HG23 ILE 19 0.837 6.738 4.285 126 HD11 ILE 19 HD11 ILE 19 -3.284 4.904 4.713 127 HD12 ILE 19 HD12 ILE 19 -1.780 5.340 5.527 128 HD13 ILE 19 HD13 ILE 19 -1.750 4.787 3.852 129 H ASN 20 HN ASN 20 0.281 8.467 1.222 130 HA ASN 20 HA ASN 20 2.753 9.405 2.369 131 HB2 ASN 20 HB2 ASN 20 2.987 7.929 0.548 132 HB3 ASN 20 HB1 ASN 20 1.810 8.799 -0.432 133 HD21 ASN 20 HD21 ASN 20 2.967 9.657 -2.167 134 HD22 ASN 20 HD22 ASN 20 4.411 10.541 -2.025 135 H SER 21 HN SER 21 0.487 10.887 0.023 136 HA SER 21 HA SER 21 1.835 13.374 -0.217 137 HB2 SER 21 HB1 SER 21 -1.134 12.753 -0.344 138 HB3 SER 21 HB2 SER 21 -0.417 14.286 -0.839 139 HG SER 21 HG SER 21 -0.302 13.256 -2.681 140 H PHE 22 HN PHE 22 -0.254 12.082 2.276 141 HA PHE 22 HA PHE 22 -0.724 14.598 3.632 142 HB2 PHE 22 HB1 PHE 22 -2.217 12.716 4.014 143 HB3 PHE 22 HB2 PHE 22 -0.878 11.728 4.599 144 HD1 PHE 22 HD1 PHE 22 0.441 12.619 6.648 145 HD2 PHE 22 HD2 PHE 22 -3.444 14.049 5.505 146 HE1 PHE 22 HE1 PHE 22 0.098 13.515 8.934 147 HE2 PHE 22 HE2 PHE 22 -3.788 14.943 7.790 148 HZ PHE 22 HZ PHE 22 -2.016 14.677 9.506 149 H ILE 23 HN ILE 23 1.498 11.865 4.272 150 HA ILE 23 HA ILE 23 2.813 13.121 6.487 151 HB ILE 23 HB ILE 23 3.903 11.052 4.555 152 HG12 ILE 23 HG11 ILE 23 1.776 10.356 5.591 153 HG13 ILE 23 HG12 ILE 23 3.123 9.422 6.240 154 HG21 ILE 23 HG21 ILE 23 4.754 10.987 7.358 155 HG22 ILE 23 HG22 ILE 23 5.226 12.474 6.537 156 HG23 ILE 23 HG23 ILE 23 5.727 10.911 5.889 157 HD11 ILE 23 HD11 ILE 23 3.016 11.646 7.905 158 HD12 ILE 23 HD12 ILE 23 2.387 10.042 8.285 159 HD13 ILE 23 HD13 ILE 23 1.318 11.271 7.608 160 H SER 24 HN SER 24 3.907 12.743 3.092 161 HA SER 24 HA SER 24 6.230 14.319 3.281 162 HB2 SER 24 HB1 SER 24 6.081 14.587 0.873 163 HB3 SER 24 HB2 SER 24 5.540 12.962 1.289 164 HG SER 24 HG SER 24 3.895 13.579 0.109 165 H ALA 25 HN ALA 25 2.868 15.353 2.723 166 HA ALA 25 HA ALA 25 3.628 18.151 2.402 167 HB1 ALA 25 HB1 ALA 25 1.611 17.590 1.313 168 HB2 ALA 25 HB2 ALA 25 1.074 18.458 2.752 169 HB3 ALA 25 HB3 ALA 25 1.004 16.697 2.706 170 H ALA 26 HN ALA 26 2.100 16.241 5.014 171 HA ALA 26 HA ALA 26 1.789 18.378 6.858 172 HB1 ALA 26 HB1 ALA 26 0.817 16.099 7.148 173 HB2 ALA 26 HB2 ALA 26 1.675 16.658 8.584 174 HB3 ALA 26 HB3 ALA 26 2.432 15.486 7.505 175 H SER 27 HN SER 27 4.592 16.348 6.124 176 HA SER 27 HA SER 27 6.220 17.184 8.322 177 HB2 SER 27 HB1 SER 27 8.082 16.297 7.057 178 HB3 SER 27 HB2 SER 27 6.695 15.239 6.792 179 HG SER 27 HG SER 27 7.845 15.854 4.860 180 H ASN 28 HN ASN 28 5.453 18.694 5.251 181 HA ASN 28 HA ASN 28 7.456 20.831 5.825 182 HB2 ASN 28 HB2 ASN 28 5.904 20.260 3.283 183 HB3 ASN 28 HB1 ASN 28 7.152 21.491 3.476 184 HD21 ASN 28 HD21 ASN 28 9.017 19.969 5.054 185 HD22 ASN 28 HD22 ASN 28 9.637 18.730 4.074 186 H THR 29 HN THR 29 4.368 20.256 6.626 187 HA THR 29 HA THR 29 3.283 22.894 5.842 188 HB THR 29 HB THR 29 1.968 20.781 7.567 189 HG1 THR 29 HG1 THR 29 2.286 19.757 5.703 190 HG21 THR 29 HG21 THR 29 -0.035 21.939 7.143 191 HG22 THR 29 HG22 THR 29 0.650 22.801 5.765 192 HG23 THR 29 HG23 THR 29 1.132 23.233 7.406 193 H GLY 30 HN GLY 30 3.022 21.238 8.994 194 HA2 GLY 30 HA2 GLY 30 3.323 23.819 10.346 195 HA3 GLY 30 HA1 GLY 30 3.009 22.268 11.128 196 H SER 31 HN SER 31 4.724 21.205 12.043 197 HA SER 31 HA SER 31 7.469 22.142 11.335 198 HB2 SER 31 HB1 SER 31 6.206 22.769 13.711 199 HB3 SER 31 HB2 SER 31 7.125 21.325 14.136 200 HG SER 31 HG SER 31 8.983 22.312 13.450 201 H PHE 32 HN PHE 32 5.839 19.671 13.365 202 HA PHE 32 HA PHE 32 6.431 17.407 13.680 203 HB2 PHE 32 HB2 PHE 32 6.339 17.869 10.708 204 HB3 PHE 32 HB1 PHE 32 6.775 16.281 11.338 205 HD1 PHE 32 HD1 PHE 32 5.164 15.746 13.579 206 HD2 PHE 32 HD2 PHE 32 4.096 17.983 10.067 207 HE1 PHE 32 HE1 PHE 32 2.771 15.239 13.983 208 HE2 PHE 32 HE2 PHE 32 1.705 17.473 10.472 209 HZ PHE 32 HZ PHE 32 1.042 16.101 12.429 210 H SER 33 HN SER 33 8.455 17.713 14.774 211 HA SER 33 HA SER 33 10.936 18.264 13.501 212 HB2 SER 33 HB2 SER 33 10.603 18.339 15.957 213 HB3 SER 33 HB1 SER 33 10.438 16.583 15.978 214 HG SER 33 HG SER 33 12.599 17.568 16.407 215 H GLN 34 HN GLN 34 12.742 16.683 13.179 216 HA GLN 34 HA GLN 34 12.096 14.640 11.360 217 HB2 GLN 34 HB1 GLN 34 14.500 14.853 13.198 218 HB3 GLN 34 HB2 GLN 34 14.388 13.757 11.821 219 HG2 GLN 34 HG2 GLN 34 14.068 15.685 10.312 220 HG3 GLN 34 HG1 GLN 34 14.172 16.782 11.689 221 HE21 GLN 34 HE21 GLN 34 16.046 16.942 9.527 222 HE22 GLN 34 HE22 GLN 34 17.573 16.500 10.120 223 H ASP 35 HN ASP 35 12.517 14.456 14.883 224 HA ASP 35 HA ASP 35 12.314 11.614 15.108 225 HB2 ASP 35 HB1 ASP 35 11.587 13.840 17.031 226 HB3 ASP 35 HB2 ASP 35 11.540 12.132 17.466 227 H GLN 36 HN GLN 36 9.867 14.166 14.921 228 HA GLN 36 HA GLN 36 7.639 12.390 15.480 229 HB2 GLN 36 HB1 GLN 36 7.611 15.055 14.032 230 HB3 GLN 36 HB2 GLN 36 6.239 14.260 14.806 231 HG2 GLN 36 HG2 GLN 36 8.749 15.173 16.246 232 HG3 GLN 36 HG1 GLN 36 7.219 16.052 16.234 233 HE21 GLN 36 HE21 GLN 36 8.896 14.253 18.311 234 HE22 GLN 36 HE22 GLN 36 7.674 13.326 19.037 235 H MET 37 HN MET 37 9.360 13.437 12.591 236 HA MET 37 HA MET 37 7.457 12.514 10.660 237 HB2 MET 37 HB2 MET 37 10.474 12.788 10.522 238 HB3 MET 37 HB1 MET 37 9.459 12.407 9.131 239 HG2 MET 37 HG2 MET 37 8.165 14.511 9.572 240 HG3 MET 37 HG1 MET 37 9.321 14.905 10.844 241 HE1 MET 37 HE1 MET 37 8.592 16.754 8.808 242 HE2 MET 37 HE2 MET 37 9.926 17.283 7.786 243 HE3 MET 37 HE3 MET 37 10.105 17.310 9.539 244 H GLU 38 HN GLU 38 10.063 10.900 12.430 245 HA GLU 38 HA GLU 38 10.087 8.448 10.998 246 HB2 GLU 38 HB1 GLU 38 11.703 9.151 12.819 247 HB3 GLU 38 HB2 GLU 38 10.450 8.748 13.992 248 HG2 GLU 38 HG1 GLU 38 10.381 6.437 13.137 249 HG3 GLU 38 HG2 GLU 38 11.619 6.836 11.946 250 H ASN 39 HN ASN 39 8.141 9.436 13.828 251 HA ASN 39 HA ASN 39 6.696 7.026 14.150 252 HB2 ASN 39 HB2 ASN 39 5.743 9.875 14.572 253 HB3 ASN 39 HB1 ASN 39 4.946 8.435 15.207 254 HD21 ASN 39 HD21 ASN 39 6.434 10.758 16.603 255 HD22 ASN 39 HD22 ASN 39 7.570 9.985 17.599 256 H MET 40 HN MET 40 5.993 9.845 12.102 257 HA MET 40 HA MET 40 3.535 8.934 11.022 258 HB2 MET 40 HB2 MET 40 5.717 10.575 9.697 259 HB3 MET 40 HB1 MET 40 4.073 10.403 9.082 260 HG2 MET 40 HG2 MET 40 3.373 11.206 11.474 261 HG3 MET 40 HG1 MET 40 5.026 11.815 11.562 262 HE1 MET 40 HE1 MET 40 5.328 14.044 8.455 263 HE2 MET 40 HE2 MET 40 5.958 12.532 9.102 264 HE3 MET 40 HE3 MET 40 5.916 13.967 10.122 265 H SER 41 HN SER 41 6.865 8.128 10.226 266 HA SER 41 HA SER 41 6.251 6.677 7.803 267 HB2 SER 41 HB2 SER 41 8.513 6.085 7.777 268 HB3 SER 41 HB1 SER 41 8.548 7.583 8.706 269 HG SER 41 HG SER 41 9.654 6.167 9.927 270 H LEU 42 HN LEU 42 6.083 5.932 11.198 271 HA LEU 42 HA LEU 42 5.980 3.024 10.729 272 HB2 LEU 42 HB2 LEU 42 5.396 4.566 13.274 273 HB3 LEU 42 HB1 LEU 42 5.739 2.841 13.136 274 HG LEU 42 HG LEU 42 7.658 5.074 12.401 275 HD11 LEU 42 HD11 LEU 42 8.661 4.811 14.455 276 HD12 LEU 42 HD12 LEU 42 8.200 3.114 14.580 277 HD13 LEU 42 HD13 LEU 42 7.016 4.377 14.918 278 HD21 LEU 42 HD21 LEU 42 8.991 2.619 12.723 279 HD22 LEU 42 HD22 LEU 42 8.691 3.466 11.205 280 HD23 LEU 42 HD23 LEU 42 7.554 2.243 11.771 281 H ILE 43 HN ILE 43 3.810 5.707 10.942 282 HA ILE 43 HA ILE 43 1.512 3.789 10.937 283 HB ILE 43 HB ILE 43 1.692 6.590 12.091 284 HG12 ILE 43 HG12 ILE 43 0.985 3.946 13.394 285 HG13 ILE 43 HG11 ILE 43 2.591 4.671 13.446 286 HG21 ILE 43 HG21 ILE 43 -0.579 6.734 12.138 287 HG22 ILE 43 HG22 ILE 43 -0.770 5.020 12.507 288 HG23 ILE 43 HG23 ILE 43 -0.524 5.540 10.842 289 HD11 ILE 43 HD11 ILE 43 1.123 5.172 15.458 290 HD12 ILE 43 HD12 ILE 43 0.097 6.114 14.377 291 HD13 ILE 43 HD13 ILE 43 1.774 6.592 14.639 292 H GLY 44 HN GLY 44 -0.074 4.147 9.356 293 HA2 GLY 44 HA2 GLY 44 -1.141 5.459 7.615 294 HA3 GLY 44 HA1 GLY 44 0.300 6.476 7.541 295 H ASN 45 HN ASN 45 2.174 5.647 6.430 296 HA ASN 45 HA ASN 45 1.623 4.067 4.120 297 HB2 ASN 45 HB2 ASN 45 4.246 4.697 5.513 298 HB3 ASN 45 HB1 ASN 45 4.137 3.897 3.945 299 HD21 ASN 45 HD21 ASN 45 5.073 6.740 4.858 300 HD22 ASN 45 HD22 ASN 45 4.279 7.768 3.765 301 H THR 46 HN THR 46 2.714 3.256 7.359 302 HA THR 46 HA THR 46 3.562 0.580 6.901 303 HB THR 46 HB THR 46 2.136 1.690 9.339 304 HG1 THR 46 HG1 THR 46 4.762 1.828 8.380 305 HG21 THR 46 HG21 THR 46 3.620 -0.111 10.438 306 HG22 THR 46 HG22 THR 46 3.793 -0.776 8.813 307 HG23 THR 46 HG23 THR 46 2.197 -0.665 9.556 308 H LEU 47 HN LEU 47 0.374 2.012 7.325 309 HA LEU 47 HA LEU 47 -1.102 -0.434 7.581 310 HB2 LEU 47 HB2 LEU 47 -1.957 2.254 6.463 311 HB3 LEU 47 HB1 LEU 47 -3.053 0.953 6.929 312 HG LEU 47 HG LEU 47 -1.132 2.430 8.755 313 HD11 LEU 47 HD11 LEU 47 -4.060 2.276 9.256 314 HD12 LEU 47 HD12 LEU 47 -3.550 3.287 7.903 315 HD13 LEU 47 HD13 LEU 47 -2.940 3.612 9.526 316 HD21 LEU 47 HD21 LEU 47 -2.459 1.033 10.500 317 HD22 LEU 47 HD22 LEU 47 -1.176 0.228 9.597 318 HD23 LEU 47 HD23 LEU 47 -2.861 -0.010 9.136 319 H MET 48 HN MET 48 -0.140 1.517 4.766 320 HA MET 48 HA MET 48 -1.594 0.189 2.760 321 HB2 MET 48 HB2 MET 48 1.246 1.251 2.624 322 HB3 MET 48 HB1 MET 48 0.250 0.846 1.226 323 HG2 MET 48 HG2 MET 48 -0.375 2.949 3.322 324 HG3 MET 48 HG1 MET 48 0.117 3.252 1.656 325 HE1 MET 48 HE1 MET 48 -2.107 0.721 0.127 326 HE2 MET 48 HE2 MET 48 -0.777 1.853 -0.098 327 HE3 MET 48 HE3 MET 48 -2.403 2.305 -0.600 328 H ALA 49 HN ALA 49 1.360 -0.808 4.427 329 HA ALA 49 HA ALA 49 2.032 -3.005 2.732 330 HB1 ALA 49 HB1 ALA 49 2.868 -1.971 5.285 331 HB2 ALA 49 HB2 ALA 49 3.745 -3.042 4.193 332 HB3 ALA 49 HB3 ALA 49 2.658 -3.717 5.407 333 H ALA 50 HN ALA 50 -0.323 -2.643 5.323 334 HA ALA 50 HA ALA 50 -0.900 -5.451 5.631 335 HB1 ALA 50 HB1 ALA 50 -2.484 -2.945 6.245 336 HB2 ALA 50 HB2 ALA 50 -1.611 -3.973 7.381 337 HB3 ALA 50 HB3 ALA 50 -3.082 -4.564 6.609 338 H MET 51 HN MET 51 -2.145 -2.903 3.519 339 HA MET 51 HA MET 51 -4.374 -4.318 2.457 340 HB2 MET 51 HB2 MET 51 -2.575 -2.335 1.029 341 HB3 MET 51 HB1 MET 51 -4.214 -2.780 0.554 342 HG2 MET 51 HG2 MET 51 -5.121 -1.844 2.601 343 HG3 MET 51 HG1 MET 51 -3.501 -1.548 3.232 344 HE1 MET 51 HE1 MET 51 -5.839 0.521 3.071 345 HE2 MET 51 HE2 MET 51 -5.025 1.985 2.526 346 HE3 MET 51 HE3 MET 51 -4.251 0.951 3.723 347 H ASP 52 HN ASP 52 -0.932 -4.535 1.793 348 HA ASP 52 HA ASP 52 -1.019 -5.900 -0.694 349 HB2 ASP 52 HB2 ASP 52 0.925 -6.091 1.622 350 HB3 ASP 52 HB1 ASP 52 1.185 -6.904 0.079 351 H ASN 53 HN ASN 53 -1.583 -7.029 2.588 352 HA ASN 53 HA ASN 53 -1.439 -9.840 2.064 353 HB2 ASN 53 HB2 ASN 53 -3.157 -8.365 4.084 354 HB3 ASN 53 HB1 ASN 53 -2.770 -10.085 4.123 355 HD21 ASN 53 HD21 ASN 53 -0.030 -10.052 3.471 356 HD22 ASN 53 HD22 ASN 53 0.823 -9.229 4.686 357 H MET 54 HN MET 54 -3.902 -7.432 1.453 358 HA MET 54 HA MET 54 -6.181 -9.078 1.154 359 HB2 MET 54 HB2 MET 54 -5.357 -6.612 -0.409 360 HB3 MET 54 HB1 MET 54 -6.964 -7.337 -0.475 361 HG2 MET 54 HG1 MET 54 -5.612 -6.316 2.043 362 HG3 MET 54 HG2 MET 54 -6.867 -5.460 1.149 363 HE1 MET 54 HE1 MET 54 -9.895 -7.850 1.343 364 HE2 MET 54 HE2 MET 54 -8.609 -7.967 0.144 365 HE3 MET 54 HE3 MET 54 -9.187 -6.383 0.654 366 H GLY 55 HN GLY 55 -3.454 -8.529 -1.020 367 HA2 GLY 55 HA2 GLY 55 -2.754 -10.211 -2.621 368 HA3 GLY 55 HA1 GLY 55 -4.408 -10.824 -2.651 369 H GLY 56 HN GLY 56 -4.450 -7.465 -2.711 370 HA2 GLY 56 HA2 GLY 56 -4.166 -5.993 -4.668 371 HA3 GLY 56 HA1 GLY 56 -4.429 -7.401 -5.696 372 H ARG 57 HN ARG 57 -6.489 -7.399 -3.001 373 HA ARG 57 HA ARG 57 -8.666 -6.118 -4.606 374 HB2 ARG 57 HB2 ARG 57 -10.212 -7.823 -3.715 375 HB3 ARG 57 HB1 ARG 57 -8.904 -8.575 -4.628 376 HG2 ARG 57 HG2 ARG 57 -7.684 -8.839 -2.396 377 HG3 ARG 57 HG1 ARG 57 -9.207 -8.397 -1.622 378 HD2 ARG 57 HD2 ARG 57 -8.724 -10.752 -3.469 379 HD3 ARG 57 HD1 ARG 57 -9.094 -10.817 -1.746 380 HE ARG 57 HE ARG 57 -11.115 -9.483 -3.423 381 HH11 ARG 57 HH21 ARG 57 -10.874 -11.300 -0.739 382 HH12 ARG 57 HH22 ARG 57 -12.026 -12.515 -1.181 383 HH21 ARG 57 HH11 ARG 57 -12.231 -11.493 -4.489 384 HH22 ARG 57 HH12 ARG 57 -12.794 -12.625 -3.305 385 H ILE 58 HN ILE 58 -9.264 -4.303 -3.520 386 HA ILE 58 HA ILE 58 -9.319 -4.441 -0.533 387 HB ILE 58 HB ILE 58 -9.054 -1.924 -2.194 388 HG12 ILE 58 HG12 ILE 58 -7.089 -3.224 -2.681 389 HG13 ILE 58 HG11 ILE 58 -6.624 -2.052 -1.448 390 HG21 ILE 58 HG21 ILE 58 -8.471 -0.892 -0.118 391 HG22 ILE 58 HG22 ILE 58 -8.295 -2.450 0.687 392 HG23 ILE 58 HG23 ILE 58 -9.896 -1.874 0.221 393 HD11 ILE 58 HD11 ILE 58 -5.869 -3.824 -0.263 394 HD12 ILE 58 HD12 ILE 58 -6.728 -4.974 -1.289 395 HD13 ILE 58 HD13 ILE 58 -7.569 -4.182 0.043 396 H THR 59 HN THR 59 -11.152 -3.573 0.513 397 HA THR 59 HA THR 59 -13.459 -2.991 -1.306 398 HB THR 59 HB THR 59 -14.729 -3.807 0.899 399 HG1 THR 59 HG1 THR 59 -13.508 -4.897 2.200 400 HG21 THR 59 HG21 THR 59 -15.332 -5.094 -0.877 401 HG22 THR 59 HG22 THR 59 -14.187 -6.249 -0.194 402 HG23 THR 59 HG23 THR 59 -13.684 -5.176 -1.500 403 HA PRO 60 HA PRO 60 -14.028 0.883 0.761 404 HB2 PRO 60 HB2 PRO 60 -16.720 1.084 0.872 405 HB3 PRO 60 HB1 PRO 60 -15.806 1.262 -0.628 406 HG2 PRO 60 HG2 PRO 60 -17.306 -1.111 0.413 407 HG3 PRO 60 HG1 PRO 60 -17.250 -0.464 -1.229 408 HD2 PRO 60 HD2 PRO 60 -15.795 -2.620 -0.468 409 HD3 PRO 60 HD1 PRO 60 -15.236 -1.490 -1.702 410 H SER 61 HN SER 61 -15.658 -1.933 2.118 411 HA SER 61 HA SER 61 -16.371 -0.627 4.615 412 HB2 SER 61 HB2 SER 61 -16.061 -3.589 4.033 413 HB3 SER 61 HB1 SER 61 -16.934 -2.873 5.389 414 HG SER 61 HG SER 61 -18.334 -3.433 3.679 415 H LYS 62 HN LYS 62 -13.786 -2.898 3.646 416 HA LYS 62 HA LYS 62 -12.483 -3.026 6.170 417 HB2 LYS 62 HB2 LYS 62 -11.982 -4.499 4.202 418 HB3 LYS 62 HB1 LYS 62 -11.174 -3.133 3.436 419 HG2 LYS 62 HG2 LYS 62 -9.652 -2.980 5.413 420 HG3 LYS 62 HG1 LYS 62 -10.415 -4.428 6.072 421 HD2 LYS 62 HD2 LYS 62 -9.788 -5.636 3.956 422 HD3 LYS 62 HD1 LYS 62 -8.884 -4.204 3.464 423 HE2 LYS 62 HE2 LYS 62 -8.342 -6.083 5.756 424 HE3 LYS 62 HE1 LYS 62 -7.238 -5.528 4.496 425 HZ1 LYS 62 HZ1 LYS 62 -7.528 -3.249 5.476 426 HZ2 LYS 62 HZ2 LYS 62 -6.672 -4.357 6.439 427 HZ3 LYS 62 HZ3 LYS 62 -8.292 -3.988 6.796 428 H LEU 63 HN LEU 63 -11.798 -0.904 3.374 429 HA LEU 63 HA LEU 63 -9.761 0.633 4.647 430 HB2 LEU 63 HB2 LEU 63 -11.617 1.077 2.333 431 HB3 LEU 63 HB1 LEU 63 -10.651 2.424 2.930 432 HG LEU 63 HG LEU 63 -8.632 1.409 2.342 433 HD11 LEU 63 HD21 LEU 63 -8.306 -0.975 2.013 434 HD12 LEU 63 HD22 LEU 63 -10.040 -1.270 2.126 435 HD13 LEU 63 HD23 LEU 63 -9.142 -0.743 3.548 436 HD21 LEU 63 HD11 LEU 63 -10.195 -0.032 0.261 437 HD22 LEU 63 HD12 LEU 63 -8.862 1.106 0.077 438 HD23 LEU 63 HD13 LEU 63 -10.488 1.696 0.423 439 H GLN 64 HN GLN 64 -13.278 1.070 4.478 440 HA GLN 64 HA GLN 64 -13.473 3.599 5.710 441 HB2 GLN 64 HB2 GLN 64 -15.395 2.306 4.757 442 HB3 GLN 64 HB1 GLN 64 -15.328 1.241 6.160 443 HG2 GLN 64 HG1 GLN 64 -15.702 3.192 7.642 444 HG3 GLN 64 HG2 GLN 64 -15.808 4.236 6.225 445 HE21 GLN 64 HE21 GLN 64 -18.069 4.258 7.747 446 HE22 GLN 64 HE22 GLN 64 -19.301 3.313 7.061 447 H ALA 65 HN ALA 65 -12.962 0.404 7.140 448 HA ALA 65 HA ALA 65 -13.217 1.336 9.878 449 HB1 ALA 65 HB1 ALA 65 -12.532 -1.177 8.501 450 HB2 ALA 65 HB2 ALA 65 -13.445 -0.922 9.988 451 HB3 ALA 65 HB3 ALA 65 -11.682 -0.939 10.027 452 H LEU 66 HN LEU 66 -10.402 0.445 7.849 453 HA LEU 66 HA LEU 66 -8.509 1.392 9.829 454 HB2 LEU 66 HB1 LEU 66 -6.861 1.156 7.882 455 HB3 LEU 66 HB2 LEU 66 -7.697 -0.308 8.395 456 HG LEU 66 HG LEU 66 -9.347 0.961 6.455 457 HD11 LEU 66 HD11 LEU 66 -7.788 0.947 4.512 458 HD12 LEU 66 HD12 LEU 66 -6.442 0.701 5.626 459 HD13 LEU 66 HD13 LEU 66 -7.379 2.195 5.690 460 HD21 LEU 66 HD21 LEU 66 -7.552 -1.411 5.963 461 HD22 LEU 66 HD22 LEU 66 -9.196 -1.136 5.381 462 HD23 LEU 66 HD23 LEU 66 -8.913 -1.516 7.080 463 H ASP 67 HN ASP 67 -9.637 2.751 6.693 464 HA ASP 67 HA ASP 67 -8.008 5.002 6.576 465 HB2 ASP 67 HB2 ASP 67 -9.613 5.989 5.167 466 HB3 ASP 67 HB1 ASP 67 -9.931 4.264 4.998 467 H MET 68 HN MET 68 -10.669 4.396 8.789 468 HA MET 68 HA MET 68 -10.873 7.128 9.738 469 HB2 MET 68 HB2 MET 68 -11.790 4.464 10.833 470 HB3 MET 68 HB1 MET 68 -12.030 5.970 11.720 471 HG2 MET 68 HG2 MET 68 -13.145 6.894 9.634 472 HG3 MET 68 HG1 MET 68 -13.100 5.258 8.978 473 HE1 MET 68 HE1 MET 68 -15.327 6.782 12.666 474 HE2 MET 68 HE2 MET 68 -15.170 7.734 11.193 475 HE3 MET 68 HE3 MET 68 -13.726 7.251 12.078 476 H ALA 69 HN ALA 69 -9.023 4.275 10.723 477 HA ALA 69 HA ALA 69 -8.028 5.401 13.181 478 HB1 ALA 69 HB1 ALA 69 -6.257 3.611 12.945 479 HB2 ALA 69 HB2 ALA 69 -6.975 3.198 11.389 480 HB3 ALA 69 HB3 ALA 69 -7.915 3.013 12.870 481 H PHE 70 HN PHE 70 -6.910 5.503 9.830 482 HA PHE 70 HA PHE 70 -4.290 6.446 10.189 483 HB2 PHE 70 HB1 PHE 70 -5.215 5.930 7.975 484 HB3 PHE 70 HB2 PHE 70 -6.312 7.305 8.097 485 HD1 PHE 70 HD2 PHE 70 -2.814 6.254 7.641 486 HD2 PHE 70 HD1 PHE 70 -5.488 9.602 7.918 487 HE1 PHE 70 HE2 PHE 70 -1.040 7.743 6.756 488 HE2 PHE 70 HE1 PHE 70 -3.715 11.092 7.032 489 HZ PHE 70 HZ PHE 70 -1.491 10.161 6.451 490 H ALA 71 HN ALA 71 -7.345 8.235 10.397 491 HA ALA 71 HA ALA 71 -6.105 10.834 10.640 492 HB1 ALA 71 HB1 ALA 71 -8.581 10.910 11.978 493 HB2 ALA 71 HB2 ALA 71 -8.783 9.731 10.682 494 HB3 ALA 71 HB3 ALA 71 -8.266 11.373 10.305 495 H SER 72 HN SER 72 -7.443 8.553 13.051 496 HA SER 72 HA SER 72 -6.719 10.187 15.313 497 HB2 SER 72 HB2 SER 72 -7.279 8.254 16.657 498 HB3 SER 72 HB1 SER 72 -8.444 8.353 15.337 499 HG SER 72 HG SER 72 -6.778 6.925 14.237 500 H SER 73 HN SER 73 -5.013 7.729 13.454 501 HA SER 73 HA SER 73 -2.901 7.316 15.374 502 HB2 SER 73 HB1 SER 73 -2.685 6.982 12.377 503 HB3 SER 73 HB2 SER 73 -1.767 6.139 13.625 504 HG SER 73 HG SER 73 -4.030 5.396 12.533 505 H VAL 74 HN VAL 74 -3.182 9.383 12.490 506 HA VAL 74 HA VAL 74 -0.551 10.532 12.772 507 HB VAL 74 HB VAL 74 -2.014 10.555 10.683 508 HG11 VAL 74 HG11 VAL 74 -3.562 12.509 10.516 509 HG12 VAL 74 HG12 VAL 74 -3.319 12.805 12.238 510 HG13 VAL 74 HG13 VAL 74 -4.094 11.315 11.700 511 HG21 VAL 74 HG21 VAL 74 -1.374 13.350 10.836 512 HG22 VAL 74 HG22 VAL 74 -0.499 12.070 9.995 513 HG23 VAL 74 HG23 VAL 74 -0.129 12.430 11.682 514 H ALA 75 HN ALA 75 -3.761 11.433 13.950 515 HA ALA 75 HA ALA 75 -3.123 14.027 14.899 516 HB1 ALA 75 HB1 ALA 75 -5.125 11.960 15.817 517 HB2 ALA 75 HB2 ALA 75 -5.422 13.424 14.879 518 HB3 ALA 75 HB3 ALA 75 -5.001 13.541 16.588 519 H GLN 76 HN GLN 76 -2.770 10.846 16.455 520 HA GLN 76 HA GLN 76 -1.857 11.919 18.980 521 HB2 GLN 76 HB1 GLN 76 -2.790 9.609 18.663 522 HB3 GLN 76 HB2 GLN 76 -1.308 9.177 17.808 523 HG2 GLN 76 HG2 GLN 76 0.014 9.778 19.812 524 HG3 GLN 76 HG1 GLN 76 -1.476 10.184 20.666 525 HE21 GLN 76 HE21 GLN 76 0.030 8.193 21.833 526 HE22 GLN 76 HE22 GLN 76 -0.690 6.676 21.586 527 H ILE 77 HN ILE 77 -0.244 10.907 15.999 528 HA ILE 77 HA ILE 77 2.427 10.867 16.954 529 HB ILE 77 HB ILE 77 1.361 11.683 14.236 530 HG12 ILE 77 HG11 ILE 77 2.606 9.062 15.094 531 HG13 ILE 77 HG12 ILE 77 0.866 9.342 15.133 532 HG21 ILE 77 HG21 ILE 77 4.158 10.792 14.994 533 HG22 ILE 77 HG22 ILE 77 3.699 12.478 14.749 534 HG23 ILE 77 HG23 ILE 77 3.608 11.336 13.408 535 HD11 ILE 77 HD11 ILE 77 1.777 10.238 12.600 536 HD12 ILE 77 HD12 ILE 77 0.770 8.831 12.943 537 HD13 ILE 77 HD13 ILE 77 2.527 8.665 12.879 538 H ALA 78 HN ALA 78 0.625 13.555 15.456 539 HA ALA 78 HA ALA 78 2.739 15.468 16.016 540 HB1 ALA 78 HB1 ALA 78 0.774 15.507 14.226 541 HB2 ALA 78 HB2 ALA 78 1.423 17.006 14.891 542 HB3 ALA 78 HB3 ALA 78 -0.081 16.339 15.525 543 H ALA 79 HN ALA 79 -0.395 14.677 17.508 544 HA ALA 79 HA ALA 79 -0.435 16.754 19.439 545 HB1 ALA 79 HB1 ALA 79 -2.434 15.611 19.450 546 HB2 ALA 79 HB2 ALA 79 -1.655 14.795 20.806 547 HB3 ALA 79 HB3 ALA 79 -1.660 14.044 19.210 548 H SER 80 HN SER 80 1.457 13.828 19.273 549 HA SER 80 HA SER 80 2.213 13.840 22.087 550 HB2 SER 80 HB1 SER 80 2.271 11.778 20.687 551 HB3 SER 80 HB2 SER 80 3.571 12.490 19.733 552 HG SER 80 HG SER 80 4.934 12.140 21.297 553 H GLN 81 HN GLN 81 3.245 15.509 19.241 554 HA GLN 81 HA GLN 81 5.949 16.033 19.725 555 HB2 GLN 81 HB2 GLN 81 3.821 17.955 18.739 556 HB3 GLN 81 HB1 GLN 81 5.559 18.232 18.611 557 HG2 GLN 81 HG2 GLN 81 5.718 16.042 17.353 558 HG3 GLN 81 HG1 GLN 81 3.955 16.006 17.325 559 HE21 GLN 81 HE21 GLN 81 2.847 17.571 15.967 560 HE22 GLN 81 HE22 GLN 81 3.683 18.439 14.772 561 H GLY 82 HN GLY 82 3.117 17.481 21.272 562 HA2 GLY 82 HA1 GLY 82 3.027 18.452 23.437 563 HA3 GLY 82 HA2 GLY 82 4.777 18.274 23.555 564 H GLY 83 HN GLY 83 3.825 19.701 20.623 565 HA2 GLY 83 HA2 GLY 83 4.741 22.346 21.629 566 HA3 GLY 83 HA1 GLY 83 4.703 21.854 19.934 567 H ASP 84 HN ASP 84 3.440 23.674 19.295 568 HA ASP 84 HA ASP 84 0.978 24.415 20.584 569 HB2 ASP 84 HB2 ASP 84 2.348 25.830 18.959 570 HB3 ASP 84 HB1 ASP 84 1.654 24.853 17.666 571 H LEU 85 HN LEU 85 -0.859 23.215 20.611 572 HA LEU 85 HA LEU 85 -1.186 20.913 18.867 573 HB2 LEU 85 HB2 LEU 85 -2.079 20.947 21.174 574 HB3 LEU 85 HB1 LEU 85 -3.174 22.256 20.727 575 HG LEU 85 HG LEU 85 -3.870 20.556 18.806 576 HD11 LEU 85 HD11 LEU 85 -2.395 18.927 20.826 577 HD12 LEU 85 HD12 LEU 85 -2.564 18.676 19.088 578 HD13 LEU 85 HD13 LEU 85 -3.886 18.249 20.173 579 HD21 LEU 85 HD21 LEU 85 -5.034 21.457 21.081 580 HD22 LEU 85 HD22 LEU 85 -4.946 19.735 21.450 581 HD23 LEU 85 HD23 LEU 85 -5.801 20.284 20.008 582 H GLY 86 HN GLY 86 -2.148 24.256 18.770 583 HA2 GLY 86 HA1 GLY 86 -4.329 23.937 16.897 584 HA3 GLY 86 HA2 GLY 86 -3.490 25.447 17.250 585 H VAL 87 HN VAL 87 -0.834 24.359 16.569 586 HA VAL 87 HA VAL 87 -0.895 24.933 13.742 587 HB VAL 87 HB VAL 87 1.042 25.267 15.450 588 HG11 VAL 87 HG11 VAL 87 0.977 22.709 15.944 589 HG12 VAL 87 HG12 VAL 87 2.547 23.493 15.787 590 HG13 VAL 87 HG13 VAL 87 1.891 22.558 14.445 591 HG21 VAL 87 HG21 VAL 87 1.507 25.968 13.279 592 HG22 VAL 87 HG22 VAL 87 1.220 24.370 12.592 593 HG23 VAL 87 HG23 VAL 87 2.705 24.691 13.488 594 H THR 88 HN THR 88 -0.660 21.904 15.606 595 HA THR 88 HA THR 88 -0.061 20.160 13.462 596 HB THR 88 HB THR 88 -1.884 19.684 15.841 597 HG1 THR 88 HG1 THR 88 0.066 19.906 16.673 598 HG21 THR 88 HG21 THR 88 -0.523 17.636 14.078 599 HG22 THR 88 HG22 THR 88 -2.201 18.135 13.853 600 HG23 THR 88 HG23 THR 88 -1.709 17.341 15.352 601 H THR 89 HN THR 89 -3.062 21.729 14.401 602 HA THR 89 HA THR 89 -4.866 20.281 12.750 603 HB THR 89 HB THR 89 -5.033 23.271 13.166 604 HG1 THR 89 HG1 THR 89 -6.216 22.413 15.148 605 HG21 THR 89 HG21 THR 89 -6.736 21.320 12.063 606 HG22 THR 89 HG22 THR 89 -7.150 22.987 12.465 607 HG23 THR 89 HG23 THR 89 -7.415 21.702 13.645 608 H ASN 90 HN ASN 90 -2.953 23.217 12.054 609 HA ASN 90 HA ASN 90 -3.724 23.302 9.269 610 HB2 ASN 90 HB1 ASN 90 -1.294 24.512 10.622 611 HB3 ASN 90 HB2 ASN 90 -1.933 24.963 9.042 612 HD21 ASN 90 HD21 ASN 90 -1.708 26.735 11.412 613 HD22 ASN 90 HD22 ASN 90 -3.288 27.241 11.774 614 H ALA 91 HN ALA 91 -0.928 22.002 11.035 615 HA ALA 91 HA ALA 91 0.567 21.199 8.729 616 HB1 ALA 91 HB1 ALA 91 2.025 20.239 10.227 617 HB2 ALA 91 HB2 ALA 91 0.729 19.554 11.208 618 HB3 ALA 91 HB3 ALA 91 1.134 21.265 11.353 619 H ILE 92 HN ILE 92 -1.582 19.302 10.865 620 HA ILE 92 HA ILE 92 -1.466 16.958 9.173 621 HB ILE 92 HB ILE 92 -3.293 17.786 11.438 622 HG12 ILE 92 HG12 ILE 92 -1.075 15.734 11.174 623 HG13 ILE 92 HG11 ILE 92 -0.982 17.257 12.058 624 HG21 ILE 92 HG21 ILE 92 -3.384 14.974 10.919 625 HG22 ILE 92 HG22 ILE 92 -3.778 15.821 9.425 626 HG23 ILE 92 HG23 ILE 92 -4.714 16.132 10.886 627 HD11 ILE 92 HD11 ILE 92 -2.586 14.791 12.713 628 HD12 ILE 92 HD12 ILE 92 -3.062 16.366 13.349 629 HD13 ILE 92 HD13 ILE 92 -1.480 15.695 13.747 630 H ALA 93 HN ALA 93 -3.760 19.652 9.519 631 HA ALA 93 HA ALA 93 -5.710 18.509 7.709 632 HB1 ALA 93 HB1 ALA 93 -5.359 21.446 8.336 633 HB2 ALA 93 HB2 ALA 93 -6.149 20.320 9.439 634 HB3 ALA 93 HB3 ALA 93 -6.835 20.617 7.842 635 H ASP 94 HN ASP 94 -3.104 20.922 7.279 636 HA ASP 94 HA ASP 94 -3.663 21.633 4.608 637 HB2 ASP 94 HB1 ASP 94 -1.853 22.587 6.152 638 HB3 ASP 94 HB2 ASP 94 -0.856 21.223 5.644 639 H ALA 95 HN ALA 95 -1.696 18.904 5.816 640 HA ALA 95 HA ALA 95 -1.110 17.918 3.156 641 HB1 ALA 95 HB1 ALA 95 0.035 16.206 4.224 642 HB2 ALA 95 HB2 ALA 95 -1.132 16.108 5.542 643 HB3 ALA 95 HB3 ALA 95 0.040 17.425 5.498 644 H LEU 96 HN LEU 96 -3.607 17.308 5.564 645 HA LEU 96 HA LEU 96 -4.777 15.035 4.223 646 HB2 LEU 96 HB2 LEU 96 -5.094 16.027 6.677 647 HB3 LEU 96 HB1 LEU 96 -6.438 16.867 5.906 648 HG LEU 96 HG LEU 96 -7.292 14.779 6.757 649 HD11 LEU 96 HD21 LEU 96 -7.887 15.539 4.378 650 HD12 LEU 96 HD22 LEU 96 -8.202 13.846 4.761 651 HD13 LEU 96 HD23 LEU 96 -6.778 14.287 3.818 652 HD21 LEU 96 HD11 LEU 96 -6.269 12.650 6.301 653 HD22 LEU 96 HD12 LEU 96 -4.987 13.722 6.866 654 HD23 LEU 96 HD13 LEU 96 -5.149 13.372 5.145 655 H THR 97 HN THR 97 -5.409 18.532 4.153 656 HA THR 97 HA THR 97 -7.721 18.368 2.456 657 HB THR 97 HB THR 97 -5.751 20.625 2.911 658 HG1 THR 97 HG1 THR 97 -7.583 21.355 4.192 659 HG21 THR 97 HG21 THR 97 -8.142 21.756 2.175 660 HG22 THR 97 HG22 THR 97 -8.072 20.341 1.125 661 HG23 THR 97 HG23 THR 97 -6.767 21.527 1.095 662 H SER 98 HN SER 98 -4.327 19.231 1.683 663 HA SER 98 HA SER 98 -4.709 19.378 -1.132 664 HB2 SER 98 HB2 SER 98 -2.211 18.524 0.364 665 HB3 SER 98 HB1 SER 98 -2.275 19.118 -1.295 666 HG SER 98 HG SER 98 -3.302 20.614 0.863 667 H ALA 99 HN ALA 99 -3.759 16.644 0.942 668 HA ALA 99 HA ALA 99 -3.316 14.719 -1.077 669 HB1 ALA 99 HB1 ALA 99 -4.165 14.609 1.786 670 HB2 ALA 99 HB2 ALA 99 -2.752 13.896 1.007 671 HB3 ALA 99 HB3 ALA 99 -4.336 13.145 0.819 672 H PHE 100 HN PHE 100 -6.355 15.574 0.585 673 HA PHE 100 HA PHE 100 -8.108 13.735 -0.542 674 HB2 PHE 100 HB1 PHE 100 -8.324 16.506 0.450 675 HB3 PHE 100 HB2 PHE 100 -9.598 16.031 -0.672 676 HD1 PHE 100 HD1 PHE 100 -10.397 13.445 -0.230 677 HD2 PHE 100 HD2 PHE 100 -8.798 16.155 2.693 678 HE1 PHE 100 HE1 PHE 100 -11.517 12.162 1.574 679 HE2 PHE 100 HE2 PHE 100 -9.913 14.872 4.492 680 HZ PHE 100 HZ PHE 100 -11.273 12.873 3.936 681 H TYR 101 HN TYR 101 -7.343 16.933 -1.962 682 HA TYR 101 HA TYR 101 -8.634 16.298 -4.471 683 HB2 TYR 101 HB2 TYR 101 -6.526 18.414 -4.265 684 HB3 TYR 101 HB1 TYR 101 -8.066 18.454 -5.124 685 HD1 TYR 101 HD1 TYR 101 -10.046 17.698 -3.159 686 HD2 TYR 101 HD2 TYR 101 -6.516 20.093 -2.641 687 HE1 TYR 101 HE1 TYR 101 -11.092 18.814 -1.201 688 HE2 TYR 101 HE2 TYR 101 -7.562 21.211 -0.691 689 HH TYR 101 HH TYR 101 -10.803 21.091 -0.017 690 H GLN 102 HN GLN 102 -5.351 16.039 -3.246 691 HA GLN 102 HA GLN 102 -4.053 15.600 -5.763 692 HB2 GLN 102 HB2 GLN 102 -3.398 14.841 -2.919 693 HB3 GLN 102 HB1 GLN 102 -2.374 14.324 -4.256 694 HG2 GLN 102 HG2 GLN 102 -2.409 16.829 -4.953 695 HG3 GLN 102 HG1 GLN 102 -2.960 17.120 -3.304 696 HE21 GLN 102 HE21 GLN 102 -0.497 18.195 -3.879 697 HE22 GLN 102 HE22 GLN 102 0.740 17.282 -3.159 698 H THR 103 HN THR 103 -6.167 13.601 -3.883 699 HA THR 103 HA THR 103 -5.309 11.236 -5.500 700 HB THR 103 HB THR 103 -6.156 9.831 -3.720 701 HG1 THR 103 HG1 THR 103 -6.689 11.774 -1.915 702 HG21 THR 103 HG21 THR 103 -4.235 10.132 -2.585 703 HG22 THR 103 HG22 THR 103 -4.825 11.646 -1.901 704 HG23 THR 103 HG23 THR 103 -4.012 11.644 -3.466 705 H THR 104 HN THR 104 -8.338 12.440 -3.923 706 HA THR 104 HA THR 104 -9.735 11.522 -6.409 707 HB THR 104 HB THR 104 -11.540 10.665 -5.120 708 HG1 THR 104 HG1 THR 104 -10.390 11.475 -2.706 709 HG21 THR 104 HG21 THR 104 -9.325 9.891 -3.278 710 HG22 THR 104 HG22 THR 104 -9.123 9.538 -4.994 711 HG23 THR 104 HG23 THR 104 -10.499 8.874 -4.113 712 H GLY 105 HN GLY 105 -9.922 13.780 -3.636 713 HA2 GLY 105 HA2 GLY 105 -10.382 16.158 -4.141 714 HA3 GLY 105 HA1 GLY 105 -11.406 15.620 -5.465 715 H VAL 106 HN VAL 106 -11.294 14.528 -2.054 716 HA VAL 106 HA VAL 106 -14.221 15.036 -1.933 717 HB VAL 106 HB VAL 106 -12.489 13.596 0.093 718 HG11 VAL 106 HG21 VAL 106 -15.400 14.115 -0.275 719 HG12 VAL 106 HG22 VAL 106 -14.464 13.976 1.213 720 HG13 VAL 106 HG23 VAL 106 -14.937 12.524 0.330 721 HG21 VAL 106 HG11 VAL 106 -14.241 12.266 -1.964 722 HG22 VAL 106 HG12 VAL 106 -12.949 11.556 -0.995 723 HG23 VAL 106 HG13 VAL 106 -12.558 12.650 -2.322 724 H VAL 107 HN VAL 107 -15.023 16.013 0.145 725 HA VAL 107 HA VAL 107 -13.734 18.515 0.654 726 HB VAL 107 HB VAL 107 -15.384 18.738 2.467 727 HG11 VAL 107 HG21 VAL 107 -17.034 19.089 0.951 728 HG12 VAL 107 HG22 VAL 107 -17.088 17.385 0.499 729 HG13 VAL 107 HG23 VAL 107 -15.901 18.457 -0.243 730 HG21 VAL 107 HG11 VAL 107 -15.753 16.789 3.587 731 HG22 VAL 107 HG12 VAL 107 -15.325 15.803 2.187 732 HG23 VAL 107 HG13 VAL 107 -16.951 16.477 2.330 733 H ASN 108 HN ASN 108 -11.944 18.862 1.874 734 HA ASN 108 HA ASN 108 -10.787 16.795 3.532 735 HB2 ASN 108 HB2 ASN 108 -9.044 18.365 3.969 736 HB3 ASN 108 HB1 ASN 108 -9.551 18.666 2.308 737 HD21 ASN 108 HD21 ASN 108 -10.423 20.731 1.819 738 HD22 ASN 108 HD22 ASN 108 -10.675 21.945 2.978 739 H SER 109 HN SER 109 -12.781 19.630 4.161 740 HA SER 109 HA SER 109 -12.426 19.849 6.952 741 HB2 SER 109 HB2 SER 109 -14.548 21.012 6.984 742 HB3 SER 109 HB1 SER 109 -13.702 21.446 5.498 743 HG SER 109 HG SER 109 -14.942 19.846 4.429 744 H ARG 110 HN ARG 110 -14.736 17.770 5.165 745 HA ARG 110 HA ARG 110 -16.124 16.778 7.423 746 HB2 ARG 110 HB2 ARG 110 -16.815 16.333 5.091 747 HB3 ARG 110 HB1 ARG 110 -15.413 15.285 4.881 748 HG2 ARG 110 HG2 ARG 110 -16.237 13.823 6.697 749 HG3 ARG 110 HG1 ARG 110 -17.642 14.870 6.898 750 HD2 ARG 110 HD1 ARG 110 -18.167 14.444 4.447 751 HD3 ARG 110 HD2 ARG 110 -16.918 13.199 4.478 752 HE ARG 110 HE ARG 110 -18.397 12.319 6.506 753 HH11 ARG 110 HH11 ARG 110 -18.927 12.302 3.264 754 HH12 ARG 110 HH12 ARG 110 -20.650 12.137 3.332 755 HH21 ARG 110 HH21 ARG 110 -20.839 12.748 6.740 756 HH22 ARG 110 HH22 ARG 110 -21.732 12.389 5.299 757 H PHE 111 HN PHE 111 -13.309 15.272 5.777 758 HA PHE 111 HA PHE 111 -12.979 13.331 7.918 759 HB2 PHE 111 HB2 PHE 111 -12.274 12.950 5.529 760 HB3 PHE 111 HB1 PHE 111 -10.976 14.115 5.788 761 HD1 PHE 111 HD1 PHE 111 -9.134 13.630 7.356 762 HD2 PHE 111 HD2 PHE 111 -12.219 10.752 6.556 763 HE1 PHE 111 HE1 PHE 111 -7.741 11.852 8.382 764 HE2 PHE 111 HE2 PHE 111 -10.828 8.974 7.581 765 HZ PHE 111 HZ PHE 111 -8.588 9.524 8.494 766 H ILE 112 HN ILE 112 -11.222 16.265 6.911 767 HA ILE 112 HA ILE 112 -9.246 16.164 8.967 768 HB ILE 112 HB ILE 112 -10.402 18.526 7.461 769 HG12 ILE 112 HG12 ILE 112 -7.995 16.734 7.058 770 HG13 ILE 112 HG11 ILE 112 -9.352 16.975 5.957 771 HG21 ILE 112 HG21 ILE 112 -9.162 19.854 8.789 772 HG22 ILE 112 HG22 ILE 112 -7.719 18.946 8.338 773 HG23 ILE 112 HG23 ILE 112 -8.669 18.453 9.740 774 HD11 ILE 112 HD11 ILE 112 -7.255 19.026 6.729 775 HD12 ILE 112 HD12 ILE 112 -8.685 19.387 5.761 776 HD13 ILE 112 HD13 ILE 112 -7.464 18.271 5.149 777 H SER 113 HN SER 113 -12.519 17.534 8.925 778 HA SER 113 HA SER 113 -12.368 19.022 11.339 779 HB2 SER 113 HB2 SER 113 -14.317 19.219 9.912 780 HB3 SER 113 HB1 SER 113 -14.692 17.507 10.113 781 HG SER 113 HG SER 113 -14.914 17.965 12.382 782 H GLU 114 HN GLU 114 -12.772 15.562 10.776 783 HA GLU 114 HA GLU 114 -13.463 14.931 13.518 784 HB2 GLU 114 HB2 GLU 114 -12.310 13.205 11.304 785 HB3 GLU 114 HB1 GLU 114 -12.914 12.592 12.844 786 HG2 GLU 114 HG2 GLU 114 -15.134 13.596 12.344 787 HG3 GLU 114 HG1 GLU 114 -14.520 14.129 10.779 788 H ILE 115 HN ILE 115 -10.431 14.992 11.661 789 HA ILE 115 HA ILE 115 -8.799 13.955 13.803 790 HB ILE 115 HB ILE 115 -8.072 15.652 11.396 791 HG12 ILE 115 HG11 ILE 115 -7.614 12.695 11.823 792 HG13 ILE 115 HG12 ILE 115 -9.095 13.311 11.086 793 HG21 ILE 115 HG21 ILE 115 -6.525 14.715 13.697 794 HG22 ILE 115 HG22 ILE 115 -6.083 15.883 12.451 795 HG23 ILE 115 HG23 ILE 115 -5.858 14.158 12.162 796 HD11 ILE 115 HD11 ILE 115 -8.047 13.615 9.116 797 HD12 ILE 115 HD12 ILE 115 -6.627 12.827 9.803 798 HD13 ILE 115 HD13 ILE 115 -6.789 14.581 9.890 799 H ARG 116 HN ARG 116 -9.654 17.241 12.738 800 HA ARG 116 HA ARG 116 -7.953 18.716 14.436 801 HB2 ARG 116 HB2 ARG 116 -9.202 19.959 12.850 802 HB3 ARG 116 HB1 ARG 116 -10.729 19.249 13.372 803 HG2 ARG 116 HG2 ARG 116 -10.835 20.565 15.300 804 HG3 ARG 116 HG1 ARG 116 -9.096 20.857 15.317 805 HD2 ARG 116 HD2 ARG 116 -10.059 22.907 14.584 806 HD3 ARG 116 HD1 ARG 116 -9.456 22.135 13.117 807 HE ARG 116 HE ARG 116 -11.894 21.302 12.857 808 HH11 ARG 116 HH11 ARG 116 -13.067 22.550 15.242 809 HH12 ARG 116 HH12 ARG 116 -13.644 24.072 14.650 810 HH21 ARG 116 HH21 ARG 116 -11.733 23.975 11.759 811 HH22 ARG 116 HH22 ARG 116 -12.890 24.879 12.678 812 H SER 117 HN SER 117 -11.182 17.359 15.117 813 HA SER 117 HA SER 117 -11.217 18.322 17.852 814 HB2 SER 117 HB2 SER 117 -13.211 16.973 18.098 815 HB3 SER 117 HB1 SER 117 -13.264 17.724 16.503 816 HG SER 117 HG SER 117 -13.033 15.084 17.207 817 H LEU 118 HN LEU 118 -10.179 15.345 16.261 818 HA LEU 118 HA LEU 118 -9.848 13.803 18.670 819 HB2 LEU 118 HB2 LEU 118 -8.655 13.590 15.900 820 HB3 LEU 118 HB1 LEU 118 -8.250 12.453 17.187 821 HG LEU 118 HG LEU 118 -11.017 13.019 16.078 822 HD11 LEU 118 HD11 LEU 118 -9.739 11.570 14.622 823 HD12 LEU 118 HD12 LEU 118 -10.875 10.562 15.519 824 HD13 LEU 118 HD13 LEU 118 -9.176 10.611 15.992 825 HD21 LEU 118 HD21 LEU 118 -11.626 11.091 17.648 826 HD22 LEU 118 HD22 LEU 118 -11.292 12.640 18.421 827 HD23 LEU 118 HD23 LEU 118 -10.070 11.368 18.430 828 H ILE 119 HN ILE 119 -7.621 15.853 16.782 829 HA ILE 119 HA ILE 119 -5.266 15.310 18.267 830 HB ILE 119 HB ILE 119 -6.100 17.931 16.983 831 HG12 ILE 119 HG11 ILE 119 -4.331 15.782 15.809 832 HG13 ILE 119 HG12 ILE 119 -6.076 15.781 15.559 833 HG21 ILE 119 HG21 ILE 119 -3.338 17.586 16.795 834 HG22 ILE 119 HG22 ILE 119 -3.721 17.061 18.434 835 HG23 ILE 119 HG23 ILE 119 -4.174 18.679 17.898 836 HD11 ILE 119 HD11 ILE 119 -4.068 17.872 14.705 837 HD12 ILE 119 HD12 ILE 119 -5.796 18.217 14.781 838 HD13 ILE 119 HD13 ILE 119 -5.193 16.965 13.694 839 H GLY 120 HN GLY 120 -7.902 17.612 18.878 840 HA2 GLY 120 HA1 GLY 120 -6.684 18.924 21.111 841 HA3 GLY 120 HA2 GLY 120 -8.420 18.850 20.803 842 H MET 121 HN MET 121 -8.545 15.934 20.821 843 HA MET 121 HA MET 121 -8.944 15.511 23.634 844 HB2 MET 121 HB2 MET 121 -10.194 14.269 21.892 845 HB3 MET 121 HB1 MET 121 -8.702 13.464 21.406 846 HG2 MET 121 HG1 MET 121 -9.695 11.914 22.878 847 HG3 MET 121 HG2 MET 121 -8.534 12.757 23.904 848 HE1 MET 121 HE1 MET 121 -12.683 11.932 24.596 849 HE2 MET 121 HE2 MET 121 -11.574 11.402 23.333 850 HE3 MET 121 HE3 MET 121 -12.645 12.770 23.037 851 H PHE 122 HN PHE 122 -6.327 14.633 21.404 852 HA PHE 122 HA PHE 122 -4.868 13.021 23.291 853 HB2 PHE 122 HB2 PHE 122 -3.980 14.539 20.823 854 HB3 PHE 122 HB1 PHE 122 -2.929 13.456 21.737 855 HD1 PHE 122 HD1 PHE 122 -3.743 11.034 22.107 856 HD2 PHE 122 HD2 PHE 122 -5.441 13.685 19.185 857 HE1 PHE 122 HE1 PHE 122 -4.695 9.091 20.896 858 HE2 PHE 122 HE2 PHE 122 -6.393 11.742 17.975 859 HZ PHE 122 HZ PHE 122 -6.020 9.444 18.829 860 H ALA 123 HN ALA 123 -4.783 16.475 22.457 861 HA ALA 123 HA ALA 123 -2.508 17.146 24.055 862 HB1 ALA 123 HB1 ALA 123 -4.869 18.704 23.018 863 HB2 ALA 123 HB2 ALA 123 -3.174 18.825 22.547 864 HB3 ALA 123 HB3 ALA 123 -3.704 19.462 24.104 865 H GLN 124 HN GLN 124 -5.904 16.680 24.836 866 HA GLN 124 HA GLN 124 -5.861 17.884 27.436 867 HB2 GLN 124 HB2 GLN 124 -7.558 15.635 26.312 868 HB3 GLN 124 HB1 GLN 124 -7.853 16.413 27.866 869 HG2 GLN 124 HG2 GLN 124 -8.145 18.577 26.764 870 HG3 GLN 124 HG1 GLN 124 -7.754 17.859 25.202 871 HE21 GLN 124 HE21 GLN 124 -10.263 19.122 25.552 872 HE22 GLN 124 HE22 GLN 124 -11.485 17.944 25.545 873 H ALA 125 HN ALA 125 -5.033 14.643 26.272 874 HA ALA 125 HA ALA 125 -4.733 13.434 28.858 875 HB1 ALA 125 HB1 ALA 125 -2.943 12.522 26.673 876 HB2 ALA 125 HB2 ALA 125 -4.671 12.485 26.316 877 HB3 ALA 125 HB3 ALA 125 -4.035 11.589 27.697 878 H SER 126 HN SER 126 -2.379 14.976 26.657 879 HA SER 126 HA SER 126 -0.179 14.669 28.528 880 HB2 SER 126 HB1 SER 126 1.086 16.013 26.972 881 HB3 SER 126 HB2 SER 126 0.061 14.938 26.021 882 HG SER 126 HG SER 126 -0.124 17.692 26.439 883 H ALA 127 HN ALA 127 -2.714 17.008 28.049 884 HA ALA 127 HA ALA 127 -1.438 19.213 29.408 885 HB1 ALA 127 HB1 ALA 127 -3.281 20.247 28.639 886 HB2 ALA 127 HB2 ALA 127 -4.267 19.322 29.770 887 HB3 ALA 127 HB3 ALA 127 -3.956 18.691 28.154 888 H ASN 128 HN ASN 128 -2.840 16.264 30.491 889 HA ASN 128 HA ASN 128 -3.589 17.198 33.144 890 HB2 ASN 128 HB2 ASN 128 -3.070 14.402 32.083 891 HB3 ASN 128 HB1 ASN 128 -3.756 14.768 33.666 892 HD21 ASN 128 HD21 ASN 128 -5.512 16.882 33.021 893 HD22 ASN 128 HD22 ASN 128 -6.684 16.355 31.911 894 H ASP 129 HN ASP 129 -0.680 15.936 31.638 895 HA ASP 129 HA ASP 129 0.724 15.276 34.060 896 HB2 ASP 129 HB2 ASP 129 1.750 16.097 31.326 897 HB3 ASP 129 HB1 ASP 129 2.767 15.470 32.622 898 H VAL 130 HN VAL 130 0.617 18.228 32.063 899 HA VAL 130 HA VAL 130 2.465 19.713 33.690 900 HB VAL 130 HB VAL 130 1.969 20.458 31.434 901 HG11 VAL 130 HG11 VAL 130 -0.436 21.525 31.186 902 HG12 VAL 130 HG12 VAL 130 -0.847 20.385 32.466 903 HG13 VAL 130 HG13 VAL 130 -0.206 19.794 30.933 904 HG21 VAL 130 HG21 VAL 130 0.706 22.770 32.370 905 HG22 VAL 130 HG22 VAL 130 2.445 22.491 32.292 906 HG23 VAL 130 HG23 VAL 130 1.561 22.140 33.778 907 H TYR 131 HN TYR 131 -0.981 19.081 33.905 908 HA TYR 131 HA TYR 131 -1.151 19.760 36.656 909 HB2 TYR 131 HB2 TYR 131 -2.247 21.904 36.638 910 HB3 TYR 131 HB1 TYR 131 -0.772 22.076 35.689 911 HD1 TYR 131 HD1 TYR 131 -0.859 22.189 33.227 912 HD2 TYR 131 HD2 TYR 131 -4.437 21.963 35.593 913 HE1 TYR 131 HE1 TYR 131 -2.202 22.886 31.262 914 HE2 TYR 131 HE2 TYR 131 -5.780 22.660 33.628 915 HH TYR 131 HH TYR 131 -5.692 22.801 31.300 916 H ALA 132 HN ALA 132 -3.618 20.119 37.246 917 HA ALA 132 HA ALA 132 -5.084 17.994 35.856 918 HB1 ALA 132 HB1 ALA 132 -6.825 19.229 37.666 919 HB2 ALA 132 HB2 ALA 132 -5.238 19.368 38.419 920 HB3 ALA 132 HB3 ALA 132 -5.862 17.782 37.965 921 H SER 133 HN SER 133 -6.317 18.410 34.094 922 HA SER 133 HA SER 133 -6.775 20.855 32.881 923 HB2 SER 133 HB2 SER 133 -8.786 18.585 32.981 924 HB3 SER 133 HB1 SER 133 -8.680 19.833 31.740 925 HG SER 133 HG SER 133 -7.637 17.909 31.102 926 H ALA 134 HN ALA 134 -8.806 22.175 32.769 927 HA ALA 134 HA ALA 134 -9.640 22.960 35.432 928 HB1 ALA 134 HB1 ALA 134 -10.033 23.911 32.671 929 HB2 ALA 134 HB2 ALA 134 -9.821 24.834 34.159 930 HB3 ALA 134 HB3 ALA 134 -11.411 24.198 33.733 931 H GLY 135 HN GLY 135 -11.061 21.037 32.833 932 HA2 GLY 135 HA2 GLY 135 -13.637 20.816 34.229 933 HA3 GLY 135 HA1 GLY 135 -13.202 20.006 32.724 934 H SER 136 HN SER 136 -14.425 18.324 34.297 935 HA SER 136 HA SER 136 -12.288 16.847 35.784 936 HB2 SER 136 HB2 SER 136 -14.173 17.656 37.208 937 HB3 SER 136 HB1 SER 136 -15.289 16.720 36.215 938 HG SER 136 HG SER 136 -14.455 14.879 36.966 939 H GLY 137 HN GLY 137 -12.055 14.637 35.328 940 HA2 GLY 137 HA2 GLY 137 -13.505 13.709 32.893 941 HA3 GLY 137 HA1 GLY 137 -11.943 13.092 33.435 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 -14.529 11.710 -11.244 2 H2 GLY 1 HT2 GLY 1 -15.171 13.121 -11.939 3 H3 GLY 1 HT3 GLY 1 -13.490 12.941 -11.773 4 HA2 GLY 1 HA2 GLY 1 -15.012 12.304 -13.976 5 HA3 GLY 1 HA1 GLY 1 -13.316 11.901 -13.706 6 H MET 2 HN MET 2 -13.934 9.923 -14.988 7 HA MET 2 HA MET 2 -15.371 7.913 -13.307 8 HB2 MET 2 HB2 MET 2 -16.261 8.358 -15.620 9 HB3 MET 2 HB1 MET 2 -14.734 7.758 -16.267 10 HG2 MET 2 HG2 MET 2 -15.125 5.612 -15.018 11 HG3 MET 2 HG1 MET 2 -16.718 6.219 -14.568 12 HE1 MET 2 HE1 MET 2 -17.580 7.882 -17.142 13 HE2 MET 2 HE2 MET 2 -18.540 6.849 -16.086 14 HE3 MET 2 HE3 MET 2 -18.612 6.622 -17.832 15 H GLY 3 HN GLY 3 -14.301 6.020 -12.730 16 HA2 GLY 3 HA2 GLY 3 -12.535 4.380 -12.902 17 HA3 GLY 3 HA1 GLY 3 -11.601 5.528 -13.861 18 H GLN 4 HN GLN 4 -12.859 7.286 -11.369 19 HA GLN 4 HA GLN 4 -10.419 6.825 -9.700 20 HB2 GLN 4 HB2 GLN 4 -12.023 9.369 -10.111 21 HB3 GLN 4 HB1 GLN 4 -10.632 9.207 -9.037 22 HG2 GLN 4 HG2 GLN 4 -9.204 8.619 -10.946 23 HG3 GLN 4 HG1 GLN 4 -10.590 8.714 -12.031 24 HE21 GLN 4 HE21 GLN 4 -8.316 10.400 -12.423 25 HE22 GLN 4 HE22 GLN 4 -8.773 12.004 -12.104 26 H ALA 5 HN ALA 5 -10.700 6.812 -7.420 27 HA ALA 5 HA ALA 5 -13.358 5.958 -6.541 28 HB1 ALA 5 HB1 ALA 5 -12.313 5.366 -4.496 29 HB2 ALA 5 HB2 ALA 5 -10.991 6.507 -4.747 30 HB3 ALA 5 HB3 ALA 5 -11.089 5.041 -5.723 31 H ASN 6 HN ASN 6 -14.815 7.179 -5.381 32 HA ASN 6 HA ASN 6 -14.755 9.994 -5.459 33 HB2 ASN 6 HB2 ASN 6 -16.169 8.281 -3.393 34 HB3 ASN 6 HB1 ASN 6 -16.588 9.934 -3.846 35 HD21 ASN 6 HD21 ASN 6 -18.388 7.643 -4.135 36 HD22 ASN 6 HD22 ASN 6 -18.726 7.509 -5.793 37 H THR 7 HN THR 7 -13.293 7.787 -3.176 38 HA THR 7 HA THR 7 -12.043 10.126 -1.831 39 HB THR 7 HB THR 7 -13.871 9.556 -0.349 40 HG1 THR 7 HG1 THR 7 -11.538 8.278 0.614 41 HG21 THR 7 HG21 THR 7 -12.922 6.756 0.022 42 HG22 THR 7 HG22 THR 7 -13.850 7.115 -1.436 43 HG23 THR 7 HG23 THR 7 -14.551 7.419 0.154 44 HA PRO 8 HA PRO 8 -8.353 7.723 -2.283 45 HB2 PRO 8 HB2 PRO 8 -6.913 8.567 -0.154 46 HB3 PRO 8 HB1 PRO 8 -7.180 9.552 -1.594 47 HG2 PRO 8 HG2 PRO 8 -8.608 9.620 1.039 48 HG3 PRO 8 HG1 PRO 8 -8.020 10.969 0.062 49 HD2 PRO 8 HD2 PRO 8 -10.611 10.245 0.047 50 HD3 PRO 8 HD1 PRO 8 -9.816 10.857 -1.402 51 H TRP 9 HN TRP 9 -9.823 7.669 0.983 52 HA TRP 9 HA TRP 9 -8.398 5.188 1.635 53 HB2 TRP 9 HB2 TRP 9 -9.682 5.235 3.729 54 HB3 TRP 9 HB1 TRP 9 -8.953 6.811 3.419 55 HD1 TRP 9 HD1 TRP 9 -12.296 5.010 3.524 56 HE1 TRP 9 HE1 TRP 9 -14.192 6.757 3.446 57 HE3 TRP 9 HE3 TRP 9 -9.572 9.219 2.585 58 HZ2 TRP 9 HZ2 TRP 9 -14.506 9.575 3.040 59 HZ3 TRP 9 HZ3 TRP 9 -10.689 11.419 2.359 60 HH2 TRP 9 HH2 TRP 9 -13.151 11.601 2.585 61 H SER 10 HN SER 10 -10.700 5.680 -0.528 62 HA SER 10 HA SER 10 -12.460 3.429 0.271 63 HB2 SER 10 HB1 SER 10 -12.639 5.695 -1.622 64 HB3 SER 10 HB2 SER 10 -13.307 4.177 -2.222 65 HG SER 10 HG SER 10 -14.852 4.277 -0.799 66 H SER 11 HN SER 11 -9.901 4.292 -1.957 67 HA SER 11 HA SER 11 -9.961 1.496 -3.015 68 HB2 SER 11 HB2 SER 11 -9.447 2.242 -5.137 69 HB3 SER 11 HB1 SER 11 -10.342 3.650 -4.567 70 HG SER 11 HG SER 11 -8.231 4.078 -5.512 71 H LYS 12 HN LYS 12 -7.844 0.540 -3.370 72 HA LYS 12 HA LYS 12 -5.946 1.198 -1.289 73 HB2 LYS 12 HB2 LYS 12 -6.489 -1.060 -2.621 74 HB3 LYS 12 HB1 LYS 12 -5.128 -0.508 -3.591 75 HG2 LYS 12 HG2 LYS 12 -3.770 -0.288 -1.523 76 HG3 LYS 12 HG1 LYS 12 -5.131 -0.900 -0.583 77 HD2 LYS 12 HD2 LYS 12 -3.652 -2.761 -1.016 78 HD3 LYS 12 HD1 LYS 12 -5.082 -2.974 -2.026 79 HE2 LYS 12 HE2 LYS 12 -3.595 -1.554 -3.745 80 HE3 LYS 12 HE1 LYS 12 -2.287 -2.279 -2.809 81 HZ1 LYS 12 HZ1 LYS 12 -3.623 -4.437 -3.145 82 HZ2 LYS 12 HZ2 LYS 12 -2.682 -3.846 -4.431 83 HZ3 LYS 12 HZ3 LYS 12 -4.363 -3.603 -4.423 84 H ALA 13 HN ALA 13 -5.991 1.644 -4.820 85 HA ALA 13 HA ALA 13 -3.332 2.702 -5.020 86 HB1 ALA 13 HB1 ALA 13 -4.296 3.779 -7.155 87 HB2 ALA 13 HB2 ALA 13 -5.802 2.960 -6.739 88 HB3 ALA 13 HB3 ALA 13 -4.345 2.019 -7.055 89 H ASN 14 HN ASN 14 -6.501 4.335 -4.780 90 HA ASN 14 HA ASN 14 -5.331 6.975 -4.623 91 HB2 ASN 14 HB2 ASN 14 -8.075 6.094 -3.682 92 HB3 ASN 14 HB1 ASN 14 -7.575 7.731 -4.106 93 HD21 ASN 14 HD21 ASN 14 -6.131 7.242 -6.488 94 HD22 ASN 14 HD22 ASN 14 -7.237 6.727 -7.667 95 H ALA 15 HN ALA 15 -6.134 4.497 -2.253 96 HA ALA 15 HA ALA 15 -6.070 6.237 0.044 97 HB1 ALA 15 HB1 ALA 15 -5.877 4.177 1.354 98 HB2 ALA 15 HB2 ALA 15 -5.482 3.269 -0.106 99 HB3 ALA 15 HB3 ALA 15 -7.086 3.977 0.085 100 H ASP 16 HN ASP 16 -3.593 4.094 -1.372 101 HA ASP 16 HA ASP 16 -1.535 4.680 0.491 102 HB2 ASP 16 HB2 ASP 16 -1.391 3.938 -2.443 103 HB3 ASP 16 HB1 ASP 16 0.024 4.036 -1.395 104 H ALA 17 HN ALA 17 -2.018 6.164 -2.747 105 HA ALA 17 HA ALA 17 0.010 8.098 -2.557 106 HB1 ALA 17 HB1 ALA 17 -2.542 8.999 -3.775 107 HB2 ALA 17 HB2 ALA 17 -1.837 7.523 -4.435 108 HB3 ALA 17 HB3 ALA 17 -0.907 9.021 -4.435 109 H PHE 18 HN PHE 18 -3.339 8.275 -1.367 110 HA PHE 18 HA PHE 18 -3.279 10.966 -0.471 111 HB2 PHE 18 HB1 PHE 18 -5.360 9.702 -0.523 112 HB3 PHE 18 HB2 PHE 18 -4.738 8.567 0.675 113 HD1 PHE 18 HD2 PHE 18 -5.590 12.167 0.143 114 HD2 PHE 18 HD1 PHE 18 -4.917 9.018 2.986 115 HE1 PHE 18 HE2 PHE 18 -6.383 13.645 1.967 116 HE2 PHE 18 HE1 PHE 18 -5.711 10.497 4.811 117 HZ PHE 18 HZ PHE 18 -6.444 12.809 4.299 118 H ILE 19 HN ILE 19 -2.124 7.987 1.071 119 HA ILE 19 HA ILE 19 -1.511 9.236 3.607 120 HB ILE 19 HB ILE 19 -0.348 6.725 2.356 121 HG12 ILE 19 HG12 ILE 19 -2.712 6.428 2.526 122 HG13 ILE 19 HG11 ILE 19 -2.030 5.641 3.949 123 HG21 ILE 19 HG21 ILE 19 1.080 7.061 4.127 124 HG22 ILE 19 HG22 ILE 19 -0.246 6.300 5.007 125 HG23 ILE 19 HG23 ILE 19 -0.079 8.055 5.010 126 HD11 ILE 19 HD11 ILE 19 -3.943 7.007 4.616 127 HD12 ILE 19 HD12 ILE 19 -3.236 8.422 3.836 128 HD13 ILE 19 HD13 ILE 19 -2.464 7.720 5.257 129 H ASN 20 HN ASN 20 0.501 8.336 0.792 130 HA ASN 20 HA ASN 20 2.957 9.361 1.814 131 HB2 ASN 20 HB1 ASN 20 2.122 9.334 -1.096 132 HB3 ASN 20 HB2 ASN 20 3.759 9.235 -0.451 133 HD21 ASN 20 HD21 ASN 20 1.499 7.320 -1.847 134 HD22 ASN 20 HD22 ASN 20 1.751 5.853 -1.034 135 H SER 21 HN SER 21 0.554 10.885 -0.342 136 HA SER 21 HA SER 21 1.847 13.389 -0.609 137 HB2 SER 21 HB1 SER 21 -0.504 14.246 -1.030 138 HB3 SER 21 HB2 SER 21 -0.015 12.873 -2.026 139 HG SER 21 HG SER 21 -1.684 12.898 0.253 140 H PHE 22 HN PHE 22 -0.240 12.146 1.956 141 HA PHE 22 HA PHE 22 -0.605 14.675 3.286 142 HB2 PHE 22 HB1 PHE 22 -2.087 12.758 3.706 143 HB3 PHE 22 HB2 PHE 22 -0.737 11.858 4.400 144 HD1 PHE 22 HD2 PHE 22 0.352 12.663 6.506 145 HD2 PHE 22 HD1 PHE 22 -3.222 14.462 4.946 146 HE1 PHE 22 HE2 PHE 22 -0.063 13.742 8.702 147 HE2 PHE 22 HE1 PHE 22 -3.637 15.539 7.138 148 HZ PHE 22 HZ PHE 22 -2.059 15.180 9.017 149 H ILE 23 HN ILE 23 1.825 12.117 3.549 150 HA ILE 23 HA ILE 23 3.074 13.170 5.929 151 HB ILE 23 HB ILE 23 4.234 11.412 3.754 152 HG12 ILE 23 HG12 ILE 23 2.971 10.673 6.411 153 HG13 ILE 23 HG11 ILE 23 2.169 10.523 4.847 154 HG21 ILE 23 HG21 ILE 23 5.131 11.386 6.607 155 HG22 ILE 23 HG22 ILE 23 5.701 12.693 5.570 156 HG23 ILE 23 HG23 ILE 23 6.043 11.016 5.143 157 HD11 ILE 23 HD11 ILE 23 4.273 8.839 6.055 158 HD12 ILE 23 HD12 ILE 23 4.541 9.243 4.360 159 HD13 ILE 23 HD13 ILE 23 3.057 8.425 4.847 160 H SER 24 HN SER 24 4.147 13.274 2.506 161 HA SER 24 HA SER 24 6.341 15.021 2.958 162 HB2 SER 24 HB2 SER 24 5.974 13.739 0.856 163 HB3 SER 24 HB1 SER 24 4.632 14.813 0.461 164 HG SER 24 HG SER 24 5.999 16.265 -0.157 165 H ALA 25 HN ALA 25 2.918 15.706 2.403 166 HA ALA 25 HA ALA 25 3.347 18.575 2.129 167 HB1 ALA 25 HB1 ALA 25 0.822 18.646 2.402 168 HB2 ALA 25 HB2 ALA 25 0.870 16.889 2.548 169 HB3 ALA 25 HB3 ALA 25 1.405 17.665 1.057 170 H ALA 26 HN ALA 26 2.148 16.448 4.743 171 HA ALA 26 HA ALA 26 1.712 18.639 6.578 172 HB1 ALA 26 HB1 ALA 26 1.556 16.832 8.295 173 HB2 ALA 26 HB2 ALA 26 2.068 15.671 7.069 174 HB3 ALA 26 HB3 ALA 26 0.539 16.529 6.885 175 H SER 27 HN SER 27 4.471 16.538 5.907 176 HA SER 27 HA SER 27 5.994 17.124 8.235 177 HB2 SER 27 HB1 SER 27 6.968 16.543 5.424 178 HB3 SER 27 HB2 SER 27 7.954 16.457 6.884 179 HG SER 27 HG SER 27 7.264 14.472 6.903 180 H ASN 28 HN ASN 28 5.440 19.016 5.326 181 HA ASN 28 HA ASN 28 7.466 20.992 6.270 182 HB2 ASN 28 HB1 ASN 28 6.130 20.598 3.584 183 HB3 ASN 28 HB2 ASN 28 7.160 21.978 3.963 184 HD21 ASN 28 HD21 ASN 28 7.994 20.228 1.927 185 HD22 ASN 28 HD22 ASN 28 9.325 19.321 2.463 186 H THR 29 HN THR 29 4.302 20.499 6.830 187 HA THR 29 HA THR 29 3.428 23.268 6.254 188 HB THR 29 HB THR 29 1.839 21.088 7.621 189 HG1 THR 29 HG1 THR 29 2.240 20.221 5.698 190 HG21 THR 29 HG21 THR 29 1.317 23.755 7.353 191 HG22 THR 29 HG22 THR 29 0.073 22.512 7.461 192 HG23 THR 29 HG23 THR 29 0.581 23.114 5.884 193 H GLY 30 HN GLY 30 2.821 21.301 9.177 194 HA2 GLY 30 HA2 GLY 30 2.869 23.661 10.841 195 HA3 GLY 30 HA1 GLY 30 2.759 21.999 11.416 196 H SER 31 HN SER 31 4.563 21.071 12.268 197 HA SER 31 HA SER 31 7.221 22.255 11.718 198 HB2 SER 31 HB2 SER 31 6.293 23.513 13.658 199 HB3 SER 31 HB1 SER 31 6.115 21.990 14.528 200 HG SER 31 HG SER 31 8.069 22.578 15.146 201 H PHE 32 HN PHE 32 5.509 19.589 11.661 202 HA PHE 32 HA PHE 32 6.428 17.582 13.275 203 HB2 PHE 32 HB2 PHE 32 6.131 17.617 10.269 204 HB3 PHE 32 HB1 PHE 32 6.580 16.147 11.132 205 HD1 PHE 32 HD1 PHE 32 5.065 15.578 13.236 206 HD2 PHE 32 HD2 PHE 32 3.859 18.086 9.961 207 HE1 PHE 32 HE1 PHE 32 2.685 15.165 13.794 208 HE2 PHE 32 HE2 PHE 32 1.480 17.673 10.522 209 HZ PHE 32 HZ PHE 32 0.893 16.209 12.435 210 H SER 33 HN SER 33 8.510 17.926 14.139 211 HA SER 33 HA SER 33 10.833 18.494 12.555 212 HB2 SER 33 HB2 SER 33 12.095 18.065 14.549 213 HB3 SER 33 HB1 SER 33 10.583 18.812 15.066 214 HG SER 33 HG SER 33 11.558 16.322 15.563 215 H GLN 34 HN GLN 34 12.738 16.919 12.456 216 HA GLN 34 HA GLN 34 12.113 14.672 10.886 217 HB2 GLN 34 HB1 GLN 34 14.412 15.847 11.402 218 HB3 GLN 34 HB2 GLN 34 14.530 14.627 12.670 219 HG2 GLN 34 HG2 GLN 34 14.237 12.843 11.022 220 HG3 GLN 34 HG1 GLN 34 14.013 14.033 9.740 221 HE21 GLN 34 HE21 GLN 34 16.134 12.120 9.600 222 HE22 GLN 34 HE22 GLN 34 17.611 12.937 9.768 223 H ASP 35 HN ASP 35 12.728 14.838 14.397 224 HA ASP 35 HA ASP 35 12.519 12.065 14.947 225 HB2 ASP 35 HB2 ASP 35 13.172 13.983 16.539 226 HB3 ASP 35 HB1 ASP 35 11.440 14.207 16.783 227 H GLN 36 HN GLN 36 9.993 14.561 14.701 228 HA GLN 36 HA GLN 36 7.847 12.711 15.349 229 HB2 GLN 36 HB1 GLN 36 7.653 15.363 13.893 230 HB3 GLN 36 HB2 GLN 36 6.363 14.530 14.759 231 HG2 GLN 36 HG2 GLN 36 8.928 15.411 16.103 232 HG3 GLN 36 HG1 GLN 36 7.493 16.433 16.031 233 HE21 GLN 36 HE21 GLN 36 8.986 14.543 18.193 234 HE22 GLN 36 HE22 GLN 36 7.664 13.828 18.979 235 H MET 37 HN MET 37 9.432 13.814 12.405 236 HA MET 37 HA MET 37 7.489 12.777 10.556 237 HB2 MET 37 HB2 MET 37 10.466 13.278 10.271 238 HB3 MET 37 HB1 MET 37 9.413 12.829 8.929 239 HG2 MET 37 HG2 MET 37 8.003 14.830 9.414 240 HG3 MET 37 HG1 MET 37 9.143 15.294 10.677 241 HE1 MET 37 HE1 MET 37 9.372 17.710 7.639 242 HE2 MET 37 HE2 MET 37 9.925 17.833 9.307 243 HE3 MET 37 HE3 MET 37 8.336 17.157 8.962 244 H GLU 38 HN GLU 38 10.224 11.362 12.270 245 HA GLU 38 HA GLU 38 10.474 8.937 10.827 246 HB2 GLU 38 HB1 GLU 38 10.848 9.530 13.776 247 HB3 GLU 38 HB2 GLU 38 11.300 7.999 13.025 248 HG2 GLU 38 HG2 GLU 38 12.750 9.272 11.427 249 HG3 GLU 38 HG1 GLU 38 12.374 10.747 12.319 250 H ASN 39 HN ASN 39 8.249 9.842 13.452 251 HA ASN 39 HA ASN 39 7.066 7.310 13.886 252 HB2 ASN 39 HB2 ASN 39 5.744 10.041 13.952 253 HB3 ASN 39 HB1 ASN 39 5.083 8.572 14.670 254 HD21 ASN 39 HD21 ASN 39 5.766 10.924 16.230 255 HD22 ASN 39 HD22 ASN 39 7.046 10.504 17.262 256 H MET 40 HN MET 40 6.418 9.757 11.418 257 HA MET 40 HA MET 40 4.116 8.512 10.268 258 HB2 MET 40 HB2 MET 40 6.240 10.179 8.883 259 HB3 MET 40 HB1 MET 40 4.606 9.877 8.291 260 HG2 MET 40 HG2 MET 40 3.796 10.896 10.510 261 HG3 MET 40 HG1 MET 40 5.449 11.475 10.714 262 HE1 MET 40 HE1 MET 40 6.142 13.047 7.370 263 HE2 MET 40 HE2 MET 40 6.704 12.141 8.772 264 HE3 MET 40 HE3 MET 40 6.368 13.864 8.922 265 H SER 41 HN SER 41 7.562 7.958 9.911 266 HA SER 41 HA SER 41 7.389 6.259 7.588 267 HB2 SER 41 HB2 SER 41 9.661 5.818 7.943 268 HB3 SER 41 HB1 SER 41 9.475 7.394 8.714 269 HG SER 41 HG SER 41 10.287 5.144 9.811 270 H LEU 42 HN LEU 42 6.780 5.799 10.980 271 HA LEU 42 HA LEU 42 6.840 2.852 10.716 272 HB2 LEU 42 HB2 LEU 42 7.742 3.892 12.771 273 HB3 LEU 42 HB1 LEU 42 6.163 4.606 13.098 274 HG LEU 42 HG LEU 42 5.281 2.162 12.932 275 HD11 LEU 42 HD11 LEU 42 7.128 0.577 13.789 276 HD12 LEU 42 HD12 LEU 42 8.265 1.793 13.206 277 HD13 LEU 42 HD13 LEU 42 7.163 1.003 12.079 278 HD21 LEU 42 HD21 LEU 42 6.827 3.441 15.158 279 HD22 LEU 42 HD22 LEU 42 6.263 1.784 15.368 280 HD23 LEU 42 HD23 LEU 42 5.105 3.077 15.059 281 H ILE 43 HN ILE 43 4.565 5.489 10.700 282 HA ILE 43 HA ILE 43 2.370 3.478 10.457 283 HB ILE 43 HB ILE 43 2.417 6.013 12.103 284 HG12 ILE 43 HG12 ILE 43 1.488 3.202 12.753 285 HG13 ILE 43 HG11 ILE 43 3.109 3.804 13.100 286 HG21 ILE 43 HG21 ILE 43 -0.128 5.015 12.363 287 HG22 ILE 43 HG22 ILE 43 0.182 4.756 10.647 288 HG23 ILE 43 HG23 ILE 43 0.307 6.376 11.330 289 HD11 ILE 43 HD11 ILE 43 1.993 5.706 14.376 290 HD12 ILE 43 HD12 ILE 43 1.836 4.110 15.108 291 HD13 ILE 43 HD13 ILE 43 0.483 4.810 14.220 292 H GLY 44 HN GLY 44 0.700 4.077 8.991 293 HA2 GLY 44 HA2 GLY 44 -0.359 5.586 7.419 294 HA3 GLY 44 HA1 GLY 44 1.079 6.611 7.482 295 H ASN 45 HN ASN 45 3.110 5.588 6.570 296 HA ASN 45 HA ASN 45 2.550 4.469 3.949 297 HB2 ASN 45 HB2 ASN 45 5.110 4.956 5.496 298 HB3 ASN 45 HB1 ASN 45 5.098 4.242 3.884 299 HD21 ASN 45 HD21 ASN 45 6.389 6.679 4.109 300 HD22 ASN 45 HD22 ASN 45 5.461 7.899 3.381 301 H THR 46 HN THR 46 3.624 3.231 7.066 302 HA THR 46 HA THR 46 4.277 0.575 6.150 303 HB THR 46 HB THR 46 3.361 1.480 8.900 304 HG1 THR 46 HG1 THR 46 5.314 2.438 7.811 305 HG21 THR 46 HG21 THR 46 3.821 -1.094 7.864 306 HG22 THR 46 HG22 THR 46 3.682 -0.645 9.565 307 HG23 THR 46 HG23 THR 46 5.267 -0.697 8.794 308 H LEU 47 HN LEU 47 1.337 2.174 7.246 309 HA LEU 47 HA LEU 47 -0.361 -0.027 7.644 310 HB2 LEU 47 HB2 LEU 47 -1.000 2.352 8.026 311 HB3 LEU 47 HB1 LEU 47 -1.079 2.587 6.281 312 HG LEU 47 HG LEU 47 -2.741 0.636 6.247 313 HD11 LEU 47 HD11 LEU 47 -2.831 -0.473 8.229 314 HD12 LEU 47 HD12 LEU 47 -3.888 0.843 8.737 315 HD13 LEU 47 HD13 LEU 47 -2.169 0.894 9.125 316 HD21 LEU 47 HD21 LEU 47 -3.969 2.514 5.898 317 HD22 LEU 47 HD22 LEU 47 -3.112 3.412 7.150 318 HD23 LEU 47 HD23 LEU 47 -4.441 2.339 7.588 319 H MET 48 HN MET 48 0.619 1.524 4.597 320 HA MET 48 HA MET 48 -1.115 0.201 2.820 321 HB2 MET 48 HB2 MET 48 1.825 0.843 2.412 322 HB3 MET 48 HB1 MET 48 0.677 0.468 1.127 323 HG2 MET 48 HG2 MET 48 -0.723 2.417 1.956 324 HG3 MET 48 HG1 MET 48 0.630 2.848 3.002 325 HE1 MET 48 HE1 MET 48 2.863 2.686 2.288 326 HE2 MET 48 HE2 MET 48 3.397 3.915 1.145 327 HE3 MET 48 HE3 MET 48 3.341 2.226 0.649 328 H ALA 49 HN ALA 49 1.766 -0.978 4.472 329 HA ALA 49 HA ALA 49 2.101 -3.406 3.006 330 HB1 ALA 49 HB1 ALA 49 2.619 -3.427 5.940 331 HB2 ALA 49 HB2 ALA 49 3.500 -2.236 4.984 332 HB3 ALA 49 HB3 ALA 49 3.653 -3.953 4.613 333 H ALA 50 HN ALA 50 -0.081 -2.501 5.620 334 HA ALA 50 HA ALA 50 -0.958 -5.145 6.300 335 HB1 ALA 50 HB1 ALA 50 -3.160 -3.550 6.749 336 HB2 ALA 50 HB2 ALA 50 -1.840 -2.383 6.808 337 HB3 ALA 50 HB3 ALA 50 -1.833 -3.777 7.889 338 H MET 51 HN MET 51 -1.948 -2.849 3.801 339 HA MET 51 HA MET 51 -4.339 -4.105 2.959 340 HB2 MET 51 HB2 MET 51 -2.264 -2.764 1.198 341 HB3 MET 51 HB1 MET 51 -3.964 -3.015 0.802 342 HG2 MET 51 HG2 MET 51 -4.645 -1.575 2.655 343 HG3 MET 51 HG1 MET 51 -2.965 -1.385 3.157 344 HE1 MET 51 HE1 MET 51 -4.625 1.880 1.637 345 HE2 MET 51 HE2 MET 51 -3.324 1.608 2.792 346 HE3 MET 51 HE3 MET 51 -4.821 0.690 2.929 347 H ASP 52 HN ASP 52 -0.970 -4.952 2.372 348 HA ASP 52 HA ASP 52 -1.272 -6.762 0.230 349 HB2 ASP 52 HB2 ASP 52 0.907 -6.066 1.298 350 HB3 ASP 52 HB1 ASP 52 0.543 -7.174 2.622 351 H ASN 53 HN ASN 53 -2.013 -7.144 3.651 352 HA ASN 53 HA ASN 53 -2.395 -9.976 3.655 353 HB2 ASN 53 HB2 ASN 53 -3.818 -7.864 5.306 354 HB3 ASN 53 HB1 ASN 53 -3.759 -9.588 5.673 355 HD21 ASN 53 HD21 ASN 53 -1.087 -10.224 5.198 356 HD22 ASN 53 HD22 ASN 53 -0.072 -9.316 6.211 357 H MET 54 HN MET 54 -4.396 -7.311 2.574 358 HA MET 54 HA MET 54 -6.914 -8.619 2.454 359 HB2 MET 54 HB2 MET 54 -5.718 -6.516 0.622 360 HB3 MET 54 HB1 MET 54 -7.416 -6.993 0.609 361 HG2 MET 54 HG2 MET 54 -5.907 -5.815 2.963 362 HG3 MET 54 HG1 MET 54 -7.121 -4.986 1.990 363 HE1 MET 54 HE1 MET 54 -10.291 -7.164 2.580 364 HE2 MET 54 HE2 MET 54 -9.032 -7.507 1.396 365 HE3 MET 54 HE3 MET 54 -9.543 -5.843 1.671 366 H GLY 55 HN GLY 55 -4.061 -8.923 0.456 367 HA2 GLY 55 HA2 GLY 55 -3.611 -10.758 -1.006 368 HA3 GLY 55 HA1 GLY 55 -5.318 -11.198 -0.938 369 H GLY 56 HN GLY 56 -4.957 -7.882 -1.448 370 HA2 GLY 56 HA2 GLY 56 -4.655 -6.678 -3.546 371 HA3 GLY 56 HA1 GLY 56 -4.956 -8.184 -4.411 372 H ARG 57 HN ARG 57 -7.028 -7.569 -1.733 373 HA ARG 57 HA ARG 57 -9.142 -6.552 -3.587 374 HB2 ARG 57 HB2 ARG 57 -10.771 -7.987 -2.459 375 HB3 ARG 57 HB1 ARG 57 -9.455 -8.975 -3.094 376 HG2 ARG 57 HG2 ARG 57 -8.385 -8.642 -0.740 377 HG3 ARG 57 HG1 ARG 57 -10.011 -8.179 -0.240 378 HD2 ARG 57 HD2 ARG 57 -10.845 -10.345 -1.226 379 HD3 ARG 57 HD1 ARG 57 -9.165 -10.809 -1.488 380 HE ARG 57 HE ARG 57 -8.895 -11.048 0.881 381 HH11 ARG 57 HH21 ARG 57 -11.601 -9.072 0.328 382 HH12 ARG 57 HH22 ARG 57 -12.492 -9.638 1.702 383 HH21 ARG 57 HH11 ARG 57 -10.199 -12.112 2.504 384 HH22 ARG 57 HH12 ARG 57 -11.699 -11.358 2.933 385 H ILE 58 HN ILE 58 -9.596 -4.521 -2.889 386 HA ILE 58 HA ILE 58 -9.726 -4.072 0.066 387 HB ILE 58 HB ILE 58 -9.213 -1.967 -2.051 388 HG12 ILE 58 HG11 ILE 58 -7.331 -3.440 -2.172 389 HG13 ILE 58 HG12 ILE 58 -6.831 -2.107 -1.132 390 HG21 ILE 58 HG21 ILE 58 -8.554 -1.899 0.894 391 HG22 ILE 58 HG22 ILE 58 -10.136 -1.401 0.292 392 HG23 ILE 58 HG23 ILE 58 -8.684 -0.547 -0.229 393 HD11 ILE 58 HD11 ILE 58 -6.248 -3.726 0.345 394 HD12 ILE 58 HD12 ILE 58 -7.218 -4.947 -0.478 395 HD13 ILE 58 HD13 ILE 58 -7.978 -3.843 0.670 396 H THR 59 HN THR 59 -11.540 -2.963 0.862 397 HA THR 59 HA THR 59 -13.634 -2.236 -1.135 398 HB THR 59 HB THR 59 -14.263 -4.435 -0.320 399 HG1 THR 59 HG1 THR 59 -16.242 -3.893 0.471 400 HG21 THR 59 HG21 THR 59 -14.638 -4.716 2.179 401 HG22 THR 59 HG22 THR 59 -13.741 -3.214 2.398 402 HG23 THR 59 HG23 THR 59 -12.951 -4.616 1.676 403 HA PRO 60 HA PRO 60 -13.979 1.497 1.219 404 HB2 PRO 60 HB2 PRO 60 -16.583 2.103 0.791 405 HB3 PRO 60 HB1 PRO 60 -15.333 2.300 -0.440 406 HG2 PRO 60 HG2 PRO 60 -17.285 0.053 -0.065 407 HG3 PRO 60 HG1 PRO 60 -16.835 0.893 -1.554 408 HD2 PRO 60 HD2 PRO 60 -15.785 -1.500 -0.938 409 HD3 PRO 60 HD1 PRO 60 -14.823 -0.261 -1.747 410 H SER 61 HN SER 61 -16.221 -1.151 1.825 411 HA SER 61 HA SER 61 -17.394 -0.060 4.216 412 HB2 SER 61 HB2 SER 61 -18.308 -2.011 2.916 413 HB3 SER 61 HB1 SER 61 -16.974 -2.985 3.532 414 HG SER 61 HG SER 61 -19.231 -2.647 4.695 415 H LYS 62 HN LYS 62 -14.792 -2.488 3.780 416 HA LYS 62 HA LYS 62 -14.051 -2.291 6.608 417 HB2 LYS 62 HB2 LYS 62 -12.665 -3.678 4.293 418 HB3 LYS 62 HB1 LYS 62 -12.256 -3.874 5.997 419 HG2 LYS 62 HG2 LYS 62 -14.528 -4.733 6.442 420 HG3 LYS 62 HG1 LYS 62 -14.935 -4.540 4.738 421 HD2 LYS 62 HD2 LYS 62 -13.143 -6.125 4.129 422 HD3 LYS 62 HD1 LYS 62 -12.733 -6.318 5.834 423 HE2 LYS 62 HE2 LYS 62 -14.767 -7.412 6.321 424 HE3 LYS 62 HE1 LYS 62 -15.536 -6.828 4.845 425 HZ1 LYS 62 HZ1 LYS 62 -14.865 -9.186 4.744 426 HZ2 LYS 62 HZ2 LYS 62 -13.242 -8.709 4.901 427 HZ3 LYS 62 HZ3 LYS 62 -14.141 -8.237 3.539 428 H LEU 63 HN LEU 63 -12.539 -1.379 3.494 429 HA LEU 63 HA LEU 63 -10.150 -0.282 4.436 430 HB2 LEU 63 HB2 LEU 63 -11.014 -0.436 2.015 431 HB3 LEU 63 HB1 LEU 63 -11.816 1.103 2.328 432 HG LEU 63 HG LEU 63 -9.699 2.171 2.818 433 HD11 LEU 63 HD21 LEU 63 -8.781 -0.658 2.942 434 HD12 LEU 63 HD22 LEU 63 -8.285 0.730 3.912 435 HD13 LEU 63 HD23 LEU 63 -7.639 0.516 2.285 436 HD21 LEU 63 HD11 LEU 63 -9.701 2.394 0.558 437 HD22 LEU 63 HD12 LEU 63 -10.157 0.709 0.310 438 HD23 LEU 63 HD13 LEU 63 -8.465 1.137 0.570 439 H GLN 64 HN GLN 64 -13.381 1.199 4.418 440 HA GLN 64 HA GLN 64 -12.633 3.793 5.301 441 HB2 GLN 64 HB2 GLN 64 -15.116 2.130 5.476 442 HB3 GLN 64 HB1 GLN 64 -15.014 3.573 6.483 443 HG2 GLN 64 HG2 GLN 64 -14.454 4.909 4.456 444 HG3 GLN 64 HG1 GLN 64 -14.660 3.460 3.472 445 HE21 GLN 64 HE21 GLN 64 -16.876 2.515 3.379 446 HE22 GLN 64 HE22 GLN 64 -18.228 3.480 3.729 447 H ALA 65 HN ALA 65 -12.960 0.753 7.029 448 HA ALA 65 HA ALA 65 -12.897 1.914 9.682 449 HB1 ALA 65 HB1 ALA 65 -11.938 -0.863 8.977 450 HB2 ALA 65 HB2 ALA 65 -13.654 -0.460 9.002 451 HB3 ALA 65 HB3 ALA 65 -12.693 -0.313 10.474 452 H LEU 66 HN LEU 66 -10.456 0.803 7.384 453 HA LEU 66 HA LEU 66 -8.246 1.005 9.256 454 HB2 LEU 66 HB2 LEU 66 -8.130 -0.411 7.225 455 HB3 LEU 66 HB1 LEU 66 -8.241 1.035 6.221 456 HG LEU 66 HG LEU 66 -6.180 1.700 7.901 457 HD11 LEU 66 HD21 LEU 66 -4.813 -0.614 7.432 458 HD12 LEU 66 HD22 LEU 66 -6.420 -1.248 7.788 459 HD13 LEU 66 HD23 LEU 66 -5.592 -0.230 8.967 460 HD21 LEU 66 HD11 LEU 66 -5.821 2.111 5.648 461 HD22 LEU 66 HD12 LEU 66 -6.374 0.509 5.162 462 HD23 LEU 66 HD13 LEU 66 -4.773 0.711 5.873 463 H ASP 67 HN ASP 67 -9.681 3.137 6.807 464 HA ASP 67 HA ASP 67 -7.801 5.202 6.731 465 HB2 ASP 67 HB1 ASP 67 -10.100 4.989 5.537 466 HB3 ASP 67 HB2 ASP 67 -10.746 5.803 6.962 467 H MET 68 HN MET 68 -10.411 4.732 9.119 468 HA MET 68 HA MET 68 -9.973 7.027 10.693 469 HB2 MET 68 HB2 MET 68 -10.745 4.247 11.626 470 HB3 MET 68 HB1 MET 68 -10.970 5.733 12.548 471 HG2 MET 68 HG2 MET 68 -12.381 6.615 10.671 472 HG3 MET 68 HG1 MET 68 -12.246 5.043 9.885 473 HE1 MET 68 HE1 MET 68 -12.240 3.068 11.235 474 HE2 MET 68 HE2 MET 68 -13.909 2.579 11.510 475 HE3 MET 68 HE3 MET 68 -12.858 2.907 12.884 476 H ALA 69 HN ALA 69 -8.290 3.897 10.765 477 HA ALA 69 HA ALA 69 -6.750 4.296 13.103 478 HB1 ALA 69 HB1 ALA 69 -5.062 2.786 11.948 479 HB2 ALA 69 HB2 ALA 69 -6.106 2.840 10.527 480 HB3 ALA 69 HB3 ALA 69 -6.703 2.145 12.033 481 H PHE 70 HN PHE 70 -6.188 5.419 9.785 482 HA PHE 70 HA PHE 70 -3.565 6.450 10.177 483 HB2 PHE 70 HB1 PHE 70 -4.518 6.241 7.944 484 HB3 PHE 70 HB2 PHE 70 -5.781 7.406 8.341 485 HD1 PHE 70 HD1 PHE 70 -5.234 9.793 8.678 486 HD2 PHE 70 HD2 PHE 70 -2.251 6.944 7.480 487 HE1 PHE 70 HE1 PHE 70 -3.727 11.649 8.016 488 HE2 PHE 70 HE2 PHE 70 -0.743 8.799 6.820 489 HZ PHE 70 HZ PHE 70 -1.481 11.151 7.087 490 H ALA 71 HN ALA 71 -6.747 7.836 10.867 491 HA ALA 71 HA ALA 71 -5.786 10.488 11.468 492 HB1 ALA 71 HB1 ALA 71 -8.288 9.024 12.358 493 HB2 ALA 71 HB2 ALA 71 -8.143 10.110 10.977 494 HB3 ALA 71 HB3 ALA 71 -7.994 10.743 12.615 495 H SER 72 HN SER 72 -6.075 7.519 13.333 496 HA SER 72 HA SER 72 -5.752 8.736 15.927 497 HB2 SER 72 HB1 SER 72 -5.056 5.923 15.031 498 HB3 SER 72 HB2 SER 72 -5.260 6.459 16.700 499 HG SER 72 HG SER 72 -7.139 5.874 14.786 500 H SER 73 HN SER 73 -3.436 7.184 13.689 501 HA SER 73 HA SER 73 -1.149 7.623 15.376 502 HB2 SER 73 HB2 SER 73 -1.309 6.001 13.429 503 HB3 SER 73 HB1 SER 73 -1.128 7.390 12.362 504 HG SER 73 HG SER 73 0.891 7.657 13.001 505 H VAL 74 HN VAL 74 -2.381 9.394 12.539 506 HA VAL 74 HA VAL 74 -0.386 11.390 12.466 507 HB VAL 74 HB VAL 74 -2.264 10.990 10.783 508 HG11 VAL 74 HG11 VAL 74 -4.345 12.229 11.146 509 HG12 VAL 74 HG12 VAL 74 -3.765 12.772 12.722 510 HG13 VAL 74 HG13 VAL 74 -4.106 11.063 12.447 511 HG21 VAL 74 HG21 VAL 74 -1.647 13.793 11.751 512 HG22 VAL 74 HG22 VAL 74 -2.404 13.428 10.200 513 HG23 VAL 74 HG23 VAL 74 -0.761 12.878 10.531 514 H ALA 75 HN ALA 75 -3.349 11.198 14.404 515 HA ALA 75 HA ALA 75 -3.083 13.847 15.505 516 HB1 ALA 75 HB1 ALA 75 -5.178 12.353 15.478 517 HB2 ALA 75 HB2 ALA 75 -4.864 13.250 16.963 518 HB3 ALA 75 HB3 ALA 75 -4.469 11.533 16.869 519 H GLN 76 HN GLN 76 -1.900 10.655 16.453 520 HA GLN 76 HA GLN 76 -0.907 11.553 19.039 521 HB2 GLN 76 HB2 GLN 76 -0.327 9.078 17.388 522 HB3 GLN 76 HB1 GLN 76 0.298 9.347 19.015 523 HG2 GLN 76 HG1 GLN 76 -2.001 9.530 19.878 524 HG3 GLN 76 HG2 GLN 76 -2.639 9.295 18.252 525 HE21 GLN 76 HE21 GLN 76 -3.267 7.480 20.391 526 HE22 GLN 76 HE22 GLN 76 -2.589 5.975 19.997 527 H ILE 77 HN ILE 77 0.623 10.815 15.890 528 HA ILE 77 HA ILE 77 3.294 11.346 16.592 529 HB ILE 77 HB ILE 77 1.865 11.961 13.989 530 HG12 ILE 77 HG11 ILE 77 3.522 9.578 14.874 531 HG13 ILE 77 HG12 ILE 77 1.768 9.593 14.694 532 HG21 ILE 77 HG21 ILE 77 3.972 13.195 14.126 533 HG22 ILE 77 HG22 ILE 77 4.159 11.841 13.012 534 HG23 ILE 77 HG23 ILE 77 4.819 11.738 14.645 535 HD11 ILE 77 HD11 ILE 77 3.729 9.103 12.683 536 HD12 ILE 77 HD12 ILE 77 2.937 10.630 12.290 537 HD13 ILE 77 HD13 ILE 77 1.976 9.164 12.495 538 H ALA 78 HN ALA 78 0.787 13.630 15.526 539 HA ALA 78 HA ALA 78 2.571 15.925 15.795 540 HB1 ALA 78 HB1 ALA 78 -0.069 15.407 14.748 541 HB2 ALA 78 HB2 ALA 78 0.986 16.791 14.452 542 HB3 ALA 78 HB3 ALA 78 -0.116 16.800 15.830 543 H ALA 79 HN ALA 79 -0.282 14.745 17.609 544 HA ALA 79 HA ALA 79 -0.210 16.706 19.654 545 HB1 ALA 79 HB1 ALA 79 -2.123 15.262 19.512 546 HB2 ALA 79 HB2 ALA 79 -1.344 14.904 21.054 547 HB3 ALA 79 HB3 ALA 79 -1.123 13.818 19.681 548 H SER 80 HN SER 80 1.868 13.998 19.043 549 HA SER 80 HA SER 80 2.944 13.895 21.766 550 HB2 SER 80 HB2 SER 80 4.534 12.280 20.847 551 HB3 SER 80 HB1 SER 80 2.908 11.891 20.283 552 HG SER 80 HG SER 80 4.675 11.951 18.673 553 H GLN 81 HN GLN 81 3.558 15.685 18.857 554 HA GLN 81 HA GLN 81 6.275 16.324 19.059 555 HB2 GLN 81 HB2 GLN 81 4.003 18.213 18.370 556 HB3 GLN 81 HB1 GLN 81 5.706 18.481 17.994 557 HG2 GLN 81 HG2 GLN 81 5.715 16.389 16.653 558 HG3 GLN 81 HG1 GLN 81 3.996 16.185 16.988 559 HE21 GLN 81 HE21 GLN 81 2.496 17.779 16.028 560 HE22 GLN 81 HE22 GLN 81 2.983 18.772 14.742 561 H GLY 82 HN GLY 82 3.589 17.476 21.025 562 HA2 GLY 82 HA2 GLY 82 3.703 18.435 23.186 563 HA3 GLY 82 HA1 GLY 82 5.462 18.383 23.077 564 H GLY 83 HN GLY 83 4.072 19.792 20.326 565 HA2 GLY 83 HA1 GLY 83 4.903 22.479 21.290 566 HA3 GLY 83 HA2 GLY 83 4.700 22.018 19.599 567 H ASP 84 HN ASP 84 3.262 23.804 19.217 568 HA ASP 84 HA ASP 84 0.885 24.233 20.799 569 HB2 ASP 84 HB1 ASP 84 1.939 25.952 19.294 570 HB3 ASP 84 HB2 ASP 84 1.363 25.022 17.910 571 H LEU 85 HN LEU 85 -0.732 22.754 20.906 572 HA LEU 85 HA LEU 85 -1.089 20.610 19.055 573 HB2 LEU 85 HB1 LEU 85 -1.962 20.520 21.348 574 HB3 LEU 85 HB2 LEU 85 -3.070 21.846 20.993 575 HG LEU 85 HG LEU 85 -3.751 20.186 18.989 576 HD11 LEU 85 HD11 LEU 85 -2.475 18.289 19.334 577 HD12 LEU 85 HD12 LEU 85 -3.867 17.888 20.339 578 HD13 LEU 85 HD13 LEU 85 -2.401 18.531 21.080 579 HD21 LEU 85 HD21 LEU 85 -4.832 21.001 21.457 580 HD22 LEU 85 HD22 LEU 85 -5.063 19.254 21.397 581 HD23 LEU 85 HD23 LEU 85 -5.704 20.273 20.109 582 H GLY 86 HN GLY 86 -2.216 23.910 19.047 583 HA2 GLY 86 HA2 GLY 86 -4.387 23.524 17.176 584 HA3 GLY 86 HA1 GLY 86 -3.626 25.066 17.561 585 H VAL 87 HN VAL 87 -0.919 23.953 16.832 586 HA VAL 87 HA VAL 87 -0.960 24.741 14.061 587 HB VAL 87 HB VAL 87 0.998 24.845 15.776 588 HG11 VAL 87 HG11 VAL 87 0.790 22.238 16.027 589 HG12 VAL 87 HG12 VAL 87 2.388 22.979 16.005 590 HG13 VAL 87 HG13 VAL 87 1.755 22.205 14.553 591 HG21 VAL 87 HG21 VAL 87 2.619 24.322 13.752 592 HG22 VAL 87 HG22 VAL 87 1.509 25.690 13.672 593 HG23 VAL 87 HG23 VAL 87 1.108 24.179 12.854 594 H THR 88 HN THR 88 -0.904 21.573 15.676 595 HA THR 88 HA THR 88 -0.355 19.963 13.419 596 HB THR 88 HB THR 88 -2.335 19.351 15.636 597 HG1 THR 88 HG1 THR 88 -0.025 19.945 16.108 598 HG21 THR 88 HG21 THR 88 -0.742 17.547 13.792 599 HG22 THR 88 HG22 THR 88 -2.476 17.850 13.679 600 HG23 THR 88 HG23 THR 88 -1.817 17.009 15.083 601 H THR 89 HN THR 89 -3.275 21.652 14.386 602 HA THR 89 HA THR 89 -5.104 20.400 12.592 603 HB THR 89 HB THR 89 -5.098 23.328 13.384 604 HG1 THR 89 HG1 THR 89 -5.797 20.988 14.778 605 HG21 THR 89 HG21 THR 89 -7.423 21.463 12.881 606 HG22 THR 89 HG22 THR 89 -6.704 22.451 11.609 607 HG23 THR 89 HG23 THR 89 -7.455 23.222 13.006 608 H ASN 90 HN ASN 90 -3.115 23.343 12.206 609 HA ASN 90 HA ASN 90 -3.782 23.660 9.410 610 HB2 ASN 90 HB1 ASN 90 -1.420 24.733 10.984 611 HB3 ASN 90 HB2 ASN 90 -1.935 25.297 9.394 612 HD21 ASN 90 HD21 ASN 90 -1.867 27.026 11.717 613 HD22 ASN 90 HD22 ASN 90 -3.466 27.485 12.057 614 H ALA 91 HN ALA 91 -1.193 22.058 11.197 615 HA ALA 91 HA ALA 91 0.454 21.457 8.912 616 HB1 ALA 91 HB1 ALA 91 0.325 19.718 11.365 617 HB2 ALA 91 HB2 ALA 91 1.013 21.338 11.459 618 HB3 ALA 91 HB3 ALA 91 1.726 20.139 10.381 619 H ILE 92 HN ILE 92 -1.780 19.383 10.787 620 HA ILE 92 HA ILE 92 -1.669 17.221 8.883 621 HB ILE 92 HB ILE 92 -3.617 17.904 11.100 622 HG12 ILE 92 HG12 ILE 92 -1.424 15.827 10.816 623 HG13 ILE 92 HG11 ILE 92 -1.353 17.277 11.816 624 HG21 ILE 92 HG21 ILE 92 -3.836 15.978 8.923 625 HG22 ILE 92 HG22 ILE 92 -5.035 16.437 10.131 626 HG23 ILE 92 HG23 ILE 92 -3.846 15.187 10.498 627 HD11 ILE 92 HD11 ILE 92 -1.965 15.504 13.296 628 HD12 ILE 92 HD12 ILE 92 -3.156 14.872 12.159 629 HD13 ILE 92 HD13 ILE 92 -3.452 16.400 12.988 630 H ALA 93 HN ALA 93 -4.174 19.693 9.551 631 HA ALA 93 HA ALA 93 -5.983 18.917 7.519 632 HB1 ALA 93 HB1 ALA 93 -6.473 20.606 9.286 633 HB2 ALA 93 HB2 ALA 93 -6.888 21.177 7.670 634 HB3 ALA 93 HB3 ALA 93 -5.413 21.743 8.454 635 H ASP 94 HN ASP 94 -3.167 21.096 7.332 636 HA ASP 94 HA ASP 94 -3.569 22.006 4.676 637 HB2 ASP 94 HB1 ASP 94 -1.135 21.608 6.391 638 HB3 ASP 94 HB2 ASP 94 -0.948 22.071 4.699 639 H ALA 95 HN ALA 95 -1.569 19.240 5.777 640 HA ALA 95 HA ALA 95 -1.081 18.290 3.098 641 HB1 ALA 95 HB1 ALA 95 -1.074 16.547 5.566 642 HB2 ALA 95 HB2 ALA 95 0.208 17.723 5.270 643 HB3 ALA 95 HB3 ALA 95 -0.065 16.409 4.126 644 H LEU 96 HN LEU 96 -3.586 17.718 5.495 645 HA LEU 96 HA LEU 96 -4.795 15.455 4.169 646 HB2 LEU 96 HB2 LEU 96 -5.108 16.549 6.613 647 HB3 LEU 96 HB1 LEU 96 -6.478 17.295 5.795 648 HG LEU 96 HG LEU 96 -7.256 15.220 6.741 649 HD11 LEU 96 HD21 LEU 96 -6.692 14.806 3.788 650 HD12 LEU 96 HD22 LEU 96 -8.023 15.764 4.437 651 HD13 LEU 96 HD23 LEU 96 -7.968 14.025 4.722 652 HD21 LEU 96 HD11 LEU 96 -4.990 14.200 6.988 653 HD22 LEU 96 HD12 LEU 96 -4.976 13.881 5.254 654 HD23 LEU 96 HD13 LEU 96 -6.162 13.085 6.288 655 H THR 97 HN THR 97 -5.384 18.964 4.083 656 HA THR 97 HA THR 97 -7.689 18.804 2.374 657 HB THR 97 HB THR 97 -5.736 21.046 2.944 658 HG1 THR 97 HG1 THR 97 -7.271 21.682 4.341 659 HG21 THR 97 HG21 THR 97 -6.567 21.865 0.971 660 HG22 THR 97 HG22 THR 97 -7.921 22.313 2.007 661 HG23 THR 97 HG23 THR 97 -8.005 20.846 1.032 662 H SER 98 HN SER 98 -4.294 19.684 1.627 663 HA SER 98 HA SER 98 -4.661 19.833 -1.190 664 HB2 SER 98 HB1 SER 98 -2.174 18.998 0.335 665 HB3 SER 98 HB2 SER 98 -2.221 19.556 -1.338 666 HG SER 98 HG SER 98 -3.031 21.030 0.946 667 H ALA 99 HN ALA 99 -3.743 17.101 0.899 668 HA ALA 99 HA ALA 99 -3.271 15.180 -1.117 669 HB1 ALA 99 HB1 ALA 99 -3.633 13.512 0.570 670 HB2 ALA 99 HB2 ALA 99 -4.636 14.606 1.522 671 HB3 ALA 99 HB3 ALA 99 -2.903 14.900 1.376 672 H PHE 100 HN PHE 100 -6.340 16.035 0.502 673 HA PHE 100 HA PHE 100 -8.074 14.188 -0.647 674 HB2 PHE 100 HB1 PHE 100 -8.314 16.959 0.335 675 HB3 PHE 100 HB2 PHE 100 -9.554 16.497 -0.831 676 HD1 PHE 100 HD1 PHE 100 -10.640 14.118 -0.442 677 HD2 PHE 100 HD2 PHE 100 -8.616 16.403 2.580 678 HE1 PHE 100 HE1 PHE 100 -11.823 12.835 1.322 679 HE2 PHE 100 HE2 PHE 100 -9.794 15.121 4.339 680 HZ PHE 100 HZ PHE 100 -11.401 13.338 3.714 681 H TYR 101 HN TYR 101 -7.205 17.352 -2.060 682 HA TYR 101 HA TYR 101 -8.473 16.771 -4.588 683 HB2 TYR 101 HB2 TYR 101 -6.273 18.788 -4.306 684 HB3 TYR 101 HB1 TYR 101 -7.765 18.890 -5.242 685 HD1 TYR 101 HD1 TYR 101 -9.806 18.085 -3.275 686 HD2 TYR 101 HD2 TYR 101 -6.350 20.591 -2.787 687 HE1 TYR 101 HE1 TYR 101 -10.915 19.240 -1.373 688 HE2 TYR 101 HE2 TYR 101 -7.457 21.747 -0.893 689 HH TYR 101 HH TYR 101 -9.649 22.144 -0.010 690 H GLN 102 HN GLN 102 -5.247 16.327 -3.290 691 HA GLN 102 HA GLN 102 -3.973 15.781 -5.824 692 HB2 GLN 102 HB1 GLN 102 -3.251 15.146 -2.959 693 HB3 GLN 102 HB2 GLN 102 -2.237 14.655 -4.315 694 HG2 GLN 102 HG1 GLN 102 -2.316 17.108 -5.057 695 HG3 GLN 102 HG2 GLN 102 -2.980 17.457 -3.462 696 HE21 GLN 102 HE21 GLN 102 -0.487 18.562 -4.108 697 HE22 GLN 102 HE22 GLN 102 0.710 17.801 -3.176 698 H THR 103 HN THR 103 -6.077 13.938 -3.788 699 HA THR 103 HA THR 103 -5.222 11.444 -5.192 700 HB THR 103 HB THR 103 -6.252 10.215 -3.359 701 HG1 THR 103 HG1 THR 103 -7.094 11.492 -1.596 702 HG21 THR 103 HG21 THR 103 -4.040 10.702 -2.800 703 HG22 THR 103 HG22 THR 103 -4.913 11.376 -1.424 704 HG23 THR 103 HG23 THR 103 -4.341 12.439 -2.712 705 H THR 104 HN THR 104 -8.298 12.831 -3.897 706 HA THR 104 HA THR 104 -9.578 11.781 -6.392 707 HB THR 104 HB THR 104 -11.481 11.060 -5.153 708 HG1 THR 104 HG1 THR 104 -10.272 12.392 -2.962 709 HG21 THR 104 HG21 THR 104 -10.537 9.272 -4.084 710 HG22 THR 104 HG22 THR 104 -9.450 10.282 -3.134 711 HG23 THR 104 HG23 THR 104 -9.062 9.906 -4.812 712 H GLY 105 HN GLY 105 -9.854 14.191 -3.765 713 HA2 GLY 105 HA2 GLY 105 -10.231 16.552 -4.402 714 HA3 GLY 105 HA1 GLY 105 -11.195 15.973 -5.757 715 H VAL 106 HN VAL 106 -11.290 14.973 -2.326 716 HA VAL 106 HA VAL 106 -14.201 15.583 -2.351 717 HB VAL 106 HB VAL 106 -12.637 14.109 -0.215 718 HG11 VAL 106 HG21 VAL 106 -15.059 13.078 -0.057 719 HG12 VAL 106 HG22 VAL 106 -15.530 14.566 -0.877 720 HG13 VAL 106 HG23 VAL 106 -14.721 14.640 0.689 721 HG21 VAL 106 HG11 VAL 106 -12.671 13.212 -2.724 722 HG22 VAL 106 HG12 VAL 106 -14.283 12.676 -2.254 723 HG23 VAL 106 HG13 VAL 106 -12.871 12.116 -1.357 724 H VAL 107 HN VAL 107 -15.009 16.478 -0.164 725 HA VAL 107 HA VAL 107 -13.632 18.960 0.353 726 HB VAL 107 HB VAL 107 -15.326 19.236 2.143 727 HG11 VAL 107 HG21 VAL 107 -17.196 19.410 0.683 728 HG12 VAL 107 HG22 VAL 107 -16.643 18.059 -0.309 729 HG13 VAL 107 HG23 VAL 107 -15.786 19.600 -0.360 730 HG21 VAL 107 HG11 VAL 107 -15.995 17.315 3.144 731 HG22 VAL 107 HG12 VAL 107 -15.438 16.334 1.785 732 HG23 VAL 107 HG13 VAL 107 -17.039 17.076 1.743 733 H ASN 108 HN ASN 108 -11.884 19.204 1.646 734 HA ASN 108 HA ASN 108 -10.891 17.059 3.308 735 HB2 ASN 108 HB2 ASN 108 -9.102 18.556 3.852 736 HB3 ASN 108 HB1 ASN 108 -9.520 18.881 2.170 737 HD21 ASN 108 HD21 ASN 108 -9.846 21.057 1.693 738 HD22 ASN 108 HD22 ASN 108 -10.329 22.239 2.810 739 H SER 109 HN SER 109 -13.018 19.752 3.833 740 HA SER 109 HA SER 109 -12.729 20.087 6.641 741 HB2 SER 109 HB2 SER 109 -15.251 20.379 4.982 742 HB3 SER 109 HB1 SER 109 -14.963 21.090 6.570 743 HG SER 109 HG SER 109 -14.541 22.557 4.863 744 H ARG 110 HN ARG 110 -14.456 17.628 4.786 745 HA ARG 110 HA ARG 110 -16.069 16.684 6.979 746 HB2 ARG 110 HB2 ARG 110 -16.544 16.157 4.596 747 HB3 ARG 110 HB1 ARG 110 -15.095 15.152 4.551 748 HG2 ARG 110 HG2 ARG 110 -16.039 13.766 6.396 749 HG3 ARG 110 HG1 ARG 110 -17.509 14.738 6.343 750 HD2 ARG 110 HD2 ARG 110 -17.756 14.107 3.920 751 HD3 ARG 110 HD1 ARG 110 -16.390 13.010 4.117 752 HE ARG 110 HE ARG 110 -17.769 11.586 5.468 753 HH11 ARG 110 HH21 ARG 110 -19.724 12.589 3.289 754 HH12 ARG 110 HH22 ARG 110 -21.124 12.914 4.255 755 HH21 ARG 110 HH11 ARG 110 -19.396 12.835 7.261 756 HH22 ARG 110 HH12 ARG 110 -20.939 13.055 6.504 757 H PHE 111 HN PHE 111 -13.063 15.310 5.560 758 HA PHE 111 HA PHE 111 -12.774 13.453 7.782 759 HB2 PHE 111 HB2 PHE 111 -11.893 12.929 5.533 760 HB3 PHE 111 HB1 PHE 111 -10.762 14.275 5.671 761 HD1 PHE 111 HD2 PHE 111 -11.770 11.050 7.251 762 HD2 PHE 111 HD1 PHE 111 -8.710 14.036 6.838 763 HE1 PHE 111 HE2 PHE 111 -10.183 9.592 8.477 764 HE2 PHE 111 HE1 PHE 111 -7.123 12.579 8.064 765 HZ PHE 111 HZ PHE 111 -7.858 10.357 8.884 766 H ILE 112 HN ILE 112 -10.979 16.369 6.761 767 HA ILE 112 HA ILE 112 -9.157 16.450 8.914 768 HB ILE 112 HB ILE 112 -10.412 18.701 7.327 769 HG12 ILE 112 HG12 ILE 112 -7.745 17.271 7.156 770 HG13 ILE 112 HG11 ILE 112 -9.084 17.101 6.021 771 HG21 ILE 112 HG21 ILE 112 -9.605 19.791 9.256 772 HG22 ILE 112 HG22 ILE 112 -8.239 19.880 8.144 773 HG23 ILE 112 HG23 ILE 112 -8.252 18.673 9.429 774 HD11 ILE 112 HD11 ILE 112 -8.924 19.584 5.594 775 HD12 ILE 112 HD12 ILE 112 -7.515 18.665 5.063 776 HD13 ILE 112 HD13 ILE 112 -7.450 19.594 6.562 777 H SER 113 HN SER 113 -12.506 17.619 8.746 778 HA SER 113 HA SER 113 -12.547 19.097 11.164 779 HB2 SER 113 HB2 SER 113 -14.630 17.535 9.654 780 HB3 SER 113 HB1 SER 113 -15.019 18.230 11.226 781 HG SER 113 HG SER 113 -13.905 19.671 9.056 782 H GLU 114 HN GLU 114 -12.890 15.613 10.584 783 HA GLU 114 HA GLU 114 -13.432 14.970 13.357 784 HB2 GLU 114 HB1 GLU 114 -12.357 13.220 11.123 785 HB3 GLU 114 HB2 GLU 114 -13.001 12.643 12.659 786 HG2 GLU 114 HG1 GLU 114 -15.190 13.607 12.137 787 HG3 GLU 114 HG2 GLU 114 -14.556 14.287 10.639 788 H ILE 115 HN ILE 115 -10.511 14.979 11.318 789 HA ILE 115 HA ILE 115 -8.729 13.923 13.290 790 HB ILE 115 HB ILE 115 -8.027 15.946 11.147 791 HG12 ILE 115 HG12 ILE 115 -9.329 14.150 10.122 792 HG13 ILE 115 HG11 ILE 115 -7.627 13.949 9.702 793 HG21 ILE 115 HG21 ILE 115 -6.554 14.208 13.006 794 HG22 ILE 115 HG22 ILE 115 -6.004 15.633 12.125 795 HG23 ILE 115 HG23 ILE 115 -6.026 14.059 11.330 796 HD11 ILE 115 HD11 ILE 115 -8.017 12.586 12.155 797 HD12 ILE 115 HD12 ILE 115 -7.700 11.877 10.573 798 HD13 ILE 115 HD13 ILE 115 -9.361 12.128 11.108 799 H ARG 116 HN ARG 116 -9.487 17.302 12.401 800 HA ARG 116 HA ARG 116 -7.822 18.593 14.273 801 HB2 ARG 116 HB2 ARG 116 -8.884 20.013 12.720 802 HB3 ARG 116 HB1 ARG 116 -10.472 19.317 13.027 803 HG2 ARG 116 HG2 ARG 116 -10.733 20.483 15.048 804 HG3 ARG 116 HG1 ARG 116 -9.000 20.750 15.229 805 HD2 ARG 116 HD2 ARG 116 -9.166 22.178 13.097 806 HD3 ARG 116 HD1 ARG 116 -10.912 22.117 13.328 807 HE ARG 116 HE ARG 116 -10.342 23.082 15.684 808 HH11 ARG 116 HH11 ARG 116 -9.770 24.409 12.703 809 HH12 ARG 116 HH12 ARG 116 -8.621 25.593 13.232 810 HH21 ARG 116 HH21 ARG 116 -8.326 24.270 16.423 811 HH22 ARG 116 HH22 ARG 116 -7.805 25.514 15.336 812 H SER 117 HN SER 117 -11.118 17.313 14.690 813 HA SER 117 HA SER 117 -11.313 18.159 17.457 814 HB2 SER 117 HB1 SER 117 -12.864 15.967 16.046 815 HB3 SER 117 HB2 SER 117 -13.337 16.817 17.517 816 HG SER 117 HG SER 117 -13.086 17.861 14.900 817 H LEU 118 HN LEU 118 -10.213 15.247 15.797 818 HA LEU 118 HA LEU 118 -10.065 13.581 18.142 819 HB2 LEU 118 HB2 LEU 118 -8.655 13.473 15.464 820 HB3 LEU 118 HB1 LEU 118 -8.448 12.242 16.709 821 HG LEU 118 HG LEU 118 -11.215 13.044 15.850 822 HD11 LEU 118 HD21 LEU 118 -9.237 11.954 14.104 823 HD12 LEU 118 HD22 LEU 118 -10.956 12.188 13.785 824 HD13 LEU 118 HD23 LEU 118 -10.386 10.670 14.480 825 HD21 LEU 118 HD11 LEU 118 -10.241 10.290 16.552 826 HD22 LEU 118 HD12 LEU 118 -11.836 11.003 16.799 827 HD23 LEU 118 HD13 LEU 118 -10.488 11.476 17.835 828 H ILE 119 HN ILE 119 -7.673 15.645 16.483 829 HA ILE 119 HA ILE 119 -5.432 14.987 18.089 830 HB ILE 119 HB ILE 119 -6.084 17.709 16.921 831 HG12 ILE 119 HG12 ILE 119 -4.393 15.626 15.570 832 HG13 ILE 119 HG11 ILE 119 -6.147 15.551 15.411 833 HG21 ILE 119 HG21 ILE 119 -3.837 18.227 17.182 834 HG22 ILE 119 HG22 ILE 119 -3.338 16.535 17.158 835 HG23 ILE 119 HG23 ILE 119 -4.090 17.212 18.602 836 HD11 ILE 119 HD11 ILE 119 -4.313 17.822 14.611 837 HD12 ILE 119 HD12 ILE 119 -6.066 17.999 14.714 838 HD13 ILE 119 HD13 ILE 119 -5.359 16.862 13.565 839 H GLY 120 HN GLY 120 -7.957 17.457 18.587 840 HA2 GLY 120 HA2 GLY 120 -6.862 18.591 20.959 841 HA3 GLY 120 HA1 GLY 120 -8.573 18.614 20.533 842 H MET 121 HN MET 121 -8.843 15.712 20.436 843 HA MET 121 HA MET 121 -9.497 15.205 23.172 844 HB2 MET 121 HB2 MET 121 -10.532 14.040 21.211 845 HB3 MET 121 HB1 MET 121 -9.020 13.162 20.981 846 HG2 MET 121 HG2 MET 121 -9.224 12.299 23.322 847 HG3 MET 121 HG1 MET 121 -10.800 13.081 23.435 848 HE1 MET 121 HE1 MET 121 -12.064 12.214 20.148 849 HE2 MET 121 HE2 MET 121 -12.350 13.051 21.672 850 HE3 MET 121 HE3 MET 121 -13.153 11.516 21.354 851 H PHE 122 HN PHE 122 -6.725 14.174 21.178 852 HA PHE 122 HA PHE 122 -5.473 12.531 23.133 853 HB2 PHE 122 HB2 PHE 122 -4.313 14.200 20.887 854 HB3 PHE 122 HB1 PHE 122 -3.349 13.093 21.863 855 HD1 PHE 122 HD1 PHE 122 -3.897 10.644 21.880 856 HD2 PHE 122 HD2 PHE 122 -5.789 13.398 19.181 857 HE1 PHE 122 HE1 PHE 122 -4.649 8.747 20.470 858 HE2 PHE 122 HE2 PHE 122 -6.541 11.501 17.771 859 HZ PHE 122 HZ PHE 122 -5.971 9.175 18.416 860 H ALA 123 HN ALA 123 -5.037 16.012 22.441 861 HA ALA 123 HA ALA 123 -3.076 16.534 24.415 862 HB1 ALA 123 HB1 ALA 123 -4.087 18.098 22.586 863 HB2 ALA 123 HB2 ALA 123 -3.571 18.812 24.113 864 HB3 ALA 123 HB3 ALA 123 -5.281 18.498 23.821 865 H GLN 124 HN GLN 124 -6.550 16.101 24.695 866 HA GLN 124 HA GLN 124 -6.774 17.137 27.386 867 HB2 GLN 124 HB2 GLN 124 -8.514 15.214 25.814 868 HB3 GLN 124 HB1 GLN 124 -8.946 15.872 27.393 869 HG2 GLN 124 HG2 GLN 124 -8.815 18.158 26.487 870 HG3 GLN 124 HG1 GLN 124 -8.351 17.515 24.912 871 HE21 GLN 124 HE21 GLN 124 -10.734 19.082 25.248 872 HE22 GLN 124 HE22 GLN 124 -12.055 18.076 24.900 873 H ALA 125 HN ALA 125 -5.980 13.990 26.011 874 HA ALA 125 HA ALA 125 -6.308 12.398 28.341 875 HB1 ALA 125 HB1 ALA 125 -3.951 11.800 26.645 876 HB2 ALA 125 HB2 ALA 125 -5.495 11.892 25.796 877 HB3 ALA 125 HB3 ALA 125 -5.286 10.753 27.126 878 H SER 126 HN SER 126 -3.659 14.513 27.323 879 HA SER 126 HA SER 126 -1.700 13.728 29.204 880 HB2 SER 126 HB2 SER 126 -2.262 16.567 28.301 881 HB3 SER 126 HB1 SER 126 -0.729 15.931 28.894 882 HG SER 126 HG SER 126 -0.709 14.525 27.093 883 H ALA 127 HN ALA 127 -4.605 15.666 29.610 884 HA ALA 127 HA ALA 127 -3.941 16.776 32.175 885 HB1 ALA 127 HB1 ALA 127 -6.473 16.975 32.398 886 HB2 ALA 127 HB2 ALA 127 -6.586 16.189 30.823 887 HB3 ALA 127 HB3 ALA 127 -5.776 17.748 30.975 888 H ASN 128 HN ASN 128 -4.863 13.607 31.162 889 HA ASN 128 HA ASN 128 -6.085 12.662 33.571 890 HB2 ASN 128 HB2 ASN 128 -4.436 11.184 31.496 891 HB3 ASN 128 HB1 ASN 128 -5.382 10.402 32.761 892 HD21 ASN 128 HD21 ASN 128 -7.696 12.067 32.736 893 HD22 ASN 128 HD22 ASN 128 -8.459 11.959 31.224 894 H ASP 129 HN ASP 129 -2.786 13.382 32.755 895 HA ASP 129 HA ASP 129 -1.564 11.748 34.815 896 HB2 ASP 129 HB2 ASP 129 -0.568 14.182 33.307 897 HB3 ASP 129 HB1 ASP 129 0.426 13.231 34.411 898 H VAL 130 HN VAL 130 -2.404 15.211 34.584 899 HA VAL 130 HA VAL 130 -1.554 15.850 37.256 900 HB VAL 130 HB VAL 130 -1.864 17.606 35.590 901 HG11 VAL 130 HG11 VAL 130 -3.575 17.003 34.156 902 HG12 VAL 130 HG12 VAL 130 -4.452 18.127 35.193 903 HG13 VAL 130 HG13 VAL 130 -4.592 16.390 35.459 904 HG21 VAL 130 HG21 VAL 130 -3.173 17.583 38.188 905 HG22 VAL 130 HG22 VAL 130 -3.970 18.700 37.080 906 HG23 VAL 130 HG23 VAL 130 -2.247 18.872 37.418 907 H TYR 131 HN TYR 131 -4.508 14.529 35.908 908 HA TYR 131 HA TYR 131 -5.435 13.496 38.381 909 HB2 TYR 131 HB2 TYR 131 -7.204 15.007 38.996 910 HB3 TYR 131 HB1 TYR 131 -5.738 15.974 38.841 911 HD1 TYR 131 HD1 TYR 131 -5.415 17.490 36.944 912 HD2 TYR 131 HD2 TYR 131 -8.998 15.156 37.345 913 HE1 TYR 131 HE1 TYR 131 -6.521 18.895 35.226 914 HE2 TYR 131 HE2 TYR 131 -10.104 16.560 35.626 915 HH TYR 131 HH TYR 131 -8.608 18.392 33.507 916 H ALA 132 HN ALA 132 -7.900 12.912 38.154 917 HA ALA 132 HA ALA 132 -8.217 11.698 35.515 918 HB1 ALA 132 HB1 ALA 132 -8.927 10.772 37.872 919 HB2 ALA 132 HB2 ALA 132 -9.945 10.449 36.468 920 HB3 ALA 132 HB3 ALA 132 -10.383 11.730 37.597 921 H SER 133 HN SER 133 -9.046 12.847 33.842 922 HA SER 133 HA SER 133 -10.462 15.340 34.211 923 HB2 SER 133 HB2 SER 133 -10.638 15.396 31.824 924 HB3 SER 133 HB1 SER 133 -9.078 14.651 32.177 925 HG SER 133 HG SER 133 -10.249 13.467 30.621 926 H ALA 134 HN ALA 134 -12.710 15.682 33.291 927 HA ALA 134 HA ALA 134 -14.550 13.820 34.528 928 HB1 ALA 134 HB1 ALA 134 -16.216 15.368 34.009 929 HB2 ALA 134 HB2 ALA 134 -15.431 15.860 32.508 930 HB3 ALA 134 HB3 ALA 134 -14.789 16.403 34.058 931 H GLY 135 HN GLY 135 -15.998 12.381 33.494 932 HA2 GLY 135 HA2 GLY 135 -16.874 11.082 31.718 933 HA3 GLY 135 HA1 GLY 135 -15.992 12.104 30.582 934 H SER 136 HN SER 136 -14.565 10.412 33.345 935 HA SER 136 HA SER 136 -12.374 9.382 31.877 936 HB2 SER 136 HB2 SER 136 -13.633 8.173 34.359 937 HB3 SER 136 HB1 SER 136 -11.980 7.922 33.796 938 HG SER 136 HG SER 136 -12.665 9.707 35.449 939 H GLY 137 HN GLY 137 -15.585 8.025 32.472 940 HA2 GLY 137 HA2 GLY 137 -16.257 6.587 30.414 941 HA3 GLY 137 HA1 GLY 137 -14.825 5.647 30.835 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 -13.519 -0.968 -15.824 2 H2 GLY 1 HT2 GLY 1 -12.175 -2.002 -15.948 3 H3 GLY 1 HT3 GLY 1 -12.216 -0.798 -14.751 4 HA2 GLY 1 HA1 GLY 1 -14.389 -2.747 -14.753 5 HA3 GLY 1 HA2 GLY 1 -12.801 -3.302 -14.223 6 H MET 2 HN MET 2 -11.796 -2.160 -12.414 7 HA MET 2 HA MET 2 -13.575 -1.596 -10.272 8 HB2 MET 2 HB1 MET 2 -10.678 -0.786 -10.660 9 HB3 MET 2 HB2 MET 2 -11.554 -0.653 -9.135 10 HG2 MET 2 HG2 MET 2 -11.048 -3.210 -10.689 11 HG3 MET 2 HG1 MET 2 -10.269 -2.741 -9.177 12 HE1 MET 2 HE1 MET 2 -11.400 -2.019 -7.236 13 HE2 MET 2 HE2 MET 2 -12.780 -2.839 -6.509 14 HE3 MET 2 HE3 MET 2 -13.042 -1.434 -7.537 15 H GLY 3 HN GLY 3 -12.037 0.528 -12.644 16 HA2 GLY 3 HA2 GLY 3 -12.769 2.684 -13.303 17 HA3 GLY 3 HA1 GLY 3 -13.998 2.619 -12.039 18 H GLN 4 HN GLN 4 -13.357 4.825 -11.458 19 HA GLN 4 HA GLN 4 -10.654 5.103 -10.263 20 HB2 GLN 4 HB1 GLN 4 -12.861 7.136 -10.716 21 HB3 GLN 4 HB2 GLN 4 -11.271 7.503 -10.050 22 HG2 GLN 4 HG1 GLN 4 -10.200 6.720 -12.115 23 HG3 GLN 4 HG2 GLN 4 -11.773 6.279 -12.780 24 HE21 GLN 4 HE21 GLN 4 -10.188 8.166 -14.161 25 HE22 GLN 4 HE22 GLN 4 -10.905 9.699 -14.034 26 H ALA 5 HN ALA 5 -10.434 5.864 -8.048 27 HA ALA 5 HA ALA 5 -12.484 4.714 -6.284 28 HB1 ALA 5 HB1 ALA 5 -10.767 5.714 -4.529 29 HB2 ALA 5 HB2 ALA 5 -9.710 5.796 -5.937 30 HB3 ALA 5 HB3 ALA 5 -10.375 4.246 -5.423 31 H ASN 6 HN ASN 6 -14.134 5.914 -5.480 32 HA ASN 6 HA ASN 6 -14.336 8.745 -5.993 33 HB2 ASN 6 HB2 ASN 6 -15.945 7.128 -3.998 34 HB3 ASN 6 HB1 ASN 6 -16.421 8.634 -4.781 35 HD21 ASN 6 HD21 ASN 6 -17.712 5.890 -4.939 36 HD22 ASN 6 HD22 ASN 6 -17.781 5.542 -6.599 37 H THR 7 HN THR 7 -12.561 7.052 -3.701 38 HA THR 7 HA THR 7 -12.029 9.522 -2.209 39 HB THR 7 HB THR 7 -12.495 7.493 -0.227 40 HG1 THR 7 HG1 THR 7 -14.906 8.196 -1.406 41 HG21 THR 7 HG21 THR 7 -12.694 9.570 0.671 42 HG22 THR 7 HG22 THR 7 -14.381 9.415 0.183 43 HG23 THR 7 HG23 THR 7 -13.241 10.282 -0.847 44 HA PRO 8 HA PRO 8 -8.015 7.670 -1.890 45 HB2 PRO 8 HB2 PRO 8 -7.115 8.754 0.417 46 HB3 PRO 8 HB1 PRO 8 -7.261 9.673 -1.083 47 HG2 PRO 8 HG2 PRO 8 -9.115 9.569 1.268 48 HG3 PRO 8 HG1 PRO 8 -8.581 10.971 0.336 49 HD2 PRO 8 HD1 PRO 8 -10.996 9.825 -0.057 50 HD3 PRO 8 HD2 PRO 8 -10.089 10.571 -1.373 51 H TRP 9 HN TRP 9 -10.074 7.516 1.005 52 HA TRP 9 HA TRP 9 -8.577 5.150 1.973 53 HB2 TRP 9 HB2 TRP 9 -10.098 5.272 3.919 54 HB3 TRP 9 HB1 TRP 9 -9.295 6.816 3.637 55 HD1 TRP 9 HD1 TRP 9 -12.673 5.070 3.110 56 HE1 TRP 9 HE1 TRP 9 -14.500 6.877 2.888 57 HE3 TRP 9 HE3 TRP 9 -9.760 9.258 3.099 58 HZ2 TRP 9 HZ2 TRP 9 -14.693 9.732 2.729 59 HZ3 TRP 9 HZ3 TRP 9 -10.787 11.503 2.916 60 HH2 TRP 9 HH2 TRP 9 -13.247 11.747 2.730 61 H SER 10 HN SER 10 -11.485 5.961 0.237 62 HA SER 10 HA SER 10 -12.947 3.545 0.747 63 HB2 SER 10 HB1 SER 10 -12.930 5.521 -1.540 64 HB3 SER 10 HB2 SER 10 -13.946 4.082 -1.583 65 HG SER 10 HG SER 10 -15.102 5.769 -0.677 66 H SER 11 HN SER 11 -10.040 4.144 -0.936 67 HA SER 11 HA SER 11 -10.069 1.358 -1.972 68 HB2 SER 11 HB1 SER 11 -9.280 3.810 -3.573 69 HB3 SER 11 HB2 SER 11 -8.990 2.147 -4.083 70 HG SER 11 HG SER 11 -11.326 1.871 -3.781 71 H LYS 12 HN LYS 12 -8.284 0.364 -1.190 72 HA LYS 12 HA LYS 12 -6.288 1.591 0.350 73 HB2 LYS 12 HB2 LYS 12 -5.185 -0.479 0.345 74 HB3 LYS 12 HB1 LYS 12 -6.854 -0.919 -0.004 75 HG2 LYS 12 HG1 LYS 12 -6.381 -1.086 -2.376 76 HG3 LYS 12 HG2 LYS 12 -4.746 -0.473 -2.131 77 HD2 LYS 12 HD1 LYS 12 -4.389 -2.469 -0.570 78 HD3 LYS 12 HD2 LYS 12 -5.890 -3.118 -1.228 79 HE2 LYS 12 HE2 LYS 12 -4.917 -2.900 -3.525 80 HE3 LYS 12 HE1 LYS 12 -3.394 -2.394 -2.793 81 HZ1 LYS 12 HZ1 LYS 12 -3.000 -4.463 -1.951 82 HZ2 LYS 12 HZ2 LYS 12 -3.835 -4.886 -3.369 83 HZ3 LYS 12 HZ3 LYS 12 -4.642 -4.883 -1.874 84 H ALA 13 HN ALA 13 -6.215 0.848 -3.138 85 HA ALA 13 HA ALA 13 -3.542 1.760 -3.577 86 HB1 ALA 13 HB1 ALA 13 -4.186 0.722 -5.494 87 HB2 ALA 13 HB2 ALA 13 -4.823 2.302 -5.947 88 HB3 ALA 13 HB3 ALA 13 -5.890 1.094 -5.231 89 H ASN 14 HN ASN 14 -6.653 3.443 -3.518 90 HA ASN 14 HA ASN 14 -5.565 5.969 -4.454 91 HB2 ASN 14 HB1 ASN 14 -8.081 5.064 -4.257 92 HB3 ASN 14 HB2 ASN 14 -7.993 5.933 -2.726 93 HD21 ASN 14 HD21 ASN 14 -9.724 7.213 -4.199 94 HD22 ASN 14 HD22 ASN 14 -9.089 8.492 -5.116 95 H ALA 15 HN ALA 15 -6.082 4.497 -1.284 96 HA ALA 15 HA ALA 15 -5.568 6.858 0.261 97 HB1 ALA 15 HB1 ALA 15 -6.211 5.436 1.877 98 HB2 ALA 15 HB2 ALA 15 -4.676 4.583 1.709 99 HB3 ALA 15 HB3 ALA 15 -6.073 4.078 0.760 100 H ASP 16 HN ASP 16 -3.439 4.539 -1.298 101 HA ASP 16 HA ASP 16 -1.072 4.976 0.172 102 HB2 ASP 16 HB2 ASP 16 -1.453 4.507 -2.800 103 HB3 ASP 16 HB1 ASP 16 0.117 4.473 -2.000 104 H ALA 17 HN ALA 17 -2.087 6.743 -2.798 105 HA ALA 17 HA ALA 17 -0.027 8.718 -2.590 106 HB1 ALA 17 HB1 ALA 17 -2.427 9.864 -3.698 107 HB2 ALA 17 HB2 ALA 17 -2.243 8.214 -4.298 108 HB3 ALA 17 HB3 ALA 17 -0.949 9.389 -4.535 109 H PHE 18 HN PHE 18 -3.036 8.242 -0.955 110 HA PHE 18 HA PHE 18 -3.378 10.932 0.051 111 HB2 PHE 18 HB1 PHE 18 -5.153 9.113 -0.069 112 HB3 PHE 18 HB2 PHE 18 -4.349 8.347 1.300 113 HD1 PHE 18 HD2 PHE 18 -5.737 11.664 0.234 114 HD2 PHE 18 HD1 PHE 18 -4.964 8.944 3.466 115 HE1 PHE 18 HE2 PHE 18 -6.952 13.167 1.788 116 HE2 PHE 18 HE1 PHE 18 -6.182 10.445 5.020 117 HZ PHE 18 HZ PHE 18 -7.176 12.554 4.181 118 H ILE 19 HN ILE 19 -1.791 7.993 1.233 119 HA ILE 19 HA ILE 19 -1.067 9.143 3.801 120 HB ILE 19 HB ILE 19 0.110 6.749 2.362 121 HG12 ILE 19 HG12 ILE 19 -2.201 6.282 2.581 122 HG13 ILE 19 HG11 ILE 19 -1.465 5.524 3.991 123 HG21 ILE 19 HG21 ILE 19 1.233 6.253 4.292 124 HG22 ILE 19 HG22 ILE 19 -0.031 6.924 5.321 125 HG23 ILE 19 HG23 ILE 19 1.129 7.997 4.537 126 HD11 ILE 19 HD11 ILE 19 -3.397 6.724 4.771 127 HD12 ILE 19 HD12 ILE 19 -2.929 8.171 3.879 128 HD13 ILE 19 HD13 ILE 19 -1.983 7.651 5.272 129 H ASN 20 HN ASN 20 0.725 8.460 0.789 130 HA ASN 20 HA ASN 20 3.232 9.486 1.678 131 HB2 ASN 20 HB1 ASN 20 2.120 9.447 -1.141 132 HB3 ASN 20 HB2 ASN 20 3.820 9.583 -0.699 133 HD21 ASN 20 HD21 ASN 20 1.716 7.349 -1.850 134 HD22 ASN 20 HD22 ASN 20 2.293 5.941 -1.099 135 H SER 21 HN SER 21 0.661 11.086 -0.234 136 HA SER 21 HA SER 21 1.969 13.618 -0.396 137 HB2 SER 21 HB2 SER 21 -0.150 12.722 -1.637 138 HB3 SER 21 HB1 SER 21 -1.026 13.365 -0.248 139 HG SER 21 HG SER 21 -0.497 14.759 -2.222 140 H PHE 22 HN PHE 22 0.004 12.158 2.130 141 HA PHE 22 HA PHE 22 -0.466 14.608 3.586 142 HB2 PHE 22 HB1 PHE 22 -1.835 12.559 3.886 143 HB3 PHE 22 HB2 PHE 22 -0.440 11.753 4.605 144 HD1 PHE 22 HD2 PHE 22 0.605 12.756 6.701 145 HD2 PHE 22 HD1 PHE 22 -3.208 14.003 5.167 146 HE1 PHE 22 HE2 PHE 22 0.050 13.762 8.899 147 HE2 PHE 22 HE1 PHE 22 -3.762 15.010 7.365 148 HZ PHE 22 HZ PHE 22 -2.133 14.888 9.229 149 H ILE 23 HN ILE 23 1.848 11.922 4.140 150 HA ILE 23 HA ILE 23 3.159 13.127 6.359 151 HB ILE 23 HB ILE 23 4.404 11.297 4.296 152 HG12 ILE 23 HG12 ILE 23 2.299 10.342 5.091 153 HG13 ILE 23 HG11 ILE 23 3.648 9.474 5.824 154 HG21 ILE 23 HG21 ILE 23 4.982 11.526 7.256 155 HG22 ILE 23 HG22 ILE 23 5.862 12.463 6.048 156 HG23 ILE 23 HG23 ILE 23 5.940 10.701 6.027 157 HD11 ILE 23 HD11 ILE 23 2.624 9.901 7.802 158 HD12 ILE 23 HD12 ILE 23 1.587 11.138 7.090 159 HD13 ILE 23 HD13 ILE 23 3.224 11.548 7.602 160 H SER 24 HN SER 24 4.254 13.044 2.943 161 HA SER 24 HA SER 24 6.481 14.751 3.286 162 HB2 SER 24 HB2 SER 24 4.715 14.589 0.828 163 HB3 SER 24 HB1 SER 24 6.407 15.086 0.884 164 HG SER 24 HG SER 24 6.583 12.855 1.969 165 H ALA 25 HN ALA 25 3.077 15.557 2.674 166 HA ALA 25 HA ALA 25 3.636 18.407 2.416 167 HB1 ALA 25 HB1 ALA 25 1.276 18.680 2.204 168 HB2 ALA 25 HB2 ALA 25 0.954 17.149 3.017 169 HB3 ALA 25 HB3 ALA 25 1.652 17.157 1.398 170 H ALA 26 HN ALA 26 2.221 16.344 4.974 171 HA ALA 26 HA ALA 26 1.752 18.481 6.819 172 HB1 ALA 26 HB1 ALA 26 1.296 16.810 8.411 173 HB2 ALA 26 HB2 ALA 26 2.440 15.680 7.687 174 HB3 ALA 26 HB3 ALA 26 0.912 16.026 6.878 175 H SER 27 HN SER 27 4.588 16.419 6.272 176 HA SER 27 HA SER 27 6.073 17.169 8.566 177 HB2 SER 27 HB2 SER 27 8.009 16.356 7.400 178 HB3 SER 27 HB1 SER 27 6.650 15.352 6.895 179 HG SER 27 HG SER 27 7.823 17.521 5.504 180 H ASN 28 HN ASN 28 5.513 18.911 5.562 181 HA ASN 28 HA ASN 28 7.459 20.992 6.450 182 HB2 ASN 28 HB2 ASN 28 6.176 20.441 3.765 183 HB3 ASN 28 HB1 ASN 28 7.157 21.868 4.098 184 HD21 ASN 28 HD21 ASN 28 8.064 20.060 2.147 185 HD22 ASN 28 HD22 ASN 28 9.403 19.196 2.733 186 H THR 29 HN THR 29 4.303 20.419 6.978 187 HA THR 29 HA THR 29 3.359 23.141 6.284 188 HB THR 29 HB THR 29 1.797 20.949 7.664 189 HG1 THR 29 HG1 THR 29 2.258 20.037 5.781 190 HG21 THR 29 HG21 THR 29 1.223 23.618 7.225 191 HG22 THR 29 HG22 THR 29 0.029 22.350 7.490 192 HG23 THR 29 HG23 THR 29 0.462 22.822 5.848 193 H GLY 30 HN GLY 30 2.762 21.217 9.240 194 HA2 GLY 30 HA2 GLY 30 2.676 23.621 10.846 195 HA3 GLY 30 HA1 GLY 30 2.601 21.970 11.457 196 H SER 31 HN SER 31 4.402 21.136 12.401 197 HA SER 31 HA SER 31 7.040 22.377 11.882 198 HB2 SER 31 HB2 SER 31 7.465 22.961 14.143 199 HB3 SER 31 HB1 SER 31 5.840 23.567 13.826 200 HG SER 31 HG SER 31 6.553 21.927 15.712 201 H PHE 32 HN PHE 32 5.405 19.668 11.850 202 HA PHE 32 HA PHE 32 6.332 17.728 13.538 203 HB2 PHE 32 HB2 PHE 32 6.106 17.675 10.526 204 HB3 PHE 32 HB1 PHE 32 6.559 16.239 11.445 205 HD1 PHE 32 HD2 PHE 32 5.005 15.716 13.533 206 HD2 PHE 32 HD1 PHE 32 3.835 18.089 10.148 207 HE1 PHE 32 HE2 PHE 32 2.620 15.289 14.057 208 HE2 PHE 32 HE1 PHE 32 1.450 17.658 10.671 209 HZ PHE 32 HZ PHE 32 0.843 16.256 12.625 210 H SER 33 HN SER 33 8.374 18.128 14.443 211 HA SER 33 HA SER 33 10.728 18.789 12.995 212 HB2 SER 33 HB1 SER 33 10.532 17.197 15.570 213 HB3 SER 33 HB2 SER 33 11.947 18.076 14.992 214 HG SER 33 HG SER 33 9.423 19.192 15.641 215 H GLN 34 HN GLN 34 12.619 17.335 12.634 216 HA GLN 34 HA GLN 34 12.020 15.143 10.979 217 HB2 GLN 34 HB1 GLN 34 14.531 15.563 12.630 218 HB3 GLN 34 HB2 GLN 34 14.387 14.514 11.219 219 HG2 GLN 34 HG2 GLN 34 13.843 16.446 9.809 220 HG3 GLN 34 HG1 GLN 34 13.907 17.511 11.214 221 HE21 GLN 34 HE21 GLN 34 15.642 17.923 8.977 222 HE22 GLN 34 HE22 GLN 34 17.235 17.615 9.478 223 H ASP 35 HN ASP 35 12.850 15.155 14.449 224 HA ASP 35 HA ASP 35 12.862 12.355 14.859 225 HB2 ASP 35 HB2 ASP 35 12.021 14.621 16.687 226 HB3 ASP 35 HB1 ASP 35 12.154 12.946 17.225 227 H GLN 36 HN GLN 36 10.146 14.658 14.845 228 HA GLN 36 HA GLN 36 8.165 12.649 15.509 229 HB2 GLN 36 HB1 GLN 36 7.765 15.310 14.109 230 HB3 GLN 36 HB2 GLN 36 6.528 14.359 14.932 231 HG2 GLN 36 HG2 GLN 36 9.009 15.387 16.330 232 HG3 GLN 36 HG1 GLN 36 7.496 16.292 16.281 233 HE21 GLN 36 HE21 GLN 36 9.142 14.404 18.356 234 HE22 GLN 36 HE22 GLN 36 7.870 13.590 19.128 235 H MET 37 HN MET 37 9.599 13.868 12.544 236 HA MET 37 HA MET 37 7.689 12.802 10.703 237 HB2 MET 37 HB2 MET 37 10.667 13.298 10.406 238 HB3 MET 37 HB1 MET 37 9.593 12.891 9.066 239 HG2 MET 37 HG2 MET 37 8.204 14.893 9.631 240 HG3 MET 37 HG1 MET 37 9.381 15.320 10.874 241 HE1 MET 37 HE1 MET 37 10.041 17.797 9.700 242 HE2 MET 37 HE2 MET 37 8.513 17.238 9.023 243 HE3 MET 37 HE3 MET 37 9.761 17.874 7.955 244 H GLU 38 HN GLU 38 10.407 11.358 12.422 245 HA GLU 38 HA GLU 38 10.672 8.961 10.931 246 HB2 GLU 38 HB1 GLU 38 12.148 9.733 12.847 247 HB3 GLU 38 HB2 GLU 38 10.885 9.175 13.946 248 HG2 GLU 38 HG2 GLU 38 11.057 6.906 13.026 249 HG3 GLU 38 HG1 GLU 38 12.275 7.450 11.872 250 H ASN 39 HN ASN 39 8.592 9.646 13.762 251 HA ASN 39 HA ASN 39 7.303 7.116 13.839 252 HB2 ASN 39 HB2 ASN 39 6.187 9.843 14.562 253 HB3 ASN 39 HB1 ASN 39 5.486 8.298 15.044 254 HD21 ASN 39 HD21 ASN 39 6.504 10.293 16.925 255 HD22 ASN 39 HD22 ASN 39 7.852 9.627 17.713 256 H MET 40 HN MET 40 6.467 10.091 12.087 257 HA MET 40 HA MET 40 4.047 9.177 10.916 258 HB2 MET 40 HB2 MET 40 6.110 11.048 9.710 259 HB3 MET 40 HB1 MET 40 4.423 10.913 9.215 260 HG2 MET 40 HG2 MET 40 3.720 11.588 11.498 261 HG3 MET 40 HG1 MET 40 5.414 11.769 11.953 262 HE1 MET 40 HE1 MET 40 2.604 14.139 9.508 263 HE2 MET 40 HE2 MET 40 2.774 12.387 9.593 264 HE3 MET 40 HE3 MET 40 3.617 13.287 8.333 265 H SER 41 HN SER 41 7.416 8.756 9.940 266 HA SER 41 HA SER 41 6.809 7.485 7.416 267 HB2 SER 41 HB2 SER 41 9.149 6.915 7.345 268 HB3 SER 41 HB1 SER 41 9.032 8.524 8.056 269 HG SER 41 HG SER 41 9.261 6.078 9.472 270 H LEU 42 HN LEU 42 6.917 6.415 10.724 271 HA LEU 42 HA LEU 42 7.097 3.570 10.021 272 HB2 LEU 42 HB2 LEU 42 8.046 4.367 12.146 273 HB3 LEU 42 HB1 LEU 42 6.457 4.942 12.652 274 HG LEU 42 HG LEU 42 5.586 2.635 12.536 275 HD11 LEU 42 HD21 LEU 42 8.336 2.150 11.452 276 HD12 LEU 42 HD22 LEU 42 6.793 1.477 10.927 277 HD13 LEU 42 HD23 LEU 42 7.564 0.874 12.393 278 HD21 LEU 42 HD11 LEU 42 6.394 3.261 14.692 279 HD22 LEU 42 HD12 LEU 42 8.077 3.113 14.184 280 HD23 LEU 42 HD13 LEU 42 7.084 1.668 14.379 281 H ILE 43 HN ILE 43 4.635 5.961 10.413 282 HA ILE 43 HA ILE 43 2.563 3.804 10.291 283 HB ILE 43 HB ILE 43 2.475 6.537 11.594 284 HG12 ILE 43 HG12 ILE 43 3.463 4.780 12.967 285 HG13 ILE 43 HG11 ILE 43 1.855 5.160 13.586 286 HG21 ILE 43 HG21 ILE 43 0.275 6.586 11.088 287 HG22 ILE 43 HG22 ILE 43 0.085 5.175 12.128 288 HG23 ILE 43 HG23 ILE 43 0.339 4.965 10.397 289 HD11 ILE 43 HD11 ILE 43 2.746 2.756 12.001 290 HD12 ILE 43 HD12 ILE 43 1.051 3.243 12.017 291 HD13 ILE 43 HD13 ILE 43 1.856 2.806 13.524 292 H GLY 44 HN GLY 44 0.839 4.151 8.803 293 HA2 GLY 44 HA1 GLY 44 -0.331 5.492 7.135 294 HA3 GLY 44 HA2 GLY 44 1.103 6.512 7.003 295 H ASN 45 HN ASN 45 3.043 5.510 6.009 296 HA ASN 45 HA ASN 45 2.388 4.037 3.624 297 HB2 ASN 45 HB2 ASN 45 4.959 3.733 3.550 298 HB3 ASN 45 HB1 ASN 45 4.341 5.383 3.489 299 HD21 ASN 45 HD21 ASN 45 6.129 6.404 4.556 300 HD22 ASN 45 HD22 ASN 45 6.569 6.062 6.159 301 H THR 46 HN THR 46 3.616 3.151 6.812 302 HA THR 46 HA THR 46 4.259 0.426 6.242 303 HB THR 46 HB THR 46 3.204 1.587 8.840 304 HG1 THR 46 HG1 THR 46 5.232 2.413 7.640 305 HG21 THR 46 HG21 THR 46 4.658 -0.946 8.094 306 HG22 THR 46 HG22 THR 46 3.184 -0.766 9.043 307 HG23 THR 46 HG23 THR 46 4.738 -0.293 9.730 308 H LEU 47 HN LEU 47 1.256 2.080 7.041 309 HA LEU 47 HA LEU 47 -0.378 -0.209 7.505 310 HB2 LEU 47 HB2 LEU 47 -1.079 2.125 7.994 311 HB3 LEU 47 HB1 LEU 47 -1.158 2.447 6.261 312 HG LEU 47 HG LEU 47 -2.804 0.518 6.091 313 HD11 LEU 47 HD11 LEU 47 -2.199 0.503 8.981 314 HD12 LEU 47 HD12 LEU 47 -2.803 -0.795 7.952 315 HD13 LEU 47 HD13 LEU 47 -3.917 0.414 8.592 316 HD21 LEU 47 HD21 LEU 47 -4.345 2.181 7.824 317 HD22 LEU 47 HD22 LEU 47 -4.279 2.217 6.062 318 HD23 LEU 47 HD23 LEU 47 -3.167 3.207 7.005 319 H MET 48 HN MET 48 0.668 1.397 4.534 320 HA MET 48 HA MET 48 -1.086 0.210 2.681 321 HB2 MET 48 HB2 MET 48 1.880 0.775 2.374 322 HB3 MET 48 HB1 MET 48 0.781 0.428 1.040 323 HG2 MET 48 HG2 MET 48 -0.610 2.392 1.756 324 HG3 MET 48 HG1 MET 48 0.625 2.775 2.955 325 HE1 MET 48 HE1 MET 48 1.824 5.202 1.954 326 HE2 MET 48 HE2 MET 48 0.097 4.888 1.799 327 HE3 MET 48 HE3 MET 48 0.995 5.531 0.427 328 H ALA 49 HN ALA 49 1.799 -1.140 4.237 329 HA ALA 49 HA ALA 49 1.948 -3.550 2.714 330 HB1 ALA 49 HB1 ALA 49 2.662 -4.104 5.420 331 HB2 ALA 49 HB2 ALA 49 3.186 -2.459 5.059 332 HB3 ALA 49 HB3 ALA 49 3.739 -3.800 4.056 333 H ALA 50 HN ALA 50 -0.076 -2.570 5.414 334 HA ALA 50 HA ALA 50 -1.093 -5.202 6.027 335 HB1 ALA 50 HB1 ALA 50 -2.997 -3.832 7.071 336 HB2 ALA 50 HB2 ALA 50 -2.104 -2.400 6.555 337 HB3 ALA 50 HB3 ALA 50 -1.380 -3.527 7.703 338 H MET 51 HN MET 51 -2.393 -2.476 4.116 339 HA MET 51 HA MET 51 -4.745 -3.813 3.220 340 HB2 MET 51 HB2 MET 51 -3.173 -1.762 1.638 341 HB3 MET 51 HB1 MET 51 -4.906 -2.081 1.559 342 HG2 MET 51 HG1 MET 51 -5.056 -1.401 3.985 343 HG3 MET 51 HG2 MET 51 -3.368 -0.897 3.888 344 HE1 MET 51 HE1 MET 51 -2.689 0.253 1.501 345 HE2 MET 51 HE2 MET 51 -2.556 1.354 2.870 346 HE3 MET 51 HE3 MET 51 -3.275 1.916 1.363 347 H ASP 52 HN ASP 52 -1.407 -3.942 2.137 348 HA ASP 52 HA ASP 52 -1.843 -5.128 -0.425 349 HB2 ASP 52 HB2 ASP 52 0.456 -5.327 1.536 350 HB3 ASP 52 HB1 ASP 52 0.499 -6.066 -0.065 351 H ASN 53 HN ASN 53 -1.963 -6.422 2.819 352 HA ASN 53 HA ASN 53 -1.688 -9.197 2.182 353 HB2 ASN 53 HB2 ASN 53 -3.209 -7.806 4.406 354 HB3 ASN 53 HB1 ASN 53 -2.961 -9.550 4.327 355 HD21 ASN 53 HD21 ASN 53 -1.883 -7.914 6.461 356 HD22 ASN 53 HD22 ASN 53 -0.189 -7.952 6.340 357 H MET 54 HN MET 54 -4.403 -6.969 1.998 358 HA MET 54 HA MET 54 -6.566 -8.735 1.791 359 HB2 MET 54 HB2 MET 54 -6.033 -6.213 0.192 360 HB3 MET 54 HB1 MET 54 -7.593 -7.028 0.278 361 HG2 MET 54 HG2 MET 54 -6.056 -5.843 2.610 362 HG3 MET 54 HG1 MET 54 -7.538 -5.200 1.903 363 HE1 MET 54 HE1 MET 54 -9.718 -6.175 1.904 364 HE2 MET 54 HE2 MET 54 -10.279 -7.611 2.759 365 HE3 MET 54 HE3 MET 54 -9.305 -7.785 1.301 366 H GLY 55 HN GLY 55 -4.368 -7.681 -0.826 367 HA2 GLY 55 HA2 GLY 55 -3.583 -9.289 -2.498 368 HA3 GLY 55 HA1 GLY 55 -5.079 -10.194 -2.266 369 H GLY 56 HN GLY 56 -5.473 -6.792 -2.356 370 HA2 GLY 56 HA2 GLY 56 -5.824 -5.397 -4.338 371 HA3 GLY 56 HA1 GLY 56 -6.124 -6.867 -5.265 372 H ARG 57 HN ARG 57 -7.622 -7.216 -2.308 373 HA ARG 57 HA ARG 57 -10.195 -6.150 -3.403 374 HB2 ARG 57 HB2 ARG 57 -11.339 -8.013 -2.370 375 HB3 ARG 57 HB1 ARG 57 -10.008 -8.666 -3.322 376 HG2 ARG 57 HG2 ARG 57 -8.641 -8.498 -1.117 377 HG3 ARG 57 HG1 ARG 57 -10.214 -8.368 -0.330 378 HD2 ARG 57 HD2 ARG 57 -10.908 -10.488 -1.442 379 HD3 ARG 57 HD1 ARG 57 -9.289 -10.629 -2.127 380 HE ARG 57 HE ARG 57 -8.430 -11.077 0.087 381 HH11 ARG 57 HH21 ARG 57 -10.103 -9.409 1.813 382 HH12 ARG 57 HH22 ARG 57 -11.181 -10.546 2.551 383 HH21 ARG 57 HH11 ARG 57 -10.565 -13.043 0.225 384 HH22 ARG 57 HH12 ARG 57 -11.441 -12.604 1.653 385 H ILE 58 HN ILE 58 -10.731 -4.370 -2.222 386 HA ILE 58 HA ILE 58 -10.199 -4.470 0.720 387 HB ILE 58 HB ILE 58 -10.551 -1.958 -0.929 388 HG12 ILE 58 HG12 ILE 58 -8.595 -3.385 -1.690 389 HG13 ILE 58 HG11 ILE 58 -8.151 -1.790 -1.082 390 HG21 ILE 58 HG21 ILE 58 -9.328 -2.530 1.789 391 HG22 ILE 58 HG22 ILE 58 -10.887 -1.757 1.504 392 HG23 ILE 58 HG23 ILE 58 -9.398 -0.945 1.019 393 HD11 ILE 58 HD11 ILE 58 -8.285 -3.653 1.112 394 HD12 ILE 58 HD12 ILE 58 -6.900 -2.719 0.542 395 HD13 ILE 58 HD13 ILE 58 -7.237 -4.306 -0.149 396 H THR 59 HN THR 59 -11.838 -3.342 2.055 397 HA THR 59 HA THR 59 -14.537 -3.441 0.760 398 HB THR 59 HB THR 59 -15.435 -4.153 2.934 399 HG1 THR 59 HG1 THR 59 -13.717 -4.773 4.493 400 HG21 THR 59 HG21 THR 59 -15.020 -6.249 2.243 401 HG22 THR 59 HG22 THR 59 -13.403 -6.161 2.941 402 HG23 THR 59 HG23 THR 59 -13.671 -5.659 1.272 403 HA PRO 60 HA PRO 60 -15.202 0.753 2.012 404 HB2 PRO 60 HB2 PRO 60 -17.842 0.735 2.585 405 HB3 PRO 60 HB1 PRO 60 -17.218 0.647 0.936 406 HG2 PRO 60 HG2 PRO 60 -18.208 -1.551 2.710 407 HG3 PRO 60 HG1 PRO 60 -18.509 -1.290 0.990 408 HD2 PRO 60 HD2 PRO 60 -16.684 -3.081 1.884 409 HD3 PRO 60 HD1 PRO 60 -16.483 -2.207 0.364 410 H SER 61 HN SER 61 -16.633 -1.684 4.195 411 HA SER 61 HA SER 61 -16.736 0.149 6.447 412 HB2 SER 61 HB2 SER 61 -17.412 -1.764 7.742 413 HB3 SER 61 HB1 SER 61 -18.182 -1.917 6.162 414 HG SER 61 HG SER 61 -17.268 -3.812 6.222 415 H LYS 62 HN LYS 62 -14.430 -2.246 5.248 416 HA LYS 62 HA LYS 62 -12.746 -2.246 7.587 417 HB2 LYS 62 HB2 LYS 62 -12.595 -4.019 5.891 418 HB3 LYS 62 HB1 LYS 62 -12.068 -2.841 4.689 419 HG2 LYS 62 HG2 LYS 62 -10.086 -2.326 6.100 420 HG3 LYS 62 HG1 LYS 62 -10.600 -3.567 7.243 421 HD2 LYS 62 HD2 LYS 62 -10.559 -5.203 5.289 422 HD3 LYS 62 HD1 LYS 62 -9.746 -3.943 4.362 423 HE2 LYS 62 HE2 LYS 62 -7.868 -4.934 5.221 424 HE3 LYS 62 HE1 LYS 62 -8.234 -3.906 6.607 425 HZ1 LYS 62 HZ1 LYS 62 -8.182 -5.863 7.687 426 HZ2 LYS 62 HZ2 LYS 62 -8.521 -6.779 6.297 427 HZ3 LYS 62 HZ3 LYS 62 -9.778 -5.999 7.132 428 H LEU 63 HN LEU 63 -12.511 -0.505 4.467 429 HA LEU 63 HA LEU 63 -10.187 1.002 5.163 430 HB2 LEU 63 HB2 LEU 63 -12.381 1.296 3.149 431 HB3 LEU 63 HB1 LEU 63 -11.309 2.667 3.434 432 HG LEU 63 HG LEU 63 -10.186 -0.086 2.969 433 HD11 LEU 63 HD11 LEU 63 -11.223 -0.006 0.937 434 HD12 LEU 63 HD12 LEU 63 -9.917 1.114 0.548 435 HD13 LEU 63 HD13 LEU 63 -11.495 1.732 1.038 436 HD21 LEU 63 HD21 LEU 63 -8.249 1.033 3.174 437 HD22 LEU 63 HD22 LEU 63 -9.146 2.522 3.475 438 HD23 LEU 63 HD23 LEU 63 -8.705 2.075 1.826 439 H GLN 64 HN GLN 64 -13.606 1.476 5.848 440 HA GLN 64 HA GLN 64 -13.597 4.193 6.601 441 HB2 GLN 64 HB2 GLN 64 -15.607 2.645 6.553 442 HB3 GLN 64 HB1 GLN 64 -15.053 1.988 8.092 443 HG2 GLN 64 HG2 GLN 64 -15.192 4.213 9.117 444 HG3 GLN 64 HG1 GLN 64 -15.678 4.912 7.573 445 HE21 GLN 64 HE21 GLN 64 -17.468 5.277 9.635 446 HE22 GLN 64 HE22 GLN 64 -18.812 4.255 9.459 447 H ALA 65 HN ALA 65 -12.723 1.310 8.512 448 HA ALA 65 HA ALA 65 -11.958 2.857 10.848 449 HB1 ALA 65 HB1 ALA 65 -10.557 0.371 10.782 450 HB2 ALA 65 HB2 ALA 65 -12.174 0.082 10.141 451 HB3 ALA 65 HB3 ALA 65 -11.974 0.786 11.746 452 H LEU 66 HN LEU 66 -10.407 1.771 7.907 453 HA LEU 66 HA LEU 66 -7.682 2.245 8.749 454 HB2 LEU 66 HB2 LEU 66 -8.303 0.825 6.791 455 HB3 LEU 66 HB1 LEU 66 -8.852 2.273 5.948 456 HG LEU 66 HG LEU 66 -6.057 2.089 7.071 457 HD11 LEU 66 HD11 LEU 66 -6.442 1.588 4.181 458 HD12 LEU 66 HD12 LEU 66 -6.963 0.277 5.239 459 HD13 LEU 66 HD13 LEU 66 -5.297 0.855 5.306 460 HD21 LEU 66 HD21 LEU 66 -7.640 3.951 5.454 461 HD22 LEU 66 HD22 LEU 66 -6.093 3.547 4.709 462 HD23 LEU 66 HD23 LEU 66 -6.136 4.230 6.335 463 H ASP 67 HN ASP 67 -9.923 4.139 6.682 464 HA ASP 67 HA ASP 67 -8.344 6.402 6.266 465 HB2 ASP 67 HB1 ASP 67 -10.796 5.891 5.529 466 HB3 ASP 67 HB2 ASP 67 -11.243 6.709 7.025 467 H MET 68 HN MET 68 -10.424 5.732 9.097 468 HA MET 68 HA MET 68 -9.648 8.157 10.477 469 HB2 MET 68 HB2 MET 68 -10.879 5.594 11.534 470 HB3 MET 68 HB1 MET 68 -10.750 7.105 12.434 471 HG2 MET 68 HG2 MET 68 -12.113 8.243 10.717 472 HG3 MET 68 HG1 MET 68 -12.240 6.732 9.816 473 HE1 MET 68 HE1 MET 68 -12.388 8.413 12.988 474 HE2 MET 68 HE2 MET 68 -12.937 7.147 14.084 475 HE3 MET 68 HE3 MET 68 -14.089 8.331 13.470 476 H ALA 69 HN ALA 69 -8.523 4.786 10.562 477 HA ALA 69 HA ALA 69 -6.832 4.946 12.820 478 HB1 ALA 69 HB1 ALA 69 -5.777 3.467 10.467 479 HB2 ALA 69 HB2 ALA 69 -7.381 2.994 11.026 480 HB3 ALA 69 HB3 ALA 69 -6.007 2.922 12.129 481 H PHE 70 HN PHE 70 -6.057 5.665 9.403 482 HA PHE 70 HA PHE 70 -3.361 6.445 9.816 483 HB2 PHE 70 HB1 PHE 70 -4.155 6.135 7.569 484 HB3 PHE 70 HB2 PHE 70 -5.420 7.345 7.787 485 HD1 PHE 70 HD1 PHE 70 -1.696 6.950 7.920 486 HD2 PHE 70 HD2 PHE 70 -5.018 9.568 7.167 487 HE1 PHE 70 HE1 PHE 70 -0.131 8.719 7.165 488 HE2 PHE 70 HE2 PHE 70 -3.452 11.338 6.413 489 HZ PHE 70 HZ PHE 70 -1.009 10.913 6.411 490 H ALA 71 HN ALA 71 -6.381 8.282 10.116 491 HA ALA 71 HA ALA 71 -5.091 10.825 10.583 492 HB1 ALA 71 HB1 ALA 71 -7.434 11.282 11.694 493 HB2 ALA 71 HB2 ALA 71 -7.861 9.730 10.973 494 HB3 ALA 71 HB3 ALA 71 -7.325 11.061 9.948 495 H SER 72 HN SER 72 -6.169 8.180 12.671 496 HA SER 72 HA SER 72 -5.800 9.590 15.155 497 HB2 SER 72 HB2 SER 72 -7.125 7.475 14.894 498 HB3 SER 72 HB1 SER 72 -5.609 6.604 14.667 499 HG SER 72 HG SER 72 -6.070 8.255 16.907 500 H SER 73 HN SER 73 -3.646 7.637 13.125 501 HA SER 73 HA SER 73 -1.486 7.559 15.042 502 HB2 SER 73 HB2 SER 73 -1.314 7.347 12.024 503 HB3 SER 73 HB1 SER 73 -0.123 6.772 13.190 504 HG SER 73 HG SER 73 -1.748 5.365 14.005 505 H VAL 74 HN VAL 74 -2.228 9.671 12.281 506 HA VAL 74 HA VAL 74 0.149 11.277 12.546 507 HB VAL 74 HB VAL 74 -0.908 12.790 10.998 508 HG11 VAL 74 HG21 VAL 74 -0.738 10.005 10.576 509 HG12 VAL 74 HG22 VAL 74 -0.756 11.267 9.345 510 HG13 VAL 74 HG23 VAL 74 -2.265 10.508 9.851 511 HG21 VAL 74 HG11 VAL 74 -3.512 11.345 11.564 512 HG22 VAL 74 HG12 VAL 74 -3.287 12.753 10.529 513 HG23 VAL 74 HG13 VAL 74 -3.077 12.899 12.274 514 H ALA 75 HN ALA 75 -3.098 11.474 13.937 515 HA ALA 75 HA ALA 75 -2.823 14.099 15.063 516 HB1 ALA 75 HB1 ALA 75 -4.720 13.491 16.470 517 HB2 ALA 75 HB2 ALA 75 -4.468 11.780 16.123 518 HB3 ALA 75 HB3 ALA 75 -4.993 12.873 14.841 519 H GLN 76 HN GLN 76 -2.041 10.860 16.302 520 HA GLN 76 HA GLN 76 -1.274 11.776 18.931 521 HB2 GLN 76 HB1 GLN 76 -1.853 9.395 18.323 522 HB3 GLN 76 HB2 GLN 76 -0.303 9.293 17.489 523 HG2 GLN 76 HG2 GLN 76 0.881 9.804 19.574 524 HG3 GLN 76 HG1 GLN 76 -0.655 9.992 20.420 525 HE21 GLN 76 HE21 GLN 76 1.003 8.073 21.476 526 HE22 GLN 76 HE22 GLN 76 0.465 6.513 21.077 527 H ILE 77 HN ILE 77 0.579 11.031 15.971 528 HA ILE 77 HA ILE 77 3.165 11.508 17.008 529 HB ILE 77 HB ILE 77 2.077 12.052 14.232 530 HG12 ILE 77 HG11 ILE 77 3.741 9.723 15.208 531 HG13 ILE 77 HG12 ILE 77 1.979 9.686 15.197 532 HG21 ILE 77 HG21 ILE 77 4.875 11.411 14.310 533 HG22 ILE 77 HG22 ILE 77 4.575 12.772 15.390 534 HG23 ILE 77 HG23 ILE 77 4.102 12.872 13.694 535 HD11 ILE 77 HD11 ILE 77 2.601 10.630 12.666 536 HD12 ILE 77 HD12 ILE 77 2.164 8.967 13.057 537 HD13 ILE 77 HD13 ILE 77 3.863 9.433 12.965 538 H ALA 78 HN ALA 78 0.874 13.789 15.526 539 HA ALA 78 HA ALA 78 2.576 16.091 15.823 540 HB1 ALA 78 HB1 ALA 78 -0.262 16.716 15.948 541 HB2 ALA 78 HB2 ALA 78 0.081 15.553 14.668 542 HB3 ALA 78 HB3 ALA 78 0.912 17.109 14.691 543 H ALA 79 HN ALA 79 -0.227 14.961 17.749 544 HA ALA 79 HA ALA 79 -0.070 16.959 19.756 545 HB1 ALA 79 HB1 ALA 79 -2.001 15.738 20.020 546 HB2 ALA 79 HB2 ALA 79 -0.998 14.878 21.188 547 HB3 ALA 79 HB3 ALA 79 -1.224 14.220 19.568 548 H SER 80 HN SER 80 1.903 14.150 19.176 549 HA SER 80 HA SER 80 3.043 14.048 21.855 550 HB2 SER 80 HB2 SER 80 4.095 12.913 19.244 551 HB3 SER 80 HB1 SER 80 4.660 12.484 20.859 552 HG SER 80 HG SER 80 1.950 12.253 20.120 553 H GLN 81 HN GLN 81 3.583 15.931 19.009 554 HA GLN 81 HA GLN 81 6.303 16.592 19.179 555 HB2 GLN 81 HB2 GLN 81 3.980 18.442 18.556 556 HB3 GLN 81 HB1 GLN 81 5.672 18.777 18.186 557 HG2 GLN 81 HG1 GLN 81 5.728 16.677 16.817 558 HG3 GLN 81 HG2 GLN 81 3.996 16.496 17.095 559 HE21 GLN 81 HE21 GLN 81 2.548 18.027 16.034 560 HE22 GLN 81 HE22 GLN 81 3.092 19.079 14.818 561 H GLY 82 HN GLY 82 3.630 17.628 21.217 562 HA2 GLY 82 HA2 GLY 82 3.797 18.489 23.425 563 HA3 GLY 82 HA1 GLY 82 5.545 18.600 23.219 564 H GLY 83 HN GLY 83 3.904 19.939 20.581 565 HA2 GLY 83 HA1 GLY 83 4.465 22.674 21.622 566 HA3 GLY 83 HA2 GLY 83 4.359 22.243 19.916 567 H ASP 84 HN ASP 84 2.791 24.064 19.795 568 HA ASP 84 HA ASP 84 0.284 23.949 21.220 569 HB2 ASP 84 HB2 ASP 84 1.234 26.018 20.149 570 HB3 ASP 84 HB1 ASP 84 0.856 25.317 18.575 571 H LEU 85 HN LEU 85 -0.847 22.040 20.956 572 HA LEU 85 HA LEU 85 -0.964 20.417 18.664 573 HB2 LEU 85 HB1 LEU 85 -1.900 19.848 20.930 574 HB3 LEU 85 HB2 LEU 85 -3.265 20.907 20.575 575 HG LEU 85 HG LEU 85 -3.876 19.554 18.649 576 HD11 LEU 85 HD21 LEU 85 -2.112 18.596 17.587 577 HD12 LEU 85 HD22 LEU 85 -2.349 17.266 18.721 578 HD13 LEU 85 HD23 LEU 85 -1.152 18.516 19.064 579 HD21 LEU 85 HD11 LEU 85 -3.985 18.694 21.309 580 HD22 LEU 85 HD12 LEU 85 -3.436 17.278 20.413 581 HD23 LEU 85 HD13 LEU 85 -4.948 18.069 19.970 582 H GLY 86 HN GLY 86 -2.392 23.518 19.212 583 HA2 GLY 86 HA2 GLY 86 -4.594 23.374 17.401 584 HA3 GLY 86 HA1 GLY 86 -3.753 24.858 17.848 585 H VAL 87 HN VAL 87 -1.148 23.938 16.886 586 HA VAL 87 HA VAL 87 -1.389 24.768 14.133 587 HB VAL 87 HB VAL 87 0.630 25.077 15.671 588 HG11 VAL 87 HG11 VAL 87 1.476 22.358 14.712 589 HG12 VAL 87 HG12 VAL 87 0.532 22.504 16.194 590 HG13 VAL 87 HG13 VAL 87 2.098 23.303 16.065 591 HG21 VAL 87 HG21 VAL 87 2.246 24.510 13.707 592 HG22 VAL 87 HG22 VAL 87 0.967 25.693 13.426 593 HG23 VAL 87 HG23 VAL 87 0.780 24.037 12.847 594 H THR 88 HN THR 88 -1.038 21.611 15.717 595 HA THR 88 HA THR 88 -0.420 20.028 13.480 596 HB THR 88 HB THR 88 -2.326 19.376 15.751 597 HG1 THR 88 HG1 THR 88 0.449 19.190 15.348 598 HG21 THR 88 HG21 THR 88 -0.861 17.529 13.846 599 HG22 THR 88 HG22 THR 88 -2.580 17.914 13.744 600 HG23 THR 88 HG23 THR 88 -1.951 17.045 15.145 601 H THR 89 HN THR 89 -3.445 21.565 14.392 602 HA THR 89 HA THR 89 -5.191 20.201 12.605 603 HB THR 89 HB THR 89 -5.287 23.147 13.336 604 HG1 THR 89 HG1 THR 89 -6.797 22.165 14.958 605 HG21 THR 89 HG21 THR 89 -7.625 22.998 12.858 606 HG22 THR 89 HG22 THR 89 -7.554 21.240 12.732 607 HG23 THR 89 HG23 THR 89 -6.798 22.244 11.495 608 H ASN 90 HN ASN 90 -3.147 23.082 12.143 609 HA ASN 90 HA ASN 90 -3.849 23.410 9.357 610 HB2 ASN 90 HB1 ASN 90 -1.412 24.379 10.882 611 HB3 ASN 90 HB2 ASN 90 -1.911 24.942 9.287 612 HD21 ASN 90 HD21 ASN 90 -4.757 25.046 9.767 613 HD22 ASN 90 HD22 ASN 90 -5.056 26.275 10.899 614 H ALA 91 HN ALA 91 -1.245 21.753 11.095 615 HA ALA 91 HA ALA 91 0.260 21.025 8.746 616 HB1 ALA 91 HB1 ALA 91 0.710 20.877 11.443 617 HB2 ALA 91 HB2 ALA 91 1.686 20.049 10.229 618 HB3 ALA 91 HB3 ALA 91 0.386 19.188 11.053 619 H ILE 92 HN ILE 92 -1.829 19.022 10.858 620 HA ILE 92 HA ILE 92 -1.902 16.777 9.104 621 HB ILE 92 HB ILE 92 -4.025 17.676 11.076 622 HG12 ILE 92 HG12 ILE 92 -1.716 17.495 12.036 623 HG13 ILE 92 HG11 ILE 92 -2.842 16.318 12.710 624 HG21 ILE 92 HG21 ILE 92 -3.648 14.832 10.840 625 HG22 ILE 92 HG22 ILE 92 -3.939 15.516 9.241 626 HG23 ILE 92 HG23 ILE 92 -5.105 15.777 10.537 627 HD11 ILE 92 HD11 ILE 92 -0.856 15.790 10.478 628 HD12 ILE 92 HD12 ILE 92 -1.993 14.612 11.134 629 HD13 ILE 92 HD13 ILE 92 -0.695 15.245 12.147 630 H ALA 93 HN ALA 93 -4.147 19.527 9.455 631 HA ALA 93 HA ALA 93 -5.989 18.637 7.443 632 HB1 ALA 93 HB1 ALA 93 -5.386 21.467 8.354 633 HB2 ALA 93 HB2 ALA 93 -6.548 20.377 9.111 634 HB3 ALA 93 HB3 ALA 93 -6.820 20.952 7.467 635 H ASP 94 HN ASP 94 -3.296 20.991 7.270 636 HA ASP 94 HA ASP 94 -3.573 21.682 4.551 637 HB2 ASP 94 HB1 ASP 94 -1.155 21.487 6.344 638 HB3 ASP 94 HB2 ASP 94 -1.024 22.026 4.671 639 H ALA 95 HN ALA 95 -1.698 18.983 5.967 640 HA ALA 95 HA ALA 95 -0.768 18.019 3.414 641 HB1 ALA 95 HB1 ALA 95 0.366 16.510 4.669 642 HB2 ALA 95 HB2 ALA 95 -1.096 15.982 5.503 643 HB3 ALA 95 HB3 ALA 95 -0.231 17.415 6.059 644 H LEU 96 HN LEU 96 -3.568 17.274 5.447 645 HA LEU 96 HA LEU 96 -4.524 15.092 3.819 646 HB2 LEU 96 HB1 LEU 96 -5.182 16.085 6.278 647 HB3 LEU 96 HB2 LEU 96 -6.526 16.681 5.302 648 HG LEU 96 HG LEU 96 -6.055 14.009 4.488 649 HD11 LEU 96 HD11 LEU 96 -6.720 13.209 7.015 650 HD12 LEU 96 HD12 LEU 96 -5.563 14.496 7.361 651 HD13 LEU 96 HD13 LEU 96 -5.086 13.129 6.355 652 HD21 LEU 96 HD21 LEU 96 -8.176 15.642 5.013 653 HD22 LEU 96 HD22 LEU 96 -8.253 14.550 6.396 654 HD23 LEU 96 HD23 LEU 96 -8.321 13.902 4.757 655 H THR 97 HN THR 97 -5.287 18.568 3.953 656 HA THR 97 HA THR 97 -7.370 18.546 2.017 657 HB THR 97 HB THR 97 -5.358 20.736 2.605 658 HG1 THR 97 HG1 THR 97 -6.363 20.596 4.449 659 HG21 THR 97 HG21 THR 97 -7.870 20.587 0.994 660 HG22 THR 97 HG22 THR 97 -6.402 21.518 0.698 661 HG23 THR 97 HG23 THR 97 -7.559 22.060 1.912 662 H SER 98 HN SER 98 -3.874 19.200 1.581 663 HA SER 98 HA SER 98 -3.970 19.497 -1.249 664 HB2 SER 98 HB2 SER 98 -2.005 20.086 0.182 665 HB3 SER 98 HB1 SER 98 -1.692 18.364 0.402 666 HG SER 98 HG SER 98 -0.947 19.920 -1.602 667 H ALA 99 HN ALA 99 -3.769 16.640 0.800 668 HA ALA 99 HA ALA 99 -3.173 14.783 -1.328 669 HB1 ALA 99 HB1 ALA 99 -3.839 14.657 1.530 670 HB2 ALA 99 HB2 ALA 99 -2.746 13.646 0.584 671 HB3 ALA 99 HB3 ALA 99 -4.476 13.299 0.600 672 H PHE 100 HN PHE 100 -6.209 15.771 0.265 673 HA PHE 100 HA PHE 100 -8.019 14.033 -0.943 674 HB2 PHE 100 HB1 PHE 100 -8.127 16.768 0.129 675 HB3 PHE 100 HB2 PHE 100 -9.355 16.443 -1.094 676 HD1 PHE 100 HD2 PHE 100 -10.441 13.964 -0.839 677 HD2 PHE 100 HD1 PHE 100 -8.705 16.298 2.326 678 HE1 PHE 100 HE2 PHE 100 -11.773 12.698 0.828 679 HE2 PHE 100 HE1 PHE 100 -10.037 15.031 3.988 680 HZ PHE 100 HZ PHE 100 -11.568 13.230 3.237 681 H TYR 101 HN TYR 101 -7.041 17.205 -2.269 682 HA TYR 101 HA TYR 101 -8.304 16.753 -4.814 683 HB2 TYR 101 HB2 TYR 101 -5.992 18.632 -4.405 684 HB3 TYR 101 HB1 TYR 101 -7.413 18.834 -5.431 685 HD1 TYR 101 HD1 TYR 101 -9.613 18.095 -3.638 686 HD2 TYR 101 HD2 TYR 101 -6.071 20.389 -2.833 687 HE1 TYR 101 HE1 TYR 101 -10.786 19.254 -1.785 688 HE2 TYR 101 HE2 TYR 101 -7.246 21.551 -0.983 689 HH TYR 101 HH TYR 101 -10.659 21.248 -0.495 690 H GLN 102 HN GLN 102 -5.089 16.112 -3.550 691 HA GLN 102 HA GLN 102 -3.968 15.483 -6.171 692 HB2 GLN 102 HB2 GLN 102 -2.959 14.961 -3.361 693 HB3 GLN 102 HB1 GLN 102 -2.035 14.639 -4.827 694 HG2 GLN 102 HG2 GLN 102 -3.213 17.362 -4.278 695 HG3 GLN 102 HG1 GLN 102 -1.633 16.900 -3.647 696 HE21 GLN 102 HE21 GLN 102 -2.761 18.695 -6.056 697 HE22 GLN 102 HE22 GLN 102 -1.669 18.312 -7.297 698 H THR 103 HN THR 103 -5.824 13.766 -3.806 699 HA THR 103 HA THR 103 -4.973 11.172 -5.006 700 HB THR 103 HB THR 103 -6.035 10.137 -3.030 701 HG1 THR 103 HG1 THR 103 -6.709 11.622 -1.372 702 HG21 THR 103 HG21 THR 103 -4.512 11.980 -1.483 703 HG22 THR 103 HG22 THR 103 -3.735 11.843 -3.060 704 HG23 THR 103 HG23 THR 103 -4.015 10.399 -2.086 705 H THR 104 HN THR 104 -8.056 12.631 -3.817 706 HA THR 104 HA THR 104 -9.369 11.230 -6.116 707 HB THR 104 HB THR 104 -10.545 11.702 -3.365 708 HG1 THR 104 HG1 THR 104 -10.348 9.183 -3.773 709 HG21 THR 104 HG21 THR 104 -11.727 11.127 -5.881 710 HG22 THR 104 HG22 THR 104 -12.506 11.137 -4.297 711 HG23 THR 104 HG23 THR 104 -11.800 9.646 -4.924 712 H GLY 105 HN GLY 105 -9.610 14.023 -3.896 713 HA2 GLY 105 HA2 GLY 105 -10.054 16.250 -4.829 714 HA3 GLY 105 HA1 GLY 105 -10.970 15.478 -6.120 715 H VAL 106 HN VAL 106 -11.102 15.056 -2.573 716 HA VAL 106 HA VAL 106 -14.025 15.651 -2.746 717 HB VAL 106 HB VAL 106 -12.577 14.142 -0.551 718 HG11 VAL 106 HG21 VAL 106 -14.621 14.751 0.358 719 HG12 VAL 106 HG22 VAL 106 -15.083 13.253 -0.450 720 HG13 VAL 106 HG23 VAL 106 -15.420 14.807 -1.213 721 HG21 VAL 106 HG11 VAL 106 -14.300 12.728 -2.522 722 HG22 VAL 106 HG12 VAL 106 -12.852 12.166 -1.687 723 HG23 VAL 106 HG13 VAL 106 -12.706 13.230 -3.086 724 H VAL 107 HN VAL 107 -14.842 16.585 -0.541 725 HA VAL 107 HA VAL 107 -13.450 19.064 -0.078 726 HB VAL 107 HB VAL 107 -15.135 19.394 1.711 727 HG11 VAL 107 HG21 VAL 107 -16.333 20.053 -0.091 728 HG12 VAL 107 HG22 VAL 107 -17.093 18.462 -0.050 729 HG13 VAL 107 HG23 VAL 107 -15.689 18.741 -1.079 730 HG21 VAL 107 HG11 VAL 107 -15.598 17.420 2.782 731 HG22 VAL 107 HG12 VAL 107 -15.369 16.457 1.321 732 HG23 VAL 107 HG13 VAL 107 -16.882 17.327 1.576 733 H ASN 108 HN ASN 108 -11.680 19.325 1.173 734 HA ASN 108 HA ASN 108 -10.667 17.222 2.876 735 HB2 ASN 108 HB1 ASN 108 -8.926 18.865 3.470 736 HB3 ASN 108 HB2 ASN 108 -9.185 18.825 1.727 737 HD21 ASN 108 HD21 ASN 108 -8.555 21.032 4.012 738 HD22 ASN 108 HD22 ASN 108 -9.419 22.352 3.391 739 H SER 109 HN SER 109 -12.763 19.942 3.383 740 HA SER 109 HA SER 109 -12.345 20.273 6.198 741 HB2 SER 109 HB2 SER 109 -13.529 21.904 4.693 742 HB3 SER 109 HB1 SER 109 -14.904 20.800 4.664 743 HG SER 109 HG SER 109 -13.842 21.482 7.145 744 H ARG 110 HN ARG 110 -14.344 18.002 4.368 745 HA ARG 110 HA ARG 110 -16.010 17.218 6.578 746 HB2 ARG 110 HB2 ARG 110 -16.583 16.691 4.242 747 HB3 ARG 110 HB1 ARG 110 -15.182 15.626 4.133 748 HG2 ARG 110 HG2 ARG 110 -16.099 14.176 5.869 749 HG3 ARG 110 HG1 ARG 110 -17.453 15.279 6.115 750 HD2 ARG 110 HD2 ARG 110 -17.978 14.923 3.622 751 HD3 ARG 110 HD1 ARG 110 -16.859 13.561 3.699 752 HE ARG 110 HE ARG 110 -18.380 12.659 5.539 753 HH11 ARG 110 HH11 ARG 110 -19.432 13.352 2.535 754 HH12 ARG 110 HH12 ARG 110 -21.100 13.601 2.932 755 HH21 ARG 110 HH21 ARG 110 -20.549 13.669 6.355 756 HH22 ARG 110 HH22 ARG 110 -21.732 13.781 5.094 757 H PHE 111 HN PHE 111 -13.145 15.561 5.173 758 HA PHE 111 HA PHE 111 -13.020 13.706 7.411 759 HB2 PHE 111 HB2 PHE 111 -12.159 13.390 4.973 760 HB3 PHE 111 HB1 PHE 111 -10.719 14.233 5.545 761 HD1 PHE 111 HD1 PHE 111 -13.047 11.692 7.038 762 HD2 PHE 111 HD2 PHE 111 -9.001 12.741 6.061 763 HE1 PHE 111 HE1 PHE 111 -12.248 9.594 8.093 764 HE2 PHE 111 HE2 PHE 111 -8.200 10.645 7.115 765 HZ PHE 111 HZ PHE 111 -9.824 9.071 8.132 766 H ILE 112 HN ILE 112 -10.997 16.466 6.377 767 HA ILE 112 HA ILE 112 -9.149 16.386 8.509 768 HB ILE 112 HB ILE 112 -10.253 18.799 7.042 769 HG12 ILE 112 HG11 ILE 112 -7.874 16.981 6.574 770 HG13 ILE 112 HG12 ILE 112 -9.250 17.235 5.500 771 HG21 ILE 112 HG21 ILE 112 -7.607 18.554 8.484 772 HG22 ILE 112 HG22 ILE 112 -9.048 19.199 9.270 773 HG23 ILE 112 HG23 ILE 112 -8.373 20.015 7.860 774 HD11 ILE 112 HD11 ILE 112 -8.600 19.569 5.170 775 HD12 ILE 112 HD12 ILE 112 -7.237 18.519 4.781 776 HD13 ILE 112 HD13 ILE 112 -7.273 19.387 6.317 777 H SER 113 HN SER 113 -12.396 17.819 8.384 778 HA SER 113 HA SER 113 -12.268 19.224 10.865 779 HB2 SER 113 HB2 SER 113 -14.517 18.028 9.257 780 HB3 SER 113 HB1 SER 113 -14.832 18.729 10.844 781 HG SER 113 HG SER 113 -13.933 20.665 10.116 782 H GLU 114 HN GLU 114 -13.130 15.855 10.116 783 HA GLU 114 HA GLU 114 -13.825 15.173 12.835 784 HB2 GLU 114 HB2 GLU 114 -14.539 13.838 10.852 785 HB3 GLU 114 HB1 GLU 114 -12.862 13.353 10.606 786 HG2 GLU 114 HG2 GLU 114 -12.850 12.390 12.914 787 HG3 GLU 114 HG1 GLU 114 -14.564 12.782 13.051 788 H ILE 115 HN ILE 115 -10.840 15.011 10.931 789 HA ILE 115 HA ILE 115 -9.298 13.631 12.942 790 HB ILE 115 HB ILE 115 -8.397 15.462 10.696 791 HG12 ILE 115 HG12 ILE 115 -8.627 12.440 10.843 792 HG13 ILE 115 HG11 ILE 115 -9.707 13.503 9.938 793 HG21 ILE 115 HG21 ILE 115 -6.975 13.940 12.786 794 HG22 ILE 115 HG22 ILE 115 -6.412 15.285 11.794 795 HG23 ILE 115 HG23 ILE 115 -6.392 13.643 11.149 796 HD11 ILE 115 HD11 ILE 115 -6.729 13.576 9.478 797 HD12 ILE 115 HD12 ILE 115 -8.023 14.105 8.403 798 HD13 ILE 115 HD13 ILE 115 -7.738 12.383 8.661 799 H ARG 116 HN ARG 116 -9.732 17.063 12.108 800 HA ARG 116 HA ARG 116 -7.882 18.193 13.905 801 HB2 ARG 116 HB2 ARG 116 -8.901 19.710 12.423 802 HB3 ARG 116 HB1 ARG 116 -10.523 19.131 12.796 803 HG2 ARG 116 HG2 ARG 116 -10.516 20.203 14.931 804 HG3 ARG 116 HG1 ARG 116 -8.784 20.522 14.844 805 HD2 ARG 116 HD2 ARG 116 -9.565 22.592 14.187 806 HD3 ARG 116 HD1 ARG 116 -9.529 21.801 12.612 807 HE ARG 116 HE ARG 116 -12.039 21.808 14.231 808 HH11 ARG 116 HH21 ARG 116 -10.420 23.566 11.874 809 HH12 ARG 116 HH22 ARG 116 -11.702 23.522 10.710 810 HH21 ARG 116 HH11 ARG 116 -13.627 21.277 12.520 811 HH22 ARG 116 HH12 ARG 116 -13.518 22.227 11.076 812 H SER 117 HN SER 117 -11.196 17.051 14.493 813 HA SER 117 HA SER 117 -11.243 17.949 17.251 814 HB2 SER 117 HB2 SER 117 -12.918 15.795 15.925 815 HB3 SER 117 HB1 SER 117 -13.290 16.634 17.431 816 HG SER 117 HG SER 117 -12.975 17.882 14.905 817 H LEU 118 HN LEU 118 -10.374 14.934 15.613 818 HA LEU 118 HA LEU 118 -10.157 13.317 17.970 819 HB2 LEU 118 HB1 LEU 118 -8.770 13.125 15.282 820 HB3 LEU 118 HB2 LEU 118 -8.673 11.883 16.532 821 HG LEU 118 HG LEU 118 -11.362 12.882 15.632 822 HD11 LEU 118 HD21 LEU 118 -11.040 12.094 13.546 823 HD12 LEU 118 HD22 LEU 118 -10.803 10.490 14.240 824 HD13 LEU 118 HD23 LEU 118 -9.416 11.543 13.961 825 HD21 LEU 118 HD11 LEU 118 -11.505 11.444 17.494 826 HD22 LEU 118 HD12 LEU 118 -10.210 10.403 16.903 827 HD23 LEU 118 HD13 LEU 118 -11.794 10.366 16.129 828 H ILE 119 HN ILE 119 -7.837 15.415 16.288 829 HA ILE 119 HA ILE 119 -5.533 14.673 17.797 830 HB ILE 119 HB ILE 119 -6.181 17.395 16.624 831 HG12 ILE 119 HG12 ILE 119 -4.679 15.100 15.339 832 HG13 ILE 119 HG11 ILE 119 -6.387 15.419 15.043 833 HG21 ILE 119 HG21 ILE 119 -3.572 16.019 17.339 834 HG22 ILE 119 HG22 ILE 119 -4.257 17.441 18.126 835 HG23 ILE 119 HG23 ILE 119 -3.690 17.544 16.460 836 HD11 ILE 119 HD11 ILE 119 -5.925 17.545 14.067 837 HD12 ILE 119 HD12 ILE 119 -4.736 16.445 13.371 838 HD13 ILE 119 HD13 ILE 119 -4.267 17.542 14.669 839 H GLY 120 HN GLY 120 -8.007 17.172 18.381 840 HA2 GLY 120 HA2 GLY 120 -6.768 18.234 20.746 841 HA3 GLY 120 HA1 GLY 120 -8.465 18.428 20.311 842 H MET 121 HN MET 121 -9.114 15.625 20.213 843 HA MET 121 HA MET 121 -9.683 15.166 22.994 844 HB2 MET 121 HB2 MET 121 -11.062 14.294 21.087 845 HB3 MET 121 HB1 MET 121 -9.766 13.153 20.726 846 HG2 MET 121 HG1 MET 121 -9.968 12.257 23.051 847 HG3 MET 121 HG2 MET 121 -11.341 13.332 23.313 848 HE1 MET 121 HE1 MET 121 -12.985 9.841 23.059 849 HE2 MET 121 HE2 MET 121 -13.037 11.392 23.893 850 HE3 MET 121 HE3 MET 121 -11.550 10.450 23.896 851 H PHE 122 HN PHE 122 -7.197 13.927 20.795 852 HA PHE 122 HA PHE 122 -6.179 11.901 22.544 853 HB2 PHE 122 HB2 PHE 122 -4.772 13.518 20.396 854 HB3 PHE 122 HB1 PHE 122 -4.115 12.070 21.159 855 HD1 PHE 122 HD2 PHE 122 -6.615 10.447 21.433 856 HD2 PHE 122 HD1 PHE 122 -5.140 12.803 18.158 857 HE1 PHE 122 HE2 PHE 122 -7.887 9.032 19.841 858 HE2 PHE 122 HE1 PHE 122 -6.411 11.388 16.567 859 HZ PHE 122 HZ PHE 122 -7.784 9.502 17.408 860 H ALA 123 HN ALA 123 -5.543 15.371 22.282 861 HA ALA 123 HA ALA 123 -3.268 15.384 24.054 862 HB1 ALA 123 HB1 ALA 123 -4.418 17.247 22.429 863 HB2 ALA 123 HB2 ALA 123 -3.262 17.640 23.702 864 HB3 ALA 123 HB3 ALA 123 -4.994 17.791 24.005 865 H GLN 124 HN GLN 124 -6.746 15.496 24.542 866 HA GLN 124 HA GLN 124 -6.643 16.324 27.309 867 HB2 GLN 124 HB1 GLN 124 -8.759 14.854 25.714 868 HB3 GLN 124 HB2 GLN 124 -8.991 15.413 27.371 869 HG2 GLN 124 HG2 GLN 124 -8.517 17.729 26.654 870 HG3 GLN 124 HG1 GLN 124 -8.290 17.169 24.997 871 HE21 GLN 124 HE21 GLN 124 -10.321 19.067 25.572 872 HE22 GLN 124 HE22 GLN 124 -11.835 18.329 25.363 873 H ALA 125 HN ALA 125 -6.486 13.212 25.657 874 HA ALA 125 HA ALA 125 -6.829 11.605 28.033 875 HB1 ALA 125 HB1 ALA 125 -5.513 10.978 25.373 876 HB2 ALA 125 HB2 ALA 125 -7.181 10.627 25.827 877 HB3 ALA 125 HB3 ALA 125 -5.853 9.783 26.625 878 H SER 126 HN SER 126 -4.085 13.178 26.502 879 HA SER 126 HA SER 126 -2.008 11.760 27.872 880 HB2 SER 126 HB1 SER 126 -1.990 14.654 26.965 881 HB3 SER 126 HB2 SER 126 -0.579 13.642 27.275 882 HG SER 126 HG SER 126 -1.761 12.210 25.630 883 H ALA 127 HN ALA 127 -4.053 14.484 28.790 884 HA ALA 127 HA ALA 127 -2.556 15.236 31.131 885 HB1 ALA 127 HB1 ALA 127 -4.044 16.918 30.777 886 HB2 ALA 127 HB2 ALA 127 -5.157 15.920 31.714 887 HB3 ALA 127 HB3 ALA 127 -5.184 15.854 29.952 888 H ASN 128 HN ASN 128 -4.545 12.541 30.418 889 HA ASN 128 HA ASN 128 -5.379 12.029 33.176 890 HB2 ASN 128 HB1 ASN 128 -6.614 11.251 31.080 891 HB3 ASN 128 HB2 ASN 128 -5.335 10.053 30.885 892 HD21 ASN 128 HD21 ASN 128 -7.102 8.404 31.266 893 HD22 ASN 128 HD22 ASN 128 -7.531 8.038 32.867 894 H ASP 129 HN ASP 129 -2.601 11.376 31.215 895 HA ASP 129 HA ASP 129 -1.642 9.043 32.595 896 HB2 ASP 129 HB2 ASP 129 -0.184 11.209 31.052 897 HB3 ASP 129 HB1 ASP 129 0.591 9.743 31.655 898 H VAL 130 HN VAL 130 -1.110 12.529 33.077 899 HA VAL 130 HA VAL 130 0.775 12.258 35.215 900 HB VAL 130 HB VAL 130 0.025 14.606 35.799 901 HG11 VAL 130 HG21 VAL 130 0.739 15.537 33.538 902 HG12 VAL 130 HG22 VAL 130 0.745 13.874 32.950 903 HG13 VAL 130 HG23 VAL 130 1.839 14.355 34.247 904 HG21 VAL 130 HG11 VAL 130 -2.352 14.020 34.844 905 HG22 VAL 130 HG12 VAL 130 -1.642 14.488 33.298 906 HG23 VAL 130 HG13 VAL 130 -1.710 15.648 34.625 907 H TYR 131 HN TYR 131 -2.747 12.204 35.108 908 HA TYR 131 HA TYR 131 -2.983 10.808 37.578 909 HB2 TYR 131 HB2 TYR 131 -3.750 12.499 39.095 910 HB3 TYR 131 HB1 TYR 131 -2.236 13.095 38.417 911 HD1 TYR 131 HD1 TYR 131 -2.261 14.823 36.616 912 HD2 TYR 131 HD2 TYR 131 -5.847 13.577 38.626 913 HE1 TYR 131 HE1 TYR 131 -3.438 16.835 35.766 914 HE2 TYR 131 HE2 TYR 131 -7.023 15.588 37.776 915 HH TYR 131 HH TYR 131 -6.725 17.615 36.804 916 H ALA 132 HN ALA 132 -5.406 10.985 38.372 917 HA ALA 132 HA ALA 132 -7.059 10.597 35.988 918 HB1 ALA 132 HB1 ALA 132 -7.741 9.070 37.565 919 HB2 ALA 132 HB2 ALA 132 -8.831 10.386 38.004 920 HB3 ALA 132 HB3 ALA 132 -7.342 10.132 38.916 921 H SER 133 HN SER 133 -8.186 12.216 35.036 922 HA SER 133 HA SER 133 -8.218 14.894 35.890 923 HB2 SER 133 HB2 SER 133 -10.408 13.538 34.290 924 HB3 SER 133 HB1 SER 133 -9.989 15.251 34.271 925 HG SER 133 HG SER 133 -7.858 14.526 33.559 926 H ALA 134 HN ALA 134 -10.514 12.285 36.606 927 HA ALA 134 HA ALA 134 -12.514 13.841 37.885 928 HB1 ALA 134 HB1 ALA 134 -13.428 11.797 38.118 929 HB2 ALA 134 HB2 ALA 134 -12.176 11.352 39.279 930 HB3 ALA 134 HB3 ALA 134 -11.920 11.077 37.555 931 H GLY 135 HN GLY 135 -9.443 12.555 39.093 932 HA2 GLY 135 HA2 GLY 135 -9.149 14.552 41.090 933 HA3 GLY 135 HA1 GLY 135 -9.846 13.125 41.857 934 H SER 136 HN SER 136 -7.537 13.521 42.924 935 HA SER 136 HA SER 136 -5.588 11.831 41.404 936 HB2 SER 136 HB2 SER 136 -4.868 14.218 41.665 937 HB3 SER 136 HB1 SER 136 -4.932 14.005 43.415 938 HG SER 136 HG SER 136 -3.404 12.369 41.683 939 H GLY 137 HN GLY 137 -4.613 10.155 42.561 940 HA2 GLY 137 HA2 GLY 137 -4.270 9.769 45.258 941 HA3 GLY 137 HA1 GLY 137 -5.965 9.341 45.022 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 -16.770 11.885 -8.063 2 H2 GLY 1 HT2 GLY 1 -15.145 11.690 -7.605 3 H3 GLY 1 HT3 GLY 1 -16.388 11.123 -6.597 4 HA2 GLY 1 HA2 GLY 1 -15.526 9.226 -7.666 5 HA3 GLY 1 HA1 GLY 1 -17.062 9.595 -8.449 6 H MET 2 HN MET 2 -15.244 12.069 -9.441 7 HA MET 2 HA MET 2 -14.929 11.130 -12.107 8 HB2 MET 2 HB2 MET 2 -13.500 13.395 -10.680 9 HB3 MET 2 HB1 MET 2 -13.515 13.152 -12.427 10 HG2 MET 2 HG2 MET 2 -16.024 13.271 -12.359 11 HG3 MET 2 HG1 MET 2 -15.913 13.683 -10.648 12 HE1 MET 2 HE1 MET 2 -13.646 14.709 -13.764 13 HE2 MET 2 HE2 MET 2 -14.550 16.134 -14.267 14 HE3 MET 2 HE3 MET 2 -15.341 14.560 -14.245 15 H GLY 3 HN GLY 3 -12.909 10.776 -9.301 16 HA2 GLY 3 HA2 GLY 3 -10.550 10.020 -10.907 17 HA3 GLY 3 HA1 GLY 3 -10.625 10.078 -9.146 18 H GLN 4 HN GLN 4 -9.554 7.894 -9.395 19 HA GLN 4 HA GLN 4 -11.086 5.688 -10.486 20 HB2 GLN 4 HB1 GLN 4 -8.710 5.772 -8.606 21 HB3 GLN 4 HB2 GLN 4 -9.390 4.283 -9.261 22 HG2 GLN 4 HG1 GLN 4 -8.951 5.057 -11.543 23 HG3 GLN 4 HG2 GLN 4 -8.346 6.594 -10.927 24 HE21 GLN 4 HE21 GLN 4 -6.787 4.639 -12.501 25 HE22 GLN 4 HE22 GLN 4 -5.496 4.146 -11.515 26 H ALA 5 HN ALA 5 -11.575 7.556 -7.776 27 HA ALA 5 HA ALA 5 -13.546 5.720 -6.706 28 HB1 ALA 5 HB1 ALA 5 -11.020 5.195 -5.788 29 HB2 ALA 5 HB2 ALA 5 -12.491 4.864 -4.875 30 HB3 ALA 5 HB3 ALA 5 -11.589 6.350 -4.582 31 H ASN 6 HN ASN 6 -14.838 6.771 -5.033 32 HA ASN 6 HA ASN 6 -14.943 9.653 -5.361 33 HB2 ASN 6 HB2 ASN 6 -16.393 8.055 -3.242 34 HB3 ASN 6 HB1 ASN 6 -16.890 9.572 -3.990 35 HD21 ASN 6 HD21 ASN 6 -18.507 7.134 -3.998 36 HD22 ASN 6 HD22 ASN 6 -18.697 6.681 -5.623 37 H THR 7 HN THR 7 -13.184 7.585 -3.307 38 HA THR 7 HA THR 7 -12.173 9.903 -1.809 39 HB THR 7 HB THR 7 -14.218 8.978 -0.564 40 HG1 THR 7 HG1 THR 7 -12.668 10.227 0.471 41 HG21 THR 7 HG21 THR 7 -13.882 6.616 -0.875 42 HG22 THR 7 HG22 THR 7 -13.671 6.962 0.842 43 HG23 THR 7 HG23 THR 7 -12.262 6.702 -0.184 44 HA PRO 8 HA PRO 8 -8.395 7.619 -2.152 45 HB2 PRO 8 HB2 PRO 8 -7.084 8.447 0.072 46 HB3 PRO 8 HB1 PRO 8 -7.287 9.450 -1.368 47 HG2 PRO 8 HG2 PRO 8 -8.890 9.434 1.169 48 HG3 PRO 8 HG1 PRO 8 -8.238 10.817 0.282 49 HD2 PRO 8 HD2 PRO 8 -10.806 10.127 0.023 50 HD3 PRO 8 HD1 PRO 8 -9.886 10.691 -1.370 51 H TRP 9 HN TRP 9 -10.170 7.405 0.922 52 HA TRP 9 HA TRP 9 -8.718 4.923 1.605 53 HB2 TRP 9 HB2 TRP 9 -10.118 4.917 3.642 54 HB3 TRP 9 HB1 TRP 9 -9.284 6.454 3.439 55 HD1 TRP 9 HD1 TRP 9 -12.735 4.863 3.274 56 HE1 TRP 9 HE1 TRP 9 -14.513 6.732 3.239 57 HE3 TRP 9 HE3 TRP 9 -9.710 8.940 2.771 58 HZ2 TRP 9 HZ2 TRP 9 -14.631 9.585 3.028 59 HZ3 TRP 9 HZ3 TRP 9 -10.678 11.220 2.655 60 HH2 TRP 9 HH2 TRP 9 -13.133 11.543 2.781 61 H SER 10 HN SER 10 -10.662 5.337 -0.748 62 HA SER 10 HA SER 10 -12.556 3.131 -0.073 63 HB2 SER 10 HB1 SER 10 -12.708 5.502 -1.807 64 HB3 SER 10 HB2 SER 10 -13.242 4.017 -2.593 65 HG SER 10 HG SER 10 -14.919 5.094 -1.430 66 H SER 11 HN SER 11 -9.937 4.145 -2.162 67 HA SER 11 HA SER 11 -9.838 1.376 -3.290 68 HB2 SER 11 HB2 SER 11 -8.890 2.332 -5.344 69 HB3 SER 11 HB1 SER 11 -10.459 3.066 -5.009 70 HG SER 11 HG SER 11 -9.511 4.902 -4.430 71 H LYS 12 HN LYS 12 -7.794 0.409 -3.284 72 HA LYS 12 HA LYS 12 -5.906 1.262 -1.330 73 HB2 LYS 12 HB2 LYS 12 -6.288 -1.043 -2.678 74 HB3 LYS 12 HB1 LYS 12 -4.910 -0.409 -3.576 75 HG2 LYS 12 HG2 LYS 12 -3.650 -0.142 -1.480 76 HG3 LYS 12 HG1 LYS 12 -5.035 -0.732 -0.561 77 HD2 LYS 12 HD2 LYS 12 -3.419 -2.547 -0.908 78 HD3 LYS 12 HD1 LYS 12 -4.908 -2.886 -1.789 79 HE2 LYS 12 HE2 LYS 12 -3.667 -3.101 -3.659 80 HE3 LYS 12 HE1 LYS 12 -3.313 -1.376 -3.555 81 HZ1 LYS 12 HZ1 LYS 12 -1.212 -1.975 -3.251 82 HZ2 LYS 12 HZ2 LYS 12 -1.618 -3.609 -3.024 83 HZ3 LYS 12 HZ3 LYS 12 -1.661 -2.530 -1.712 84 H ALA 13 HN ALA 13 -5.874 1.603 -4.880 85 HA ALA 13 HA ALA 13 -3.304 2.782 -5.105 86 HB1 ALA 13 HB1 ALA 13 -5.806 2.834 -6.745 87 HB2 ALA 13 HB2 ALA 13 -4.194 2.265 -7.179 88 HB3 ALA 13 HB3 ALA 13 -4.534 3.994 -7.131 89 H ASN 14 HN ASN 14 -6.489 4.370 -4.749 90 HA ASN 14 HA ASN 14 -5.340 7.017 -4.536 91 HB2 ASN 14 HB2 ASN 14 -8.061 6.081 -3.585 92 HB3 ASN 14 HB1 ASN 14 -7.582 7.736 -3.964 93 HD21 ASN 14 HD21 ASN 14 -9.717 6.965 -5.415 94 HD22 ASN 14 HD22 ASN 14 -9.300 6.513 -6.996 95 H ALA 15 HN ALA 15 -6.118 4.480 -2.226 96 HA ALA 15 HA ALA 15 -6.091 6.110 0.127 97 HB1 ALA 15 HB1 ALA 15 -6.278 3.323 -0.497 98 HB2 ALA 15 HB2 ALA 15 -6.701 4.139 1.009 99 HB3 ALA 15 HB3 ALA 15 -5.062 3.534 0.762 100 H ASP 16 HN ASP 16 -3.488 4.481 -1.643 101 HA ASP 16 HA ASP 16 -1.453 4.948 0.329 102 HB2 ASP 16 HB2 ASP 16 -1.272 3.347 -1.607 103 HB3 ASP 16 HB1 ASP 16 -1.071 4.740 -2.671 104 H ALA 17 HN ALA 17 -2.108 6.723 -2.727 105 HA ALA 17 HA ALA 17 -0.249 8.787 -2.374 106 HB1 ALA 17 HB1 ALA 17 -1.400 8.761 -4.437 107 HB2 ALA 17 HB2 ALA 17 -2.007 10.209 -3.635 108 HB3 ALA 17 HB3 ALA 17 -2.980 8.739 -3.655 109 H PHE 18 HN PHE 18 -3.340 8.302 -0.770 110 HA PHE 18 HA PHE 18 -3.538 10.969 0.324 111 HB2 PHE 18 HB1 PHE 18 -5.436 9.304 0.167 112 HB3 PHE 18 HB2 PHE 18 -4.685 8.419 1.495 113 HD1 PHE 18 HD1 PHE 18 -6.247 11.637 0.514 114 HD2 PHE 18 HD2 PHE 18 -4.784 9.230 3.757 115 HE1 PHE 18 HE1 PHE 18 -7.300 13.187 2.139 116 HE2 PHE 18 HE2 PHE 18 -5.837 10.780 5.382 117 HZ PHE 18 HZ PHE 18 -7.093 12.759 4.574 118 H ILE 19 HN ILE 19 -2.241 7.889 1.572 119 HA ILE 19 HA ILE 19 -1.457 8.975 4.126 120 HB ILE 19 HB ILE 19 -0.219 6.616 2.683 121 HG12 ILE 19 HG12 ILE 19 -2.580 6.224 2.658 122 HG13 ILE 19 HG11 ILE 19 -1.950 5.310 4.028 123 HG21 ILE 19 HG21 ILE 19 0.455 7.819 5.074 124 HG22 ILE 19 HG22 ILE 19 0.794 6.139 4.656 125 HG23 ILE 19 HG23 ILE 19 -0.647 6.542 5.591 126 HD11 ILE 19 HD11 ILE 19 -2.529 7.267 5.504 127 HD12 ILE 19 HD12 ILE 19 -3.931 6.495 4.764 128 HD13 ILE 19 HD13 ILE 19 -3.317 8.015 4.115 129 H ASN 20 HN ASN 20 0.288 8.413 1.076 130 HA ASN 20 HA ASN 20 2.812 9.423 2.030 131 HB2 ASN 20 HB2 ASN 20 2.978 8.096 0.113 132 HB3 ASN 20 HB1 ASN 20 1.603 8.868 -0.668 133 HD21 ASN 20 HD21 ASN 20 2.376 9.956 -2.472 134 HD22 ASN 20 HD22 ASN 20 3.715 11.001 -2.472 135 H SER 21 HN SER 21 0.255 10.910 0.014 136 HA SER 21 HA SER 21 1.455 13.474 -0.195 137 HB2 SER 21 HB1 SER 21 -1.502 12.801 -0.058 138 HB3 SER 21 HB2 SER 21 -0.811 14.295 -0.691 139 HG SER 21 HG SER 21 -0.983 13.123 -2.471 140 H PHE 22 HN PHE 22 -0.341 11.946 2.389 141 HA PHE 22 HA PHE 22 -0.843 14.369 3.892 142 HB2 PHE 22 HB1 PHE 22 -2.193 12.390 4.303 143 HB3 PHE 22 HB2 PHE 22 -0.760 11.461 4.744 144 HD1 PHE 22 HD2 PHE 22 0.555 12.107 6.795 145 HD2 PHE 22 HD1 PHE 22 -3.263 13.839 5.867 146 HE1 PHE 22 HE2 PHE 22 0.346 12.900 9.135 147 HE2 PHE 22 HE1 PHE 22 -3.473 14.631 8.206 148 HZ PHE 22 HZ PHE 22 -1.668 14.163 9.841 149 H ILE 23 HN ILE 23 1.561 11.741 4.305 150 HA ILE 23 HA ILE 23 2.948 13.046 6.451 151 HB ILE 23 HB ILE 23 4.104 11.058 4.477 152 HG12 ILE 23 HG11 ILE 23 1.895 10.357 5.509 153 HG13 ILE 23 HG12 ILE 23 3.256 9.305 5.897 154 HG21 ILE 23 HG21 ILE 23 5.111 12.399 6.811 155 HG22 ILE 23 HG22 ILE 23 5.928 11.218 5.788 156 HG23 ILE 23 HG23 ILE 23 4.963 10.677 7.162 157 HD11 ILE 23 HD11 ILE 23 2.949 9.694 8.093 158 HD12 ILE 23 HD12 ILE 23 1.557 10.705 7.706 159 HD13 ILE 23 HD13 ILE 23 3.162 11.424 7.827 160 H SER 24 HN SER 24 3.877 12.714 2.999 161 HA SER 24 HA SER 24 6.133 14.420 3.123 162 HB2 SER 24 HB2 SER 24 5.527 12.961 1.181 163 HB3 SER 24 HB1 SER 24 4.243 14.100 0.773 164 HG SER 24 HG SER 24 5.666 15.424 -0.006 165 H ALA 25 HN ALA 25 2.703 15.196 2.675 166 HA ALA 25 HA ALA 25 3.227 18.020 2.167 167 HB1 ALA 25 HB1 ALA 25 0.647 16.640 2.962 168 HB2 ALA 25 HB2 ALA 25 1.202 16.874 1.305 169 HB3 ALA 25 HB3 ALA 25 0.793 18.269 2.302 170 H ALA 26 HN ALA 26 2.056 16.143 4.976 171 HA ALA 26 HA ALA 26 1.711 18.421 6.684 172 HB1 ALA 26 HB1 ALA 26 0.694 16.262 7.220 173 HB2 ALA 26 HB2 ALA 26 1.761 16.759 8.533 174 HB3 ALA 26 HB3 ALA 26 2.289 15.529 7.385 175 H SER 27 HN SER 27 4.528 16.535 5.801 176 HA SER 27 HA SER 27 6.209 17.293 7.990 177 HB2 SER 27 HB2 SER 27 6.966 16.613 5.134 178 HB3 SER 27 HB1 SER 27 8.076 16.654 6.503 179 HG SER 27 HG SER 27 7.233 14.545 6.001 180 H ASN 28 HN ASN 28 5.353 18.938 4.994 181 HA ASN 28 HA ASN 28 7.264 21.115 5.705 182 HB2 ASN 28 HB1 ASN 28 7.207 21.798 3.432 183 HB3 ASN 28 HB2 ASN 28 7.276 20.037 3.378 184 HD21 ASN 28 HD21 ASN 28 6.239 21.266 1.131 185 HD22 ASN 28 HD22 ASN 28 4.547 21.148 1.077 186 H THR 29 HN THR 29 4.201 20.412 6.466 187 HA THR 29 HA THR 29 3.002 23.010 5.750 188 HB THR 29 HB THR 29 1.815 20.857 7.515 189 HG1 THR 29 HG1 THR 29 2.222 19.864 5.615 190 HG21 THR 29 HG21 THR 29 0.169 22.532 5.723 191 HG22 THR 29 HG22 THR 29 0.962 23.402 7.036 192 HG23 THR 29 HG23 THR 29 -0.117 22.056 7.396 193 H GLY 30 HN GLY 30 2.889 21.356 8.914 194 HA2 GLY 30 HA2 GLY 30 3.123 23.963 10.240 195 HA3 GLY 30 HA1 GLY 30 2.857 22.414 11.039 196 H SER 31 HN SER 31 4.614 21.354 11.894 197 HA SER 31 HA SER 31 7.325 22.387 11.193 198 HB2 SER 31 HB2 SER 31 7.636 21.753 13.820 199 HB3 SER 31 HB1 SER 31 7.271 23.380 13.251 200 HG SER 31 HG SER 31 5.620 23.121 14.538 201 H PHE 32 HN PHE 32 5.820 19.870 13.260 202 HA PHE 32 HA PHE 32 6.457 17.616 13.538 203 HB2 PHE 32 HB2 PHE 32 6.323 18.106 10.575 204 HB3 PHE 32 HB1 PHE 32 6.848 16.531 11.173 205 HD1 PHE 32 HD1 PHE 32 5.293 15.840 13.395 206 HD2 PHE 32 HD2 PHE 32 4.071 18.150 9.982 207 HE1 PHE 32 HE1 PHE 32 2.932 15.205 13.808 208 HE2 PHE 32 HE2 PHE 32 1.712 17.513 10.398 209 HZ PHE 32 HZ PHE 32 1.142 16.040 12.309 210 H SER 33 HN SER 33 8.460 17.805 14.625 211 HA SER 33 HA SER 33 10.928 18.538 13.421 212 HB2 SER 33 HB1 SER 33 10.204 16.888 15.836 213 HB3 SER 33 HB2 SER 33 11.888 17.052 15.338 214 HG SER 33 HG SER 33 10.083 19.016 16.215 215 H GLN 34 HN GLN 34 12.739 17.105 12.828 216 HA GLN 34 HA GLN 34 12.091 15.166 10.898 217 HB2 GLN 34 HB1 GLN 34 14.591 15.367 12.606 218 HB3 GLN 34 HB2 GLN 34 14.450 14.390 11.146 219 HG2 GLN 34 HG2 GLN 34 13.955 16.408 9.827 220 HG3 GLN 34 HG1 GLN 34 14.051 17.395 11.285 221 HE21 GLN 34 HE21 GLN 34 15.810 17.951 9.149 222 HE22 GLN 34 HE22 GLN 34 17.388 17.484 9.568 223 H ASP 35 HN ASP 35 12.748 14.748 14.366 224 HA ASP 35 HA ASP 35 12.710 11.896 14.393 225 HB2 ASP 35 HB2 ASP 35 12.306 12.094 16.780 226 HB3 ASP 35 HB1 ASP 35 13.436 13.360 16.303 227 H GLN 36 HN GLN 36 10.115 14.303 14.510 228 HA GLN 36 HA GLN 36 8.003 12.435 15.102 229 HB2 GLN 36 HB1 GLN 36 7.860 15.090 13.639 230 HB3 GLN 36 HB2 GLN 36 6.495 14.225 14.346 231 HG2 GLN 36 HG2 GLN 36 8.894 15.306 15.857 232 HG3 GLN 36 HG1 GLN 36 7.268 15.988 15.875 233 HE21 GLN 36 HE21 GLN 36 9.220 14.214 17.805 234 HE22 GLN 36 HE22 GLN 36 8.092 13.178 18.538 235 H MET 37 HN MET 37 9.594 13.469 12.139 236 HA MET 37 HA MET 37 7.677 12.426 10.287 237 HB2 MET 37 HB2 MET 37 10.684 12.753 10.043 238 HB3 MET 37 HB1 MET 37 9.615 12.362 8.695 239 HG2 MET 37 HG2 MET 37 8.327 14.458 9.185 240 HG3 MET 37 HG1 MET 37 9.532 14.864 10.407 241 HE1 MET 37 HE1 MET 37 8.661 16.665 8.284 242 HE2 MET 37 HE2 MET 37 10.012 17.236 7.308 243 HE3 MET 37 HE3 MET 37 10.135 17.258 9.065 244 H GLU 38 HN GLU 38 10.380 10.948 12.029 245 HA GLU 38 HA GLU 38 10.434 8.453 10.668 246 HB2 GLU 38 HB1 GLU 38 11.024 9.156 13.556 247 HB3 GLU 38 HB2 GLU 38 11.340 7.567 12.859 248 HG2 GLU 38 HG2 GLU 38 12.530 10.212 11.970 249 HG3 GLU 38 HG1 GLU 38 13.384 8.873 12.737 250 H ASN 39 HN ASN 39 8.585 9.448 13.563 251 HA ASN 39 HA ASN 39 7.199 6.982 13.910 252 HB2 ASN 39 HB2 ASN 39 7.289 9.043 15.478 253 HB3 ASN 39 HB1 ASN 39 5.961 9.669 14.500 254 HD21 ASN 39 HD21 ASN 39 5.308 9.174 17.120 255 HD22 ASN 39 HD22 ASN 39 4.379 7.760 17.258 256 H MET 40 HN MET 40 6.323 9.912 12.094 257 HA MET 40 HA MET 40 3.806 8.958 11.139 258 HB2 MET 40 HB2 MET 40 5.757 10.894 9.849 259 HB3 MET 40 HB1 MET 40 4.078 10.671 9.354 260 HG2 MET 40 HG2 MET 40 3.422 11.237 11.747 261 HG3 MET 40 HG1 MET 40 5.098 11.718 12.007 262 HE1 MET 40 HE1 MET 40 5.980 12.754 9.302 263 HE2 MET 40 HE2 MET 40 6.313 13.655 10.778 264 HE3 MET 40 HE3 MET 40 5.651 14.491 9.376 265 H SER 41 HN SER 41 7.107 8.560 9.971 266 HA SER 41 HA SER 41 6.382 7.288 7.477 267 HB2 SER 41 HB2 SER 41 8.950 7.061 9.082 268 HB3 SER 41 HB1 SER 41 8.745 6.612 7.389 269 HG SER 41 HG SER 41 9.238 8.603 7.003 270 H LEU 42 HN LEU 42 6.647 6.221 10.779 271 HA LEU 42 HA LEU 42 6.775 3.375 10.055 272 HB2 LEU 42 HB2 LEU 42 7.865 4.154 12.119 273 HB3 LEU 42 HB1 LEU 42 6.316 4.737 12.729 274 HG LEU 42 HG LEU 42 5.524 2.273 12.311 275 HD11 LEU 42 HD11 LEU 42 7.175 0.605 12.248 276 HD12 LEU 42 HD12 LEU 42 8.434 1.697 12.828 277 HD13 LEU 42 HD13 LEU 42 7.837 1.838 11.174 278 HD21 LEU 42 HD21 LEU 42 6.977 3.545 14.529 279 HD22 LEU 42 HD22 LEU 42 7.001 1.782 14.585 280 HD23 LEU 42 HD23 LEU 42 5.462 2.642 14.549 281 H ILE 43 HN ILE 43 4.356 5.782 10.658 282 HA ILE 43 HA ILE 43 2.273 3.632 10.654 283 HB ILE 43 HB ILE 43 2.299 6.367 11.953 284 HG12 ILE 43 HG12 ILE 43 3.266 4.611 13.307 285 HG13 ILE 43 HG11 ILE 43 1.663 4.965 13.949 286 HG21 ILE 43 HG21 ILE 43 0.096 6.488 11.449 287 HG22 ILE 43 HG22 ILE 43 -0.115 5.172 12.602 288 HG23 ILE 43 HG23 ILE 43 0.052 4.819 10.884 289 HD11 ILE 43 HD11 ILE 43 2.638 2.548 12.500 290 HD12 ILE 43 HD12 ILE 43 0.980 3.058 12.187 291 HD13 ILE 43 HD13 ILE 43 1.488 2.671 13.831 292 H GLY 44 HN GLY 44 0.448 3.984 9.278 293 HA2 GLY 44 HA1 GLY 44 -0.794 5.141 7.582 294 HA3 GLY 44 HA2 GLY 44 0.481 6.363 7.518 295 H ASN 45 HN ASN 45 2.581 5.644 6.550 296 HA ASN 45 HA ASN 45 2.161 4.272 4.054 297 HB2 ASN 45 HB2 ASN 45 4.665 5.096 5.550 298 HB3 ASN 45 HB1 ASN 45 4.717 4.304 3.975 299 HD21 ASN 45 HD21 ASN 45 5.749 6.883 4.099 300 HD22 ASN 45 HD22 ASN 45 4.680 8.003 3.406 301 H THR 46 HN THR 46 3.513 3.332 7.190 302 HA THR 46 HA THR 46 4.394 0.715 6.434 303 HB THR 46 HB THR 46 3.356 1.664 9.122 304 HG1 THR 46 HG1 THR 46 6.004 1.531 8.121 305 HG21 THR 46 HG21 THR 46 3.525 -0.815 8.814 306 HG22 THR 46 HG22 THR 46 4.623 -0.187 10.043 307 HG23 THR 46 HG23 THR 46 5.238 -0.609 8.445 308 H LEU 47 HN LEU 47 1.292 2.030 7.444 309 HA LEU 47 HA LEU 47 -0.128 -0.381 7.885 310 HB2 LEU 47 HB2 LEU 47 -1.015 1.881 8.394 311 HB3 LEU 47 HB1 LEU 47 -1.153 2.201 6.666 312 HG LEU 47 HG LEU 47 -2.622 0.121 6.530 313 HD11 LEU 47 HD11 LEU 47 -1.737 -0.509 8.951 314 HD12 LEU 47 HD12 LEU 47 -3.378 -0.930 8.460 315 HD13 LEU 47 HD13 LEU 47 -3.096 0.490 9.467 316 HD21 LEU 47 HD21 LEU 47 -4.228 1.693 6.474 317 HD22 LEU 47 HD22 LEU 47 -3.196 2.790 7.392 318 HD23 LEU 47 HD23 LEU 47 -4.284 1.689 8.237 319 H MET 48 HN MET 48 0.642 1.340 4.884 320 HA MET 48 HA MET 48 -1.029 -0.030 3.087 321 HB2 MET 48 HB2 MET 48 1.841 0.860 2.668 322 HB3 MET 48 HB1 MET 48 0.720 0.422 1.378 323 HG2 MET 48 HG2 MET 48 0.352 2.681 3.371 324 HG3 MET 48 HG1 MET 48 0.760 2.859 1.665 325 HE1 MET 48 HE1 MET 48 -1.242 0.414 0.393 326 HE2 MET 48 HE2 MET 48 -0.460 1.891 -0.161 327 HE3 MET 48 HE3 MET 48 -2.210 1.730 -0.286 328 H ALA 49 HN ALA 49 1.870 -1.121 4.731 329 HA ALA 49 HA ALA 49 2.441 -3.408 3.122 330 HB1 ALA 49 HB1 ALA 49 2.820 -3.692 6.047 331 HB2 ALA 49 HB2 ALA 49 3.598 -2.287 5.317 332 HB3 ALA 49 HB3 ALA 49 3.980 -3.907 4.736 333 H ALA 50 HN ALA 50 0.128 -2.862 5.736 334 HA ALA 50 HA ALA 50 -0.640 -5.613 6.076 335 HB1 ALA 50 HB1 ALA 50 -2.868 -4.365 6.842 336 HB2 ALA 50 HB2 ALA 50 -1.811 -2.952 6.787 337 HB3 ALA 50 HB3 ALA 50 -1.410 -4.315 7.834 338 H MET 51 HN MET 51 -1.771 -3.010 3.948 339 HA MET 51 HA MET 51 -4.070 -4.261 2.890 340 HB2 MET 51 HB2 MET 51 -2.057 -2.568 1.375 341 HB3 MET 51 HB1 MET 51 -3.733 -2.858 0.910 342 HG2 MET 51 HG2 MET 51 -3.007 -1.644 3.580 343 HG3 MET 51 HG1 MET 51 -3.244 -0.654 2.139 344 HE1 MET 51 HE1 MET 51 -6.368 -0.751 4.802 345 HE2 MET 51 HE2 MET 51 -4.935 0.173 4.361 346 HE3 MET 51 HE3 MET 51 -4.756 -1.376 5.181 347 H ASP 52 HN ASP 52 -0.664 -4.872 2.303 348 HA ASP 52 HA ASP 52 -0.808 -6.342 -0.103 349 HB2 ASP 52 HB2 ASP 52 1.302 -5.734 1.129 350 HB3 ASP 52 HB1 ASP 52 0.939 -7.017 2.282 351 H ASN 53 HN ASN 53 -1.656 -7.260 3.187 352 HA ASN 53 HA ASN 53 -1.910 -10.075 2.756 353 HB2 ASN 53 HB2 ASN 53 -3.449 -8.270 4.650 354 HB3 ASN 53 HB1 ASN 53 -3.388 -10.030 4.745 355 HD21 ASN 53 HD21 ASN 53 -2.402 -8.265 6.847 356 HD22 ASN 53 HD22 ASN 53 -0.728 -8.517 6.972 357 H MET 54 HN MET 54 -4.028 -7.356 2.066 358 HA MET 54 HA MET 54 -6.456 -8.753 1.621 359 HB2 MET 54 HB1 MET 54 -5.317 -6.298 0.255 360 HB3 MET 54 HB2 MET 54 -6.964 -6.875 0.006 361 HG2 MET 54 HG2 MET 54 -5.743 -6.028 2.652 362 HG3 MET 54 HG1 MET 54 -6.951 -5.135 1.729 363 HE1 MET 54 HE1 MET 54 -9.292 -6.063 1.114 364 HE2 MET 54 HE2 MET 54 -9.963 -7.590 1.685 365 HE3 MET 54 HE3 MET 54 -8.609 -7.596 0.559 366 H GLY 55 HN GLY 55 -3.541 -8.546 -0.308 367 HA2 GLY 55 HA2 GLY 55 -2.950 -10.111 -2.023 368 HA3 GLY 55 HA1 GLY 55 -4.638 -10.617 -2.109 369 H GLY 56 HN GLY 56 -4.212 -7.226 -2.052 370 HA2 GLY 56 HA2 GLY 56 -3.977 -5.673 -3.880 371 HA3 GLY 56 HA1 GLY 56 -4.124 -7.019 -5.009 372 H ARG 57 HN ARG 57 -6.351 -6.854 -2.360 373 HA ARG 57 HA ARG 57 -8.437 -5.664 -4.132 374 HB2 ARG 57 HB2 ARG 57 -10.016 -7.411 -3.490 375 HB3 ARG 57 HB1 ARG 57 -8.585 -8.161 -4.198 376 HG2 ARG 57 HG2 ARG 57 -7.730 -8.246 -1.723 377 HG3 ARG 57 HG1 ARG 57 -9.435 -8.052 -1.313 378 HD2 ARG 57 HD2 ARG 57 -9.890 -10.004 -2.904 379 HD3 ARG 57 HD1 ARG 57 -8.147 -10.277 -2.911 380 HE ARG 57 HE ARG 57 -8.918 -10.142 -0.206 381 HH11 ARG 57 HH11 ARG 57 -8.581 -12.255 -2.826 382 HH12 ARG 57 HH12 ARG 57 -9.318 -13.611 -2.039 383 HH21 ARG 57 HH21 ARG 57 -10.297 -11.796 0.750 384 HH22 ARG 57 HH22 ARG 57 -10.290 -13.350 -0.014 385 H ILE 58 HN ILE 58 -9.076 -3.867 -3.017 386 HA ILE 58 HA ILE 58 -9.320 -4.116 -0.045 387 HB ILE 58 HB ILE 58 -9.063 -1.543 -1.618 388 HG12 ILE 58 HG12 ILE 58 -7.062 -2.916 -2.006 389 HG13 ILE 58 HG11 ILE 58 -6.678 -1.576 -0.925 390 HG21 ILE 58 HG21 ILE 58 -8.959 -2.348 1.284 391 HG22 ILE 58 HG22 ILE 58 -9.919 -1.077 0.529 392 HG23 ILE 58 HG23 ILE 58 -8.180 -0.867 0.732 393 HD11 ILE 58 HD11 ILE 58 -6.456 -4.409 -0.433 394 HD12 ILE 58 HD12 ILE 58 -7.584 -3.696 0.721 395 HD13 ILE 58 HD13 ILE 58 -5.940 -3.069 0.591 396 H THR 59 HN THR 59 -11.144 -2.952 0.928 397 HA THR 59 HA THR 59 -13.424 -2.572 -0.972 398 HB THR 59 HB THR 59 -14.877 -3.770 0.420 399 HG1 THR 59 HG1 THR 59 -14.661 -3.835 2.536 400 HG21 THR 59 HG21 THR 59 -12.205 -5.122 0.878 401 HG22 THR 59 HG22 THR 59 -13.145 -5.244 -0.608 402 HG23 THR 59 HG23 THR 59 -13.789 -5.897 0.898 403 HA PRO 60 HA PRO 60 -14.108 1.339 0.993 404 HB2 PRO 60 HB1 PRO 60 -16.800 1.530 0.965 405 HB3 PRO 60 HB2 PRO 60 -15.814 1.674 -0.491 406 HG2 PRO 60 HG2 PRO 60 -17.377 -0.665 0.520 407 HG3 PRO 60 HG1 PRO 60 -17.208 -0.069 -1.133 408 HD2 PRO 60 HD2 PRO 60 -15.819 -2.208 -0.184 409 HD3 PRO 60 HD1 PRO 60 -15.203 -1.150 -1.453 410 H SER 61 HN SER 61 -16.486 -1.060 2.200 411 HA SER 61 HA SER 61 -16.933 0.216 4.705 412 HB2 SER 61 HB1 SER 61 -17.938 -1.858 5.405 413 HB3 SER 61 HB2 SER 61 -18.304 -1.662 3.691 414 HG SER 61 HG SER 61 -16.326 -2.947 3.355 415 H LYS 62 HN LYS 62 -14.452 -2.082 3.664 416 HA LYS 62 HA LYS 62 -13.398 -2.528 6.325 417 HB2 LYS 62 HB1 LYS 62 -12.305 -2.998 3.546 418 HB3 LYS 62 HB2 LYS 62 -11.364 -3.350 4.995 419 HG2 LYS 62 HG2 LYS 62 -13.228 -4.805 5.801 420 HG3 LYS 62 HG1 LYS 62 -14.071 -4.518 4.278 421 HD2 LYS 62 HD2 LYS 62 -12.019 -5.409 3.089 422 HD3 LYS 62 HD1 LYS 62 -11.397 -5.888 4.668 423 HE2 LYS 62 HE2 LYS 62 -13.624 -7.127 4.990 424 HE3 LYS 62 HE1 LYS 62 -13.880 -6.886 3.262 425 HZ1 LYS 62 HZ1 LYS 62 -12.704 -9.015 4.098 426 HZ2 LYS 62 HZ2 LYS 62 -11.336 -8.014 4.213 427 HZ3 LYS 62 HZ3 LYS 62 -12.115 -8.225 2.718 428 H LEU 63 HN LEU 63 -12.242 -0.564 3.553 429 HA LEU 63 HA LEU 63 -10.091 0.660 4.979 430 HB2 LEU 63 HB2 LEU 63 -11.722 1.618 2.613 431 HB3 LEU 63 HB1 LEU 63 -10.320 2.485 3.236 432 HG LEU 63 HG LEU 63 -10.319 -0.369 2.222 433 HD11 LEU 63 HD11 LEU 63 -10.340 0.827 0.253 434 HD12 LEU 63 HD12 LEU 63 -8.616 0.945 0.614 435 HD13 LEU 63 HD13 LEU 63 -9.694 2.283 1.012 436 HD21 LEU 63 HD21 LEU 63 -7.712 0.687 2.404 437 HD22 LEU 63 HD22 LEU 63 -8.417 -0.576 3.412 438 HD23 LEU 63 HD23 LEU 63 -8.504 1.110 3.922 439 H GLN 64 HN GLN 64 -13.530 1.291 4.900 440 HA GLN 64 HA GLN 64 -13.610 3.954 5.836 441 HB2 GLN 64 HB2 GLN 64 -15.405 1.580 6.067 442 HB3 GLN 64 HB1 GLN 64 -15.714 2.934 7.153 443 HG2 GLN 64 HG2 GLN 64 -15.844 4.467 5.239 444 HG3 GLN 64 HG1 GLN 64 -15.473 3.141 4.136 445 HE21 GLN 64 HE21 GLN 64 -17.776 4.065 3.363 446 HE22 GLN 64 HE22 GLN 64 -19.115 3.238 3.999 447 H ALA 65 HN ALA 65 -13.305 0.919 7.669 448 HA ALA 65 HA ALA 65 -13.158 2.233 10.244 449 HB1 ALA 65 HB1 ALA 65 -13.147 -0.464 9.220 450 HB2 ALA 65 HB2 ALA 65 -13.476 0.088 10.864 451 HB3 ALA 65 HB3 ALA 65 -11.821 -0.264 10.366 452 H LEU 66 HN LEU 66 -10.817 1.202 7.819 453 HA LEU 66 HA LEU 66 -8.487 1.690 9.481 454 HB2 LEU 66 HB2 LEU 66 -8.421 0.152 7.553 455 HB3 LEU 66 HB1 LEU 66 -8.748 1.500 6.465 456 HG LEU 66 HG LEU 66 -6.550 2.216 8.158 457 HD11 LEU 66 HD21 LEU 66 -6.660 -0.600 7.478 458 HD12 LEU 66 HD22 LEU 66 -5.470 0.259 8.454 459 HD13 LEU 66 HD23 LEU 66 -5.276 0.170 6.704 460 HD21 LEU 66 HD11 LEU 66 -5.825 1.536 5.439 461 HD22 LEU 66 HD12 LEU 66 -5.948 3.128 6.187 462 HD23 LEU 66 HD13 LEU 66 -7.373 2.381 5.466 463 H ASP 67 HN ASP 67 -10.156 3.537 6.930 464 HA ASP 67 HA ASP 67 -8.435 5.705 6.643 465 HB2 ASP 67 HB1 ASP 67 -10.587 5.388 5.405 466 HB3 ASP 67 HB2 ASP 67 -11.453 5.904 6.852 467 H MET 68 HN MET 68 -10.880 5.226 9.198 468 HA MET 68 HA MET 68 -10.356 7.739 10.505 469 HB2 MET 68 HB2 MET 68 -11.497 5.164 11.632 470 HB3 MET 68 HB1 MET 68 -11.572 6.741 12.417 471 HG2 MET 68 HG2 MET 68 -12.805 7.624 10.432 472 HG3 MET 68 HG1 MET 68 -12.805 5.999 9.746 473 HE1 MET 68 HE1 MET 68 -14.722 3.933 12.402 474 HE2 MET 68 HE2 MET 68 -12.990 4.235 12.281 475 HE3 MET 68 HE3 MET 68 -13.928 3.932 10.822 476 H ALA 69 HN ALA 69 -8.954 4.507 10.802 477 HA ALA 69 HA ALA 69 -7.512 4.919 13.224 478 HB1 ALA 69 HB1 ALA 69 -6.043 3.090 12.421 479 HB2 ALA 69 HB2 ALA 69 -6.776 3.220 10.821 480 HB3 ALA 69 HB3 ALA 69 -7.749 2.699 12.197 481 H PHE 70 HN PHE 70 -6.734 5.747 9.867 482 HA PHE 70 HA PHE 70 -4.006 6.472 10.280 483 HB2 PHE 70 HB1 PHE 70 -5.012 6.222 8.038 484 HB3 PHE 70 HB2 PHE 70 -6.011 7.646 8.327 485 HD1 PHE 70 HD1 PHE 70 -2.502 6.456 7.989 486 HD2 PHE 70 HD2 PHE 70 -5.131 9.850 8.077 487 HE1 PHE 70 HE1 PHE 70 -0.648 7.912 7.220 488 HE2 PHE 70 HE2 PHE 70 -3.277 11.306 7.308 489 HZ PHE 70 HZ PHE 70 -1.036 10.337 6.879 490 H ALA 71 HN ALA 71 -7.015 8.289 10.731 491 HA ALA 71 HA ALA 71 -5.725 10.823 11.235 492 HB1 ALA 71 HB1 ALA 71 -7.980 11.358 12.330 493 HB2 ALA 71 HB2 ALA 71 -8.468 9.726 11.874 494 HB3 ALA 71 HB3 ALA 71 -8.030 10.895 10.629 495 H SER 72 HN SER 72 -6.501 8.041 13.230 496 HA SER 72 HA SER 72 -6.216 9.364 15.774 497 HB2 SER 72 HB2 SER 72 -7.339 7.160 15.469 498 HB3 SER 72 HB1 SER 72 -5.771 6.441 15.102 499 HG SER 72 HG SER 72 -5.185 7.503 17.234 500 H SER 73 HN SER 73 -3.939 7.422 13.811 501 HA SER 73 HA SER 73 -1.753 7.746 15.665 502 HB2 SER 73 HB2 SER 73 -2.128 6.069 13.631 503 HB3 SER 73 HB1 SER 73 -1.231 7.311 12.757 504 HG SER 73 HG SER 73 -0.268 6.508 15.244 505 H VAL 74 HN VAL 74 -2.596 9.399 12.625 506 HA VAL 74 HA VAL 74 -0.355 11.128 12.512 507 HB VAL 74 HB VAL 74 -1.703 12.542 11.069 508 HG11 VAL 74 HG21 VAL 74 -3.020 10.376 9.946 509 HG12 VAL 74 HG22 VAL 74 -1.716 9.618 10.861 510 HG13 VAL 74 HG23 VAL 74 -1.344 10.828 9.633 511 HG21 VAL 74 HG11 VAL 74 -4.130 12.255 10.901 512 HG22 VAL 74 HG12 VAL 74 -3.689 12.634 12.565 513 HG23 VAL 74 HG13 VAL 74 -4.082 10.975 12.113 514 H ALA 75 HN ALA 75 -3.363 11.384 14.357 515 HA ALA 75 HA ALA 75 -2.846 14.090 15.271 516 HB1 ALA 75 HB1 ALA 75 -4.745 11.901 16.093 517 HB2 ALA 75 HB2 ALA 75 -5.113 13.469 15.372 518 HB3 ALA 75 HB3 ALA 75 -4.596 13.371 17.056 519 H GLN 76 HN GLN 76 -2.307 10.845 16.632 520 HA GLN 76 HA GLN 76 -1.329 11.790 19.171 521 HB2 GLN 76 HB2 GLN 76 -2.128 9.447 18.694 522 HB3 GLN 76 HB1 GLN 76 -0.636 9.182 17.791 523 HG2 GLN 76 HG2 GLN 76 0.649 9.825 19.853 524 HG3 GLN 76 HG1 GLN 76 -0.879 9.892 20.729 525 HE21 GLN 76 HE21 GLN 76 -1.208 7.991 21.883 526 HE22 GLN 76 HE22 GLN 76 -0.751 6.440 21.367 527 H ILE 77 HN ILE 77 0.308 10.850 16.144 528 HA ILE 77 HA ILE 77 2.975 11.085 17.047 529 HB ILE 77 HB ILE 77 1.825 11.765 14.327 530 HG12 ILE 77 HG12 ILE 77 3.178 9.234 15.307 531 HG13 ILE 77 HG11 ILE 77 1.428 9.432 15.193 532 HG21 ILE 77 HG21 ILE 77 4.622 11.541 15.394 533 HG22 ILE 77 HG22 ILE 77 3.958 12.699 14.241 534 HG23 ILE 77 HG23 ILE 77 4.294 11.043 13.734 535 HD11 ILE 77 HD11 ILE 77 3.439 9.076 13.038 536 HD12 ILE 77 HD12 ILE 77 2.161 10.247 12.709 537 HD13 ILE 77 HD13 ILE 77 1.748 8.576 13.095 538 H ALA 78 HN ALA 78 0.954 13.578 15.497 539 HA ALA 78 HA ALA 78 2.899 15.675 15.956 540 HB1 ALA 78 HB1 ALA 78 -0.062 15.976 15.396 541 HB2 ALA 78 HB2 ALA 78 1.150 15.703 14.145 542 HB3 ALA 78 HB3 ALA 78 1.200 17.175 15.114 543 H ALA 79 HN ALA 79 -0.257 14.908 17.471 544 HA ALA 79 HA ALA 79 -0.190 16.960 19.427 545 HB1 ALA 79 HB1 ALA 79 -2.198 15.608 19.002 546 HB2 ALA 79 HB2 ALA 79 -1.757 15.523 20.707 547 HB3 ALA 79 HB3 ALA 79 -1.383 14.177 19.631 548 H SER 80 HN SER 80 1.605 14.005 19.185 549 HA SER 80 HA SER 80 2.335 13.932 22.021 550 HB2 SER 80 HB2 SER 80 3.790 12.086 21.392 551 HB3 SER 80 HB1 SER 80 2.232 11.874 20.594 552 HG SER 80 HG SER 80 4.566 13.010 19.454 553 H GLN 81 HN GLN 81 3.476 15.504 19.158 554 HA GLN 81 HA GLN 81 6.210 15.832 19.613 555 HB2 GLN 81 HB2 GLN 81 4.212 17.906 18.662 556 HB3 GLN 81 HB1 GLN 81 5.962 18.065 18.519 557 HG2 GLN 81 HG2 GLN 81 5.986 15.907 17.231 558 HG3 GLN 81 HG1 GLN 81 4.223 15.927 17.259 559 HE21 GLN 81 HE21 GLN 81 6.860 18.290 16.505 560 HE22 GLN 81 HE22 GLN 81 6.154 18.829 15.059 561 H GLY 82 HN GLY 82 3.513 17.453 21.226 562 HA2 GLY 82 HA2 GLY 82 3.576 18.331 23.449 563 HA3 GLY 82 HA1 GLY 82 5.335 18.194 23.425 564 H GLY 83 HN GLY 83 3.777 19.668 20.701 565 HA2 GLY 83 HA1 GLY 83 4.789 22.322 21.637 566 HA3 GLY 83 HA2 GLY 83 4.722 21.835 19.943 567 H ASP 84 HN ASP 84 3.414 23.778 19.561 568 HA ASP 84 HA ASP 84 0.917 24.270 20.859 569 HB2 ASP 84 HB2 ASP 84 1.955 25.004 18.111 570 HB3 ASP 84 HB1 ASP 84 0.395 25.555 18.720 571 H LEU 85 HN LEU 85 -1.086 23.367 20.551 572 HA LEU 85 HA LEU 85 -1.266 21.003 18.809 573 HB2 LEU 85 HB1 LEU 85 -2.255 21.100 21.134 574 HB3 LEU 85 HB2 LEU 85 -3.431 22.262 20.519 575 HG LEU 85 HG LEU 85 -3.777 20.385 18.660 576 HD11 LEU 85 HD11 LEU 85 -3.703 18.221 20.336 577 HD12 LEU 85 HD12 LEU 85 -2.247 19.087 20.827 578 HD13 LEU 85 HD13 LEU 85 -2.456 18.594 19.147 579 HD21 LEU 85 HD21 LEU 85 -5.252 21.323 20.708 580 HD22 LEU 85 HD22 LEU 85 -5.008 19.672 21.278 581 HD23 LEU 85 HD23 LEU 85 -5.776 19.962 19.717 582 H GLY 86 HN GLY 86 -2.086 24.350 18.691 583 HA2 GLY 86 HA2 GLY 86 -4.269 24.155 16.806 584 HA3 GLY 86 HA1 GLY 86 -3.331 25.609 17.147 585 H VAL 87 HN VAL 87 -0.752 24.366 16.500 586 HA VAL 87 HA VAL 87 -0.764 24.879 13.656 587 HB VAL 87 HB VAL 87 1.184 25.220 15.296 588 HG11 VAL 87 HG11 VAL 87 2.674 23.281 15.586 589 HG12 VAL 87 HG12 VAL 87 1.518 22.257 14.732 590 HG13 VAL 87 HG13 VAL 87 1.092 22.956 16.295 591 HG21 VAL 87 HG21 VAL 87 1.819 25.626 13.112 592 HG22 VAL 87 HG22 VAL 87 1.291 24.039 12.553 593 HG23 VAL 87 HG23 VAL 87 2.811 24.204 13.432 594 H THR 88 HN THR 88 -0.446 21.875 15.585 595 HA THR 88 HA THR 88 -0.022 20.081 13.462 596 HB THR 88 HB THR 88 -1.761 19.661 15.914 597 HG1 THR 88 HG1 THR 88 0.057 19.342 16.914 598 HG21 THR 88 HG21 THR 88 -1.402 17.275 15.501 599 HG22 THR 88 HG22 THR 88 -0.438 17.650 14.071 600 HG23 THR 88 HG23 THR 88 -2.163 18.016 14.093 601 H THR 89 HN THR 89 -2.976 21.683 14.517 602 HA THR 89 HA THR 89 -4.865 20.228 12.982 603 HB THR 89 HB THR 89 -4.899 23.230 13.422 604 HG1 THR 89 HG1 THR 89 -5.840 21.172 15.130 605 HG21 THR 89 HG21 THR 89 -7.195 23.106 13.067 606 HG22 THR 89 HG22 THR 89 -7.271 21.395 13.489 607 HG23 THR 89 HG23 THR 89 -6.608 21.890 11.932 608 H ASN 90 HN ASN 90 -2.927 23.095 12.120 609 HA ASN 90 HA ASN 90 -3.815 23.132 9.369 610 HB2 ASN 90 HB1 ASN 90 -1.289 24.307 10.567 611 HB3 ASN 90 HB2 ASN 90 -2.028 24.760 9.031 612 HD21 ASN 90 HD21 ASN 90 -4.733 24.951 9.698 613 HD22 ASN 90 HD22 ASN 90 -4.941 26.197 10.832 614 H ALA 91 HN ALA 91 -1.016 21.765 11.070 615 HA ALA 91 HA ALA 91 0.393 20.886 8.733 616 HB1 ALA 91 HB1 ALA 91 0.699 19.148 11.068 617 HB2 ALA 91 HB2 ALA 91 0.858 20.858 11.470 618 HB3 ALA 91 HB3 ALA 91 1.902 20.139 10.244 619 H ILE 92 HN ILE 92 -1.621 18.990 11.014 620 HA ILE 92 HA ILE 92 -1.681 16.658 9.339 621 HB ILE 92 HB ILE 92 -3.542 17.570 11.553 622 HG12 ILE 92 HG12 ILE 92 -1.219 15.620 11.477 623 HG13 ILE 92 HG11 ILE 92 -1.235 17.189 12.282 624 HG21 ILE 92 HG21 ILE 92 -4.776 15.687 11.275 625 HG22 ILE 92 HG22 ILE 92 -3.349 14.700 10.958 626 HG23 ILE 92 HG23 ILE 92 -4.081 15.635 9.656 627 HD11 ILE 92 HD11 ILE 92 -2.865 14.735 12.977 628 HD12 ILE 92 HD12 ILE 92 -3.225 16.334 13.629 629 HD13 ILE 92 HD13 ILE 92 -1.678 15.564 13.986 630 H ALA 93 HN ALA 93 -4.031 19.308 9.818 631 HA ALA 93 HA ALA 93 -5.986 18.277 8.002 632 HB1 ALA 93 HB1 ALA 93 -6.349 20.130 9.679 633 HB2 ALA 93 HB2 ALA 93 -6.976 20.478 8.068 634 HB3 ALA 93 HB3 ALA 93 -5.457 21.200 8.597 635 H ASP 94 HN ASP 94 -3.396 20.702 7.482 636 HA ASP 94 HA ASP 94 -3.929 21.220 4.759 637 HB2 ASP 94 HB1 ASP 94 -1.327 21.158 6.299 638 HB3 ASP 94 HB2 ASP 94 -1.416 21.663 4.612 639 H ALA 95 HN ALA 95 -2.009 18.611 6.233 640 HA ALA 95 HA ALA 95 -1.086 17.467 3.781 641 HB1 ALA 95 HB1 ALA 95 -1.296 16.627 6.610 642 HB2 ALA 95 HB2 ALA 95 0.042 16.440 5.476 643 HB3 ALA 95 HB3 ALA 95 -1.309 15.307 5.442 644 H LEU 96 HN LEU 96 -3.984 16.826 5.753 645 HA LEU 96 HA LEU 96 -5.012 14.780 3.987 646 HB2 LEU 96 HB1 LEU 96 -6.632 16.527 5.855 647 HB3 LEU 96 HB2 LEU 96 -7.021 14.901 5.294 648 HG LEU 96 HG LEU 96 -4.456 15.356 6.784 649 HD11 LEU 96 HD21 LEU 96 -7.188 14.988 8.050 650 HD12 LEU 96 HD22 LEU 96 -6.196 16.441 8.157 651 HD13 LEU 96 HD23 LEU 96 -5.648 14.944 8.908 652 HD21 LEU 96 HD11 LEU 96 -4.821 13.043 7.437 653 HD22 LEU 96 HD12 LEU 96 -5.023 13.177 5.690 654 HD23 LEU 96 HD13 LEU 96 -6.439 13.066 6.737 655 H THR 97 HN THR 97 -5.423 18.285 4.223 656 HA THR 97 HA THR 97 -7.583 18.501 2.362 657 HB THR 97 HB THR 97 -5.405 20.509 3.002 658 HG1 THR 97 HG1 THR 97 -6.454 20.752 4.784 659 HG21 THR 97 HG21 THR 97 -7.423 22.061 2.360 660 HG22 THR 97 HG22 THR 97 -7.986 20.643 1.477 661 HG23 THR 97 HG23 THR 97 -6.424 21.362 1.085 662 H SER 98 HN SER 98 -4.071 19.002 1.852 663 HA SER 98 HA SER 98 -4.278 19.339 -0.976 664 HB2 SER 98 HB1 SER 98 -1.925 18.140 0.512 665 HB3 SER 98 HB2 SER 98 -1.890 18.993 -1.031 666 HG SER 98 HG SER 98 -2.660 20.849 0.107 667 H ALA 99 HN ALA 99 -3.512 16.442 0.967 668 HA ALA 99 HA ALA 99 -3.202 14.603 -1.136 669 HB1 ALA 99 HB1 ALA 99 -2.922 14.255 1.407 670 HB2 ALA 99 HB2 ALA 99 -3.543 12.900 0.465 671 HB3 ALA 99 HB3 ALA 99 -4.650 13.894 1.413 672 H PHE 100 HN PHE 100 -6.214 15.622 0.493 673 HA PHE 100 HA PHE 100 -8.063 13.924 -0.714 674 HB2 PHE 100 HB1 PHE 100 -8.123 16.677 0.336 675 HB3 PHE 100 HB2 PHE 100 -9.371 16.340 -0.863 676 HD1 PHE 100 HD2 PHE 100 -10.377 13.793 -0.534 677 HD2 PHE 100 HD1 PHE 100 -8.768 16.332 2.536 678 HE1 PHE 100 HE2 PHE 100 -11.692 12.561 1.174 679 HE2 PHE 100 HE1 PHE 100 -10.079 15.101 4.239 680 HZ PHE 100 HZ PHE 100 -11.539 13.215 3.559 681 H TYR 101 HN TYR 101 -6.999 17.069 -2.043 682 HA TYR 101 HA TYR 101 -8.251 16.593 -4.606 683 HB2 TYR 101 HB2 TYR 101 -5.994 18.533 -4.168 684 HB3 TYR 101 HB1 TYR 101 -7.403 18.693 -5.219 685 HD1 TYR 101 HD2 TYR 101 -9.681 18.085 -3.611 686 HD2 TYR 101 HD1 TYR 101 -6.080 20.123 -2.453 687 HE1 TYR 101 HE2 TYR 101 -10.916 19.222 -1.780 688 HE2 TYR 101 HE1 TYR 101 -7.313 21.260 -0.627 689 HH TYR 101 HH TYR 101 -9.274 21.556 0.361 690 H GLN 102 HN GLN 102 -5.055 16.016 -3.271 691 HA GLN 102 HA GLN 102 -3.805 15.444 -5.825 692 HB2 GLN 102 HB1 GLN 102 -3.032 14.738 -2.981 693 HB3 GLN 102 HB2 GLN 102 -2.023 14.392 -4.384 694 HG2 GLN 102 HG1 GLN 102 -2.242 16.899 -4.938 695 HG3 GLN 102 HG2 GLN 102 -2.848 17.083 -3.293 696 HE21 GLN 102 HE21 GLN 102 -0.382 18.292 -4.064 697 HE22 GLN 102 HE22 GLN 102 0.859 17.536 -3.189 698 H THR 103 HN THR 103 -5.908 13.674 -3.719 699 HA THR 103 HA THR 103 -5.105 11.121 -5.041 700 HB THR 103 HB THR 103 -6.187 9.977 -3.210 701 HG1 THR 103 HG1 THR 103 -7.084 11.429 -1.524 702 HG21 THR 103 HG21 THR 103 -4.080 10.472 -2.423 703 HG22 THR 103 HG22 THR 103 -5.036 11.363 -1.239 704 HG23 THR 103 HG23 THR 103 -4.307 12.211 -2.603 705 H THR 104 HN THR 104 -8.189 12.628 -3.911 706 HA THR 104 HA THR 104 -9.415 11.525 -6.412 707 HB THR 104 HB THR 104 -10.068 10.246 -4.368 708 HG1 THR 104 HG1 THR 104 -11.990 11.804 -5.733 709 HG21 THR 104 HG21 THR 104 -11.198 11.262 -2.575 710 HG22 THR 104 HG22 THR 104 -11.576 12.706 -3.510 711 HG23 THR 104 HG23 THR 104 -9.927 12.422 -2.954 712 H GLY 105 HN GLY 105 -9.711 14.027 -3.878 713 HA2 GLY 105 HA2 GLY 105 -10.025 16.374 -4.597 714 HA3 GLY 105 HA1 GLY 105 -10.974 15.771 -5.952 715 H VAL 106 HN VAL 106 -11.103 14.965 -2.471 716 HA VAL 106 HA VAL 106 -14.019 15.564 -2.565 717 HB VAL 106 HB VAL 106 -12.406 14.007 -0.519 718 HG11 VAL 106 HG21 VAL 106 -14.295 14.816 0.628 719 HG12 VAL 106 HG22 VAL 106 -14.827 13.239 0.048 720 HG13 VAL 106 HG23 VAL 106 -15.324 14.703 -0.800 721 HG21 VAL 106 HG11 VAL 106 -14.390 12.491 -1.954 722 HG22 VAL 106 HG12 VAL 106 -12.650 12.218 -1.862 723 HG23 VAL 106 HG13 VAL 106 -13.312 13.279 -3.105 724 H VAL 107 HN VAL 107 -14.870 16.533 -0.455 725 HA VAL 107 HA VAL 107 -13.533 19.018 0.064 726 HB VAL 107 HB VAL 107 -15.242 19.304 1.818 727 HG11 VAL 107 HG21 VAL 107 -16.806 19.716 0.233 728 HG12 VAL 107 HG22 VAL 107 -16.925 18.010 -0.198 729 HG13 VAL 107 HG23 VAL 107 -15.663 19.014 -0.913 730 HG21 VAL 107 HG11 VAL 107 -16.910 17.184 1.747 731 HG22 VAL 107 HG12 VAL 107 -15.595 17.312 2.914 732 HG23 VAL 107 HG13 VAL 107 -15.383 16.351 1.449 733 H ASN 108 HN ASN 108 -11.783 19.316 1.345 734 HA ASN 108 HA ASN 108 -10.748 17.232 3.063 735 HB2 ASN 108 HB1 ASN 108 -9.033 18.857 3.653 736 HB3 ASN 108 HB2 ASN 108 -9.332 18.946 1.917 737 HD21 ASN 108 HD21 ASN 108 -8.561 21.017 4.200 738 HD22 ASN 108 HD22 ASN 108 -9.520 22.350 3.772 739 H SER 109 HN SER 109 -12.924 19.902 3.526 740 HA SER 109 HA SER 109 -12.574 20.213 6.362 741 HB2 SER 109 HB1 SER 109 -14.662 21.458 6.290 742 HB3 SER 109 HB2 SER 109 -13.693 21.883 4.880 743 HG SER 109 HG SER 109 -14.922 20.401 3.673 744 H ARG 110 HN ARG 110 -14.651 18.067 4.433 745 HA ARG 110 HA ARG 110 -16.339 17.221 6.571 746 HB2 ARG 110 HB1 ARG 110 -16.816 16.717 4.205 747 HB3 ARG 110 HB2 ARG 110 -15.419 15.644 4.150 748 HG2 ARG 110 HG2 ARG 110 -17.296 14.222 4.537 749 HG3 ARG 110 HG1 ARG 110 -16.502 14.384 6.104 750 HD2 ARG 110 HD2 ARG 110 -18.096 16.214 6.681 751 HD3 ARG 110 HD1 ARG 110 -18.922 15.943 5.147 752 HE ARG 110 HE ARG 110 -18.965 14.120 7.480 753 HH11 ARG 110 HH11 ARG 110 -21.095 15.423 5.470 754 HH12 ARG 110 HH12 ARG 110 -21.739 13.960 4.802 755 HH21 ARG 110 HH21 ARG 110 -19.213 11.954 6.076 756 HH22 ARG 110 HH22 ARG 110 -20.674 11.996 5.146 757 H PHE 111 HN PHE 111 -13.413 15.592 5.270 758 HA PHE 111 HA PHE 111 -13.372 13.707 7.484 759 HB2 PHE 111 HB1 PHE 111 -12.439 13.255 5.181 760 HB3 PHE 111 HB2 PHE 111 -11.115 14.350 5.575 761 HD1 PHE 111 HD2 PHE 111 -12.862 11.259 6.731 762 HD2 PHE 111 HD1 PHE 111 -9.268 13.609 6.852 763 HE1 PHE 111 HE2 PHE 111 -11.703 9.426 7.935 764 HE2 PHE 111 HE1 PHE 111 -8.110 11.776 8.056 765 HZ PHE 111 HZ PHE 111 -9.328 9.685 8.597 766 H ILE 112 HN ILE 112 -11.221 16.415 6.554 767 HA ILE 112 HA ILE 112 -9.548 16.333 8.826 768 HB ILE 112 HB ILE 112 -10.449 18.761 7.251 769 HG12 ILE 112 HG12 ILE 112 -8.156 16.812 6.905 770 HG13 ILE 112 HG11 ILE 112 -9.472 17.120 5.773 771 HG21 ILE 112 HG21 ILE 112 -8.961 19.993 8.435 772 HG22 ILE 112 HG22 ILE 112 -7.755 18.707 8.412 773 HG23 ILE 112 HG23 ILE 112 -9.034 18.694 9.626 774 HD11 ILE 112 HD11 ILE 112 -8.686 19.456 5.514 775 HD12 ILE 112 HD12 ILE 112 -7.434 18.301 5.061 776 HD13 ILE 112 HD13 ILE 112 -7.354 19.122 6.620 777 H SER 113 HN SER 113 -12.802 17.607 8.483 778 HA SER 113 HA SER 113 -12.875 19.291 10.769 779 HB2 SER 113 HB1 SER 113 -14.756 19.378 9.323 780 HB3 SER 113 HB2 SER 113 -14.988 17.631 9.390 781 HG SER 113 HG SER 113 -15.846 19.582 11.095 782 H GLU 114 HN GLU 114 -13.421 15.786 10.470 783 HA GLU 114 HA GLU 114 -14.036 15.444 13.283 784 HB2 GLU 114 HB2 GLU 114 -13.122 13.409 11.227 785 HB3 GLU 114 HB1 GLU 114 -13.828 13.038 12.800 786 HG2 GLU 114 HG2 GLU 114 -15.903 14.190 12.157 787 HG3 GLU 114 HG1 GLU 114 -15.198 14.610 10.596 788 H ILE 115 HN ILE 115 -11.090 15.187 11.329 789 HA ILE 115 HA ILE 115 -9.465 14.004 13.380 790 HB ILE 115 HB ILE 115 -8.677 15.718 11.008 791 HG12 ILE 115 HG11 ILE 115 -8.890 12.720 11.419 792 HG13 ILE 115 HG12 ILE 115 -9.856 13.707 10.320 793 HG21 ILE 115 HG21 ILE 115 -6.644 13.890 11.700 794 HG22 ILE 115 HG22 ILE 115 -7.150 14.635 13.216 795 HG23 ILE 115 HG23 ILE 115 -6.599 15.644 11.879 796 HD11 ILE 115 HD11 ILE 115 -7.429 12.420 9.728 797 HD12 ILE 115 HD12 ILE 115 -7.021 14.130 9.868 798 HD13 ILE 115 HD13 ILE 115 -8.262 13.611 8.728 799 H ARG 116 HN ARG 116 -10.044 17.411 12.473 800 HA ARG 116 HA ARG 116 -8.106 18.605 14.132 801 HB2 ARG 116 HB2 ARG 116 -9.268 20.613 13.845 802 HB3 ARG 116 HB1 ARG 116 -9.837 19.673 12.468 803 HG2 ARG 116 HG2 ARG 116 -11.823 18.979 13.814 804 HG3 ARG 116 HG1 ARG 116 -11.270 20.026 15.119 805 HD2 ARG 116 HD2 ARG 116 -11.432 21.982 13.654 806 HD3 ARG 116 HD1 ARG 116 -11.900 20.954 12.299 807 HE ARG 116 HE ARG 116 -14.041 20.576 13.387 808 HH11 ARG 116 HH11 ARG 116 -12.786 23.556 13.891 809 HH12 ARG 116 HH12 ARG 116 -13.615 23.893 15.374 810 HH21 ARG 116 HH21 ARG 116 -14.739 20.640 15.793 811 HH22 ARG 116 HH22 ARG 116 -14.721 22.242 16.451 812 H SER 117 HN SER 117 -11.399 17.536 14.969 813 HA SER 117 HA SER 117 -11.220 18.418 17.719 814 HB2 SER 117 HB1 SER 117 -13.271 17.173 18.052 815 HB3 SER 117 HB2 SER 117 -13.370 17.972 16.483 816 HG SER 117 HG SER 117 -13.962 15.888 16.140 817 H LEU 118 HN LEU 118 -10.444 15.421 16.021 818 HA LEU 118 HA LEU 118 -10.094 13.795 18.363 819 HB2 LEU 118 HB2 LEU 118 -8.884 13.596 15.591 820 HB3 LEU 118 HB1 LEU 118 -8.715 12.355 16.832 821 HG LEU 118 HG LEU 118 -11.452 13.363 16.119 822 HD11 LEU 118 HD21 LEU 118 -11.119 11.043 14.633 823 HD12 LEU 118 HD22 LEU 118 -9.616 11.922 14.350 824 HD13 LEU 118 HD23 LEU 118 -11.165 12.681 13.980 825 HD21 LEU 118 HD11 LEU 118 -11.186 10.532 16.515 826 HD22 LEU 118 HD12 LEU 118 -12.031 11.704 17.526 827 HD23 LEU 118 HD13 LEU 118 -10.322 11.368 17.805 828 H ILE 119 HN ILE 119 -7.892 15.912 16.547 829 HA ILE 119 HA ILE 119 -5.491 15.155 17.891 830 HB ILE 119 HB ILE 119 -6.221 17.891 16.802 831 HG12 ILE 119 HG12 ILE 119 -4.762 15.642 15.396 832 HG13 ILE 119 HG11 ILE 119 -6.493 15.917 15.214 833 HG21 ILE 119 HG21 ILE 119 -4.174 17.674 18.296 834 HG22 ILE 119 HG22 ILE 119 -3.850 18.260 16.665 835 HG23 ILE 119 HG23 ILE 119 -3.503 16.582 17.084 836 HD11 ILE 119 HD11 ILE 119 -5.135 17.015 13.418 837 HD12 ILE 119 HD12 ILE 119 -4.361 18.001 14.659 838 HD13 ILE 119 HD13 ILE 119 -6.091 18.162 14.357 839 H GLY 120 HN GLY 120 -8.055 17.438 18.750 840 HA2 GLY 120 HA2 GLY 120 -6.672 18.611 20.989 841 HA3 GLY 120 HA1 GLY 120 -8.417 18.649 20.730 842 H MET 121 HN MET 121 -8.699 15.745 20.595 843 HA MET 121 HA MET 121 -9.133 15.170 23.352 844 HB2 MET 121 HB1 MET 121 -10.273 14.005 21.457 845 HB3 MET 121 HB2 MET 121 -8.757 13.182 21.091 846 HG2 MET 121 HG1 MET 121 -8.754 12.252 23.412 847 HG3 MET 121 HG2 MET 121 -10.331 12.996 23.678 848 HE1 MET 121 HE1 MET 121 -12.286 12.709 22.320 849 HE2 MET 121 HE2 MET 121 -12.725 11.305 21.351 850 HE3 MET 121 HE3 MET 121 -11.704 12.561 20.657 851 H PHE 122 HN PHE 122 -6.476 14.235 21.164 852 HA PHE 122 HA PHE 122 -5.057 12.597 23.002 853 HB2 PHE 122 HB2 PHE 122 -4.023 14.365 20.766 854 HB3 PHE 122 HB1 PHE 122 -3.051 13.160 21.610 855 HD1 PHE 122 HD2 PHE 122 -3.678 10.736 21.482 856 HD2 PHE 122 HD1 PHE 122 -5.625 13.733 19.100 857 HE1 PHE 122 HE2 PHE 122 -4.572 8.969 19.989 858 HE2 PHE 122 HE1 PHE 122 -6.518 11.967 17.605 859 HZ PHE 122 HZ PHE 122 -5.991 9.583 18.051 860 H ALA 123 HN ALA 123 -4.679 16.088 22.311 861 HA ALA 123 HA ALA 123 -2.641 16.636 24.177 862 HB1 ALA 123 HB1 ALA 123 -4.779 18.204 22.850 863 HB2 ALA 123 HB2 ALA 123 -3.051 18.536 22.975 864 HB3 ALA 123 HB3 ALA 123 -4.121 18.910 24.326 865 H GLN 124 HN GLN 124 -6.088 16.145 24.683 866 HA GLN 124 HA GLN 124 -6.130 17.118 27.405 867 HB2 GLN 124 HB2 GLN 124 -7.964 15.176 25.967 868 HB3 GLN 124 HB1 GLN 124 -8.295 15.895 27.544 869 HG2 GLN 124 HG2 GLN 124 -7.846 17.446 24.975 870 HG3 GLN 124 HG1 GLN 124 -9.418 17.144 25.718 871 HE21 GLN 124 HE21 GLN 124 -7.375 19.622 25.385 872 HE22 GLN 124 HE22 GLN 124 -7.569 20.391 26.884 873 H ALA 125 HN ALA 125 -5.428 14.004 25.909 874 HA ALA 125 HA ALA 125 -5.581 12.349 28.205 875 HB1 ALA 125 HB1 ALA 125 -4.965 11.895 25.618 876 HB2 ALA 125 HB2 ALA 125 -4.574 10.751 26.901 877 HB3 ALA 125 HB3 ALA 125 -3.341 11.863 26.307 878 H SER 126 HN SER 126 -3.092 14.612 27.162 879 HA SER 126 HA SER 126 -0.961 13.764 28.825 880 HB2 SER 126 HB2 SER 126 -0.844 15.566 27.066 881 HB3 SER 126 HB1 SER 126 -1.681 16.640 28.187 882 HG SER 126 HG SER 126 0.085 15.982 29.694 883 H ALA 127 HN ALA 127 -3.819 15.714 29.565 884 HA ALA 127 HA ALA 127 -3.034 16.626 32.142 885 HB1 ALA 127 HB1 ALA 127 -5.285 16.881 30.577 886 HB2 ALA 127 HB2 ALA 127 -5.150 17.445 32.242 887 HB3 ALA 127 HB3 ALA 127 -5.868 15.870 31.900 888 H ASN 128 HN ASN 128 -4.156 13.498 31.036 889 HA ASN 128 HA ASN 128 -5.023 12.348 33.458 890 HB2 ASN 128 HB2 ASN 128 -3.397 11.025 31.264 891 HB3 ASN 128 HB1 ASN 128 -4.357 10.184 32.482 892 HD21 ASN 128 HD21 ASN 128 -4.706 10.318 29.457 893 HD22 ASN 128 HD22 ASN 128 -6.319 10.804 29.253 894 H ASP 129 HN ASP 129 -1.869 13.409 32.554 895 HA ASP 129 HA ASP 129 -0.284 11.691 34.203 896 HB2 ASP 129 HB2 ASP 129 0.159 14.545 33.285 897 HB3 ASP 129 HB1 ASP 129 1.380 13.583 34.120 898 H VAL 130 HN VAL 130 -2.083 14.662 34.903 899 HA VAL 130 HA VAL 130 -0.978 15.096 37.514 900 HB VAL 130 HB VAL 130 -2.240 16.847 36.359 901 HG11 VAL 130 HG11 VAL 130 -4.088 16.244 35.221 902 HG12 VAL 130 HG12 VAL 130 -4.921 16.110 36.769 903 HG13 VAL 130 HG13 VAL 130 -4.156 14.691 36.055 904 HG21 VAL 130 HG21 VAL 130 -2.778 15.924 39.057 905 HG22 VAL 130 HG22 VAL 130 -4.168 16.787 38.401 906 HG23 VAL 130 HG23 VAL 130 -2.591 17.574 38.463 907 H TYR 131 HN TYR 131 -3.504 12.977 36.311 908 HA TYR 131 HA TYR 131 -3.422 11.247 38.547 909 HB2 TYR 131 HB2 TYR 131 -5.411 11.797 39.787 910 HB3 TYR 131 HB1 TYR 131 -4.445 13.267 39.683 911 HD1 TYR 131 HD2 TYR 131 -7.417 11.503 38.353 912 HD2 TYR 131 HD1 TYR 131 -5.182 15.171 38.399 913 HE1 TYR 131 HE2 TYR 131 -9.309 12.672 37.252 914 HE2 TYR 131 HE1 TYR 131 -7.072 16.338 37.299 915 HH TYR 131 HH TYR 131 -10.157 14.704 36.728 916 H ALA 132 HN ALA 132 -5.151 9.579 38.414 917 HA ALA 132 HA ALA 132 -5.791 8.989 35.660 918 HB1 ALA 132 HB1 ALA 132 -5.750 7.584 38.132 919 HB2 ALA 132 HB2 ALA 132 -5.990 6.917 36.516 920 HB3 ALA 132 HB3 ALA 132 -7.379 7.427 37.475 921 H SER 133 HN SER 133 -7.420 9.953 34.568 922 HA SER 133 HA SER 133 -9.457 11.544 35.750 923 HB2 SER 133 HB2 SER 133 -10.398 11.696 33.577 924 HB3 SER 133 HB1 SER 133 -8.671 11.480 33.294 925 HG SER 133 HG SER 133 -9.168 9.183 33.152 926 H ALA 134 HN ALA 134 -11.789 11.077 35.853 927 HA ALA 134 HA ALA 134 -13.499 9.741 36.776 928 HB1 ALA 134 HB1 ALA 134 -14.302 8.617 35.001 929 HB2 ALA 134 HB2 ALA 134 -13.060 7.381 35.200 930 HB3 ALA 134 HB3 ALA 134 -12.741 8.799 34.201 931 H GLY 135 HN GLY 135 -13.752 7.018 37.171 932 HA2 GLY 135 HA2 GLY 135 -12.862 5.159 38.359 933 HA3 GLY 135 HA1 GLY 135 -11.316 6.001 38.465 934 H SER 136 HN SER 136 -11.695 5.050 40.784 935 HA SER 136 HA SER 136 -13.111 7.138 42.395 936 HB2 SER 136 HB2 SER 136 -14.250 4.919 42.475 937 HB3 SER 136 HB1 SER 136 -12.763 4.209 43.103 938 HG SER 136 HG SER 136 -14.667 5.402 44.459 939 H GLY 137 HN GLY 137 -11.959 7.972 44.143 940 HA2 GLY 137 HA2 GLY 137 -9.145 7.967 44.100 941 HA3 GLY 137 HA1 GLY 137 -10.103 8.410 45.514 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 -11.721 -3.078 -8.366 2 H2 GLY 1 HT2 GLY 1 -11.753 -4.553 -9.208 3 H3 GLY 1 HT3 GLY 1 -12.792 -3.288 -9.664 4 HA2 GLY 1 HA2 GLY 1 -10.014 -2.543 -9.675 5 HA3 GLY 1 HA1 GLY 1 -10.411 -3.829 -10.815 6 H MET 2 HN MET 2 -12.655 -1.311 -9.760 7 HA MET 2 HA MET 2 -13.514 -0.684 -12.395 8 HB2 MET 2 HB2 MET 2 -13.606 0.985 -9.864 9 HB3 MET 2 HB1 MET 2 -14.471 1.383 -11.349 10 HG2 MET 2 HG2 MET 2 -15.617 -0.832 -11.226 11 HG3 MET 2 HG1 MET 2 -14.816 -1.128 -9.682 12 HE1 MET 2 HE1 MET 2 -17.801 -0.786 -8.012 13 HE2 MET 2 HE2 MET 2 -17.027 -1.754 -9.266 14 HE3 MET 2 HE3 MET 2 -18.455 -0.798 -9.656 15 H GLY 3 HN GLY 3 -10.988 0.761 -10.365 16 HA2 GLY 3 HA2 GLY 3 -9.001 1.769 -11.316 17 HA3 GLY 3 HA1 GLY 3 -9.896 2.053 -12.808 18 H GLN 4 HN GLN 4 -11.946 2.872 -10.345 19 HA GLN 4 HA GLN 4 -11.018 5.717 -10.376 20 HB2 GLN 4 HB2 GLN 4 -13.849 4.626 -10.402 21 HB3 GLN 4 HB1 GLN 4 -13.436 6.332 -10.232 22 HG2 GLN 4 HG2 GLN 4 -13.855 6.066 -12.548 23 HG3 GLN 4 HG1 GLN 4 -12.096 6.027 -12.421 24 HE21 GLN 4 HE21 GLN 4 -11.114 4.256 -13.413 25 HE22 GLN 4 HE22 GLN 4 -11.887 2.787 -13.771 26 H ALA 5 HN ALA 5 -11.457 6.927 -8.418 27 HA ALA 5 HA ALA 5 -12.365 5.364 -6.073 28 HB1 ALA 5 HB1 ALA 5 -9.731 6.854 -6.010 29 HB2 ALA 5 HB2 ALA 5 -9.837 5.122 -6.328 30 HB3 ALA 5 HB3 ALA 5 -10.389 5.772 -4.783 31 H ASN 6 HN ASN 6 -14.133 6.816 -5.925 32 HA ASN 6 HA ASN 6 -13.978 9.645 -6.090 33 HB2 ASN 6 HB2 ASN 6 -15.841 8.067 -4.292 34 HB3 ASN 6 HB1 ASN 6 -16.117 9.676 -4.959 35 HD21 ASN 6 HD21 ASN 6 -15.507 9.448 -7.619 36 HD22 ASN 6 HD22 ASN 6 -16.477 8.270 -8.361 37 H THR 7 HN THR 7 -12.816 7.490 -3.685 38 HA THR 7 HA THR 7 -12.139 9.828 -1.961 39 HB THR 7 HB THR 7 -12.551 7.381 -0.431 40 HG1 THR 7 HG1 THR 7 -14.700 7.171 -0.746 41 HG21 THR 7 HG21 THR 7 -14.254 9.210 0.588 42 HG22 THR 7 HG22 THR 7 -13.184 10.277 -0.322 43 HG23 THR 7 HG23 THR 7 -12.524 9.217 0.923 44 HA PRO 8 HA PRO 8 -8.050 8.115 -2.069 45 HB2 PRO 8 HB2 PRO 8 -7.086 8.952 0.317 46 HB3 PRO 8 HB1 PRO 8 -7.319 10.032 -1.060 47 HG2 PRO 8 HG2 PRO 8 -9.070 9.599 1.328 48 HG3 PRO 8 HG1 PRO 8 -8.619 11.114 0.544 49 HD2 PRO 8 HD2 PRO 8 -11.014 9.940 0.116 50 HD3 PRO 8 HD1 PRO 8 -10.184 10.857 -1.141 51 H TRP 9 HN TRP 9 -9.963 7.522 0.882 52 HA TRP 9 HA TRP 9 -8.324 5.124 1.459 53 HB2 TRP 9 HB2 TRP 9 -9.749 4.914 3.476 54 HB3 TRP 9 HB1 TRP 9 -9.003 6.510 3.371 55 HD1 TRP 9 HD1 TRP 9 -12.348 4.720 2.932 56 HE1 TRP 9 HE1 TRP 9 -14.241 6.471 2.999 57 HE3 TRP 9 HE3 TRP 9 -9.579 9.003 3.000 58 HZ2 TRP 9 HZ2 TRP 9 -14.537 9.319 3.071 59 HZ3 TRP 9 HZ3 TRP 9 -10.686 11.219 3.065 60 HH2 TRP 9 HH2 TRP 9 -13.159 11.382 3.104 61 H SER 10 HN SER 10 -11.081 5.959 -0.325 62 HA SER 10 HA SER 10 -12.608 3.525 0.057 63 HB2 SER 10 HB1 SER 10 -12.607 5.718 -2.012 64 HB3 SER 10 HB2 SER 10 -13.599 4.277 -2.223 65 HG SER 10 HG SER 10 -14.432 4.734 -0.081 66 H SER 11 HN SER 11 -9.623 4.075 -1.355 67 HA SER 11 HA SER 11 -9.832 1.515 -2.852 68 HB2 SER 11 HB1 SER 11 -10.002 3.714 -4.307 69 HB3 SER 11 HB2 SER 11 -8.256 3.767 -4.058 70 HG SER 11 HG SER 11 -9.122 2.545 -5.940 71 H LYS 12 HN LYS 12 -7.763 0.436 -3.067 72 HA LYS 12 HA LYS 12 -5.995 0.908 -0.813 73 HB2 LYS 12 HB1 LYS 12 -6.587 -1.320 -2.124 74 HB3 LYS 12 HB2 LYS 12 -5.206 -0.846 -3.111 75 HG2 LYS 12 HG2 LYS 12 -3.826 -0.663 -1.051 76 HG3 LYS 12 HG1 LYS 12 -5.205 -1.209 -0.098 77 HD2 LYS 12 HD2 LYS 12 -3.732 -3.106 -0.568 78 HD3 LYS 12 HD1 LYS 12 -5.255 -3.312 -1.434 79 HE2 LYS 12 HE2 LYS 12 -3.000 -1.896 -2.811 80 HE3 LYS 12 HE1 LYS 12 -2.942 -3.655 -2.684 81 HZ1 LYS 12 HZ1 LYS 12 -5.528 -2.799 -3.451 82 HZ2 LYS 12 HZ2 LYS 12 -4.459 -3.837 -4.266 83 HZ3 LYS 12 HZ3 LYS 12 -4.371 -2.158 -4.512 84 H ALA 13 HN ALA 13 -5.783 1.440 -4.317 85 HA ALA 13 HA ALA 13 -3.039 2.435 -4.137 86 HB1 ALA 13 HB1 ALA 13 -3.166 2.739 -6.477 87 HB2 ALA 13 HB2 ALA 13 -4.920 2.917 -6.446 88 HB3 ALA 13 HB3 ALA 13 -4.190 1.333 -6.184 89 H ASN 14 HN ASN 14 -6.286 3.795 -4.192 90 HA ASN 14 HA ASN 14 -5.436 6.539 -4.562 91 HB2 ASN 14 HB1 ASN 14 -7.813 5.433 -4.836 92 HB3 ASN 14 HB2 ASN 14 -7.968 5.810 -3.120 93 HD21 ASN 14 HD21 ASN 14 -9.698 7.385 -3.917 94 HD22 ASN 14 HD22 ASN 14 -9.198 8.915 -4.455 95 H ALA 15 HN ALA 15 -5.810 4.414 -1.796 96 HA ALA 15 HA ALA 15 -5.768 6.477 0.216 97 HB1 ALA 15 HB1 ALA 15 -5.468 4.702 1.792 98 HB2 ALA 15 HB2 ALA 15 -4.798 3.633 0.558 99 HB3 ALA 15 HB3 ALA 15 -6.510 4.057 0.524 100 H ASP 16 HN ASP 16 -3.232 4.452 -1.238 101 HA ASP 16 HA ASP 16 -1.068 5.262 0.373 102 HB2 ASP 16 HB2 ASP 16 -1.091 3.516 -1.511 103 HB3 ASP 16 HB1 ASP 16 -0.834 4.867 -2.615 104 H ALA 17 HN ALA 17 -2.039 6.727 -2.763 105 HA ALA 17 HA ALA 17 -0.240 8.882 -2.736 106 HB1 ALA 17 HB1 ALA 17 -2.739 8.234 -4.080 107 HB2 ALA 17 HB2 ALA 17 -1.358 9.156 -4.676 108 HB3 ALA 17 HB3 ALA 17 -2.619 9.961 -3.742 109 H PHE 18 HN PHE 18 -3.306 8.498 -1.015 110 HA PHE 18 HA PHE 18 -3.456 11.217 -0.066 111 HB2 PHE 18 HB1 PHE 18 -5.344 9.503 -0.098 112 HB3 PHE 18 HB2 PHE 18 -4.587 8.775 1.318 113 HD1 PHE 18 HD2 PHE 18 -5.988 11.974 -0.001 114 HD2 PHE 18 HD1 PHE 18 -4.903 9.696 3.475 115 HE1 PHE 18 HE2 PHE 18 -7.072 13.670 1.448 116 HE2 PHE 18 HE1 PHE 18 -5.986 11.392 4.925 117 HZ PHE 18 HZ PHE 18 -7.071 13.379 3.911 118 H ILE 19 HN ILE 19 -2.378 8.195 1.540 119 HA ILE 19 HA ILE 19 -1.468 9.447 3.932 120 HB ILE 19 HB ILE 19 -0.196 7.007 2.670 121 HG12 ILE 19 HG12 ILE 19 -2.525 6.536 2.550 122 HG13 ILE 19 HG11 ILE 19 -1.981 5.775 4.043 123 HG21 ILE 19 HG21 ILE 19 -0.655 6.799 5.471 124 HG22 ILE 19 HG22 ILE 19 0.058 8.384 5.174 125 HG23 ILE 19 HG23 ILE 19 0.894 6.927 4.635 126 HD11 ILE 19 HD11 ILE 19 -3.459 8.399 3.738 127 HD12 ILE 19 HD12 ILE 19 -2.676 7.914 5.241 128 HD13 ILE 19 HD13 ILE 19 -3.999 6.950 4.585 129 H ASN 20 HN ASN 20 0.241 8.704 0.893 130 HA ASN 20 HA ASN 20 2.782 9.739 1.762 131 HB2 ASN 20 HB2 ASN 20 2.897 8.332 -0.107 132 HB3 ASN 20 HB1 ASN 20 1.538 9.111 -0.908 133 HD21 ASN 20 HD21 ASN 20 2.404 10.026 -2.782 134 HD22 ASN 20 HD22 ASN 20 3.758 11.051 -2.814 135 H SER 21 HN SER 21 0.201 11.162 -0.271 136 HA SER 21 HA SER 21 1.407 13.710 -0.598 137 HB2 SER 21 HB2 SER 21 -0.625 12.941 -1.830 138 HB3 SER 21 HB1 SER 21 -1.556 13.098 -0.341 139 HG SER 21 HG SER 21 -1.273 15.261 -0.371 140 H PHE 22 HN PHE 22 -0.340 12.278 2.075 141 HA PHE 22 HA PHE 22 -0.762 14.749 3.524 142 HB2 PHE 22 HB1 PHE 22 -2.158 12.872 4.075 143 HB3 PHE 22 HB2 PHE 22 -0.757 11.844 4.376 144 HD1 PHE 22 HD2 PHE 22 0.731 12.303 6.338 145 HD2 PHE 22 HD1 PHE 22 -2.972 14.393 5.733 146 HE1 PHE 22 HE2 PHE 22 0.766 13.048 8.704 147 HE2 PHE 22 HE1 PHE 22 -2.938 15.138 8.097 148 HZ PHE 22 HZ PHE 22 -1.068 14.465 9.583 149 H ILE 23 HN ILE 23 1.596 12.079 3.939 150 HA ILE 23 HA ILE 23 3.085 13.350 6.015 151 HB ILE 23 HB ILE 23 4.102 11.430 3.908 152 HG12 ILE 23 HG12 ILE 23 2.981 10.809 6.653 153 HG13 ILE 23 HG11 ILE 23 2.046 10.670 5.164 154 HG21 ILE 23 HG21 ILE 23 6.015 11.270 5.126 155 HG22 ILE 23 HG22 ILE 23 5.147 11.333 6.660 156 HG23 ILE 23 HG23 ILE 23 5.527 12.825 5.799 157 HD11 ILE 23 HD11 ILE 23 4.593 9.171 5.847 158 HD12 ILE 23 HD12 ILE 23 3.788 9.103 4.279 159 HD13 ILE 23 HD13 ILE 23 2.973 8.486 5.716 160 H SER 24 HN SER 24 3.855 13.126 2.517 161 HA SER 24 HA SER 24 6.095 14.833 2.538 162 HB2 SER 24 HB2 SER 24 4.009 14.677 0.343 163 HB3 SER 24 HB1 SER 24 5.693 15.165 0.164 164 HG SER 24 HG SER 24 6.334 13.143 0.365 165 H ALA 25 HN ALA 25 2.646 15.645 2.418 166 HA ALA 25 HA ALA 25 3.152 18.494 2.069 167 HB1 ALA 25 HB1 ALA 25 1.056 17.786 1.239 168 HB2 ALA 25 HB2 ALA 25 0.653 18.606 2.748 169 HB3 ALA 25 HB3 ALA 25 0.704 16.843 2.687 170 H ALA 26 HN ALA 26 1.970 16.496 4.801 171 HA ALA 26 HA ALA 26 1.864 18.603 6.703 172 HB1 ALA 26 HB1 ALA 26 1.851 16.876 8.395 173 HB2 ALA 26 HB2 ALA 26 2.574 15.716 7.281 174 HB3 ALA 26 HB3 ALA 26 0.928 16.289 7.011 175 H SER 27 HN SER 27 4.585 16.826 5.434 176 HA SER 27 HA SER 27 6.429 17.413 7.561 177 HB2 SER 27 HB2 SER 27 8.176 16.901 5.837 178 HB3 SER 27 HB1 SER 27 6.936 15.654 5.965 179 HG SER 27 HG SER 27 5.952 17.240 4.234 180 H ASN 28 HN ASN 28 5.433 19.186 4.677 181 HA ASN 28 HA ASN 28 7.375 21.337 5.386 182 HB2 ASN 28 HB2 ASN 28 5.769 20.919 2.848 183 HB3 ASN 28 HB1 ASN 28 6.946 22.204 3.116 184 HD21 ASN 28 HD21 ASN 28 7.227 20.193 1.036 185 HD22 ASN 28 HD22 ASN 28 8.631 19.306 1.392 186 H THR 29 HN THR 29 4.339 20.587 6.234 187 HA THR 29 HA THR 29 3.090 23.193 5.669 188 HB THR 29 HB THR 29 2.010 21.023 7.474 189 HG1 THR 29 HG1 THR 29 2.365 20.005 5.582 190 HG21 THR 29 HG21 THR 29 0.342 22.721 5.696 191 HG22 THR 29 HG22 THR 29 1.093 23.517 7.079 192 HG23 THR 29 HG23 THR 29 0.019 22.145 7.329 193 H GLY 30 HN GLY 30 3.174 21.464 8.793 194 HA2 GLY 30 HA2 GLY 30 3.468 24.042 10.164 195 HA3 GLY 30 HA1 GLY 30 3.245 22.472 10.938 196 H SER 31 HN SER 31 5.049 21.372 11.643 197 HA SER 31 HA SER 31 7.719 22.328 10.755 198 HB2 SER 31 HB2 SER 31 8.500 22.401 13.107 199 HB3 SER 31 HB1 SER 31 7.216 23.574 12.816 200 HG SER 31 HG SER 31 6.655 22.513 14.650 201 H PHE 32 HN PHE 32 6.092 20.008 12.951 202 HA PHE 32 HA PHE 32 6.662 17.765 13.419 203 HB2 PHE 32 HB1 PHE 32 6.681 18.077 10.433 204 HB3 PHE 32 HB2 PHE 32 7.182 16.539 11.136 205 HD1 PHE 32 HD2 PHE 32 5.565 15.760 13.176 206 HD2 PHE 32 HD1 PHE 32 4.411 18.275 9.880 207 HE1 PHE 32 HE2 PHE 32 3.199 15.120 13.515 208 HE2 PHE 32 HE1 PHE 32 2.046 17.629 10.225 209 HZ PHE 32 HZ PHE 32 1.437 16.051 12.043 210 H SER 33 HN SER 33 8.614 18.038 14.607 211 HA SER 33 HA SER 33 11.163 18.598 13.481 212 HB2 SER 33 HB2 SER 33 10.643 18.656 15.924 213 HB3 SER 33 HB1 SER 33 10.569 16.894 15.919 214 HG SER 33 HG SER 33 12.622 17.201 16.391 215 H GLN 34 HN GLN 34 12.975 17.060 13.176 216 HA GLN 34 HA GLN 34 12.405 14.977 11.379 217 HB2 GLN 34 HB1 GLN 34 14.677 16.073 11.940 218 HB3 GLN 34 HB2 GLN 34 14.782 14.883 13.238 219 HG2 GLN 34 HG2 GLN 34 14.414 13.078 11.539 220 HG3 GLN 34 HG1 GLN 34 14.472 14.306 10.276 221 HE21 GLN 34 HE21 GLN 34 16.501 14.169 9.298 222 HE22 GLN 34 HE22 GLN 34 17.970 13.964 10.123 223 H ASP 35 HN ASP 35 12.732 14.863 14.910 224 HA ASP 35 HA ASP 35 12.592 12.011 15.158 225 HB2 ASP 35 HB1 ASP 35 11.796 14.236 17.057 226 HB3 ASP 35 HB2 ASP 35 11.800 12.529 17.503 227 H GLN 36 HN GLN 36 10.110 14.534 14.953 228 HA GLN 36 HA GLN 36 7.916 12.679 15.438 229 HB2 GLN 36 HB1 GLN 36 7.780 15.399 14.110 230 HB3 GLN 36 HB2 GLN 36 6.478 14.543 14.936 231 HG2 GLN 36 HG1 GLN 36 9.024 15.571 16.228 232 HG3 GLN 36 HG2 GLN 36 7.422 16.287 16.397 233 HE21 GLN 36 HE21 GLN 36 9.402 14.686 18.296 234 HE22 GLN 36 HE22 GLN 36 8.367 13.576 19.056 235 H MET 37 HN MET 37 9.545 14.037 12.606 236 HA MET 37 HA MET 37 7.692 13.078 10.642 237 HB2 MET 37 HB2 MET 37 10.685 13.526 10.400 238 HB3 MET 37 HB1 MET 37 9.562 13.353 9.051 239 HG2 MET 37 HG2 MET 37 8.292 15.334 9.966 240 HG3 MET 37 HG1 MET 37 9.596 15.556 11.132 241 HE1 MET 37 HE1 MET 37 9.219 14.583 7.381 242 HE2 MET 37 HE2 MET 37 9.705 16.077 6.585 243 HE3 MET 37 HE3 MET 37 8.283 16.064 7.625 244 H GLU 38 HN GLU 38 10.492 11.596 12.231 245 HA GLU 38 HA GLU 38 10.708 9.267 10.633 246 HB2 GLU 38 HB1 GLU 38 11.236 9.761 13.569 247 HB3 GLU 38 HB2 GLU 38 11.553 8.201 12.810 248 HG2 GLU 38 HG2 GLU 38 12.987 9.375 11.123 249 HG3 GLU 38 HG1 GLU 38 12.751 10.874 12.022 250 H ASN 39 HN ASN 39 8.589 9.972 13.403 251 HA ASN 39 HA ASN 39 7.424 7.410 13.695 252 HB2 ASN 39 HB1 ASN 39 7.061 9.501 15.144 253 HB3 ASN 39 HB2 ASN 39 5.871 9.991 13.940 254 HD21 ASN 39 HD21 ASN 39 4.842 9.531 16.446 255 HD22 ASN 39 HD22 ASN 39 4.013 8.051 16.505 256 H MET 40 HN MET 40 6.778 9.992 11.384 257 HA MET 40 HA MET 40 4.371 9.007 10.258 258 HB2 MET 40 HB2 MET 40 6.666 10.401 8.843 259 HB3 MET 40 HB1 MET 40 5.018 10.256 8.233 260 HG2 MET 40 HG1 MET 40 5.908 11.716 10.736 261 HG3 MET 40 HG2 MET 40 5.256 12.440 9.266 262 HE1 MET 40 HE1 MET 40 1.629 11.303 9.116 263 HE2 MET 40 HE2 MET 40 2.958 10.344 8.469 264 HE3 MET 40 HE3 MET 40 3.004 12.100 8.339 265 H SER 41 HN SER 41 7.708 7.997 9.831 266 HA SER 41 HA SER 41 7.265 6.347 7.513 267 HB2 SER 41 HB2 SER 41 9.355 6.003 9.685 268 HB3 SER 41 HB1 SER 41 9.424 5.351 8.048 269 HG SER 41 HG SER 41 9.803 7.949 8.960 270 H LEU 42 HN LEU 42 6.636 5.935 10.911 271 HA LEU 42 HA LEU 42 6.273 3.014 10.614 272 HB2 LEU 42 HB2 LEU 42 5.797 4.780 13.033 273 HB3 LEU 42 HB1 LEU 42 5.875 3.018 13.019 274 HG LEU 42 HG LEU 42 8.141 4.891 12.269 275 HD11 LEU 42 HD11 LEU 42 7.376 3.417 14.757 276 HD12 LEU 42 HD12 LEU 42 8.137 4.999 14.582 277 HD13 LEU 42 HD13 LEU 42 9.090 3.532 14.354 278 HD21 LEU 42 HD21 LEU 42 9.006 3.101 11.211 279 HD22 LEU 42 HD22 LEU 42 7.634 2.106 11.698 280 HD23 LEU 42 HD23 LEU 42 9.037 2.255 12.758 281 H ILE 43 HN ILE 43 4.376 5.959 10.806 282 HA ILE 43 HA ILE 43 1.901 4.279 10.680 283 HB ILE 43 HB ILE 43 2.372 7.041 11.829 284 HG12 ILE 43 HG12 ILE 43 1.066 4.587 13.032 285 HG13 ILE 43 HG11 ILE 43 2.781 4.955 13.213 286 HG21 ILE 43 HG21 ILE 43 -0.282 5.640 11.377 287 HG22 ILE 43 HG22 ILE 43 0.302 7.011 10.434 288 HG23 ILE 43 HG23 ILE 43 -0.046 7.207 12.152 289 HD11 ILE 43 HD11 ILE 43 2.386 6.773 14.585 290 HD12 ILE 43 HD12 ILE 43 0.983 5.789 15.004 291 HD13 ILE 43 HD13 ILE 43 0.818 7.115 13.854 292 H GLY 44 HN GLY 44 0.232 5.040 9.203 293 HA2 GLY 44 HA1 GLY 44 -0.563 6.257 7.316 294 HA3 GLY 44 HA2 GLY 44 0.940 7.181 7.312 295 H ASN 45 HN ASN 45 2.787 6.273 6.247 296 HA ASN 45 HA ASN 45 2.241 4.724 3.920 297 HB2 ASN 45 HB2 ASN 45 4.265 6.220 4.324 298 HB3 ASN 45 HB1 ASN 45 4.932 4.913 5.303 299 HD21 ASN 45 HD21 ASN 45 6.529 5.367 3.225 300 HD22 ASN 45 HD22 ASN 45 6.292 4.268 1.954 301 H THR 46 HN THR 46 3.199 3.825 7.183 302 HA THR 46 HA THR 46 3.876 1.090 6.619 303 HB THR 46 HB THR 46 2.715 2.213 9.185 304 HG1 THR 46 HG1 THR 46 5.276 2.291 8.038 305 HG21 THR 46 HG21 THR 46 2.750 -0.138 9.356 306 HG22 THR 46 HG22 THR 46 4.273 0.358 10.093 307 HG23 THR 46 HG23 THR 46 4.254 -0.270 8.445 308 H LEU 47 HN LEU 47 0.847 2.760 7.309 309 HA LEU 47 HA LEU 47 -0.839 0.544 7.773 310 HB2 LEU 47 HB2 LEU 47 -1.524 2.945 7.955 311 HB3 LEU 47 HB1 LEU 47 -1.532 3.041 6.195 312 HG LEU 47 HG LEU 47 -3.168 1.092 6.212 313 HD11 LEU 47 HD11 LEU 47 -2.717 1.500 9.113 314 HD12 LEU 47 HD12 LEU 47 -3.209 0.046 8.243 315 HD13 LEU 47 HD13 LEU 47 -4.401 1.287 8.633 316 HD21 LEU 47 HD21 LEU 47 -3.660 3.691 6.166 317 HD22 LEU 47 HD22 LEU 47 -4.348 3.376 7.759 318 HD23 LEU 47 HD23 LEU 47 -4.984 2.541 6.343 319 H MET 48 HN MET 48 0.332 1.923 4.721 320 HA MET 48 HA MET 48 -1.256 0.482 2.902 321 HB2 MET 48 HB2 MET 48 0.443 2.237 2.302 322 HB3 MET 48 HB1 MET 48 1.708 1.042 2.591 323 HG2 MET 48 HG1 MET 48 0.664 -0.434 0.880 324 HG3 MET 48 HG2 MET 48 -0.533 0.821 0.557 325 HE1 MET 48 HE1 MET 48 0.080 0.998 -2.024 326 HE2 MET 48 HE2 MET 48 1.030 -0.431 -1.624 327 HE3 MET 48 HE3 MET 48 1.754 0.861 -2.577 328 H ALA 49 HN ALA 49 1.578 -0.569 4.744 329 HA ALA 49 HA ALA 49 1.983 -3.067 3.423 330 HB1 ALA 49 HB1 ALA 49 3.062 -3.759 5.581 331 HB2 ALA 49 HB2 ALA 49 2.480 -2.261 6.306 332 HB3 ALA 49 HB3 ALA 49 3.643 -2.206 4.982 333 H ALA 50 HN ALA 50 -0.289 -2.043 5.910 334 HA ALA 50 HA ALA 50 -1.179 -4.676 6.661 335 HB1 ALA 50 HB1 ALA 50 -3.312 -3.311 7.312 336 HB2 ALA 50 HB2 ALA 50 -2.336 -1.905 6.887 337 HB3 ALA 50 HB3 ALA 50 -1.807 -2.992 8.173 338 H MET 51 HN MET 51 -2.428 -2.281 4.326 339 HA MET 51 HA MET 51 -4.641 -3.813 3.412 340 HB2 MET 51 HB2 MET 51 -2.922 -1.893 1.808 341 HB3 MET 51 HB1 MET 51 -4.566 -2.393 1.414 342 HG2 MET 51 HG2 MET 51 -5.240 -1.478 3.708 343 HG3 MET 51 HG1 MET 51 -3.643 -0.731 3.766 344 HE1 MET 51 HE1 MET 51 -3.483 0.847 0.342 345 HE2 MET 51 HE2 MET 51 -2.671 0.050 1.688 346 HE3 MET 51 HE3 MET 51 -3.148 1.741 1.831 347 H ASP 52 HN ASP 52 -1.214 -3.996 2.669 348 HA ASP 52 HA ASP 52 -1.351 -5.542 0.285 349 HB2 ASP 52 HB2 ASP 52 0.702 -5.478 2.512 350 HB3 ASP 52 HB1 ASP 52 0.926 -6.386 1.016 351 H ASN 53 HN ASN 53 -1.719 -6.426 3.669 352 HA ASN 53 HA ASN 53 -1.454 -9.252 3.396 353 HB2 ASN 53 HB2 ASN 53 -3.235 -7.680 5.287 354 HB3 ASN 53 HB1 ASN 53 -2.792 -9.377 5.473 355 HD21 ASN 53 HD21 ASN 53 -2.109 -7.045 7.263 356 HD22 ASN 53 HD22 ASN 53 -0.416 -7.071 7.377 357 H MET 54 HN MET 54 -4.071 -7.052 2.626 358 HA MET 54 HA MET 54 -6.220 -8.895 2.453 359 HB2 MET 54 HB2 MET 54 -5.586 -6.377 0.902 360 HB3 MET 54 HB1 MET 54 -7.076 -7.285 0.653 361 HG2 MET 54 HG2 MET 54 -6.136 -6.111 3.288 362 HG3 MET 54 HG1 MET 54 -7.433 -5.472 2.279 363 HE1 MET 54 HE1 MET 54 -10.052 -8.298 2.258 364 HE2 MET 54 HE2 MET 54 -8.727 -8.032 1.128 365 HE3 MET 54 HE3 MET 54 -9.635 -6.656 1.751 366 H GLY 55 HN GLY 55 -3.561 -8.221 0.241 367 HA2 GLY 55 HA2 GLY 55 -2.752 -9.942 -1.284 368 HA3 GLY 55 HA1 GLY 55 -4.383 -10.613 -1.333 369 H GLY 56 HN GLY 56 -4.344 -7.213 -1.466 370 HA2 GLY 56 HA2 GLY 56 -4.163 -5.774 -3.422 371 HA3 GLY 56 HA1 GLY 56 -4.326 -7.202 -4.443 372 H ARG 57 HN ARG 57 -6.480 -7.324 -1.843 373 HA ARG 57 HA ARG 57 -8.654 -6.130 -3.515 374 HB2 ARG 57 HB2 ARG 57 -10.132 -7.920 -2.853 375 HB3 ARG 57 HB1 ARG 57 -8.652 -8.660 -3.462 376 HG2 ARG 57 HG2 ARG 57 -7.888 -8.558 -0.955 377 HG3 ARG 57 HG1 ARG 57 -9.613 -8.412 -0.624 378 HD2 ARG 57 HD2 ARG 57 -10.023 -10.486 -1.921 379 HD3 ARG 57 HD1 ARG 57 -8.289 -10.639 -2.202 380 HE ARG 57 HE ARG 57 -8.409 -10.516 0.526 381 HH11 ARG 57 HH11 ARG 57 -9.639 -12.510 -1.976 382 HH12 ARG 57 HH12 ARG 57 -10.141 -13.780 -0.912 383 HH21 ARG 57 HH21 ARG 57 -9.273 -12.066 1.975 384 HH22 ARG 57 HH22 ARG 57 -9.935 -13.529 1.324 385 H ILE 58 HN ILE 58 -9.328 -4.332 -2.442 386 HA ILE 58 HA ILE 58 -9.520 -4.503 0.539 387 HB ILE 58 HB ILE 58 -9.270 -1.967 -1.099 388 HG12 ILE 58 HG12 ILE 58 -7.261 -3.375 -1.404 389 HG13 ILE 58 HG11 ILE 58 -6.897 -1.969 -0.402 390 HG21 ILE 58 HG21 ILE 58 -8.771 -0.949 1.037 391 HG22 ILE 58 HG22 ILE 58 -8.722 -2.523 1.830 392 HG23 ILE 58 HG23 ILE 58 -10.253 -1.886 1.230 393 HD11 ILE 58 HD11 ILE 58 -6.797 -4.804 0.285 394 HD12 ILE 58 HD12 ILE 58 -7.783 -3.880 1.419 395 HD13 ILE 58 HD13 ILE 58 -6.103 -3.423 1.135 396 H THR 59 HN THR 59 -11.468 -3.899 1.486 397 HA THR 59 HA THR 59 -13.746 -3.609 -0.402 398 HB THR 59 HB THR 59 -15.135 -4.411 1.333 399 HG1 THR 59 HG1 THR 59 -14.474 -4.388 3.486 400 HG21 THR 59 HG21 THR 59 -12.829 -5.921 2.345 401 HG22 THR 59 HG22 THR 59 -12.905 -5.848 0.584 402 HG23 THR 59 HG23 THR 59 -14.266 -6.496 1.501 403 HA PRO 60 HA PRO 60 -14.437 0.655 0.572 404 HB2 PRO 60 HB2 PRO 60 -17.134 0.794 0.509 405 HB3 PRO 60 HB1 PRO 60 -16.149 0.616 -0.946 406 HG2 PRO 60 HG1 PRO 60 -17.655 -1.464 0.593 407 HG3 PRO 60 HG2 PRO 60 -17.528 -1.249 -1.156 408 HD2 PRO 60 HD2 PRO 60 -16.073 -3.098 0.189 409 HD3 PRO 60 HD1 PRO 60 -15.474 -2.298 -1.264 410 H SER 61 HN SER 61 -16.547 -1.597 2.376 411 HA SER 61 HA SER 61 -17.042 0.281 4.523 412 HB2 SER 61 HB2 SER 61 -18.520 -1.678 3.971 413 HB3 SER 61 HB1 SER 61 -17.259 -2.743 4.594 414 HG SER 61 HG SER 61 -19.116 -1.371 5.938 415 H LYS 62 HN LYS 62 -14.682 -2.293 3.953 416 HA LYS 62 HA LYS 62 -13.578 -2.340 6.597 417 HB2 LYS 62 HB2 LYS 62 -13.146 -4.078 4.854 418 HB3 LYS 62 HB1 LYS 62 -12.164 -2.908 3.973 419 HG2 LYS 62 HG2 LYS 62 -10.694 -2.678 5.963 420 HG3 LYS 62 HG1 LYS 62 -11.654 -3.902 6.794 421 HD2 LYS 62 HD2 LYS 62 -11.123 -5.499 4.937 422 HD3 LYS 62 HD1 LYS 62 -10.055 -4.279 4.244 423 HE2 LYS 62 HE2 LYS 62 -8.425 -5.110 5.567 424 HE3 LYS 62 HE1 LYS 62 -9.299 -4.419 6.935 425 HZ1 LYS 62 HZ1 LYS 62 -10.504 -6.845 6.138 426 HZ2 LYS 62 HZ2 LYS 62 -9.815 -6.437 7.636 427 HZ3 LYS 62 HZ3 LYS 62 -8.849 -7.098 6.405 428 H LEU 63 HN LEU 63 -12.543 -0.590 3.649 429 HA LEU 63 HA LEU 63 -10.359 0.789 4.812 430 HB2 LEU 63 HB2 LEU 63 -12.143 1.237 2.469 431 HB3 LEU 63 HB1 LEU 63 -11.197 2.615 3.030 432 HG LEU 63 HG LEU 63 -9.816 -0.023 2.751 433 HD11 LEU 63 HD11 LEU 63 -11.021 1.552 0.547 434 HD12 LEU 63 HD12 LEU 63 -10.596 -0.156 0.606 435 HD13 LEU 63 HD13 LEU 63 -9.347 1.053 0.312 436 HD21 LEU 63 HD21 LEU 63 -9.166 2.810 3.013 437 HD22 LEU 63 HD22 LEU 63 -8.302 2.057 1.673 438 HD23 LEU 63 HD23 LEU 63 -8.149 1.399 3.303 439 H GLN 64 HN GLN 64 -13.820 1.433 4.949 440 HA GLN 64 HA GLN 64 -13.782 4.089 5.912 441 HB2 GLN 64 HB2 GLN 64 -15.620 1.759 6.494 442 HB3 GLN 64 HB1 GLN 64 -15.894 3.356 7.190 443 HG2 GLN 64 HG2 GLN 64 -16.010 4.345 4.958 444 HG3 GLN 64 HG1 GLN 64 -15.625 2.790 4.221 445 HE21 GLN 64 HE21 GLN 64 -17.982 3.790 3.338 446 HE22 GLN 64 HE22 GLN 64 -19.309 3.037 4.081 447 H ALA 65 HN ALA 65 -13.578 1.023 7.733 448 HA ALA 65 HA ALA 65 -13.149 2.345 10.279 449 HB1 ALA 65 HB1 ALA 65 -12.088 -0.387 10.009 450 HB2 ALA 65 HB2 ALA 65 -13.769 -0.229 9.500 451 HB3 ALA 65 HB3 ALA 65 -13.292 0.244 11.132 452 H LEU 66 HN LEU 66 -11.002 0.712 7.936 453 HA LEU 66 HA LEU 66 -8.578 1.125 9.381 454 HB2 LEU 66 HB2 LEU 66 -8.797 -0.403 7.426 455 HB3 LEU 66 HB1 LEU 66 -8.958 1.003 6.373 456 HG LEU 66 HG LEU 66 -6.686 1.620 7.791 457 HD11 LEU 66 HD21 LEU 66 -6.642 -0.597 8.850 458 HD12 LEU 66 HD22 LEU 66 -5.288 -0.428 7.733 459 HD13 LEU 66 HD23 LEU 66 -6.705 -1.368 7.265 460 HD21 LEU 66 HD11 LEU 66 -6.838 1.903 5.415 461 HD22 LEU 66 HD12 LEU 66 -7.063 0.173 5.159 462 HD23 LEU 66 HD13 LEU 66 -5.499 0.789 5.692 463 H ASP 67 HN ASP 67 -10.040 3.055 6.745 464 HA ASP 67 HA ASP 67 -8.164 5.101 6.545 465 HB2 ASP 67 HB1 ASP 67 -10.327 4.865 5.236 466 HB3 ASP 67 HB2 ASP 67 -11.149 5.597 6.613 467 H MET 68 HN MET 68 -10.640 4.658 9.043 468 HA MET 68 HA MET 68 -10.255 7.192 10.333 469 HB2 MET 68 HB2 MET 68 -11.274 4.533 11.363 470 HB3 MET 68 HB1 MET 68 -11.278 6.010 12.326 471 HG2 MET 68 HG2 MET 68 -12.611 7.121 10.517 472 HG3 MET 68 HG1 MET 68 -12.694 5.572 9.680 473 HE1 MET 68 HE1 MET 68 -14.915 6.745 9.786 474 HE2 MET 68 HE2 MET 68 -16.120 6.554 11.056 475 HE3 MET 68 HE3 MET 68 -15.718 5.186 10.021 476 H ALA 69 HN ALA 69 -8.583 4.099 10.574 477 HA ALA 69 HA ALA 69 -7.156 4.564 12.988 478 HB1 ALA 69 HB1 ALA 69 -6.939 2.382 12.183 479 HB2 ALA 69 HB2 ALA 69 -5.375 3.075 11.753 480 HB3 ALA 69 HB3 ALA 69 -6.636 2.916 10.530 481 H PHE 70 HN PHE 70 -6.336 5.410 9.621 482 HA PHE 70 HA PHE 70 -3.772 6.485 10.053 483 HB2 PHE 70 HB1 PHE 70 -4.810 6.213 7.814 484 HB3 PHE 70 HB2 PHE 70 -5.902 7.551 8.173 485 HD1 PHE 70 HD1 PHE 70 -2.339 6.619 7.699 486 HD2 PHE 70 HD2 PHE 70 -5.171 9.827 8.040 487 HE1 PHE 70 HE1 PHE 70 -0.599 8.229 6.970 488 HE2 PHE 70 HE2 PHE 70 -3.433 11.439 7.310 489 HZ PHE 70 HZ PHE 70 -1.146 10.640 6.776 490 H ALA 71 HN ALA 71 -6.950 7.992 10.544 491 HA ALA 71 HA ALA 71 -5.915 10.608 11.170 492 HB1 ALA 71 HB1 ALA 71 -8.178 10.679 10.655 493 HB2 ALA 71 HB2 ALA 71 -8.250 10.697 12.418 494 HB3 ALA 71 HB3 ALA 71 -8.531 9.195 11.538 495 H SER 72 HN SER 72 -6.767 7.783 13.154 496 HA SER 72 HA SER 72 -6.291 9.095 15.678 497 HB2 SER 72 HB2 SER 72 -6.098 6.133 15.066 498 HB3 SER 72 HB1 SER 72 -6.388 6.873 16.641 499 HG SER 72 HG SER 72 -8.360 7.607 15.916 500 H SER 73 HN SER 73 -4.272 6.969 13.636 501 HA SER 73 HA SER 73 -2.000 7.069 15.409 502 HB2 SER 73 HB1 SER 73 -1.947 6.539 12.431 503 HB3 SER 73 HB2 SER 73 -0.786 5.988 13.640 504 HG SER 73 HG SER 73 -2.576 4.514 12.872 505 H VAL 74 HN VAL 74 -2.790 8.804 12.401 506 HA VAL 74 HA VAL 74 -0.423 10.360 12.261 507 HB VAL 74 HB VAL 74 -2.288 10.169 10.519 508 HG11 VAL 74 HG11 VAL 74 -4.093 11.815 10.667 509 HG12 VAL 74 HG12 VAL 74 -3.466 12.391 12.213 510 HG13 VAL 74 HG13 VAL 74 -4.132 10.762 12.082 511 HG21 VAL 74 HG21 VAL 74 -1.737 13.063 10.869 512 HG22 VAL 74 HG22 VAL 74 -1.431 12.020 9.480 513 HG23 VAL 74 HG23 VAL 74 -0.326 12.006 10.854 514 H ALA 75 HN ALA 75 -3.509 11.026 13.914 515 HA ALA 75 HA ALA 75 -2.795 13.621 14.853 516 HB1 ALA 75 HB1 ALA 75 -5.108 12.524 14.884 517 HB2 ALA 75 HB2 ALA 75 -4.669 13.446 16.321 518 HB3 ALA 75 HB3 ALA 75 -4.578 11.686 16.342 519 H GLN 76 HN GLN 76 -2.244 10.390 16.204 520 HA GLN 76 HA GLN 76 -1.222 11.308 18.737 521 HB2 GLN 76 HB2 GLN 76 -2.004 8.968 18.264 522 HB3 GLN 76 HB1 GLN 76 -0.552 8.729 17.292 523 HG2 GLN 76 HG2 GLN 76 0.822 9.334 19.302 524 HG3 GLN 76 HG1 GLN 76 -0.663 9.395 20.249 525 HE21 GLN 76 HE21 GLN 76 -1.241 7.445 21.226 526 HE22 GLN 76 HE22 GLN 76 -0.704 5.912 20.732 527 H ILE 77 HN ILE 77 0.356 10.432 15.662 528 HA ILE 77 HA ILE 77 3.042 10.649 16.473 529 HB ILE 77 HB ILE 77 1.823 11.522 13.838 530 HG12 ILE 77 HG11 ILE 77 3.152 8.890 14.508 531 HG13 ILE 77 HG12 ILE 77 1.411 9.130 14.655 532 HG21 ILE 77 HG21 ILE 77 4.618 11.215 14.842 533 HG22 ILE 77 HG22 ILE 77 3.968 12.352 13.660 534 HG23 ILE 77 HG23 ILE 77 4.281 10.680 13.195 535 HD11 ILE 77 HD11 ILE 77 1.997 10.174 12.147 536 HD12 ILE 77 HD12 ILE 77 1.293 8.587 12.462 537 HD13 ILE 77 HD13 ILE 77 3.038 8.754 12.252 538 H ALA 78 HN ALA 78 0.971 13.222 15.140 539 HA ALA 78 HA ALA 78 2.947 15.280 15.736 540 HB1 ALA 78 HB1 ALA 78 1.408 15.512 13.830 541 HB2 ALA 78 HB2 ALA 78 1.186 16.837 14.971 542 HB3 ALA 78 HB3 ALA 78 0.034 15.503 14.933 543 H ALA 79 HN ALA 79 -0.297 14.486 17.039 544 HA ALA 79 HA ALA 79 -0.318 16.448 19.084 545 HB1 ALA 79 HB1 ALA 79 -1.498 13.704 19.495 546 HB2 ALA 79 HB2 ALA 79 -2.193 14.812 18.311 547 HB3 ALA 79 HB3 ALA 79 -2.131 15.267 20.013 548 H SER 80 HN SER 80 1.466 13.487 18.811 549 HA SER 80 HA SER 80 2.063 13.305 21.676 550 HB2 SER 80 HB2 SER 80 3.594 11.495 20.998 551 HB3 SER 80 HB1 SER 80 2.005 11.274 20.266 552 HG SER 80 HG SER 80 4.292 11.401 19.032 553 H GLN 81 HN GLN 81 3.331 14.952 18.914 554 HA GLN 81 HA GLN 81 6.043 15.244 19.428 555 HB2 GLN 81 HB2 GLN 81 4.143 17.488 18.677 556 HB3 GLN 81 HB1 GLN 81 5.888 17.481 18.421 557 HG2 GLN 81 HG2 GLN 81 5.727 15.644 16.868 558 HG3 GLN 81 HG1 GLN 81 4.026 15.395 17.256 559 HE21 GLN 81 HE21 GLN 81 6.270 17.378 15.413 560 HE22 GLN 81 HE22 GLN 81 5.084 18.231 14.552 561 H GLY 82 HN GLY 82 3.352 16.725 21.166 562 HA2 GLY 82 HA2 GLY 82 3.426 17.422 23.452 563 HA3 GLY 82 HA1 GLY 82 5.186 17.324 23.399 564 H GLY 83 HN GLY 83 4.179 18.932 20.658 565 HA2 GLY 83 HA1 GLY 83 4.883 21.540 21.890 566 HA3 GLY 83 HA2 GLY 83 4.887 21.190 20.162 567 H ASP 84 HN ASP 84 3.586 23.230 20.043 568 HA ASP 84 HA ASP 84 0.927 23.311 21.189 569 HB2 ASP 84 HB2 ASP 84 2.356 25.296 20.381 570 HB3 ASP 84 HB1 ASP 84 1.830 24.857 18.756 571 H LEU 85 HN LEU 85 -0.728 22.043 20.512 572 HA LEU 85 HA LEU 85 -0.644 20.439 18.152 573 HB2 LEU 85 HB1 LEU 85 -2.691 21.149 20.189 574 HB3 LEU 85 HB2 LEU 85 -3.296 20.548 18.644 575 HG LEU 85 HG LEU 85 -1.462 18.694 18.964 576 HD11 LEU 85 HD21 LEU 85 -1.311 18.184 21.483 577 HD12 LEU 85 HD22 LEU 85 -1.812 19.856 21.732 578 HD13 LEU 85 HD23 LEU 85 -0.309 19.504 20.879 579 HD21 LEU 85 HD11 LEU 85 -3.235 17.358 19.415 580 HD22 LEU 85 HD12 LEU 85 -4.189 18.842 19.428 581 HD23 LEU 85 HD13 LEU 85 -3.568 18.179 20.941 582 H GLY 86 HN GLY 86 -1.362 23.762 18.597 583 HA2 GLY 86 HA2 GLY 86 -3.256 24.276 16.571 584 HA3 GLY 86 HA1 GLY 86 -1.994 25.411 17.050 585 H VAL 87 HN VAL 87 0.296 24.012 16.309 586 HA VAL 87 HA VAL 87 0.381 24.500 13.477 587 HB VAL 87 HB VAL 87 2.280 23.073 15.356 588 HG11 VAL 87 HG21 VAL 87 3.213 22.181 13.498 589 HG12 VAL 87 HG22 VAL 87 3.706 23.824 13.092 590 HG13 VAL 87 HG23 VAL 87 2.209 23.165 12.432 591 HG21 VAL 87 HG11 VAL 87 2.054 25.833 14.174 592 HG22 VAL 87 HG12 VAL 87 3.627 25.205 14.668 593 HG23 VAL 87 HG13 VAL 87 2.331 25.366 15.852 594 H THR 88 HN THR 88 0.360 21.468 15.379 595 HA THR 88 HA THR 88 0.494 19.656 13.229 596 HB THR 88 HB THR 88 -1.057 19.428 15.821 597 HG1 THR 88 HG1 THR 88 0.952 19.337 16.456 598 HG21 THR 88 HG21 THR 88 -1.940 17.866 14.159 599 HG22 THR 88 HG22 THR 88 -0.992 16.988 15.359 600 HG23 THR 88 HG23 THR 88 -0.305 17.328 13.769 601 H THR 89 HN THR 89 -2.400 21.132 14.695 602 HA THR 89 HA THR 89 -4.359 19.932 13.078 603 HB THR 89 HB THR 89 -4.368 22.860 13.866 604 HG1 THR 89 HG1 THR 89 -4.910 20.518 15.359 605 HG21 THR 89 HG21 THR 89 -6.436 20.808 13.133 606 HG22 THR 89 HG22 THR 89 -6.266 22.467 12.561 607 HG23 THR 89 HG23 THR 89 -6.867 22.154 14.189 608 H ASN 90 HN ASN 90 -2.445 22.871 12.435 609 HA ASN 90 HA ASN 90 -3.520 23.236 9.772 610 HB2 ASN 90 HB2 ASN 90 -0.947 24.266 11.009 611 HB3 ASN 90 HB1 ASN 90 -1.658 24.844 9.502 612 HD21 ASN 90 HD21 ASN 90 -1.259 26.543 11.828 613 HD22 ASN 90 HD22 ASN 90 -2.792 27.028 12.370 614 H ALA 91 HN ALA 91 -0.728 21.567 11.144 615 HA ALA 91 HA ALA 91 0.548 20.978 8.626 616 HB1 ALA 91 HB1 ALA 91 2.133 19.987 9.914 617 HB2 ALA 91 HB2 ALA 91 0.944 19.037 10.805 618 HB3 ALA 91 HB3 ALA 91 1.257 20.711 11.262 619 H ILE 92 HN ILE 92 -1.285 18.835 10.835 620 HA ILE 92 HA ILE 92 -1.507 16.696 8.949 621 HB ILE 92 HB ILE 92 -3.312 17.392 11.286 622 HG12 ILE 92 HG11 ILE 92 -0.913 15.543 11.104 623 HG13 ILE 92 HG12 ILE 92 -0.926 17.116 11.902 624 HG21 ILE 92 HG21 ILE 92 -4.100 15.715 9.465 625 HG22 ILE 92 HG22 ILE 92 -4.167 15.201 11.150 626 HG23 ILE 92 HG23 ILE 92 -2.850 14.655 10.113 627 HD11 ILE 92 HD11 ILE 92 -2.791 16.275 13.369 628 HD12 ILE 92 HD12 ILE 92 -1.270 15.411 13.593 629 HD13 ILE 92 HD13 ILE 92 -2.569 14.679 12.651 630 H ALA 93 HN ALA 93 -3.848 19.240 9.869 631 HA ALA 93 HA ALA 93 -5.915 18.447 8.093 632 HB1 ALA 93 HB1 ALA 93 -5.228 21.281 8.925 633 HB2 ALA 93 HB2 ALA 93 -6.143 20.147 9.919 634 HB3 ALA 93 HB3 ALA 93 -6.798 20.695 8.377 635 H ASP 94 HN ASP 94 -3.384 20.939 7.573 636 HA ASP 94 HA ASP 94 -4.087 21.610 4.924 637 HB2 ASP 94 HB1 ASP 94 -1.393 21.534 6.294 638 HB3 ASP 94 HB2 ASP 94 -1.625 22.189 4.675 639 H ALA 95 HN ALA 95 -1.949 19.009 6.083 640 HA ALA 95 HA ALA 95 -1.155 18.095 3.494 641 HB1 ALA 95 HB1 ALA 95 -1.504 16.286 5.883 642 HB2 ALA 95 HB2 ALA 95 -0.199 17.469 5.812 643 HB3 ALA 95 HB3 ALA 95 -0.297 16.192 4.602 644 H LEU 96 HN LEU 96 -3.917 17.251 5.565 645 HA LEU 96 HA LEU 96 -4.883 15.137 3.853 646 HB2 LEU 96 HB2 LEU 96 -6.471 16.846 5.788 647 HB3 LEU 96 HB1 LEU 96 -6.908 15.245 5.188 648 HG LEU 96 HG LEU 96 -4.258 15.562 6.535 649 HD11 LEU 96 HD21 LEU 96 -5.671 14.924 8.684 650 HD12 LEU 96 HD22 LEU 96 -6.941 15.814 7.844 651 HD13 LEU 96 HD23 LEU 96 -5.422 16.615 8.247 652 HD21 LEU 96 HD11 LEU 96 -5.908 13.463 5.580 653 HD22 LEU 96 HD12 LEU 96 -5.876 13.322 7.338 654 HD23 LEU 96 HD13 LEU 96 -4.367 13.318 6.425 655 H THR 97 HN THR 97 -5.479 18.622 4.026 656 HA THR 97 HA THR 97 -7.695 18.673 2.209 657 HB THR 97 HB THR 97 -5.623 20.815 2.773 658 HG1 THR 97 HG1 THR 97 -7.050 21.472 4.326 659 HG21 THR 97 HG21 THR 97 -6.677 21.764 0.985 660 HG22 THR 97 HG22 THR 97 -7.928 22.116 2.176 661 HG23 THR 97 HG23 THR 97 -8.082 20.708 1.125 662 H SER 98 HN SER 98 -4.226 19.372 1.630 663 HA SER 98 HA SER 98 -4.467 19.678 -1.189 664 HB2 SER 98 HB1 SER 98 -2.073 18.613 0.336 665 HB3 SER 98 HB2 SER 98 -2.054 19.366 -1.259 666 HG SER 98 HG SER 98 -2.096 20.510 1.198 667 H ALA 99 HN ALA 99 -4.081 16.795 0.819 668 HA ALA 99 HA ALA 99 -3.519 14.992 -1.364 669 HB1 ALA 99 HB1 ALA 99 -4.020 13.214 0.241 670 HB2 ALA 99 HB2 ALA 99 -4.772 14.380 1.330 671 HB3 ALA 99 HB3 ALA 99 -3.037 14.456 1.019 672 H PHE 100 HN PHE 100 -6.529 15.818 0.377 673 HA PHE 100 HA PHE 100 -8.325 14.080 -0.845 674 HB2 PHE 100 HB1 PHE 100 -8.499 16.813 0.279 675 HB3 PHE 100 HB2 PHE 100 -9.800 16.371 -0.824 676 HD1 PHE 100 HD1 PHE 100 -10.790 13.927 -0.449 677 HD2 PHE 100 HD2 PHE 100 -8.703 16.222 2.524 678 HE1 PHE 100 HE1 PHE 100 -11.852 12.574 1.341 679 HE2 PHE 100 HE2 PHE 100 -9.763 14.872 4.309 680 HZ PHE 100 HZ PHE 100 -11.333 13.044 3.719 681 H TYR 101 HN TYR 101 -7.491 17.334 -2.080 682 HA TYR 101 HA TYR 101 -8.825 16.900 -4.604 683 HB2 TYR 101 HB2 TYR 101 -6.628 18.912 -4.191 684 HB3 TYR 101 HB1 TYR 101 -8.085 19.053 -5.177 685 HD1 TYR 101 HD2 TYR 101 -10.225 18.199 -3.413 686 HD2 TYR 101 HD1 TYR 101 -6.743 20.545 -2.510 687 HE1 TYR 101 HE2 TYR 101 -11.421 19.234 -1.502 688 HE2 TYR 101 HE1 TYR 101 -7.938 21.583 -0.602 689 HH TYR 101 HH TYR 101 -10.912 21.810 -0.200 690 H GLN 102 HN GLN 102 -5.549 16.412 -3.442 691 HA GLN 102 HA GLN 102 -4.386 16.027 -6.065 692 HB2 GLN 102 HB2 GLN 102 -3.493 15.345 -3.262 693 HB3 GLN 102 HB1 GLN 102 -2.541 14.899 -4.678 694 HG2 GLN 102 HG2 GLN 102 -3.482 17.727 -4.143 695 HG3 GLN 102 HG1 GLN 102 -1.912 17.120 -3.618 696 HE21 GLN 102 HE21 GLN 102 -3.130 18.972 -5.995 697 HE22 GLN 102 HE22 GLN 102 -2.160 18.504 -7.307 698 H THR 103 HN THR 103 -6.297 14.007 -3.986 699 HA THR 103 HA THR 103 -5.385 11.605 -5.506 700 HB THR 103 HB THR 103 -6.393 10.282 -3.709 701 HG1 THR 103 HG1 THR 103 -7.047 11.722 -1.838 702 HG21 THR 103 HG21 THR 103 -5.053 11.610 -1.763 703 HG22 THR 103 HG22 THR 103 -4.379 12.395 -3.192 704 HG23 THR 103 HG23 THR 103 -4.252 10.646 -3.003 705 H THR 104 HN THR 104 -8.511 12.828 -4.163 706 HA THR 104 HA THR 104 -9.753 11.802 -6.687 707 HB THR 104 HB THR 104 -10.589 10.258 -5.181 708 HG1 THR 104 HG1 THR 104 -12.393 12.293 -4.500 709 HG21 THR 104 HG21 THR 104 -9.718 10.698 -3.108 710 HG22 THR 104 HG22 THR 104 -11.353 11.288 -2.814 711 HG23 THR 104 HG23 THR 104 -10.066 12.424 -3.214 712 H GLY 105 HN GLY 105 -10.117 14.134 -3.999 713 HA2 GLY 105 HA2 GLY 105 -10.580 16.493 -4.637 714 HA3 GLY 105 HA1 GLY 105 -11.593 15.872 -5.936 715 H VAL 106 HN VAL 106 -11.448 14.934 -2.488 716 HA VAL 106 HA VAL 106 -14.384 15.431 -2.366 717 HB VAL 106 HB VAL 106 -12.710 13.948 -0.329 718 HG11 VAL 106 HG21 VAL 106 -15.050 12.811 -0.111 719 HG12 VAL 106 HG22 VAL 106 -15.640 14.235 -0.968 720 HG13 VAL 106 HG23 VAL 106 -14.826 14.417 0.585 721 HG21 VAL 106 HG11 VAL 106 -12.351 12.827 -2.449 722 HG22 VAL 106 HG12 VAL 106 -14.070 12.911 -2.832 723 HG23 VAL 106 HG13 VAL 106 -13.510 11.877 -1.518 724 H VAL 107 HN VAL 107 -15.079 16.174 -0.047 725 HA VAL 107 HA VAL 107 -13.756 18.709 0.455 726 HB VAL 107 HB VAL 107 -15.412 18.804 2.380 727 HG11 VAL 107 HG21 VAL 107 -17.298 18.213 0.345 728 HG12 VAL 107 HG22 VAL 107 -15.855 18.821 -0.468 729 HG13 VAL 107 HG23 VAL 107 -16.643 19.793 0.774 730 HG21 VAL 107 HG11 VAL 107 -17.097 16.684 1.483 731 HG22 VAL 107 HG12 VAL 107 -16.333 16.865 3.063 732 HG23 VAL 107 HG13 VAL 107 -15.495 16.001 1.771 733 H ASN 108 HN ASN 108 -11.957 18.933 1.679 734 HA ASN 108 HA ASN 108 -10.938 16.787 3.335 735 HB2 ASN 108 HB2 ASN 108 -9.106 18.256 3.803 736 HB3 ASN 108 HB1 ASN 108 -9.559 18.560 2.126 737 HD21 ASN 108 HD21 ASN 108 -9.890 20.734 1.620 738 HD22 ASN 108 HD22 ASN 108 -10.333 21.937 2.730 739 H SER 109 HN SER 109 -12.855 19.650 3.896 740 HA SER 109 HA SER 109 -12.511 19.972 6.678 741 HB2 SER 109 HB2 SER 109 -15.088 20.339 5.126 742 HB3 SER 109 HB1 SER 109 -14.671 21.097 6.663 743 HG SER 109 HG SER 109 -12.781 21.935 5.453 744 H ARG 110 HN ARG 110 -14.854 17.882 4.953 745 HA ARG 110 HA ARG 110 -16.197 16.904 7.243 746 HB2 ARG 110 HB2 ARG 110 -16.908 16.466 4.896 747 HB3 ARG 110 HB1 ARG 110 -15.548 15.359 4.715 748 HG2 ARG 110 HG2 ARG 110 -16.425 13.994 6.589 749 HG3 ARG 110 HG1 ARG 110 -17.799 15.090 6.732 750 HD2 ARG 110 HD1 ARG 110 -18.396 14.572 4.355 751 HD3 ARG 110 HD2 ARG 110 -17.093 13.383 4.326 752 HE ARG 110 HE ARG 110 -18.814 12.848 6.554 753 HH11 ARG 110 HH11 ARG 110 -20.583 13.450 4.061 754 HH12 ARG 110 HH12 ARG 110 -20.859 11.838 3.493 755 HH21 ARG 110 HH21 ARG 110 -18.335 10.444 5.421 756 HH22 ARG 110 HH22 ARG 110 -19.585 10.136 4.263 757 H PHE 111 HN PHE 111 -13.409 15.417 5.544 758 HA PHE 111 HA PHE 111 -13.038 13.442 7.647 759 HB2 PHE 111 HB2 PHE 111 -12.356 13.084 5.268 760 HB3 PHE 111 HB1 PHE 111 -11.097 14.299 5.482 761 HD1 PHE 111 HD2 PHE 111 -12.350 11.043 6.815 762 HD2 PHE 111 HD1 PHE 111 -9.020 13.735 6.466 763 HE1 PHE 111 HE2 PHE 111 -10.855 9.322 7.790 764 HE2 PHE 111 HE1 PHE 111 -7.526 12.012 7.442 765 HZ PHE 111 HZ PHE 111 -8.443 9.806 8.103 766 H ILE 112 HN ILE 112 -11.209 16.340 6.634 767 HA ILE 112 HA ILE 112 -9.258 16.247 8.686 768 HB ILE 112 HB ILE 112 -10.462 18.629 7.250 769 HG12 ILE 112 HG12 ILE 112 -8.058 16.859 6.767 770 HG13 ILE 112 HG11 ILE 112 -9.419 17.152 5.685 771 HG21 ILE 112 HG21 ILE 112 -9.373 19.349 9.323 772 HG22 ILE 112 HG22 ILE 112 -8.365 19.783 7.944 773 HG23 ILE 112 HG23 ILE 112 -7.950 18.384 8.933 774 HD11 ILE 112 HD11 ILE 112 -8.736 19.574 5.600 775 HD12 ILE 112 HD12 ILE 112 -7.545 18.474 4.903 776 HD13 ILE 112 HD13 ILE 112 -7.291 19.145 6.515 777 H SER 113 HN SER 113 -12.474 17.801 8.665 778 HA SER 113 HA SER 113 -12.299 19.102 11.169 779 HB2 SER 113 HB1 SER 113 -14.198 19.409 9.624 780 HB3 SER 113 HB2 SER 113 -14.721 17.753 9.934 781 HG SER 113 HG SER 113 -15.701 18.486 11.615 782 H GLU 114 HN GLU 114 -13.059 15.723 10.400 783 HA GLU 114 HA GLU 114 -13.760 14.970 13.093 784 HB2 GLU 114 HB2 GLU 114 -14.325 13.632 11.050 785 HB3 GLU 114 HB1 GLU 114 -12.617 13.220 10.894 786 HG2 GLU 114 HG2 GLU 114 -12.685 12.238 13.189 787 HG3 GLU 114 HG1 GLU 114 -14.417 12.568 13.248 788 H ILE 115 HN ILE 115 -10.713 14.930 11.261 789 HA ILE 115 HA ILE 115 -9.196 13.679 13.390 790 HB ILE 115 HB ILE 115 -8.234 15.367 11.060 791 HG12 ILE 115 HG12 ILE 115 -8.580 12.367 11.350 792 HG13 ILE 115 HG11 ILE 115 -9.555 13.423 10.329 793 HG21 ILE 115 HG21 ILE 115 -6.900 13.980 13.273 794 HG22 ILE 115 HG22 ILE 115 -6.257 15.178 12.149 795 HG23 ILE 115 HG23 ILE 115 -6.310 13.476 11.688 796 HD11 ILE 115 HD11 ILE 115 -7.347 12.095 9.446 797 HD12 ILE 115 HD12 ILE 115 -6.626 13.629 9.933 798 HD13 ILE 115 HD13 ILE 115 -7.925 13.603 8.739 799 H ARG 116 HN ARG 116 -9.650 17.048 12.310 800 HA ARG 116 HA ARG 116 -7.841 18.307 14.068 801 HB2 ARG 116 HB2 ARG 116 -8.904 19.665 12.421 802 HB3 ARG 116 HB1 ARG 116 -10.514 19.194 12.963 803 HG2 ARG 116 HG2 ARG 116 -10.316 20.463 14.973 804 HG3 ARG 116 HG1 ARG 116 -8.578 20.669 14.760 805 HD2 ARG 116 HD2 ARG 116 -9.127 21.926 12.606 806 HD3 ARG 116 HD1 ARG 116 -10.807 21.928 13.144 807 HE ARG 116 HE ARG 116 -8.974 23.823 14.000 808 HH11 ARG 116 HH11 ARG 116 -11.773 23.703 15.060 809 HH12 ARG 116 HH12 ARG 116 -11.510 23.460 16.754 810 HH21 ARG 116 HH21 ARG 116 -8.207 22.476 16.370 811 HH22 ARG 116 HH22 ARG 116 -9.491 22.766 17.496 812 H SER 117 HN SER 117 -11.168 17.204 14.662 813 HA SER 117 HA SER 117 -11.264 18.268 17.358 814 HB2 SER 117 HB2 SER 117 -13.294 17.743 15.989 815 HB3 SER 117 HB1 SER 117 -12.912 16.029 16.149 816 HG SER 117 HG SER 117 -14.417 17.059 17.734 817 H LEU 118 HN LEU 118 -10.314 15.187 15.918 818 HA LEU 118 HA LEU 118 -10.122 13.757 18.424 819 HB2 LEU 118 HB2 LEU 118 -8.863 13.274 15.710 820 HB3 LEU 118 HB1 LEU 118 -8.712 12.160 17.068 821 HG LEU 118 HG LEU 118 -11.442 13.099 16.254 822 HD11 LEU 118 HD21 LEU 118 -10.367 12.373 14.153 823 HD12 LEU 118 HD22 LEU 118 -11.597 11.217 14.662 824 HD13 LEU 118 HD23 LEU 118 -9.890 10.859 14.921 825 HD21 LEU 118 HD11 LEU 118 -10.894 11.687 18.316 826 HD22 LEU 118 HD12 LEU 118 -10.486 10.389 17.194 827 HD23 LEU 118 HD13 LEU 118 -12.127 11.034 17.238 828 H ILE 119 HN ILE 119 -7.794 15.570 16.432 829 HA ILE 119 HA ILE 119 -5.452 14.944 17.906 830 HB ILE 119 HB ILE 119 -6.158 17.551 16.523 831 HG12 ILE 119 HG12 ILE 119 -4.594 15.181 15.468 832 HG13 ILE 119 HG11 ILE 119 -6.308 15.436 15.136 833 HG21 ILE 119 HG21 ILE 119 -3.664 16.430 17.741 834 HG22 ILE 119 HG22 ILE 119 -4.237 18.098 17.696 835 HG23 ILE 119 HG23 ILE 119 -3.513 17.375 16.259 836 HD11 ILE 119 HD11 ILE 119 -4.108 17.425 14.494 837 HD12 ILE 119 HD12 ILE 119 -5.817 17.591 14.088 838 HD13 ILE 119 HD13 ILE 119 -4.847 16.330 13.324 839 H GLY 120 HN GLY 120 -7.928 17.434 18.455 840 HA2 GLY 120 HA2 GLY 120 -6.547 18.651 20.687 841 HA3 GLY 120 HA1 GLY 120 -8.249 18.875 20.287 842 H MET 121 HN MET 121 -8.680 15.902 20.323 843 HA MET 121 HA MET 121 -9.465 15.668 23.080 844 HB2 MET 121 HB2 MET 121 -10.552 14.469 21.152 845 HB3 MET 121 HB1 MET 121 -9.131 13.428 21.065 846 HG2 MET 121 HG1 MET 121 -9.510 12.775 23.443 847 HG3 MET 121 HG2 MET 121 -10.980 13.747 23.449 848 HE1 MET 121 HE1 MET 121 -12.401 12.735 20.250 849 HE2 MET 121 HE2 MET 121 -12.480 13.775 21.670 850 HE3 MET 121 HE3 MET 121 -13.501 12.342 21.579 851 H PHE 122 HN PHE 122 -6.704 14.420 21.231 852 HA PHE 122 HA PHE 122 -5.638 12.711 23.243 853 HB2 PHE 122 HB2 PHE 122 -4.284 14.303 21.048 854 HB3 PHE 122 HB1 PHE 122 -3.434 13.140 22.065 855 HD1 PHE 122 HD1 PHE 122 -4.172 10.730 22.078 856 HD2 PHE 122 HD2 PHE 122 -5.689 13.590 19.255 857 HE1 PHE 122 HE1 PHE 122 -4.974 8.879 20.635 858 HE2 PHE 122 HE2 PHE 122 -6.491 11.740 17.812 859 HZ PHE 122 HZ PHE 122 -6.134 9.385 18.502 860 H ALA 123 HN ALA 123 -5.273 16.199 22.703 861 HA ALA 123 HA ALA 123 -3.234 16.654 24.647 862 HB1 ALA 123 HB1 ALA 123 -3.482 18.626 23.556 863 HB2 ALA 123 HB2 ALA 123 -4.772 18.947 24.715 864 HB3 ALA 123 HB3 ALA 123 -5.157 18.276 23.130 865 H GLN 124 HN GLN 124 -6.719 16.270 24.931 866 HA GLN 124 HA GLN 124 -6.898 17.205 27.662 867 HB2 GLN 124 HB2 GLN 124 -8.700 15.391 26.032 868 HB3 GLN 124 HB1 GLN 124 -9.103 15.999 27.638 869 HG2 GLN 124 HG2 GLN 124 -8.932 18.311 26.823 870 HG3 GLN 124 HG1 GLN 124 -8.474 17.727 25.224 871 HE21 GLN 124 HE21 GLN 124 -10.819 19.323 25.574 872 HE22 GLN 124 HE22 GLN 124 -12.185 18.358 25.284 873 H ALA 125 HN ALA 125 -6.197 14.099 26.156 874 HA ALA 125 HA ALA 125 -6.536 12.452 28.465 875 HB1 ALA 125 HB1 ALA 125 -4.343 11.482 26.907 876 HB2 ALA 125 HB2 ALA 125 -5.542 12.152 25.801 877 HB3 ALA 125 HB3 ALA 125 -6.003 10.886 26.939 878 H SER 126 HN SER 126 -3.957 14.611 27.474 879 HA SER 126 HA SER 126 -1.879 13.609 29.149 880 HB2 SER 126 HB1 SER 126 -0.842 15.783 28.883 881 HB3 SER 126 HB2 SER 126 -1.609 15.354 27.354 882 HG SER 126 HG SER 126 -2.007 17.511 28.749 883 H ALA 127 HN ALA 127 -4.699 15.580 29.843 884 HA ALA 127 HA ALA 127 -3.846 16.578 32.396 885 HB1 ALA 127 HB1 ALA 127 -5.759 17.690 31.837 886 HB2 ALA 127 HB2 ALA 127 -6.543 16.357 32.690 887 HB3 ALA 127 HB3 ALA 127 -6.405 16.322 30.929 888 H ASN 128 HN ASN 128 -5.154 13.504 31.345 889 HA ASN 128 HA ASN 128 -6.197 12.403 33.653 890 HB2 ASN 128 HB2 ASN 128 -4.291 11.082 31.702 891 HB3 ASN 128 HB1 ASN 128 -5.270 10.213 32.884 892 HD21 ASN 128 HD21 ASN 128 -5.614 9.776 30.076 893 HD22 ASN 128 HD22 ASN 128 -7.142 10.363 29.627 894 H ASP 129 HN ASP 129 -2.879 13.337 33.109 895 HA ASP 129 HA ASP 129 -2.018 11.886 35.544 896 HB2 ASP 129 HB2 ASP 129 -0.497 13.518 33.495 897 HB3 ASP 129 HB1 ASP 129 0.248 12.793 34.920 898 H VAL 130 HN VAL 130 -1.475 15.234 34.348 899 HA VAL 130 HA VAL 130 -1.502 16.103 37.187 900 HB VAL 130 HB VAL 130 -0.460 18.135 36.441 901 HG11 VAL 130 HG21 VAL 130 0.805 15.844 36.558 902 HG12 VAL 130 HG22 VAL 130 1.620 17.233 35.839 903 HG13 VAL 130 HG23 VAL 130 0.895 16.003 34.804 904 HG21 VAL 130 HG11 VAL 130 -1.258 18.842 34.415 905 HG22 VAL 130 HG12 VAL 130 -1.464 17.198 33.812 906 HG23 VAL 130 HG13 VAL 130 0.130 17.950 33.792 907 H TYR 131 HN TYR 131 -3.561 16.186 34.434 908 HA TYR 131 HA TYR 131 -5.484 17.468 33.955 909 HB2 TYR 131 HB2 TYR 131 -6.457 17.869 36.618 910 HB3 TYR 131 HB1 TYR 131 -6.995 16.697 35.425 911 HD1 TYR 131 HD2 TYR 131 -4.637 17.274 38.231 912 HD2 TYR 131 HD1 TYR 131 -6.309 14.411 35.505 913 HE1 TYR 131 HE2 TYR 131 -3.628 15.439 39.546 914 HE2 TYR 131 HE1 TYR 131 -5.308 12.574 36.817 915 HH TYR 131 HH TYR 131 -3.676 13.182 39.893 916 H ALA 132 HN ALA 132 -5.155 18.952 37.148 917 HA ALA 132 HA ALA 132 -4.065 21.423 35.968 918 HB1 ALA 132 HB1 ALA 132 -6.829 21.246 37.202 919 HB2 ALA 132 HB2 ALA 132 -6.426 21.760 35.564 920 HB3 ALA 132 HB3 ALA 132 -5.972 22.765 36.939 921 H SER 133 HN SER 133 -2.325 20.940 37.441 922 HA SER 133 HA SER 133 -2.404 20.313 40.127 923 HB2 SER 133 HB2 SER 133 -0.268 21.317 40.351 924 HB3 SER 133 HB1 SER 133 -0.364 20.861 38.651 925 HG SER 133 HG SER 133 -1.338 23.143 38.529 926 H ALA 134 HN ALA 134 -2.130 21.806 42.057 927 HA ALA 134 HA ALA 134 -4.381 23.578 42.256 928 HB1 ALA 134 HB1 ALA 134 -3.580 22.501 44.255 929 HB2 ALA 134 HB2 ALA 134 -3.299 24.229 44.457 930 HB3 ALA 134 HB3 ALA 134 -1.961 23.163 44.030 931 H GLY 135 HN GLY 135 -0.974 24.087 41.535 932 HA2 GLY 135 HA2 GLY 135 -0.207 26.003 40.274 933 HA3 GLY 135 HA1 GLY 135 -1.629 26.894 40.818 934 H SER 136 HN SER 136 -0.225 25.137 43.347 935 HA SER 136 HA SER 136 0.439 27.438 44.875 936 HB2 SER 136 HB1 SER 136 1.589 24.646 45.167 937 HB3 SER 136 HB2 SER 136 1.530 25.889 46.417 938 HG SER 136 HG SER 136 -0.841 25.836 45.951 939 H GLY 137 HN GLY 137 2.376 25.473 42.671 940 HA2 GLY 137 HA2 GLY 137 4.300 27.600 42.323 941 HA3 GLY 137 HA1 GLY 137 4.967 26.302 43.314 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 -20.652 4.836 -11.596 2 H2 GLY 1 HT2 GLY 1 -19.885 4.421 -10.138 3 H3 GLY 1 HT3 GLY 1 -20.722 3.240 -11.028 4 HA2 GLY 1 HA2 GLY 1 -18.211 3.212 -11.203 5 HA3 GLY 1 HA1 GLY 1 -19.124 3.178 -12.712 6 H MET 2 HN MET 2 -17.101 5.143 -10.632 7 HA MET 2 HA MET 2 -17.106 7.291 -12.709 8 HB2 MET 2 HB2 MET 2 -16.210 7.373 -9.811 9 HB3 MET 2 HB1 MET 2 -16.136 8.730 -10.934 10 HG2 MET 2 HG2 MET 2 -18.650 7.271 -10.063 11 HG3 MET 2 HG1 MET 2 -18.161 8.888 -9.556 12 HE1 MET 2 HE1 MET 2 -17.162 10.358 -11.162 13 HE2 MET 2 HE2 MET 2 -18.413 11.198 -12.075 14 HE3 MET 2 HE3 MET 2 -17.241 10.190 -12.921 15 H GLY 3 HN GLY 3 -15.148 7.882 -13.668 16 HA2 GLY 3 HA2 GLY 3 -13.111 5.977 -13.989 17 HA3 GLY 3 HA1 GLY 3 -12.888 7.701 -14.289 18 H GLN 4 HN GLN 4 -13.410 8.545 -11.570 19 HA GLN 4 HA GLN 4 -10.930 7.494 -10.271 20 HB2 GLN 4 HB2 GLN 4 -12.268 10.188 -9.875 21 HB3 GLN 4 HB1 GLN 4 -10.731 9.670 -9.182 22 HG2 GLN 4 HG2 GLN 4 -11.341 10.000 -12.136 23 HG3 GLN 4 HG1 GLN 4 -10.320 11.057 -11.160 24 HE21 GLN 4 HE21 GLN 4 -9.984 8.759 -13.440 25 HE22 GLN 4 HE22 GLN 4 -8.526 8.053 -12.939 26 H ALA 5 HN ALA 5 -11.008 7.199 -7.949 27 HA ALA 5 HA ALA 5 -13.479 6.074 -7.005 28 HB1 ALA 5 HB1 ALA 5 -11.452 6.935 -5.007 29 HB2 ALA 5 HB2 ALA 5 -10.897 5.806 -6.242 30 HB3 ALA 5 HB3 ALA 5 -12.251 5.374 -5.198 31 H ASN 6 HN ASN 6 -14.764 6.867 -5.175 32 HA ASN 6 HA ASN 6 -15.285 9.731 -5.381 33 HB2 ASN 6 HB2 ASN 6 -16.432 7.676 -3.464 34 HB3 ASN 6 HB1 ASN 6 -17.079 9.290 -3.759 35 HD21 ASN 6 HD21 ASN 6 -18.567 6.833 -4.266 36 HD22 ASN 6 HD22 ASN 6 -18.849 6.743 -5.938 37 H THR 7 HN THR 7 -13.153 7.833 -3.562 38 HA THR 7 HA THR 7 -12.322 10.135 -1.986 39 HB THR 7 HB THR 7 -14.345 8.960 -0.785 40 HG1 THR 7 HG1 THR 7 -13.084 10.539 0.178 41 HG21 THR 7 HG21 THR 7 -12.430 7.285 0.654 42 HG22 THR 7 HG22 THR 7 -12.665 6.764 -1.014 43 HG23 THR 7 HG23 THR 7 -14.048 6.894 0.071 44 HA PRO 8 HA PRO 8 -8.463 8.004 -2.374 45 HB2 PRO 8 HB2 PRO 8 -7.132 8.903 -0.200 46 HB3 PRO 8 HB1 PRO 8 -7.429 9.892 -1.631 47 HG2 PRO 8 HG2 PRO 8 -8.918 9.821 0.969 48 HG3 PRO 8 HG1 PRO 8 -8.399 11.223 0.026 49 HD2 PRO 8 HD2 PRO 8 -10.934 10.327 -0.062 50 HD3 PRO 8 HD1 PRO 8 -10.151 11.016 -1.483 51 H TRP 9 HN TRP 9 -10.221 7.672 0.688 52 HA TRP 9 HA TRP 9 -8.564 5.319 1.380 53 HB2 TRP 9 HB2 TRP 9 -9.915 5.258 3.462 54 HB3 TRP 9 HB1 TRP 9 -9.145 6.825 3.213 55 HD1 TRP 9 HD1 TRP 9 -12.534 5.093 3.133 56 HE1 TRP 9 HE1 TRP 9 -14.389 6.887 3.137 57 HE3 TRP 9 HE3 TRP 9 -9.690 9.293 2.580 58 HZ2 TRP 9 HZ2 TRP 9 -14.628 9.733 2.933 59 HZ3 TRP 9 HZ3 TRP 9 -10.753 11.531 2.489 60 HH2 TRP 9 HH2 TRP 9 -13.216 11.754 2.665 61 H SER 10 HN SER 10 -10.724 5.581 -0.872 62 HA SER 10 HA SER 10 -12.372 3.236 -0.030 63 HB2 SER 10 HB2 SER 10 -13.805 3.809 -1.978 64 HB3 SER 10 HB1 SER 10 -13.676 5.151 -0.841 65 HG SER 10 HG SER 10 -12.994 5.069 -3.419 66 H SER 11 HN SER 11 -9.863 4.297 -2.176 67 HA SER 11 HA SER 11 -9.994 1.687 -3.622 68 HB2 SER 11 HB1 SER 11 -9.188 4.439 -4.408 69 HB3 SER 11 HB2 SER 11 -8.203 3.128 -5.055 70 HG SER 11 HG SER 11 -10.640 2.306 -5.333 71 H LYS 12 HN LYS 12 -7.864 0.670 -4.051 72 HA LYS 12 HA LYS 12 -6.234 0.634 -1.646 73 HB2 LYS 12 HB1 LYS 12 -6.763 -1.271 -3.387 74 HB3 LYS 12 HB2 LYS 12 -5.355 -0.619 -4.222 75 HG2 LYS 12 HG2 LYS 12 -3.967 -0.955 -2.256 76 HG3 LYS 12 HG1 LYS 12 -5.371 -1.442 -1.304 77 HD2 LYS 12 HD1 LYS 12 -4.173 -3.441 -2.006 78 HD3 LYS 12 HD2 LYS 12 -5.703 -3.365 -2.877 79 HE2 LYS 12 HE2 LYS 12 -4.211 -3.833 -4.609 80 HE3 LYS 12 HE1 LYS 12 -4.278 -2.073 -4.678 81 HZ1 LYS 12 HZ1 LYS 12 -2.237 -3.639 -3.194 82 HZ2 LYS 12 HZ2 LYS 12 -2.285 -1.948 -3.361 83 HZ3 LYS 12 HZ3 LYS 12 -1.998 -2.932 -4.717 84 H ALA 13 HN ALA 13 -5.769 1.839 -4.965 85 HA ALA 13 HA ALA 13 -3.052 2.762 -4.347 86 HB1 ALA 13 HB1 ALA 13 -4.849 3.106 -6.761 87 HB2 ALA 13 HB2 ALA 13 -3.448 2.045 -6.611 88 HB3 ALA 13 HB3 ALA 13 -3.229 3.795 -6.656 89 H ASN 14 HN ASN 14 -6.292 4.126 -4.509 90 HA ASN 14 HA ASN 14 -5.428 6.889 -4.447 91 HB2 ASN 14 HB1 ASN 14 -7.834 5.666 -4.886 92 HB3 ASN 14 HB2 ASN 14 -8.048 6.255 -3.237 93 HD21 ASN 14 HD21 ASN 14 -9.525 7.408 -5.393 94 HD22 ASN 14 HD22 ASN 14 -9.012 9.016 -5.566 95 H ALA 15 HN ALA 15 -6.005 4.430 -2.005 96 HA ALA 15 HA ALA 15 -6.092 6.282 0.222 97 HB1 ALA 15 HB1 ALA 15 -7.073 4.131 0.569 98 HB2 ALA 15 HB2 ALA 15 -5.623 4.174 1.572 99 HB3 ALA 15 HB3 ALA 15 -5.608 3.305 0.038 100 H ASP 16 HN ASP 16 -3.530 4.176 -1.091 101 HA ASP 16 HA ASP 16 -1.519 4.862 0.775 102 HB2 ASP 16 HB2 ASP 16 0.039 3.929 -0.740 103 HB3 ASP 16 HB1 ASP 16 -1.465 3.078 -1.089 104 H ALA 17 HN ALA 17 -2.226 6.417 -2.382 105 HA ALA 17 HA ALA 17 -0.208 8.385 -2.274 106 HB1 ALA 17 HB1 ALA 17 -1.478 9.601 -3.890 107 HB2 ALA 17 HB2 ALA 17 -2.996 8.900 -3.328 108 HB3 ALA 17 HB3 ALA 17 -1.829 7.899 -4.192 109 H PHE 18 HN PHE 18 -3.457 8.389 -0.831 110 HA PHE 18 HA PHE 18 -3.409 11.068 0.144 111 HB2 PHE 18 HB1 PHE 18 -5.436 9.611 0.103 112 HB3 PHE 18 HB2 PHE 18 -4.747 8.661 1.418 113 HD1 PHE 18 HD2 PHE 18 -6.026 12.010 0.463 114 HD2 PHE 18 HD1 PHE 18 -4.733 9.476 3.680 115 HE1 PHE 18 HE2 PHE 18 -6.905 13.648 2.105 116 HE2 PHE 18 HE1 PHE 18 -5.611 11.112 5.323 117 HZ PHE 18 HZ PHE 18 -6.697 13.198 4.535 118 H ILE 19 HN ILE 19 -2.457 8.008 1.738 119 HA ILE 19 HA ILE 19 -1.610 9.192 4.188 120 HB ILE 19 HB ILE 19 -0.360 6.752 2.903 121 HG12 ILE 19 HG12 ILE 19 -2.751 6.451 2.738 122 HG13 ILE 19 HG11 ILE 19 -2.189 5.496 4.109 123 HG21 ILE 19 HG21 ILE 19 0.509 6.340 4.958 124 HG22 ILE 19 HG22 ILE 19 -0.988 6.792 5.774 125 HG23 ILE 19 HG23 ILE 19 0.165 8.036 5.291 126 HD11 ILE 19 HD11 ILE 19 -3.775 6.579 5.309 127 HD12 ILE 19 HD12 ILE 19 -3.995 7.805 4.060 128 HD13 ILE 19 HD13 ILE 19 -2.698 7.973 5.243 129 H ASN 20 HN ASN 20 0.189 8.472 1.197 130 HA ASN 20 HA ASN 20 2.711 9.462 2.180 131 HB2 ASN 20 HB2 ASN 20 3.003 8.111 0.332 132 HB3 ASN 20 HB1 ASN 20 1.561 8.711 -0.477 133 HD21 ASN 20 HD21 ASN 20 2.147 9.806 -2.341 134 HD22 ASN 20 HD22 ASN 20 3.445 10.893 -2.469 135 H SER 21 HN SER 21 0.243 10.929 0.038 136 HA SER 21 HA SER 21 1.492 13.447 -0.263 137 HB2 SER 21 HB2 SER 21 -0.491 12.821 -1.560 138 HB3 SER 21 HB1 SER 21 -1.467 12.790 -0.091 139 HG SER 21 HG SER 21 -0.775 15.050 0.157 140 H PHE 22 HN PHE 22 -0.311 12.073 2.404 141 HA PHE 22 HA PHE 22 -0.696 14.567 3.826 142 HB2 PHE 22 HB1 PHE 22 -2.125 12.686 4.351 143 HB3 PHE 22 HB2 PHE 22 -0.730 11.683 4.755 144 HD1 PHE 22 HD1 PHE 22 0.608 12.144 6.787 145 HD2 PHE 22 HD2 PHE 22 -2.952 14.365 5.874 146 HE1 PHE 22 HE1 PHE 22 0.544 12.996 9.115 147 HE2 PHE 22 HE2 PHE 22 -3.018 15.218 8.203 148 HZ PHE 22 HZ PHE 22 -1.268 14.534 9.823 149 H ILE 23 HN ILE 23 1.600 11.857 4.289 150 HA ILE 23 HA ILE 23 3.080 13.065 6.395 151 HB ILE 23 HB ILE 23 4.060 11.154 4.256 152 HG12 ILE 23 HG12 ILE 23 2.954 10.604 7.026 153 HG13 ILE 23 HG11 ILE 23 2.058 10.370 5.525 154 HG21 ILE 23 HG21 ILE 23 5.158 11.182 7.021 155 HG22 ILE 23 HG22 ILE 23 5.627 12.521 5.973 156 HG23 ILE 23 HG23 ILE 23 5.973 10.861 5.490 157 HD11 ILE 23 HD11 ILE 23 3.321 8.536 4.898 158 HD12 ILE 23 HD12 ILE 23 3.423 8.371 6.651 159 HD13 ILE 23 HD13 ILE 23 4.755 9.100 5.756 160 H SER 24 HN SER 24 3.925 12.928 2.908 161 HA SER 24 HA SER 24 6.166 14.667 3.099 162 HB2 SER 24 HB2 SER 24 4.298 14.373 0.730 163 HB3 SER 24 HB1 SER 24 5.978 14.912 0.689 164 HG SER 24 HG SER 24 4.951 12.355 1.292 165 H ALA 25 HN ALA 25 2.720 15.368 2.710 166 HA ALA 25 HA ALA 25 3.165 18.213 2.248 167 HB1 ALA 25 HB1 ALA 25 1.154 17.021 1.401 168 HB2 ALA 25 HB2 ALA 25 0.730 18.399 2.416 169 HB3 ALA 25 HB3 ALA 25 0.630 16.762 3.064 170 H ALA 26 HN ALA 26 2.072 16.255 5.033 171 HA ALA 26 HA ALA 26 1.704 18.487 6.797 172 HB1 ALA 26 HB1 ALA 26 1.344 16.907 8.470 173 HB2 ALA 26 HB2 ALA 26 2.547 15.795 7.818 174 HB3 ALA 26 HB3 ALA 26 0.982 15.966 7.023 175 H SER 27 HN SER 27 4.505 16.380 6.186 176 HA SER 27 HA SER 27 6.174 17.323 8.263 177 HB2 SER 27 HB1 SER 27 8.025 16.469 6.975 178 HB3 SER 27 HB2 SER 27 6.654 15.391 6.712 179 HG SER 27 HG SER 27 7.828 16.094 4.788 180 H ASN 28 HN ASN 28 5.274 18.844 5.234 181 HA ASN 28 HA ASN 28 7.268 21.003 5.754 182 HB2 ASN 28 HB1 ASN 28 5.686 20.286 3.273 183 HB3 ASN 28 HB2 ASN 28 6.716 21.712 3.403 184 HD21 ASN 28 HD21 ASN 28 7.351 19.748 1.479 185 HD22 ASN 28 HD22 ASN 28 8.750 18.913 1.955 186 H THR 29 HN THR 29 4.202 20.413 6.663 187 HA THR 29 HA THR 29 3.121 23.069 5.926 188 HB THR 29 HB THR 29 1.803 20.946 7.633 189 HG1 THR 29 HG1 THR 29 2.130 19.963 5.729 190 HG21 THR 29 HG21 THR 29 -0.064 22.247 7.526 191 HG22 THR 29 HG22 THR 29 0.269 22.758 5.873 192 HG23 THR 29 HG23 THR 29 1.091 23.542 7.221 193 H GLY 30 HN GLY 30 2.866 21.379 9.059 194 HA2 GLY 30 HA1 GLY 30 3.211 23.938 10.439 195 HA3 GLY 30 HA2 GLY 30 2.896 22.382 11.205 196 H SER 31 HN SER 31 4.610 21.295 12.089 197 HA SER 31 HA SER 31 7.355 22.227 11.371 198 HB2 SER 31 HB1 SER 31 8.006 22.303 13.663 199 HB3 SER 31 HB2 SER 31 6.460 23.146 13.597 200 HG SER 31 HG SER 31 6.148 21.750 15.196 201 H PHE 32 HN PHE 32 5.749 19.733 13.390 202 HA PHE 32 HA PHE 32 6.326 17.458 13.647 203 HB2 PHE 32 HB2 PHE 32 6.193 17.976 10.683 204 HB3 PHE 32 HB1 PHE 32 6.620 16.372 11.282 205 HD1 PHE 32 HD2 PHE 32 5.027 15.911 13.593 206 HD2 PHE 32 HD1 PHE 32 3.947 18.034 10.014 207 HE1 PHE 32 HE2 PHE 32 2.638 15.420 14.023 208 HE2 PHE 32 HE1 PHE 32 1.556 17.540 10.447 209 HZ PHE 32 HZ PHE 32 0.902 16.233 12.450 210 H SER 33 HN SER 33 8.359 17.648 14.711 211 HA SER 33 HA SER 33 10.827 18.265 13.443 212 HB2 SER 33 HB1 SER 33 10.474 16.362 15.773 213 HB3 SER 33 HB2 SER 33 11.890 17.342 15.396 214 HG SER 33 HG SER 33 9.931 18.013 16.941 215 H GLN 34 HN GLN 34 12.615 16.701 12.990 216 HA GLN 34 HA GLN 34 11.929 14.780 11.060 217 HB2 GLN 34 HB1 GLN 34 14.365 14.785 12.871 218 HB3 GLN 34 HB2 GLN 34 14.217 13.897 11.354 219 HG2 GLN 34 HG2 GLN 34 13.931 15.997 10.122 220 HG3 GLN 34 HG1 GLN 34 13.994 16.911 11.630 221 HE21 GLN 34 HE21 GLN 34 15.901 17.487 9.647 222 HE22 GLN 34 HE22 GLN 34 17.423 16.890 10.105 223 H ASP 35 HN ASP 35 12.526 14.323 14.542 224 HA ASP 35 HA ASP 35 12.246 11.490 14.577 225 HB2 ASP 35 HB2 ASP 35 11.663 13.594 16.676 226 HB3 ASP 35 HB1 ASP 35 11.563 11.863 16.998 227 H GLN 36 HN GLN 36 9.841 14.089 14.665 228 HA GLN 36 HA GLN 36 7.604 12.336 15.222 229 HB2 GLN 36 HB1 GLN 36 7.625 15.069 13.903 230 HB3 GLN 36 HB2 GLN 36 6.219 14.263 14.597 231 HG2 GLN 36 HG2 GLN 36 8.714 15.091 16.112 232 HG3 GLN 36 HG1 GLN 36 7.147 15.896 16.189 233 HE21 GLN 36 HE21 GLN 36 8.954 13.956 18.052 234 HE22 GLN 36 HE22 GLN 36 7.767 12.957 18.742 235 H MET 37 HN MET 37 9.173 13.523 12.284 236 HA MET 37 HA MET 37 7.186 12.632 10.427 237 HB2 MET 37 HB2 MET 37 10.186 12.945 10.109 238 HB3 MET 37 HB1 MET 37 9.068 12.664 8.774 239 HG2 MET 37 HG2 MET 37 7.828 14.732 9.436 240 HG3 MET 37 HG1 MET 37 9.053 15.033 10.669 241 HE1 MET 37 HE1 MET 37 10.123 17.568 9.412 242 HE2 MET 37 HE2 MET 37 8.437 17.086 9.250 243 HE3 MET 37 HE3 MET 37 9.334 17.614 7.830 244 H GLU 38 HN GLU 38 9.869 10.991 12.032 245 HA GLU 38 HA GLU 38 9.840 8.602 10.458 246 HB2 GLU 38 HB1 GLU 38 10.596 9.064 13.358 247 HB3 GLU 38 HB2 GLU 38 10.885 7.554 12.494 248 HG2 GLU 38 HG2 GLU 38 11.975 10.282 11.735 249 HG3 GLU 38 HG1 GLU 38 12.900 8.952 12.432 250 H ASN 39 HN ASN 39 7.973 9.604 13.306 251 HA ASN 39 HA ASN 39 6.719 7.138 13.888 252 HB2 ASN 39 HB2 ASN 39 5.553 9.934 14.057 253 HB3 ASN 39 HB1 ASN 39 4.882 8.505 14.843 254 HD21 ASN 39 HD21 ASN 39 6.192 11.052 15.991 255 HD22 ASN 39 HD22 ASN 39 7.366 10.452 17.059 256 H MET 40 HN MET 40 5.906 9.609 11.483 257 HA MET 40 HA MET 40 3.467 8.373 10.594 258 HB2 MET 40 HB2 MET 40 5.401 10.260 9.221 259 HB3 MET 40 HB1 MET 40 3.881 9.741 8.495 260 HG2 MET 40 HG2 MET 40 2.715 10.578 10.585 261 HG3 MET 40 HG1 MET 40 4.253 11.290 11.072 262 HE1 MET 40 HE1 MET 40 5.247 13.039 7.891 263 HE2 MET 40 HE2 MET 40 5.699 12.195 9.371 264 HE3 MET 40 HE3 MET 40 5.196 13.882 9.445 265 H SER 41 HN SER 41 6.859 7.897 9.800 266 HA SER 41 HA SER 41 6.391 6.267 7.459 267 HB2 SER 41 HB2 SER 41 8.796 6.237 9.307 268 HB3 SER 41 HB1 SER 41 8.740 5.669 7.638 269 HG SER 41 HG SER 41 9.317 7.634 7.198 270 H LEU 42 HN LEU 42 6.297 5.675 10.887 271 HA LEU 42 HA LEU 42 6.346 2.737 10.448 272 HB2 LEU 42 HB2 LEU 42 6.143 4.281 13.050 273 HB3 LEU 42 HB1 LEU 42 6.457 2.554 12.873 274 HG LEU 42 HG LEU 42 8.242 4.809 11.909 275 HD11 LEU 42 HD11 LEU 42 9.509 4.469 13.775 276 HD12 LEU 42 HD12 LEU 42 9.231 2.728 13.763 277 HD13 LEU 42 HD13 LEU 42 8.015 3.810 14.442 278 HD21 LEU 42 HD21 LEU 42 8.303 1.820 11.521 279 HD22 LEU 42 HD22 LEU 42 9.794 2.762 11.501 280 HD23 LEU 42 HD23 LEU 42 8.526 3.092 10.320 281 H ILE 43 HN ILE 43 4.125 5.315 10.763 282 HA ILE 43 HA ILE 43 1.936 3.323 11.172 283 HB ILE 43 HB ILE 43 2.024 6.136 12.302 284 HG12 ILE 43 HG12 ILE 43 2.124 3.459 13.725 285 HG13 ILE 43 HG11 ILE 43 3.525 4.494 13.451 286 HG21 ILE 43 HG21 ILE 43 -0.048 5.241 13.516 287 HG22 ILE 43 HG22 ILE 43 -0.029 3.915 12.352 288 HG23 ILE 43 HG23 ILE 43 -0.242 5.573 11.794 289 HD11 ILE 43 HD11 ILE 43 2.689 6.196 14.865 290 HD12 ILE 43 HD12 ILE 43 2.307 4.705 15.727 291 HD13 ILE 43 HD13 ILE 43 1.050 5.547 14.819 292 H GLY 44 HN GLY 44 -0.197 4.197 10.329 293 HA2 GLY 44 HA1 GLY 44 -1.458 5.123 8.580 294 HA3 GLY 44 HA2 GLY 44 -0.274 6.429 8.531 295 H ASN 45 HN ASN 45 1.903 5.733 7.490 296 HA ASN 45 HA ASN 45 1.300 4.642 4.862 297 HB2 ASN 45 HB2 ASN 45 3.010 6.448 5.302 298 HB3 ASN 45 HB1 ASN 45 4.027 5.220 6.056 299 HD21 ASN 45 HD21 ASN 45 5.464 4.220 4.639 300 HD22 ASN 45 HD22 ASN 45 5.230 4.049 2.968 301 H THR 46 HN THR 46 3.075 3.501 7.729 302 HA THR 46 HA THR 46 4.081 1.087 6.619 303 HB THR 46 HB THR 46 3.173 1.709 9.447 304 HG1 THR 46 HG1 THR 46 4.897 2.956 8.797 305 HG21 THR 46 HG21 THR 46 3.285 -0.568 9.627 306 HG22 THR 46 HG22 THR 46 5.017 -0.247 9.720 307 HG23 THR 46 HG23 THR 46 4.291 -0.735 8.188 308 H LEU 47 HN LEU 47 0.912 1.929 7.926 309 HA LEU 47 HA LEU 47 -0.204 -0.688 8.047 310 HB2 LEU 47 HB2 LEU 47 -1.511 1.979 7.417 311 HB3 LEU 47 HB1 LEU 47 -2.400 0.493 7.762 312 HG LEU 47 HG LEU 47 -0.441 1.864 9.632 313 HD11 LEU 47 HD11 LEU 47 -2.764 2.898 9.245 314 HD12 LEU 47 HD12 LEU 47 -2.339 2.515 10.913 315 HD13 LEU 47 HD13 LEU 47 -3.412 1.446 10.009 316 HD21 LEU 47 HD21 LEU 47 -2.145 -0.626 9.958 317 HD22 LEU 47 HD22 LEU 47 -1.250 0.154 11.262 318 HD23 LEU 47 HD23 LEU 47 -0.382 -0.565 9.905 319 H MET 48 HN MET 48 0.359 1.516 5.367 320 HA MET 48 HA MET 48 -1.307 0.334 3.409 321 HB2 MET 48 HB2 MET 48 1.470 1.474 2.965 322 HB3 MET 48 HB1 MET 48 0.190 1.324 1.761 323 HG2 MET 48 HG2 MET 48 0.031 3.005 4.281 324 HG3 MET 48 HG1 MET 48 0.326 3.630 2.658 325 HE1 MET 48 HE1 MET 48 -1.959 1.182 1.244 326 HE2 MET 48 HE2 MET 48 -0.957 2.548 0.762 327 HE3 MET 48 HE3 MET 48 -2.712 2.674 0.662 328 H ALA 49 HN ALA 49 1.763 -0.721 4.748 329 HA ALA 49 HA ALA 49 2.457 -2.633 2.746 330 HB1 ALA 49 HB1 ALA 49 4.186 -2.935 4.160 331 HB2 ALA 49 HB2 ALA 49 3.101 -3.643 5.357 332 HB3 ALA 49 HB3 ALA 49 3.379 -1.900 5.340 333 H ALA 50 HN ALA 50 0.398 -2.848 5.630 334 HA ALA 50 HA ALA 50 -0.251 -5.623 5.387 335 HB1 ALA 50 HB1 ALA 50 -1.781 -3.282 6.559 336 HB2 ALA 50 HB2 ALA 50 -0.789 -4.450 7.434 337 HB3 ALA 50 HB3 ALA 50 -2.313 -4.959 6.704 338 H MET 51 HN MET 51 -1.241 -2.797 3.652 339 HA MET 51 HA MET 51 -3.755 -3.627 2.634 340 HB2 MET 51 HB2 MET 51 -2.448 -1.369 2.361 341 HB3 MET 51 HB1 MET 51 -1.780 -2.139 0.921 342 HG2 MET 51 HG2 MET 51 -4.032 -2.527 0.047 343 HG3 MET 51 HG1 MET 51 -4.741 -1.854 1.515 344 HE1 MET 51 HE1 MET 51 -1.417 -0.496 -0.067 345 HE2 MET 51 HE2 MET 51 -2.050 0.448 -1.414 346 HE3 MET 51 HE3 MET 51 -2.310 -1.294 -1.370 347 H ASP 52 HN ASP 52 -0.474 -4.541 1.726 348 HA ASP 52 HA ASP 52 -1.263 -5.833 -0.754 349 HB2 ASP 52 HB2 ASP 52 0.997 -6.803 -0.713 350 HB3 ASP 52 HB1 ASP 52 1.061 -5.080 -0.346 351 H ASN 53 HN ASN 53 -1.594 -6.636 2.538 352 HA ASN 53 HA ASN 53 -1.390 -9.515 2.315 353 HB2 ASN 53 HB2 ASN 53 -2.849 -7.767 4.321 354 HB3 ASN 53 HB1 ASN 53 -2.622 -9.508 4.490 355 HD21 ASN 53 HD21 ASN 53 -1.523 -7.686 6.406 356 HD22 ASN 53 HD22 ASN 53 0.169 -7.733 6.281 357 H MET 54 HN MET 54 -3.903 -7.159 1.697 358 HA MET 54 HA MET 54 -6.211 -8.766 1.782 359 HB2 MET 54 HB2 MET 54 -5.500 -6.583 -0.202 360 HB3 MET 54 HB1 MET 54 -7.122 -7.230 0.046 361 HG2 MET 54 HG1 MET 54 -5.417 -5.867 2.155 362 HG3 MET 54 HG2 MET 54 -6.810 -5.157 1.340 363 HE1 MET 54 HE1 MET 54 -9.712 -7.507 2.368 364 HE2 MET 54 HE2 MET 54 -8.608 -7.803 1.028 365 HE3 MET 54 HE3 MET 54 -9.166 -6.164 1.353 366 H GLY 55 HN GLY 55 -3.681 -8.581 -0.674 367 HA2 GLY 55 HA2 GLY 55 -3.139 -10.437 -2.119 368 HA3 GLY 55 HA1 GLY 55 -4.761 -11.077 -1.861 369 H GLY 56 HN GLY 56 -5.003 -7.784 -2.372 370 HA2 GLY 56 HA2 GLY 56 -4.969 -6.603 -4.550 371 HA3 GLY 56 HA1 GLY 56 -5.326 -8.149 -5.321 372 H ARG 57 HN ARG 57 -7.026 -7.785 -2.413 373 HA ARG 57 HA ARG 57 -9.427 -6.799 -3.901 374 HB2 ARG 57 HB2 ARG 57 -10.797 -8.335 -2.594 375 HB3 ARG 57 HB1 ARG 57 -9.522 -9.245 -3.402 376 HG2 ARG 57 HG2 ARG 57 -8.199 -8.763 -1.161 377 HG3 ARG 57 HG1 ARG 57 -9.821 -8.567 -0.497 378 HD2 ARG 57 HD2 ARG 57 -10.425 -10.804 -1.447 379 HD3 ARG 57 HD1 ARG 57 -8.747 -11.000 -1.956 380 HE ARG 57 HE ARG 57 -8.145 -10.864 0.493 381 HH11 ARG 57 HH21 ARG 57 -11.477 -10.599 0.174 382 HH12 ARG 57 HH22 ARG 57 -11.862 -11.832 1.327 383 HH21 ARG 57 HH11 ARG 57 -8.579 -12.887 1.693 384 HH22 ARG 57 HH12 ARG 57 -10.222 -13.129 2.187 385 H ILE 58 HN ILE 58 -9.977 -4.841 -3.100 386 HA ILE 58 HA ILE 58 -9.603 -4.379 -0.167 387 HB ILE 58 HB ILE 58 -9.665 -2.310 -2.385 388 HG12 ILE 58 HG12 ILE 58 -7.643 -3.565 -2.644 389 HG13 ILE 58 HG11 ILE 58 -7.203 -2.101 -1.764 390 HG21 ILE 58 HG21 ILE 58 -8.437 -1.214 -0.183 391 HG22 ILE 58 HG22 ILE 58 -9.672 -2.230 0.559 392 HG23 ILE 58 HG23 ILE 58 -10.135 -0.983 -0.599 393 HD11 ILE 58 HD11 ILE 58 -6.199 -3.609 -0.359 394 HD12 ILE 58 HD12 ILE 58 -7.273 -4.924 -0.836 395 HD13 ILE 58 HD13 ILE 58 -7.824 -3.710 0.319 396 H THR 59 HN THR 59 -11.290 -3.096 0.874 397 HA THR 59 HA THR 59 -13.803 -2.789 -0.670 398 HB THR 59 HB THR 59 -14.565 -3.812 1.861 399 HG1 THR 59 HG1 THR 59 -12.601 -4.799 2.092 400 HG21 THR 59 HG21 THR 59 -14.683 -5.700 -0.368 401 HG22 THR 59 HG22 THR 59 -15.237 -4.087 -0.816 402 HG23 THR 59 HG23 THR 59 -15.998 -4.939 0.528 403 HA PRO 60 HA PRO 60 -14.377 0.867 1.740 404 HB2 PRO 60 HB2 PRO 60 -17.021 0.856 2.292 405 HB3 PRO 60 HB1 PRO 60 -16.380 1.175 0.679 406 HG2 PRO 60 HG2 PRO 60 -17.527 -1.351 1.800 407 HG3 PRO 60 HG1 PRO 60 -17.782 -0.624 0.211 408 HD2 PRO 60 HD2 PRO 60 -16.080 -2.699 0.607 409 HD3 PRO 60 HD1 PRO 60 -15.810 -1.476 -0.635 410 H SER 61 HN SER 61 -16.026 -1.950 3.197 411 HA SER 61 HA SER 61 -16.151 -0.846 5.842 412 HB2 SER 61 HB2 SER 61 -16.712 -3.073 6.562 413 HB3 SER 61 HB1 SER 61 -17.457 -2.842 4.980 414 HG SER 61 HG SER 61 -14.963 -4.098 5.472 415 H LYS 62 HN LYS 62 -13.670 -2.670 4.111 416 HA LYS 62 HA LYS 62 -12.024 -3.093 6.473 417 HB2 LYS 62 HB2 LYS 62 -11.431 -3.278 3.507 418 HB3 LYS 62 HB1 LYS 62 -10.261 -3.687 4.761 419 HG2 LYS 62 HG2 LYS 62 -11.936 -5.320 5.690 420 HG3 LYS 62 HG1 LYS 62 -12.955 -4.994 4.288 421 HD2 LYS 62 HD2 LYS 62 -11.026 -5.663 2.818 422 HD3 LYS 62 HD1 LYS 62 -10.149 -6.145 4.271 423 HE2 LYS 62 HE2 LYS 62 -12.866 -7.245 4.159 424 HE3 LYS 62 HE1 LYS 62 -11.857 -7.770 2.811 425 HZ1 LYS 62 HZ1 LYS 62 -11.821 -9.006 5.112 426 HZ2 LYS 62 HZ2 LYS 62 -10.688 -7.799 5.492 427 HZ3 LYS 62 HZ3 LYS 62 -10.416 -8.841 4.179 428 H LEU 63 HN LEU 63 -11.802 -0.892 3.660 429 HA LEU 63 HA LEU 63 -9.546 0.563 4.727 430 HB2 LEU 63 HB2 LEU 63 -11.509 0.992 2.502 431 HB3 LEU 63 HB1 LEU 63 -10.494 2.336 3.021 432 HG LEU 63 HG LEU 63 -8.488 1.128 2.538 433 HD11 LEU 63 HD21 LEU 63 -10.281 -1.274 2.061 434 HD12 LEU 63 HD22 LEU 63 -9.209 -1.051 3.443 435 HD13 LEU 63 HD23 LEU 63 -8.534 -1.241 1.824 436 HD21 LEU 63 HD11 LEU 63 -9.625 2.065 0.568 437 HD22 LEU 63 HD12 LEU 63 -10.539 0.568 0.372 438 HD23 LEU 63 HD13 LEU 63 -8.790 0.573 0.143 439 H GLN 64 HN GLN 64 -13.046 0.937 4.943 440 HA GLN 64 HA GLN 64 -13.206 3.569 5.928 441 HB2 GLN 64 HB2 GLN 64 -15.214 2.260 5.439 442 HB3 GLN 64 HB1 GLN 64 -14.831 1.138 6.744 443 HG2 GLN 64 HG2 GLN 64 -15.093 2.904 8.401 444 HG3 GLN 64 HG1 GLN 64 -15.325 4.105 7.131 445 HE21 GLN 64 HE21 GLN 64 -17.456 4.292 8.562 446 HE22 GLN 64 HE22 GLN 64 -18.761 3.327 8.064 447 H ALA 65 HN ALA 65 -12.500 0.549 7.684 448 HA ALA 65 HA ALA 65 -12.268 1.871 10.259 449 HB1 ALA 65 HB1 ALA 65 -12.541 -0.357 10.690 450 HB2 ALA 65 HB2 ALA 65 -10.785 -0.403 10.539 451 HB3 ALA 65 HB3 ALA 65 -11.800 -0.843 9.165 452 H LEU 66 HN LEU 66 -10.101 1.148 7.593 453 HA LEU 66 HA LEU 66 -7.662 1.790 9.035 454 HB2 LEU 66 HB2 LEU 66 -7.679 0.349 7.015 455 HB3 LEU 66 HB1 LEU 66 -8.197 1.731 6.049 456 HG LEU 66 HG LEU 66 -6.093 2.908 7.044 457 HD11 LEU 66 HD21 LEU 66 -5.472 -0.027 7.496 458 HD12 LEU 66 HD22 LEU 66 -5.535 1.241 8.722 459 HD13 LEU 66 HD23 LEU 66 -4.258 1.253 7.505 460 HD21 LEU 66 HD11 LEU 66 -5.892 0.651 5.027 461 HD22 LEU 66 HD12 LEU 66 -4.691 1.928 5.227 462 HD23 LEU 66 HD13 LEU 66 -6.321 2.326 4.680 463 H ASP 67 HN ASP 67 -9.610 3.538 6.585 464 HA ASP 67 HA ASP 67 -8.150 5.904 6.430 465 HB2 ASP 67 HB1 ASP 67 -10.374 5.250 5.267 466 HB3 ASP 67 HB2 ASP 67 -11.152 5.975 6.673 467 H MET 68 HN MET 68 -10.446 4.936 8.964 468 HA MET 68 HA MET 68 -10.291 7.449 10.389 469 HB2 MET 68 HB2 MET 68 -11.118 4.685 11.326 470 HB3 MET 68 HB1 MET 68 -11.350 6.170 12.247 471 HG2 MET 68 HG2 MET 68 -12.501 5.606 9.495 472 HG3 MET 68 HG1 MET 68 -13.403 5.561 11.010 473 HE1 MET 68 HE1 MET 68 -13.229 7.225 12.673 474 HE2 MET 68 HE2 MET 68 -13.687 8.894 12.344 475 HE3 MET 68 HE3 MET 68 -11.985 8.473 12.512 476 H ALA 69 HN ALA 69 -8.590 4.343 10.649 477 HA ALA 69 HA ALA 69 -7.166 4.877 13.049 478 HB1 ALA 69 HB1 ALA 69 -5.676 3.432 10.941 479 HB2 ALA 69 HB2 ALA 69 -7.272 2.777 11.310 480 HB3 ALA 69 HB3 ALA 69 -6.066 2.934 12.588 481 H PHE 70 HN PHE 70 -6.259 5.549 9.656 482 HA PHE 70 HA PHE 70 -3.703 6.631 10.103 483 HB2 PHE 70 HB1 PHE 70 -4.673 6.264 7.852 484 HB3 PHE 70 HB2 PHE 70 -5.776 7.616 8.116 485 HD1 PHE 70 HD2 PHE 70 -2.190 6.676 7.831 486 HD2 PHE 70 HD1 PHE 70 -5.051 9.877 7.861 487 HE1 PHE 70 HE2 PHE 70 -0.429 8.254 7.082 488 HE2 PHE 70 HE1 PHE 70 -3.291 11.456 7.112 489 HZ PHE 70 HZ PHE 70 -0.981 10.645 6.723 490 H ALA 71 HN ALA 71 -6.876 8.164 10.499 491 HA ALA 71 HA ALA 71 -5.903 10.823 10.932 492 HB1 ALA 71 HB1 ALA 71 -8.157 10.861 12.375 493 HB2 ALA 71 HB2 ALA 71 -8.433 9.350 11.511 494 HB3 ALA 71 HB3 ALA 71 -8.187 10.847 10.612 495 H SER 72 HN SER 72 -6.472 8.103 13.146 496 HA SER 72 HA SER 72 -5.897 9.599 15.544 497 HB2 SER 72 HB2 SER 72 -5.779 7.427 16.639 498 HB3 SER 72 HB1 SER 72 -7.127 7.420 15.501 499 HG SER 72 HG SER 72 -5.102 5.763 15.582 500 H SER 73 HN SER 73 -3.908 7.877 13.209 501 HA SER 73 HA SER 73 -1.527 7.780 14.834 502 HB2 SER 73 HB1 SER 73 -1.607 6.294 12.981 503 HB3 SER 73 HB2 SER 73 -2.023 7.592 11.862 504 HG SER 73 HG SER 73 0.417 7.337 13.283 505 H VAL 74 HN VAL 74 -2.677 10.056 12.354 506 HA VAL 74 HA VAL 74 -0.354 11.760 12.499 507 HB VAL 74 HB VAL 74 -1.660 13.342 11.208 508 HG11 VAL 74 HG21 VAL 74 -2.626 10.607 10.359 509 HG12 VAL 74 HG22 VAL 74 -0.937 11.087 10.202 510 HG13 VAL 74 HG23 VAL 74 -2.190 11.975 9.335 511 HG21 VAL 74 HG11 VAL 74 -4.065 13.114 10.921 512 HG22 VAL 74 HG12 VAL 74 -3.708 13.167 12.647 513 HG23 VAL 74 HG13 VAL 74 -4.072 11.627 11.869 514 H ALA 75 HN ALA 75 -3.434 11.667 14.230 515 HA ALA 75 HA ALA 75 -3.109 14.227 15.525 516 HB1 ALA 75 HB1 ALA 75 -4.627 12.145 16.974 517 HB2 ALA 75 HB2 ALA 75 -5.160 12.430 15.317 518 HB3 ALA 75 HB3 ALA 75 -5.127 13.761 16.475 519 H GLN 76 HN GLN 76 -2.287 10.888 16.445 520 HA GLN 76 HA GLN 76 -1.337 11.603 19.082 521 HB2 GLN 76 HB2 GLN 76 -0.788 9.196 17.324 522 HB3 GLN 76 HB1 GLN 76 -0.247 9.339 18.997 523 HG2 GLN 76 HG1 GLN 76 -2.599 9.626 19.720 524 HG3 GLN 76 HG2 GLN 76 -3.128 9.450 18.047 525 HE21 GLN 76 HE21 GLN 76 -3.996 7.607 20.052 526 HE22 GLN 76 HE22 GLN 76 -3.325 6.090 19.694 527 H ILE 77 HN ILE 77 0.352 10.884 16.011 528 HA ILE 77 HA ILE 77 2.991 11.276 16.900 529 HB ILE 77 HB ILE 77 1.748 11.958 14.223 530 HG12 ILE 77 HG11 ILE 77 3.365 9.560 15.141 531 HG13 ILE 77 HG12 ILE 77 1.611 9.576 14.954 532 HG21 ILE 77 HG21 ILE 77 4.653 11.719 15.060 533 HG22 ILE 77 HG22 ILE 77 3.846 13.172 14.471 534 HG23 ILE 77 HG23 ILE 77 4.102 11.806 13.388 535 HD11 ILE 77 HD11 ILE 77 2.859 10.625 12.571 536 HD12 ILE 77 HD12 ILE 77 1.798 9.226 12.737 537 HD13 ILE 77 HD13 ILE 77 3.539 9.043 12.954 538 H ALA 78 HN ALA 78 0.708 13.694 15.637 539 HA ALA 78 HA ALA 78 2.567 15.890 16.120 540 HB1 ALA 78 HB1 ALA 78 0.901 16.031 14.320 541 HB2 ALA 78 HB2 ALA 78 0.643 17.319 15.496 542 HB3 ALA 78 HB3 ALA 78 -0.400 15.898 15.502 543 H ALA 79 HN ALA 79 -0.567 14.941 17.585 544 HA ALA 79 HA ALA 79 -0.524 16.857 19.676 545 HB1 ALA 79 HB1 ALA 79 -1.639 14.086 20.073 546 HB2 ALA 79 HB2 ALA 79 -2.406 15.206 18.948 547 HB3 ALA 79 HB3 ALA 79 -2.273 15.625 20.656 548 H SER 80 HN SER 80 1.287 13.929 19.253 549 HA SER 80 HA SER 80 1.990 13.647 22.078 550 HB2 SER 80 HB1 SER 80 2.999 12.376 19.527 551 HB3 SER 80 HB2 SER 80 3.743 12.050 21.093 552 HG SER 80 HG SER 80 1.690 10.846 20.109 553 H GLN 81 HN GLN 81 3.121 15.472 19.371 554 HA GLN 81 HA GLN 81 5.849 15.832 20.027 555 HB2 GLN 81 HB1 GLN 81 3.839 17.705 18.757 556 HB3 GLN 81 HB2 GLN 81 5.556 18.087 18.890 557 HG2 GLN 81 HG2 GLN 81 6.051 15.923 17.701 558 HG3 GLN 81 HG1 GLN 81 4.318 15.736 17.430 559 HE21 GLN 81 HE21 GLN 81 6.963 18.129 16.881 560 HE22 GLN 81 HE22 GLN 81 6.341 18.695 15.408 561 H GLY 82 HN GLY 82 2.947 17.320 21.364 562 HA2 GLY 82 HA2 GLY 82 2.722 18.370 23.476 563 HA3 GLY 82 HA1 GLY 82 4.457 18.173 23.721 564 H GLY 83 HN GLY 83 3.523 19.563 20.717 565 HA2 GLY 83 HA1 GLY 83 4.602 22.175 21.631 566 HA3 GLY 83 HA2 GLY 83 4.439 21.665 19.951 567 H ASP 84 HN ASP 84 3.193 23.451 19.279 568 HA ASP 84 HA ASP 84 0.816 24.285 20.741 569 HB2 ASP 84 HB2 ASP 84 2.188 25.794 19.251 570 HB3 ASP 84 HB1 ASP 84 1.559 24.900 17.867 571 H LEU 85 HN LEU 85 -0.819 22.782 20.848 572 HA LEU 85 HA LEU 85 -1.345 20.765 18.912 573 HB2 LEU 85 HB2 LEU 85 -2.239 20.658 21.196 574 HB3 LEU 85 HB1 LEU 85 -3.242 22.075 20.884 575 HG LEU 85 HG LEU 85 -4.142 20.647 18.868 576 HD11 LEU 85 HD11 LEU 85 -2.926 18.581 20.718 577 HD12 LEU 85 HD12 LEU 85 -2.618 18.791 18.996 578 HD13 LEU 85 HD13 LEU 85 -4.185 18.198 19.545 579 HD21 LEU 85 HD21 LEU 85 -6.005 20.362 20.148 580 HD22 LEU 85 HD22 LEU 85 -5.082 21.245 21.364 581 HD23 LEU 85 HD23 LEU 85 -5.129 19.483 21.400 582 H GLY 86 HN GLY 86 -2.163 24.143 18.970 583 HA2 GLY 86 HA2 GLY 86 -4.387 24.009 17.136 584 HA3 GLY 86 HA1 GLY 86 -3.451 25.455 17.506 585 H VAL 87 HN VAL 87 -0.880 24.458 16.702 586 HA VAL 87 HA VAL 87 -1.047 24.973 13.875 587 HB VAL 87 HB VAL 87 0.940 25.347 15.536 588 HG11 VAL 87 HG11 VAL 87 2.526 23.608 15.742 589 HG12 VAL 87 HG12 VAL 87 1.778 22.655 14.460 590 HG13 VAL 87 HG13 VAL 87 0.982 22.806 16.025 591 HG21 VAL 87 HG21 VAL 87 2.541 24.860 13.510 592 HG22 VAL 87 HG22 VAL 87 1.287 26.089 13.351 593 HG23 VAL 87 HG23 VAL 87 1.042 24.484 12.660 594 H THR 88 HN THR 88 -0.646 21.966 15.756 595 HA THR 88 HA THR 88 -0.083 20.201 13.639 596 HB THR 88 HB THR 88 -1.852 19.769 16.067 597 HG1 THR 88 HG1 THR 88 0.433 20.221 16.329 598 HG21 THR 88 HG21 THR 88 -1.552 17.361 15.606 599 HG22 THR 88 HG22 THR 88 -0.695 17.757 14.116 600 HG23 THR 88 HG23 THR 88 -2.403 18.161 14.285 601 H THR 89 HN THR 89 -3.109 21.727 14.580 602 HA THR 89 HA THR 89 -4.889 20.239 12.945 603 HB THR 89 HB THR 89 -5.092 23.227 13.362 604 HG1 THR 89 HG1 THR 89 -6.004 22.721 15.373 605 HG21 THR 89 HG21 THR 89 -7.541 22.503 13.635 606 HG22 THR 89 HG22 THR 89 -7.031 20.943 12.993 607 HG23 THR 89 HG23 THR 89 -6.859 22.398 12.012 608 H ASN 90 HN ASN 90 -3.074 23.233 12.212 609 HA ASN 90 HA ASN 90 -3.846 23.245 9.427 610 HB2 ASN 90 HB1 ASN 90 -3.007 25.242 10.765 611 HB3 ASN 90 HB2 ASN 90 -1.391 24.550 10.626 612 HD21 ASN 90 HD21 ASN 90 -0.280 25.551 8.946 613 HD22 ASN 90 HD22 ASN 90 -0.942 25.920 7.428 614 H ALA 91 HN ALA 91 -1.022 22.053 11.221 615 HA ALA 91 HA ALA 91 0.538 21.278 8.957 616 HB1 ALA 91 HB1 ALA 91 0.539 19.729 11.538 617 HB2 ALA 91 HB2 ALA 91 1.176 21.373 11.485 618 HB3 ALA 91 HB3 ALA 91 1.897 20.115 10.480 619 H ILE 92 HN ILE 92 -1.628 19.321 11.022 620 HA ILE 92 HA ILE 92 -1.487 17.017 9.275 621 HB ILE 92 HB ILE 92 -3.453 17.748 11.465 622 HG12 ILE 92 HG12 ILE 92 -1.012 15.946 11.426 623 HG13 ILE 92 HG11 ILE 92 -1.135 17.503 12.244 624 HG21 ILE 92 HG21 ILE 92 -4.038 15.971 9.585 625 HG22 ILE 92 HG22 ILE 92 -4.391 15.635 11.279 626 HG23 ILE 92 HG23 ILE 92 -2.952 14.949 10.525 627 HD11 ILE 92 HD11 ILE 92 -3.079 16.551 13.558 628 HD12 ILE 92 HD12 ILE 92 -1.523 15.795 13.902 629 HD13 ILE 92 HD13 ILE 92 -2.690 14.977 12.863 630 H ALA 93 HN ALA 93 -4.066 19.429 9.900 631 HA ALA 93 HA ALA 93 -5.920 18.455 7.998 632 HB1 ALA 93 HB1 ALA 93 -5.422 21.354 8.731 633 HB2 ALA 93 HB2 ALA 93 -6.422 20.237 9.660 634 HB3 ALA 93 HB3 ALA 93 -6.897 20.697 8.026 635 H ASP 94 HN ASP 94 -3.383 20.944 7.550 636 HA ASP 94 HA ASP 94 -3.880 21.493 4.827 637 HB2 ASP 94 HB1 ASP 94 -1.289 21.440 6.389 638 HB3 ASP 94 HB2 ASP 94 -1.392 22.018 4.727 639 H ALA 95 HN ALA 95 -1.755 18.998 6.247 640 HA ALA 95 HA ALA 95 -0.839 17.873 3.813 641 HB1 ALA 95 HB1 ALA 95 -1.468 16.390 6.385 642 HB2 ALA 95 HB2 ALA 95 0.024 17.282 6.088 643 HB3 ALA 95 HB3 ALA 95 -0.363 15.864 5.116 644 H LEU 96 HN LEU 96 -3.720 17.087 5.758 645 HA LEU 96 HA LEU 96 -4.680 15.069 3.918 646 HB2 LEU 96 HB2 LEU 96 -6.408 16.658 5.821 647 HB3 LEU 96 HB1 LEU 96 -6.646 15.006 5.255 648 HG LEU 96 HG LEU 96 -4.102 15.571 6.697 649 HD11 LEU 96 HD21 LEU 96 -6.838 15.778 7.901 650 HD12 LEU 96 HD22 LEU 96 -5.376 16.687 8.288 651 HD13 LEU 96 HD23 LEU 96 -5.551 15.021 8.840 652 HD21 LEU 96 HD11 LEU 96 -6.126 13.328 6.909 653 HD22 LEU 96 HD12 LEU 96 -4.466 13.317 7.505 654 HD23 LEU 96 HD13 LEU 96 -4.780 13.335 5.770 655 H THR 97 HN THR 97 -5.016 18.549 4.161 656 HA THR 97 HA THR 97 -7.311 18.848 2.490 657 HB THR 97 HB THR 97 -4.981 20.715 2.970 658 HG1 THR 97 HG1 THR 97 -7.591 20.894 4.001 659 HG21 THR 97 HG21 THR 97 -6.019 22.333 1.740 660 HG22 THR 97 HG22 THR 97 -7.632 21.760 2.162 661 HG23 THR 97 HG23 THR 97 -6.711 20.947 0.897 662 H SER 98 HN SER 98 -3.840 19.165 1.650 663 HA SER 98 HA SER 98 -4.343 19.406 -1.169 664 HB2 SER 98 HB2 SER 98 -1.948 19.051 -1.434 665 HB3 SER 98 HB1 SER 98 -2.217 20.096 -0.039 666 HG SER 98 HG SER 98 -1.694 18.498 1.296 667 H ALA 99 HN ALA 99 -3.474 16.634 0.894 668 HA ALA 99 HA ALA 99 -3.190 14.675 -1.101 669 HB1 ALA 99 HB1 ALA 99 -4.015 13.065 0.674 670 HB2 ALA 99 HB2 ALA 99 -4.338 14.470 1.692 671 HB3 ALA 99 HB3 ALA 99 -2.688 14.112 1.179 672 H PHE 100 HN PHE 100 -6.182 15.849 0.454 673 HA PHE 100 HA PHE 100 -8.036 14.071 -0.671 674 HB2 PHE 100 HB1 PHE 100 -8.100 16.863 0.288 675 HB3 PHE 100 HB2 PHE 100 -9.359 16.469 -0.881 676 HD1 PHE 100 HD1 PHE 100 -10.547 14.111 -0.468 677 HD2 PHE 100 HD2 PHE 100 -8.506 16.418 2.534 678 HE1 PHE 100 HE1 PHE 100 -11.828 12.941 1.305 679 HE2 PHE 100 HE2 PHE 100 -9.787 15.244 4.302 680 HZ PHE 100 HZ PHE 100 -11.444 13.505 3.686 681 H TYR 101 HN TYR 101 -7.003 17.193 -2.073 682 HA TYR 101 HA TYR 101 -8.239 16.639 -4.627 683 HB2 TYR 101 HB2 TYR 101 -6.023 18.632 -4.179 684 HB3 TYR 101 HB1 TYR 101 -7.379 18.732 -5.303 685 HD1 TYR 101 HD1 TYR 101 -9.742 18.188 -3.848 686 HD2 TYR 101 HD2 TYR 101 -6.209 20.206 -2.466 687 HE1 TYR 101 HE1 TYR 101 -11.088 19.351 -2.114 688 HE2 TYR 101 HE2 TYR 101 -7.552 21.372 -0.735 689 HH TYR 101 HH TYR 101 -10.705 21.739 -0.799 690 H GLN 102 HN GLN 102 -5.047 16.143 -3.258 691 HA GLN 102 HA GLN 102 -3.790 15.492 -5.801 692 HB2 GLN 102 HB2 GLN 102 -2.966 14.968 -2.930 693 HB3 GLN 102 HB1 GLN 102 -1.960 14.585 -4.326 694 HG2 GLN 102 HG2 GLN 102 -2.496 17.131 -4.938 695 HG3 GLN 102 HG1 GLN 102 -2.701 17.248 -3.190 696 HE21 GLN 102 HE21 GLN 102 -0.592 18.687 -3.980 697 HE22 GLN 102 HE22 GLN 102 0.871 17.893 -3.645 698 H THR 103 HN THR 103 -5.823 13.798 -3.583 699 HA THR 103 HA THR 103 -4.966 11.195 -4.765 700 HB THR 103 HB THR 103 -6.006 10.140 -2.829 701 HG1 THR 103 HG1 THR 103 -6.818 11.621 -1.187 702 HG21 THR 103 HG21 THR 103 -3.920 10.550 -2.040 703 HG22 THR 103 HG22 THR 103 -4.701 11.797 -1.068 704 HG23 THR 103 HG23 THR 103 -3.940 12.222 -2.601 705 H THR 104 HN THR 104 -8.052 12.700 -3.634 706 HA THR 104 HA THR 104 -9.327 11.344 -5.979 707 HB THR 104 HB THR 104 -10.454 11.723 -3.195 708 HG1 THR 104 HG1 THR 104 -10.461 9.221 -4.058 709 HG21 THR 104 HG21 THR 104 -11.707 11.240 -5.793 710 HG22 THR 104 HG22 THR 104 -12.447 11.680 -4.253 711 HG23 THR 104 HG23 THR 104 -12.090 9.990 -4.609 712 H GLY 105 HN GLY 105 -9.605 14.108 -3.723 713 HA2 GLY 105 HA2 GLY 105 -10.016 16.351 -4.651 714 HA3 GLY 105 HA1 GLY 105 -10.914 15.591 -5.961 715 H VAL 106 HN VAL 106 -11.099 15.156 -2.418 716 HA VAL 106 HA VAL 106 -14.017 15.760 -2.625 717 HB VAL 106 HB VAL 106 -12.677 14.292 -0.352 718 HG11 VAL 106 HG21 VAL 106 -15.475 14.689 -1.385 719 HG12 VAL 106 HG22 VAL 106 -14.865 14.863 0.261 720 HG13 VAL 106 HG23 VAL 106 -15.086 13.256 -0.432 721 HG21 VAL 106 HG11 VAL 106 -14.010 12.461 -2.066 722 HG22 VAL 106 HG12 VAL 106 -12.286 12.532 -1.700 723 HG23 VAL 106 HG13 VAL 106 -12.932 13.417 -3.083 724 H VAL 107 HN VAL 107 -14.851 16.658 -0.409 725 HA VAL 107 HA VAL 107 -13.410 19.115 0.111 726 HB VAL 107 HB VAL 107 -15.165 19.505 1.796 727 HG11 VAL 107 HG21 VAL 107 -17.160 18.864 0.137 728 HG12 VAL 107 HG22 VAL 107 -15.816 18.553 -0.961 729 HG13 VAL 107 HG23 VAL 107 -16.023 20.154 -0.249 730 HG21 VAL 107 HG11 VAL 107 -15.876 17.650 2.887 731 HG22 VAL 107 HG12 VAL 107 -15.329 16.588 1.586 732 HG23 VAL 107 HG13 VAL 107 -16.910 17.366 1.487 733 H ASN 108 HN ASN 108 -11.697 19.295 1.450 734 HA ASN 108 HA ASN 108 -10.865 17.133 3.186 735 HB2 ASN 108 HB1 ASN 108 -9.786 19.894 3.562 736 HB3 ASN 108 HB2 ASN 108 -8.931 18.352 3.511 737 HD21 ASN 108 HD21 ASN 108 -10.314 17.517 0.979 738 HD22 ASN 108 HD22 ASN 108 -9.493 18.371 -0.233 739 H SER 109 HN SER 109 -12.693 20.080 3.626 740 HA SER 109 HA SER 109 -12.480 20.425 6.413 741 HB2 SER 109 HB1 SER 109 -14.937 20.853 4.689 742 HB3 SER 109 HB2 SER 109 -14.647 21.571 6.273 743 HG SER 109 HG SER 109 -13.415 22.095 3.815 744 H ARG 110 HN ARG 110 -14.362 18.041 4.609 745 HA ARG 110 HA ARG 110 -16.034 17.283 6.843 746 HB2 ARG 110 HB2 ARG 110 -16.642 16.769 4.509 747 HB3 ARG 110 HB1 ARG 110 -15.248 15.697 4.381 748 HG2 ARG 110 HG1 ARG 110 -17.123 14.290 4.872 749 HG3 ARG 110 HG2 ARG 110 -16.206 14.424 6.373 750 HD2 ARG 110 HD1 ARG 110 -17.728 16.202 7.150 751 HD3 ARG 110 HD2 ARG 110 -18.639 16.085 5.645 752 HE ARG 110 HE ARG 110 -18.894 13.563 6.473 753 HH11 ARG 110 HH21 ARG 110 -19.549 16.599 7.882 754 HH12 ARG 110 HH22 ARG 110 -20.308 15.947 9.297 755 HH21 ARG 110 HH11 ARG 110 -19.604 12.652 8.481 756 HH22 ARG 110 HH12 ARG 110 -20.339 13.714 9.636 757 H PHE 111 HN PHE 111 -13.196 15.631 5.375 758 HA PHE 111 HA PHE 111 -13.012 13.782 7.619 759 HB2 PHE 111 HB2 PHE 111 -12.248 13.205 5.317 760 HB3 PHE 111 HB1 PHE 111 -10.952 14.390 5.479 761 HD1 PHE 111 HD2 PHE 111 -12.351 11.257 6.921 762 HD2 PHE 111 HD1 PHE 111 -8.963 13.887 6.692 763 HE1 PHE 111 HE2 PHE 111 -10.964 9.572 8.098 764 HE2 PHE 111 HE1 PHE 111 -7.576 12.202 7.870 765 HZ PHE 111 HZ PHE 111 -8.576 10.045 8.573 766 H ILE 112 HN ILE 112 -11.114 16.595 6.531 767 HA ILE 112 HA ILE 112 -9.158 16.580 8.565 768 HB ILE 112 HB ILE 112 -10.457 18.904 7.118 769 HG12 ILE 112 HG12 ILE 112 -7.957 17.257 6.676 770 HG13 ILE 112 HG11 ILE 112 -9.327 17.450 5.582 771 HG21 ILE 112 HG21 ILE 112 -8.710 20.301 7.921 772 HG22 ILE 112 HG22 ILE 112 -7.797 18.929 8.550 773 HG23 ILE 112 HG23 ILE 112 -9.289 19.437 9.345 774 HD11 ILE 112 HD11 ILE 112 -7.383 19.625 6.418 775 HD12 ILE 112 HD12 ILE 112 -8.793 19.873 5.388 776 HD13 ILE 112 HD13 ILE 112 -7.463 18.855 4.833 777 H SER 113 HN SER 113 -12.354 18.192 8.553 778 HA SER 113 HA SER 113 -12.166 19.411 11.096 779 HB2 SER 113 HB1 SER 113 -14.034 19.758 9.465 780 HB3 SER 113 HB2 SER 113 -14.649 18.159 9.883 781 HG SER 113 HG SER 113 -14.440 20.460 11.499 782 H GLU 114 HN GLU 114 -13.230 16.117 10.239 783 HA GLU 114 HA GLU 114 -13.976 15.264 12.836 784 HB2 GLU 114 HB1 GLU 114 -12.727 13.710 10.550 785 HB3 GLU 114 HB2 GLU 114 -13.412 12.962 11.994 786 HG2 GLU 114 HG1 GLU 114 -15.578 14.131 11.491 787 HG3 GLU 114 HG2 GLU 114 -14.874 14.685 9.972 788 H ILE 115 HN ILE 115 -10.802 15.066 11.210 789 HA ILE 115 HA ILE 115 -9.426 13.920 13.455 790 HB ILE 115 HB ILE 115 -8.404 15.584 11.134 791 HG12 ILE 115 HG12 ILE 115 -8.363 12.595 11.652 792 HG13 ILE 115 HG11 ILE 115 -9.468 13.415 10.547 793 HG21 ILE 115 HG21 ILE 115 -6.962 15.493 13.269 794 HG22 ILE 115 HG22 ILE 115 -6.197 14.977 11.766 795 HG23 ILE 115 HG23 ILE 115 -6.773 13.775 12.921 796 HD11 ILE 115 HD11 ILE 115 -7.144 12.371 9.708 797 HD12 ILE 115 HD12 ILE 115 -6.552 13.954 10.213 798 HD13 ILE 115 HD13 ILE 115 -7.819 13.835 8.992 799 H ARG 116 HN ARG 116 -10.151 17.236 12.500 800 HA ARG 116 HA ARG 116 -8.405 18.665 14.175 801 HB2 ARG 116 HB1 ARG 116 -10.114 19.573 12.491 802 HB3 ARG 116 HB2 ARG 116 -11.308 19.415 13.778 803 HG2 ARG 116 HG1 ARG 116 -9.579 20.752 15.208 804 HG3 ARG 116 HG2 ARG 116 -8.902 21.211 13.647 805 HD2 ARG 116 HD1 ARG 116 -11.801 21.584 14.452 806 HD3 ARG 116 HD2 ARG 116 -10.581 22.858 14.462 807 HE ARG 116 HE ARG 116 -11.420 21.440 11.961 808 HH11 ARG 116 HH21 ARG 116 -8.962 23.286 12.118 809 HH12 ARG 116 HH22 ARG 116 -9.624 24.754 11.481 810 HH21 ARG 116 HH11 ARG 116 -12.919 23.737 11.840 811 HH22 ARG 116 HH12 ARG 116 -11.863 25.010 11.324 812 H SER 117 HN SER 117 -11.659 17.409 14.976 813 HA SER 117 HA SER 117 -11.517 18.252 17.733 814 HB2 SER 117 HB1 SER 117 -13.648 17.740 16.507 815 HB3 SER 117 HB2 SER 117 -13.209 16.032 16.551 816 HG SER 117 HG SER 117 -13.617 15.955 18.626 817 H LEU 118 HN LEU 118 -10.613 15.301 16.015 818 HA LEU 118 HA LEU 118 -10.190 13.682 18.353 819 HB2 LEU 118 HB1 LEU 118 -9.028 13.542 15.559 820 HB3 LEU 118 HB2 LEU 118 -8.736 12.319 16.797 821 HG LEU 118 HG LEU 118 -11.567 13.118 16.250 822 HD11 LEU 118 HD21 LEU 118 -11.010 10.894 14.601 823 HD12 LEU 118 HD22 LEU 118 -9.768 12.091 14.232 824 HD13 LEU 118 HD23 LEU 118 -11.473 12.515 14.082 825 HD21 LEU 118 HD11 LEU 118 -11.590 10.466 16.512 826 HD22 LEU 118 HD12 LEU 118 -11.490 11.520 17.922 827 HD23 LEU 118 HD13 LEU 118 -10.030 10.768 17.280 828 H ILE 119 HN ILE 119 -7.972 15.688 16.396 829 HA ILE 119 HA ILE 119 -5.596 15.090 17.822 830 HB ILE 119 HB ILE 119 -6.370 17.737 16.555 831 HG12 ILE 119 HG11 ILE 119 -4.771 15.506 15.297 832 HG13 ILE 119 HG12 ILE 119 -6.526 15.579 15.143 833 HG21 ILE 119 HG21 ILE 119 -4.271 18.423 17.008 834 HG22 ILE 119 HG22 ILE 119 -3.585 16.912 16.409 835 HG23 ILE 119 HG23 ILE 119 -4.130 17.030 18.082 836 HD11 ILE 119 HD11 ILE 119 -5.473 16.684 13.223 837 HD12 ILE 119 HD12 ILE 119 -4.568 17.741 14.308 838 HD13 ILE 119 HD13 ILE 119 -6.323 17.875 14.210 839 H GLY 120 HN GLY 120 -8.210 17.355 18.550 840 HA2 GLY 120 HA2 GLY 120 -6.846 18.693 20.710 841 HA3 GLY 120 HA1 GLY 120 -8.589 18.691 20.445 842 H MET 121 HN MET 121 -8.756 15.746 20.477 843 HA MET 121 HA MET 121 -9.101 15.394 23.328 844 HB2 MET 121 HB1 MET 121 -10.490 14.267 21.560 845 HB3 MET 121 HB2 MET 121 -9.093 13.264 21.171 846 HG2 MET 121 HG1 MET 121 -9.042 12.532 23.580 847 HG3 MET 121 HG2 MET 121 -10.558 13.399 23.821 848 HE1 MET 121 HE1 MET 121 -12.256 12.604 20.873 849 HE2 MET 121 HE2 MET 121 -12.429 13.271 22.494 850 HE3 MET 121 HE3 MET 121 -13.214 11.745 22.087 851 H PHE 122 HN PHE 122 -6.687 14.270 20.972 852 HA PHE 122 HA PHE 122 -5.280 12.544 22.780 853 HB2 PHE 122 HB2 PHE 122 -4.355 14.025 20.304 854 HB3 PHE 122 HB1 PHE 122 -3.380 12.826 21.154 855 HD1 PHE 122 HD1 PHE 122 -4.506 10.505 21.579 856 HD2 PHE 122 HD2 PHE 122 -5.858 13.333 18.643 857 HE1 PHE 122 HE1 PHE 122 -5.688 8.688 20.374 858 HE2 PHE 122 HE2 PHE 122 -7.040 11.517 17.438 859 HZ PHE 122 HZ PHE 122 -6.955 9.194 18.303 860 H ALA 123 HN ALA 123 -5.087 16.007 22.130 861 HA ALA 123 HA ALA 123 -2.638 16.447 23.591 862 HB1 ALA 123 HB1 ALA 123 -4.180 17.991 21.962 863 HB2 ALA 123 HB2 ALA 123 -2.945 18.642 23.040 864 HB3 ALA 123 HB3 ALA 123 -4.637 18.632 23.540 865 H GLN 124 HN GLN 124 -5.998 16.120 24.511 866 HA GLN 124 HA GLN 124 -5.728 17.290 27.141 867 HB2 GLN 124 HB1 GLN 124 -7.732 15.333 25.984 868 HB3 GLN 124 HB2 GLN 124 -7.863 16.024 27.602 869 HG2 GLN 124 HG2 GLN 124 -7.878 18.295 26.629 870 HG3 GLN 124 HG1 GLN 124 -7.752 17.601 25.011 871 HE21 GLN 124 HE21 GLN 124 -10.004 19.218 25.825 872 HE22 GLN 124 HE22 GLN 124 -11.379 18.223 25.785 873 H ALA 125 HN ALA 125 -5.267 14.058 25.800 874 HA ALA 125 HA ALA 125 -5.055 12.684 28.318 875 HB1 ALA 125 HB1 ALA 125 -4.086 10.869 27.041 876 HB2 ALA 125 HB2 ALA 125 -3.692 11.957 25.709 877 HB3 ALA 125 HB3 ALA 125 -5.377 11.581 26.073 878 H SER 126 HN SER 126 -2.764 14.484 26.332 879 HA SER 126 HA SER 126 -0.368 13.635 27.640 880 HB2 SER 126 HB1 SER 126 -0.936 16.358 26.431 881 HB3 SER 126 HB2 SER 126 0.649 15.632 26.689 882 HG SER 126 HG SER 126 0.005 13.957 25.252 883 H ALA 127 HN ALA 127 -2.825 15.999 28.489 884 HA ALA 127 HA ALA 127 -1.306 17.325 30.552 885 HB1 ALA 127 HB1 ALA 127 -4.112 17.262 29.630 886 HB2 ALA 127 HB2 ALA 127 -3.128 18.632 30.146 887 HB3 ALA 127 HB3 ALA 127 -3.910 17.605 31.348 888 H ASN 128 HN ASN 128 -2.645 14.211 30.339 889 HA ASN 128 HA ASN 128 -3.178 13.911 33.210 890 HB2 ASN 128 HB2 ASN 128 -3.070 11.896 30.947 891 HB3 ASN 128 HB1 ASN 128 -3.535 11.510 32.603 892 HD21 ASN 128 HD21 ASN 128 -5.350 11.224 30.360 893 HD22 ASN 128 HD22 ASN 128 -6.613 12.337 30.572 894 H ASP 129 HN ASP 129 -0.472 13.638 31.095 895 HA ASP 129 HA ASP 129 1.019 11.742 32.733 896 HB2 ASP 129 HB1 ASP 129 1.402 12.186 30.251 897 HB3 ASP 129 HB2 ASP 129 2.155 13.708 30.730 898 H VAL 130 HN VAL 130 1.021 15.278 32.292 899 HA VAL 130 HA VAL 130 3.145 15.871 34.089 900 HB VAL 130 HB VAL 130 2.189 17.561 32.585 901 HG11 VAL 130 HG11 VAL 130 -0.107 18.487 33.764 902 HG12 VAL 130 HG12 VAL 130 -0.274 16.746 33.993 903 HG13 VAL 130 HG13 VAL 130 -0.072 17.407 32.370 904 HG21 VAL 130 HG21 VAL 130 2.055 19.417 34.169 905 HG22 VAL 130 HG22 VAL 130 3.295 18.282 34.705 906 HG23 VAL 130 HG23 VAL 130 1.717 18.298 35.489 907 H TYR 131 HN TYR 131 -0.163 14.928 34.642 908 HA TYR 131 HA TYR 131 0.244 14.267 37.367 909 HB2 TYR 131 HB2 TYR 131 -0.838 16.062 38.553 910 HB3 TYR 131 HB1 TYR 131 0.412 16.792 37.548 911 HD1 TYR 131 HD2 TYR 131 -3.221 16.232 37.928 912 HD2 TYR 131 HD1 TYR 131 -0.150 18.174 35.638 913 HE1 TYR 131 HE2 TYR 131 -4.937 17.629 36.811 914 HE2 TYR 131 HE1 TYR 131 -1.867 19.571 34.520 915 HH TYR 131 HH TYR 131 -4.676 19.061 34.125 916 H ALA 132 HN ALA 132 -2.066 14.101 38.495 917 HA ALA 132 HA ALA 132 -3.767 12.703 36.548 918 HB1 ALA 132 HB1 ALA 132 -3.190 12.243 39.179 919 HB2 ALA 132 HB2 ALA 132 -4.598 11.581 38.348 920 HB3 ALA 132 HB3 ALA 132 -4.753 13.049 39.313 921 H SER 133 HN SER 133 -5.288 13.813 35.425 922 HA SER 133 HA SER 133 -6.064 16.482 35.882 923 HB2 SER 133 HB1 SER 133 -6.521 15.240 33.779 924 HB3 SER 133 HB2 SER 133 -7.744 14.290 34.624 925 HG SER 133 HG SER 133 -9.020 15.855 34.080 926 H ALA 134 HN ALA 134 -7.433 13.476 37.156 927 HA ALA 134 HA ALA 134 -9.802 14.466 38.307 928 HB1 ALA 134 HB1 ALA 134 -9.831 12.282 38.876 929 HB2 ALA 134 HB2 ALA 134 -8.743 12.685 40.204 930 HB3 ALA 134 HB3 ALA 134 -8.087 12.147 38.658 931 H GLY 135 HN GLY 135 -6.470 14.613 39.526 932 HA2 GLY 135 HA2 GLY 135 -5.605 16.322 40.953 933 HA3 GLY 135 HA1 GLY 135 -7.256 16.860 41.267 934 H SER 136 HN SER 136 -6.517 16.857 43.571 935 HA SER 136 HA SER 136 -5.766 14.445 44.920 936 HB2 SER 136 HB1 SER 136 -6.251 15.640 46.965 937 HB3 SER 136 HB2 SER 136 -5.530 16.785 45.834 938 HG SER 136 HG SER 136 -8.100 16.646 46.834 939 H GLY 137 HN GLY 137 -8.860 15.752 43.932 940 HA2 GLY 137 HA1 GLY 137 -10.348 13.787 45.556 941 HA3 GLY 137 HA2 GLY 137 -11.061 15.010 44.505 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 -17.183 -0.096 -4.716 2 H2 GLY 1 HT2 GLY 1 -18.025 -1.005 -5.879 3 H3 GLY 1 HT3 GLY 1 -18.862 -0.301 -4.578 4 HA2 GLY 1 HA2 GLY 1 -19.325 1.355 -5.980 5 HA3 GLY 1 HA1 GLY 1 -17.657 1.844 -5.680 6 H MET 2 HN MET 2 -18.707 2.506 -8.110 7 HA MET 2 HA MET 2 -17.365 0.565 -9.949 8 HB2 MET 2 HB2 MET 2 -19.882 2.183 -10.444 9 HB3 MET 2 HB1 MET 2 -19.036 1.250 -11.679 10 HG2 MET 2 HG1 MET 2 -19.327 -0.793 -10.250 11 HG3 MET 2 HG2 MET 2 -20.305 0.172 -9.144 12 HE1 MET 2 HE1 MET 2 -21.930 2.120 -11.488 13 HE2 MET 2 HE2 MET 2 -22.093 1.613 -9.809 14 HE3 MET 2 HE3 MET 2 -23.355 1.208 -10.971 15 H GLY 3 HN GLY 3 -16.505 1.621 -11.934 16 HA2 GLY 3 HA2 GLY 3 -15.315 3.329 -13.021 17 HA3 GLY 3 HA1 GLY 3 -16.338 4.482 -12.164 18 H GLN 4 HN GLN 4 -15.087 5.859 -11.003 19 HA GLN 4 HA GLN 4 -12.625 4.759 -9.708 20 HB2 GLN 4 HB2 GLN 4 -13.313 7.599 -10.523 21 HB3 GLN 4 HB1 GLN 4 -11.843 7.129 -9.670 22 HG2 GLN 4 HG2 GLN 4 -11.224 5.646 -11.540 23 HG3 GLN 4 HG1 GLN 4 -12.701 6.100 -12.392 24 HE21 GLN 4 HE21 GLN 4 -10.199 6.621 -13.605 25 HE22 GLN 4 HE22 GLN 4 -9.954 8.300 -13.648 26 H ALA 5 HN ALA 5 -12.207 5.380 -7.511 27 HA ALA 5 HA ALA 5 -14.574 5.585 -5.865 28 HB1 ALA 5 HB1 ALA 5 -11.756 6.152 -4.933 29 HB2 ALA 5 HB2 ALA 5 -12.306 4.508 -5.263 30 HB3 ALA 5 HB3 ALA 5 -13.095 5.469 -4.010 31 H ASN 6 HN ASN 6 -15.419 7.392 -4.821 32 HA ASN 6 HA ASN 6 -14.569 10.005 -5.878 33 HB2 ASN 6 HB2 ASN 6 -16.770 9.342 -3.898 34 HB3 ASN 6 HB1 ASN 6 -16.555 10.871 -4.752 35 HD21 ASN 6 HD21 ASN 6 -18.939 9.218 -5.000 36 HD22 ASN 6 HD22 ASN 6 -19.030 8.720 -6.620 37 H THR 7 HN THR 7 -13.144 8.228 -3.697 38 HA THR 7 HA THR 7 -12.219 10.528 -2.136 39 HB THR 7 HB THR 7 -14.142 9.918 -0.791 40 HG1 THR 7 HG1 THR 7 -11.804 8.762 0.313 41 HG21 THR 7 HG21 THR 7 -14.018 7.489 -1.849 42 HG22 THR 7 HG22 THR 7 -14.766 7.754 -0.273 43 HG23 THR 7 HG23 THR 7 -13.115 7.143 -0.373 44 HA PRO 8 HA PRO 8 -8.457 8.207 -2.324 45 HB2 PRO 8 HB2 PRO 8 -7.200 9.067 -0.091 46 HB3 PRO 8 HB1 PRO 8 -7.370 10.048 -1.548 47 HG2 PRO 8 HG1 PRO 8 -8.991 10.093 0.971 48 HG3 PRO 8 HG2 PRO 8 -8.360 11.450 0.034 49 HD2 PRO 8 HD1 PRO 8 -10.929 10.679 -0.167 50 HD3 PRO 8 HD2 PRO 8 -10.040 11.301 -1.557 51 H TRP 9 HN TRP 9 -10.157 8.073 0.828 52 HA TRP 9 HA TRP 9 -8.658 5.677 1.589 53 HB2 TRP 9 HB2 TRP 9 -10.177 5.597 3.536 54 HB3 TRP 9 HB1 TRP 9 -9.436 7.189 3.343 55 HD1 TRP 9 HD1 TRP 9 -12.758 5.365 3.109 56 HE1 TRP 9 HE1 TRP 9 -14.655 7.097 2.880 57 HE3 TRP 9 HE3 TRP 9 -9.998 9.603 2.453 58 HZ2 TRP 9 HZ2 TRP 9 -14.957 9.918 2.468 59 HZ3 TRP 9 HZ3 TRP 9 -11.108 11.794 2.146 60 HH2 TRP 9 HH2 TRP 9 -13.583 11.960 2.152 61 H SER 10 HN SER 10 -11.265 6.220 -0.480 62 HA SER 10 HA SER 10 -12.603 3.675 0.159 63 HB2 SER 10 HB1 SER 10 -13.103 5.838 -1.863 64 HB3 SER 10 HB2 SER 10 -13.883 4.258 -1.989 65 HG SER 10 HG SER 10 -15.096 5.819 -0.771 66 H SER 11 HN SER 11 -9.723 3.969 -0.954 67 HA SER 11 HA SER 11 -9.991 1.744 -2.852 68 HB2 SER 11 HB1 SER 11 -10.014 4.262 -3.930 69 HB3 SER 11 HB2 SER 11 -8.291 3.891 -3.948 70 HG SER 11 HG SER 11 -8.623 2.477 -5.452 71 H LYS 12 HN LYS 12 -8.020 0.609 -3.122 72 HA LYS 12 HA LYS 12 -6.162 0.856 -0.905 73 HB2 LYS 12 HB1 LYS 12 -6.915 -1.248 -2.323 74 HB3 LYS 12 HB2 LYS 12 -5.556 -0.781 -3.341 75 HG2 LYS 12 HG2 LYS 12 -4.134 -0.729 -1.238 76 HG3 LYS 12 HG1 LYS 12 -5.490 -1.477 -0.394 77 HD2 LYS 12 HD2 LYS 12 -3.956 -3.225 -1.122 78 HD3 LYS 12 HD1 LYS 12 -5.439 -3.339 -2.069 79 HE2 LYS 12 HE1 LYS 12 -4.164 -3.211 -3.923 80 HE3 LYS 12 HE2 LYS 12 -3.810 -1.540 -3.483 81 HZ1 LYS 12 HZ1 LYS 12 -2.152 -2.937 -1.881 82 HZ2 LYS 12 HZ2 LYS 12 -1.711 -2.247 -3.371 83 HZ3 LYS 12 HZ3 LYS 12 -2.150 -3.886 -3.287 84 H ALA 13 HN ALA 13 -6.060 1.614 -4.366 85 HA ALA 13 HA ALA 13 -3.255 2.492 -4.184 86 HB1 ALA 13 HB1 ALA 13 -3.651 3.171 -6.592 87 HB2 ALA 13 HB2 ALA 13 -5.289 2.538 -6.430 88 HB3 ALA 13 HB3 ALA 13 -3.905 1.457 -6.261 89 H ASN 14 HN ASN 14 -6.473 3.905 -4.306 90 HA ASN 14 HA ASN 14 -5.568 6.632 -4.670 91 HB2 ASN 14 HB1 ASN 14 -7.970 5.496 -4.943 92 HB3 ASN 14 HB2 ASN 14 -8.143 6.041 -3.275 93 HD21 ASN 14 HD21 ASN 14 -9.557 7.140 -5.645 94 HD22 ASN 14 HD22 ASN 14 -9.110 8.773 -5.756 95 H ALA 15 HN ALA 15 -6.046 4.530 -1.899 96 HA ALA 15 HA ALA 15 -6.002 6.645 0.072 97 HB1 ALA 15 HB1 ALA 15 -5.369 4.632 1.603 98 HB2 ALA 15 HB2 ALA 15 -5.698 3.659 0.168 99 HB3 ALA 15 HB3 ALA 15 -6.969 4.667 0.860 100 H ASP 16 HN ASP 16 -3.497 4.425 -1.167 101 HA ASP 16 HA ASP 16 -1.411 5.193 0.563 102 HB2 ASP 16 HB2 ASP 16 0.134 4.387 -1.126 103 HB3 ASP 16 HB1 ASP 16 -1.280 3.335 -1.113 104 H ALA 17 HN ALA 17 -2.517 6.773 -2.430 105 HA ALA 17 HA ALA 17 -0.439 8.737 -2.531 106 HB1 ALA 17 HB1 ALA 17 -3.015 8.267 -3.823 107 HB2 ALA 17 HB2 ALA 17 -1.563 9.029 -4.472 108 HB3 ALA 17 HB3 ALA 17 -2.720 9.983 -3.542 109 H PHE 18 HN PHE 18 -3.657 8.762 -1.002 110 HA PHE 18 HA PHE 18 -3.544 11.418 0.018 111 HB2 PHE 18 HB2 PHE 18 -5.584 9.969 -0.033 112 HB3 PHE 18 HB1 PHE 18 -4.896 9.014 1.278 113 HD1 PHE 18 HD1 PHE 18 -4.471 10.073 3.505 114 HD2 PHE 18 HD2 PHE 18 -6.565 12.118 0.362 115 HE1 PHE 18 HE1 PHE 18 -5.347 11.707 5.152 116 HE2 PHE 18 HE2 PHE 18 -7.440 13.753 2.009 117 HZ PHE 18 HZ PHE 18 -6.832 13.547 4.402 118 H ILE 19 HN ILE 19 -2.507 8.320 1.459 119 HA ILE 19 HA ILE 19 -1.633 9.466 3.947 120 HB ILE 19 HB ILE 19 -0.534 6.980 2.602 121 HG12 ILE 19 HG11 ILE 19 -2.913 6.718 2.605 122 HG13 ILE 19 HG12 ILE 19 -2.325 5.832 4.011 123 HG21 ILE 19 HG21 ILE 19 0.499 6.571 4.572 124 HG22 ILE 19 HG22 ILE 19 -0.940 6.998 5.499 125 HG23 ILE 19 HG23 ILE 19 0.173 8.259 4.968 126 HD11 ILE 19 HD11 ILE 19 -2.686 8.364 5.032 127 HD12 ILE 19 HD12 ILE 19 -3.850 7.046 5.173 128 HD13 ILE 19 HD13 ILE 19 -4.017 8.234 3.882 129 H ASN 20 HN ASN 20 0.056 8.724 0.904 130 HA ASN 20 HA ASN 20 2.644 9.590 1.823 131 HB2 ASN 20 HB2 ASN 20 2.825 8.275 -0.065 132 HB3 ASN 20 HB1 ASN 20 1.376 8.941 -0.806 133 HD21 ASN 20 HD21 ASN 20 1.917 10.076 -2.657 134 HD22 ASN 20 HD22 ASN 20 3.236 11.133 -2.804 135 H SER 21 HN SER 21 0.170 11.201 -0.201 136 HA SER 21 HA SER 21 1.519 13.691 -0.437 137 HB2 SER 21 HB1 SER 21 -1.474 13.210 -0.284 138 HB3 SER 21 HB2 SER 21 -0.684 14.636 -0.958 139 HG SER 21 HG SER 21 -0.016 13.503 -2.652 140 H PHE 22 HN PHE 22 -0.351 12.274 2.150 141 HA PHE 22 HA PHE 22 -0.730 14.715 3.655 142 HB2 PHE 22 HB1 PHE 22 -2.182 12.853 4.122 143 HB3 PHE 22 HB2 PHE 22 -0.811 11.790 4.435 144 HD1 PHE 22 HD2 PHE 22 0.705 12.293 6.416 145 HD2 PHE 22 HD1 PHE 22 -3.082 14.231 5.826 146 HE1 PHE 22 HE2 PHE 22 0.685 12.980 8.799 147 HE2 PHE 22 HE1 PHE 22 -3.103 14.918 8.207 148 HZ PHE 22 HZ PHE 22 -1.218 14.293 9.695 149 H ILE 23 HN ILE 23 1.549 11.977 4.047 150 HA ILE 23 HA ILE 23 3.022 13.167 6.190 151 HB ILE 23 HB ILE 23 3.983 11.193 4.101 152 HG12 ILE 23 HG12 ILE 23 2.865 10.632 6.859 153 HG13 ILE 23 HG11 ILE 23 1.884 10.570 5.395 154 HG21 ILE 23 HG21 ILE 23 5.601 12.489 5.748 155 HG22 ILE 23 HG22 ILE 23 5.803 10.758 5.479 156 HG23 ILE 23 HG23 ILE 23 4.976 11.335 6.926 157 HD11 ILE 23 HD11 ILE 23 2.855 8.340 6.130 158 HD12 ILE 23 HD12 ILE 23 4.446 8.991 5.737 159 HD13 ILE 23 HD13 ILE 23 3.233 8.806 4.471 160 H SER 24 HN SER 24 3.888 12.934 2.712 161 HA SER 24 HA SER 24 6.195 14.563 2.840 162 HB2 SER 24 HB2 SER 24 4.211 14.368 0.554 163 HB3 SER 24 HB1 SER 24 5.880 14.922 0.434 164 HG SER 24 HG SER 24 6.310 12.902 0.122 165 H ALA 25 HN ALA 25 2.784 15.468 2.530 166 HA ALA 25 HA ALA 25 3.385 18.297 2.165 167 HB1 ALA 25 HB1 ALA 25 1.309 17.405 1.263 168 HB2 ALA 25 HB2 ALA 25 0.921 18.577 2.521 169 HB3 ALA 25 HB3 ALA 25 0.813 16.849 2.861 170 H ALA 26 HN ALA 26 2.081 16.343 4.866 171 HA ALA 26 HA ALA 26 1.900 18.477 6.740 172 HB1 ALA 26 HB1 ALA 26 1.850 16.742 8.454 173 HB2 ALA 26 HB2 ALA 26 2.512 15.565 7.318 174 HB3 ALA 26 HB3 ALA 26 0.895 16.222 7.065 175 H SER 27 HN SER 27 4.662 16.694 5.580 176 HA SER 27 HA SER 27 6.416 17.227 7.793 177 HB2 SER 27 HB1 SER 27 6.973 16.670 4.869 178 HB3 SER 27 HB2 SER 27 8.235 16.796 6.094 179 HG SER 27 HG SER 27 6.520 14.757 5.566 180 H ASN 28 HN ASN 28 5.555 19.076 4.911 181 HA ASN 28 HA ASN 28 7.433 21.222 5.791 182 HB2 ASN 28 HB2 ASN 28 5.999 20.845 3.146 183 HB3 ASN 28 HB1 ASN 28 7.126 22.149 3.520 184 HD21 ASN 28 HD21 ASN 28 7.593 20.200 1.414 185 HD22 ASN 28 HD22 ASN 28 8.989 19.336 1.841 186 H THR 29 HN THR 29 4.361 20.417 6.421 187 HA THR 29 HA THR 29 3.078 22.990 5.826 188 HB THR 29 HB THR 29 2.017 20.792 7.611 189 HG1 THR 29 HG1 THR 29 2.516 19.855 5.669 190 HG21 THR 29 HG21 THR 29 0.503 22.677 5.813 191 HG22 THR 29 HG22 THR 29 0.955 23.136 7.454 192 HG23 THR 29 HG23 THR 29 -0.099 21.749 7.185 193 H GLY 30 HN GLY 30 3.157 21.282 8.963 194 HA2 GLY 30 HA1 GLY 30 3.340 23.888 10.315 195 HA3 GLY 30 HA2 GLY 30 3.099 22.329 11.101 196 H SER 31 HN SER 31 4.891 21.216 11.846 197 HA SER 31 HA SER 31 7.583 22.203 11.070 198 HB2 SER 31 HB2 SER 31 6.435 23.089 13.393 199 HB3 SER 31 HB1 SER 31 7.273 21.643 13.955 200 HG SER 31 HG SER 31 8.849 23.082 14.021 201 H PHE 32 HN PHE 32 5.912 19.879 13.229 202 HA PHE 32 HA PHE 32 6.487 17.642 13.723 203 HB2 PHE 32 HB2 PHE 32 6.578 17.930 10.733 204 HB3 PHE 32 HB1 PHE 32 7.033 16.393 11.469 205 HD1 PHE 32 HD2 PHE 32 5.320 15.798 13.568 206 HD2 PHE 32 HD1 PHE 32 4.357 18.026 10.016 207 HE1 PHE 32 HE2 PHE 32 2.930 15.205 13.842 208 HE2 PHE 32 HE1 PHE 32 1.970 17.428 10.294 209 HZ PHE 32 HZ PHE 32 1.256 16.017 12.205 210 H SER 33 HN SER 33 8.417 17.928 14.940 211 HA SER 33 HA SER 33 10.981 18.496 13.852 212 HB2 SER 33 HB1 SER 33 10.410 16.771 16.276 213 HB3 SER 33 HB2 SER 33 11.878 17.691 15.949 214 HG SER 33 HG SER 33 9.909 18.542 17.309 215 H GLN 34 HN GLN 34 12.804 16.978 13.586 216 HA GLN 34 HA GLN 34 12.286 14.873 11.797 217 HB2 GLN 34 HB1 GLN 34 14.626 15.236 13.693 218 HB3 GLN 34 HB2 GLN 34 14.596 14.081 12.361 219 HG2 GLN 34 HG2 GLN 34 14.231 15.937 10.767 220 HG3 GLN 34 HG1 GLN 34 14.280 17.088 12.103 221 HE21 GLN 34 HE21 GLN 34 16.180 17.285 10.004 222 HE22 GLN 34 HE22 GLN 34 17.711 16.848 10.592 223 H ASP 35 HN ASP 35 12.384 14.851 15.321 224 HA ASP 35 HA ASP 35 12.342 11.970 15.580 225 HB2 ASP 35 HB1 ASP 35 11.618 14.223 17.468 226 HB3 ASP 35 HB2 ASP 35 11.515 12.525 17.930 227 H GLN 36 HN GLN 36 9.849 14.490 15.415 228 HA GLN 36 HA GLN 36 7.669 12.616 15.898 229 HB2 GLN 36 HB1 GLN 36 7.580 15.389 14.668 230 HB3 GLN 36 HB2 GLN 36 6.215 14.495 15.337 231 HG2 GLN 36 HG2 GLN 36 6.936 14.773 17.532 232 HG3 GLN 36 HG1 GLN 36 8.622 14.979 17.061 233 HE21 GLN 36 HE21 GLN 36 7.647 16.903 18.774 234 HE22 GLN 36 HE22 GLN 36 7.410 18.365 17.945 235 H MET 37 HN MET 37 9.302 13.972 13.076 236 HA MET 37 HA MET 37 7.416 13.065 11.113 237 HB2 MET 37 HB2 MET 37 10.406 13.534 10.887 238 HB3 MET 37 HB1 MET 37 9.315 13.302 9.520 239 HG2 MET 37 HG1 MET 37 7.990 15.275 10.312 240 HG3 MET 37 HG2 MET 37 9.205 15.541 11.564 241 HE1 MET 37 HE1 MET 37 9.334 14.393 7.814 242 HE2 MET 37 HE2 MET 37 9.689 15.924 7.019 243 HE3 MET 37 HE3 MET 37 8.186 15.735 7.920 244 H GLU 38 HN GLU 38 10.145 11.511 12.735 245 HA GLU 38 HA GLU 38 10.398 9.221 11.088 246 HB2 GLU 38 HB2 GLU 38 10.871 9.728 14.018 247 HB3 GLU 38 HB1 GLU 38 11.047 8.101 13.361 248 HG2 GLU 38 HG1 GLU 38 12.640 8.986 11.667 249 HG3 GLU 38 HG2 GLU 38 12.501 10.585 12.398 250 H ASN 39 HN ASN 39 8.221 9.830 13.844 251 HA ASN 39 HA ASN 39 6.998 7.283 13.964 252 HB2 ASN 39 HB2 ASN 39 5.736 10.005 14.425 253 HB3 ASN 39 HB1 ASN 39 5.058 8.465 14.956 254 HD21 ASN 39 HD21 ASN 39 5.928 10.672 16.722 255 HD22 ASN 39 HD22 ASN 39 7.194 10.068 17.676 256 H MET 40 HN MET 40 6.477 9.980 11.763 257 HA MET 40 HA MET 40 4.042 9.078 10.585 258 HB2 MET 40 HB2 MET 40 6.324 10.642 9.339 259 HB3 MET 40 HB1 MET 40 4.707 10.485 8.650 260 HG2 MET 40 HG2 MET 40 3.791 11.471 10.783 261 HG3 MET 40 HG1 MET 40 5.453 11.784 11.286 262 HE1 MET 40 HE1 MET 40 2.920 13.817 8.114 263 HE2 MET 40 HE2 MET 40 2.522 12.499 9.214 264 HE3 MET 40 HE3 MET 40 3.462 12.170 7.760 265 H SER 41 HN SER 41 7.401 8.175 10.056 266 HA SER 41 HA SER 41 6.934 6.686 7.624 267 HB2 SER 41 HB2 SER 41 9.189 7.477 8.358 268 HB3 SER 41 HB1 SER 41 9.134 6.309 9.678 269 HG SER 41 HG SER 41 10.136 5.229 8.099 270 H LEU 42 HN LEU 42 6.497 6.004 11.012 271 HA LEU 42 HA LEU 42 6.270 3.098 10.543 272 HB2 LEU 42 HB2 LEU 42 5.875 4.800 13.022 273 HB3 LEU 42 HB1 LEU 42 5.719 3.044 12.992 274 HG LEU 42 HG LEU 42 8.081 2.998 12.005 275 HD11 LEU 42 HD21 LEU 42 9.328 5.165 12.884 276 HD12 LEU 42 HD22 LEU 42 7.740 5.901 12.664 277 HD13 LEU 42 HD23 LEU 42 8.565 5.156 11.294 278 HD21 LEU 42 HD11 LEU 42 8.984 2.797 14.131 279 HD22 LEU 42 HD12 LEU 42 7.265 2.739 14.520 280 HD23 LEU 42 HD13 LEU 42 8.166 4.241 14.728 281 H ILE 43 HN ILE 43 4.243 5.908 10.711 282 HA ILE 43 HA ILE 43 1.833 4.135 10.682 283 HB ILE 43 HB ILE 43 2.159 7.006 11.599 284 HG12 ILE 43 HG12 ILE 43 1.129 4.567 13.073 285 HG13 ILE 43 HG11 ILE 43 2.802 5.119 13.155 286 HG21 ILE 43 HG21 ILE 43 -0.285 6.882 12.092 287 HG22 ILE 43 HG22 ILE 43 -0.348 5.334 11.250 288 HG23 ILE 43 HG23 ILE 43 0.062 6.804 10.365 289 HD11 ILE 43 HD11 ILE 43 2.262 7.020 14.358 290 HD12 ILE 43 HD12 ILE 43 0.995 5.937 14.935 291 HD13 ILE 43 HD13 ILE 43 0.639 7.118 13.674 292 H GLY 44 HN GLY 44 0.032 5.013 9.286 293 HA2 GLY 44 HA1 GLY 44 -0.762 5.949 7.273 294 HA3 GLY 44 HA2 GLY 44 0.671 6.975 7.242 295 H ASN 45 HN ASN 45 2.524 6.236 6.119 296 HA ASN 45 HA ASN 45 2.155 4.597 3.864 297 HB2 ASN 45 HB2 ASN 45 4.704 5.138 5.418 298 HB3 ASN 45 HB1 ASN 45 4.649 4.424 3.807 299 HD21 ASN 45 HD21 ASN 45 2.511 6.038 2.722 300 HD22 ASN 45 HD22 ASN 45 3.058 7.640 2.611 301 H THR 46 HN THR 46 3.178 3.728 7.138 302 HA THR 46 HA THR 46 3.949 1.041 6.643 303 HB THR 46 HB THR 46 2.605 2.249 9.081 304 HG1 THR 46 HG1 THR 46 5.197 2.103 8.095 305 HG21 THR 46 HG21 THR 46 4.321 0.020 9.641 306 HG22 THR 46 HG22 THR 46 3.124 -0.467 8.442 307 HG23 THR 46 HG23 THR 46 2.602 0.197 9.990 308 H LEU 47 HN LEU 47 0.768 2.513 7.090 309 HA LEU 47 HA LEU 47 -0.780 0.162 7.399 310 HB2 LEU 47 HB2 LEU 47 -1.517 2.698 5.901 311 HB3 LEU 47 HB1 LEU 47 -2.653 1.488 6.498 312 HG LEU 47 HG LEU 47 -0.775 3.169 8.188 313 HD11 LEU 47 HD11 LEU 47 -2.559 4.580 7.640 314 HD12 LEU 47 HD12 LEU 47 -3.139 3.825 9.125 315 HD13 LEU 47 HD13 LEU 47 -3.714 3.250 7.560 316 HD21 LEU 47 HD21 LEU 47 -2.593 0.848 8.802 317 HD22 LEU 47 HD22 LEU 47 -2.266 2.072 10.029 318 HD23 LEU 47 HD23 LEU 47 -0.940 1.131 9.347 319 H MET 48 HN MET 48 0.543 1.692 4.493 320 HA MET 48 HA MET 48 -0.832 0.248 2.509 321 HB2 MET 48 HB2 MET 48 2.076 1.111 2.571 322 HB3 MET 48 HB1 MET 48 1.235 0.551 1.126 323 HG2 MET 48 HG2 MET 48 -0.461 2.381 1.503 324 HG3 MET 48 HG1 MET 48 0.572 2.993 2.795 325 HE1 MET 48 HE1 MET 48 2.961 2.832 2.528 326 HE2 MET 48 HE2 MET 48 3.555 4.225 1.629 327 HE3 MET 48 HE3 MET 48 3.826 2.602 1.001 328 H ALA 49 HN ALA 49 1.996 -0.722 4.435 329 HA ALA 49 HA ALA 49 2.493 -3.195 3.102 330 HB1 ALA 49 HB1 ALA 49 4.009 -3.582 4.781 331 HB2 ALA 49 HB2 ALA 49 2.881 -3.105 6.049 332 HB3 ALA 49 HB3 ALA 49 3.729 -1.873 5.115 333 H ALA 50 HN ALA 50 0.156 -2.255 5.552 334 HA ALA 50 HA ALA 50 -0.662 -4.913 6.295 335 HB1 ALA 50 HB1 ALA 50 -2.005 -2.207 6.438 336 HB2 ALA 50 HB2 ALA 50 -1.313 -3.149 7.758 337 HB3 ALA 50 HB3 ALA 50 -2.809 -3.678 6.988 338 H MET 51 HN MET 51 -1.615 -2.691 3.717 339 HA MET 51 HA MET 51 -3.947 -4.055 2.830 340 HB2 MET 51 HB2 MET 51 -1.904 -2.612 1.113 341 HB3 MET 51 HB1 MET 51 -3.587 -2.933 0.692 342 HG2 MET 51 HG2 MET 51 -4.388 -1.464 2.405 343 HG3 MET 51 HG1 MET 51 -2.790 -1.341 3.140 344 HE1 MET 51 HE1 MET 51 -3.308 2.114 2.181 345 HE2 MET 51 HE2 MET 51 -4.146 0.827 3.043 346 HE3 MET 51 HE3 MET 51 -4.810 1.441 1.532 347 H ASP 52 HN ASP 52 -0.529 -4.725 2.367 348 HA ASP 52 HA ASP 52 -0.718 -6.568 0.211 349 HB2 ASP 52 HB2 ASP 52 1.188 -6.427 2.562 350 HB3 ASP 52 HB1 ASP 52 1.386 -7.563 1.228 351 H ASN 53 HN ASN 53 -1.570 -6.849 3.580 352 HA ASN 53 HA ASN 53 -1.594 -9.721 3.741 353 HB2 ASN 53 HB2 ASN 53 -3.147 -7.612 5.270 354 HB3 ASN 53 HB1 ASN 53 -3.154 -9.328 5.677 355 HD21 ASN 53 HD21 ASN 53 -2.124 -7.359 7.497 356 HD22 ASN 53 HD22 ASN 53 -0.443 -7.550 7.622 357 H MET 54 HN MET 54 -3.864 -7.339 2.518 358 HA MET 54 HA MET 54 -6.181 -9.017 2.409 359 HB2 MET 54 HB2 MET 54 -5.336 -6.665 0.694 360 HB3 MET 54 HB1 MET 54 -6.919 -7.431 0.589 361 HG2 MET 54 HG2 MET 54 -5.724 -6.108 3.044 362 HG3 MET 54 HG1 MET 54 -7.051 -5.484 2.064 363 HE1 MET 54 HE1 MET 54 -9.858 -8.067 2.538 364 HE2 MET 54 HE2 MET 54 -8.596 -8.120 1.309 365 HE3 MET 54 HE3 MET 54 -9.310 -6.574 1.764 366 H GLY 55 HN GLY 55 -3.448 -8.571 0.202 367 HA2 GLY 55 HA2 GLY 55 -2.683 -10.348 -1.256 368 HA3 GLY 55 HA1 GLY 55 -4.303 -11.046 -1.207 369 H GLY 56 HN GLY 56 -4.352 -7.669 -1.584 370 HA2 GLY 56 HA2 GLY 56 -4.265 -6.364 -3.637 371 HA3 GLY 56 HA1 GLY 56 -4.391 -7.865 -4.555 372 H ARG 57 HN ARG 57 -6.450 -7.486 -1.796 373 HA ARG 57 HA ARG 57 -8.715 -6.628 -3.532 374 HB2 ARG 57 HB2 ARG 57 -10.124 -8.416 -2.703 375 HB3 ARG 57 HB1 ARG 57 -8.658 -9.139 -3.362 376 HG2 ARG 57 HG2 ARG 57 -7.745 -8.953 -0.933 377 HG3 ARG 57 HG1 ARG 57 -9.437 -8.755 -0.476 378 HD2 ARG 57 HD2 ARG 57 -9.951 -10.880 -1.719 379 HD3 ARG 57 HD1 ARG 57 -8.218 -11.096 -1.967 380 HE ARG 57 HE ARG 57 -7.986 -11.281 0.501 381 HH11 ARG 57 HH11 ARG 57 -9.609 -13.621 -0.189 382 HH12 ARG 57 HH12 ARG 57 -10.989 -13.470 0.847 383 HH21 ARG 57 HH21 ARG 57 -10.429 -10.121 1.549 384 HH22 ARG 57 HH22 ARG 57 -11.453 -11.489 1.831 385 H ILE 58 HN ILE 58 -9.480 -4.821 -2.536 386 HA ILE 58 HA ILE 58 -9.468 -4.785 0.452 387 HB ILE 58 HB ILE 58 -9.637 -2.411 -1.422 388 HG12 ILE 58 HG11 ILE 58 -7.489 -3.444 -1.776 389 HG13 ILE 58 HG12 ILE 58 -7.233 -2.073 -0.696 390 HG21 ILE 58 HG21 ILE 58 -10.517 -2.215 0.951 391 HG22 ILE 58 HG22 ILE 58 -9.198 -1.110 0.559 392 HG23 ILE 58 HG23 ILE 58 -8.880 -2.562 1.508 393 HD11 ILE 58 HD11 ILE 58 -7.826 -4.129 1.056 394 HD12 ILE 58 HD12 ILE 58 -6.203 -3.554 0.674 395 HD13 ILE 58 HD13 ILE 58 -6.873 -4.939 -0.187 396 H THR 59 HN THR 59 -11.418 -4.795 1.445 397 HA THR 59 HA THR 59 -13.846 -4.670 -0.232 398 HB THR 59 HB THR 59 -14.890 -5.864 1.430 399 HG1 THR 59 HG1 THR 59 -13.920 -5.479 3.707 400 HG21 THR 59 HG21 THR 59 -12.338 -6.686 1.009 401 HG22 THR 59 HG22 THR 59 -13.481 -7.552 2.036 402 HG23 THR 59 HG23 THR 59 -12.308 -6.450 2.757 403 HA PRO 60 HA PRO 60 -15.145 -0.600 0.913 404 HB2 PRO 60 HB2 PRO 60 -17.756 -0.906 1.550 405 HB3 PRO 60 HB1 PRO 60 -17.155 -0.994 -0.107 406 HG2 PRO 60 HG2 PRO 60 -17.828 -3.214 1.788 407 HG3 PRO 60 HG1 PRO 60 -18.204 -3.069 0.069 408 HD2 PRO 60 HD2 PRO 60 -16.156 -4.585 0.962 409 HD3 PRO 60 HD1 PRO 60 -16.087 -3.737 -0.583 410 H SER 61 HN SER 61 -15.604 -3.155 3.254 411 HA SER 61 HA SER 61 -16.354 -1.402 5.449 412 HB2 SER 61 HB2 SER 61 -16.813 -3.901 5.321 413 HB3 SER 61 HB1 SER 61 -15.099 -4.151 5.653 414 HG SER 61 HG SER 61 -15.352 -3.447 7.643 415 H LYS 62 HN LYS 62 -13.321 -2.953 4.394 416 HA LYS 62 HA LYS 62 -11.752 -1.753 6.527 417 HB2 LYS 62 HB2 LYS 62 -10.840 -2.915 3.874 418 HB3 LYS 62 HB1 LYS 62 -9.815 -2.592 5.273 419 HG2 LYS 62 HG2 LYS 62 -11.088 -4.214 6.605 420 HG3 LYS 62 HG1 LYS 62 -12.163 -4.513 5.239 421 HD2 LYS 62 HD2 LYS 62 -10.271 -5.344 3.910 422 HD3 LYS 62 HD1 LYS 62 -9.169 -5.004 5.245 423 HE2 LYS 62 HE2 LYS 62 -11.393 -6.582 6.192 424 HE3 LYS 62 HE1 LYS 62 -10.647 -7.376 4.804 425 HZ1 LYS 62 HZ1 LYS 62 -8.463 -6.895 5.970 426 HZ2 LYS 62 HZ2 LYS 62 -9.440 -8.113 6.641 427 HZ3 LYS 62 HZ3 LYS 62 -9.387 -6.571 7.354 428 H LEU 63 HN LEU 63 -12.679 -0.880 3.266 429 HA LEU 63 HA LEU 63 -10.826 1.106 2.612 430 HB2 LEU 63 HB2 LEU 63 -13.432 0.330 1.774 431 HB3 LEU 63 HB1 LEU 63 -13.468 2.075 2.022 432 HG LEU 63 HG LEU 63 -11.588 2.380 0.535 433 HD11 LEU 63 HD11 LEU 63 -10.153 0.593 0.952 434 HD12 LEU 63 HD12 LEU 63 -10.739 0.286 -0.686 435 HD13 LEU 63 HD13 LEU 63 -11.421 -0.605 0.677 436 HD21 LEU 63 HD21 LEU 63 -13.484 2.340 -0.808 437 HD22 LEU 63 HD22 LEU 63 -13.851 0.663 -0.403 438 HD23 LEU 63 HD23 LEU 63 -12.545 1.033 -1.530 439 H GLN 64 HN GLN 64 -13.836 1.539 4.490 440 HA GLN 64 HA GLN 64 -13.126 4.263 5.242 441 HB2 GLN 64 HB2 GLN 64 -15.486 3.543 5.035 442 HB3 GLN 64 HB1 GLN 64 -15.249 2.409 6.366 443 HG2 GLN 64 HG2 GLN 64 -16.136 4.253 7.487 444 HG3 GLN 64 HG1 GLN 64 -14.405 4.550 7.651 445 HE21 GLN 64 HE21 GLN 64 -13.955 6.715 7.237 446 HE22 GLN 64 HE22 GLN 64 -14.715 7.665 6.054 447 H ALA 65 HN ALA 65 -13.226 1.112 6.916 448 HA ALA 65 HA ALA 65 -12.444 1.927 9.480 449 HB1 ALA 65 HB1 ALA 65 -11.741 -0.308 9.855 450 HB2 ALA 65 HB2 ALA 65 -11.292 -0.536 8.165 451 HB3 ALA 65 HB3 ALA 65 -12.993 -0.445 8.620 452 H LEU 66 HN LEU 66 -10.286 1.032 6.759 453 HA LEU 66 HA LEU 66 -7.830 1.573 8.048 454 HB2 LEU 66 HB1 LEU 66 -8.022 0.532 5.794 455 HB3 LEU 66 HB2 LEU 66 -8.517 2.093 5.137 456 HG LEU 66 HG LEU 66 -6.326 3.004 6.162 457 HD11 LEU 66 HD21 LEU 66 -5.773 1.123 7.588 458 HD12 LEU 66 HD22 LEU 66 -4.544 1.234 6.327 459 HD13 LEU 66 HD23 LEU 66 -5.815 0.015 6.216 460 HD21 LEU 66 HD11 LEU 66 -5.028 2.265 4.184 461 HD22 LEU 66 HD12 LEU 66 -6.675 2.715 3.743 462 HD23 LEU 66 HD13 LEU 66 -6.232 1.013 3.872 463 H ASP 67 HN ASP 67 -9.861 3.781 6.096 464 HA ASP 67 HA ASP 67 -8.339 6.113 6.267 465 HB2 ASP 67 HB1 ASP 67 -10.784 5.607 5.303 466 HB3 ASP 67 HB2 ASP 67 -11.264 6.371 6.818 467 H MET 68 HN MET 68 -10.717 4.960 8.675 468 HA MET 68 HA MET 68 -10.365 7.066 10.541 469 HB2 MET 68 HB2 MET 68 -11.079 4.155 10.992 470 HB3 MET 68 HB1 MET 68 -11.217 5.411 12.222 471 HG2 MET 68 HG2 MET 68 -12.724 6.684 10.679 472 HG3 MET 68 HG1 MET 68 -12.660 5.327 9.555 473 HE1 MET 68 HE1 MET 68 -13.139 6.625 12.843 474 HE2 MET 68 HE2 MET 68 -13.496 5.218 13.842 475 HE3 MET 68 HE3 MET 68 -14.816 6.209 13.225 476 H ALA 69 HN ALA 69 -8.636 3.954 10.263 477 HA ALA 69 HA ALA 69 -7.029 4.183 12.573 478 HB1 ALA 69 HB1 ALA 69 -7.017 2.128 11.309 479 HB2 ALA 69 HB2 ALA 69 -5.374 2.772 11.284 480 HB3 ALA 69 HB3 ALA 69 -6.416 2.957 9.872 481 H PHE 70 HN PHE 70 -6.405 5.413 9.279 482 HA PHE 70 HA PHE 70 -3.841 6.509 9.762 483 HB2 PHE 70 HB1 PHE 70 -4.940 6.354 7.519 484 HB3 PHE 70 HB2 PHE 70 -6.003 7.682 7.986 485 HD1 PHE 70 HD2 PHE 70 -2.411 6.750 7.581 486 HD2 PHE 70 HD1 PHE 70 -5.290 9.929 7.793 487 HE1 PHE 70 HE2 PHE 70 -0.659 8.379 6.925 488 HE2 PHE 70 HE1 PHE 70 -3.539 11.559 7.138 489 HZ PHE 70 HZ PHE 70 -1.223 10.784 6.703 490 H ALA 71 HN ALA 71 -7.057 7.994 10.199 491 HA ALA 71 HA ALA 71 -6.053 10.528 11.104 492 HB1 ALA 71 HB1 ALA 71 -8.273 10.756 10.578 493 HB2 ALA 71 HB2 ALA 71 -8.475 10.407 12.295 494 HB3 ALA 71 HB3 ALA 71 -8.672 9.121 11.104 495 H SER 72 HN SER 72 -6.892 7.526 12.790 496 HA SER 72 HA SER 72 -6.625 8.626 15.444 497 HB2 SER 72 HB1 SER 72 -6.301 5.753 14.526 498 HB3 SER 72 HB2 SER 72 -6.584 6.288 16.182 499 HG SER 72 HG SER 72 -8.606 6.832 15.692 500 H SER 73 HN SER 73 -4.408 6.612 13.474 501 HA SER 73 HA SER 73 -2.243 6.821 15.365 502 HB2 SER 73 HB1 SER 73 -2.008 6.234 12.407 503 HB3 SER 73 HB2 SER 73 -0.906 5.737 13.691 504 HG SER 73 HG SER 73 -3.593 4.913 13.324 505 H VAL 74 HN VAL 74 -3.156 8.682 12.498 506 HA VAL 74 HA VAL 74 -0.721 10.199 12.334 507 HB VAL 74 HB VAL 74 -2.546 10.010 10.558 508 HG11 VAL 74 HG11 VAL 74 -3.791 12.180 12.271 509 HG12 VAL 74 HG12 VAL 74 -4.438 10.554 12.060 510 HG13 VAL 74 HG13 VAL 74 -4.365 11.656 10.687 511 HG21 VAL 74 HG21 VAL 74 -1.420 11.709 9.603 512 HG22 VAL 74 HG22 VAL 74 -0.725 12.077 11.181 513 HG23 VAL 74 HG23 VAL 74 -2.210 12.874 10.666 514 H ALA 75 HN ALA 75 -3.828 10.828 13.959 515 HA ALA 75 HA ALA 75 -3.141 13.429 14.909 516 HB1 ALA 75 HB1 ALA 75 -5.252 13.350 15.690 517 HB2 ALA 75 HB2 ALA 75 -4.844 12.021 16.775 518 HB3 ALA 75 HB3 ALA 75 -5.345 11.683 15.119 519 H GLN 76 HN GLN 76 -2.464 10.204 16.161 520 HA GLN 76 HA GLN 76 -1.572 11.101 18.764 521 HB2 GLN 76 HB1 GLN 76 -1.074 8.551 17.207 522 HB3 GLN 76 HB2 GLN 76 -0.513 8.809 18.859 523 HG2 GLN 76 HG2 GLN 76 -2.839 9.206 19.588 524 HG3 GLN 76 HG1 GLN 76 -3.400 8.950 17.935 525 HE21 GLN 76 HE21 GLN 76 -4.373 7.255 19.963 526 HE22 GLN 76 HE22 GLN 76 -3.738 5.698 19.729 527 H ILE 77 HN ILE 77 0.113 10.311 15.721 528 HA ILE 77 HA ILE 77 2.767 10.574 16.623 529 HB ILE 77 HB ILE 77 1.638 11.457 13.952 530 HG12 ILE 77 HG12 ILE 77 2.966 8.825 14.608 531 HG13 ILE 77 HG11 ILE 77 1.222 9.043 14.762 532 HG21 ILE 77 HG21 ILE 77 3.767 12.229 13.715 533 HG22 ILE 77 HG22 ILE 77 4.178 10.525 13.519 534 HG23 ILE 77 HG23 ILE 77 4.356 11.301 15.093 535 HD11 ILE 77 HD11 ILE 77 2.829 8.687 12.358 536 HD12 ILE 77 HD12 ILE 77 1.838 10.143 12.266 537 HD13 ILE 77 HD13 ILE 77 1.080 8.576 12.558 538 H ALA 78 HN ALA 78 0.706 13.117 15.211 539 HA ALA 78 HA ALA 78 2.626 15.201 15.888 540 HB1 ALA 78 HB1 ALA 78 -0.272 15.493 15.059 541 HB2 ALA 78 HB2 ALA 78 1.066 15.311 13.927 542 HB3 ALA 78 HB3 ALA 78 0.983 16.730 14.971 543 H ALA 79 HN ALA 79 -0.645 14.348 17.093 544 HA ALA 79 HA ALA 79 -0.760 16.335 19.114 545 HB1 ALA 79 HB1 ALA 79 -2.688 14.912 18.428 546 HB2 ALA 79 HB2 ALA 79 -2.456 14.933 20.176 547 HB3 ALA 79 HB3 ALA 79 -1.930 13.538 19.234 548 H SER 80 HN SER 80 0.998 13.321 18.982 549 HA SER 80 HA SER 80 1.504 13.189 21.852 550 HB2 SER 80 HB2 SER 80 3.125 11.430 21.246 551 HB3 SER 80 HB1 SER 80 1.582 11.165 20.434 552 HG SER 80 HG SER 80 2.768 12.618 18.759 553 H GLN 81 HN GLN 81 2.856 14.894 19.171 554 HA GLN 81 HA GLN 81 5.529 15.267 19.829 555 HB2 GLN 81 HB1 GLN 81 3.600 17.452 18.982 556 HB3 GLN 81 HB2 GLN 81 5.354 17.503 18.821 557 HG2 GLN 81 HG2 GLN 81 5.346 15.692 17.245 558 HG3 GLN 81 HG1 GLN 81 3.646 15.346 17.557 559 HE21 GLN 81 HE21 GLN 81 5.604 16.780 15.296 560 HE22 GLN 81 HE22 GLN 81 4.517 17.916 14.657 561 H GLY 82 HN GLY 82 2.700 16.613 21.446 562 HA2 GLY 82 HA2 GLY 82 2.551 17.480 23.636 563 HA3 GLY 82 HA1 GLY 82 4.271 17.147 23.839 564 H GLY 83 HN GLY 83 3.477 18.925 21.014 565 HA2 GLY 83 HA1 GLY 83 4.501 21.404 22.333 566 HA3 GLY 83 HA2 GLY 83 4.703 21.030 20.621 567 H ASP 84 HN ASP 84 3.693 23.162 20.224 568 HA ASP 84 HA ASP 84 1.009 23.759 21.058 569 HB2 ASP 84 HB2 ASP 84 2.904 24.816 19.003 570 HB3 ASP 84 HB1 ASP 84 1.198 25.227 18.833 571 H LEU 85 HN LEU 85 -0.585 22.295 20.569 572 HA LEU 85 HA LEU 85 -0.624 20.600 18.277 573 HB2 LEU 85 HB2 LEU 85 -2.517 21.382 20.406 574 HB3 LEU 85 HB1 LEU 85 -3.276 20.875 18.897 575 HG LEU 85 HG LEU 85 -1.408 18.943 19.108 576 HD11 LEU 85 HD21 LEU 85 -0.378 19.374 21.139 577 HD12 LEU 85 HD22 LEU 85 -1.689 18.322 21.678 578 HD13 LEU 85 HD23 LEU 85 -1.835 20.072 21.848 579 HD21 LEU 85 HD11 LEU 85 -4.119 19.064 19.211 580 HD22 LEU 85 HD12 LEU 85 -3.772 18.480 20.838 581 HD23 LEU 85 HD13 LEU 85 -3.207 17.570 19.437 582 H GLY 86 HN GLY 86 -1.341 23.953 18.626 583 HA2 GLY 86 HA1 GLY 86 -3.270 24.373 16.609 584 HA3 GLY 86 HA2 GLY 86 -2.017 25.540 17.032 585 H VAL 87 HN VAL 87 0.267 24.050 16.317 586 HA VAL 87 HA VAL 87 0.319 24.493 13.468 587 HB VAL 87 HB VAL 87 2.250 23.143 15.370 588 HG11 VAL 87 HG21 VAL 87 2.413 22.188 13.061 589 HG12 VAL 87 HG22 VAL 87 3.855 23.085 13.537 590 HG13 VAL 87 HG23 VAL 87 2.681 23.819 12.444 591 HG21 VAL 87 HG11 VAL 87 2.256 25.473 15.751 592 HG22 VAL 87 HG12 VAL 87 2.031 25.843 14.042 593 HG23 VAL 87 HG13 VAL 87 3.586 25.240 14.616 594 H THR 88 HN THR 88 0.248 21.524 15.460 595 HA THR 88 HA THR 88 0.422 19.646 13.365 596 HB THR 88 HB THR 88 -1.155 19.518 15.946 597 HG1 THR 88 HG1 THR 88 0.645 18.234 16.542 598 HG21 THR 88 HG21 THR 88 -1.156 17.058 15.540 599 HG22 THR 88 HG22 THR 88 -0.494 17.354 13.931 600 HG23 THR 88 HG23 THR 88 -2.104 17.944 14.344 601 H THR 89 HN THR 89 -2.513 21.129 14.750 602 HA THR 89 HA THR 89 -4.420 19.901 13.094 603 HB THR 89 HB THR 89 -4.555 22.843 13.769 604 HG1 THR 89 HG1 THR 89 -4.958 20.608 15.466 605 HG21 THR 89 HG21 THR 89 -6.369 21.766 12.427 606 HG22 THR 89 HG22 THR 89 -6.932 22.375 13.983 607 HG23 THR 89 HG23 THR 89 -6.645 20.648 13.764 608 H ASN 90 HN ASN 90 -2.560 22.887 12.469 609 HA ASN 90 HA ASN 90 -3.585 23.191 9.781 610 HB2 ASN 90 HB2 ASN 90 -2.597 25.062 11.122 611 HB3 ASN 90 HB1 ASN 90 -1.018 24.295 10.959 612 HD21 ASN 90 HD21 ASN 90 -3.697 25.684 9.008 613 HD22 ASN 90 HD22 ASN 90 -2.721 26.098 7.683 614 H ALA 91 HN ALA 91 -0.808 21.575 11.227 615 HA ALA 91 HA ALA 91 0.549 21.017 8.739 616 HB1 ALA 91 HB1 ALA 91 0.707 19.512 11.366 617 HB2 ALA 91 HB2 ALA 91 1.665 20.938 10.968 618 HB3 ALA 91 HB3 ALA 91 1.882 19.447 10.053 619 H ILE 92 HN ILE 92 -1.288 18.852 10.916 620 HA ILE 92 HA ILE 92 -1.447 16.697 9.048 621 HB ILE 92 HB ILE 92 -3.244 17.435 11.378 622 HG12 ILE 92 HG12 ILE 92 -0.930 15.492 11.108 623 HG13 ILE 92 HG11 ILE 92 -0.907 17.012 12.002 624 HG21 ILE 92 HG21 ILE 92 -2.974 14.677 10.211 625 HG22 ILE 92 HG22 ILE 92 -4.120 15.819 9.509 626 HG23 ILE 92 HG23 ILE 92 -4.275 15.342 11.199 627 HD11 ILE 92 HD11 ILE 92 -2.545 16.204 13.572 628 HD12 ILE 92 HD12 ILE 92 -1.311 14.952 13.424 629 HD13 ILE 92 HD13 ILE 92 -2.856 14.770 12.593 630 H ALA 93 HN ALA 93 -3.835 19.221 9.897 631 HA ALA 93 HA ALA 93 -5.867 18.432 8.099 632 HB1 ALA 93 HB1 ALA 93 -6.675 20.742 8.248 633 HB2 ALA 93 HB2 ALA 93 -5.113 21.265 8.878 634 HB3 ALA 93 HB3 ALA 93 -6.134 20.191 9.835 635 H ASP 94 HN ASP 94 -3.262 20.840 7.511 636 HA ASP 94 HA ASP 94 -3.928 21.411 4.826 637 HB2 ASP 94 HB1 ASP 94 -2.096 22.462 6.340 638 HB3 ASP 94 HB2 ASP 94 -1.064 21.172 5.724 639 H ALA 95 HN ALA 95 -1.666 18.918 6.050 640 HA ALA 95 HA ALA 95 -0.942 17.807 3.569 641 HB1 ALA 95 HB1 ALA 95 -1.163 15.602 5.237 642 HB2 ALA 95 HB2 ALA 95 -0.947 16.938 6.367 643 HB3 ALA 95 HB3 ALA 95 0.251 16.647 5.106 644 H LEU 96 HN LEU 96 -3.780 17.117 5.603 645 HA LEU 96 HA LEU 96 -4.853 15.092 3.842 646 HB2 LEU 96 HB2 LEU 96 -6.394 16.835 5.782 647 HB3 LEU 96 HB1 LEU 96 -6.846 15.235 5.193 648 HG LEU 96 HG LEU 96 -4.217 15.573 6.595 649 HD11 LEU 96 HD21 LEU 96 -6.954 15.631 7.846 650 HD12 LEU 96 HD22 LEU 96 -5.537 16.603 8.241 651 HD13 LEU 96 HD23 LEU 96 -5.599 14.905 8.709 652 HD21 LEU 96 HD11 LEU 96 -6.295 13.374 6.428 653 HD22 LEU 96 HD12 LEU 96 -4.773 13.257 7.312 654 HD23 LEU 96 HD13 LEU 96 -4.761 13.431 5.557 655 H THR 97 HN THR 97 -5.399 18.588 4.209 656 HA THR 97 HA THR 97 -7.528 18.803 2.321 657 HB THR 97 HB THR 97 -5.407 20.840 3.068 658 HG1 THR 97 HG1 THR 97 -7.180 21.575 4.405 659 HG21 THR 97 HG21 THR 97 -6.325 21.975 1.330 660 HG22 THR 97 HG22 THR 97 -7.696 22.208 2.413 661 HG23 THR 97 HG23 THR 97 -7.713 20.893 1.240 662 H SER 98 HN SER 98 -4.001 19.247 1.884 663 HA SER 98 HA SER 98 -4.157 19.766 -0.929 664 HB2 SER 98 HB2 SER 98 -1.867 18.507 0.612 665 HB3 SER 98 HB1 SER 98 -1.758 19.302 -0.959 666 HG SER 98 HG SER 98 -1.240 20.877 0.418 667 H ALA 99 HN ALA 99 -3.969 16.783 0.946 668 HA ALA 99 HA ALA 99 -3.473 15.047 -1.307 669 HB1 ALA 99 HB1 ALA 99 -2.975 14.194 0.876 670 HB2 ALA 99 HB2 ALA 99 -4.352 13.263 0.286 671 HB3 ALA 99 HB3 ALA 99 -4.599 14.558 1.458 672 H PHE 100 HN PHE 100 -6.438 16.005 0.431 673 HA PHE 100 HA PHE 100 -8.335 14.421 -0.840 674 HB2 PHE 100 HB1 PHE 100 -8.327 17.111 0.370 675 HB3 PHE 100 HB2 PHE 100 -9.621 16.845 -0.799 676 HD1 PHE 100 HD2 PHE 100 -11.021 14.678 -0.552 677 HD2 PHE 100 HD1 PHE 100 -8.499 16.255 2.552 678 HE1 PHE 100 HE2 PHE 100 -12.268 13.355 1.136 679 HE2 PHE 100 HE1 PHE 100 -9.743 14.931 4.233 680 HZ PHE 100 HZ PHE 100 -11.627 13.480 3.528 681 H TYR 101 HN TYR 101 -7.267 17.636 -2.002 682 HA TYR 101 HA TYR 101 -8.606 17.348 -4.542 683 HB2 TYR 101 HB2 TYR 101 -6.270 19.183 -4.079 684 HB3 TYR 101 HB1 TYR 101 -7.706 19.449 -5.069 685 HD1 TYR 101 HD1 TYR 101 -9.909 18.707 -3.336 686 HD2 TYR 101 HD2 TYR 101 -6.280 20.790 -2.365 687 HE1 TYR 101 HE1 TYR 101 -11.043 19.777 -1.408 688 HE2 TYR 101 HE2 TYR 101 -7.414 21.864 -0.438 689 HH TYR 101 HH TYR 101 -10.817 21.123 0.338 690 H GLN 102 HN GLN 102 -5.379 16.606 -3.371 691 HA GLN 102 HA GLN 102 -4.282 16.136 -6.023 692 HB2 GLN 102 HB1 GLN 102 -3.340 15.400 -3.242 693 HB3 GLN 102 HB2 GLN 102 -2.430 15.012 -4.702 694 HG2 GLN 102 HG2 GLN 102 -3.344 17.819 -4.036 695 HG3 GLN 102 HG1 GLN 102 -1.770 17.186 -3.553 696 HE21 GLN 102 HE21 GLN 102 -2.908 19.188 -5.792 697 HE22 GLN 102 HE22 GLN 102 -2.013 18.734 -7.161 698 H THR 103 HN THR 103 -6.248 14.306 -3.842 699 HA THR 103 HA THR 103 -5.501 11.786 -5.242 700 HB THR 103 HB THR 103 -6.673 10.636 -3.422 701 HG1 THR 103 HG1 THR 103 -7.369 12.072 -1.663 702 HG21 THR 103 HG21 THR 103 -4.512 10.882 -2.700 703 HG22 THR 103 HG22 THR 103 -5.291 11.904 -1.491 704 HG23 THR 103 HG23 THR 103 -4.534 12.634 -2.907 705 H THR 104 HN THR 104 -8.576 13.303 -4.083 706 HA THR 104 HA THR 104 -9.802 12.227 -6.596 707 HB THR 104 HB THR 104 -11.756 11.577 -5.422 708 HG1 THR 104 HG1 THR 104 -11.674 12.099 -3.021 709 HG21 THR 104 HG21 THR 104 -9.151 10.781 -4.341 710 HG22 THR 104 HG22 THR 104 -10.531 9.784 -4.798 711 HG23 THR 104 HG23 THR 104 -10.477 10.538 -3.204 712 H GLY 105 HN GLY 105 -10.077 14.726 -4.059 713 HA2 GLY 105 HA2 GLY 105 -10.369 17.075 -4.800 714 HA3 GLY 105 HA1 GLY 105 -11.346 16.466 -6.133 715 H VAL 106 HN VAL 106 -11.434 15.642 -2.662 716 HA VAL 106 HA VAL 106 -14.323 16.410 -2.683 717 HB VAL 106 HB VAL 106 -12.933 14.592 -0.700 718 HG11 VAL 106 HG21 VAL 106 -14.960 15.128 0.271 719 HG12 VAL 106 HG22 VAL 106 -15.481 13.787 -0.748 720 HG13 VAL 106 HG23 VAL 106 -15.737 15.449 -1.279 721 HG21 VAL 106 HG11 VAL 106 -13.268 12.769 -2.062 722 HG22 VAL 106 HG12 VAL 106 -13.058 13.985 -3.323 723 HG23 VAL 106 HG13 VAL 106 -14.678 13.482 -2.843 724 H VAL 107 HN VAL 107 -15.055 17.095 -0.356 725 HA VAL 107 HA VAL 107 -13.453 19.398 0.389 726 HB VAL 107 HB VAL 107 -15.187 19.489 2.306 727 HG11 VAL 107 HG21 VAL 107 -16.066 20.944 0.830 728 HG12 VAL 107 HG22 VAL 107 -16.960 19.608 0.102 729 HG13 VAL 107 HG23 VAL 107 -15.368 20.046 -0.519 730 HG21 VAL 107 HG11 VAL 107 -16.726 17.837 2.497 731 HG22 VAL 107 HG12 VAL 107 -15.628 16.877 1.504 732 HG23 VAL 107 HG13 VAL 107 -16.965 17.748 0.752 733 H ASN 108 HN ASN 108 -11.729 19.330 1.725 734 HA ASN 108 HA ASN 108 -11.024 16.958 3.216 735 HB2 ASN 108 HB2 ASN 108 -9.122 18.244 3.993 736 HB3 ASN 108 HB1 ASN 108 -9.380 18.623 2.289 737 HD21 ASN 108 HD21 ASN 108 -9.495 20.827 1.814 738 HD22 ASN 108 HD22 ASN 108 -9.865 22.046 2.936 739 H SER 109 HN SER 109 -12.862 19.800 3.905 740 HA SER 109 HA SER 109 -12.633 20.012 6.699 741 HB2 SER 109 HB2 SER 109 -13.916 21.561 5.198 742 HB3 SER 109 HB1 SER 109 -15.189 20.344 5.106 743 HG SER 109 HG SER 109 -15.797 20.820 7.059 744 H ARG 110 HN ARG 110 -14.405 17.616 4.799 745 HA ARG 110 HA ARG 110 -16.014 16.647 6.987 746 HB2 ARG 110 HB2 ARG 110 -15.083 15.226 4.474 747 HB3 ARG 110 HB1 ARG 110 -16.354 14.655 5.555 748 HG2 ARG 110 HG1 ARG 110 -16.457 17.396 4.292 749 HG3 ARG 110 HG2 ARG 110 -17.106 15.974 3.475 750 HD2 ARG 110 HD2 ARG 110 -18.499 15.520 5.517 751 HD3 ARG 110 HD1 ARG 110 -17.939 17.054 6.184 752 HE ARG 110 HE ARG 110 -19.238 18.212 4.522 753 HH11 ARG 110 HH11 ARG 110 -18.868 16.445 2.179 754 HH12 ARG 110 HH12 ARG 110 -20.417 15.687 2.021 755 HH21 ARG 110 HH21 ARG 110 -21.446 16.517 5.226 756 HH22 ARG 110 HH22 ARG 110 -21.876 15.728 3.746 757 H PHE 111 HN PHE 111 -13.041 15.277 5.511 758 HA PHE 111 HA PHE 111 -12.728 13.374 7.692 759 HB2 PHE 111 HB1 PHE 111 -11.898 13.010 5.334 760 HB3 PHE 111 HB2 PHE 111 -10.653 14.216 5.657 761 HD1 PHE 111 HD2 PHE 111 -12.068 11.016 6.984 762 HD2 PHE 111 HD1 PHE 111 -8.647 13.600 6.716 763 HE1 PHE 111 HE2 PHE 111 -10.678 9.291 8.096 764 HE2 PHE 111 HE1 PHE 111 -7.257 11.874 7.828 765 HZ PHE 111 HZ PHE 111 -8.272 9.719 8.518 766 H ILE 112 HN ILE 112 -10.942 16.298 6.682 767 HA ILE 112 HA ILE 112 -9.071 16.345 8.791 768 HB ILE 112 HB ILE 112 -10.364 18.618 7.264 769 HG12 ILE 112 HG12 ILE 112 -7.757 17.101 7.016 770 HG13 ILE 112 HG11 ILE 112 -9.067 17.177 5.837 771 HG21 ILE 112 HG21 ILE 112 -9.285 20.087 8.589 772 HG22 ILE 112 HG22 ILE 112 -7.765 19.224 8.358 773 HG23 ILE 112 HG23 ILE 112 -8.857 18.753 9.660 774 HD11 ILE 112 HD11 ILE 112 -7.128 19.350 6.633 775 HD12 ILE 112 HD12 ILE 112 -8.657 19.732 5.844 776 HD13 ILE 112 HD13 ILE 112 -7.468 18.723 5.020 777 H SER 113 HN SER 113 -12.366 17.722 8.690 778 HA SER 113 HA SER 113 -12.305 19.045 11.190 779 HB2 SER 113 HB2 SER 113 -14.194 19.307 9.670 780 HB3 SER 113 HB1 SER 113 -14.607 17.602 9.842 781 HG SER 113 HG SER 113 -15.083 19.719 11.526 782 H GLU 114 HN GLU 114 -13.192 15.660 10.460 783 HA GLU 114 HA GLU 114 -13.816 14.871 13.110 784 HB2 GLU 114 HB2 GLU 114 -12.534 13.253 10.886 785 HB3 GLU 114 HB1 GLU 114 -13.250 12.570 12.345 786 HG2 GLU 114 HG2 GLU 114 -15.418 13.654 11.737 787 HG3 GLU 114 HG1 GLU 114 -14.684 14.207 10.231 788 H ILE 115 HN ILE 115 -10.692 14.694 11.382 789 HA ILE 115 HA ILE 115 -9.216 13.715 13.643 790 HB ILE 115 HB ILE 115 -8.302 15.261 11.197 791 HG12 ILE 115 HG12 ILE 115 -8.157 12.303 11.853 792 HG13 ILE 115 HG11 ILE 115 -9.377 13.030 10.806 793 HG21 ILE 115 HG21 ILE 115 -6.723 15.404 13.138 794 HG22 ILE 115 HG22 ILE 115 -6.055 14.518 11.768 795 HG23 ILE 115 HG23 ILE 115 -6.664 13.642 13.172 796 HD11 ILE 115 HD11 ILE 115 -7.848 13.500 9.123 797 HD12 ILE 115 HD12 ILE 115 -7.147 12.021 9.781 798 HD13 ILE 115 HD13 ILE 115 -6.488 13.589 10.241 799 H ARG 116 HN ARG 116 -10.023 16.965 12.506 800 HA ARG 116 HA ARG 116 -8.258 18.495 14.082 801 HB2 ARG 116 HB2 ARG 116 -10.018 19.272 12.350 802 HB3 ARG 116 HB1 ARG 116 -11.152 19.262 13.700 803 HG2 ARG 116 HG1 ARG 116 -9.177 20.629 14.877 804 HG3 ARG 116 HG2 ARG 116 -8.807 21.045 13.203 805 HD2 ARG 116 HD2 ARG 116 -11.175 21.769 12.897 806 HD3 ARG 116 HD1 ARG 116 -11.471 21.436 14.604 807 HE ARG 116 HE ARG 116 -9.297 23.168 14.611 808 HH11 ARG 116 HH11 ARG 116 -11.785 24.062 15.853 809 HH12 ARG 116 HH12 ARG 116 -12.299 25.369 14.838 810 HH21 ARG 116 HH21 ARG 116 -10.254 24.465 12.189 811 HH22 ARG 116 HH22 ARG 116 -11.433 25.596 12.764 812 H SER 117 HN SER 117 -11.479 17.217 14.962 813 HA SER 117 HA SER 117 -11.334 18.230 17.675 814 HB2 SER 117 HB2 SER 117 -13.353 16.964 18.059 815 HB3 SER 117 HB1 SER 117 -13.466 17.656 16.440 816 HG SER 117 HG SER 117 -13.167 15.023 17.243 817 H LEU 118 HN LEU 118 -10.472 15.193 16.095 818 HA LEU 118 HA LEU 118 -10.050 13.686 18.511 819 HB2 LEU 118 HB2 LEU 118 -8.953 13.384 15.703 820 HB3 LEU 118 HB1 LEU 118 -8.632 12.228 16.996 821 HG LEU 118 HG LEU 118 -11.461 13.038 16.364 822 HD11 LEU 118 HD21 LEU 118 -11.523 10.978 14.883 823 HD12 LEU 118 HD22 LEU 118 -9.760 10.990 14.919 824 HD13 LEU 118 HD23 LEU 118 -10.637 12.347 14.212 825 HD21 LEU 118 HD11 LEU 118 -10.022 10.879 17.835 826 HD22 LEU 118 HD12 LEU 118 -11.527 10.436 17.029 827 HD23 LEU 118 HD13 LEU 118 -11.521 11.712 18.246 828 H ILE 119 HN ILE 119 -7.859 15.585 16.431 829 HA ILE 119 HA ILE 119 -5.449 15.025 17.812 830 HB ILE 119 HB ILE 119 -6.305 17.573 16.407 831 HG12 ILE 119 HG12 ILE 119 -4.586 15.283 15.413 832 HG13 ILE 119 HG11 ILE 119 -6.311 15.421 15.074 833 HG21 ILE 119 HG21 ILE 119 -3.553 17.304 16.194 834 HG22 ILE 119 HG22 ILE 119 -3.875 16.818 17.859 835 HG23 ILE 119 HG23 ILE 119 -4.392 18.404 17.288 836 HD11 ILE 119 HD11 ILE 119 -4.827 16.360 13.260 837 HD12 ILE 119 HD12 ILE 119 -4.292 17.583 14.412 838 HD13 ILE 119 HD13 ILE 119 -5.982 17.519 13.916 839 H GLY 120 HN GLY 120 -7.970 17.442 18.469 840 HA2 GLY 120 HA1 GLY 120 -6.534 18.747 20.602 841 HA3 GLY 120 HA2 GLY 120 -8.271 18.859 20.320 842 H MET 121 HN MET 121 -8.702 15.965 20.457 843 HA MET 121 HA MET 121 -9.189 15.696 23.255 844 HB2 MET 121 HB2 MET 121 -10.389 14.425 21.463 845 HB3 MET 121 HB1 MET 121 -8.928 13.470 21.212 846 HG2 MET 121 HG1 MET 121 -9.013 12.796 23.619 847 HG3 MET 121 HG2 MET 121 -10.545 13.656 23.772 848 HE1 MET 121 HE1 MET 121 -8.556 11.588 21.541 849 HE2 MET 121 HE2 MET 121 -9.628 10.452 20.730 850 HE3 MET 121 HE3 MET 121 -8.997 10.067 22.328 851 H PHE 122 HN PHE 122 -6.504 14.600 21.217 852 HA PHE 122 HA PHE 122 -5.233 12.980 23.219 853 HB2 PHE 122 HB2 PHE 122 -4.139 14.422 20.791 854 HB3 PHE 122 HB1 PHE 122 -3.174 13.335 21.791 855 HD1 PHE 122 HD1 PHE 122 -4.066 10.940 22.154 856 HD2 PHE 122 HD2 PHE 122 -5.525 13.571 19.088 857 HE1 PHE 122 HE1 PHE 122 -4.990 8.995 20.924 858 HE2 PHE 122 HE2 PHE 122 -6.449 11.627 17.859 859 HZ PHE 122 HZ PHE 122 -6.182 9.338 18.777 860 H ALA 123 HN ALA 123 -5.026 16.425 22.412 861 HA ALA 123 HA ALA 123 -2.799 17.026 24.117 862 HB1 ALA 123 HB1 ALA 123 -4.446 19.300 24.077 863 HB2 ALA 123 HB2 ALA 123 -4.739 18.498 22.533 864 HB3 ALA 123 HB3 ALA 123 -3.098 18.957 22.991 865 H GLN 124 HN GLN 124 -6.217 16.568 24.730 866 HA GLN 124 HA GLN 124 -6.257 17.823 27.332 867 HB2 GLN 124 HB2 GLN 124 -8.034 15.680 26.127 868 HB3 GLN 124 HB1 GLN 124 -8.368 16.523 27.640 869 HG2 GLN 124 HG2 GLN 124 -8.415 18.672 26.454 870 HG3 GLN 124 HG1 GLN 124 -8.017 17.861 24.939 871 HE21 GLN 124 HE21 GLN 124 -10.426 19.339 25.132 872 HE22 GLN 124 HE22 GLN 124 -11.745 18.271 25.135 873 H ALA 125 HN ALA 125 -5.494 14.578 26.170 874 HA ALA 125 HA ALA 125 -5.435 13.341 28.780 875 HB1 ALA 125 HB1 ALA 125 -5.303 12.412 26.203 876 HB2 ALA 125 HB2 ALA 125 -4.922 11.446 27.629 877 HB3 ALA 125 HB3 ALA 125 -3.628 12.235 26.726 878 H SER 126 HN SER 126 -3.071 15.078 26.817 879 HA SER 126 HA SER 126 -0.784 14.384 28.443 880 HB2 SER 126 HB1 SER 126 0.375 16.125 27.225 881 HB3 SER 126 HB2 SER 126 -0.675 15.279 26.087 882 HG SER 126 HG SER 126 -0.899 17.518 25.868 883 H ALA 127 HN ALA 127 -3.372 16.673 28.761 884 HA ALA 127 HA ALA 127 -2.051 18.540 30.510 885 HB1 ALA 127 HB1 ALA 127 -5.001 17.875 30.563 886 HB2 ALA 127 HB2 ALA 127 -4.282 18.852 29.284 887 HB3 ALA 127 HB3 ALA 127 -4.227 19.410 30.955 888 H ASN 128 HN ASN 128 -3.314 15.351 30.963 889 HA ASN 128 HA ASN 128 -3.757 15.541 33.821 890 HB2 ASN 128 HB1 ASN 128 -4.709 13.766 32.259 891 HB3 ASN 128 HB2 ASN 128 -3.104 13.033 32.255 892 HD21 ASN 128 HD21 ASN 128 -4.927 11.363 33.301 893 HD22 ASN 128 HD22 ASN 128 -4.883 11.337 34.997 894 H ASP 129 HN ASP 129 -0.977 14.946 31.780 895 HA ASP 129 HA ASP 129 0.717 13.768 33.782 896 HB2 ASP 129 HB1 ASP 129 1.389 15.380 31.303 897 HB3 ASP 129 HB2 ASP 129 2.578 14.512 32.276 898 H VAL 130 HN VAL 130 0.280 17.135 32.686 899 HA VAL 130 HA VAL 130 2.202 18.261 34.499 900 HB VAL 130 HB VAL 130 1.437 19.547 32.588 901 HG11 VAL 130 HG11 VAL 130 -1.252 18.995 33.806 902 HG12 VAL 130 HG12 VAL 130 -0.742 18.849 32.124 903 HG13 VAL 130 HG13 VAL 130 -1.027 20.443 32.824 904 HG21 VAL 130 HG21 VAL 130 0.624 20.625 35.291 905 HG22 VAL 130 HG22 VAL 130 0.524 21.612 33.833 906 HG23 VAL 130 HG23 VAL 130 2.082 20.982 34.366 907 H TYR 131 HN TYR 131 -1.183 17.372 34.818 908 HA TYR 131 HA TYR 131 -1.104 17.246 37.652 909 HB2 TYR 131 HB2 TYR 131 -2.255 19.240 38.340 910 HB3 TYR 131 HB1 TYR 131 -0.901 19.762 37.337 911 HD1 TYR 131 HD2 TYR 131 -1.274 20.520 35.009 912 HD2 TYR 131 HD1 TYR 131 -4.542 19.479 37.595 913 HE1 TYR 131 HE2 TYR 131 -2.854 21.649 33.466 914 HE2 TYR 131 HE1 TYR 131 -6.122 20.609 36.053 915 HH TYR 131 HH TYR 131 -4.986 22.512 33.329 916 H ALA 132 HN ALA 132 -3.423 17.073 38.552 917 HA ALA 132 HA ALA 132 -4.964 15.400 36.742 918 HB1 ALA 132 HB1 ALA 132 -6.647 15.608 38.765 919 HB2 ALA 132 HB2 ALA 132 -5.258 16.321 39.584 920 HB3 ALA 132 HB3 ALA 132 -5.160 14.678 38.950 921 H SER 133 HN SER 133 -6.429 16.148 35.297 922 HA SER 133 HA SER 133 -7.115 18.883 34.991 923 HB2 SER 133 HB1 SER 133 -8.778 18.134 33.401 924 HB3 SER 133 HB2 SER 133 -7.373 17.080 33.244 925 HG SER 133 HG SER 133 -8.454 15.463 34.097 926 H ALA 134 HN ALA 134 -8.533 16.366 36.972 927 HA ALA 134 HA ALA 134 -11.079 17.453 37.489 928 HB1 ALA 134 HB1 ALA 134 -10.280 16.487 39.958 929 HB2 ALA 134 HB2 ALA 134 -9.244 15.602 38.838 930 HB3 ALA 134 HB3 ALA 134 -10.998 15.520 38.670 931 H GLY 135 HN GLY 135 -7.918 18.419 38.718 932 HA2 GLY 135 HA2 GLY 135 -8.677 20.052 40.877 933 HA3 GLY 135 HA1 GLY 135 -7.284 20.379 39.846 934 H SER 136 HN SER 136 -8.933 20.647 37.415 935 HA SER 136 HA SER 136 -9.454 23.454 37.533 936 HB2 SER 136 HB1 SER 136 -10.379 23.205 35.308 937 HB3 SER 136 HB2 SER 136 -8.985 22.132 35.440 938 HG SER 136 HG SER 136 -11.154 21.329 34.590 939 H GLY 137 HN GLY 137 -11.451 20.660 38.207 940 HA2 GLY 137 HA2 GLY 137 -14.022 21.858 37.988 941 HA3 GLY 137 HA1 GLY 137 -13.633 20.510 39.057 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 -8.974 2.081 -16.422 2 H2 GLY 1 HT2 GLY 1 -8.246 1.855 -14.903 3 H3 GLY 1 HT3 GLY 1 -8.030 3.315 -15.744 4 HA2 GLY 1 HA2 GLY 1 -10.778 2.545 -15.172 5 HA3 GLY 1 HA1 GLY 1 -9.792 3.045 -13.799 6 H MET 2 HN MET 2 -11.344 4.095 -16.736 7 HA MET 2 HA MET 2 -10.148 6.660 -17.032 8 HB2 MET 2 HB2 MET 2 -12.986 5.760 -17.614 9 HB3 MET 2 HB1 MET 2 -12.286 7.280 -18.167 10 HG2 MET 2 HG2 MET 2 -10.478 5.962 -19.308 11 HG3 MET 2 HG1 MET 2 -11.336 4.486 -18.863 12 HE1 MET 2 HE1 MET 2 -11.323 7.558 -21.511 13 HE2 MET 2 HE2 MET 2 -11.959 7.970 -19.920 14 HE3 MET 2 HE3 MET 2 -13.041 7.933 -21.310 15 H GLY 3 HN GLY 3 -12.736 5.518 -14.907 16 HA2 GLY 3 HA1 GLY 3 -13.222 8.241 -13.888 17 HA3 GLY 3 HA2 GLY 3 -14.052 6.776 -13.363 18 H GLN 4 HN GLN 4 -13.441 8.088 -11.244 19 HA GLN 4 HA GLN 4 -10.973 6.797 -10.192 20 HB2 GLN 4 HB1 GLN 4 -10.252 8.832 -9.102 21 HB3 GLN 4 HB2 GLN 4 -10.493 9.195 -10.811 22 HG2 GLN 4 HG2 GLN 4 -12.842 9.955 -10.199 23 HG3 GLN 4 HG1 GLN 4 -12.351 9.834 -8.508 24 HE21 GLN 4 HE21 GLN 4 -12.201 12.055 -7.951 25 HE22 GLN 4 HE22 GLN 4 -11.184 13.158 -8.746 26 H ALA 5 HN ALA 5 -11.005 6.661 -7.798 27 HA ALA 5 HA ALA 5 -13.581 5.863 -6.808 28 HB1 ALA 5 HB1 ALA 5 -11.536 6.561 -4.794 29 HB2 ALA 5 HB2 ALA 5 -10.995 5.420 -6.026 30 HB3 ALA 5 HB3 ALA 5 -12.407 5.045 -5.037 31 H ASN 6 HN ASN 6 -14.998 6.941 -5.401 32 HA ASN 6 HA ASN 6 -15.136 9.789 -5.589 33 HB2 ASN 6 HB2 ASN 6 -16.437 8.022 -3.493 34 HB3 ASN 6 HB1 ASN 6 -16.964 9.629 -3.993 35 HD21 ASN 6 HD21 ASN 6 -18.479 7.049 -4.212 36 HD22 ASN 6 HD22 ASN 6 -18.852 6.893 -5.861 37 H THR 7 HN THR 7 -13.264 7.756 -3.571 38 HA THR 7 HA THR 7 -12.239 10.113 -2.131 39 HB THR 7 HB THR 7 -14.025 9.424 -0.636 40 HG1 THR 7 HG1 THR 7 -11.544 8.395 0.259 41 HG21 THR 7 HG21 THR 7 -14.361 7.195 0.094 42 HG22 THR 7 HG22 THR 7 -12.790 6.675 -0.515 43 HG23 THR 7 HG23 THR 7 -14.089 7.065 -1.643 44 HA PRO 8 HA PRO 8 -8.423 7.953 -2.677 45 HB2 PRO 8 HB2 PRO 8 -7.032 8.765 -0.500 46 HB3 PRO 8 HB1 PRO 8 -7.335 9.796 -1.902 47 HG2 PRO 8 HG2 PRO 8 -8.800 9.672 0.712 48 HG3 PRO 8 HG1 PRO 8 -8.247 11.094 -0.179 49 HD2 PRO 8 HD1 PRO 8 -10.802 10.309 -0.306 50 HD3 PRO 8 HD2 PRO 8 -9.984 10.955 -1.729 51 H TRP 9 HN TRP 9 -9.889 7.640 0.575 52 HA TRP 9 HA TRP 9 -8.317 5.222 1.096 53 HB2 TRP 9 HB2 TRP 9 -9.667 5.050 3.160 54 HB3 TRP 9 HB1 TRP 9 -8.950 6.651 2.984 55 HD1 TRP 9 HD1 TRP 9 -12.271 4.818 2.920 56 HE1 TRP 9 HE1 TRP 9 -14.187 6.547 2.934 57 HE3 TRP 9 HE3 TRP 9 -9.583 9.105 2.301 58 HZ2 TRP 9 HZ2 TRP 9 -14.526 9.385 2.713 59 HZ3 TRP 9 HZ3 TRP 9 -10.718 11.303 2.210 60 HH2 TRP 9 HH2 TRP 9 -13.185 11.450 2.415 61 H SER 10 HN SER 10 -10.924 5.838 -0.853 62 HA SER 10 HA SER 10 -12.436 3.389 -0.258 63 HB2 SER 10 HB1 SER 10 -12.703 5.695 -2.101 64 HB3 SER 10 HB2 SER 10 -13.304 4.158 -2.724 65 HG SER 10 HG SER 10 -14.961 4.444 -1.500 66 H SER 11 HN SER 11 -9.880 4.453 -2.386 67 HA SER 11 HA SER 11 -9.816 1.717 -3.593 68 HB2 SER 11 HB2 SER 11 -8.907 4.362 -4.770 69 HB3 SER 11 HB1 SER 11 -8.661 2.789 -5.529 70 HG SER 11 HG SER 11 -10.925 2.524 -5.534 71 H LYS 12 HN LYS 12 -7.708 0.768 -3.811 72 HA LYS 12 HA LYS 12 -5.880 1.440 -1.675 73 HB2 LYS 12 HB1 LYS 12 -6.027 -0.585 -3.845 74 HB3 LYS 12 HB2 LYS 12 -4.417 -0.214 -3.231 75 HG2 LYS 12 HG2 LYS 12 -5.140 -0.702 -0.947 76 HG3 LYS 12 HG1 LYS 12 -6.792 -0.975 -1.503 77 HD2 LYS 12 HD2 LYS 12 -5.384 -3.077 -1.157 78 HD3 LYS 12 HD1 LYS 12 -6.149 -2.925 -2.739 79 HE2 LYS 12 HE2 LYS 12 -4.039 -1.985 -3.650 80 HE3 LYS 12 HE1 LYS 12 -3.279 -2.201 -2.073 81 HZ1 LYS 12 HZ1 LYS 12 -3.700 -4.569 -2.224 82 HZ2 LYS 12 HZ2 LYS 12 -2.794 -4.045 -3.563 83 HZ3 LYS 12 HZ3 LYS 12 -4.453 -4.368 -3.730 84 H ALA 13 HN ALA 13 -5.938 2.022 -5.164 85 HA ALA 13 HA ALA 13 -3.250 3.017 -5.358 86 HB1 ALA 13 HB1 ALA 13 -4.702 4.343 -7.327 87 HB2 ALA 13 HB2 ALA 13 -5.609 2.851 -7.074 88 HB3 ALA 13 HB3 ALA 13 -3.900 2.782 -7.508 89 H ASN 14 HN ASN 14 -6.381 4.725 -5.043 90 HA ASN 14 HA ASN 14 -5.146 7.332 -4.838 91 HB2 ASN 14 HB2 ASN 14 -7.893 6.506 -3.854 92 HB3 ASN 14 HB1 ASN 14 -7.357 8.132 -4.279 93 HD21 ASN 14 HD21 ASN 14 -9.546 7.352 -5.680 94 HD22 ASN 14 HD22 ASN 14 -9.155 6.861 -7.257 95 H ALA 15 HN ALA 15 -5.984 4.824 -2.535 96 HA ALA 15 HA ALA 15 -5.869 6.444 -0.172 97 HB1 ALA 15 HB1 ALA 15 -5.742 4.361 1.043 98 HB2 ALA 15 HB2 ALA 15 -5.198 3.502 -0.399 99 HB3 ALA 15 HB3 ALA 15 -6.844 4.129 -0.314 100 H ASP 16 HN ASP 16 -3.395 4.355 -1.687 101 HA ASP 16 HA ASP 16 -1.327 4.841 0.166 102 HB2 ASP 16 HB2 ASP 16 0.240 4.349 -1.736 103 HB3 ASP 16 HB1 ASP 16 -1.050 3.160 -1.558 104 H ALA 17 HN ALA 17 -1.937 6.651 -2.885 105 HA ALA 17 HA ALA 17 0.096 8.588 -2.481 106 HB1 ALA 17 HB1 ALA 17 -0.972 9.866 -4.160 107 HB2 ALA 17 HB2 ALA 17 -2.571 9.261 -3.725 108 HB3 ALA 17 HB3 ALA 17 -1.420 8.205 -4.548 109 H PHE 18 HN PHE 18 -3.199 8.374 -1.253 110 HA PHE 18 HA PHE 18 -3.405 10.986 -0.132 111 HB2 PHE 18 HB1 PHE 18 -5.296 9.384 -0.369 112 HB3 PHE 18 HB2 PHE 18 -4.589 8.391 0.903 113 HD1 PHE 18 HD2 PHE 18 -6.112 11.688 0.144 114 HD2 PHE 18 HD1 PHE 18 -4.766 9.005 3.217 115 HE1 PHE 18 HE2 PHE 18 -7.235 13.086 1.858 116 HE2 PHE 18 HE1 PHE 18 -5.891 10.400 4.928 117 HZ PHE 18 HZ PHE 18 -7.128 12.436 4.247 118 H ILE 19 HN ILE 19 -1.982 7.984 1.101 119 HA ILE 19 HA ILE 19 -1.426 9.076 3.735 120 HB ILE 19 HB ILE 19 -0.107 6.707 2.385 121 HG12 ILE 19 HG12 ILE 19 -2.512 6.400 2.267 122 HG13 ILE 19 HG11 ILE 19 -1.889 5.386 3.569 123 HG21 ILE 19 HG21 ILE 19 0.867 6.330 4.388 124 HG22 ILE 19 HG22 ILE 19 -0.656 6.577 5.244 125 HG23 ILE 19 HG23 ILE 19 0.363 7.959 4.839 126 HD11 ILE 19 HD11 ILE 19 -3.218 8.097 3.857 127 HD12 ILE 19 HD12 ILE 19 -2.460 7.220 5.186 128 HD13 ILE 19 HD13 ILE 19 -3.871 6.542 4.373 129 H ASN 20 HN ASN 20 0.580 8.410 0.850 130 HA ASN 20 HA ASN 20 3.014 9.431 1.935 131 HB2 ASN 20 HB1 ASN 20 2.167 9.499 -0.974 132 HB3 ASN 20 HB2 ASN 20 3.815 9.483 -0.347 133 HD21 ASN 20 HD21 ASN 20 1.569 7.469 -1.729 134 HD22 ASN 20 HD22 ASN 20 2.050 5.989 -1.048 135 H SER 21 HN SER 21 0.541 11.024 -0.099 136 HA SER 21 HA SER 21 1.812 13.568 -0.211 137 HB2 SER 21 HB2 SER 21 -0.314 12.624 -1.451 138 HB3 SER 21 HB1 SER 21 -1.178 13.339 -0.091 139 HG SER 21 HG SER 21 -0.815 14.730 -1.966 140 H PHE 22 HN PHE 22 -0.180 12.076 2.279 141 HA PHE 22 HA PHE 22 -0.716 14.493 3.751 142 HB2 PHE 22 HB1 PHE 22 -2.029 12.454 4.116 143 HB3 PHE 22 HB2 PHE 22 -0.590 11.614 4.696 144 HD1 PHE 22 HD1 PHE 22 0.497 12.309 6.828 145 HD2 PHE 22 HD2 PHE 22 -3.210 14.027 5.500 146 HE1 PHE 22 HE1 PHE 22 0.093 13.200 9.107 147 HE2 PHE 22 HE2 PHE 22 -3.614 14.917 7.779 148 HZ PHE 22 HZ PHE 22 -1.963 14.504 9.583 149 H ILE 23 HN ILE 23 1.711 11.906 4.279 150 HA ILE 23 HA ILE 23 3.005 13.213 6.465 151 HB ILE 23 HB ILE 23 4.232 11.317 4.446 152 HG12 ILE 23 HG12 ILE 23 2.870 10.700 7.084 153 HG13 ILE 23 HG11 ILE 23 2.117 10.477 5.505 154 HG21 ILE 23 HG21 ILE 23 5.904 10.905 6.065 155 HG22 ILE 23 HG22 ILE 23 4.958 11.648 7.356 156 HG23 ILE 23 HG23 ILE 23 5.698 12.655 6.111 157 HD11 ILE 23 HD11 ILE 23 4.779 9.278 5.644 158 HD12 ILE 23 HD12 ILE 23 3.252 8.556 5.134 159 HD13 ILE 23 HD13 ILE 23 3.678 8.602 6.845 160 H SER 24 HN SER 24 4.035 13.028 3.032 161 HA SER 24 HA SER 24 6.199 14.851 3.288 162 HB2 SER 24 HB2 SER 24 4.460 14.439 0.839 163 HB3 SER 24 HB1 SER 24 6.121 15.033 0.867 164 HG SER 24 HG SER 24 6.773 13.030 1.677 165 H ALA 25 HN ALA 25 2.749 15.395 2.868 166 HA ALA 25 HA ALA 25 3.054 18.227 2.246 167 HB1 ALA 25 HB1 ALA 25 0.651 16.591 3.103 168 HB2 ALA 25 HB2 ALA 25 1.074 17.064 1.457 169 HB3 ALA 25 HB3 ALA 25 0.577 18.288 2.628 170 H ALA 26 HN ALA 26 2.108 16.374 5.154 171 HA ALA 26 HA ALA 26 1.752 18.733 6.783 172 HB1 ALA 26 HB1 ALA 26 0.819 17.164 8.093 173 HB2 ALA 26 HB2 ALA 26 2.433 16.552 8.454 174 HB3 ALA 26 HB3 ALA 26 1.517 15.881 7.104 175 H SER 27 HN SER 27 4.513 16.676 6.046 176 HA SER 27 HA SER 27 6.232 17.507 8.149 177 HB2 SER 27 HB2 SER 27 6.966 16.756 5.305 178 HB3 SER 27 HB1 SER 27 8.070 16.782 6.681 179 HG SER 27 HG SER 27 7.430 14.817 6.978 180 H ASN 28 HN ASN 28 5.366 19.092 5.123 181 HA ASN 28 HA ASN 28 7.320 21.254 5.758 182 HB2 ASN 28 HB2 ASN 28 7.253 21.880 3.468 183 HB3 ASN 28 HB1 ASN 28 7.298 20.118 3.462 184 HD21 ASN 28 HD21 ASN 28 6.260 21.272 1.187 185 HD22 ASN 28 HD22 ASN 28 4.566 21.181 1.151 186 H THR 29 HN THR 29 4.234 20.636 6.551 187 HA THR 29 HA THR 29 3.114 23.255 5.775 188 HB THR 29 HB THR 29 1.873 21.127 7.535 189 HG1 THR 29 HG1 THR 29 2.116 20.154 5.629 190 HG21 THR 29 HG21 THR 29 0.241 22.920 5.854 191 HG22 THR 29 HG22 THR 29 1.114 23.724 7.158 192 HG23 THR 29 HG23 THR 29 -0.004 22.414 7.525 193 H GLY 30 HN GLY 30 2.866 21.688 8.963 194 HA2 GLY 30 HA2 GLY 30 3.190 24.292 10.250 195 HA3 GLY 30 HA1 GLY 30 2.891 22.761 11.070 196 H SER 31 HN SER 31 4.621 21.689 11.955 197 HA SER 31 HA SER 31 7.355 22.646 11.233 198 HB2 SER 31 HB2 SER 31 5.997 22.687 13.866 199 HB3 SER 31 HB1 SER 31 7.643 22.053 13.876 200 HG SER 31 HG SER 31 8.408 23.942 13.217 201 H PHE 32 HN PHE 32 5.698 20.178 13.245 202 HA PHE 32 HA PHE 32 6.288 17.917 13.582 203 HB2 PHE 32 HB2 PHE 32 6.212 18.418 10.632 204 HB3 PHE 32 HB1 PHE 32 6.805 16.855 11.192 205 HD1 PHE 32 HD2 PHE 32 5.226 16.255 13.539 206 HD2 PHE 32 HD1 PHE 32 4.005 18.153 9.876 207 HE1 PHE 32 HE2 PHE 32 2.898 15.496 13.919 208 HE2 PHE 32 HE1 PHE 32 1.678 17.390 10.262 209 HZ PHE 32 HZ PHE 32 1.125 16.060 12.282 210 H SER 33 HN SER 33 8.257 18.175 14.757 211 HA SER 33 HA SER 33 10.784 18.799 13.616 212 HB2 SER 33 HB2 SER 33 11.705 18.175 15.673 213 HB3 SER 33 HB1 SER 33 10.042 18.554 16.122 214 HG SER 33 HG SER 33 11.260 16.327 16.561 215 H GLN 34 HN GLN 34 12.624 17.254 13.326 216 HA GLN 34 HA GLN 34 12.091 15.273 11.405 217 HB2 GLN 34 HB1 GLN 34 14.408 15.463 13.354 218 HB3 GLN 34 HB2 GLN 34 14.374 14.398 11.949 219 HG2 GLN 34 HG2 GLN 34 14.089 16.352 10.470 220 HG3 GLN 34 HG1 GLN 34 14.112 17.420 11.874 221 HE21 GLN 34 HE21 GLN 34 16.077 17.660 9.800 222 HE22 GLN 34 HE22 GLN 34 17.584 17.216 10.442 223 H ASP 35 HN ASP 35 12.266 14.995 14.932 224 HA ASP 35 HA ASP 35 12.216 12.174 15.157 225 HB2 ASP 35 HB2 ASP 35 10.965 14.315 16.898 226 HB3 ASP 35 HB1 ASP 35 11.018 12.611 17.347 227 H GLN 36 HN GLN 36 9.515 14.482 14.840 228 HA GLN 36 HA GLN 36 7.434 12.515 14.927 229 HB2 GLN 36 HB1 GLN 36 7.581 15.277 13.696 230 HB3 GLN 36 HB2 GLN 36 6.108 14.306 13.684 231 HG2 GLN 36 HG2 GLN 36 5.872 15.601 15.634 232 HG3 GLN 36 HG1 GLN 36 6.516 14.078 16.247 233 HE21 GLN 36 HE21 GLN 36 8.583 14.123 17.250 234 HE22 GLN 36 HE22 GLN 36 9.500 15.540 17.425 235 H MET 37 HN MET 37 9.435 13.781 12.301 236 HA MET 37 HA MET 37 7.976 12.607 10.138 237 HB2 MET 37 HB2 MET 37 10.919 13.283 10.419 238 HB3 MET 37 HB1 MET 37 10.161 12.793 8.903 239 HG2 MET 37 HG2 MET 37 8.536 14.705 9.196 240 HG3 MET 37 HG1 MET 37 9.505 15.240 10.569 241 HE1 MET 37 HE1 MET 37 8.701 16.919 8.487 242 HE2 MET 37 HE2 MET 37 9.937 17.554 7.405 243 HE3 MET 37 HE3 MET 37 10.097 17.785 9.144 244 H GLU 38 HN GLU 38 10.385 11.333 12.369 245 HA GLU 38 HA GLU 38 10.862 8.878 10.916 246 HB2 GLU 38 HB1 GLU 38 11.246 9.623 13.830 247 HB3 GLU 38 HB2 GLU 38 11.752 8.080 13.142 248 HG2 GLU 38 HG2 GLU 38 13.116 9.356 11.458 249 HG3 GLU 38 HG1 GLU 38 12.711 10.838 12.325 250 H ASN 39 HN ASN 39 8.583 9.871 13.442 251 HA ASN 39 HA ASN 39 7.503 7.236 13.897 252 HB2 ASN 39 HB2 ASN 39 6.271 9.972 14.337 253 HB3 ASN 39 HB1 ASN 39 5.613 8.457 14.957 254 HD21 ASN 39 HD21 ASN 39 6.514 10.621 16.676 255 HD22 ASN 39 HD22 ASN 39 7.885 10.090 17.525 256 H MET 40 HN MET 40 6.502 9.961 11.845 257 HA MET 40 HA MET 40 4.139 8.807 10.791 258 HB2 MET 40 HB2 MET 40 6.146 10.666 9.477 259 HB3 MET 40 HB1 MET 40 4.557 10.291 8.810 260 HG2 MET 40 HG2 MET 40 3.504 11.149 10.891 261 HG3 MET 40 HG1 MET 40 5.102 11.567 11.510 262 HE1 MET 40 HE1 MET 40 4.969 14.109 11.796 263 HE2 MET 40 HE2 MET 40 3.264 13.675 11.713 264 HE3 MET 40 HE3 MET 40 3.853 15.074 10.821 265 H SER 41 HN SER 41 7.521 8.274 10.015 266 HA SER 41 HA SER 41 7.052 6.785 7.584 267 HB2 SER 41 HB2 SER 41 9.360 6.262 7.650 268 HB3 SER 41 HB1 SER 41 9.260 7.847 8.417 269 HG SER 41 HG SER 41 9.777 5.347 9.525 270 H LEU 42 HN LEU 42 6.870 6.021 10.975 271 HA LEU 42 HA LEU 42 6.994 3.114 10.493 272 HB2 LEU 42 HB2 LEU 42 6.279 4.604 13.035 273 HB3 LEU 42 HB1 LEU 42 6.727 2.904 12.898 274 HG LEU 42 HG LEU 42 8.522 5.235 12.156 275 HD11 LEU 42 HD11 LEU 42 8.882 5.368 14.384 276 HD12 LEU 42 HD12 LEU 42 9.666 3.794 14.248 277 HD13 LEU 42 HD13 LEU 42 7.963 3.894 14.691 278 HD21 LEU 42 HD21 LEU 42 9.251 3.433 10.852 279 HD22 LEU 42 HD22 LEU 42 8.783 2.241 12.063 280 HD23 LEU 42 HD23 LEU 42 10.214 3.238 12.316 281 H ILE 43 HN ILE 43 4.593 5.625 10.864 282 HA ILE 43 HA ILE 43 2.474 3.517 10.700 283 HB ILE 43 HB ILE 43 2.501 6.175 12.143 284 HG12 ILE 43 HG12 ILE 43 1.688 3.404 13.060 285 HG13 ILE 43 HG11 ILE 43 3.310 4.065 13.270 286 HG21 ILE 43 HG21 ILE 43 0.389 6.263 11.106 287 HG22 ILE 43 HG22 ILE 43 0.041 5.478 12.646 288 HG23 ILE 43 HG23 ILE 43 0.179 4.513 11.178 289 HD11 ILE 43 HD11 ILE 43 1.272 5.946 14.155 290 HD12 ILE 43 HD12 ILE 43 2.659 5.309 15.037 291 HD13 ILE 43 HD13 ILE 43 1.144 4.408 15.007 292 H GLY 44 HN GLY 44 0.583 4.128 9.402 293 HA2 GLY 44 HA1 GLY 44 -0.517 5.372 7.689 294 HA3 GLY 44 HA2 GLY 44 0.832 6.509 7.685 295 H ASN 45 HN ASN 45 2.898 5.689 6.711 296 HA ASN 45 HA ASN 45 2.425 4.478 4.149 297 HB2 ASN 45 HB2 ASN 45 4.981 4.947 5.713 298 HB3 ASN 45 HB1 ASN 45 4.949 4.344 4.057 299 HD21 ASN 45 HD21 ASN 45 6.182 6.838 4.624 300 HD22 ASN 45 HD22 ASN 45 5.259 8.064 3.898 301 H THR 46 HN THR 46 3.619 3.234 7.246 302 HA THR 46 HA THR 46 4.390 0.642 6.380 303 HB THR 46 HB THR 46 3.102 1.384 9.026 304 HG1 THR 46 HG1 THR 46 5.275 1.682 9.672 305 HG21 THR 46 HG21 THR 46 3.667 -1.106 8.098 306 HG22 THR 46 HG22 THR 46 3.750 -0.661 9.803 307 HG23 THR 46 HG23 THR 46 5.216 -0.680 8.823 308 H LEU 47 HN LEU 47 1.244 2.020 7.172 309 HA LEU 47 HA LEU 47 -0.271 -0.395 7.212 310 HB2 LEU 47 HB2 LEU 47 -1.102 2.379 6.304 311 HB3 LEU 47 HB1 LEU 47 -2.207 1.063 6.702 312 HG LEU 47 HG LEU 47 -0.226 2.380 8.586 313 HD11 LEU 47 HD11 LEU 47 -2.884 2.417 9.560 314 HD12 LEU 47 HD12 LEU 47 -2.969 2.926 7.875 315 HD13 LEU 47 HD13 LEU 47 -1.929 3.792 9.006 316 HD21 LEU 47 HD21 LEU 47 -2.067 0.000 8.892 317 HD22 LEU 47 HD22 LEU 47 -1.452 0.900 10.278 318 HD23 LEU 47 HD23 LEU 47 -0.331 0.075 9.193 319 H MET 48 HN MET 48 0.864 1.646 4.559 320 HA MET 48 HA MET 48 -0.683 0.622 2.445 321 HB2 MET 48 HB2 MET 48 0.970 2.482 2.226 322 HB3 MET 48 HB1 MET 48 2.274 1.299 2.338 323 HG2 MET 48 HG2 MET 48 1.334 0.133 0.341 324 HG3 MET 48 HG1 MET 48 0.119 1.404 0.204 325 HE1 MET 48 HE1 MET 48 4.154 1.497 0.964 326 HE2 MET 48 HE2 MET 48 4.541 1.433 -0.754 327 HE3 MET 48 HE3 MET 48 3.536 0.177 -0.038 328 H ALA 49 HN ALA 49 2.270 -0.714 3.919 329 HA ALA 49 HA ALA 49 2.566 -2.923 2.134 330 HB1 ALA 49 HB1 ALA 49 4.401 -3.088 3.441 331 HB2 ALA 49 HB2 ALA 49 3.372 -3.815 4.674 332 HB3 ALA 49 HB3 ALA 49 3.667 -2.077 4.687 333 H ALA 50 HN ALA 50 0.549 -2.397 4.972 334 HA ALA 50 HA ALA 50 -0.344 -5.110 5.287 335 HB1 ALA 50 HB1 ALA 50 -0.766 -3.605 7.096 336 HB2 ALA 50 HB2 ALA 50 -2.349 -3.961 6.404 337 HB3 ALA 50 HB3 ALA 50 -1.546 -2.434 6.033 338 H MET 51 HN MET 51 -1.099 -2.585 3.040 339 HA MET 51 HA MET 51 -3.698 -3.388 2.218 340 HB2 MET 51 HB2 MET 51 -1.486 -2.205 0.511 341 HB3 MET 51 HB1 MET 51 -3.208 -2.197 0.132 342 HG2 MET 51 HG2 MET 51 -3.637 -0.886 2.197 343 HG3 MET 51 HG1 MET 51 -1.903 -0.858 2.521 344 HE1 MET 51 HE1 MET 51 -2.524 1.424 2.890 345 HE2 MET 51 HE2 MET 51 -3.825 2.084 1.904 346 HE3 MET 51 HE3 MET 51 -2.181 2.684 1.697 347 H ASP 52 HN ASP 52 -0.518 -4.710 1.506 348 HA ASP 52 HA ASP 52 -1.463 -6.372 -0.694 349 HB2 ASP 52 HB2 ASP 52 1.052 -6.517 0.999 350 HB3 ASP 52 HB1 ASP 52 0.751 -7.511 -0.426 351 H ASN 53 HN ASN 53 -1.894 -6.506 2.640 352 HA ASN 53 HA ASN 53 -1.710 -9.356 3.055 353 HB2 ASN 53 HB2 ASN 53 -3.145 -7.157 4.554 354 HB3 ASN 53 HB1 ASN 53 -3.141 -8.837 5.091 355 HD21 ASN 53 HD21 ASN 53 -1.931 -6.825 6.702 356 HD22 ASN 53 HD22 ASN 53 -0.256 -7.094 6.724 357 H MET 54 HN MET 54 -4.418 -7.193 2.278 358 HA MET 54 HA MET 54 -6.580 -8.903 2.505 359 HB2 MET 54 HB2 MET 54 -7.340 -7.750 0.217 360 HB3 MET 54 HB1 MET 54 -7.318 -6.872 1.741 361 HG2 MET 54 HG1 MET 54 -6.252 -5.555 -0.029 362 HG3 MET 54 HG2 MET 54 -5.075 -5.995 1.194 363 HE1 MET 54 HE1 MET 54 -4.842 -6.543 -3.169 364 HE2 MET 54 HE2 MET 54 -5.452 -5.272 -2.111 365 HE3 MET 54 HE3 MET 54 -6.447 -6.689 -2.439 366 H GLY 55 HN GLY 55 -3.944 -9.251 0.256 367 HA2 GLY 55 HA2 GLY 55 -3.484 -11.224 -1.003 368 HA3 GLY 55 HA1 GLY 55 -5.115 -11.796 -0.652 369 H GLY 56 HN GLY 56 -6.197 -9.091 -1.512 370 HA2 GLY 56 HA2 GLY 56 -5.828 -8.034 -3.894 371 HA3 GLY 56 HA1 GLY 56 -6.195 -9.675 -4.425 372 H ARG 57 HN ARG 57 -7.753 -8.191 -1.621 373 HA ARG 57 HA ARG 57 -10.217 -7.751 -3.227 374 HB2 ARG 57 HB2 ARG 57 -11.571 -8.934 -1.551 375 HB3 ARG 57 HB1 ARG 57 -10.372 -10.022 -2.246 376 HG2 ARG 57 HG2 ARG 57 -8.870 -9.399 -0.271 377 HG3 ARG 57 HG1 ARG 57 -10.295 -8.651 0.450 378 HD2 ARG 57 HD2 ARG 57 -11.487 -10.874 0.108 379 HD3 ARG 57 HD1 ARG 57 -9.913 -11.560 -0.297 380 HE ARG 57 HE ARG 57 -9.180 -10.995 2.006 381 HH11 ARG 57 HH21 ARG 57 -11.529 -12.888 2.225 382 HH12 ARG 57 HH22 ARG 57 -12.497 -12.103 3.427 383 HH21 ARG 57 HH11 ARG 57 -10.859 -9.061 3.142 384 HH22 ARG 57 HH12 ARG 57 -12.118 -9.937 3.947 385 H ILE 58 HN ILE 58 -10.721 -5.647 -2.848 386 HA ILE 58 HA ILE 58 -10.287 -4.593 -0.081 387 HB ILE 58 HB ILE 58 -10.265 -3.103 -2.721 388 HG12 ILE 58 HG12 ILE 58 -8.241 -4.386 -2.475 389 HG13 ILE 58 HG11 ILE 58 -7.855 -2.718 -2.045 390 HG21 ILE 58 HG21 ILE 58 -10.579 -1.237 -1.506 391 HG22 ILE 58 HG22 ILE 58 -9.161 -1.633 -0.536 392 HG23 ILE 58 HG23 ILE 58 -10.752 -2.214 -0.048 393 HD11 ILE 58 HD11 ILE 58 -8.570 -3.585 0.384 394 HD12 ILE 58 HD12 ILE 58 -6.925 -3.785 -0.222 395 HD13 ILE 58 HD13 ILE 58 -8.061 -5.132 -0.297 396 H THR 59 HN THR 59 -11.963 -3.326 0.829 397 HA THR 59 HA THR 59 -14.445 -2.982 -0.751 398 HB THR 59 HB THR 59 -15.526 -3.860 1.584 399 HG1 THR 59 HG1 THR 59 -13.923 -4.770 2.608 400 HG21 THR 59 HG21 THR 59 -16.351 -5.593 0.307 401 HG22 THR 59 HG22 THR 59 -14.778 -5.958 -0.404 402 HG23 THR 59 HG23 THR 59 -15.706 -4.574 -0.980 403 HA PRO 60 HA PRO 60 -14.941 0.763 1.552 404 HB2 PRO 60 HB2 PRO 60 -17.557 0.793 2.233 405 HB3 PRO 60 HB1 PRO 60 -16.991 1.046 0.580 406 HG2 PRO 60 HG2 PRO 60 -18.078 -1.438 1.854 407 HG3 PRO 60 HG1 PRO 60 -18.434 -0.759 0.262 408 HD2 PRO 60 HD2 PRO 60 -16.717 -2.819 0.588 409 HD3 PRO 60 HD1 PRO 60 -16.495 -1.607 -0.674 410 H SER 61 HN SER 61 -16.735 -1.851 3.231 411 HA SER 61 HA SER 61 -16.627 -0.656 5.814 412 HB2 SER 61 HB2 SER 61 -17.230 -2.825 6.674 413 HB3 SER 61 HB1 SER 61 -18.055 -2.630 5.127 414 HG SER 61 HG SER 61 -16.102 -3.714 4.245 415 H LYS 62 HN LYS 62 -14.326 -2.736 4.102 416 HA LYS 62 HA LYS 62 -12.582 -3.057 6.406 417 HB2 LYS 62 HB2 LYS 62 -12.591 -4.687 4.552 418 HB3 LYS 62 HB1 LYS 62 -12.015 -3.437 3.450 419 HG2 LYS 62 HG2 LYS 62 -10.007 -3.152 4.949 420 HG3 LYS 62 HG1 LYS 62 -10.559 -4.556 5.861 421 HD2 LYS 62 HD2 LYS 62 -10.521 -5.879 3.727 422 HD3 LYS 62 HD1 LYS 62 -9.806 -4.481 2.924 423 HE2 LYS 62 HE2 LYS 62 -7.766 -4.830 3.872 424 HE3 LYS 62 HE1 LYS 62 -8.463 -5.268 5.432 425 HZ1 LYS 62 HZ1 LYS 62 -8.459 -7.429 4.916 426 HZ2 LYS 62 HZ2 LYS 62 -7.324 -7.002 3.726 427 HZ3 LYS 62 HZ3 LYS 62 -8.966 -7.168 3.319 428 H LEU 63 HN LEU 63 -12.448 -1.047 3.451 429 HA LEU 63 HA LEU 63 -10.046 0.335 4.319 430 HB2 LEU 63 HB2 LEU 63 -12.003 0.621 2.075 431 HB3 LEU 63 HB1 LEU 63 -10.961 1.993 2.454 432 HG LEU 63 HG LEU 63 -8.973 0.597 2.206 433 HD11 LEU 63 HD21 LEU 63 -10.997 -1.612 1.752 434 HD12 LEU 63 HD22 LEU 63 -9.790 -1.517 3.035 435 HD13 LEU 63 HD23 LEU 63 -9.284 -1.768 1.365 436 HD21 LEU 63 HD11 LEU 63 -10.853 0.087 -0.116 437 HD22 LEU 63 HD12 LEU 63 -9.093 0.196 -0.180 438 HD23 LEU 63 HD13 LEU 63 -10.053 1.631 0.181 439 H GLN 64 HN GLN 64 -13.511 1.203 4.224 440 HA GLN 64 HA GLN 64 -13.293 3.826 5.232 441 HB2 GLN 64 HB2 GLN 64 -15.448 1.747 5.703 442 HB3 GLN 64 HB1 GLN 64 -15.610 3.450 6.134 443 HG2 GLN 64 HG2 GLN 64 -15.372 4.126 3.827 444 HG3 GLN 64 HG1 GLN 64 -14.954 2.484 3.338 445 HE21 GLN 64 HE21 GLN 64 -17.216 3.947 2.246 446 HE22 GLN 64 HE22 GLN 64 -18.640 3.168 2.742 447 H ALA 65 HN ALA 65 -13.373 0.729 6.979 448 HA ALA 65 HA ALA 65 -13.326 1.972 9.600 449 HB1 ALA 65 HB1 ALA 65 -12.938 -0.805 8.533 450 HB2 ALA 65 HB2 ALA 65 -14.097 -0.220 9.726 451 HB3 ALA 65 HB3 ALA 65 -12.408 -0.447 10.176 452 H LEU 66 HN LEU 66 -10.885 0.741 7.351 453 HA LEU 66 HA LEU 66 -8.669 1.114 9.188 454 HB2 LEU 66 HB2 LEU 66 -8.571 -0.469 7.280 455 HB3 LEU 66 HB1 LEU 66 -8.661 0.893 6.163 456 HG LEU 66 HG LEU 66 -6.605 1.736 7.677 457 HD11 LEU 66 HD21 LEU 66 -6.656 -0.246 9.139 458 HD12 LEU 66 HD22 LEU 66 -5.156 -0.202 8.212 459 HD13 LEU 66 HD23 LEU 66 -6.456 -1.295 7.736 460 HD21 LEU 66 HD11 LEU 66 -5.872 -0.344 5.675 461 HD22 LEU 66 HD12 LEU 66 -5.328 1.327 5.808 462 HD23 LEU 66 HD13 LEU 66 -6.911 0.968 5.116 463 H ASP 67 HN ASP 67 -9.763 2.927 6.289 464 HA ASP 67 HA ASP 67 -7.920 5.012 6.349 465 HB2 ASP 67 HB2 ASP 67 -9.336 6.109 4.901 466 HB3 ASP 67 HB1 ASP 67 -10.084 4.515 4.852 467 H MET 68 HN MET 68 -10.493 4.370 8.610 468 HA MET 68 HA MET 68 -10.572 7.020 9.778 469 HB2 MET 68 HB2 MET 68 -11.531 4.298 10.647 470 HB3 MET 68 HB1 MET 68 -11.622 5.681 11.738 471 HG2 MET 68 HG2 MET 68 -12.836 6.927 9.899 472 HG3 MET 68 HG1 MET 68 -12.910 5.406 9.009 473 HE1 MET 68 HE1 MET 68 -15.309 7.262 12.015 474 HE2 MET 68 HE2 MET 68 -13.580 7.493 11.765 475 HE3 MET 68 HE3 MET 68 -14.143 6.459 13.076 476 H ALA 69 HN ALA 69 -8.565 4.188 10.238 477 HA ALA 69 HA ALA 69 -7.515 4.987 12.819 478 HB1 ALA 69 HB1 ALA 69 -5.650 3.325 12.128 479 HB2 ALA 69 HB2 ALA 69 -6.660 3.002 10.718 480 HB3 ALA 69 HB3 ALA 69 -7.281 2.690 12.338 481 H PHE 70 HN PHE 70 -6.526 5.523 9.459 482 HA PHE 70 HA PHE 70 -3.924 6.509 9.880 483 HB2 PHE 70 HB1 PHE 70 -4.898 6.174 7.636 484 HB3 PHE 70 HB2 PHE 70 -5.984 7.538 7.904 485 HD1 PHE 70 HD2 PHE 70 -2.392 6.572 7.673 486 HD2 PHE 70 HD1 PHE 70 -5.250 9.776 7.577 487 HE1 PHE 70 HE2 PHE 70 -0.618 8.131 6.918 488 HE2 PHE 70 HE1 PHE 70 -3.476 11.336 6.823 489 HZ PHE 70 HZ PHE 70 -1.160 10.514 6.494 490 H ALA 71 HN ALA 71 -7.035 8.207 10.186 491 HA ALA 71 HA ALA 71 -5.909 10.797 10.698 492 HB1 ALA 71 HB1 ALA 71 -8.293 10.792 12.076 493 HB2 ALA 71 HB2 ALA 71 -8.551 9.516 10.887 494 HB3 ALA 71 HB3 ALA 71 -8.126 11.143 10.356 495 H SER 72 HN SER 72 -6.715 8.067 12.808 496 HA SER 72 HA SER 72 -6.284 9.487 15.279 497 HB2 SER 72 HB2 SER 72 -6.017 6.514 14.740 498 HB3 SER 72 HB1 SER 72 -6.254 7.277 16.313 499 HG SER 72 HG SER 72 -8.295 7.332 15.919 500 H SER 73 HN SER 73 -4.166 7.691 13.091 501 HA SER 73 HA SER 73 -1.905 7.624 14.882 502 HB2 SER 73 HB2 SER 73 -2.157 7.356 11.881 503 HB3 SER 73 HB1 SER 73 -0.614 7.220 12.724 504 HG SER 73 HG SER 73 -2.819 5.522 12.732 505 H VAL 74 HN VAL 74 -2.720 9.736 12.130 506 HA VAL 74 HA VAL 74 -0.453 11.428 12.299 507 HB VAL 74 HB VAL 74 -1.785 13.066 11.067 508 HG11 VAL 74 HG21 VAL 74 -1.159 11.452 9.535 509 HG12 VAL 74 HG22 VAL 74 -2.911 11.283 9.424 510 HG13 VAL 74 HG23 VAL 74 -1.976 10.157 10.409 511 HG21 VAL 74 HG11 VAL 74 -3.821 12.803 12.529 512 HG22 VAL 74 HG12 VAL 74 -4.172 11.300 11.676 513 HG23 VAL 74 HG13 VAL 74 -4.180 12.833 10.803 514 H ALA 75 HN ALA 75 -3.490 11.463 14.107 515 HA ALA 75 HA ALA 75 -3.026 14.019 15.370 516 HB1 ALA 75 HB1 ALA 75 -4.762 13.176 17.015 517 HB2 ALA 75 HB2 ALA 75 -4.780 11.664 16.108 518 HB3 ALA 75 HB3 ALA 75 -5.276 13.166 15.328 519 H GLN 76 HN GLN 76 -2.415 10.648 16.362 520 HA GLN 76 HA GLN 76 -1.389 11.312 18.961 521 HB2 GLN 76 HB2 GLN 76 -0.890 8.914 17.173 522 HB3 GLN 76 HB1 GLN 76 -0.359 9.024 18.851 523 HG2 GLN 76 HG2 GLN 76 -2.763 9.460 19.494 524 HG3 GLN 76 HG1 GLN 76 -3.210 9.099 17.826 525 HE21 GLN 76 HE21 GLN 76 -1.033 7.008 17.611 526 HE22 GLN 76 HE22 GLN 76 -1.611 5.674 18.487 527 H ILE 77 HN ILE 77 0.304 10.559 15.895 528 HA ILE 77 HA ILE 77 2.941 10.910 16.801 529 HB ILE 77 HB ILE 77 1.782 11.689 14.110 530 HG12 ILE 77 HG12 ILE 77 3.158 9.130 14.987 531 HG13 ILE 77 HG11 ILE 77 1.411 9.311 14.826 532 HG21 ILE 77 HG21 ILE 77 4.626 10.853 14.636 533 HG22 ILE 77 HG22 ILE 77 4.142 12.534 14.864 534 HG23 ILE 77 HG23 ILE 77 3.974 11.775 13.282 535 HD11 ILE 77 HD11 ILE 77 2.528 10.313 12.428 536 HD12 ILE 77 HD12 ILE 77 1.614 8.819 12.637 537 HD13 ILE 77 HD13 ILE 77 3.374 8.802 12.767 538 H ALA 78 HN ALA 78 0.777 13.374 15.414 539 HA ALA 78 HA ALA 78 2.659 15.524 15.980 540 HB1 ALA 78 HB1 ALA 78 -0.278 15.712 15.266 541 HB2 ALA 78 HB2 ALA 78 1.023 15.563 14.084 542 HB3 ALA 78 HB3 ALA 78 0.929 16.988 15.116 543 H ALA 79 HN ALA 79 -0.577 14.683 17.301 544 HA ALA 79 HA ALA 79 -0.599 16.663 19.331 545 HB1 ALA 79 HB1 ALA 79 -1.773 13.909 19.723 546 HB2 ALA 79 HB2 ALA 79 -2.492 15.061 18.597 547 HB3 ALA 79 HB3 ALA 79 -2.383 15.455 20.313 548 H SER 80 HN SER 80 1.145 13.665 19.103 549 HA SER 80 HA SER 80 1.738 13.469 21.951 550 HB2 SER 80 HB2 SER 80 3.363 11.747 21.250 551 HB3 SER 80 HB1 SER 80 1.795 11.479 20.490 552 HG SER 80 HG SER 80 3.763 11.411 19.117 553 H GLN 81 HN GLN 81 2.985 15.254 19.271 554 HA GLN 81 HA GLN 81 5.679 15.636 19.923 555 HB2 GLN 81 HB1 GLN 81 3.671 17.678 18.921 556 HB3 GLN 81 HB2 GLN 81 5.419 17.915 18.916 557 HG2 GLN 81 HG2 GLN 81 5.704 15.963 17.465 558 HG3 GLN 81 HG1 GLN 81 3.969 15.651 17.513 559 HE21 GLN 81 HE21 GLN 81 6.452 17.825 16.213 560 HE22 GLN 81 HE22 GLN 81 5.433 18.610 15.106 561 H GLY 82 HN GLY 82 2.820 16.930 21.510 562 HA2 GLY 82 HA1 GLY 82 2.647 17.866 23.669 563 HA3 GLY 82 HA2 GLY 82 4.377 17.590 23.877 564 H GLY 83 HN GLY 83 3.572 19.254 21.000 565 HA2 GLY 83 HA1 GLY 83 4.528 21.793 22.241 566 HA3 GLY 83 HA2 GLY 83 4.693 21.387 20.533 567 H ASP 84 HN ASP 84 3.624 23.546 20.227 568 HA ASP 84 HA ASP 84 0.944 24.058 21.084 569 HB2 ASP 84 HB2 ASP 84 2.665 25.098 18.843 570 HB3 ASP 84 HB1 ASP 84 0.968 25.569 18.952 571 H LEU 85 HN LEU 85 -0.644 22.575 20.651 572 HA LEU 85 HA LEU 85 -0.683 20.829 18.394 573 HB2 LEU 85 HB2 LEU 85 -2.526 21.573 20.569 574 HB3 LEU 85 HB1 LEU 85 -3.332 21.064 19.085 575 HG LEU 85 HG LEU 85 -1.493 19.138 19.172 576 HD11 LEU 85 HD21 LEU 85 -0.241 19.385 21.061 577 HD12 LEU 85 HD22 LEU 85 -1.628 18.645 21.861 578 HD13 LEU 85 HD23 LEU 85 -1.452 20.400 21.845 579 HD21 LEU 85 HD11 LEU 85 -3.309 17.848 19.552 580 HD22 LEU 85 HD12 LEU 85 -4.210 19.350 19.752 581 HD23 LEU 85 HD13 LEU 85 -3.543 18.527 21.161 582 H GLY 86 HN GLY 86 -1.540 24.161 18.726 583 HA2 GLY 86 HA2 GLY 86 -3.498 24.468 16.716 584 HA3 GLY 86 HA1 GLY 86 -2.304 25.700 17.126 585 H VAL 87 HN VAL 87 0.028 24.174 16.429 586 HA VAL 87 HA VAL 87 0.090 24.679 13.583 587 HB VAL 87 HB VAL 87 2.044 23.263 15.420 588 HG11 VAL 87 HG21 VAL 87 2.800 22.446 13.412 589 HG12 VAL 87 HG22 VAL 87 3.532 24.047 13.309 590 HG13 VAL 87 HG23 VAL 87 2.009 23.718 12.481 591 HG21 VAL 87 HG11 VAL 87 1.767 26.069 14.340 592 HG22 VAL 87 HG12 VAL 87 3.318 25.453 14.912 593 HG23 VAL 87 HG13 VAL 87 1.946 25.555 16.017 594 H THR 88 HN THR 88 0.142 21.665 15.522 595 HA THR 88 HA THR 88 0.317 19.821 13.414 596 HB THR 88 HB THR 88 -1.243 19.654 16.003 597 HG1 THR 88 HG1 THR 88 0.935 19.714 16.336 598 HG21 THR 88 HG21 THR 88 -2.205 18.114 14.342 599 HG22 THR 88 HG22 THR 88 -1.325 17.219 15.581 600 HG23 THR 88 HG23 THR 88 -0.598 17.476 13.994 601 H THR 89 HN THR 89 -2.630 21.285 14.785 602 HA THR 89 HA THR 89 -4.535 20.034 13.148 603 HB THR 89 HB THR 89 -4.682 22.986 13.776 604 HG1 THR 89 HG1 THR 89 -4.900 20.759 15.503 605 HG21 THR 89 HG21 THR 89 -6.904 21.056 14.207 606 HG22 THR 89 HG22 THR 89 -6.451 21.385 12.536 607 HG23 THR 89 HG23 THR 89 -6.952 22.707 13.590 608 H ASN 90 HN ASN 90 -2.609 22.960 12.469 609 HA ASN 90 HA ASN 90 -3.670 23.288 9.796 610 HB2 ASN 90 HB2 ASN 90 -1.103 24.321 11.046 611 HB3 ASN 90 HB1 ASN 90 -1.764 24.857 9.501 612 HD21 ASN 90 HD21 ASN 90 -1.405 26.630 11.773 613 HD22 ASN 90 HD22 ASN 90 -2.944 27.139 12.279 614 H ALA 91 HN ALA 91 -0.806 21.707 11.172 615 HA ALA 91 HA ALA 91 0.397 21.024 8.648 616 HB1 ALA 91 HB1 ALA 91 1.794 19.514 9.935 617 HB2 ALA 91 HB2 ALA 91 0.662 19.559 11.287 618 HB3 ALA 91 HB3 ALA 91 1.585 21.000 10.861 619 H ILE 92 HN ILE 92 -1.373 18.948 10.973 620 HA ILE 92 HA ILE 92 -1.632 16.727 9.209 621 HB ILE 92 HB ILE 92 -3.432 17.614 11.486 622 HG12 ILE 92 HG12 ILE 92 -1.144 15.623 11.380 623 HG13 ILE 92 HG11 ILE 92 -1.074 17.221 12.125 624 HG21 ILE 92 HG21 ILE 92 -4.772 15.911 10.873 625 HG22 ILE 92 HG22 ILE 92 -3.431 14.805 11.171 626 HG23 ILE 92 HG23 ILE 92 -3.678 15.477 9.560 627 HD11 ILE 92 HD11 ILE 92 -1.510 15.588 13.867 628 HD12 ILE 92 HD12 ILE 92 -2.852 14.907 12.949 629 HD13 ILE 92 HD13 ILE 92 -2.977 16.534 13.617 630 H ALA 93 HN ALA 93 -3.885 19.410 9.894 631 HA ALA 93 HA ALA 93 -5.926 18.550 8.084 632 HB1 ALA 93 HB1 ALA 93 -6.272 20.276 9.834 633 HB2 ALA 93 HB2 ALA 93 -6.765 20.850 8.242 634 HB3 ALA 93 HB3 ALA 93 -5.231 21.378 8.933 635 H ASP 94 HN ASP 94 -3.324 20.976 7.632 636 HA ASP 94 HA ASP 94 -3.921 21.535 4.906 637 HB2 ASP 94 HB1 ASP 94 -1.302 21.662 6.420 638 HB3 ASP 94 HB2 ASP 94 -1.520 22.291 4.787 639 H ALA 95 HN ALA 95 -2.021 18.952 6.387 640 HA ALA 95 HA ALA 95 -0.884 18.020 3.888 641 HB1 ALA 95 HB1 ALA 95 -1.235 15.954 5.918 642 HB2 ALA 95 HB2 ALA 95 -0.532 17.423 6.594 643 HB3 ALA 95 HB3 ALA 95 0.253 16.611 5.241 644 H LEU 96 HN LEU 96 -3.703 17.114 5.843 645 HA LEU 96 HA LEU 96 -4.537 14.967 4.102 646 HB2 LEU 96 HB2 LEU 96 -5.256 15.794 6.604 647 HB3 LEU 96 HB1 LEU 96 -6.625 16.366 5.649 648 HG LEU 96 HG LEU 96 -5.915 13.743 4.745 649 HD11 LEU 96 HD11 LEU 96 -6.846 13.303 7.465 650 HD12 LEU 96 HD12 LEU 96 -5.258 14.070 7.446 651 HD13 LEU 96 HD13 LEU 96 -5.508 12.538 6.606 652 HD21 LEU 96 HD21 LEU 96 -8.256 13.278 5.474 653 HD22 LEU 96 HD22 LEU 96 -8.123 14.763 4.530 654 HD23 LEU 96 HD23 LEU 96 -8.285 14.844 6.284 655 H THR 97 HN THR 97 -5.335 18.415 4.330 656 HA THR 97 HA THR 97 -7.466 18.394 2.428 657 HB THR 97 HB THR 97 -5.529 20.641 3.056 658 HG1 THR 97 HG1 THR 97 -6.453 20.313 4.935 659 HG21 THR 97 HG21 THR 97 -6.673 21.537 1.290 660 HG22 THR 97 HG22 THR 97 -7.910 21.809 2.517 661 HG23 THR 97 HG23 THR 97 -8.015 20.406 1.454 662 H SER 98 HN SER 98 -3.999 19.199 1.985 663 HA SER 98 HA SER 98 -4.124 19.618 -0.818 664 HB2 SER 98 HB2 SER 98 -1.725 19.296 -0.820 665 HB3 SER 98 HB1 SER 98 -2.157 20.129 0.673 666 HG SER 98 HG SER 98 -0.712 18.169 0.735 667 H ALA 99 HN ALA 99 -3.840 16.637 1.058 668 HA ALA 99 HA ALA 99 -3.262 14.933 -1.201 669 HB1 ALA 99 HB1 ALA 99 -4.709 13.909 1.215 670 HB2 ALA 99 HB2 ALA 99 -3.061 14.506 1.403 671 HB3 ALA 99 HB3 ALA 99 -3.393 13.169 0.302 672 H PHE 100 HN PHE 100 -6.280 15.760 0.517 673 HA PHE 100 HA PHE 100 -8.095 14.088 -0.765 674 HB2 PHE 100 HB1 PHE 100 -8.209 16.754 0.470 675 HB3 PHE 100 HB2 PHE 100 -9.458 16.488 -0.746 676 HD1 PHE 100 HD1 PHE 100 -10.582 14.049 -0.613 677 HD2 PHE 100 HD2 PHE 100 -8.673 16.091 2.646 678 HE1 PHE 100 HE1 PHE 100 -11.867 12.673 1.001 679 HE2 PHE 100 HE2 PHE 100 -9.956 14.717 4.258 680 HZ PHE 100 HZ PHE 100 -11.552 13.006 3.438 681 H TYR 101 HN TYR 101 -7.118 17.326 -1.931 682 HA TYR 101 HA TYR 101 -8.434 16.993 -4.482 683 HB2 TYR 101 HB2 TYR 101 -6.180 18.920 -3.961 684 HB3 TYR 101 HB1 TYR 101 -7.594 19.129 -4.999 685 HD1 TYR 101 HD1 TYR 101 -9.815 18.270 -3.333 686 HD2 TYR 101 HD2 TYR 101 -6.325 20.528 -2.249 687 HE1 TYR 101 HE1 TYR 101 -11.057 19.274 -1.437 688 HE2 TYR 101 HE2 TYR 101 -7.569 21.538 -0.354 689 HH TYR 101 HH TYR 101 -11.006 20.769 0.206 690 H GLN 102 HN GLN 102 -5.187 16.379 -3.290 691 HA GLN 102 HA GLN 102 -4.063 15.954 -5.943 692 HB2 GLN 102 HB2 GLN 102 -3.074 15.263 -3.163 693 HB3 GLN 102 HB1 GLN 102 -2.141 14.971 -4.632 694 HG2 GLN 102 HG2 GLN 102 -3.251 17.690 -3.895 695 HG3 GLN 102 HG1 GLN 102 -1.630 17.161 -3.447 696 HE21 GLN 102 HE21 GLN 102 -2.972 19.109 -5.637 697 HE22 GLN 102 HE22 GLN 102 -2.004 18.796 -6.996 698 H THR 103 HN THR 103 -5.918 14.035 -3.735 699 HA THR 103 HA THR 103 -5.044 11.548 -5.124 700 HB THR 103 HB THR 103 -6.155 10.357 -3.277 701 HG1 THR 103 HG1 THR 103 -6.956 11.670 -1.550 702 HG21 THR 103 HG21 THR 103 -4.006 10.650 -2.566 703 HG22 THR 103 HG22 THR 103 -4.764 11.730 -1.396 704 HG23 THR 103 HG23 THR 103 -4.037 12.388 -2.861 705 H THR 104 HN THR 104 -8.176 12.890 -3.915 706 HA THR 104 HA THR 104 -9.386 11.768 -6.412 707 HB THR 104 HB THR 104 -11.319 11.057 -5.173 708 HG1 THR 104 HG1 THR 104 -11.621 11.599 -3.074 709 HG21 THR 104 HG21 THR 104 -10.369 9.250 -4.105 710 HG22 THR 104 HG22 THR 104 -9.178 10.241 -3.263 711 HG23 THR 104 HG23 THR 104 -8.948 9.844 -4.966 712 H GLY 105 HN GLY 105 -9.765 14.213 -3.831 713 HA2 GLY 105 HA2 GLY 105 -10.185 16.550 -4.529 714 HA3 GLY 105 HA1 GLY 105 -11.133 15.917 -5.872 715 H VAL 106 HN VAL 106 -11.213 15.034 -2.406 716 HA VAL 106 HA VAL 106 -14.133 15.643 -2.465 717 HB VAL 106 HB VAL 106 -12.586 14.005 -0.436 718 HG11 VAL 106 HG21 VAL 106 -14.599 14.699 0.575 719 HG12 VAL 106 HG22 VAL 106 -15.008 13.122 -0.099 720 HG13 VAL 106 HG23 VAL 106 -15.500 14.594 -0.938 721 HG21 VAL 106 HG11 VAL 106 -12.664 13.146 -2.875 722 HG22 VAL 106 HG12 VAL 106 -14.391 12.922 -2.598 723 HG23 VAL 106 HG13 VAL 106 -13.219 12.051 -1.609 724 H VAL 107 HN VAL 107 -14.953 16.459 -0.239 725 HA VAL 107 HA VAL 107 -13.567 18.908 0.380 726 HB VAL 107 HB VAL 107 -15.253 19.066 2.239 727 HG11 VAL 107 HG21 VAL 107 -15.791 18.754 -0.632 728 HG12 VAL 107 HG22 VAL 107 -16.315 20.021 0.477 729 HG13 VAL 107 HG23 VAL 107 -17.218 18.509 0.376 730 HG21 VAL 107 HG11 VAL 107 -16.055 17.113 3.035 731 HG22 VAL 107 HG12 VAL 107 -15.396 16.223 1.660 732 HG23 VAL 107 HG13 VAL 107 -16.990 16.971 1.546 733 H ASN 108 HN ASN 108 -11.802 19.098 1.654 734 HA ASN 108 HA ASN 108 -10.795 16.896 3.232 735 HB2 ASN 108 HB1 ASN 108 -9.086 18.531 3.975 736 HB3 ASN 108 HB2 ASN 108 -9.292 18.562 2.224 737 HD21 ASN 108 HD21 ASN 108 -8.721 20.684 4.583 738 HD22 ASN 108 HD22 ASN 108 -9.620 22.013 4.032 739 H SER 109 HN SER 109 -12.913 19.555 3.847 740 HA SER 109 HA SER 109 -12.600 19.805 6.665 741 HB2 SER 109 HB2 SER 109 -13.879 21.396 5.241 742 HB3 SER 109 HB1 SER 109 -15.129 20.171 5.034 743 HG SER 109 HG SER 109 -14.727 21.859 7.085 744 H ARG 110 HN ARG 110 -14.374 17.445 4.727 745 HA ARG 110 HA ARG 110 -16.016 16.437 6.852 746 HB2 ARG 110 HB2 ARG 110 -16.413 15.941 4.456 747 HB3 ARG 110 HB1 ARG 110 -14.944 14.965 4.426 748 HG2 ARG 110 HG2 ARG 110 -15.915 13.530 6.229 749 HG3 ARG 110 HG1 ARG 110 -17.408 14.464 6.125 750 HD2 ARG 110 HD2 ARG 110 -16.146 12.882 3.863 751 HD3 ARG 110 HD1 ARG 110 -17.578 12.408 4.777 752 HE ARG 110 HE ARG 110 -17.461 14.776 2.956 753 HH11 ARG 110 HH11 ARG 110 -19.614 14.869 5.031 754 HH12 ARG 110 HH12 ARG 110 -20.942 14.114 4.215 755 HH21 ARG 110 HH21 ARG 110 -18.964 12.698 1.744 756 HH22 ARG 110 HH22 ARG 110 -20.575 12.885 2.354 757 H PHE 111 HN PHE 111 -12.947 15.123 5.527 758 HA PHE 111 HA PHE 111 -12.707 13.207 7.705 759 HB2 PHE 111 HB1 PHE 111 -11.726 13.027 5.323 760 HB3 PHE 111 HB2 PHE 111 -10.453 14.096 5.910 761 HD1 PHE 111 HD2 PHE 111 -12.098 10.806 6.436 762 HD2 PHE 111 HD1 PHE 111 -8.744 13.318 7.387 763 HE1 PHE 111 HE2 PHE 111 -10.954 8.877 7.497 764 HE2 PHE 111 HE1 PHE 111 -7.603 11.389 8.449 765 HZ PHE 111 HZ PHE 111 -8.706 9.169 8.503 766 H ILE 112 HN ILE 112 -10.832 16.117 6.814 767 HA ILE 112 HA ILE 112 -9.149 16.165 9.077 768 HB ILE 112 HB ILE 112 -10.238 18.460 7.427 769 HG12 ILE 112 HG11 ILE 112 -7.656 16.875 7.309 770 HG13 ILE 112 HG12 ILE 112 -8.975 16.795 6.142 771 HG21 ILE 112 HG21 ILE 112 -7.853 19.330 8.337 772 HG22 ILE 112 HG22 ILE 112 -8.333 18.333 9.710 773 HG23 ILE 112 HG23 ILE 112 -9.366 19.660 9.181 774 HD11 ILE 112 HD11 ILE 112 -8.636 19.347 5.887 775 HD12 ILE 112 HD12 ILE 112 -7.433 18.287 5.151 776 HD13 ILE 112 HD13 ILE 112 -7.086 19.084 6.687 777 H SER 113 HN SER 113 -12.469 17.374 8.732 778 HA SER 113 HA SER 113 -12.601 18.952 11.075 779 HB2 SER 113 HB2 SER 113 -14.486 18.987 9.611 780 HB3 SER 113 HB1 SER 113 -14.682 17.237 9.708 781 HG SER 113 HG SER 113 -15.353 19.223 11.550 782 H GLU 114 HN GLU 114 -13.057 15.437 10.695 783 HA GLU 114 HA GLU 114 -13.643 15.002 13.495 784 HB2 GLU 114 HB2 GLU 114 -12.673 13.097 11.343 785 HB3 GLU 114 HB1 GLU 114 -13.230 12.603 12.941 786 HG2 GLU 114 HG2 GLU 114 -14.875 14.142 10.907 787 HG3 GLU 114 HG1 GLU 114 -15.042 12.422 11.264 788 H ILE 115 HN ILE 115 -10.689 14.847 11.532 789 HA ILE 115 HA ILE 115 -8.973 13.723 13.499 790 HB ILE 115 HB ILE 115 -8.322 15.758 11.345 791 HG12 ILE 115 HG12 ILE 115 -8.158 12.729 11.350 792 HG13 ILE 115 HG11 ILE 115 -9.379 13.679 10.504 793 HG21 ILE 115 HG21 ILE 115 -6.196 15.675 12.080 794 HG22 ILE 115 HG22 ILE 115 -6.207 13.915 11.975 795 HG23 ILE 115 HG23 ILE 115 -6.735 14.714 13.456 796 HD11 ILE 115 HD11 ILE 115 -6.991 12.878 9.405 797 HD12 ILE 115 HD12 ILE 115 -6.608 14.512 9.946 798 HD13 ILE 115 HD13 ILE 115 -7.948 14.243 8.831 799 H ARG 116 HN ARG 116 -9.762 17.141 12.823 800 HA ARG 116 HA ARG 116 -8.056 18.339 14.718 801 HB2 ARG 116 HB1 ARG 116 -10.816 19.123 13.757 802 HB3 ARG 116 HB2 ARG 116 -9.848 20.149 14.817 803 HG2 ARG 116 HG1 ARG 116 -7.987 19.992 13.114 804 HG3 ARG 116 HG2 ARG 116 -9.128 19.189 12.035 805 HD2 ARG 116 HD2 ARG 116 -9.145 21.538 11.477 806 HD3 ARG 116 HD1 ARG 116 -10.658 21.183 12.310 807 HE ARG 116 HE ARG 116 -8.869 21.996 14.309 808 HH11 ARG 116 HH11 ARG 116 -8.289 23.605 11.611 809 HH12 ARG 116 HH12 ARG 116 -9.079 25.090 12.022 810 HH21 ARG 116 HH21 ARG 116 -10.732 23.758 14.764 811 HH22 ARG 116 HH22 ARG 116 -10.463 25.177 13.808 812 H SER 117 HN SER 117 -11.413 17.191 15.195 813 HA SER 117 HA SER 117 -11.603 17.848 17.949 814 HB2 SER 117 HB2 SER 117 -12.832 15.459 16.537 815 HB3 SER 117 HB1 SER 117 -13.382 16.167 18.055 816 HG SER 117 HG SER 117 -14.006 17.983 16.993 817 H LEU 118 HN LEU 118 -10.121 15.104 16.307 818 HA LEU 118 HA LEU 118 -9.652 13.586 18.738 819 HB2 LEU 118 HB2 LEU 118 -8.340 13.400 16.008 820 HB3 LEU 118 HB1 LEU 118 -8.175 12.210 17.301 821 HG LEU 118 HG LEU 118 -10.767 13.018 15.944 822 HD11 LEU 118 HD11 LEU 118 -8.768 10.904 15.490 823 HD12 LEU 118 HD12 LEU 118 -10.026 11.513 14.413 824 HD13 LEU 118 HD13 LEU 118 -10.421 10.305 15.637 825 HD21 LEU 118 HD21 LEU 118 -11.689 11.107 17.303 826 HD22 LEU 118 HD22 LEU 118 -11.185 12.493 18.271 827 HD23 LEU 118 HD23 LEU 118 -10.158 11.061 18.178 828 H ILE 119 HN ILE 119 -7.678 15.793 16.735 829 HA ILE 119 HA ILE 119 -5.238 15.452 18.159 830 HB ILE 119 HB ILE 119 -6.280 17.991 16.865 831 HG12 ILE 119 HG12 ILE 119 -4.555 15.810 15.661 832 HG13 ILE 119 HG11 ILE 119 -6.296 15.926 15.404 833 HG21 ILE 119 HG21 ILE 119 -3.662 18.113 16.476 834 HG22 ILE 119 HG22 ILE 119 -3.620 17.067 17.895 835 HG23 ILE 119 HG23 ILE 119 -4.364 18.663 17.998 836 HD11 ILE 119 HD11 ILE 119 -4.285 18.099 14.740 837 HD12 ILE 119 HD12 ILE 119 -6.022 18.167 14.438 838 HD13 ILE 119 HD13 ILE 119 -5.021 17.005 13.568 839 H GLY 120 HN GLY 120 -8.075 17.452 18.826 840 HA2 GLY 120 HA2 GLY 120 -6.868 18.899 21.023 841 HA3 GLY 120 HA1 GLY 120 -8.596 18.791 20.689 842 H MET 121 HN MET 121 -8.695 15.885 20.734 843 HA MET 121 HA MET 121 -9.189 15.450 23.506 844 HB2 MET 121 HB2 MET 121 -10.153 14.117 21.584 845 HB3 MET 121 HB1 MET 121 -8.591 13.311 21.446 846 HG2 MET 121 HG2 MET 121 -8.788 12.613 23.838 847 HG3 MET 121 HG1 MET 121 -10.400 13.327 23.880 848 HE1 MET 121 HE1 MET 121 -12.292 12.743 22.456 849 HE2 MET 121 HE2 MET 121 -12.476 11.322 21.431 850 HE3 MET 121 HE3 MET 121 -11.472 12.666 20.890 851 H PHE 122 HN PHE 122 -6.420 14.497 21.464 852 HA PHE 122 HA PHE 122 -4.976 13.087 23.464 853 HB2 PHE 122 HB1 PHE 122 -3.935 14.737 21.141 854 HB3 PHE 122 HB2 PHE 122 -2.969 13.600 22.081 855 HD1 PHE 122 HD1 PHE 122 -3.784 11.157 22.213 856 HD2 PHE 122 HD2 PHE 122 -5.241 13.986 19.327 857 HE1 PHE 122 HE1 PHE 122 -4.602 9.293 20.799 858 HE2 PHE 122 HE2 PHE 122 -6.060 12.121 17.913 859 HZ PHE 122 HZ PHE 122 -5.741 9.774 18.649 860 H ALA 123 HN ALA 123 -5.142 16.548 22.719 861 HA ALA 123 HA ALA 123 -3.034 17.360 24.488 862 HB1 ALA 123 HB1 ALA 123 -4.698 19.515 24.480 863 HB2 ALA 123 HB2 ALA 123 -5.255 18.673 23.034 864 HB3 ALA 123 HB3 ALA 123 -3.564 19.154 23.178 865 H GLN 124 HN GLN 124 -6.440 16.634 24.983 866 HA GLN 124 HA GLN 124 -6.638 17.779 27.620 867 HB2 GLN 124 HB1 GLN 124 -8.210 15.538 26.312 868 HB3 GLN 124 HB2 GLN 124 -8.649 16.316 27.832 869 HG2 GLN 124 HG2 GLN 124 -8.878 18.469 26.714 870 HG3 GLN 124 HG1 GLN 124 -8.303 17.777 25.197 871 HE21 GLN 124 HE21 GLN 124 -10.868 18.991 25.303 872 HE22 GLN 124 HE22 GLN 124 -12.063 17.792 25.173 873 H ALA 125 HN ALA 125 -5.580 14.647 26.387 874 HA ALA 125 HA ALA 125 -5.575 13.181 28.810 875 HB1 ALA 125 HB1 ALA 125 -4.686 12.751 26.199 876 HB2 ALA 125 HB2 ALA 125 -4.595 11.598 27.530 877 HB3 ALA 125 HB3 ALA 125 -3.220 12.646 27.173 878 H SER 126 HN SER 126 -3.280 15.554 27.544 879 HA SER 126 HA SER 126 -1.134 15.127 29.333 880 HB2 SER 126 HB2 SER 126 -2.140 17.805 28.321 881 HB3 SER 126 HB1 SER 126 -0.513 17.449 28.900 882 HG SER 126 HG SER 126 -0.557 17.344 26.658 883 H ALA 127 HN ALA 127 -4.185 16.864 29.793 884 HA ALA 127 HA ALA 127 -3.506 18.019 32.337 885 HB1 ALA 127 HB1 ALA 127 -6.334 17.265 31.868 886 HB2 ALA 127 HB2 ALA 127 -5.609 18.295 30.634 887 HB3 ALA 127 HB3 ALA 127 -5.645 18.826 32.315 888 H ASN 128 HN ASN 128 -4.522 14.837 31.347 889 HA ASN 128 HA ASN 128 -5.584 13.864 33.795 890 HB2 ASN 128 HB1 ASN 128 -5.569 12.662 31.561 891 HB3 ASN 128 HB2 ASN 128 -3.874 12.275 31.863 892 HD21 ASN 128 HD21 ASN 128 -3.523 10.352 32.989 893 HD22 ASN 128 HD22 ASN 128 -4.670 9.574 33.969 894 H ASP 129 HN ASP 129 -2.401 14.843 32.989 895 HA ASP 129 HA ASP 129 -0.931 13.148 34.797 896 HB2 ASP 129 HB2 ASP 129 -0.348 15.858 33.585 897 HB3 ASP 129 HB1 ASP 129 0.794 15.024 34.638 898 H VAL 130 HN VAL 130 -2.371 16.393 35.134 899 HA VAL 130 HA VAL 130 -1.467 16.795 37.840 900 HB VAL 130 HB VAL 130 -3.283 18.535 37.901 901 HG11 VAL 130 HG21 VAL 130 -2.321 19.535 35.531 902 HG12 VAL 130 HG22 VAL 130 -1.096 18.331 35.935 903 HG13 VAL 130 HG23 VAL 130 -1.468 19.626 37.072 904 HG21 VAL 130 HG11 VAL 130 -3.807 18.066 35.007 905 HG22 VAL 130 HG12 VAL 130 -4.876 18.713 36.253 906 HG23 VAL 130 HG13 VAL 130 -4.597 16.974 36.145 907 H TYR 131 HN TYR 131 -4.225 15.167 36.411 908 HA TYR 131 HA TYR 131 -4.782 13.608 38.714 909 HB2 TYR 131 HB2 TYR 131 -6.771 14.656 39.612 910 HB3 TYR 131 HB1 TYR 131 -5.483 15.862 39.614 911 HD1 TYR 131 HD2 TYR 131 -5.454 17.682 37.950 912 HD2 TYR 131 HD1 TYR 131 -8.664 14.833 38.105 913 HE1 TYR 131 HE2 TYR 131 -6.836 19.162 36.518 914 HE2 TYR 131 HE1 TYR 131 -10.047 16.312 36.673 915 HH TYR 131 HH TYR 131 -8.719 19.085 35.075 916 H ALA 132 HN ALA 132 -7.380 12.952 38.481 917 HA ALA 132 HA ALA 132 -7.513 11.810 35.800 918 HB1 ALA 132 HB1 ALA 132 -9.471 10.646 36.593 919 HB2 ALA 132 HB2 ALA 132 -9.653 11.763 37.945 920 HB3 ALA 132 HB3 ALA 132 -8.294 10.639 37.906 921 H SER 133 HN SER 133 -8.199 13.044 34.120 922 HA SER 133 HA SER 133 -10.276 15.121 34.655 923 HB2 SER 133 HB2 SER 133 -8.127 15.907 33.665 924 HB3 SER 133 HB1 SER 133 -8.408 14.852 32.280 925 HG SER 133 HG SER 133 -9.383 17.292 32.755 926 H ALA 134 HN ALA 134 -12.221 15.034 33.545 927 HA ALA 134 HA ALA 134 -13.990 13.956 32.428 928 HB1 ALA 134 HB1 ALA 134 -12.563 12.918 30.179 929 HB2 ALA 134 HB2 ALA 134 -11.844 14.470 30.611 930 HB3 ALA 134 HB3 ALA 134 -13.568 14.366 30.257 931 H GLY 135 HN GLY 135 -14.461 12.168 33.734 932 HA2 GLY 135 HA2 GLY 135 -12.868 9.811 33.932 933 HA3 GLY 135 HA1 GLY 135 -14.588 9.897 34.312 934 H SER 136 HN SER 136 -15.269 10.836 31.580 935 HA SER 136 HA SER 136 -15.602 8.236 30.351 936 HB2 SER 136 HB2 SER 136 -16.805 9.391 28.635 937 HB3 SER 136 HB1 SER 136 -17.173 10.239 30.137 938 HG SER 136 HG SER 136 -15.300 10.971 28.145 939 H GLY 137 HN GLY 137 -14.851 7.782 28.081 940 HA2 GLY 137 HA2 GLY 137 -12.415 9.216 27.236 941 HA3 GLY 137 HA1 GLY 137 -12.195 7.527 27.694
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