NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
1805 | 1ayk | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H VAL 1 HT2 VAL 1 3.169 20.002 47.304 2 2H VAL 1 HT1 VAL 1 4.447 18.895 47.143 3 3H VAL 1 HT3 VAL 1 4.731 20.552 46.918 4 HA VAL 1 HA VAL 1 4.543 20.071 44.757 5 HB VAL 1 HB VAL 1 4.562 17.667 45.161 6 1HG1 VAL 1 HG11 VAL 1 2.493 17.950 46.823 7 2HG1 VAL 1 HG13 VAL 1 1.567 17.540 45.379 8 3HG1 VAL 1 HG12 VAL 1 2.785 16.426 45.991 9 1HG2 VAL 1 HG23 VAL 1 3.904 18.609 42.899 10 2HG2 VAL 1 HG22 VAL 1 3.359 16.960 43.203 11 3HG2 VAL 1 HG21 VAL 1 2.225 18.300 43.334 12 H LEU 2 HN LEU 2 3.363 22.144 44.978 13 HA LEU 2 HA LEU 2 0.541 22.307 45.317 14 1HB LEU 2 HB2 LEU 2 1.987 24.295 45.401 15 2HB LEU 2 HB1 LEU 2 2.397 24.088 43.701 16 HG LEU 2 HG LEU 2 0.030 24.449 43.080 17 1HD1 LEU 2 HD11 LEU 2 -0.297 24.557 46.078 18 2HD1 LEU 2 HD13 LEU 2 -1.414 25.433 45.031 19 3HD1 LEU 2 HD12 LEU 2 -1.266 23.684 44.890 20 1HD2 LEU 2 HD23 LEU 2 1.726 26.351 43.450 21 2HD2 LEU 2 HD22 LEU 2 0.022 26.802 43.430 22 3HD2 LEU 2 HD21 LEU 2 0.877 26.656 44.965 23 H THR 3 HN THR 3 2.485 22.136 42.333 24 HA THR 3 HA THR 3 0.010 21.546 40.779 25 HB THR 3 HB THR 3 1.551 21.815 38.806 26 HG1 THR 3 HG1 THR 3 3.338 21.849 40.859 27 1HG2 THR 3 HG21 THR 3 0.199 23.698 39.663 28 2HG2 THR 3 HG23 THR 3 1.501 24.121 40.775 29 3HG2 THR 3 HG22 THR 3 1.749 24.257 39.035 30 H GLU 4 HN GLU 4 -0.290 19.573 39.769 31 HA GLU 4 HA GLU 4 1.155 17.284 40.787 32 1HB GLU 4 HB2 GLU 4 -1.256 17.282 40.029 33 2HB GLU 4 HB1 GLU 4 -0.675 17.418 38.369 34 1HG GLU 4 HG2 GLU 4 0.579 15.312 38.630 35 2HG GLU 4 HG1 GLU 4 0.006 15.172 40.293 36 H GLY 5 HN GLY 5 2.825 16.119 39.797 37 1HA GLY 5 HA2 GLY 5 4.595 15.705 38.302 38 2HA GLY 5 HA1 GLY 5 3.556 16.366 37.035 39 H ASN 6 HN ASN 6 5.199 17.655 36.059 40 HA ASN 6 HA ASN 6 6.756 19.506 37.680 41 1HB ASN 6 HB2 ASN 6 6.416 19.156 34.695 42 2HB ASN 6 HB1 ASN 6 7.439 20.411 35.390 43 1HD2 ASN 6 HD22 ASN 6 9.370 17.173 34.774 44 2HD2 ASN 6 HD21 ASN 6 8.297 18.035 33.782 45 HA PRO 7 HA PRO 7 3.760 22.794 37.720 46 1HB PRO 7 HB2 PRO 7 5.557 24.986 37.406 47 2HB PRO 7 HB1 PRO 7 5.004 24.290 38.937 48 1HG PRO 7 HG2 PRO 7 7.629 23.988 37.610 49 2HG PRO 7 HG1 PRO 7 7.191 23.662 39.294 50 1HD PRO 7 HD2 PRO 7 7.680 21.699 37.319 51 2HD PRO 7 HD1 PRO 7 6.876 21.428 38.881 52 H ARG 8 HN ARG 8 2.591 22.733 35.785 53 HA ARG 8 HA ARG 8 3.903 23.639 33.268 54 1HB ARG 8 HB2 ARG 8 1.135 22.487 33.733 55 2HB ARG 8 HB1 ARG 8 1.845 22.844 32.165 56 1HG ARG 8 HG2 ARG 8 2.921 20.843 34.173 57 2HG ARG 8 HG1 ARG 8 2.045 20.444 32.699 58 1HD ARG 8 HD2 ARG 8 4.828 21.553 33.004 59 2HD ARG 8 HD1 ARG 8 4.272 20.200 32.023 60 HE ARG 8 HE ARG 8 2.995 22.342 30.865 61 1HH1 ARG 8 HH21 ARG 8 6.228 21.631 31.816 62 2HH1 ARG 8 HH22 ARG 8 6.950 22.562 30.547 63 1HH2 ARG 8 HH11 ARG 8 3.918 23.557 29.191 64 2HH2 ARG 8 HH12 ARG 8 5.642 23.644 29.055 65 H TRP 9 HN TRP 9 2.875 25.326 31.984 66 HA TRP 9 HA TRP 9 2.029 27.574 33.574 67 1HB TRP 9 HB2 TRP 9 1.936 27.055 30.587 68 2HB TRP 9 HB1 TRP 9 1.507 28.600 31.321 69 HD1 TRP 9 HD1 TRP 9 4.435 26.552 30.228 70 HE1 TRP 9 HE1 TRP 9 6.629 27.782 30.797 71 HE3 TRP 9 HE3 TRP 9 2.613 30.261 33.220 72 HZ2 TRP 9 HZ2 TRP 9 7.497 30.047 32.322 73 HZ3 TRP 9 HZ3 TRP 9 4.137 31.940 34.217 74 HH2 TRP 9 HH2 TRP 9 6.575 31.839 33.773 75 H GLU 10 HN GLU 10 -0.001 28.047 34.287 76 HA GLU 10 HA GLU 10 -2.213 26.261 33.645 77 1HB GLU 10 HB2 GLU 10 -2.055 28.807 35.282 78 2HB GLU 10 HB1 GLU 10 -3.522 27.842 35.114 79 1HG GLU 10 HG2 GLU 10 -0.890 26.738 36.134 80 2HG GLU 10 HG1 GLU 10 -2.185 27.316 37.183 81 H GLN 11 HN GLN 11 -1.102 29.390 32.553 82 HA GLN 11 HA GLN 11 -3.656 30.040 31.253 83 1HB GLN 11 HB2 GLN 11 -0.919 31.337 31.161 84 2HB GLN 11 HB1 GLN 11 -2.330 31.961 30.304 85 1HG GLN 11 HG2 GLN 11 -3.541 32.159 32.450 86 2HG GLN 11 HG1 GLN 11 -2.125 31.541 33.301 87 1HE2 GLN 11 HE22 GLN 11 -1.055 34.886 33.661 88 2HE2 GLN 11 HE21 GLN 11 -1.487 33.440 34.435 89 H THR 12 HN THR 12 -4.017 30.001 28.993 90 HA THR 12 HA THR 12 -2.308 28.085 27.509 91 HB THR 12 HB THR 12 -4.120 28.233 25.792 92 HG1 THR 12 HG1 THR 12 -4.715 30.403 26.385 93 1HG2 THR 12 HG22 THR 12 -4.878 27.638 28.660 94 2HG2 THR 12 HG21 THR 12 -5.936 27.269 27.299 95 3HG2 THR 12 HG23 THR 12 -4.355 26.496 27.421 96 H HIS 13 HN HIS 13 -2.424 31.364 28.033 97 HA HIS 13 HA HIS 13 -1.050 31.953 25.434 98 1HB HIS 13 HB2 HIS 13 -2.753 33.881 27.048 99 2HB HIS 13 HB1 HIS 13 -1.984 34.199 25.492 100 HD1 HIS 13 HD1 HIS 13 -2.775 32.308 23.558 101 HD2 HIS 13 HD2 HIS 13 -5.368 33.079 26.730 102 HE1 HIS 13 HE1 HIS 13 -5.073 31.546 22.807 103 H LEU 14 HN LEU 14 0.925 32.991 25.668 104 HA LEU 14 HA LEU 14 1.734 33.839 28.435 105 1HB LEU 14 HB2 LEU 14 3.405 32.288 26.434 106 2HB LEU 14 HB1 LEU 14 3.954 32.858 28.007 107 HG LEU 14 HG LEU 14 1.631 30.948 27.601 108 1HD1 LEU 14 HD13 LEU 14 4.516 30.421 28.384 109 2HD1 LEU 14 HD12 LEU 14 3.220 29.228 28.474 110 3HD1 LEU 14 HD11 LEU 14 3.713 29.878 26.911 111 1HD2 LEU 14 HD22 LEU 14 3.022 32.126 30.011 112 2HD2 LEU 14 HD21 LEU 14 1.294 31.951 29.702 113 3HD2 LEU 14 HD23 LEU 14 2.260 30.540 30.125 114 H THR 15 HN THR 15 3.528 35.375 28.450 115 HA THR 15 HA THR 15 3.750 36.984 25.920 116 HB THR 15 HB THR 15 3.887 38.985 27.347 117 HG1 THR 15 HG1 THR 15 2.968 37.814 29.604 118 1HG2 THR 15 HG21 THR 15 1.490 37.210 27.873 119 2HG2 THR 15 HG23 THR 15 1.540 38.938 28.227 120 3HG2 THR 15 HG22 THR 15 1.678 38.375 26.562 121 H TYR 16 HN TYR 16 5.836 38.139 25.719 122 HA TYR 16 HA TYR 16 8.004 37.186 27.523 123 1HB TYR 16 HB2 TYR 16 9.359 36.368 25.660 124 2HB TYR 16 HB1 TYR 16 7.821 35.505 25.696 125 HD1 TYR 16 HD2 TYR 16 6.081 35.946 24.022 126 HD2 TYR 16 HD1 TYR 16 9.862 37.981 23.898 127 HE1 TYR 16 HE2 TYR 16 5.606 36.684 21.702 128 HE2 TYR 16 HE1 TYR 16 9.385 38.720 21.577 129 HH TYR 16 HH TYR 16 6.406 38.694 20.212 130 H ARG 17 HN ARG 17 9.967 38.453 27.301 131 HA ARG 17 HA ARG 17 9.792 40.879 25.584 132 1HB ARG 17 HB2 ARG 17 8.765 41.443 27.809 133 2HB ARG 17 HB1 ARG 17 10.304 41.034 28.568 134 1HG ARG 17 HG2 ARG 17 11.437 42.746 27.204 135 2HG ARG 17 HG1 ARG 17 9.905 43.169 26.450 136 1HD ARG 17 HD2 ARG 17 9.003 43.678 28.732 137 2HD ARG 17 HD1 ARG 17 10.615 43.432 29.391 138 HE ARG 17 HE ARG 17 9.615 45.819 28.141 139 1HH1 ARG 17 HH21 ARG 17 12.438 43.815 28.162 140 2HH1 ARG 17 HH22 ARG 17 13.450 45.037 27.470 141 1HH2 ARG 17 HH11 ARG 17 10.934 47.404 27.276 142 2HH2 ARG 17 HH12 ARG 17 12.606 47.061 26.978 143 H ILE 18 HN ILE 18 11.786 41.572 24.908 144 HA ILE 18 HA ILE 18 14.134 39.948 25.717 145 HB ILE 18 HB ILE 18 13.827 42.088 23.583 146 1HG1 ILE 18 HG12 ILE 18 14.009 39.076 23.280 147 2HG1 ILE 18 HG11 ILE 18 12.481 39.957 23.296 148 1HG2 ILE 18 HG23 ILE 18 16.059 40.153 24.259 149 2HG2 ILE 18 HG22 ILE 18 15.964 41.036 22.735 150 3HG2 ILE 18 HG21 ILE 18 16.139 41.914 24.253 151 1HD1 ILE 18 HD13 ILE 18 14.755 40.485 21.369 152 2HD1 ILE 18 HD12 ILE 18 13.314 39.542 20.985 153 3HD1 ILE 18 HD11 ILE 18 13.172 41.262 21.351 154 H GLU 19 HN GLU 19 15.319 40.709 27.408 155 HA GLU 19 HA GLU 19 14.927 43.310 28.533 156 1HB GLU 19 HB2 GLU 19 15.766 41.307 29.780 157 2HB GLU 19 HB1 GLU 19 17.303 41.476 28.932 158 1HG GLU 19 HG2 GLU 19 17.567 43.748 29.846 159 2HG GLU 19 HG1 GLU 19 16.027 43.592 30.690 160 H ASN 20 HN ASN 20 17.467 42.045 26.360 161 HA ASN 20 HA ASN 20 18.011 44.757 25.424 162 1HB ASN 20 HB2 ASN 20 19.267 44.593 27.617 163 2HB ASN 20 HB1 ASN 20 20.238 43.317 26.884 164 1HD2 ASN 20 HD22 ASN 20 22.418 45.818 25.705 165 2HD2 ASN 20 HD21 ASN 20 22.231 44.399 26.618 166 H TYR 21 HN TYR 21 19.438 44.761 23.573 167 HA TYR 21 HA TYR 21 19.686 42.075 22.279 168 1HB TYR 21 HB2 TYR 21 19.788 44.881 21.122 169 2HB TYR 21 HB1 TYR 21 19.955 43.396 20.186 170 HD1 TYR 21 HD2 TYR 21 17.649 45.503 22.143 171 HD2 TYR 21 HD1 TYR 21 18.039 41.942 19.773 172 HE1 TYR 21 HE2 TYR 21 15.179 45.338 21.986 173 HE2 TYR 21 HE1 TYR 21 15.569 41.779 19.613 174 HH TYR 21 HH TYR 21 13.525 44.219 20.207 175 H THR 22 HN THR 22 21.714 41.222 22.030 176 HA THR 22 HA THR 22 24.010 42.670 23.032 177 HB THR 22 HB THR 22 24.083 40.340 23.391 178 HG1 THR 22 HG1 THR 22 25.854 39.665 22.118 179 1HG2 THR 22 HG21 THR 22 23.237 40.149 20.502 180 2HG2 THR 22 HG23 THR 22 23.876 38.759 21.378 181 3HG2 THR 22 HG22 THR 22 22.396 39.547 21.929 182 HA PRO 23 HA PRO 23 25.045 44.670 19.167 183 1HB PRO 23 HB2 PRO 23 27.889 44.640 19.563 184 2HB PRO 23 HB1 PRO 23 26.778 45.968 19.922 185 1HG PRO 23 HG2 PRO 23 28.100 44.138 21.799 186 2HG PRO 23 HG1 PRO 23 27.218 45.632 22.149 187 1HD PRO 23 HD2 PRO 23 26.304 42.990 22.661 188 2HD PRO 23 HD1 PRO 23 25.336 44.475 22.741 189 H ASP 24 HN ASP 24 25.648 41.503 19.937 190 HA ASP 24 HA ASP 24 27.552 40.688 17.966 191 1HB ASP 24 HB2 ASP 24 25.233 39.208 19.239 192 2HB ASP 24 HB1 ASP 24 26.396 38.441 18.157 193 H LEU 25 HN LEU 25 24.028 41.118 17.827 194 HA LEU 25 HA LEU 25 24.219 41.165 14.860 195 1HB LEU 25 HB2 LEU 25 22.333 39.470 16.514 196 2HB LEU 25 HB1 LEU 25 22.034 39.826 14.819 197 HG LEU 25 HG LEU 25 24.655 38.620 15.727 198 1HD1 LEU 25 HD12 LEU 25 22.778 37.182 16.515 199 2HD1 LEU 25 HD11 LEU 25 22.193 37.091 14.853 200 3HD1 LEU 25 HD13 LEU 25 23.763 36.406 15.276 201 1HD2 LEU 25 HD22 LEU 25 23.156 38.817 13.101 202 2HD2 LEU 25 HD21 LEU 25 24.775 39.405 13.478 203 3HD2 LEU 25 HD23 LEU 25 24.476 37.677 13.340 204 HA PRO 26 HA PRO 26 21.631 44.733 15.411 205 1HB PRO 26 HB2 PRO 26 19.889 44.225 13.153 206 2HB PRO 26 HB1 PRO 26 21.255 45.346 13.232 207 1HG PRO 26 HG2 PRO 26 21.123 42.778 11.863 208 2HG PRO 26 HG1 PRO 26 22.443 43.957 11.849 209 1HD PRO 26 HD2 PRO 26 22.422 41.419 13.184 210 2HD PRO 26 HD1 PRO 26 23.669 42.679 13.289 211 H ARG 27 HN ARG 27 19.490 45.214 16.254 212 HA ARG 27 HA ARG 27 18.177 42.984 17.515 213 1HB ARG 27 HB2 ARG 27 16.589 44.603 18.352 214 2HB ARG 27 HB1 ARG 27 18.183 45.355 18.382 215 1HG ARG 27 HG2 ARG 27 17.654 46.380 16.135 216 2HG ARG 27 HG1 ARG 27 16.006 45.779 16.314 217 1HD ARG 27 HD2 ARG 27 15.867 47.018 18.500 218 2HD ARG 27 HD1 ARG 27 17.430 47.745 18.121 219 HE ARG 27 HE ARG 27 15.893 48.268 15.875 220 1HH1 ARG 27 HH21 ARG 27 15.593 48.723 19.274 221 2HH1 ARG 27 HH22 ARG 27 14.634 50.159 19.134 222 1HH2 ARG 27 HH11 ARG 27 14.633 50.137 15.666 223 2HH2 ARG 27 HH12 ARG 27 14.094 50.962 17.090 224 H ALA 28 HN ALA 28 17.653 44.733 14.524 225 HA ALA 28 HA ALA 28 15.002 43.912 13.948 226 1HB ALA 28 HB3 ALA 28 16.367 45.585 12.644 227 2HB ALA 28 HB2 ALA 28 17.255 44.233 11.946 228 3HB ALA 28 HB1 ALA 28 15.528 44.407 11.636 229 H ASP 29 HN ASP 29 18.105 42.269 13.393 230 HA ASP 29 HA ASP 29 16.818 40.007 12.059 231 1HB ASP 29 HB2 ASP 29 19.631 40.480 13.074 232 2HB ASP 29 HB1 ASP 29 19.127 38.994 12.269 233 H VAL 30 HN VAL 30 17.867 40.776 15.347 234 HA VAL 30 HA VAL 30 17.725 38.058 16.320 235 HB VAL 30 HB VAL 30 17.497 40.714 17.767 236 1HG1 VAL 30 HG13 VAL 30 17.640 37.866 18.768 237 2HG1 VAL 30 HG12 VAL 30 18.139 39.230 19.767 238 3HG1 VAL 30 HG11 VAL 30 16.473 39.116 19.201 239 1HG2 VAL 30 HG23 VAL 30 19.666 40.157 16.584 240 2HG2 VAL 30 HG22 VAL 30 19.821 40.367 18.328 241 3HG2 VAL 30 HG21 VAL 30 19.803 38.746 17.635 242 H ASP 31 HN ASP 31 15.402 40.767 16.239 243 HA ASP 31 HA ASP 31 13.304 39.485 17.677 244 1HB ASP 31 HB2 ASP 31 13.249 41.542 15.450 245 2HB ASP 31 HB1 ASP 31 11.806 41.035 16.328 246 H HIS 32 HN HIS 32 14.161 39.439 14.229 247 HA HIS 32 HA HIS 32 11.936 37.911 13.321 248 1HB HIS 32 HB2 HIS 32 13.501 39.047 11.791 249 2HB HIS 32 HB1 HIS 32 14.782 37.934 12.272 250 HD1 HIS 32 HD1 HIS 32 11.149 37.386 11.193 251 HD2 HIS 32 HD2 HIS 32 14.990 36.027 10.306 252 HE1 HIS 32 HE1 HIS 32 10.884 35.594 9.421 253 H ALA 33 HN ALA 33 15.178 36.842 14.385 254 HA ALA 33 HA ALA 33 14.746 34.053 14.061 255 1HB ALA 33 HB1 ALA 33 16.502 35.612 15.968 256 2HB ALA 33 HB3 ALA 33 16.531 33.853 15.869 257 3HB ALA 33 HB2 ALA 33 16.975 34.822 14.464 258 H ILE 34 HN ILE 34 14.281 36.096 16.966 259 HA ILE 34 HA ILE 34 13.257 33.929 18.575 260 HB ILE 34 HB ILE 34 12.857 36.922 18.880 261 1HG1 ILE 34 HG12 ILE 34 15.236 36.356 18.835 262 2HG1 ILE 34 HG11 ILE 34 14.757 36.764 20.479 263 1HG2 ILE 34 HG23 ILE 34 12.542 34.625 20.830 264 2HG2 ILE 34 HG22 ILE 34 12.520 36.328 21.288 265 3HG2 ILE 34 HG21 ILE 34 11.264 35.683 20.231 266 1HD1 ILE 34 HD11 ILE 34 14.380 34.144 20.684 267 2HD1 ILE 34 HD13 ILE 34 15.496 34.096 19.322 268 3HD1 ILE 34 HD12 ILE 34 15.992 34.829 20.846 269 H GLU 35 HN GLU 35 11.669 36.520 16.687 270 HA GLU 35 HA GLU 35 8.992 35.898 17.435 271 1HB GLU 35 HB2 GLU 35 9.610 37.956 16.205 272 2HB GLU 35 HB1 GLU 35 10.003 36.987 14.786 273 1HG GLU 35 HG2 GLU 35 7.662 36.184 14.682 274 2HG GLU 35 HG1 GLU 35 7.271 37.157 16.099 275 H LYS 36 HN LYS 36 11.002 34.661 14.777 276 HA LYS 36 HA LYS 36 9.000 33.043 13.562 277 1HB LYS 36 HB2 LYS 36 11.169 33.641 12.507 278 2HB LYS 36 HB1 LYS 36 11.993 32.570 13.640 279 1HG LYS 36 HG2 LYS 36 10.718 30.653 12.787 280 2HG LYS 36 HG1 LYS 36 9.845 31.711 11.679 281 1HD LYS 36 HD2 LYS 36 11.970 32.312 10.574 282 2HD LYS 36 HD1 LYS 36 12.842 31.244 11.676 283 1HE LYS 36 HE2 LYS 36 12.433 30.076 9.568 284 2HE LYS 36 HE1 LYS 36 11.474 29.332 10.849 285 1HZ LYS 36 HZ2 LYS 36 10.121 31.504 9.562 286 2HZ LYS 36 HZ1 LYS 36 10.511 30.253 8.482 287 3HZ LYS 36 HZ3 LYS 36 9.585 29.921 9.864 288 H ALA 37 HN ALA 37 11.317 32.297 16.173 289 HA ALA 37 HA ALA 37 10.768 29.501 16.305 290 1HB ALA 37 HB1 ALA 37 12.658 30.640 17.477 291 2HB ALA 37 HB3 ALA 37 11.497 31.336 18.607 292 3HB ALA 37 HB2 ALA 37 11.727 29.589 18.543 293 H PHE 38 HN PHE 38 9.332 32.178 18.212 294 HA PHE 38 HA PHE 38 7.523 30.546 19.681 295 1HB PHE 38 HB2 PHE 38 7.513 33.457 18.881 296 2HB PHE 38 HB1 PHE 38 6.152 32.764 19.762 297 HD1 PHE 38 HD2 PHE 38 6.779 31.320 21.879 298 HD2 PHE 38 HD1 PHE 38 9.345 34.272 20.104 299 HE1 PHE 38 HE2 PHE 38 8.042 31.502 24.005 300 HE2 PHE 38 HE1 PHE 38 10.610 34.452 22.228 301 HZ PHE 38 HZ PHE 38 9.959 33.067 24.180 302 H GLN 39 HN GLN 39 7.147 32.116 16.506 303 HA GLN 39 HA GLN 39 4.385 31.500 16.169 304 1HB GLN 39 HB2 GLN 39 6.614 31.870 14.155 305 2HB GLN 39 HB1 GLN 39 4.921 31.677 13.697 306 1HG GLN 39 HG2 GLN 39 4.290 33.665 14.909 307 2HG GLN 39 HG1 GLN 39 5.896 33.799 15.627 308 1HE2 GLN 39 HE22 GLN 39 5.567 36.038 12.568 309 2HE2 GLN 39 HE21 GLN 39 4.578 35.835 13.933 310 H LEU 40 HN LEU 40 7.303 29.612 15.387 311 HA LEU 40 HA LEU 40 6.001 27.482 14.030 312 1HB LEU 40 HB2 LEU 40 8.504 27.519 15.726 313 2HB LEU 40 HB1 LEU 40 7.985 26.111 14.808 314 HG LEU 40 HG LEU 40 8.451 28.845 13.582 315 1HD1 LEU 40 HD11 LEU 40 10.275 26.424 13.714 316 2HD1 LEU 40 HD13 LEU 40 10.576 27.860 12.733 317 3HD1 LEU 40 HD12 LEU 40 10.549 27.982 14.493 318 1HD2 LEU 40 HD22 LEU 40 7.691 26.131 12.519 319 2HD2 LEU 40 HD21 LEU 40 7.129 27.726 12.025 320 3HD2 LEU 40 HD23 LEU 40 8.717 27.160 11.524 321 H TRP 41 HN TRP 41 6.684 27.899 17.512 322 HA TRP 41 HA TRP 41 5.565 25.341 18.248 323 1HB TRP 41 HB2 TRP 41 6.046 27.880 19.835 324 2HB TRP 41 HB1 TRP 41 5.497 26.367 20.556 325 HD1 TRP 41 HD1 TRP 41 8.559 28.186 19.702 326 HE1 TRP 41 HE1 TRP 41 10.618 26.641 19.824 327 HE3 TRP 41 HE3 TRP 41 6.238 23.642 19.914 328 HZ2 TRP 41 HZ2 TRP 41 11.205 23.847 19.984 329 HZ3 TRP 41 HZ3 TRP 41 7.570 21.557 20.047 330 HH2 TRP 41 HH2 TRP 41 10.048 21.652 20.082 331 H SER 42 HN SER 42 4.251 28.637 18.098 332 HA SER 42 HA SER 42 1.666 27.942 19.178 333 1HB SER 42 HB2 SER 42 2.540 30.263 19.138 334 2HB SER 42 HB1 SER 42 2.440 30.259 17.379 335 HG SER 42 HG SER 42 0.228 30.048 17.536 336 H ASN 43 HN ASN 43 3.088 27.842 15.989 337 HA ASN 43 HA ASN 43 0.730 27.757 14.415 338 1HB ASN 43 HB2 ASN 43 3.450 26.502 13.993 339 2HB ASN 43 HB1 ASN 43 2.173 26.463 12.778 340 1HD2 ASN 43 HD22 ASN 43 4.375 29.520 12.316 341 2HD2 ASN 43 HD21 ASN 43 4.741 27.872 12.486 342 H VAL 44 HN VAL 44 2.439 25.129 16.118 343 HA VAL 44 HA VAL 44 0.333 23.221 15.195 344 HB VAL 44 HB VAL 44 1.843 21.466 15.904 345 1HG1 VAL 44 HG11 VAL 44 2.194 22.606 13.697 346 2HG1 VAL 44 HG13 VAL 44 3.420 23.617 14.465 347 3HG1 VAL 44 HG12 VAL 44 3.660 21.872 14.353 348 1HG2 VAL 44 HG21 VAL 44 3.272 23.761 17.234 349 2HG2 VAL 44 HG23 VAL 44 2.929 22.146 17.854 350 3HG2 VAL 44 HG22 VAL 44 4.221 22.381 16.683 351 H THR 45 HN THR 45 0.432 25.328 17.623 352 HA THR 45 HA THR 45 -1.020 23.481 19.437 353 HB THR 45 HB THR 45 0.122 24.352 21.427 354 HG1 THR 45 HG1 THR 45 0.812 26.320 20.928 355 1HG2 THR 45 HG22 THR 45 1.080 22.412 19.927 356 2HG2 THR 45 HG21 THR 45 2.355 23.581 19.577 357 3HG2 THR 45 HG23 THR 45 2.060 23.068 21.236 358 HA PRO 46 HA PRO 46 -3.702 27.046 19.541 359 1HB PRO 46 HB2 PRO 46 -4.942 26.588 22.036 360 2HB PRO 46 HB1 PRO 46 -5.467 25.913 20.486 361 1HG PRO 46 HG2 PRO 46 -4.084 24.556 22.723 362 2HG PRO 46 HG1 PRO 46 -4.997 23.847 21.381 363 1HD PRO 46 HD2 PRO 46 -2.161 23.888 21.641 364 2HD PRO 46 HD1 PRO 46 -3.088 23.445 20.191 365 H LEU 47 HN LEU 47 -1.005 26.693 21.351 366 HA LEU 47 HA LEU 47 -1.409 28.708 23.410 367 1HB LEU 47 HB2 LEU 47 1.165 27.620 22.223 368 2HB LEU 47 HB1 LEU 47 1.043 28.582 23.694 369 HG LEU 47 HG LEU 47 -0.290 25.886 23.282 370 1HD1 LEU 47 HD13 LEU 47 2.255 26.692 24.719 371 2HD1 LEU 47 HD12 LEU 47 1.461 25.133 24.944 372 3HD1 LEU 47 HD11 LEU 47 2.105 25.575 23.363 373 1HD2 LEU 47 HD21 LEU 47 -0.167 27.866 25.562 374 2HD2 LEU 47 HD23 LEU 47 -1.556 26.973 24.941 375 3HD2 LEU 47 HD22 LEU 47 -0.337 26.144 25.905 376 H THR 48 HN THR 48 -0.541 30.856 23.391 377 HA THR 48 HA THR 48 0.222 31.940 20.696 378 HB THR 48 HB THR 48 -1.192 33.874 21.059 379 HG1 THR 48 HG1 THR 48 -1.417 34.315 23.103 380 1HG2 THR 48 HG22 THR 48 -2.634 31.270 21.609 381 2HG2 THR 48 HG21 THR 48 -3.438 32.771 21.152 382 3HG2 THR 48 HG23 THR 48 -2.322 31.993 20.032 383 H PHE 49 HN PHE 49 1.752 33.599 20.757 384 HA PHE 49 HA PHE 49 2.803 34.383 23.457 385 1HB PHE 49 HB2 PHE 49 4.382 33.722 20.956 386 2HB PHE 49 HB1 PHE 49 5.069 34.402 22.433 387 HD1 PHE 49 HD2 PHE 49 5.220 33.084 24.486 388 HD2 PHE 49 HD1 PHE 49 3.561 31.424 20.889 389 HE1 PHE 49 HE2 PHE 49 5.375 30.809 25.464 390 HE2 PHE 49 HE1 PHE 49 3.714 29.149 21.869 391 HZ PHE 49 HZ PHE 49 4.621 28.843 24.156 392 H THR 50 HN THR 50 2.818 36.543 23.728 393 HA THR 50 HA THR 50 2.802 38.308 21.291 394 HB THR 50 HB THR 50 1.344 38.750 23.916 395 HG1 THR 50 HG1 THR 50 -0.241 38.705 21.811 396 1HG2 THR 50 HG23 THR 50 1.649 40.375 21.387 397 2HG2 THR 50 HG22 THR 50 0.292 40.611 22.489 398 3HG2 THR 50 HG21 THR 50 1.942 40.880 23.052 399 H LYS 51 HN LYS 51 4.347 39.864 21.264 400 HA LYS 51 HA LYS 51 6.314 39.987 23.408 401 1HB LYS 51 HB2 LYS 51 6.864 40.332 20.979 402 2HB LYS 51 HB1 LYS 51 5.995 41.862 21.045 403 1HG LYS 51 HG2 LYS 51 7.509 42.607 22.885 404 2HG LYS 51 HG1 LYS 51 8.422 41.111 22.711 405 1HD LYS 51 HD2 LYS 51 7.971 42.912 20.332 406 2HD LYS 51 HD1 LYS 51 9.270 43.249 21.473 407 1HE LYS 51 HE2 LYS 51 10.162 40.961 21.111 408 2HE LYS 51 HE1 LYS 51 8.889 40.663 19.928 409 1HZ LYS 51 HZ3 LYS 51 9.736 42.686 18.743 410 2HZ LYS 51 HZ2 LYS 51 11.087 42.641 19.772 411 3HZ LYS 51 HZ1 LYS 51 10.771 41.343 18.721 412 H VAL 52 HN VAL 52 6.573 41.610 24.936 413 HA VAL 52 HA VAL 52 4.486 43.776 25.016 414 HB VAL 52 HB VAL 52 4.564 43.604 27.485 415 1HG1 VAL 52 HG11 VAL 52 3.903 41.092 25.930 416 2HG1 VAL 52 HG13 VAL 52 3.517 41.280 27.640 417 3HG1 VAL 52 HG12 VAL 52 2.798 42.364 26.450 418 1HG2 VAL 52 HG22 VAL 52 6.499 41.368 26.837 419 2HG2 VAL 52 HG21 VAL 52 6.748 42.748 27.907 420 3HG2 VAL 52 HG23 VAL 52 5.652 41.451 28.381 421 H SER 53 HN SER 53 5.342 45.808 25.188 422 HA SER 53 HA SER 53 8.286 46.058 25.327 423 1HB SER 53 HB2 SER 53 6.712 47.288 23.671 424 2HB SER 53 HB1 SER 53 6.333 48.342 25.032 425 HG SER 53 HG SER 53 8.562 48.780 25.208 426 H GLU 54 HN GLU 54 5.784 46.045 27.557 427 HA GLU 54 HA GLU 54 7.507 47.354 29.571 428 1HB GLU 54 HB2 GLU 54 6.045 49.144 28.471 429 2HB GLU 54 HB1 GLU 54 4.667 48.310 29.186 430 1HG GLU 54 HG2 GLU 54 5.632 48.591 31.426 431 2HG GLU 54 HG1 GLU 54 7.028 49.412 30.727 432 H GLY 55 HN GLY 55 6.714 46.930 31.771 433 1HA GLY 55 HA2 GLY 55 5.441 45.738 33.391 434 2HA GLY 55 HA1 GLY 55 4.465 45.060 32.089 435 H GLN 56 HN GLN 56 5.272 43.331 34.035 436 HA GLN 56 HA GLN 56 7.780 42.012 33.241 437 1HB GLN 56 HB2 GLN 56 5.628 41.319 35.261 438 2HB GLN 56 HB1 GLN 56 7.044 40.305 34.971 439 1HG GLN 56 HG2 GLN 56 8.535 42.107 35.617 440 2HG GLN 56 HG1 GLN 56 7.183 43.232 35.750 441 1HE2 GLN 56 HE22 GLN 56 7.213 42.393 39.202 442 2HE2 GLN 56 HE21 GLN 56 7.548 43.593 38.051 443 H ALA 57 HN ALA 57 7.918 40.129 32.026 444 HA ALA 57 HA ALA 57 5.376 39.188 30.739 445 1HB ALA 57 HB2 ALA 57 7.405 40.181 29.398 446 2HB ALA 57 HB1 ALA 57 8.129 38.596 29.666 447 3HB ALA 57 HB3 ALA 57 6.598 38.734 28.797 448 H ASP 58 HN ASP 58 5.150 36.880 30.406 449 HA ASP 58 HA ASP 58 5.781 35.286 32.673 450 1HB ASP 58 HB2 ASP 58 4.978 34.525 29.854 451 2HB ASP 58 HB1 ASP 58 5.112 33.361 31.172 452 H ILE 59 HN ILE 59 7.376 35.566 29.507 453 HA ILE 59 HA ILE 59 9.642 33.894 30.564 454 HB ILE 59 HB ILE 59 8.742 34.343 27.701 455 1HG1 ILE 59 HG12 ILE 59 8.649 31.824 29.385 456 2HG1 ILE 59 HG11 ILE 59 7.269 32.900 29.175 457 1HG2 ILE 59 HG22 ILE 59 10.974 32.702 28.929 458 2HG2 ILE 59 HG21 ILE 59 10.401 32.476 27.277 459 3HG2 ILE 59 HG23 ILE 59 11.129 34.009 27.756 460 1HD1 ILE 59 HD11 ILE 59 8.762 31.687 26.841 461 2HD1 ILE 59 HD13 ILE 59 7.359 30.917 27.583 462 3HD1 ILE 59 HD12 ILE 59 7.195 32.497 26.817 463 H MET 60 HN MET 60 11.356 35.127 31.053 464 HA MET 60 HA MET 60 11.738 37.749 29.679 465 1HB MET 60 HB2 MET 60 13.017 36.614 32.187 466 2HB MET 60 HB1 MET 60 13.262 38.243 31.556 467 1HG MET 60 HG2 MET 60 10.562 37.112 32.338 468 2HG MET 60 HG1 MET 60 11.542 38.137 33.385 469 1HE MET 60 HE3 MET 60 12.454 40.198 32.867 470 2HE MET 60 HE2 MET 60 12.719 40.507 31.156 471 3HE MET 60 HE1 MET 60 11.585 41.508 32.060 472 H ILE 61 HN ILE 61 13.367 37.961 28.220 473 HA ILE 61 HA ILE 61 15.483 35.827 28.104 474 HB ILE 61 HB ILE 61 14.267 37.474 25.868 475 1HG1 ILE 61 HG12 ILE 61 14.235 34.475 26.316 476 2HG1 ILE 61 HG11 ILE 61 12.919 35.542 26.813 477 1HG2 ILE 61 HG23 ILE 61 16.637 35.613 26.005 478 2HG2 ILE 61 HG22 ILE 61 15.729 35.781 24.504 479 3HG2 ILE 61 HG21 ILE 61 16.509 37.187 25.224 480 1HD1 ILE 61 HD11 ILE 61 13.981 35.397 23.980 481 2HD1 ILE 61 HD13 ILE 61 12.582 34.486 24.546 482 3HD1 ILE 61 HD12 ILE 61 12.540 36.249 24.533 483 H SER 62 HN SER 62 17.543 36.538 28.357 484 HA SER 62 HA SER 62 18.238 39.326 27.636 485 1HB SER 62 HB2 SER 62 19.115 39.880 29.814 486 2HB SER 62 HB1 SER 62 17.449 39.347 30.035 487 HG SER 62 HG SER 62 18.605 37.168 30.277 488 H PHE 63 HN PHE 63 20.644 39.665 27.958 489 HA PHE 63 HA PHE 63 22.147 37.127 27.387 490 1HB PHE 63 HB2 PHE 63 22.504 39.949 26.336 491 2HB PHE 63 HB1 PHE 63 23.692 38.669 26.106 492 HD1 PHE 63 HD1 PHE 63 20.241 39.763 25.316 493 HD2 PHE 63 HD2 PHE 63 23.302 36.839 24.591 494 HE1 PHE 63 HE1 PHE 63 18.950 38.886 23.381 495 HE2 PHE 63 HE2 PHE 63 22.016 35.969 22.659 496 HZ PHE 63 HZ PHE 63 19.841 36.991 22.055 497 H VAL 64 HN VAL 64 23.992 36.766 28.612 498 HA VAL 64 HA VAL 64 24.944 38.966 30.407 499 HB VAL 64 HB VAL 64 24.958 37.466 32.320 500 1HG1 VAL 64 HG11 VAL 64 22.841 38.720 31.622 501 2HG1 VAL 64 HG13 VAL 64 22.259 37.183 30.983 502 3HG1 VAL 64 HG12 VAL 64 22.601 37.350 32.706 503 1HG2 VAL 64 HG21 VAL 64 24.001 35.446 30.282 504 2HG2 VAL 64 HG23 VAL 64 25.399 35.330 31.352 505 3HG2 VAL 64 HG22 VAL 64 23.769 35.206 32.014 506 H ARG 65 HN ARG 65 27.097 38.413 31.395 507 HA ARG 65 HA ARG 65 28.704 36.548 29.674 508 1HB ARG 65 HB2 ARG 65 29.349 39.388 30.512 509 2HB ARG 65 HB1 ARG 65 30.548 38.273 29.855 510 1HG ARG 65 HG2 ARG 65 29.228 38.009 27.821 511 2HG ARG 65 HG1 ARG 65 27.977 39.068 28.466 512 1HD ARG 65 HD2 ARG 65 30.850 39.869 27.921 513 2HD ARG 65 HD1 ARG 65 29.464 40.283 26.915 514 HE ARG 65 HE ARG 65 28.793 41.211 29.458 515 1HH1 ARG 65 HH21 ARG 65 31.389 41.583 27.225 516 2HH1 ARG 65 HH22 ARG 65 31.763 43.200 27.720 517 1HH2 ARG 65 HH11 ARG 65 29.261 43.322 30.119 518 2HH2 ARG 65 HH12 ARG 65 30.558 44.184 29.364 519 H GLY 66 HN GLY 66 30.471 35.563 30.713 520 1HA GLY 66 HA2 GLY 66 31.379 34.418 32.565 521 2HA GLY 66 HA1 GLY 66 31.705 36.060 33.114 522 H ASP 67 HN ASP 67 31.351 35.530 35.316 523 HA ASP 67 HA ASP 67 28.962 34.220 36.252 524 1HB ASP 67 HB2 ASP 67 31.129 34.438 37.540 525 2HB ASP 67 HB1 ASP 67 30.726 36.135 37.803 526 H HIS 68 HN HIS 68 26.973 35.042 36.553 527 HA HIS 68 HA HIS 68 26.630 38.019 36.639 528 1HB HIS 68 HB2 HIS 68 24.497 37.606 35.313 529 2HB HIS 68 HB1 HIS 68 26.003 37.405 34.420 530 HD1 HIS 68 HD1 HIS 68 26.930 34.726 34.653 531 HD2 HIS 68 HD2 HIS 68 22.834 35.458 34.894 532 HE1 HIS 68 HE1 HIS 68 25.779 32.532 34.128 533 H ARG 69 HN ARG 69 26.728 36.946 39.000 534 HA ARG 69 HA ARG 69 25.559 36.543 40.985 535 1HB ARG 69 HB2 ARG 69 23.388 37.882 39.350 536 2HB ARG 69 HB1 ARG 69 23.246 37.528 41.069 537 1HG ARG 69 HG2 ARG 69 25.248 38.886 41.522 538 2HG ARG 69 HG1 ARG 69 25.401 39.243 39.801 539 1HD ARG 69 HD2 ARG 69 23.149 40.290 39.840 540 2HD ARG 69 HD1 ARG 69 23.057 39.988 41.577 541 HE ARG 69 HE ARG 69 25.408 41.400 41.312 542 1HH1 ARG 69 HH21 ARG 69 22.149 41.805 40.268 543 2HH1 ARG 69 HH22 ARG 69 22.207 43.535 40.320 544 1HH2 ARG 69 HH11 ARG 69 25.502 43.657 41.394 545 2HH2 ARG 69 HH12 ARG 69 24.105 44.584 40.963 546 H ASP 70 HN ASP 70 25.779 34.262 39.480 547 HA ASP 70 HA ASP 70 23.219 32.878 40.129 548 1HB ASP 70 HB2 ASP 70 24.661 32.786 37.472 549 2HB ASP 70 HB1 ASP 70 23.528 31.533 37.979 550 H ASN 71 HN ASN 71 23.548 30.493 40.286 551 HA ASN 71 HA ASN 71 26.181 29.928 41.510 552 1HB ASN 71 HB2 ASN 71 23.593 28.364 41.366 553 2HB ASN 71 HB1 ASN 71 25.061 27.741 42.119 554 1HD2 ASN 71 HD22 ASN 71 22.945 29.492 44.706 555 2HD2 ASN 71 HD21 ASN 71 22.630 28.241 43.601 556 H SER 72 HN SER 72 25.243 29.962 38.438 557 HA SER 72 HA SER 72 26.919 27.583 37.722 558 1HB SER 72 HB2 SER 72 24.346 28.412 36.351 559 2HB SER 72 HB1 SER 72 25.403 27.095 35.854 560 HG SER 72 HG SER 72 25.015 26.518 38.271 561 HA PRO 73 HA PRO 73 28.204 31.590 35.659 562 1HB PRO 73 HB2 PRO 73 30.952 30.987 36.287 563 2HB PRO 73 HB1 PRO 73 29.950 32.267 36.979 564 1HG PRO 73 HG2 PRO 73 30.835 29.832 38.270 565 2HG PRO 73 HG1 PRO 73 29.860 31.136 38.963 566 1HD PRO 73 HD2 PRO 73 28.980 28.490 38.162 567 2HD PRO 73 HD1 PRO 73 28.016 29.785 38.896 568 H PHE 74 HN PHE 74 29.249 31.686 33.585 569 HA PHE 74 HA PHE 74 29.435 29.119 32.208 570 1HB PHE 74 HB2 PHE 74 29.961 31.969 31.318 571 2HB PHE 74 HB1 PHE 74 30.111 30.575 30.247 572 HD1 PHE 74 HD1 PHE 74 28.138 29.279 29.568 573 HD2 PHE 74 HD2 PHE 74 27.783 32.697 32.144 574 HE1 PHE 74 HE1 PHE 74 25.691 29.321 29.173 575 HE2 PHE 74 HE2 PHE 74 25.333 32.738 31.750 576 HZ PHE 74 HZ PHE 74 24.289 31.049 30.265 577 H ASP 75 HN ASP 75 31.299 28.016 31.694 578 HA ASP 75 HA ASP 75 33.849 29.062 32.819 579 1HB ASP 75 HB2 ASP 75 33.017 26.745 33.409 580 2HB ASP 75 HB1 ASP 75 33.272 26.295 31.722 581 H GLY 76 HN GLY 76 33.711 30.591 30.832 582 1HA GLY 76 HA2 GLY 76 34.724 31.211 28.799 583 2HA GLY 76 HA1 GLY 76 35.630 29.701 28.888 584 HA PRO 77 HA PRO 77 32.510 29.566 25.385 585 1HB PRO 77 HB2 PRO 77 34.658 28.302 23.844 586 2HB PRO 77 HB1 PRO 77 33.785 29.802 23.498 587 1HG PRO 77 HG2 PRO 77 36.481 29.592 24.401 588 2HG PRO 77 HG1 PRO 77 35.524 31.077 24.280 589 1HD PRO 77 HD2 PRO 77 36.325 29.628 26.692 590 2HD PRO 77 HD1 PRO 77 35.542 31.217 26.571 591 H GLY 78 HN GLY 78 33.990 27.548 27.528 592 1HA GLY 78 HA2 GLY 78 33.157 25.011 26.217 593 2HA GLY 78 HA1 GLY 78 34.104 25.143 27.701 594 H GLY 79 HN GLY 79 31.971 23.450 27.788 595 1HA GLY 79 HA2 GLY 79 30.228 23.028 29.338 596 2HA GLY 79 HA1 GLY 79 30.289 24.724 29.820 597 H ASN 80 HN ASN 80 27.880 24.548 29.698 598 HA ASN 80 HA ASN 80 26.583 24.108 27.151 599 1HB ASN 80 HB2 ASN 80 25.659 25.446 29.711 600 2HB ASN 80 HB1 ASN 80 24.612 25.190 28.315 601 1HD2 ASN 80 HD22 ASN 80 24.346 22.250 30.678 602 2HD2 ASN 80 HD21 ASN 80 24.162 23.924 30.893 603 H LEU 81 HN LEU 81 25.620 25.750 25.774 604 HA LEU 81 HA LEU 81 27.199 28.261 25.728 605 1HB LEU 81 HB2 LEU 81 25.069 27.365 23.765 606 2HB LEU 81 HB1 LEU 81 26.310 28.588 23.512 607 HG LEU 81 HG LEU 81 26.691 25.595 23.763 608 1HD1 LEU 81 HD13 LEU 81 26.042 26.597 21.547 609 2HD1 LEU 81 HD12 LEU 81 27.519 27.559 21.607 610 3HD1 LEU 81 HD11 LEU 81 27.615 25.800 21.531 611 1HD2 LEU 81 HD23 LEU 81 28.688 27.859 23.940 612 2HD2 LEU 81 HD22 LEU 81 28.518 26.466 25.007 613 3HD2 LEU 81 HD21 LEU 81 29.167 26.256 23.381 614 H ALA 82 HN ALA 82 24.342 27.190 27.079 615 HA ALA 82 HA ALA 82 23.519 29.798 27.925 616 1HB ALA 82 HB3 ALA 82 21.911 28.540 25.679 617 2HB ALA 82 HB2 ALA 82 21.319 29.854 26.695 618 3HB ALA 82 HB1 ALA 82 22.715 30.109 25.648 619 H HIS 83 HN HIS 83 21.134 29.555 28.903 620 HA HIS 83 HA HIS 83 20.318 26.833 29.509 621 1HB HIS 83 HB2 HIS 83 20.863 26.842 31.901 622 2HB HIS 83 HB1 HIS 83 22.334 26.994 30.943 623 HD1 HIS 83 HD1 HIS 83 22.426 28.027 33.798 624 HD2 HIS 83 HD2 HIS 83 21.299 30.419 30.581 625 HE1 HIS 83 HE1 HIS 83 22.792 30.422 34.526 626 H ALA 84 HN ALA 84 18.557 26.871 31.239 627 HA ALA 84 HA ALA 84 17.284 29.517 31.614 628 1HB ALA 84 HB3 ALA 84 16.059 27.237 30.044 629 2HB ALA 84 HB2 ALA 84 15.095 28.538 30.747 630 3HB ALA 84 HB1 ALA 84 16.305 28.902 29.517 631 H PHE 85 HN PHE 85 15.399 29.339 33.095 632 HA PHE 85 HA PHE 85 15.905 27.234 35.143 633 1HB PHE 85 HB2 PHE 85 14.359 29.844 35.247 634 2HB PHE 85 HB1 PHE 85 14.576 28.743 36.609 635 HD1 PHE 85 HD2 PHE 85 16.287 31.088 34.310 636 HD2 PHE 85 HD1 PHE 85 16.717 28.510 37.722 637 HE1 PHE 85 HE2 PHE 85 18.497 32.097 34.796 638 HE2 PHE 85 HE1 PHE 85 18.930 29.521 38.207 639 HZ PHE 85 HZ PHE 85 19.819 31.314 36.743 640 H GLN 86 HN GLN 86 13.985 26.210 36.172 641 HA GLN 86 HA GLN 86 12.164 25.184 34.228 642 1HB GLN 86 HB2 GLN 86 12.228 25.089 37.249 643 2HB GLN 86 HB1 GLN 86 10.933 24.319 36.339 644 1HG GLN 86 HG2 GLN 86 12.733 23.088 35.023 645 2HG GLN 86 HG1 GLN 86 13.896 23.709 36.195 646 1HE2 GLN 86 HE22 GLN 86 11.632 21.854 38.732 647 2HE2 GLN 86 HE21 GLN 86 11.640 23.502 38.325 648 HA PRO 87 HA PRO 87 9.060 28.332 34.071 649 1HB PRO 87 HB2 PRO 87 6.756 26.611 34.156 650 2HB PRO 87 HB1 PRO 87 7.532 27.291 32.720 651 1HG PRO 87 HG2 PRO 87 7.652 24.536 33.729 652 2HG PRO 87 HG1 PRO 87 8.188 25.162 32.162 653 1HD PRO 87 HD2 PRO 87 9.875 24.345 34.294 654 2HD PRO 87 HD1 PRO 87 10.371 25.254 32.852 655 H GLY 88 HN GLY 88 9.057 29.428 36.041 656 1HA GLY 88 HA2 GLY 88 6.992 28.742 37.958 657 2HA GLY 88 HA1 GLY 88 8.608 28.476 38.609 658 HA PRO 89 HA PRO 89 7.238 33.010 38.952 659 1HB PRO 89 HB2 PRO 89 7.436 32.948 41.809 660 2HB PRO 89 HB1 PRO 89 5.952 33.040 40.850 661 1HG PRO 89 HG2 PRO 89 7.010 30.752 42.345 662 2HG PRO 89 HG1 PRO 89 5.421 30.936 41.590 663 1HD PRO 89 HD2 PRO 89 7.592 29.316 40.645 664 2HD PRO 89 HD1 PRO 89 6.056 29.641 39.814 665 H GLY 90 HN GLY 90 8.602 34.643 40.475 666 1HA GLY 90 HA2 GLY 90 10.722 35.531 40.936 667 2HA GLY 90 HA1 GLY 90 11.187 33.892 41.390 668 H ILE 91 HN ILE 91 12.988 33.338 40.296 669 HA ILE 91 HA ILE 91 13.610 34.508 37.692 670 HB ILE 91 HB ILE 91 15.355 34.013 39.412 671 1HG1 ILE 91 HG12 ILE 91 15.816 32.324 36.944 672 2HG1 ILE 91 HG11 ILE 91 15.759 34.084 36.865 673 1HG2 ILE 91 HG23 ILE 91 14.235 31.838 40.114 674 2HG2 ILE 91 HG22 ILE 91 14.912 31.114 38.656 675 3HG2 ILE 91 HG21 ILE 91 15.984 31.749 39.903 676 1HD1 ILE 91 HD12 ILE 91 17.552 34.163 38.620 677 2HD1 ILE 91 HD11 ILE 91 17.672 32.406 38.512 678 3HD1 ILE 91 HD13 ILE 91 18.074 33.405 37.116 679 H GLY 92 HN GLY 92 11.768 31.852 38.696 680 1HA GLY 92 HA2 GLY 92 12.404 29.851 36.803 681 2HA GLY 92 HA1 GLY 92 10.797 30.092 37.485 682 H GLY 93 HN GLY 93 11.941 29.576 34.651 683 1HA GLY 93 HA2 GLY 93 10.811 29.964 32.580 684 2HA GLY 93 HA1 GLY 93 10.032 31.377 33.289 685 H ASP 94 HN ASP 94 12.820 32.228 34.298 686 HA ASP 94 HA ASP 94 13.407 34.009 32.135 687 1HB ASP 94 HB2 ASP 94 15.039 33.173 34.547 688 2HB ASP 94 HB1 ASP 94 15.546 34.433 33.421 689 H ALA 95 HN ALA 95 15.218 33.998 30.674 690 HA ALA 95 HA ALA 95 16.700 31.417 30.399 691 1HB ALA 95 HB3 ALA 95 14.597 31.596 28.880 692 2HB ALA 95 HB2 ALA 95 15.531 32.790 27.979 693 3HB ALA 95 HB1 ALA 95 16.126 31.137 28.129 694 H HIS 96 HN HIS 96 18.828 31.907 30.308 695 HA HIS 96 HA HIS 96 19.643 34.629 29.348 696 1HB HIS 96 HB2 HIS 96 21.153 32.662 31.087 697 2HB HIS 96 HB1 HIS 96 21.663 34.294 30.681 698 HD2 HIS 96 HD2 HIS 96 18.021 34.934 31.459 699 HE1 HIS 96 HE1 HIS 96 20.051 34.703 35.189 700 HE2 HIS 96 HE2 HIS 96 17.919 35.426 34.026 701 H PHE 97 HN PHE 97 21.345 34.820 27.872 702 HA PHE 97 HA PHE 97 22.178 32.299 26.460 703 1HB PHE 97 HB2 PHE 97 21.590 35.071 25.403 704 2HB PHE 97 HB1 PHE 97 22.435 33.850 24.455 705 HD1 PHE 97 HD1 PHE 97 19.317 34.341 26.473 706 HD2 PHE 97 HD2 PHE 97 21.183 32.329 23.169 707 HE1 PHE 97 HE1 PHE 97 17.135 33.342 25.843 708 HE2 PHE 97 HE2 PHE 97 19.001 31.338 22.537 709 HZ PHE 97 HZ PHE 97 16.976 31.845 23.874 710 H ASP 98 HN ASP 98 24.369 31.995 26.292 711 HA ASP 98 HA ASP 98 26.174 33.720 27.741 712 1HB ASP 98 HB2 ASP 98 26.475 31.238 27.412 713 2HB ASP 98 HB1 ASP 98 26.899 31.573 25.733 714 H GLU 99 HN GLU 99 26.575 35.740 26.933 715 HA GLU 99 HA GLU 99 26.650 36.264 24.057 716 1HB GLU 99 HB2 GLU 99 25.844 37.880 25.850 717 2HB GLU 99 HB1 GLU 99 27.530 38.109 26.281 718 1HG GLU 99 HG2 GLU 99 28.057 38.982 24.099 719 2HG GLU 99 HG1 GLU 99 26.469 38.527 23.479 720 H ASP 100 HN ASP 100 28.877 34.829 26.064 721 HA ASP 100 HA ASP 100 31.277 36.237 25.228 722 1HB ASP 100 HB2 ASP 100 30.849 33.493 26.437 723 2HB ASP 100 HB1 ASP 100 32.442 34.162 26.095 724 H GLU 101 HN GLU 101 29.363 33.609 23.926 725 HA GLU 101 HA GLU 101 31.422 32.891 21.937 726 1HB GLU 101 HB2 GLU 101 28.545 31.994 22.317 727 2HB GLU 101 HB1 GLU 101 29.614 31.377 21.059 728 1HG GLU 101 HG2 GLU 101 29.777 29.813 22.855 729 2HG GLU 101 HG1 GLU 101 31.251 30.780 22.930 730 H ARG 102 HN ARG 102 30.917 33.103 19.584 731 HA ARG 102 HA ARG 102 29.617 35.719 19.070 732 1HB ARG 102 HB2 ARG 102 31.849 35.137 18.074 733 2HB ARG 102 HB1 ARG 102 31.048 33.881 17.129 734 1HG ARG 102 HG2 ARG 102 29.591 35.572 16.089 735 2HG ARG 102 HG1 ARG 102 30.368 36.836 17.046 736 1HD ARG 102 HD2 ARG 102 31.873 35.017 15.148 737 2HD ARG 102 HD1 ARG 102 31.272 36.615 14.697 738 HE ARG 102 HE ARG 102 32.731 37.100 16.994 739 1HH1 ARG 102 HH21 ARG 102 33.276 35.526 13.976 740 2HH1 ARG 102 HH22 ARG 102 34.972 35.883 13.946 741 1HH2 ARG 102 HH11 ARG 102 34.934 37.577 16.973 742 2HH2 ARG 102 HH12 ARG 102 35.911 37.044 15.646 743 H TRP 103 HN TRP 103 27.512 35.765 18.533 744 HA TRP 103 HA TRP 103 26.156 33.297 17.661 745 1HB TRP 103 HB2 TRP 103 25.140 36.078 18.301 746 2HB TRP 103 HB1 TRP 103 24.103 34.730 17.831 747 HD1 TRP 103 HD1 TRP 103 25.452 36.332 20.802 748 HE1 TRP 103 HE1 TRP 103 25.323 34.776 22.854 749 HE3 TRP 103 HE3 TRP 103 24.483 31.888 18.481 750 HZ2 TRP 103 HZ2 TRP 103 24.873 32.012 23.433 751 HZ3 TRP 103 HZ3 TRP 103 24.216 29.814 19.802 752 HH2 TRP 103 HH2 TRP 103 24.408 29.868 22.274 753 H THR 104 HN THR 104 25.324 32.961 15.630 754 HA THR 104 HA THR 104 25.534 35.153 13.615 755 HB THR 104 HB THR 104 26.514 33.501 12.017 756 HG1 THR 104 HG1 THR 104 27.241 31.938 14.215 757 1HG2 THR 104 HG23 THR 104 27.856 35.134 13.537 758 2HG2 THR 104 HG22 THR 104 28.294 33.685 14.440 759 3HG2 THR 104 HG21 THR 104 28.732 33.830 12.740 760 H ASN 105 HN ASN 105 24.448 34.399 11.512 761 HA ASN 105 HA ASN 105 22.035 32.725 12.149 762 1HB ASN 105 HB2 ASN 105 22.231 35.194 10.400 763 2HB ASN 105 HB1 ASN 105 20.779 34.219 10.634 764 1HD2 ASN 105 HD22 ASN 105 20.858 35.189 14.272 765 2HD2 ASN 105 HD21 ASN 105 21.048 33.715 13.452 766 H ASN 106 HN ASN 106 24.703 32.056 10.716 767 HA ASN 106 HA ASN 106 23.374 30.756 8.404 768 1HB ASN 106 HB2 ASN 106 24.889 31.583 6.746 769 2HB ASN 106 HB1 ASN 106 24.263 32.985 7.609 770 1HD2 ASN 106 HD22 ASN 106 27.402 33.657 9.243 771 2HD2 ASN 106 HD21 ASN 106 25.729 33.762 9.487 772 H PHE 107 HN PHE 107 25.640 29.789 7.123 773 HA PHE 107 HA PHE 107 26.246 27.458 8.573 774 1HB PHE 107 HB2 PHE 107 27.754 28.839 6.344 775 2HB PHE 107 HB1 PHE 107 28.181 27.238 6.949 776 HD1 PHE 107 HD1 PHE 107 26.702 25.318 6.601 777 HD2 PHE 107 HD2 PHE 107 25.678 29.216 5.116 778 HE1 PHE 107 HE1 PHE 107 24.949 24.311 5.164 779 HE2 PHE 107 HE2 PHE 107 23.925 28.209 3.681 780 HZ PHE 107 HZ PHE 107 23.559 25.757 3.703 781 H ARG 108 HN ARG 108 27.222 30.444 9.565 782 HA ARG 108 HA ARG 108 29.989 30.132 10.124 783 1HB ARG 108 HB2 ARG 108 27.795 31.670 11.474 784 2HB ARG 108 HB1 ARG 108 29.439 31.726 12.082 785 1HG ARG 108 HG2 ARG 108 28.802 32.288 9.192 786 2HG ARG 108 HG1 ARG 108 28.706 33.556 10.404 787 1HD ARG 108 HD2 ARG 108 31.119 32.865 11.037 788 2HD ARG 108 HD1 ARG 108 31.148 32.015 9.497 789 HE ARG 108 HE ARG 108 31.481 34.835 9.891 790 1HH1 ARG 108 HH21 ARG 108 29.832 32.601 7.836 791 2HH1 ARG 108 HH22 ARG 108 29.508 33.780 6.612 792 1HH2 ARG 108 HH11 ARG 108 31.072 36.366 8.298 793 2HH2 ARG 108 HH12 ARG 108 30.215 35.900 6.866 794 H GLU 109 HN GLU 109 30.266 30.380 12.878 795 HA GLU 109 HA GLU 109 30.621 27.762 13.748 796 1HB GLU 109 HB2 GLU 109 30.151 30.283 15.350 797 2HB GLU 109 HB1 GLU 109 30.678 28.759 16.063 798 1HG GLU 109 HG2 GLU 109 32.652 28.741 14.592 799 2HG GLU 109 HG1 GLU 109 32.132 30.266 13.870 800 H TYR 110 HN TYR 110 27.930 29.867 14.948 801 HA TYR 110 HA TYR 110 26.270 27.379 15.201 802 1HB TYR 110 HB2 TYR 110 26.568 29.490 17.356 803 2HB TYR 110 HB1 TYR 110 25.555 28.051 17.436 804 HD1 TYR 110 HD2 TYR 110 26.622 25.770 17.455 805 HD2 TYR 110 HD1 TYR 110 28.909 29.391 17.781 806 HE1 TYR 110 HE2 TYR 110 28.548 24.474 18.325 807 HE2 TYR 110 HE1 TYR 110 30.836 28.104 18.653 808 HH TYR 110 HH TYR 110 31.681 25.786 18.575 809 H ASN 111 HN ASN 111 23.983 27.780 15.344 810 HA ASN 111 HA ASN 111 23.149 30.332 14.031 811 1HB ASN 111 HB2 ASN 111 21.736 27.664 14.365 812 2HB ASN 111 HB1 ASN 111 21.020 29.081 13.595 813 1HD2 ASN 111 HD22 ASN 111 23.455 28.927 10.836 814 2HD2 ASN 111 HD21 ASN 111 22.867 30.087 11.927 815 H LEU 112 HN LEU 112 22.245 31.845 15.358 816 HA LEU 112 HA LEU 112 21.805 31.437 18.127 817 1HB LEU 112 HB2 LEU 112 22.136 33.666 17.127 818 2HB LEU 112 HB1 LEU 112 20.587 33.531 16.303 819 HG LEU 112 HG LEU 112 19.423 33.430 18.475 820 1HD1 LEU 112 HD11 LEU 112 22.255 33.441 19.516 821 2HD1 LEU 112 HD13 LEU 112 20.956 34.118 20.499 822 3HD1 LEU 112 HD12 LEU 112 20.897 32.427 20.008 823 1HD2 LEU 112 HD22 LEU 112 19.920 35.625 17.381 824 2HD2 LEU 112 HD21 LEU 112 19.815 35.751 19.138 825 3HD2 LEU 112 HD23 LEU 112 21.391 35.737 18.347 826 H HIS 113 HN HIS 113 19.474 31.382 15.423 827 HA HIS 113 HA HIS 113 17.121 31.114 16.983 828 1HB HIS 113 HB2 HIS 113 17.123 31.581 14.552 829 2HB HIS 113 HB1 HIS 113 17.657 29.929 14.248 830 HD1 HIS 113 HD1 HIS 113 15.949 28.082 15.579 831 HD2 HIS 113 HD2 HIS 113 14.381 31.762 14.410 832 HE1 HIS 113 HE1 HIS 113 13.434 27.801 15.511 833 H ARG 114 HN ARG 114 19.330 28.572 15.776 834 HA ARG 114 HA ARG 114 17.732 26.355 16.545 835 1HB ARG 114 HB2 ARG 114 19.662 26.015 15.130 836 2HB ARG 114 HB1 ARG 114 20.741 26.663 16.359 837 1HG ARG 114 HG2 ARG 114 20.855 24.202 16.278 838 2HG ARG 114 HG1 ARG 114 20.242 24.741 17.830 839 1HD ARG 114 HD2 ARG 114 17.987 24.186 17.218 840 2HD ARG 114 HD1 ARG 114 18.427 23.928 15.535 841 HE ARG 114 HE ARG 114 18.563 22.021 17.725 842 1HH1 ARG 114 HH21 ARG 114 20.271 23.030 14.899 843 2HH1 ARG 114 HH22 ARG 114 21.193 21.569 14.788 844 1HH2 ARG 114 HH11 ARG 114 19.755 20.129 17.588 845 2HH2 ARG 114 HH12 ARG 114 20.903 19.932 16.306 846 H VAL 115 HN VAL 115 20.161 28.181 18.423 847 HA VAL 115 HA VAL 115 19.882 26.503 20.762 848 HB VAL 115 HB VAL 115 20.948 29.314 20.381 849 1HG1 VAL 115 HG13 VAL 115 20.785 27.567 22.840 850 2HG1 VAL 115 HG12 VAL 115 22.008 28.827 22.677 851 3HG1 VAL 115 HG11 VAL 115 20.295 29.251 22.662 852 1HG2 VAL 115 HG22 VAL 115 22.194 26.567 20.649 853 2HG2 VAL 115 HG21 VAL 115 22.357 27.706 19.312 854 3HG2 VAL 115 HG23 VAL 115 23.121 28.050 20.864 855 H ALA 116 HN ALA 116 18.426 29.604 19.772 856 HA ALA 116 HA ALA 116 16.991 30.112 22.169 857 1HB ALA 116 HB2 ALA 116 17.218 31.702 20.232 858 2HB ALA 116 HB1 ALA 116 16.056 30.712 19.346 859 3HB ALA 116 HB3 ALA 116 15.563 31.544 20.822 860 H ALA 117 HN ALA 117 16.008 28.316 19.248 861 HA ALA 117 HA ALA 117 13.408 27.604 20.136 862 1HB ALA 117 HB3 ALA 117 15.358 26.194 18.298 863 2HB ALA 117 HB2 ALA 117 13.702 25.641 18.550 864 3HB ALA 117 HB1 ALA 117 14.004 27.226 17.837 865 H HIS 118 HN HIS 118 16.554 26.009 20.618 866 HA HIS 118 HA HIS 118 15.590 23.663 21.909 867 1HB HIS 118 HB2 HIS 118 17.945 23.988 21.151 868 2HB HIS 118 HB1 HIS 118 18.183 25.141 22.464 869 HD1 HIS 118 HD1 HIS 118 17.706 21.483 21.779 870 HD2 HIS 118 HD2 HIS 118 18.358 23.967 25.064 871 HE1 HIS 118 HE1 HIS 118 18.249 19.963 23.727 872 H GLU 119 HN GLU 119 16.506 26.840 23.248 873 HA GLU 119 HA GLU 119 16.127 26.187 25.994 874 1HB GLU 119 HB2 GLU 119 15.809 28.814 24.512 875 2HB GLU 119 HB1 GLU 119 15.724 28.672 26.270 876 1HG GLU 119 HG2 GLU 119 17.992 27.694 26.302 877 2HG GLU 119 HG1 GLU 119 18.078 27.846 24.547 878 H LEU 120 HN LEU 120 13.858 27.330 23.517 879 HA LEU 120 HA LEU 120 11.610 27.684 25.239 880 1HB LEU 120 HB2 LEU 120 11.700 26.856 22.318 881 2HB LEU 120 HB1 LEU 120 10.247 27.378 23.170 882 HG LEU 120 HG LEU 120 12.755 29.052 22.819 883 1HD1 LEU 120 HD13 LEU 120 11.329 28.561 20.743 884 2HD1 LEU 120 HD12 LEU 120 10.051 29.485 21.534 885 3HD1 LEU 120 HD11 LEU 120 11.583 30.260 21.134 886 1HD2 LEU 120 HD22 LEU 120 10.150 29.446 24.278 887 2HD2 LEU 120 HD21 LEU 120 11.779 29.938 24.742 888 3HD2 LEU 120 HD23 LEU 120 10.901 30.845 23.514 889 H GLY 121 HN GLY 121 12.917 24.845 23.587 890 1HA GLY 121 HA2 GLY 121 10.789 23.057 24.098 891 2HA GLY 121 HA1 GLY 121 12.476 22.568 23.941 892 H HIS 122 HN HIS 122 13.596 23.908 26.135 893 HA HIS 122 HA HIS 122 12.834 22.134 28.285 894 1HB HIS 122 HB2 HIS 122 14.648 24.548 28.112 895 2HB HIS 122 HB1 HIS 122 14.357 23.724 29.645 896 HD1 HIS 122 HD1 HIS 122 14.531 20.874 29.158 897 HD2 HIS 122 HD2 HIS 122 16.931 23.492 26.975 898 HE1 HIS 122 HE1 HIS 122 16.471 19.504 28.282 899 H SER 123 HN SER 123 12.180 25.554 27.589 900 HA SER 123 HA SER 123 10.868 26.192 30.030 901 1HB SER 123 HB2 SER 123 10.450 27.255 27.228 902 2HB SER 123 HB1 SER 123 9.698 27.952 28.659 903 HG SER 123 HG SER 123 11.570 29.056 28.396 904 H LEU 124 HN LEU 124 9.639 24.745 27.029 905 HA LEU 124 HA LEU 124 6.887 24.675 27.999 906 1HB LEU 124 HB2 LEU 124 8.208 23.311 25.637 907 2HB LEU 124 HB1 LEU 124 6.471 23.366 25.927 908 HG LEU 124 HG LEU 124 8.206 25.841 25.669 909 1HD1 LEU 124 HD12 LEU 124 6.519 24.408 23.596 910 2HD1 LEU 124 HD11 LEU 124 7.176 26.032 23.389 911 3HD1 LEU 124 HD13 LEU 124 8.265 24.655 23.554 912 1HD2 LEU 124 HD22 LEU 124 5.247 25.319 25.964 913 2HD2 LEU 124 HD21 LEU 124 6.251 26.530 26.762 914 3HD2 LEU 124 HD23 LEU 124 5.788 26.742 25.076 915 H GLY 125 HN GLY 125 9.530 22.963 28.917 916 1HA GLY 125 HA2 GLY 125 9.563 21.113 30.403 917 2HA GLY 125 HA1 GLY 125 7.866 20.817 30.037 918 H LEU 126 HN LEU 126 9.644 21.187 27.170 919 HA LEU 126 HA LEU 126 9.355 18.335 26.582 920 1HB LEU 126 HB2 LEU 126 10.693 20.536 24.970 921 2HB LEU 126 HB1 LEU 126 10.306 18.922 24.379 922 HG LEU 126 HG LEU 126 8.277 20.942 25.388 923 1HD1 LEU 126 HD11 LEU 126 9.394 21.467 23.177 924 2HD1 LEU 126 HD13 LEU 126 8.736 19.953 22.561 925 3HD1 LEU 126 HD12 LEU 126 7.650 21.241 23.081 926 1HD2 LEU 126 HD21 LEU 126 8.094 18.088 24.422 927 2HD2 LEU 126 HD23 LEU 126 7.265 18.860 25.773 928 3HD2 LEU 126 HD22 LEU 126 6.750 19.190 24.124 929 H SER 127 HN SER 127 11.013 16.818 26.457 930 HA SER 127 HA SER 127 13.640 17.654 27.637 931 1HB SER 127 HB2 SER 127 12.307 14.936 27.532 932 2HB SER 127 HB1 SER 127 13.862 15.281 28.282 933 HG SER 127 HG SER 127 11.749 15.328 29.569 934 H HIS 128 HN HIS 128 15.510 16.259 26.886 935 HA HIS 128 HA HIS 128 15.932 16.534 24.091 936 1HB HIS 128 HB2 HIS 128 17.325 14.699 26.063 937 2HB HIS 128 HB1 HIS 128 17.933 15.119 24.462 938 HD1 HIS 128 HD1 HIS 128 19.477 15.865 27.078 939 HD2 HIS 128 HD2 HIS 128 16.890 18.434 25.054 940 HE1 HIS 128 HE1 HIS 128 20.155 18.216 27.721 941 H SER 129 HN SER 129 16.533 14.577 22.657 942 HA SER 129 HA SER 129 14.921 12.152 23.191 943 1HB SER 129 HB2 SER 129 13.396 13.803 22.048 944 2HB SER 129 HB1 SER 129 14.503 13.797 20.678 945 HG SER 129 HG SER 129 12.614 11.990 21.404 946 H THR 130 HN THR 130 15.380 10.466 21.520 947 HA THR 130 HA THR 130 18.222 10.628 20.689 948 HB THR 130 HB THR 130 17.957 8.200 20.250 949 HG1 THR 130 HG1 THR 130 15.685 8.426 19.717 950 1HG2 THR 130 HG22 THR 130 18.581 8.977 22.503 951 2HG2 THR 130 HG21 THR 130 16.877 9.098 22.937 952 3HG2 THR 130 HG23 THR 130 17.589 7.522 22.590 953 H ASP 131 HN ASP 131 15.450 11.613 19.338 954 HA ASP 131 HA ASP 131 15.765 10.402 16.674 955 1HB ASP 131 HB2 ASP 131 13.529 11.023 17.643 956 2HB ASP 131 HB1 ASP 131 14.001 12.717 17.524 957 H ILE 132 HN ILE 132 17.468 11.105 15.488 958 HA ILE 132 HA ILE 132 18.899 13.518 15.862 959 HB ILE 132 HB ILE 132 19.671 11.499 14.568 960 1HG1 ILE 132 HG12 ILE 132 19.842 14.086 13.001 961 2HG1 ILE 132 HG11 ILE 132 20.769 13.775 14.468 962 1HG2 ILE 132 HG22 ILE 132 17.470 11.414 13.240 963 2HG2 ILE 132 HG21 ILE 132 18.151 12.709 12.254 964 3HG2 ILE 132 HG23 ILE 132 18.957 11.143 12.332 965 1HD1 ILE 132 HD12 ILE 132 21.690 11.710 13.364 966 2HD1 ILE 132 HD11 ILE 132 20.888 12.211 11.876 967 3HD1 ILE 132 HD13 ILE 132 22.162 13.213 12.570 968 H GLY 133 HN GLY 133 15.942 12.908 14.085 969 1HA GLY 133 HA2 GLY 133 16.086 15.390 12.557 970 2HA GLY 133 HA1 GLY 133 14.675 14.339 12.685 971 H ALA 134 HN ALA 134 15.747 14.895 15.777 972 HA ALA 134 HA ALA 134 13.638 16.957 16.199 973 1HB ALA 134 HB2 ALA 134 15.186 15.218 18.146 974 2HB ALA 134 HB1 ALA 134 13.963 16.398 18.615 975 3HB ALA 134 HB3 ALA 134 13.509 14.999 17.645 976 H LEU 135 HN LEU 135 14.117 18.995 16.954 977 HA LEU 135 HA LEU 135 16.810 19.991 16.634 978 1HB LEU 135 HB2 LEU 135 14.409 21.257 17.992 979 2HB LEU 135 HB1 LEU 135 15.880 22.107 17.523 980 HG LEU 135 HG LEU 135 14.068 20.631 15.589 981 1HD1 LEU 135 HD11 LEU 135 14.238 23.543 16.389 982 2HD1 LEU 135 HD13 LEU 135 13.531 23.028 14.857 983 3HD1 LEU 135 HD12 LEU 135 12.816 22.499 16.379 984 1HD2 LEU 135 HD21 LEU 135 16.590 22.270 15.313 985 2HD2 LEU 135 HD23 LEU 135 16.171 20.739 14.545 986 3HD2 LEU 135 HD22 LEU 135 15.422 22.233 13.993 987 H MET 136 HN MET 136 14.882 18.934 19.370 988 HA MET 136 HA MET 136 16.641 19.962 21.409 989 1HB MET 136 HB2 MET 136 14.714 17.623 21.553 990 2HB MET 136 HB1 MET 136 15.385 18.511 22.922 991 1HG MET 136 HG2 MET 136 13.633 19.709 20.757 992 2HG MET 136 HG1 MET 136 13.092 19.275 22.375 993 1HE MET 136 HE2 MET 136 13.994 19.964 24.387 994 2HE MET 136 HE1 MET 136 15.700 20.397 24.309 995 3HE MET 136 HE3 MET 136 14.495 21.607 24.768 996 H TYR 137 HN TYR 137 17.749 18.143 19.134 997 HA TYR 137 HA TYR 137 18.602 15.727 20.373 998 1HB TYR 137 HB2 TYR 137 18.721 16.413 17.871 999 2HB TYR 137 HB1 TYR 137 20.257 17.167 18.297 1000 HD1 TYR 137 HD2 TYR 137 18.386 13.947 18.333 1001 HD2 TYR 137 HD1 TYR 137 22.226 15.848 18.635 1002 HE1 TYR 137 HE2 TYR 137 19.489 11.731 18.226 1003 HE2 TYR 137 HE1 TYR 137 23.328 13.626 18.530 1004 HH TYR 137 HH TYR 137 22.116 11.020 17.398 1005 HA PRO 138 HA PRO 138 21.442 17.486 23.340 1006 1HB PRO 138 HB2 PRO 138 23.239 15.203 23.268 1007 2HB PRO 138 HB1 PRO 138 22.067 15.634 24.521 1008 1HG PRO 138 HG2 PRO 138 21.860 13.511 22.554 1009 2HG PRO 138 HG1 PRO 138 20.714 13.916 23.840 1010 1HD PRO 138 HD2 PRO 138 20.369 14.345 21.015 1011 2HD PRO 138 HD1 PRO 138 19.279 14.849 22.327 1012 H SER 139 HN SER 139 22.958 15.797 20.544 1013 HA SER 139 HA SER 139 25.294 17.585 20.693 1014 1HB SER 139 HB2 SER 139 25.496 15.191 19.990 1015 2HB SER 139 HB1 SER 139 24.574 15.579 18.542 1016 HG SER 139 HG SER 139 26.432 17.394 18.681 1017 H TYR 140 HN TYR 140 25.620 19.372 19.490 1018 HA TYR 140 HA TYR 140 23.442 20.575 18.024 1019 1HB TYR 140 HB2 TYR 140 25.146 21.910 19.213 1020 2HB TYR 140 HB1 TYR 140 26.391 21.291 18.130 1021 HD1 TYR 140 HD1 TYR 140 26.444 21.946 15.756 1022 HD2 TYR 140 HD2 TYR 140 23.555 23.587 18.476 1023 HE1 TYR 140 HE1 TYR 140 25.942 23.753 14.133 1024 HE2 TYR 140 HE2 TYR 140 23.048 25.392 16.851 1025 HH TYR 140 HH TYR 140 24.481 26.524 14.858 1026 H THR 141 HN THR 141 23.120 20.658 15.798 1027 HA THR 141 HA THR 141 25.199 19.617 13.973 1028 HB THR 141 HB THR 141 23.506 18.048 12.919 1029 HG1 THR 141 HG1 THR 141 21.595 18.533 13.723 1030 1HG2 THR 141 HG21 THR 141 25.363 17.331 14.473 1031 2HG2 THR 141 HG23 THR 141 24.192 17.376 15.790 1032 3HG2 THR 141 HG22 THR 141 23.973 16.248 14.453 1033 H PHE 142 HN PHE 142 25.011 20.542 11.943 1034 HA PHE 142 HA PHE 142 23.157 22.778 11.688 1035 1HB PHE 142 HB2 PHE 142 25.515 22.799 10.813 1036 2HB PHE 142 HB1 PHE 142 25.019 21.624 9.596 1037 HD1 PHE 142 HD1 PHE 142 23.490 22.239 7.785 1038 HD2 PHE 142 HD2 PHE 142 24.712 25.103 10.746 1039 HE1 PHE 142 HE1 PHE 142 22.614 24.077 6.367 1040 HE2 PHE 142 HE2 PHE 142 23.837 26.939 9.328 1041 HZ PHE 142 HZ PHE 142 22.787 26.429 7.140 1042 H SER 143 HN SER 143 21.091 22.490 11.039 1043 HA SER 143 HA SER 143 20.459 20.244 9.143 1044 1HB SER 143 HB2 SER 143 18.796 21.614 11.268 1045 2HB SER 143 HB1 SER 143 18.107 20.546 10.049 1046 HG SER 143 HG SER 143 19.375 18.884 10.834 1047 H GLY 144 HN GLY 144 21.002 23.490 9.137 1048 1HA GLY 144 HA2 GLY 144 20.569 25.052 7.414 1049 2HA GLY 144 HA1 GLY 144 19.543 23.847 6.632 1050 H ASP 145 HN ASP 145 17.346 24.115 6.811 1051 HA ASP 145 HA ASP 145 16.334 26.468 8.187 1052 1HB ASP 145 HB2 ASP 145 14.951 24.164 6.781 1053 2HB ASP 145 HB1 ASP 145 14.085 25.531 7.482 1054 H VAL 146 HN VAL 146 15.080 26.523 10.087 1055 HA VAL 146 HA VAL 146 15.399 24.146 11.850 1056 HB VAL 146 HB VAL 146 14.453 26.957 12.503 1057 1HG1 VAL 146 HG12 VAL 146 15.246 24.573 14.200 1058 2HG1 VAL 146 HG11 VAL 146 15.063 26.206 14.839 1059 3HG1 VAL 146 HG13 VAL 146 13.673 25.370 14.147 1060 1HG2 VAL 146 HG23 VAL 146 16.856 26.687 11.642 1061 2HG2 VAL 146 HG22 VAL 146 16.685 27.415 13.237 1062 3HG2 VAL 146 HG21 VAL 146 17.157 25.724 13.087 1063 H GLN 147 HN GLN 147 13.706 22.772 12.001 1064 HA GLN 147 HA GLN 147 10.926 23.877 11.917 1065 1HB GLN 147 HB2 GLN 147 11.990 21.515 10.337 1066 2HB GLN 147 HB1 GLN 147 10.275 21.876 10.537 1067 1HG GLN 147 HG2 GLN 147 10.539 24.026 9.442 1068 2HG GLN 147 HG1 GLN 147 12.288 23.819 9.372 1069 1HE2 GLN 147 HE22 GLN 147 10.922 22.800 6.053 1070 2HE2 GLN 147 HE21 GLN 147 10.961 24.239 6.953 1071 H LEU 148 HN LEU 148 9.401 22.584 13.094 1072 HA LEU 148 HA LEU 148 10.573 21.150 15.348 1073 1HB LEU 148 HB2 LEU 148 7.666 21.415 14.516 1074 2HB LEU 148 HB1 LEU 148 8.247 20.851 16.083 1075 HG LEU 148 HG LEU 148 8.762 23.604 14.913 1076 1HD1 LEU 148 HD13 LEU 148 6.845 22.589 17.024 1077 2HD1 LEU 148 HD12 LEU 148 7.257 24.294 16.840 1078 3HD1 LEU 148 HD11 LEU 148 6.448 23.437 15.529 1079 1HD2 LEU 148 HD21 LEU 148 9.643 22.197 17.432 1080 2HD2 LEU 148 HD23 LEU 148 10.577 23.236 16.354 1081 3HD2 LEU 148 HD22 LEU 148 9.400 23.944 17.454 1082 H ALA 149 HN ALA 149 9.961 18.914 15.902 1083 HA ALA 149 HA ALA 149 9.794 17.198 13.453 1084 1HB ALA 149 HB3 ALA 149 10.815 16.684 16.257 1085 2HB ALA 149 HB2 ALA 149 10.614 15.409 15.055 1086 3HB ALA 149 HB1 ALA 149 11.751 16.725 14.764 1087 H GLN 150 HN GLN 150 8.393 15.310 13.551 1088 HA GLN 150 HA GLN 150 5.777 15.847 14.538 1089 1HB GLN 150 HB2 GLN 150 6.272 14.236 12.706 1090 2HB GLN 150 HB1 GLN 150 7.030 13.158 13.878 1091 1HG GLN 150 HG2 GLN 150 4.894 12.971 15.099 1092 2HG GLN 150 HG1 GLN 150 4.132 14.052 13.932 1093 1HE2 GLN 150 HE22 GLN 150 5.256 10.319 12.597 1094 2HE2 GLN 150 HE21 GLN 150 6.175 11.068 13.812 1095 H ASP 151 HN ASP 151 8.466 13.972 15.863 1096 HA ASP 151 HA ASP 151 7.127 12.849 18.104 1097 1HB ASP 151 HB2 ASP 151 9.401 12.186 17.391 1098 2HB ASP 151 HB1 ASP 151 10.011 13.770 17.870 1099 H ASP 152 HN ASP 152 8.702 16.034 17.675 1100 HA ASP 152 HA ASP 152 8.237 16.827 20.436 1101 1HB ASP 152 HB2 ASP 152 8.961 18.394 17.946 1102 2HB ASP 152 HB1 ASP 152 8.802 19.129 19.542 1103 H ILE 153 HN ILE 153 6.584 17.394 17.334 1104 HA ILE 153 HA ILE 153 4.634 19.226 18.325 1105 HB ILE 153 HB ILE 153 4.505 17.214 16.060 1106 1HG1 ILE 153 HG12 ILE 153 4.839 20.227 16.007 1107 2HG1 ILE 153 HG11 ILE 153 6.197 19.103 15.968 1108 1HG2 ILE 153 HG22 ILE 153 2.591 19.400 16.905 1109 2HG2 ILE 153 HG21 ILE 153 2.611 18.734 15.272 1110 3HG2 ILE 153 HG23 ILE 153 2.234 17.693 16.644 1111 1HD1 ILE 153 HD13 ILE 153 3.913 19.071 13.976 1112 2HD1 ILE 153 HD12 ILE 153 5.465 19.858 13.688 1113 3HD1 ILE 153 HD11 ILE 153 5.389 18.110 13.906 1114 H ASP 154 HN ASP 154 4.475 15.670 17.954 1115 HA ASP 154 HA ASP 154 1.881 15.350 19.078 1116 1HB ASP 154 HB2 ASP 154 4.277 13.495 19.016 1117 2HB ASP 154 HB1 ASP 154 2.686 13.001 19.600 1118 H GLY 155 HN GLY 155 5.089 15.468 20.593 1119 1HA GLY 155 HA2 GLY 155 4.287 14.762 23.231 1120 2HA GLY 155 HA1 GLY 155 5.713 15.717 22.837 1121 H ILE 156 HN ILE 156 4.755 18.070 21.871 1122 HA ILE 156 HA ILE 156 3.740 19.323 24.258 1123 HB ILE 156 HB ILE 156 5.211 20.463 22.568 1124 1HG1 ILE 156 HG12 ILE 156 3.900 22.638 22.606 1125 2HG1 ILE 156 HG11 ILE 156 2.548 21.737 23.282 1126 1HG2 ILE 156 HG22 ILE 156 3.968 19.581 20.578 1127 2HG2 ILE 156 HG21 ILE 156 2.654 20.694 20.959 1128 3HG2 ILE 156 HG23 ILE 156 4.244 21.319 20.525 1129 1HD1 ILE 156 HD12 ILE 156 5.243 21.534 24.609 1130 2HD1 ILE 156 HD11 ILE 156 4.253 22.966 24.879 1131 3HD1 ILE 156 HD13 ILE 156 3.634 21.377 25.315 1132 H GLN 157 HN GLN 157 2.216 18.294 21.228 1133 HA GLN 157 HA GLN 157 -0.316 19.556 21.748 1134 1HB GLN 157 HB2 GLN 157 0.463 17.181 20.042 1135 2HB GLN 157 HB1 GLN 157 -1.195 17.777 20.139 1136 1HG GLN 157 HG2 GLN 157 -0.486 19.981 19.358 1137 2HG GLN 157 HG1 GLN 157 1.200 19.461 19.344 1138 1HE2 GLN 157 HE22 GLN 157 -0.332 19.091 15.900 1139 2HE2 GLN 157 HE21 GLN 157 -0.264 20.391 16.988 1140 H ALA 158 HN ALA 158 1.006 16.359 22.575 1141 HA ALA 158 HA ALA 158 -1.390 15.239 23.619 1142 1HB ALA 158 HB2 ALA 158 0.752 13.985 23.212 1143 2HB ALA 158 HB1 ALA 158 1.414 14.747 24.657 1144 3HB ALA 158 HB3 ALA 158 0.030 13.664 24.787 1145 H ILE 159 HN ILE 159 1.111 17.250 25.202 1146 HA ILE 159 HA ILE 159 -0.054 17.103 27.823 1147 HB ILE 159 HB ILE 159 1.642 19.259 26.524 1148 1HG1 ILE 159 HG12 ILE 159 2.377 17.143 28.573 1149 2HG1 ILE 159 HG11 ILE 159 2.619 16.941 26.840 1150 1HG2 ILE 159 HG22 ILE 159 0.679 18.903 29.373 1151 2HG2 ILE 159 HG21 ILE 159 2.093 19.874 28.971 1152 3HG2 ILE 159 HG23 ILE 159 0.509 20.324 28.343 1153 1HD1 ILE 159 HD11 ILE 159 3.784 19.205 28.487 1154 2HD1 ILE 159 HD13 ILE 159 4.672 17.763 27.988 1155 3HD1 ILE 159 HD12 ILE 159 4.080 18.900 26.775 1156 H TYR 160 HN TYR 160 -0.377 19.570 25.250 1157 HA TYR 160 HA TYR 160 -2.685 20.751 26.712 1158 1HB TYR 160 HB2 TYR 160 -1.123 21.637 24.270 1159 2HB TYR 160 HB1 TYR 160 -2.556 22.476 24.865 1160 HD1 TYR 160 HD2 TYR 160 -2.541 23.669 26.985 1161 HD2 TYR 160 HD1 TYR 160 0.969 21.639 25.560 1162 HE1 TYR 160 HE2 TYR 160 -1.166 24.864 28.667 1163 HE2 TYR 160 HE1 TYR 160 2.343 22.838 27.247 1164 HH TYR 160 HH TYR 160 1.297 24.174 29.856 1165 H GLY 161 HN GLY 161 -2.111 20.134 23.235 1166 1HA GLY 161 HA2 GLY 161 -3.903 18.143 22.659 1167 2HA GLY 161 HA1 GLY 161 -4.961 19.539 22.869 1168 H ARG 162 HN ARG 162 -5.367 18.961 20.481 1169 HA ARG 162 HA ARG 162 -3.229 19.795 18.626 1170 1HB ARG 162 HB2 ARG 162 -6.079 18.858 18.197 1171 2HB ARG 162 HB1 ARG 162 -5.010 19.347 16.880 1172 1HG ARG 162 HG2 ARG 162 -3.367 17.636 17.597 1173 2HG ARG 162 HG1 ARG 162 -4.469 17.128 18.876 1174 1HD ARG 162 HD2 ARG 162 -5.065 17.045 15.902 1175 2HD ARG 162 HD1 ARG 162 -4.666 15.655 16.905 1176 HE ARG 162 HE ARG 162 -6.865 16.841 18.158 1177 1HH1 ARG 162 HH21 ARG 162 -6.058 15.571 15.051 1178 2HH1 ARG 162 HH22 ARG 162 -7.684 15.111 14.672 1179 1HH2 ARG 162 HH11 ARG 162 -8.993 16.247 17.674 1180 2HH2 ARG 162 HH12 ARG 162 -9.344 15.493 16.154 1181 H SER 163 HN SER 163 -3.397 21.639 17.256 1182 HA SER 163 HA SER 163 -4.685 23.922 18.504 1183 1HB SER 163 HB2 SER 163 -3.410 23.808 15.763 1184 2HB SER 163 HB1 SER 163 -3.630 25.226 16.783 1185 HG SER 163 HG SER 163 -1.499 23.953 16.725 1186 H GLN 164 HN GLN 164 -6.889 22.661 18.217 1187 HA GLN 164 HA GLN 164 -8.078 22.696 15.573 1188 1HB GLN 164 HB2 GLN 164 -9.276 22.470 18.346 1189 2HB GLN 164 HB1 GLN 164 -10.233 22.374 16.865 1190 1HG GLN 164 HG2 GLN 164 -8.874 20.478 16.091 1191 2HG GLN 164 HG1 GLN 164 -7.890 20.576 17.553 1192 1HE2 GLN 164 HE22 GLN 164 -10.686 18.050 17.976 1193 2HE2 GLN 164 HE21 GLN 164 -9.513 18.262 16.768 1194 H ASN 165 HN ASN 165 -9.193 24.332 14.583 1195 HA ASN 165 HA ASN 165 -10.154 26.654 16.120 1196 1HB ASN 165 HB2 ASN 165 -7.961 26.904 14.043 1197 2HB ASN 165 HB1 ASN 165 -8.842 28.260 14.747 1198 1HD2 ASN 165 HD22 ASN 165 -7.350 27.733 18.037 1199 2HD2 ASN 165 HD21 ASN 165 -8.860 28.082 17.346 1200 HA PRO 166 HA PRO 166 -12.559 25.406 12.319 1201 1HB PRO 166 HB2 PRO 166 -14.965 26.039 13.844 1202 2HB PRO 166 HB1 PRO 166 -14.452 24.470 13.205 1203 1HG PRO 166 HG2 PRO 166 -14.456 25.270 15.952 1204 2HG PRO 166 HG1 PRO 166 -13.781 23.775 15.286 1205 1HD PRO 166 HD2 PRO 166 -12.352 26.119 16.292 1206 2HD PRO 166 HD1 PRO 166 -11.682 24.549 15.800 1207 H VAL 167 HN VAL 167 -12.159 27.190 11.048 1208 HA VAL 167 HA VAL 167 -12.827 29.901 11.957 1209 HB VAL 167 HB VAL 167 -11.659 28.791 9.392 1210 1HG1 VAL 167 HG13 VAL 167 -12.330 31.630 10.195 1211 2HG1 VAL 167 HG12 VAL 167 -11.112 31.258 8.973 1212 3HG1 VAL 167 HG11 VAL 167 -12.791 30.779 8.720 1213 1HG2 VAL 167 HG22 VAL 167 -10.270 28.745 11.479 1214 2HG2 VAL 167 HG21 VAL 167 -9.599 29.790 10.226 1215 3HG2 VAL 167 HG23 VAL 167 -10.457 30.494 11.598 1216 H GLN 168 HN GLN 168 -14.556 31.121 11.272 1217 HA GLN 168 HA GLN 168 -16.755 29.729 9.922 1218 1HB GLN 168 HB2 GLN 168 -16.527 32.558 10.994 1219 2HB GLN 168 HB1 GLN 168 -18.018 31.814 10.423 1220 1HG GLN 168 HG2 GLN 168 -17.523 29.955 12.154 1221 2HG GLN 168 HG1 GLN 168 -16.373 31.098 12.847 1222 1HE2 GLN 168 HE22 GLN 168 -20.376 32.062 12.985 1223 2HE2 GLN 168 HE21 GLN 168 -19.815 31.063 11.733 1224 HA PRO 169 HA PRO 169 -15.991 31.225 5.798 1225 1HB PRO 169 HB2 PRO 169 -18.741 32.201 5.453 1226 2HB PRO 169 HB1 PRO 169 -17.949 30.822 4.675 1227 1HG PRO 169 HG2 PRO 169 -19.909 30.733 6.781 1228 2HG PRO 169 HG1 PRO 169 -19.046 29.365 6.062 1229 1HD PRO 169 HD2 PRO 169 -18.688 30.445 8.708 1230 2HD PRO 169 HD1 PRO 169 -17.770 29.133 7.946 No H/Q in entry = 1230 Start of MODEL 2 1 1H VAL 1 HT1 VAL 1 9.489 23.367 44.287 2 2H VAL 1 HT3 VAL 1 9.821 22.980 45.906 3 3H VAL 1 HT2 VAL 1 10.818 22.382 44.670 4 HA VAL 1 HA VAL 1 9.600 20.547 44.656 5 HB VAL 1 HB VAL 1 7.428 20.447 45.941 6 1HG1 VAL 1 HG11 VAL 1 9.696 19.980 46.931 7 2HG1 VAL 1 HG13 VAL 1 9.732 21.647 47.501 8 3HG1 VAL 1 HG12 VAL 1 8.500 20.535 48.103 9 1HG2 VAL 1 HG22 VAL 1 8.153 23.347 46.460 10 2HG2 VAL 1 HG21 VAL 1 6.667 22.729 45.740 11 3HG2 VAL 1 HG23 VAL 1 7.007 22.439 47.444 12 H LEU 2 HN LEU 2 7.527 19.653 43.676 13 HA LEU 2 HA LEU 2 6.937 21.087 41.243 14 1HB LEU 2 HB2 LEU 2 5.475 18.734 42.491 15 2HB LEU 2 HB1 LEU 2 5.311 19.278 40.823 16 HG LEU 2 HG LEU 2 7.858 18.241 42.106 17 1HD1 LEU 2 HD11 LEU 2 6.145 16.507 41.660 18 2HD1 LEU 2 HD13 LEU 2 6.056 17.039 39.981 19 3HD1 LEU 2 HD12 LEU 2 7.544 16.321 40.601 20 1HD2 LEU 2 HD23 LEU 2 7.245 19.468 39.418 21 2HD2 LEU 2 HD22 LEU 2 8.639 19.730 40.469 22 3HD2 LEU 2 HD21 LEU 2 8.502 18.238 39.543 23 H THR 3 HN THR 3 5.025 22.179 40.668 24 HA THR 3 HA THR 3 3.549 23.329 42.954 25 HB THR 3 HB THR 3 2.659 24.894 41.315 26 HG1 THR 3 HG1 THR 3 2.296 23.651 39.560 27 1HG2 THR 3 HG23 THR 3 5.040 25.136 42.140 28 2HG2 THR 3 HG22 THR 3 5.563 24.381 40.635 29 3HG2 THR 3 HG21 THR 3 4.710 25.925 40.598 30 H GLU 4 HN GLU 4 1.126 23.473 42.775 31 HA GLU 4 HA GLU 4 -0.006 20.855 42.428 32 1HB GLU 4 HB2 GLU 4 -0.888 22.555 44.016 33 2HB GLU 4 HB1 GLU 4 -1.416 23.535 42.647 34 1HG GLU 4 HG2 GLU 4 -2.899 21.739 41.897 35 2HG GLU 4 HG1 GLU 4 -2.332 20.701 43.207 36 H GLY 5 HN GLY 5 -1.150 19.994 40.695 37 1HA GLY 5 HA2 GLY 5 -2.257 19.989 38.580 38 2HA GLY 5 HA1 GLY 5 -1.910 21.712 38.417 39 H ASN 6 HN ASN 6 -1.235 20.986 36.171 40 HA ASN 6 HA ASN 6 1.172 19.389 35.935 41 1HB ASN 6 HB2 ASN 6 -0.051 21.250 33.883 42 2HB ASN 6 HB1 ASN 6 1.061 19.920 33.568 43 1HD2 ASN 6 HD22 ASN 6 -2.437 18.726 32.950 44 2HD2 ASN 6 HD21 ASN 6 -1.483 19.979 32.317 45 HA PRO 7 HA PRO 7 3.867 22.877 36.867 46 1HB PRO 7 HB2 PRO 7 6.183 21.788 35.589 47 2HB PRO 7 HB1 PRO 7 5.772 21.679 37.306 48 1HG PRO 7 HG2 PRO 7 5.616 19.584 35.253 49 2HG PRO 7 HG1 PRO 7 5.493 19.421 37.011 50 1HD PRO 7 HD2 PRO 7 3.347 19.227 35.142 51 2HD PRO 7 HD1 PRO 7 3.210 19.309 36.909 52 H ARG 8 HN ARG 8 2.368 22.523 34.200 53 HA ARG 8 HA ARG 8 4.158 24.085 32.401 54 1HB ARG 8 HB2 ARG 8 1.609 22.525 31.971 55 2HB ARG 8 HB1 ARG 8 2.099 23.751 30.806 56 1HG ARG 8 HG2 ARG 8 3.030 21.758 29.958 57 2HG ARG 8 HG1 ARG 8 4.388 22.528 30.769 58 1HD ARG 8 HD2 ARG 8 3.929 21.130 32.783 59 2HD ARG 8 HD1 ARG 8 2.637 20.324 31.894 60 HE ARG 8 HE ARG 8 4.860 20.034 30.263 61 1HH1 ARG 8 HH21 ARG 8 4.045 19.392 33.544 62 2HH1 ARG 8 HH22 ARG 8 5.117 18.041 33.691 63 1HH2 ARG 8 HH11 ARG 8 6.269 18.277 30.429 64 2HH2 ARG 8 HH12 ARG 8 6.381 17.412 31.926 65 H TRP 9 HN TRP 9 3.091 25.961 31.263 66 HA TRP 9 HA TRP 9 2.075 27.814 33.202 67 1HB TRP 9 HB2 TRP 9 2.030 27.935 30.167 68 2HB TRP 9 HB1 TRP 9 1.725 29.302 31.241 69 HD1 TRP 9 HD1 TRP 9 4.507 26.931 30.116 70 HE1 TRP 9 HE1 TRP 9 6.785 27.956 30.757 71 HE3 TRP 9 HE3 TRP 9 2.923 30.962 32.817 72 HZ2 TRP 9 HZ2 TRP 9 7.805 30.196 32.225 73 HZ3 TRP 9 HZ3 TRP 9 4.563 32.525 33.824 74 HH2 TRP 9 HH2 TRP 9 6.998 32.147 33.530 75 H GLU 10 HN GLU 10 -0.013 28.214 33.809 76 HA GLU 10 HA GLU 10 -2.114 26.431 32.840 77 1HB GLU 10 HB2 GLU 10 -2.143 28.754 34.791 78 2HB GLU 10 HB1 GLU 10 -3.529 27.708 34.476 79 1HG GLU 10 HG2 GLU 10 -2.238 25.748 35.203 80 2HG GLU 10 HG1 GLU 10 -0.826 26.767 35.479 81 H GLN 11 HN GLN 11 -0.939 29.511 31.936 82 HA GLN 11 HA GLN 11 -3.499 30.471 30.841 83 1HB GLN 11 HB2 GLN 11 -0.657 31.511 30.612 84 2HB GLN 11 HB1 GLN 11 -2.073 32.326 29.947 85 1HG GLN 11 HG2 GLN 11 -3.055 32.488 32.194 86 2HG GLN 11 HG1 GLN 11 -1.662 31.645 32.873 87 1HE2 GLN 11 HE22 GLN 11 0.236 34.590 33.116 88 2HE2 GLN 11 HE21 GLN 11 -0.011 32.985 33.611 89 H THR 12 HN THR 12 -4.035 30.458 28.644 90 HA THR 12 HA THR 12 -2.482 28.575 26.953 91 HB THR 12 HB THR 12 -4.417 28.734 25.423 92 HG1 THR 12 HG1 THR 12 -6.132 30.037 26.927 93 1HG2 THR 12 HG21 THR 12 -5.196 28.363 28.329 94 2HG2 THR 12 HG23 THR 12 -6.121 27.781 26.945 95 3HG2 THR 12 HG22 THR 12 -4.517 27.122 27.275 96 H HIS 13 HN HIS 13 -2.516 31.793 27.669 97 HA HIS 13 HA HIS 13 -1.380 32.577 25.007 98 1HB HIS 13 HB2 HIS 13 -2.947 34.249 27.002 99 2HB HIS 13 HB1 HIS 13 -2.170 34.883 25.550 100 HD1 HIS 13 HD1 HIS 13 -4.691 32.151 26.440 101 HD2 HIS 13 HD2 HIS 13 -3.839 34.817 23.351 102 HE1 HIS 13 HE1 HIS 13 -6.537 31.877 24.728 103 H LEU 14 HN LEU 14 0.781 32.947 25.224 104 HA LEU 14 HA LEU 14 1.847 33.707 27.927 105 1HB LEU 14 HB2 LEU 14 3.231 32.366 25.589 106 2HB LEU 14 HB1 LEU 14 3.966 32.726 27.150 107 HG LEU 14 HG LEU 14 1.530 30.958 26.770 108 1HD1 LEU 14 HD12 LEU 14 4.466 30.297 27.102 109 2HD1 LEU 14 HD11 LEU 14 3.180 29.124 27.387 110 3HD1 LEU 14 HD13 LEU 14 3.398 29.819 25.782 111 1HD2 LEU 14 HD22 LEU 14 3.160 31.838 29.153 112 2HD2 LEU 14 HD21 LEU 14 1.409 31.695 28.995 113 3HD2 LEU 14 HD23 LEU 14 2.398 30.248 29.171 114 H THR 15 HN THR 15 3.691 35.187 27.925 115 HA THR 15 HA THR 15 3.824 37.011 25.550 116 HB THR 15 HB THR 15 3.787 38.940 27.014 117 HG1 THR 15 HG1 THR 15 4.189 36.977 28.906 118 1HG2 THR 15 HG23 THR 15 1.596 37.879 26.354 119 2HG2 THR 15 HG22 THR 15 1.583 37.074 27.923 120 3HG2 THR 15 HG21 THR 15 1.522 38.834 27.836 121 H TYR 16 HN TYR 16 5.880 38.155 25.388 122 HA TYR 16 HA TYR 16 8.037 37.235 27.219 123 1HB TYR 16 HB2 TYR 16 9.462 36.536 25.338 124 2HB TYR 16 HB1 TYR 16 7.990 35.569 25.398 125 HD1 TYR 16 HD2 TYR 16 6.097 36.084 23.823 126 HD2 TYR 16 HD1 TYR 16 9.940 37.963 23.484 127 HE1 TYR 16 HE2 TYR 16 5.551 36.780 21.506 128 HE2 TYR 16 HE1 TYR 16 9.394 38.662 21.169 129 HH TYR 16 HH TYR 16 7.948 38.449 19.479 130 H ARG 17 HN ARG 17 9.872 38.603 27.205 131 HA ARG 17 HA ARG 17 9.822 40.992 25.441 132 1HB ARG 17 HB2 ARG 17 8.510 41.563 27.501 133 2HB ARG 17 HB1 ARG 17 9.938 41.194 28.465 134 1HG ARG 17 HG2 ARG 17 11.206 42.936 27.303 135 2HG ARG 17 HG1 ARG 17 9.816 43.297 26.281 136 1HD ARG 17 HD2 ARG 17 8.502 43.863 28.302 137 2HD ARG 17 HD1 ARG 17 9.905 43.546 29.309 138 HE ARG 17 HE ARG 17 9.292 45.979 27.870 139 1HH1 ARG 17 HH21 ARG 17 11.954 43.891 28.590 140 2HH1 ARG 17 HH22 ARG 17 13.142 45.118 28.302 141 1HH2 ARG 17 HH11 ARG 17 10.824 47.564 27.516 142 2HH2 ARG 17 HH12 ARG 17 12.505 47.190 27.699 143 H ILE 18 HN ILE 18 11.899 41.646 24.951 144 HA ILE 18 HA ILE 18 14.110 40.047 26.097 145 HB ILE 18 HB ILE 18 13.969 42.038 23.815 146 1HG1 ILE 18 HG12 ILE 18 14.556 39.065 23.807 147 2HG1 ILE 18 HG11 ILE 18 12.937 39.728 23.573 148 1HG2 ILE 18 HG23 ILE 18 16.301 40.560 25.047 149 2HG2 ILE 18 HG22 ILE 18 16.327 41.080 23.361 150 3HG2 ILE 18 HG21 ILE 18 16.176 42.273 24.652 151 1HD1 ILE 18 HD12 ILE 18 15.317 40.538 21.894 152 2HD1 ILE 18 HD11 ILE 18 14.207 39.247 21.435 153 3HD1 ILE 18 HD13 ILE 18 13.617 40.900 21.590 154 H GLU 19 HN GLU 19 15.313 40.831 27.753 155 HA GLU 19 HA GLU 19 14.828 43.426 28.875 156 1HB GLU 19 HB2 GLU 19 17.030 41.394 29.320 157 2HB GLU 19 HB1 GLU 19 16.934 42.906 30.222 158 1HG GLU 19 HG2 GLU 19 15.809 41.295 31.577 159 2HG GLU 19 HG1 GLU 19 14.528 42.231 30.814 160 H ASN 20 HN ASN 20 17.431 42.194 26.755 161 HA ASN 20 HA ASN 20 17.929 44.910 25.810 162 1HB ASN 20 HB2 ASN 20 20.242 45.083 26.562 163 2HB ASN 20 HB1 ASN 20 19.188 44.880 27.963 164 1HD2 ASN 20 HD22 ASN 20 22.077 42.469 28.207 165 2HD2 ASN 20 HD21 ASN 20 21.978 44.154 28.027 166 H TYR 21 HN TYR 21 19.574 44.950 24.095 167 HA TYR 21 HA TYR 21 19.820 42.291 22.730 168 1HB TYR 21 HB2 TYR 21 19.868 45.116 21.618 169 2HB TYR 21 HB1 TYR 21 20.120 43.656 20.662 170 HD1 TYR 21 HD1 TYR 21 18.283 42.068 20.270 171 HD2 TYR 21 HD2 TYR 21 17.680 45.706 22.471 172 HE1 TYR 21 HE1 TYR 21 15.827 41.811 20.019 173 HE2 TYR 21 HE2 TYR 21 15.227 45.449 22.228 174 HH TYR 21 HH TYR 21 13.648 44.300 20.651 175 H THR 22 HN THR 22 21.874 41.508 22.397 176 HA THR 22 HA THR 22 24.135 42.890 23.532 177 HB THR 22 HB THR 22 24.290 40.533 23.572 178 HG1 THR 22 HG1 THR 22 25.776 40.928 21.246 179 1HG2 THR 22 HG22 THR 22 23.353 40.720 20.711 180 2HG2 THR 22 HG21 THR 22 24.143 39.265 21.308 181 3HG2 THR 22 HG23 THR 22 22.643 39.820 22.049 182 HA PRO 23 HA PRO 23 25.000 45.355 19.890 183 1HB PRO 23 HB2 PRO 23 27.817 45.589 20.317 184 2HB PRO 23 HB1 PRO 23 26.573 46.738 20.828 185 1HG PRO 23 HG2 PRO 23 28.103 44.846 22.481 186 2HG PRO 23 HG1 PRO 23 27.085 46.197 23.001 187 1HD PRO 23 HD2 PRO 23 26.439 43.422 23.193 188 2HD PRO 23 HD1 PRO 23 25.341 44.793 23.475 189 H ASP 24 HN ASP 24 25.928 42.240 20.470 190 HA ASP 24 HA ASP 24 27.869 41.720 18.424 191 1HB ASP 24 HB2 ASP 24 25.778 39.944 19.720 192 2HB ASP 24 HB1 ASP 24 26.994 39.351 18.587 193 H LEU 25 HN LEU 25 24.312 41.731 18.417 194 HA LEU 25 HA LEU 25 24.387 41.825 15.439 195 1HB LEU 25 HB2 LEU 25 22.620 40.027 17.129 196 2HB LEU 25 HB1 LEU 25 22.422 40.257 15.398 197 HG LEU 25 HG LEU 25 24.966 39.220 16.688 198 1HD1 LEU 25 HD12 LEU 25 22.587 37.790 15.492 199 2HD1 LEU 25 HD11 LEU 25 24.167 37.023 15.660 200 3HD1 LEU 25 HD13 LEU 25 23.294 37.567 17.092 201 1HD2 LEU 25 HD21 LEU 25 24.026 39.633 13.845 202 2HD2 LEU 25 HD23 LEU 25 25.581 40.045 14.568 203 3HD2 LEU 25 HD22 LEU 25 25.197 38.366 14.208 204 HA PRO 26 HA PRO 26 21.512 45.142 16.154 205 1HB PRO 26 HB2 PRO 26 19.819 44.662 13.886 206 2HB PRO 26 HB1 PRO 26 21.179 45.790 13.978 207 1HG PRO 26 HG2 PRO 26 21.050 43.195 12.607 208 2HG PRO 26 HG1 PRO 26 22.291 44.451 12.483 209 1HD PRO 26 HD2 PRO 26 22.557 41.956 13.829 210 2HD PRO 26 HD1 PRO 26 23.678 43.330 13.917 211 H ARG 27 HN ARG 27 19.337 45.414 16.962 212 HA ARG 27 HA ARG 27 18.178 43.066 18.151 213 1HB ARG 27 HB2 ARG 27 16.367 44.587 18.855 214 2HB ARG 27 HB1 ARG 27 17.946 45.314 19.149 215 1HG ARG 27 HG2 ARG 27 17.706 46.476 16.906 216 2HG ARG 27 HG1 ARG 27 16.037 45.905 16.875 217 1HD ARG 27 HD2 ARG 27 16.166 48.193 17.800 218 2HD ARG 27 HD1 ARG 27 15.597 47.049 19.015 219 HE ARG 27 HE ARG 27 18.341 47.111 19.395 220 1HH1 ARG 27 HH21 ARG 27 15.766 49.396 19.247 221 2HH1 ARG 27 HH22 ARG 27 16.527 50.521 20.323 222 1HH2 ARG 27 HH11 ARG 27 19.343 48.552 20.805 223 2HH2 ARG 27 HH12 ARG 27 18.557 50.043 21.204 224 H ALA 28 HN ALA 28 17.589 44.816 15.170 225 HA ALA 28 HA ALA 28 15.007 43.809 14.547 226 1HB ALA 28 HB3 ALA 28 17.333 44.650 12.809 227 2HB ALA 28 HB2 ALA 28 15.786 44.147 12.128 228 3HB ALA 28 HB1 ALA 28 15.866 45.560 13.181 229 H ASP 29 HN ASP 29 18.232 42.404 13.988 230 HA ASP 29 HA ASP 29 17.120 40.089 12.596 231 1HB ASP 29 HB2 ASP 29 19.878 40.721 13.673 232 2HB ASP 29 HB1 ASP 29 19.486 39.205 12.859 233 H VAL 30 HN VAL 30 18.121 40.844 15.907 234 HA VAL 30 HA VAL 30 18.027 38.106 16.836 235 HB VAL 30 HB VAL 30 17.807 40.753 18.295 236 1HG1 VAL 30 HG13 VAL 30 17.872 37.908 19.320 237 2HG1 VAL 30 HG12 VAL 30 18.388 39.268 20.316 238 3HG1 VAL 30 HG11 VAL 30 16.728 39.188 19.729 239 1HG2 VAL 30 HG21 VAL 30 20.045 38.730 17.959 240 2HG2 VAL 30 HG23 VAL 30 19.985 40.349 17.265 241 3HG2 VAL 30 HG22 VAL 30 20.125 40.144 19.011 242 H ASP 31 HN ASP 31 15.677 40.790 16.831 243 HA ASP 31 HA ASP 31 13.604 39.450 18.250 244 1HB ASP 31 HB2 ASP 31 13.563 41.876 17.728 245 2HB ASP 31 HB1 ASP 31 13.351 41.496 16.019 246 H HIS 32 HN HIS 32 14.403 39.506 14.780 247 HA HIS 32 HA HIS 32 12.153 38.034 13.858 248 1HB HIS 32 HB2 HIS 32 13.752 39.192 12.357 249 2HB HIS 32 HB1 HIS 32 14.992 38.015 12.786 250 HD1 HIS 32 HD1 HIS 32 11.355 37.734 11.629 251 HD2 HIS 32 HD2 HIS 32 15.097 36.082 10.829 252 HE1 HIS 32 HE1 HIS 32 11.007 36.028 9.789 253 H ALA 33 HN ALA 33 15.354 36.903 14.962 254 HA ALA 33 HA ALA 33 14.949 34.120 14.523 255 1HB ALA 33 HB3 ALA 33 16.556 35.491 16.698 256 2HB ALA 33 HB2 ALA 33 16.731 33.809 16.201 257 3HB ALA 33 HB1 ALA 33 17.139 35.107 15.080 258 H ILE 34 HN ILE 34 14.316 36.083 17.448 259 HA ILE 34 HA ILE 34 13.312 33.860 18.981 260 HB ILE 34 HB ILE 34 12.781 36.832 19.283 261 1HG1 ILE 34 HG12 ILE 34 15.173 36.363 19.383 262 2HG1 ILE 34 HG11 ILE 34 14.584 36.708 21.004 263 1HG2 ILE 34 HG21 ILE 34 12.393 34.487 21.159 264 2HG2 ILE 34 HG23 ILE 34 12.363 36.170 21.683 265 3HG2 ILE 34 HG22 ILE 34 11.154 35.580 20.544 266 1HD1 ILE 34 HD11 ILE 34 14.291 34.055 21.093 267 2HD1 ILE 34 HD13 ILE 34 15.531 34.117 19.840 268 3HD1 ILE 34 HD12 ILE 34 15.843 34.814 21.429 269 H GLU 35 HN GLU 35 11.661 36.432 17.118 270 HA GLU 35 HA GLU 35 9.010 35.620 17.750 271 1HB GLU 35 HB2 GLU 35 9.558 37.765 16.641 272 2HB GLU 35 HB1 GLU 35 9.998 36.885 15.176 273 1HG GLU 35 HG2 GLU 35 7.706 35.995 15.006 274 2HG GLU 35 HG1 GLU 35 7.266 36.833 16.494 275 H LYS 36 HN LYS 36 11.169 34.555 15.126 276 HA LYS 36 HA LYS 36 9.253 32.940 13.770 277 1HB LYS 36 HB2 LYS 36 11.499 33.568 12.856 278 2HB LYS 36 HB1 LYS 36 12.234 32.427 13.985 279 1HG LYS 36 HG2 LYS 36 10.913 30.591 12.997 280 2HG LYS 36 HG1 LYS 36 10.180 31.729 11.867 281 1HD LYS 36 HD2 LYS 36 12.362 32.215 10.884 282 2HD LYS 36 HD1 LYS 36 13.152 31.163 12.061 283 1HE LYS 36 HE2 LYS 36 12.847 29.969 9.936 284 2HE LYS 36 HE1 LYS 36 11.850 29.240 11.193 285 1HZ LYS 36 HZ3 LYS 36 10.602 31.381 9.684 286 2HZ LYS 36 HZ2 LYS 36 10.924 29.963 8.805 287 3HZ LYS 36 HZ1 LYS 36 9.959 29.898 10.201 288 H ALA 37 HN ALA 37 11.442 32.176 16.477 289 HA ALA 37 HA ALA 37 10.884 29.380 16.543 290 1HB ALA 37 HB2 ALA 37 12.681 30.756 17.823 291 2HB ALA 37 HB1 ALA 37 11.422 30.979 19.040 292 3HB ALA 37 HB3 ALA 37 11.969 29.355 18.621 293 H PHE 38 HN PHE 38 9.328 32.066 18.350 294 HA PHE 38 HA PHE 38 7.483 30.422 19.764 295 1HB PHE 38 HB2 PHE 38 7.446 33.310 18.901 296 2HB PHE 38 HB1 PHE 38 6.053 32.604 19.718 297 HD1 PHE 38 HD2 PHE 38 6.652 31.177 21.887 298 HD2 PHE 38 HD1 PHE 38 9.120 34.279 20.233 299 HE1 PHE 38 HE2 PHE 38 7.753 31.473 24.088 300 HE2 PHE 38 HE1 PHE 38 10.219 34.577 22.439 301 HZ PHE 38 HZ PHE 38 9.534 33.176 24.367 302 H GLN 39 HN GLN 39 7.252 31.919 16.534 303 HA GLN 39 HA GLN 39 4.531 31.231 16.034 304 1HB GLN 39 HB2 GLN 39 6.886 31.555 14.162 305 2HB GLN 39 HB1 GLN 39 5.229 31.318 13.604 306 1HG GLN 39 HG2 GLN 39 4.502 33.350 14.697 307 2HG GLN 39 HG1 GLN 39 6.074 33.548 15.473 308 1HE2 GLN 39 HE22 GLN 39 6.093 35.704 12.437 309 2HE2 GLN 39 HE21 GLN 39 5.216 35.661 13.891 310 H LEU 40 HN LEU 40 7.531 29.383 15.516 311 HA LEU 40 HA LEU 40 6.359 27.201 14.119 312 1HB LEU 40 HB2 LEU 40 8.742 27.309 15.988 313 2HB LEU 40 HB1 LEU 40 8.311 25.878 15.057 314 HG LEU 40 HG LEU 40 8.849 28.602 13.833 315 1HD1 LEU 40 HD11 LEU 40 10.637 26.192 14.250 316 2HD1 LEU 40 HD13 LEU 40 10.998 27.454 13.075 317 3HD1 LEU 40 HD12 LEU 40 10.912 27.847 14.793 318 1HD2 LEU 40 HD23 LEU 40 8.174 25.871 12.740 319 2HD2 LEU 40 HD22 LEU 40 7.610 27.455 12.209 320 3HD2 LEU 40 HD21 LEU 40 9.236 26.920 11.800 321 H TRP 41 HN TRP 41 6.715 27.797 17.611 322 HA TRP 41 HA TRP 41 5.580 25.233 18.352 323 1HB TRP 41 HB2 TRP 41 6.001 27.813 19.881 324 2HB TRP 41 HB1 TRP 41 5.357 26.347 20.619 325 HD1 TRP 41 HD1 TRP 41 8.537 28.030 19.908 326 HE1 TRP 41 HE1 TRP 41 10.522 26.410 20.201 327 HE3 TRP 41 HE3 TRP 41 6.023 23.592 20.128 328 HZ2 TRP 41 HZ2 TRP 41 10.980 23.597 20.500 329 HZ3 TRP 41 HZ3 TRP 41 7.254 21.462 20.418 330 HH2 TRP 41 HH2 TRP 41 9.729 21.459 20.602 331 H SER 42 HN SER 42 4.266 28.515 17.997 332 HA SER 42 HA SER 42 1.633 27.859 18.978 333 1HB SER 42 HB2 SER 42 2.470 30.176 18.873 334 2HB SER 42 HB1 SER 42 2.517 30.086 17.115 335 HG SER 42 HG SER 42 0.582 31.053 18.011 336 H ASN 43 HN ASN 43 3.061 27.929 15.730 337 HA ASN 43 HA ASN 43 0.748 27.603 14.180 338 1HB ASN 43 HB2 ASN 43 3.542 26.519 13.796 339 2HB ASN 43 HB1 ASN 43 2.278 26.344 12.578 340 1HD2 ASN 43 HD22 ASN 43 2.067 30.100 12.421 341 2HD2 ASN 43 HD21 ASN 43 0.988 28.891 12.924 342 H VAL 44 HN VAL 44 2.350 25.212 16.211 343 HA VAL 44 HA VAL 44 0.499 23.098 15.144 344 HB VAL 44 HB VAL 44 2.088 21.530 16.327 345 1HG1 VAL 44 HG11 VAL 44 2.208 22.036 13.890 346 2HG1 VAL 44 HG13 VAL 44 3.318 23.359 14.242 347 3HG1 VAL 44 HG12 VAL 44 3.795 21.694 14.580 348 1HG2 VAL 44 HG23 VAL 44 2.969 23.386 17.845 349 2HG2 VAL 44 HG22 VAL 44 4.200 22.363 17.107 350 3HG2 VAL 44 HG21 VAL 44 3.877 23.968 16.455 351 H THR 45 HN THR 45 0.347 25.310 17.493 352 HA THR 45 HA THR 45 -1.226 23.507 19.236 353 HB THR 45 HB THR 45 -0.172 24.668 21.271 354 HG1 THR 45 HG1 THR 45 0.912 26.148 19.624 355 1HG2 THR 45 HG23 THR 45 1.507 22.816 19.563 356 2HG2 THR 45 HG22 THR 45 1.758 23.114 21.278 357 3HG2 THR 45 HG21 THR 45 0.280 22.329 20.730 358 HA PRO 46 HA PRO 46 -3.860 27.102 19.180 359 1HB PRO 46 HB2 PRO 46 -5.098 26.775 21.709 360 2HB PRO 46 HB1 PRO 46 -5.656 26.067 20.187 361 1HG PRO 46 HG2 PRO 46 -4.305 24.739 22.456 362 2HG PRO 46 HG1 PRO 46 -5.230 24.013 21.131 363 1HD PRO 46 HD2 PRO 46 -2.398 23.984 21.404 364 2HD PRO 46 HD1 PRO 46 -3.327 23.538 19.954 365 H LEU 47 HN LEU 47 -1.209 26.745 21.092 366 HA LEU 47 HA LEU 47 -1.591 28.876 23.021 367 1HB LEU 47 HB2 LEU 47 0.950 27.604 21.956 368 2HB LEU 47 HB1 LEU 47 0.863 28.659 23.363 369 HG LEU 47 HG LEU 47 -0.693 26.070 23.105 370 1HD1 LEU 47 HD13 LEU 47 1.766 25.685 23.081 371 2HD1 LEU 47 HD12 LEU 47 1.901 26.586 24.592 372 3HD1 LEU 47 HD11 LEU 47 1.007 25.066 24.547 373 1HD2 LEU 47 HD22 LEU 47 -0.232 28.080 25.318 374 2HD2 LEU 47 HD21 LEU 47 -1.751 27.380 24.763 375 3HD2 LEU 47 HD23 LEU 47 -0.622 26.405 25.699 376 H THR 48 HN THR 48 -0.833 31.015 22.918 377 HA THR 48 HA THR 48 0.151 31.966 20.239 378 HB THR 48 HB THR 48 -1.248 33.992 20.549 379 HG1 THR 48 HG1 THR 48 -1.357 33.791 22.848 380 1HG2 THR 48 HG21 THR 48 -2.782 31.385 20.705 381 2HG2 THR 48 HG23 THR 48 -3.430 32.917 20.122 382 3HG2 THR 48 HG22 THR 48 -2.131 32.116 19.237 383 H PHE 49 HN PHE 49 1.694 33.634 20.344 384 HA PHE 49 HA PHE 49 2.628 34.388 23.103 385 1HB PHE 49 HB2 PHE 49 4.212 33.841 20.581 386 2HB PHE 49 HB1 PHE 49 4.899 34.583 22.027 387 HD1 PHE 49 HD2 PHE 49 5.174 33.320 24.092 388 HD2 PHE 49 HD1 PHE 49 3.498 31.491 20.588 389 HE1 PHE 49 HE2 PHE 49 5.469 31.085 25.120 390 HE2 PHE 49 HE1 PHE 49 3.795 29.252 21.618 391 HZ PHE 49 HZ PHE 49 4.782 29.049 23.884 392 H THR 50 HN THR 50 2.719 36.537 23.497 393 HA THR 50 HA THR 50 2.587 38.441 21.179 394 HB THR 50 HB THR 50 1.246 38.717 23.887 395 HG1 THR 50 HG1 THR 50 -0.345 38.767 21.717 396 1HG2 THR 50 HG21 THR 50 1.264 40.471 21.419 397 2HG2 THR 50 HG23 THR 50 0.170 40.690 22.784 398 3HG2 THR 50 HG22 THR 50 1.909 40.877 23.009 399 H LYS 51 HN LYS 51 4.196 39.947 21.181 400 HA LYS 51 HA LYS 51 6.161 39.954 23.342 401 1HB LYS 51 HB2 LYS 51 6.706 40.315 20.886 402 2HB LYS 51 HB1 LYS 51 5.951 41.903 21.030 403 1HG LYS 51 HG2 LYS 51 7.530 42.504 22.822 404 2HG LYS 51 HG1 LYS 51 8.282 40.914 22.699 405 1HD LYS 51 HD2 LYS 51 8.840 41.399 20.318 406 2HD LYS 51 HD1 LYS 51 8.174 43.021 20.522 407 1HE LYS 51 HE2 LYS 51 10.529 43.244 20.859 408 2HE LYS 51 HE1 LYS 51 9.808 43.299 22.468 409 1HZ LYS 51 HZ2 LYS 51 10.178 40.734 22.336 410 2HZ LYS 51 HZ1 LYS 51 11.363 41.162 21.197 411 3HZ LYS 51 HZ3 LYS 51 11.453 41.766 22.779 412 H VAL 52 HN VAL 52 6.358 41.511 24.973 413 HA VAL 52 HA VAL 52 4.308 43.719 24.991 414 HB VAL 52 HB VAL 52 4.266 43.480 27.464 415 1HG1 VAL 52 HG11 VAL 52 3.590 41.072 25.764 416 2HG1 VAL 52 HG13 VAL 52 3.118 41.197 27.458 417 3HG1 VAL 52 HG12 VAL 52 2.513 42.368 26.286 418 1HG2 VAL 52 HG21 VAL 52 6.101 41.150 26.840 419 2HG2 VAL 52 HG23 VAL 52 6.414 42.510 27.919 420 3HG2 VAL 52 HG22 VAL 52 5.219 41.292 28.361 421 H SER 53 HN SER 53 5.124 45.728 25.250 422 HA SER 53 HA SER 53 8.046 46.021 25.705 423 1HB SER 53 HB2 SER 53 6.681 47.217 23.844 424 2HB SER 53 HB1 SER 53 6.103 48.266 25.137 425 HG SER 53 HG SER 53 8.821 47.811 25.133 426 H GLU 54 HN GLU 54 5.239 45.990 27.537 427 HA GLU 54 HA GLU 54 6.617 47.324 29.790 428 1HB GLU 54 HB2 GLU 54 5.253 49.064 28.499 429 2HB GLU 54 HB1 GLU 54 3.820 48.170 29.010 430 1HG GLU 54 HG2 GLU 54 4.439 48.475 31.362 431 2HG GLU 54 HG1 GLU 54 5.904 49.328 30.878 432 H GLY 55 HN GLY 55 5.556 46.831 31.843 433 1HA GLY 55 HA2 GLY 55 4.094 45.573 33.253 434 2HA GLY 55 HA1 GLY 55 3.394 44.818 31.819 435 H GLN 56 HN GLN 56 3.852 42.979 33.584 436 HA GLN 56 HA GLN 56 6.622 41.986 33.520 437 1HB GLN 56 HB2 GLN 56 4.050 40.871 34.674 438 2HB GLN 56 HB1 GLN 56 5.598 40.034 34.776 439 1HG GLN 56 HG2 GLN 56 6.574 41.835 36.048 440 2HG GLN 56 HG1 GLN 56 5.167 42.863 35.770 441 1HE2 GLN 56 HE22 GLN 56 4.911 41.152 39.146 442 2HE2 GLN 56 HE21 GLN 56 6.143 42.069 38.422 443 H ALA 57 HN ALA 57 7.365 40.306 32.231 444 HA ALA 57 HA ALA 57 5.487 39.300 30.122 445 1HB ALA 57 HB2 ALA 57 7.554 40.534 29.395 446 2HB ALA 57 HB1 ALA 57 8.521 39.263 30.145 447 3HB ALA 57 HB3 ALA 57 7.467 38.881 28.784 448 H ASP 58 HN ASP 58 5.136 37.102 29.948 449 HA ASP 58 HA ASP 58 5.637 35.407 32.178 450 1HB ASP 58 HB2 ASP 58 4.908 34.789 29.308 451 2HB ASP 58 HB1 ASP 58 5.003 33.551 30.561 452 H ILE 59 HN ILE 59 7.386 35.755 29.091 453 HA ILE 59 HA ILE 59 9.584 34.055 30.245 454 HB ILE 59 HB ILE 59 8.828 34.446 27.333 455 1HG1 ILE 59 HG12 ILE 59 8.654 31.954 29.052 456 2HG1 ILE 59 HG11 ILE 59 7.280 33.016 28.738 457 1HG2 ILE 59 HG22 ILE 59 10.983 32.827 28.715 458 2HG2 ILE 59 HG21 ILE 59 10.520 32.594 27.030 459 3HG2 ILE 59 HG23 ILE 59 11.212 34.132 27.550 460 1HD1 ILE 59 HD11 ILE 59 8.929 31.778 26.523 461 2HD1 ILE 59 HD13 ILE 59 7.478 31.016 27.174 462 3HD1 ILE 59 HD12 ILE 59 7.370 32.587 26.380 463 H MET 60 HN MET 60 11.290 35.306 30.785 464 HA MET 60 HA MET 60 11.760 37.852 29.288 465 1HB MET 60 HB2 MET 60 12.771 36.853 31.959 466 2HB MET 60 HB1 MET 60 13.350 38.329 31.186 467 1HG MET 60 HG2 MET 60 11.030 39.194 31.134 468 2HG MET 60 HG1 MET 60 10.480 37.737 31.963 469 1HE MET 60 HE1 MET 60 9.675 40.325 33.155 470 2HE MET 60 HE3 MET 60 10.809 41.226 34.172 471 3HE MET 60 HE2 MET 60 11.014 41.205 32.423 472 H ILE 61 HN ILE 61 13.597 38.113 28.073 473 HA ILE 61 HA ILE 61 15.570 35.842 28.020 474 HB ILE 61 HB ILE 61 14.638 37.668 25.781 475 1HG1 ILE 61 HG12 ILE 61 14.503 34.649 26.077 476 2HG1 ILE 61 HG11 ILE 61 13.163 35.733 26.447 477 1HG2 ILE 61 HG23 ILE 61 16.922 35.702 25.986 478 2HG2 ILE 61 HG22 ILE 61 16.188 36.088 24.431 479 3HG2 ILE 61 HG21 ILE 61 16.953 37.356 25.384 480 1HD1 ILE 61 HD12 ILE 61 14.535 35.493 23.750 481 2HD1 ILE 61 HD11 ILE 61 12.957 34.820 24.160 482 3HD1 ILE 61 HD13 ILE 61 13.189 36.568 24.125 483 H SER 62 HN SER 62 17.687 36.407 28.397 484 HA SER 62 HA SER 62 18.483 39.267 28.133 485 1HB SER 62 HB2 SER 62 19.373 39.360 30.370 486 2HB SER 62 HB1 SER 62 17.700 38.823 30.496 487 HG SER 62 HG SER 62 18.889 37.432 31.716 488 H PHE 63 HN PHE 63 20.764 39.563 28.041 489 HA PHE 63 HA PHE 63 22.302 37.098 27.288 490 1HB PHE 63 HB2 PHE 63 22.499 39.989 26.387 491 2HB PHE 63 HB1 PHE 63 23.720 38.779 26.010 492 HD1 PHE 63 HD1 PHE 63 20.200 39.783 25.480 493 HD2 PHE 63 HD2 PHE 63 23.305 37.010 24.409 494 HE1 PHE 63 HE1 PHE 63 18.834 38.989 23.566 495 HE2 PHE 63 HE2 PHE 63 21.937 36.215 22.496 496 HZ PHE 63 HZ PHE 63 19.701 37.205 22.074 497 H VAL 64 HN VAL 64 24.113 36.653 28.537 498 HA VAL 64 HA VAL 64 25.112 38.811 30.385 499 HB VAL 64 HB VAL 64 25.391 37.097 32.127 500 1HG1 VAL 64 HG13 VAL 64 22.604 37.215 30.931 501 2HG1 VAL 64 HG12 VAL 64 22.975 36.735 32.586 502 3HG1 VAL 64 HG11 VAL 64 23.296 38.386 32.052 503 1HG2 VAL 64 HG21 VAL 64 24.108 35.308 30.038 504 2HG2 VAL 64 HG23 VAL 64 25.710 35.123 30.747 505 3HG2 VAL 64 HG22 VAL 64 24.273 34.865 31.737 506 H ARG 65 HN ARG 65 27.328 38.482 31.138 507 HA ARG 65 HA ARG 65 29.004 36.823 29.272 508 1HB ARG 65 HB2 ARG 65 29.505 39.606 30.369 509 2HB ARG 65 HB1 ARG 65 30.751 38.628 29.596 510 1HG ARG 65 HG2 ARG 65 29.428 38.506 27.550 511 2HG ARG 65 HG1 ARG 65 28.136 39.434 28.304 512 1HD ARG 65 HD2 ARG 65 30.975 40.399 27.872 513 2HD ARG 65 HD1 ARG 65 29.604 40.857 26.868 514 HE ARG 65 HE ARG 65 30.386 42.037 29.381 515 1HH1 ARG 65 HH21 ARG 65 27.559 40.999 27.679 516 2HH1 ARG 65 HH22 ARG 65 26.482 41.930 28.663 517 1HH2 ARG 65 HH11 ARG 65 28.991 43.253 30.644 518 2HH2 ARG 65 HH12 ARG 65 27.289 43.209 30.327 519 H GLY 66 HN GLY 66 30.482 35.516 30.273 520 1HA GLY 66 HA2 GLY 66 31.463 34.336 32.056 521 2HA GLY 66 HA1 GLY 66 31.971 35.944 32.564 522 H ASP 67 HN ASP 67 31.697 35.688 34.770 523 HA ASP 67 HA ASP 67 29.395 34.438 35.967 524 1HB ASP 67 HB2 ASP 67 31.645 34.765 37.076 525 2HB ASP 67 HB1 ASP 67 31.236 36.473 37.252 526 H HIS 68 HN HIS 68 27.414 35.283 36.361 527 HA HIS 68 HA HIS 68 27.057 38.251 36.380 528 1HB HIS 68 HB2 HIS 68 24.924 37.844 35.055 529 2HB HIS 68 HB1 HIS 68 26.426 37.627 34.156 530 HD1 HIS 68 HD1 HIS 68 27.346 34.950 34.413 531 HD2 HIS 68 HD2 HIS 68 23.253 35.696 34.668 532 HE1 HIS 68 HE1 HIS 68 26.186 32.746 33.955 533 H ARG 69 HN ARG 69 27.151 37.094 38.739 534 HA ARG 69 HA ARG 69 25.974 36.637 40.702 535 1HB ARG 69 HB2 ARG 69 23.828 38.065 39.111 536 2HB ARG 69 HB1 ARG 69 23.630 37.593 40.797 537 1HG ARG 69 HG2 ARG 69 25.680 38.877 41.362 538 2HG ARG 69 HG1 ARG 69 25.782 39.417 39.689 539 1HD ARG 69 HD2 ARG 69 23.448 40.350 39.942 540 2HD ARG 69 HD1 ARG 69 23.547 39.999 41.663 541 HE ARG 69 HE ARG 69 24.649 42.282 40.314 542 1HH1 ARG 69 HH21 ARG 69 25.473 39.952 42.731 543 2HH1 ARG 69 HH22 ARG 69 26.792 40.886 43.351 544 1HH2 ARG 69 HH11 ARG 69 26.346 43.502 41.131 545 2HH2 ARG 69 HH12 ARG 69 27.280 42.889 42.455 546 H ASP 70 HN ASP 70 26.231 34.383 39.267 547 HA ASP 70 HA ASP 70 23.657 32.985 39.786 548 1HB ASP 70 HB2 ASP 70 25.133 33.048 37.149 549 2HB ASP 70 HB1 ASP 70 24.150 31.653 37.591 550 H ASN 71 HN ASN 71 23.986 30.605 39.920 551 HA ASN 71 HA ASN 71 26.568 30.024 41.235 552 1HB ASN 71 HB2 ASN 71 24.414 29.344 42.282 553 2HB ASN 71 HB1 ASN 71 24.112 28.276 40.910 554 1HD2 ASN 71 HD22 ASN 71 25.830 25.715 42.613 555 2HD2 ASN 71 HD21 ASN 71 24.423 26.202 41.799 556 H SER 72 HN SER 72 25.780 30.077 38.110 557 HA SER 72 HA SER 72 27.495 27.700 37.485 558 1HB SER 72 HB2 SER 72 25.042 27.214 37.089 559 2HB SER 72 HB1 SER 72 25.054 28.492 35.878 560 HG SER 72 HG SER 72 27.149 26.948 35.425 561 HA PRO 73 HA PRO 73 28.818 31.711 35.448 562 1HB PRO 73 HB2 PRO 73 31.548 30.963 36.160 563 2HB PRO 73 HB1 PRO 73 30.628 32.381 36.686 564 1HG PRO 73 HG2 PRO 73 31.309 30.101 38.281 565 2HG PRO 73 HG1 PRO 73 30.253 31.445 38.742 566 1HD PRO 73 HD2 PRO 73 29.492 28.704 38.069 567 2HD PRO 73 HD1 PRO 73 28.467 30.014 38.684 568 H PHE 74 HN PHE 74 29.839 31.747 33.363 569 HA PHE 74 HA PHE 74 29.942 29.165 32.016 570 1HB PHE 74 HB2 PHE 74 30.536 31.993 31.107 571 2HB PHE 74 HB1 PHE 74 30.657 30.594 30.041 572 HD1 PHE 74 HD2 PHE 74 28.361 32.739 31.968 573 HD2 PHE 74 HD1 PHE 74 28.682 29.350 29.352 574 HE1 PHE 74 HE2 PHE 74 25.909 32.800 31.588 575 HE2 PHE 74 HE1 PHE 74 26.235 29.411 28.967 576 HZ PHE 74 HZ PHE 74 24.846 31.136 30.084 577 H ASP 75 HN ASP 75 31.739 27.944 31.635 578 HA ASP 75 HA ASP 75 34.354 28.973 32.618 579 1HB ASP 75 HB2 ASP 75 33.459 26.745 33.395 580 2HB ASP 75 HB1 ASP 75 33.626 26.165 31.736 581 H GLY 76 HN GLY 76 34.076 30.344 30.470 582 1HA GLY 76 HA2 GLY 76 35.187 30.798 28.447 583 2HA GLY 76 HA1 GLY 76 35.949 29.212 28.558 584 HA PRO 77 HA PRO 77 32.649 29.306 25.198 585 1HB PRO 77 HB2 PRO 77 34.581 28.071 23.421 586 2HB PRO 77 HB1 PRO 77 33.849 29.675 23.283 587 1HG PRO 77 HG2 PRO 77 36.568 29.055 24.025 588 2HG PRO 77 HG1 PRO 77 35.817 30.656 23.930 589 1HD PRO 77 HD2 PRO 77 36.544 29.168 26.318 590 2HD PRO 77 HD1 PRO 77 35.847 30.797 26.218 591 H GLY 78 HN GLY 78 34.201 27.193 27.170 592 1HA GLY 78 HA2 GLY 78 33.287 24.711 25.804 593 2HA GLY 78 HA1 GLY 78 34.297 24.780 27.249 594 H GLY 79 HN GLY 79 32.248 23.078 27.437 595 1HA GLY 79 HA2 GLY 79 30.551 22.577 29.006 596 2HA GLY 79 HA1 GLY 79 30.630 24.250 29.560 597 H ASN 80 HN ASN 80 28.252 24.190 29.556 598 HA ASN 80 HA ASN 80 26.776 23.811 27.101 599 1HB ASN 80 HB2 ASN 80 26.047 25.186 29.703 600 2HB ASN 80 HB1 ASN 80 24.911 24.909 28.383 601 1HD2 ASN 80 HD22 ASN 80 25.149 21.264 28.814 602 2HD2 ASN 80 HD21 ASN 80 25.255 22.392 27.550 603 H LEU 81 HN LEU 81 25.790 25.465 25.801 604 HA LEU 81 HA LEU 81 27.426 27.930 25.610 605 1HB LEU 81 HB2 LEU 81 25.117 27.084 23.844 606 2HB LEU 81 HB1 LEU 81 26.407 28.223 23.459 607 HG LEU 81 HG LEU 81 26.736 25.241 23.914 608 1HD1 LEU 81 HD11 LEU 81 25.680 25.885 21.764 609 2HD1 LEU 81 HD13 LEU 81 27.046 26.947 21.427 610 3HD1 LEU 81 HD12 LEU 81 27.289 25.201 21.526 611 1HD2 LEU 81 HD22 LEU 81 28.717 27.464 23.366 612 2HD2 LEU 81 HD21 LEU 81 28.747 26.289 24.682 613 3HD2 LEU 81 HD23 LEU 81 29.085 25.775 23.031 614 H ALA 82 HN ALA 82 24.661 26.964 27.196 615 HA ALA 82 HA ALA 82 23.952 29.609 28.035 616 1HB ALA 82 HB1 ALA 82 22.273 28.354 25.852 617 2HB ALA 82 HB3 ALA 82 21.623 29.573 26.951 618 3HB ALA 82 HB2 ALA 82 22.972 29.971 25.886 619 H HIS 83 HN HIS 83 21.516 29.417 29.012 620 HA HIS 83 HA HIS 83 20.723 26.764 29.843 621 1HB HIS 83 HB2 HIS 83 21.301 26.928 32.213 622 2HB HIS 83 HB1 HIS 83 22.764 27.041 31.238 623 HD1 HIS 83 HD1 HIS 83 21.900 28.395 34.174 624 HD2 HIS 83 HD2 HIS 83 22.639 30.281 30.531 625 HE1 HIS 83 HE1 HIS 83 22.517 30.790 34.715 626 H ALA 84 HN ALA 84 18.872 26.902 31.411 627 HA ALA 84 HA ALA 84 17.660 29.612 31.641 628 1HB ALA 84 HB2 ALA 84 16.890 28.506 29.484 629 2HB ALA 84 HB1 ALA 84 16.136 27.264 30.480 630 3HB ALA 84 HB3 ALA 84 15.598 28.940 30.601 631 H PHE 85 HN PHE 85 15.858 29.626 33.187 632 HA PHE 85 HA PHE 85 16.272 27.604 35.321 633 1HB PHE 85 HB2 PHE 85 14.738 30.220 35.241 634 2HB PHE 85 HB1 PHE 85 14.807 29.162 36.650 635 HD1 PHE 85 HD2 PHE 85 16.717 31.432 34.475 636 HD2 PHE 85 HD1 PHE 85 16.882 28.882 37.925 637 HE1 PHE 85 HE2 PHE 85 18.886 32.446 35.119 638 HE2 PHE 85 HE1 PHE 85 19.053 29.895 38.569 639 HZ PHE 85 HZ PHE 85 20.053 31.678 37.166 640 H GLN 86 HN GLN 86 14.432 26.511 36.277 641 HA GLN 86 HA GLN 86 12.656 25.366 34.389 642 1HB GLN 86 HB2 GLN 86 12.601 25.480 37.409 643 2HB GLN 86 HB1 GLN 86 11.433 24.543 36.480 644 1HG GLN 86 HG2 GLN 86 14.406 24.210 36.061 645 2HG GLN 86 HG1 GLN 86 13.550 23.323 37.319 646 1HE2 GLN 86 HE22 GLN 86 13.513 21.699 33.764 647 2HE2 GLN 86 HE21 GLN 86 14.735 22.670 34.430 648 HA PRO 87 HA PRO 87 9.407 28.373 34.040 649 1HB PRO 87 HB2 PRO 87 7.211 26.498 34.218 650 2HB PRO 87 HB1 PRO 87 7.898 27.223 32.757 651 1HG PRO 87 HG2 PRO 87 8.223 24.489 33.737 652 2HG PRO 87 HG1 PRO 87 8.757 25.175 32.195 653 1HD PRO 87 HD2 PRO 87 10.429 24.450 34.392 654 2HD PRO 87 HD1 PRO 87 10.913 25.353 32.941 655 H GLY 88 HN GLY 88 9.412 29.514 35.982 656 1HA GLY 88 HA2 GLY 88 7.415 28.730 37.981 657 2HA GLY 88 HA1 GLY 88 9.073 28.762 38.583 658 HA PRO 89 HA PRO 89 7.030 33.079 38.443 659 1HB PRO 89 HB2 PRO 89 7.117 33.315 41.302 660 2HB PRO 89 HB1 PRO 89 5.672 33.154 40.292 661 1HG PRO 89 HG2 PRO 89 6.921 31.135 42.023 662 2HG PRO 89 HG1 PRO 89 5.339 31.084 41.230 663 1HD PRO 89 HD2 PRO 89 7.653 29.595 40.474 664 2HD PRO 89 HD1 PRO 89 6.144 29.752 39.551 665 H GLY 90 HN GLY 90 8.214 35.052 39.382 666 1HA GLY 90 HA2 GLY 90 10.184 36.205 39.920 667 2HA GLY 90 HA1 GLY 90 10.770 34.722 40.666 668 H ILE 91 HN ILE 91 12.669 34.130 39.774 669 HA ILE 91 HA ILE 91 13.435 35.020 37.105 670 HB ILE 91 HB ILE 91 14.996 34.859 39.067 671 1HG1 ILE 91 HG12 ILE 91 15.851 33.159 36.708 672 2HG1 ILE 91 HG11 ILE 91 15.733 34.918 36.656 673 1HG2 ILE 91 HG21 ILE 91 14.161 32.670 39.913 674 2HG2 ILE 91 HG23 ILE 91 14.866 31.878 38.504 675 3HG2 ILE 91 HG22 ILE 91 15.907 32.682 39.675 676 1HD1 ILE 91 HD13 ILE 91 17.283 34.975 38.666 677 2HD1 ILE 91 HD12 ILE 91 17.547 33.250 38.411 678 3HD1 ILE 91 HD11 ILE 91 18.018 34.410 37.168 679 H GLY 92 HN GLY 92 11.665 32.370 38.211 680 1HA GLY 92 HA2 GLY 92 12.644 30.246 36.597 681 2HA GLY 92 HA1 GLY 92 10.971 30.404 37.129 682 H GLY 93 HN GLY 93 12.387 29.763 34.439 683 1HA GLY 93 HA2 GLY 93 11.433 29.902 32.257 684 2HA GLY 93 HA1 GLY 93 10.460 31.273 32.788 685 H ASP 94 HN ASP 94 13.157 32.356 33.974 686 HA ASP 94 HA ASP 94 13.726 34.110 31.775 687 1HB ASP 94 HB2 ASP 94 15.266 33.512 34.314 688 2HB ASP 94 HB1 ASP 94 15.764 34.740 33.148 689 H ALA 95 HN ALA 95 14.938 33.737 30.002 690 HA ALA 95 HA ALA 95 16.704 31.326 29.943 691 1HB ALA 95 HB1 ALA 95 15.484 33.034 27.756 692 2HB ALA 95 HB3 ALA 95 16.652 31.750 27.448 693 3HB ALA 95 HB2 ALA 95 15.084 31.364 28.156 694 H HIS 96 HN HIS 96 18.894 31.599 29.911 695 HA HIS 96 HA HIS 96 19.981 34.366 29.463 696 1HB HIS 96 HB2 HIS 96 20.903 32.056 31.178 697 2HB HIS 96 HB1 HIS 96 21.985 33.382 30.756 698 HD2 HIS 96 HD2 HIS 96 18.262 34.503 31.648 699 HE1 HIS 96 HE1 HIS 96 20.940 35.266 34.864 700 HE2 HIS 96 HE2 HIS 96 18.597 35.644 33.981 701 H PHE 97 HN PHE 97 21.516 34.630 27.874 702 HA PHE 97 HA PHE 97 22.375 32.176 26.358 703 1HB PHE 97 HB2 PHE 97 21.840 35.008 25.440 704 2HB PHE 97 HB1 PHE 97 22.654 33.807 24.438 705 HD1 PHE 97 HD1 PHE 97 19.534 34.378 26.420 706 HD2 PHE 97 HD2 PHE 97 21.403 32.259 23.186 707 HE1 PHE 97 HE1 PHE 97 17.332 33.432 25.768 708 HE2 PHE 97 HE2 PHE 97 19.204 31.316 22.530 709 HZ PHE 97 HZ PHE 97 17.166 31.904 23.821 710 H ASP 98 HN ASP 98 24.543 31.861 26.035 711 HA ASP 98 HA ASP 98 26.455 33.365 27.590 712 1HB ASP 98 HB2 ASP 98 26.758 30.978 26.991 713 2HB ASP 98 HB1 ASP 98 26.913 31.426 25.292 714 H GLU 99 HN GLU 99 26.592 35.517 27.009 715 HA GLU 99 HA GLU 99 26.611 36.369 24.226 716 1HB GLU 99 HB2 GLU 99 25.724 37.697 26.176 717 2HB GLU 99 HB1 GLU 99 27.386 37.967 26.664 718 1HG GLU 99 HG2 GLU 99 27.889 39.114 24.597 719 2HG GLU 99 HG1 GLU 99 26.317 38.683 23.925 720 H ASP 100 HN ASP 100 29.012 35.061 26.235 721 HA ASP 100 HA ASP 100 31.245 36.649 25.224 722 1HB ASP 100 HB2 ASP 100 31.123 33.981 26.664 723 2HB ASP 100 HB1 ASP 100 32.631 34.769 26.206 724 H GLU 101 HN GLU 101 29.298 34.165 24.003 725 HA GLU 101 HA GLU 101 31.330 33.096 22.138 726 1HB GLU 101 HB2 GLU 101 28.396 32.497 22.603 727 2HB GLU 101 HB1 GLU 101 29.359 31.720 21.345 728 1HG GLU 101 HG2 GLU 101 30.837 30.742 22.948 729 2HG GLU 101 HG1 GLU 101 30.179 31.727 24.254 730 H ARG 102 HN ARG 102 31.003 33.254 19.802 731 HA ARG 102 HA ARG 102 29.800 35.850 19.026 732 1HB ARG 102 HB2 ARG 102 32.061 35.256 18.199 733 2HB ARG 102 HB1 ARG 102 31.388 33.835 17.401 734 1HG ARG 102 HG2 ARG 102 29.969 35.260 15.996 735 2HG ARG 102 HG1 ARG 102 30.567 36.699 16.825 736 1HD ARG 102 HD2 ARG 102 31.762 36.381 14.705 737 2HD ARG 102 HD1 ARG 102 32.862 36.167 16.066 738 HE ARG 102 HE ARG 102 31.937 33.603 15.529 739 1HH1 ARG 102 HH21 ARG 102 33.445 36.166 13.782 740 2HH1 ARG 102 HH22 ARG 102 34.239 35.113 12.660 741 1HH2 ARG 102 HH11 ARG 102 32.973 32.212 14.079 742 2HH2 ARG 102 HH12 ARG 102 33.981 32.873 12.835 743 H TRP 103 HN TRP 103 27.611 35.685 18.721 744 HA TRP 103 HA TRP 103 26.431 33.217 17.629 745 1HB TRP 103 HB2 TRP 103 25.195 35.868 18.429 746 2HB TRP 103 HB1 TRP 103 24.282 34.449 17.915 747 HD1 TRP 103 HD1 TRP 103 25.612 36.052 20.924 748 HE1 TRP 103 HE1 TRP 103 25.584 34.426 22.925 749 HE3 TRP 103 HE3 TRP 103 24.771 31.659 18.473 750 HZ2 TRP 103 HZ2 TRP 103 25.249 31.629 23.422 751 HZ3 TRP 103 HZ3 TRP 103 24.607 29.529 19.726 752 HH2 TRP 103 HH2 TRP 103 24.844 29.505 22.198 753 H THR 104 HN THR 104 25.306 33.118 15.638 754 HA THR 104 HA THR 104 25.731 35.396 13.734 755 HB THR 104 HB THR 104 26.468 33.898 12.021 756 HG1 THR 104 HG1 THR 104 25.139 32.182 12.342 757 1HG2 THR 104 HG21 THR 104 28.106 34.450 13.901 758 2HG2 THR 104 HG23 THR 104 27.789 32.830 14.521 759 3HG2 THR 104 HG22 THR 104 28.504 33.040 12.924 760 H ASN 105 HN ASN 105 24.186 35.331 11.927 761 HA ASN 105 HA ASN 105 21.614 33.972 12.674 762 1HB ASN 105 HB2 ASN 105 22.109 36.505 11.078 763 2HB ASN 105 HB1 ASN 105 20.526 35.796 11.395 764 1HD2 ASN 105 HD22 ASN 105 20.903 36.497 15.022 765 2HD2 ASN 105 HD21 ASN 105 20.588 35.132 14.064 766 H ASN 106 HN ASN 106 23.932 32.939 10.994 767 HA ASN 106 HA ASN 106 22.273 32.205 8.629 768 1HB ASN 106 HB2 ASN 106 24.266 32.565 7.147 769 2HB ASN 106 HB1 ASN 106 23.606 34.054 7.823 770 1HD2 ASN 106 HD21 ASN 106 25.034 32.488 10.376 771 2HD2 ASN 106 HD22 ASN 106 26.567 33.209 10.326 772 H PHE 107 HN PHE 107 24.227 30.759 7.269 773 HA PHE 107 HA PHE 107 24.266 28.320 8.819 774 1HB PHE 107 HB2 PHE 107 25.717 28.954 6.234 775 2HB PHE 107 HB1 PHE 107 25.356 27.348 6.867 776 HD1 PHE 107 HD2 PHE 107 23.074 26.464 6.844 777 HD2 PHE 107 HD1 PHE 107 23.966 30.367 5.293 778 HE1 PHE 107 HE2 PHE 107 20.850 26.534 5.742 779 HE2 PHE 107 HE1 PHE 107 21.746 30.441 4.192 780 HZ PHE 107 HZ PHE 107 20.188 28.524 4.416 781 H ARG 108 HN ARG 108 26.099 30.881 9.459 782 HA ARG 108 HA ARG 108 28.781 29.985 9.269 783 1HB ARG 108 HB2 ARG 108 27.433 31.799 11.268 784 2HB ARG 108 HB1 ARG 108 29.166 31.493 11.299 785 1HG ARG 108 HG2 ARG 108 27.836 32.405 8.752 786 2HG ARG 108 HG1 ARG 108 28.262 33.581 9.992 787 1HD ARG 108 HD2 ARG 108 30.599 32.931 9.881 788 2HD ARG 108 HD1 ARG 108 30.233 31.616 8.775 789 HE ARG 108 HE ARG 108 29.262 33.899 7.504 790 1HH1 ARG 108 HH21 ARG 108 32.249 32.794 8.835 791 2HH1 ARG 108 HH22 ARG 108 33.227 33.714 7.740 792 1HH2 ARG 108 HH11 ARG 108 30.527 35.100 6.065 793 2HH2 ARG 108 HH12 ARG 108 32.254 35.019 6.177 794 H GLU 109 HN GLU 109 29.837 29.900 11.804 795 HA GLU 109 HA GLU 109 29.645 27.170 12.440 796 1HB GLU 109 HB2 GLU 109 30.607 29.509 14.090 797 2HB GLU 109 HB1 GLU 109 30.806 27.825 14.582 798 1HG GLU 109 HG2 GLU 109 32.024 27.354 12.489 799 2HG GLU 109 HG1 GLU 109 31.832 29.038 11.999 800 H TYR 110 HN TYR 110 28.306 29.848 14.469 801 HA TYR 110 HA TYR 110 26.488 27.797 15.712 802 1HB TYR 110 HB2 TYR 110 27.513 30.437 16.777 803 2HB TYR 110 HB1 TYR 110 26.345 29.407 17.607 804 HD1 TYR 110 HD2 TYR 110 27.011 26.922 17.944 805 HD2 TYR 110 HD1 TYR 110 29.823 30.057 17.096 806 HE1 TYR 110 HE2 TYR 110 28.843 25.512 18.829 807 HE2 TYR 110 HE1 TYR 110 31.665 28.644 17.975 808 HH TYR 110 HH TYR 110 31.652 26.539 19.807 809 H ASN 111 HN ASN 111 24.350 27.980 15.461 810 HA ASN 111 HA ASN 111 23.253 30.417 14.132 811 1HB ASN 111 HB2 ASN 111 22.754 28.260 13.058 812 2HB ASN 111 HB1 ASN 111 22.056 27.665 14.564 813 1HD2 ASN 111 HD22 ASN 111 19.942 30.878 13.217 814 2HD2 ASN 111 HD21 ASN 111 21.593 31.021 13.585 815 H LEU 112 HN LEU 112 22.324 31.877 15.473 816 HA LEU 112 HA LEU 112 21.879 31.471 18.243 817 1HB LEU 112 HB2 LEU 112 22.117 33.702 17.216 818 2HB LEU 112 HB1 LEU 112 20.582 33.484 16.380 819 HG LEU 112 HG LEU 112 19.421 33.324 18.564 820 1HD1 LEU 112 HD13 LEU 112 22.248 33.571 19.581 821 2HD1 LEU 112 HD12 LEU 112 20.910 34.185 20.555 822 3HD1 LEU 112 HD11 LEU 112 20.967 32.482 20.111 823 1HD2 LEU 112 HD22 LEU 112 19.778 35.517 17.383 824 2HD2 LEU 112 HD21 LEU 112 19.579 35.673 19.128 825 3HD2 LEU 112 HD23 LEU 112 21.188 35.782 18.408 826 H HIS 113 HN HIS 113 19.566 31.343 15.525 827 HA HIS 113 HA HIS 113 17.233 30.967 17.084 828 1HB HIS 113 HB2 HIS 113 17.238 31.492 14.659 829 2HB HIS 113 HB1 HIS 113 17.761 29.843 14.325 830 HD1 HIS 113 HD1 HIS 113 16.069 27.911 15.274 831 HD2 HIS 113 HD2 HIS 113 14.503 31.758 14.949 832 HE1 HIS 113 HE1 HIS 113 13.546 27.675 15.376 833 H ARG 114 HN ARG 114 19.522 28.510 15.852 834 HA ARG 114 HA ARG 114 17.997 26.225 16.521 835 1HB ARG 114 HB2 ARG 114 20.968 26.746 16.433 836 2HB ARG 114 HB1 ARG 114 20.355 25.170 16.927 837 1HG ARG 114 HG2 ARG 114 19.324 26.406 14.381 838 2HG ARG 114 HG1 ARG 114 20.909 25.639 14.383 839 1HD ARG 114 HD2 ARG 114 18.362 24.279 15.319 840 2HD ARG 114 HD1 ARG 114 19.077 24.070 13.724 841 HE ARG 114 HE ARG 114 21.145 23.479 15.495 842 1HH1 ARG 114 HH21 ARG 114 17.905 22.431 14.952 843 2HH1 ARG 114 HH22 ARG 114 18.190 20.819 15.519 844 1HH2 ARG 114 HH11 ARG 114 21.532 21.368 16.234 845 2HH2 ARG 114 HH12 ARG 114 20.236 20.219 16.243 846 H VAL 115 HN VAL 115 20.211 28.125 18.576 847 HA VAL 115 HA VAL 115 19.818 26.426 20.886 848 HB VAL 115 HB VAL 115 20.862 29.259 20.631 849 1HG1 VAL 115 HG12 VAL 115 20.613 27.393 22.993 850 2HG1 VAL 115 HG11 VAL 115 21.869 28.629 22.939 851 3HG1 VAL 115 HG13 VAL 115 20.172 29.097 22.886 852 1HG2 VAL 115 HG23 VAL 115 22.170 27.431 19.520 853 2HG2 VAL 115 HG22 VAL 115 23.046 28.201 20.844 854 3HG2 VAL 115 HG21 VAL 115 22.296 26.624 21.082 855 H ALA 116 HN ALA 116 18.356 29.471 19.777 856 HA ALA 116 HA ALA 116 16.832 30.052 22.093 857 1HB ALA 116 HB1 ALA 116 17.083 31.557 20.094 858 2HB ALA 116 HB3 ALA 116 15.958 30.511 19.226 859 3HB ALA 116 HB2 ALA 116 15.418 31.396 20.652 860 H ALA 117 HN ALA 117 15.886 28.141 19.218 861 HA ALA 117 HA ALA 117 13.297 27.442 20.138 862 1HB ALA 117 HB2 ALA 117 14.147 27.030 17.824 863 2HB ALA 117 HB1 ALA 117 15.164 25.738 18.461 864 3HB ALA 117 HB3 ALA 117 13.407 25.597 18.539 865 H HIS 118 HN HIS 118 16.437 25.798 20.629 866 HA HIS 118 HA HIS 118 15.421 23.551 22.045 867 1HB HIS 118 HB2 HIS 118 17.760 23.719 21.237 868 2HB HIS 118 HB1 HIS 118 18.080 24.955 22.455 869 HD1 HIS 118 HD1 HIS 118 16.787 21.378 22.318 870 HD2 HIS 118 HD2 HIS 118 18.929 23.877 24.869 871 HE1 HIS 118 HE1 HIS 118 17.496 19.949 24.284 872 H GLU 119 HN GLU 119 16.601 26.696 23.305 873 HA GLU 119 HA GLU 119 16.145 26.126 26.060 874 1HB GLU 119 HB2 GLU 119 16.092 28.747 24.541 875 2HB GLU 119 HB1 GLU 119 15.980 28.643 26.296 876 1HG GLU 119 HG2 GLU 119 18.152 27.464 26.363 877 2HG GLU 119 HG1 GLU 119 18.271 27.595 24.607 878 H LEU 120 HN LEU 120 14.002 27.484 23.577 879 HA LEU 120 HA LEU 120 11.826 28.065 25.343 880 1HB LEU 120 HB2 LEU 120 11.881 27.431 22.382 881 2HB LEU 120 HB1 LEU 120 10.438 27.971 23.236 882 HG LEU 120 HG LEU 120 13.053 29.510 23.208 883 1HD1 LEU 120 HD11 LEU 120 12.027 29.277 20.940 884 2HD1 LEU 120 HD13 LEU 120 10.557 30.020 21.567 885 3HD1 LEU 120 HD12 LEU 120 12.061 30.942 21.519 886 1HD2 LEU 120 HD23 LEU 120 10.296 30.005 24.325 887 2HD2 LEU 120 HD22 LEU 120 11.871 30.349 25.040 888 3HD2 LEU 120 HD21 LEU 120 11.245 31.381 23.760 889 H GLY 121 HN GLY 121 12.709 25.148 23.512 890 1HA GLY 121 HA2 GLY 121 10.374 23.632 23.993 891 2HA GLY 121 HA1 GLY 121 11.986 22.930 23.831 892 H HIS 122 HN HIS 122 13.238 24.149 26.060 893 HA HIS 122 HA HIS 122 12.324 22.424 28.185 894 1HB HIS 122 HB2 HIS 122 14.269 24.748 28.140 895 2HB HIS 122 HB1 HIS 122 13.974 23.763 29.574 896 HD1 HIS 122 HD1 HIS 122 13.974 20.986 28.694 897 HD2 HIS 122 HD2 HIS 122 16.531 23.750 26.907 898 HE1 HIS 122 HE1 HIS 122 15.839 19.649 27.630 899 H SER 123 HN SER 123 11.966 25.878 27.489 900 HA SER 123 HA SER 123 10.694 26.653 29.908 901 1HB SER 123 HB2 SER 123 11.460 28.244 28.147 902 2HB SER 123 HB1 SER 123 10.150 27.692 27.109 903 HG SER 123 HG SER 123 9.188 29.314 28.109 904 H LEU 124 HN LEU 124 9.494 24.948 27.086 905 HA LEU 124 HA LEU 124 6.688 25.188 27.913 906 1HB LEU 124 HB2 LEU 124 8.043 23.564 25.746 907 2HB LEU 124 HB1 LEU 124 6.298 23.640 25.982 908 HG LEU 124 HG LEU 124 8.057 26.069 25.521 909 1HD1 LEU 124 HD11 LEU 124 6.380 24.443 23.593 910 2HD1 LEU 124 HD13 LEU 124 7.003 26.053 23.231 911 3HD1 LEU 124 HD12 LEU 124 8.121 24.720 23.520 912 1HD2 LEU 124 HD22 LEU 124 5.105 25.622 25.910 913 2HD2 LEU 124 HD21 LEU 124 6.128 26.931 26.500 914 3HD2 LEU 124 HD23 LEU 124 5.616 26.903 24.815 915 H GLY 125 HN GLY 125 9.241 23.377 29.032 916 1HA GLY 125 HA2 GLY 125 9.054 21.738 30.770 917 2HA GLY 125 HA1 GLY 125 7.378 21.457 30.304 918 H LEU 126 HN LEU 126 9.459 21.492 27.610 919 HA LEU 126 HA LEU 126 9.081 18.605 27.239 920 1HB LEU 126 HB2 LEU 126 10.640 20.591 25.554 921 2HB LEU 126 HB1 LEU 126 10.145 18.971 25.066 922 HG LEU 126 HG LEU 126 8.267 21.240 25.793 923 1HD1 LEU 126 HD11 LEU 126 9.555 21.368 23.586 924 2HD1 LEU 126 HD13 LEU 126 8.651 19.934 23.097 925 3HD1 LEU 126 HD12 LEU 126 7.796 21.431 23.470 926 1HD2 LEU 126 HD22 LEU 126 7.855 18.331 25.121 927 2HD2 LEU 126 HD21 LEU 126 7.061 19.314 26.351 928 3HD2 LEU 126 HD23 LEU 126 6.628 19.508 24.654 929 H SER 127 HN SER 127 10.750 17.053 27.216 930 HA SER 127 HA SER 127 13.294 17.906 28.550 931 1HB SER 127 HB2 SER 127 11.835 15.253 28.462 932 2HB SER 127 HB1 SER 127 13.479 15.425 29.074 933 HG SER 127 HG SER 127 11.496 15.662 30.543 934 H HIS 128 HN HIS 128 15.266 16.834 27.781 935 HA HIS 128 HA HIS 128 15.745 17.076 25.050 936 1HB HIS 128 HB2 HIS 128 17.099 15.158 26.971 937 2HB HIS 128 HB1 HIS 128 17.756 15.686 25.420 938 HD1 HIS 128 HD1 HIS 128 16.950 16.942 28.878 939 HD2 HIS 128 HD2 HIS 128 18.790 18.330 25.404 940 HE1 HIS 128 HE1 HIS 128 18.075 19.128 29.488 941 H SER 129 HN SER 129 16.532 15.088 23.641 942 HA SER 129 HA SER 129 14.761 12.725 23.909 943 1HB SER 129 HB2 SER 129 13.476 14.465 22.625 944 2HB SER 129 HB1 SER 129 14.757 14.456 21.417 945 HG SER 129 HG SER 129 12.719 12.926 21.402 946 H THR 130 HN THR 130 15.414 10.993 22.417 947 HA THR 130 HA THR 130 18.313 11.161 21.740 948 HB THR 130 HB THR 130 18.197 8.701 21.664 949 HG1 THR 130 HG1 THR 130 16.009 8.624 20.938 950 1HG2 THR 130 HG21 THR 130 18.581 9.847 23.826 951 2HG2 THR 130 HG23 THR 130 16.841 9.848 24.119 952 3HG2 THR 130 HG22 THR 130 17.720 8.322 24.036 953 H ASP 131 HN ASP 131 15.513 11.764 20.152 954 HA ASP 131 HA ASP 131 16.028 10.197 17.719 955 1HB ASP 131 HB2 ASP 131 13.720 10.835 18.486 956 2HB ASP 131 HB1 ASP 131 14.118 12.511 18.119 957 H ILE 132 HN ILE 132 17.410 10.838 16.142 958 HA ILE 132 HA ILE 132 18.950 13.227 16.296 959 HB ILE 132 HB ILE 132 19.561 11.135 15.024 960 1HG1 ILE 132 HG12 ILE 132 19.652 13.665 13.353 961 2HG1 ILE 132 HG11 ILE 132 20.696 13.375 14.745 962 1HG2 ILE 132 HG22 ILE 132 17.236 11.086 13.886 963 2HG2 ILE 132 HG21 ILE 132 17.904 12.285 12.777 964 3HG2 ILE 132 HG23 ILE 132 18.640 10.686 12.898 965 1HD1 ILE 132 HD12 ILE 132 21.464 11.248 13.637 966 2HD1 ILE 132 HD11 ILE 132 20.562 11.731 12.201 967 3HD1 ILE 132 HD13 ILE 132 21.916 12.712 12.766 968 H GLY 133 HN GLY 133 15.982 12.491 14.493 969 1HA GLY 133 HA2 GLY 133 15.980 14.987 13.027 970 2HA GLY 133 HA1 GLY 133 14.609 13.890 13.190 971 H ALA 134 HN ALA 134 15.691 14.547 16.276 972 HA ALA 134 HA ALA 134 13.517 16.553 16.653 973 1HB ALA 134 HB3 ALA 134 15.078 14.837 18.593 974 2HB ALA 134 HB2 ALA 134 13.949 16.088 19.104 975 3HB ALA 134 HB1 ALA 134 13.373 14.709 18.171 976 H LEU 135 HN LEU 135 13.927 18.633 17.292 977 HA LEU 135 HA LEU 135 16.598 19.703 16.997 978 1HB LEU 135 HB2 LEU 135 14.150 20.971 18.278 979 2HB LEU 135 HB1 LEU 135 15.582 21.827 17.713 980 HG LEU 135 HG LEU 135 13.790 20.164 15.920 981 1HD1 LEU 135 HD11 LEU 135 13.890 23.163 16.374 982 2HD1 LEU 135 HD13 LEU 135 12.956 22.365 15.109 983 3HD1 LEU 135 HD12 LEU 135 12.558 22.091 16.805 984 1HD2 LEU 135 HD23 LEU 135 16.148 22.002 15.462 985 2HD2 LEU 135 HD22 LEU 135 15.923 20.351 14.885 986 3HD2 LEU 135 HD21 LEU 135 14.989 21.666 14.179 987 H MET 136 HN MET 136 14.625 18.638 19.675 988 HA MET 136 HA MET 136 16.183 19.848 21.763 989 1HB MET 136 HB2 MET 136 14.358 17.434 21.858 990 2HB MET 136 HB1 MET 136 14.934 18.343 23.255 991 1HG MET 136 HG2 MET 136 13.284 19.510 20.993 992 2HG MET 136 HG1 MET 136 12.641 19.038 22.562 993 1HE MET 136 HE2 MET 136 13.429 19.708 24.644 994 2HE MET 136 HE1 MET 136 15.105 20.248 24.687 995 3HE MET 136 HE3 MET 136 13.800 21.375 25.077 996 H TYR 137 HN TYR 137 17.587 18.079 19.672 997 HA TYR 137 HA TYR 137 18.548 15.744 20.992 998 1HB TYR 137 HB2 TYR 137 18.820 16.514 18.508 999 2HB TYR 137 HB1 TYR 137 20.252 17.362 19.089 1000 HD1 TYR 137 HD2 TYR 137 18.611 14.005 19.043 1001 HD2 TYR 137 HD1 TYR 137 22.291 16.194 19.387 1002 HE1 TYR 137 HE2 TYR 137 19.880 11.878 18.962 1003 HE2 TYR 137 HE1 TYR 137 23.562 14.064 19.305 1004 HH TYR 137 HH TYR 137 23.284 11.743 19.646 1005 HA PRO 138 HA PRO 138 20.997 17.670 24.208 1006 1HB PRO 138 HB2 PRO 138 23.101 15.652 24.064 1007 2HB PRO 138 HB1 PRO 138 21.873 15.874 25.318 1008 1HG PRO 138 HG2 PRO 138 21.953 13.821 23.289 1009 2HG PRO 138 HG1 PRO 138 20.715 14.063 24.529 1010 1HD PRO 138 HD2 PRO 138 20.460 14.540 21.701 1011 2HD PRO 138 HD1 PRO 138 19.251 14.854 22.962 1012 H SER 139 HN SER 139 23.152 16.182 21.734 1013 HA SER 139 HA SER 139 24.970 18.471 21.902 1014 1HB SER 139 HB2 SER 139 26.308 17.270 20.274 1015 2HB SER 139 HB1 SER 139 25.748 16.127 21.490 1016 HG SER 139 HG SER 139 24.147 16.567 19.243 1017 H TYR 140 HN TYR 140 25.636 19.628 19.888 1018 HA TYR 140 HA TYR 140 23.382 20.882 18.621 1019 1HB TYR 140 HB2 TYR 140 25.619 21.958 19.000 1020 2HB TYR 140 HB1 TYR 140 26.287 20.913 17.746 1021 HD1 TYR 140 HD1 TYR 140 25.651 21.192 15.392 1022 HD2 TYR 140 HD2 TYR 140 24.093 23.773 18.453 1023 HE1 TYR 140 HE1 TYR 140 24.880 22.785 13.657 1024 HE2 TYR 140 HE2 TYR 140 23.313 25.361 16.717 1025 HH TYR 140 HH TYR 140 23.631 24.611 13.264 1026 H THR 141 HN THR 141 22.680 20.686 16.423 1027 HA THR 141 HA THR 141 23.869 18.540 14.760 1028 HB THR 141 HB THR 141 21.672 17.439 14.434 1029 HG1 THR 141 HG1 THR 141 20.609 18.591 16.691 1030 1HG2 THR 141 HG23 THR 141 23.338 16.719 16.223 1031 2HG2 THR 141 HG22 THR 141 22.325 17.577 17.384 1032 3HG2 THR 141 HG21 THR 141 21.670 16.208 16.487 1033 H PHE 142 HN PHE 142 22.865 18.535 12.558 1034 HA PHE 142 HA PHE 142 21.268 20.876 11.798 1035 1HB PHE 142 HB2 PHE 142 23.659 21.692 11.995 1036 2HB PHE 142 HB1 PHE 142 24.073 20.579 10.693 1037 HD1 PHE 142 HD2 PHE 142 21.652 23.320 11.538 1038 HD2 PHE 142 HD1 PHE 142 23.861 21.280 8.465 1039 HE1 PHE 142 HE2 PHE 142 20.874 24.985 9.871 1040 HE2 PHE 142 HE1 PHE 142 23.084 22.946 6.802 1041 HZ PHE 142 HZ PHE 142 21.588 24.796 7.505 1042 H SER 143 HN SER 143 19.835 19.835 10.487 1043 HA SER 143 HA SER 143 20.797 17.628 8.724 1044 1HB SER 143 HB2 SER 143 18.462 17.013 8.522 1045 2HB SER 143 HB1 SER 143 18.829 17.251 10.228 1046 HG SER 143 HG SER 143 17.824 19.216 10.158 1047 H GLY 144 HN GLY 144 20.719 20.829 8.401 1048 1HA GLY 144 HA2 GLY 144 20.966 21.970 6.294 1049 2HA GLY 144 HA1 GLY 144 20.114 20.648 5.499 1050 H ASP 145 HN ASP 145 18.409 21.341 8.249 1051 HA ASP 145 HA ASP 145 16.940 23.676 7.278 1052 1HB ASP 145 HB2 ASP 145 16.124 21.599 5.942 1053 2HB ASP 145 HB1 ASP 145 15.370 21.098 7.456 1054 H VAL 146 HN VAL 146 14.982 24.048 8.773 1055 HA VAL 146 HA VAL 146 15.432 22.868 11.491 1056 HB VAL 146 HB VAL 146 15.159 25.799 10.760 1057 1HG1 VAL 146 HG11 VAL 146 14.905 24.358 13.407 1058 2HG1 VAL 146 HG13 VAL 146 15.385 26.055 13.322 1059 3HG1 VAL 146 HG12 VAL 146 13.814 25.549 12.703 1060 1HG2 VAL 146 HG23 VAL 146 17.321 24.147 12.104 1061 2HG2 VAL 146 HG22 VAL 146 17.438 25.012 10.572 1062 3HG2 VAL 146 HG21 VAL 146 17.317 25.911 12.084 1063 H GLN 147 HN GLN 147 13.545 21.659 11.460 1064 HA GLN 147 HA GLN 147 10.986 23.208 11.452 1065 1HB GLN 147 HB2 GLN 147 11.577 20.647 9.933 1066 2HB GLN 147 HB1 GLN 147 9.945 21.249 10.229 1067 1HG GLN 147 HG2 GLN 147 10.454 23.323 9.041 1068 2HG GLN 147 HG1 GLN 147 12.127 22.809 8.811 1069 1HE2 GLN 147 HE22 GLN 147 10.228 19.954 6.865 1070 2HE2 GLN 147 HE21 GLN 147 10.573 19.963 8.528 1071 H LEU 148 HN LEU 148 9.261 22.034 12.648 1072 HA LEU 148 HA LEU 148 10.339 20.706 15.005 1073 1HB LEU 148 HB2 LEU 148 7.457 21.019 14.099 1074 2HB LEU 148 HB1 LEU 148 7.982 20.515 15.707 1075 HG LEU 148 HG LEU 148 8.620 23.187 14.409 1076 1HD1 LEU 148 HD13 LEU 148 6.719 22.454 16.658 1077 2HD1 LEU 148 HD12 LEU 148 7.080 24.095 16.121 1078 3HD1 LEU 148 HD11 LEU 148 6.251 22.975 15.040 1079 1HD2 LEU 148 HD23 LEU 148 9.410 21.889 17.017 1080 2HD2 LEU 148 HD22 LEU 148 10.402 22.825 15.898 1081 3HD2 LEU 148 HD21 LEU 148 9.238 23.643 16.934 1082 H ALA 149 HN ALA 149 9.915 18.505 15.625 1083 HA ALA 149 HA ALA 149 9.529 16.678 13.286 1084 1HB ALA 149 HB1 ALA 149 10.885 16.344 15.969 1085 2HB ALA 149 HB3 ALA 149 10.540 14.981 14.905 1086 3HB ALA 149 HB2 ALA 149 11.616 16.269 14.366 1087 H GLN 150 HN GLN 150 8.363 14.622 13.799 1088 HA GLN 150 HA GLN 150 5.755 15.121 14.819 1089 1HB GLN 150 HB2 GLN 150 6.268 13.293 13.230 1090 2HB GLN 150 HB1 GLN 150 7.190 12.463 14.483 1091 1HG GLN 150 HG2 GLN 150 5.154 12.288 15.872 1092 2HG GLN 150 HG1 GLN 150 4.232 13.126 14.623 1093 1HE2 GLN 150 HE22 GLN 150 3.483 9.981 13.207 1094 2HE2 GLN 150 HE21 GLN 150 2.892 11.448 13.827 1095 H ASP 151 HN ASP 151 8.624 13.654 16.320 1096 HA ASP 151 HA ASP 151 7.401 12.796 18.735 1097 1HB ASP 151 HB2 ASP 151 9.702 12.176 18.078 1098 2HB ASP 151 HB1 ASP 151 10.215 13.848 18.304 1099 H ASP 152 HN ASP 152 8.764 15.970 17.832 1100 HA ASP 152 HA ASP 152 8.302 17.087 20.479 1101 1HB ASP 152 HB2 ASP 152 8.907 18.364 17.797 1102 2HB ASP 152 HB1 ASP 152 8.777 19.269 19.305 1103 H ILE 153 HN ILE 153 6.623 17.270 17.336 1104 HA ILE 153 HA ILE 153 4.610 19.119 18.147 1105 HB ILE 153 HB ILE 153 4.508 16.894 16.089 1106 1HG1 ILE 153 HG12 ILE 153 4.911 19.876 15.736 1107 2HG1 ILE 153 HG11 ILE 153 6.246 18.731 15.849 1108 1HG2 ILE 153 HG21 ILE 153 2.641 19.207 16.680 1109 2HG2 ILE 153 HG23 ILE 153 2.666 18.379 15.122 1110 3HG2 ILE 153 HG22 ILE 153 2.238 17.493 16.586 1111 1HD1 ILE 153 HD11 ILE 153 5.198 17.465 13.925 1112 2HD1 ILE 153 HD13 ILE 153 4.072 18.812 13.743 1113 3HD1 ILE 153 HD12 ILE 153 5.801 19.069 13.510 1114 H ASP 154 HN ASP 154 4.514 15.541 18.082 1115 HA ASP 154 HA ASP 154 1.898 15.304 19.196 1116 1HB ASP 154 HB2 ASP 154 4.289 13.443 19.299 1117 2HB ASP 154 HB1 ASP 154 2.679 13.001 19.870 1118 H GLY 155 HN GLY 155 5.099 15.504 20.719 1119 1HA GLY 155 HA2 GLY 155 4.274 14.981 23.388 1120 2HA GLY 155 HA1 GLY 155 5.709 15.900 22.946 1121 H ILE 156 HN ILE 156 4.752 18.184 21.799 1122 HA ILE 156 HA ILE 156 3.718 19.596 24.091 1123 HB ILE 156 HB ILE 156 5.204 20.588 22.287 1124 1HG1 ILE 156 HG12 ILE 156 3.920 22.796 22.279 1125 2HG1 ILE 156 HG11 ILE 156 2.611 21.937 23.085 1126 1HG2 ILE 156 HG21 ILE 156 3.837 19.665 20.383 1127 2HG2 ILE 156 HG23 ILE 156 2.596 20.858 20.767 1128 3HG2 ILE 156 HG22 ILE 156 4.195 21.383 20.248 1129 1HD1 ILE 156 HD13 ILE 156 5.366 21.728 24.263 1130 2HD1 ILE 156 HD12 ILE 156 4.460 23.220 24.495 1131 3HD1 ILE 156 HD11 ILE 156 3.794 21.692 25.062 1132 H GLN 157 HN GLN 157 2.247 18.468 21.064 1133 HA GLN 157 HA GLN 157 -0.322 19.689 21.536 1134 1HB GLN 157 HB2 GLN 157 0.504 17.313 19.844 1135 2HB GLN 157 HB1 GLN 157 -1.138 17.958 19.875 1136 1HG GLN 157 HG2 GLN 157 -0.308 20.152 19.143 1137 2HG GLN 157 HG1 GLN 157 1.345 19.534 19.135 1138 1HE2 GLN 157 HE22 GLN 157 -0.117 19.232 15.667 1139 2HE2 GLN 157 HE21 GLN 157 0.083 20.536 16.736 1140 H ALA 158 HN ALA 158 1.060 16.529 22.348 1141 HA ALA 158 HA ALA 158 -1.321 15.322 23.326 1142 1HB ALA 158 HB2 ALA 158 1.595 14.956 24.024 1143 2HB ALA 158 HB1 ALA 158 0.329 13.991 24.781 1144 3HB ALA 158 HB3 ALA 158 0.575 13.911 23.036 1145 H ILE 159 HN ILE 159 1.058 17.431 24.900 1146 HA ILE 159 HA ILE 159 -0.104 17.259 27.527 1147 HB ILE 159 HB ILE 159 1.610 19.387 26.216 1148 1HG1 ILE 159 HG12 ILE 159 2.330 17.276 28.266 1149 2HG1 ILE 159 HG11 ILE 159 2.528 17.034 26.530 1150 1HG2 ILE 159 HG23 ILE 159 0.681 19.023 29.074 1151 2HG2 ILE 159 HG22 ILE 159 2.086 19.998 28.647 1152 3HG2 ILE 159 HG21 ILE 159 0.490 20.447 28.050 1153 1HD1 ILE 159 HD11 ILE 159 3.943 19.105 26.462 1154 2HD1 ILE 159 HD13 ILE 159 3.834 19.184 28.220 1155 3HD1 ILE 159 HD12 ILE 159 4.638 17.816 27.448 1156 H TYR 160 HN TYR 160 -0.453 19.682 24.903 1157 HA TYR 160 HA TYR 160 -2.731 20.911 26.383 1158 1HB TYR 160 HB2 TYR 160 -1.226 21.752 23.889 1159 2HB TYR 160 HB1 TYR 160 -2.613 22.623 24.543 1160 HD1 TYR 160 HD1 TYR 160 0.914 21.722 25.062 1161 HD2 TYR 160 HD2 TYR 160 -2.462 23.840 26.662 1162 HE1 TYR 160 HE1 TYR 160 2.408 22.906 26.646 1163 HE2 TYR 160 HE2 TYR 160 -0.966 25.028 28.243 1164 HH TYR 160 HH TYR 160 2.402 25.037 27.923 1165 H GLY 161 HN GLY 161 -2.129 20.136 22.942 1166 1HA GLY 161 HA2 GLY 161 -3.945 18.223 22.331 1167 2HA GLY 161 HA1 GLY 161 -5.008 19.613 22.562 1168 H ARG 162 HN ARG 162 -5.418 19.118 20.174 1169 HA ARG 162 HA ARG 162 -3.279 19.989 18.336 1170 1HB ARG 162 HB2 ARG 162 -6.113 19.019 17.889 1171 2HB ARG 162 HB1 ARG 162 -5.051 19.545 16.581 1172 1HG ARG 162 HG2 ARG 162 -3.391 17.841 17.245 1173 2HG ARG 162 HG1 ARG 162 -4.459 17.311 18.545 1174 1HD ARG 162 HD2 ARG 162 -4.699 15.848 16.582 1175 2HD ARG 162 HD1 ARG 162 -6.195 16.737 16.879 1176 HE ARG 162 HE ARG 162 -4.849 18.344 15.083 1177 1HH1 ARG 162 HH21 ARG 162 -5.731 15.015 15.256 1178 2HH1 ARG 162 HH22 ARG 162 -5.896 14.832 13.541 1179 1HH2 ARG 162 HH11 ARG 162 -5.062 18.125 12.841 1180 2HH2 ARG 162 HH12 ARG 162 -5.518 16.593 12.175 1181 H SER 163 HN SER 163 -3.516 21.806 16.927 1182 HA SER 163 HA SER 163 -4.779 24.098 18.194 1183 1HB SER 163 HB2 SER 163 -3.577 23.991 15.421 1184 2HB SER 163 HB1 SER 163 -3.757 25.398 16.466 1185 HG SER 163 HG SER 163 -1.623 24.428 16.444 1186 H GLN 164 HN GLN 164 -6.968 22.732 17.902 1187 HA GLN 164 HA GLN 164 -8.208 22.845 15.286 1188 1HB GLN 164 HB2 GLN 164 -9.355 22.546 18.076 1189 2HB GLN 164 HB1 GLN 164 -10.335 22.482 16.612 1190 1HG GLN 164 HG2 GLN 164 -8.995 20.593 15.783 1191 2HG GLN 164 HG1 GLN 164 -7.999 20.651 17.239 1192 1HE2 GLN 164 HE22 GLN 164 -11.497 19.969 18.877 1193 2HE2 GLN 164 HE21 GLN 164 -10.812 21.488 18.550 1194 H ASN 165 HN ASN 165 -9.373 24.527 14.385 1195 HA ASN 165 HA ASN 165 -10.221 26.793 16.072 1196 1HB ASN 165 HB2 ASN 165 -8.452 27.304 13.668 1197 2HB ASN 165 HB1 ASN 165 -8.935 28.452 14.918 1198 1HD2 ASN 165 HD22 ASN 165 -6.622 27.105 17.358 1199 2HD2 ASN 165 HD21 ASN 165 -8.181 27.768 17.242 1200 HA PRO 166 HA PRO 166 -13.526 26.698 13.107 1201 1HB PRO 166 HB2 PRO 166 -13.964 29.538 12.960 1202 2HB PRO 166 HB1 PRO 166 -14.845 28.370 13.956 1203 1HG PRO 166 HG2 PRO 166 -12.829 30.331 14.798 1204 2HG PRO 166 HG1 PRO 166 -13.906 29.351 15.805 1205 1HD PRO 166 HD2 PRO 166 -11.109 28.965 15.480 1206 2HD PRO 166 HD1 PRO 166 -12.245 27.832 16.243 1207 H VAL 167 HN VAL 167 -14.030 27.628 10.866 1208 HA VAL 167 HA VAL 167 -11.502 27.944 9.389 1209 HB VAL 167 HB VAL 167 -14.374 27.796 8.421 1210 1HG1 VAL 167 HG12 VAL 167 -11.702 27.800 7.004 1211 2HG1 VAL 167 HG11 VAL 167 -13.175 27.187 6.250 1212 3HG1 VAL 167 HG13 VAL 167 -13.073 28.879 6.735 1213 1HG2 VAL 167 HG23 VAL 167 -12.164 25.745 8.729 1214 2HG2 VAL 167 HG22 VAL 167 -13.768 25.713 9.460 1215 3HG2 VAL 167 HG21 VAL 167 -13.589 25.474 7.723 1216 H GLN 168 HN GLN 168 -10.791 29.848 8.512 1217 HA GLN 168 HA GLN 168 -12.124 32.308 9.321 1218 1HB GLN 168 HB2 GLN 168 -9.640 31.761 7.673 1219 2HB GLN 168 HB1 GLN 168 -10.175 33.380 8.111 1220 1HG GLN 168 HG2 GLN 168 -10.005 32.837 10.488 1221 2HG GLN 168 HG1 GLN 168 -9.565 31.172 10.098 1222 1HE2 GLN 168 HE22 GLN 168 -6.695 33.983 10.166 1223 2HE2 GLN 168 HE21 GLN 168 -8.268 34.262 10.739 1224 HA PRO 169 HA PRO 169 -14.592 32.953 5.697 1225 1HB PRO 169 HB2 PRO 169 -13.770 35.721 5.284 1226 2HB PRO 169 HB1 PRO 169 -15.301 35.118 5.936 1227 1HG PRO 169 HG2 PRO 169 -13.119 36.349 7.397 1228 2HG PRO 169 HG1 PRO 169 -14.667 35.777 8.037 1229 1HD PRO 169 HD2 PRO 169 -12.094 34.579 8.443 1230 2HD PRO 169 HD1 PRO 169 -13.668 33.936 8.951 No H/Q in entry = 1230 Start of MODEL 3 1 1H VAL 1 HT1 VAL 1 -8.803 19.148 16.365 2 2H VAL 1 HT3 VAL 1 -7.493 18.402 17.140 3 3H VAL 1 HT2 VAL 1 -7.540 18.483 15.443 4 HA VAL 1 HA VAL 1 -8.253 16.371 15.673 5 HB VAL 1 HB VAL 1 -8.025 16.146 18.030 6 1HG1 VAL 1 HG11 VAL 1 -8.789 18.471 18.581 7 2HG1 VAL 1 HG13 VAL 1 -10.454 17.921 18.409 8 3HG1 VAL 1 HG12 VAL 1 -9.429 17.244 19.668 9 1HG2 VAL 1 HG22 VAL 1 -9.864 14.752 16.829 10 2HG2 VAL 1 HG21 VAL 1 -9.844 14.761 18.592 11 3HG2 VAL 1 HG23 VAL 1 -11.003 15.764 17.719 12 H LEU 2 HN LEU 2 -9.462 16.842 13.805 13 HA LEU 2 HA LEU 2 -12.128 18.074 14.049 14 1HB LEU 2 HB2 LEU 2 -10.757 16.820 11.651 15 2HB LEU 2 HB1 LEU 2 -12.212 17.811 11.609 16 HG LEU 2 HG LEU 2 -9.565 18.803 12.703 17 1HD1 LEU 2 HD12 LEU 2 -10.726 18.919 9.913 18 2HD1 LEU 2 HD11 LEU 2 -9.507 20.065 10.472 19 3HD1 LEU 2 HD13 LEU 2 -9.134 18.342 10.406 20 1HD2 LEU 2 HD21 LEU 2 -12.212 20.089 11.987 21 2HD2 LEU 2 HD23 LEU 2 -11.326 20.184 13.508 22 3HD2 LEU 2 HD22 LEU 2 -10.728 21.033 12.086 23 H THR 3 HN THR 3 -11.131 15.125 12.329 24 HA THR 3 HA THR 3 -13.707 13.859 13.074 25 HB THR 3 HB THR 3 -13.111 12.181 11.398 26 HG1 THR 3 HG1 THR 3 -10.841 13.444 10.557 27 1HG2 THR 3 HG22 THR 3 -14.006 14.472 10.732 28 2HG2 THR 3 HG21 THR 3 -12.347 14.896 10.310 29 3HG2 THR 3 HG23 THR 3 -13.164 13.584 9.462 30 H GLU 4 HN GLU 4 -13.771 11.782 14.094 31 HA GLU 4 HA GLU 4 -11.808 11.419 16.177 32 1HB GLU 4 HB2 GLU 4 -14.211 10.785 16.393 33 2HB GLU 4 HB1 GLU 4 -13.944 9.490 15.225 34 1HG GLU 4 HG2 GLU 4 -12.381 8.388 16.684 35 2HG GLU 4 HG1 GLU 4 -12.361 9.762 17.791 36 H GLY 5 HN GLY 5 -10.117 9.942 16.302 37 1HA GLY 5 HA2 GLY 5 -8.574 8.319 15.583 38 2HA GLY 5 HA1 GLY 5 -9.791 7.755 14.439 39 H ASN 6 HN ASN 6 -8.028 7.561 12.863 40 HA ASN 6 HA ASN 6 -6.597 9.939 12.024 41 1HB ASN 6 HB2 ASN 6 -6.898 7.167 10.855 42 2HB ASN 6 HB1 ASN 6 -5.952 8.419 10.056 43 1HD2 ASN 6 HD22 ASN 6 -3.258 7.121 11.990 44 2HD2 ASN 6 HD21 ASN 6 -3.950 7.191 10.441 45 HA PRO 7 HA PRO 7 -9.662 11.651 9.309 46 1HB PRO 7 HB2 PRO 7 -7.880 12.238 7.111 47 2HB PRO 7 HB1 PRO 7 -8.463 13.353 8.354 48 1HG PRO 7 HG2 PRO 7 -5.806 12.154 8.103 49 2HG PRO 7 HG1 PRO 7 -6.340 13.420 9.218 50 1HD PRO 7 HD2 PRO 7 -5.743 10.719 9.898 51 2HD PRO 7 HD1 PRO 7 -6.516 11.928 10.943 52 H ARG 8 HN ARG 8 -10.236 11.440 6.767 53 HA ARG 8 HA ARG 8 -9.567 8.741 5.721 54 1HB ARG 8 HB2 ARG 8 -12.373 9.691 6.365 55 2HB ARG 8 HB1 ARG 8 -12.028 8.325 5.307 56 1HG ARG 8 HG2 ARG 8 -10.815 7.207 7.146 57 2HG ARG 8 HG1 ARG 8 -11.174 8.571 8.207 58 1HD ARG 8 HD2 ARG 8 -13.238 6.811 6.850 59 2HD ARG 8 HD1 ARG 8 -12.787 6.729 8.554 60 HE ARG 8 HE ARG 8 -13.545 9.353 8.259 61 1HH1 ARG 8 HH21 ARG 8 -14.901 6.305 7.393 62 2HH1 ARG 8 HH22 ARG 8 -16.541 6.820 7.614 63 1HH2 ARG 8 HH11 ARG 8 -15.679 10.044 8.559 64 2HH2 ARG 8 HH12 ARG 8 -16.981 8.937 8.275 65 H TRP 9 HN TRP 9 -9.972 8.588 3.428 66 HA TRP 9 HA TRP 9 -9.739 11.108 2.032 67 1HB TRP 9 HB2 TRP 9 -10.245 8.287 1.047 68 2HB TRP 9 HB1 TRP 9 -9.997 9.665 -0.025 69 HD1 TRP 9 HD1 TRP 9 -8.175 7.201 2.123 70 HE1 TRP 9 HE1 TRP 9 -5.639 7.649 2.017 71 HE3 TRP 9 HE3 TRP 9 -8.173 11.713 -0.273 72 HZ2 TRP 9 HZ2 TRP 9 -3.842 9.656 1.048 73 HZ3 TRP 9 HZ3 TRP 9 -6.039 12.868 -0.775 74 HH2 TRP 9 HH2 TRP 9 -3.877 11.846 -0.120 75 H GLU 10 HN GLU 10 -11.362 12.406 1.338 76 HA GLU 10 HA GLU 10 -14.128 11.714 1.886 77 1HB GLU 10 HB2 GLU 10 -12.835 14.051 0.458 78 2HB GLU 10 HB1 GLU 10 -14.573 13.922 0.727 79 1HG GLU 10 HG2 GLU 10 -14.191 13.772 3.160 80 2HG GLU 10 HG1 GLU 10 -12.451 13.906 2.894 81 H GLN 11 HN GLN 11 -12.081 11.789 -0.984 82 HA GLN 11 HA GLN 11 -14.331 11.326 -2.809 83 1HB GLN 11 HB2 GLN 11 -11.324 11.350 -3.177 84 2HB GLN 11 HB1 GLN 11 -12.461 11.065 -4.494 85 1HG GLN 11 HG2 GLN 11 -13.530 13.243 -4.045 86 2HG GLN 11 HG1 GLN 11 -12.391 13.529 -2.731 87 1HE2 GLN 11 HE22 GLN 11 -9.782 13.278 -5.595 88 2HE2 GLN 11 HE21 GLN 11 -10.288 12.059 -4.529 89 H THR 12 HN THR 12 -14.698 9.371 -3.972 90 HA THR 12 HA THR 12 -13.771 6.922 -2.564 91 HB THR 12 HB THR 12 -15.494 5.784 -3.913 92 HG1 THR 12 HG1 THR 12 -15.277 8.111 -5.322 93 1HG2 THR 12 HG22 THR 12 -16.093 7.007 -1.792 94 2HG2 THR 12 HG21 THR 12 -16.598 8.370 -2.792 95 3HG2 THR 12 HG23 THR 12 -17.432 6.822 -2.924 96 H HIS 13 HN HIS 13 -12.829 8.846 -5.101 97 HA HIS 13 HA HIS 13 -11.469 6.581 -6.526 98 1HB HIS 13 HB2 HIS 13 -12.524 9.230 -7.559 99 2HB HIS 13 HB1 HIS 13 -11.403 8.223 -8.476 100 HD1 HIS 13 HD1 HIS 13 -14.554 7.392 -6.472 101 HD2 HIS 13 HD2 HIS 13 -12.919 6.759 -10.255 102 HE1 HIS 13 HE1 HIS 13 -16.210 5.953 -7.736 103 H LEU 14 HN LEU 14 -9.280 6.661 -6.408 104 HA LEU 14 HA LEU 14 -7.954 9.260 -5.697 105 1HB LEU 14 HB2 LEU 14 -7.280 6.503 -4.619 106 2HB LEU 14 HB1 LEU 14 -6.417 7.994 -4.246 107 HG LEU 14 HG LEU 14 -9.364 7.563 -3.669 108 1HD1 LEU 14 HD11 LEU 14 -6.903 7.137 -1.966 109 2HD1 LEU 14 HD13 LEU 14 -8.493 7.423 -1.258 110 3HD1 LEU 14 HD12 LEU 14 -8.223 6.010 -2.277 111 1HD2 LEU 14 HD23 LEU 14 -7.360 9.737 -3.031 112 2HD2 LEU 14 HD22 LEU 14 -8.972 9.898 -3.725 113 3HD2 LEU 14 HD21 LEU 14 -8.785 9.500 -2.021 114 H THR 15 HN THR 15 -5.663 9.308 -6.345 115 HA THR 15 HA THR 15 -5.050 7.477 -8.647 116 HB THR 15 HB THR 15 -4.074 9.354 -9.821 117 HG1 THR 15 HG1 THR 15 -4.550 10.641 -7.363 118 1HG2 THR 15 HG22 THR 15 -6.659 9.022 -9.713 119 2HG2 THR 15 HG21 THR 15 -6.640 10.483 -8.726 120 3HG2 THR 15 HG23 THR 15 -6.029 10.528 -10.379 121 H TYR 16 HN TYR 16 -2.732 7.178 -9.021 122 HA TYR 16 HA TYR 16 -0.938 7.992 -6.798 123 1HB TYR 16 HB2 TYR 16 -0.196 5.702 -6.386 124 2HB TYR 16 HB1 TYR 16 -1.938 5.804 -6.131 125 HD1 TYR 16 HD2 TYR 16 -3.512 4.980 -7.898 126 HD2 TYR 16 HD1 TYR 16 0.732 4.361 -8.144 127 HE1 TYR 16 HE2 TYR 16 -3.868 3.218 -9.605 128 HE2 TYR 16 HE1 TYR 16 0.375 2.599 -9.852 129 HH TYR 16 HH TYR 16 -1.106 1.525 -11.102 130 H ARG 17 HN ARG 17 1.348 7.627 -7.355 131 HA ARG 17 HA ARG 17 1.873 7.069 -10.245 132 1HB ARG 17 HB2 ARG 17 1.576 9.531 -9.989 133 2HB ARG 17 HB1 ARG 17 2.852 9.540 -8.776 134 1HG ARG 17 HG2 ARG 17 4.453 8.662 -10.453 135 2HG ARG 17 HG1 ARG 17 3.174 8.662 -11.666 136 1HD ARG 17 HD2 ARG 17 2.909 11.146 -11.228 137 2HD ARG 17 HD1 ARG 17 4.368 11.053 -10.244 138 HE ARG 17 HE ARG 17 5.108 9.912 -12.665 139 1HH1 ARG 17 HH21 ARG 17 3.678 12.866 -11.605 140 2HH1 ARG 17 HH22 ARG 17 4.348 13.807 -12.895 141 1HH2 ARG 17 HH11 ARG 17 5.991 11.125 -14.354 142 2HH2 ARG 17 HH12 ARG 17 5.657 12.821 -14.451 143 H ILE 18 HN ILE 18 3.781 5.983 -10.535 144 HA ILE 18 HA ILE 18 5.440 5.438 -8.131 145 HB ILE 18 HB ILE 18 5.536 4.324 -10.959 146 1HG1 ILE 18 HG12 ILE 18 4.780 2.975 -8.351 147 2HG1 ILE 18 HG11 ILE 18 3.597 3.673 -9.457 148 1HG2 ILE 18 HG23 ILE 18 7.173 3.697 -8.486 149 2HG2 ILE 18 HG22 ILE 18 7.119 2.660 -9.912 150 3HG2 ILE 18 HG21 ILE 18 7.771 4.295 -10.034 151 1HD1 ILE 18 HD11 ILE 18 5.617 1.554 -10.240 152 2HD1 ILE 18 HD13 ILE 18 3.941 1.217 -9.805 153 3HD1 ILE 18 HD12 ILE 18 4.303 2.179 -11.237 154 H GLU 19 HN GLU 19 6.994 6.936 -7.749 155 HA GLU 19 HA GLU 19 7.750 8.938 -9.615 156 1HB GLU 19 HB2 GLU 19 7.985 9.002 -7.080 157 2HB GLU 19 HB1 GLU 19 9.449 8.038 -7.284 158 1HG GLU 19 HG2 GLU 19 10.143 10.337 -7.232 159 2HG GLU 19 HG1 GLU 19 10.256 9.813 -8.912 160 H ASN 20 HN ASN 20 9.368 5.858 -8.793 161 HA ASN 20 HA ASN 20 10.678 5.875 -11.391 162 1HB ASN 20 HB2 ASN 20 12.969 6.061 -10.654 163 2HB ASN 20 HB1 ASN 20 12.095 7.464 -10.042 164 1HD2 ASN 20 HD22 ASN 20 14.100 5.918 -7.248 165 2HD2 ASN 20 HD21 ASN 20 14.505 6.499 -8.790 166 H TYR 21 HN TYR 21 12.000 3.906 -11.706 167 HA TYR 21 HA TYR 21 11.061 1.672 -9.937 168 1HB TYR 21 HB2 TYR 21 11.990 1.671 -12.826 169 2HB TYR 21 HB1 TYR 21 11.537 0.231 -11.914 170 HD1 TYR 21 HD1 TYR 21 9.213 -0.180 -11.268 171 HD2 TYR 21 HD2 TYR 21 10.314 3.305 -13.525 172 HE1 TYR 21 HE1 TYR 21 6.828 0.213 -11.824 173 HE2 TYR 21 HE2 TYR 21 7.929 3.701 -14.078 174 HH TYR 21 HH TYR 21 5.833 2.342 -14.243 175 H THR 22 HN THR 22 12.598 0.568 -8.798 176 HA THR 22 HA THR 22 15.364 1.427 -8.966 177 HB THR 22 HB THR 22 14.601 0.872 -6.783 178 HG1 THR 22 HG1 THR 22 15.788 -1.502 -6.904 179 1HG2 THR 22 HG23 THR 22 13.598 -1.675 -8.068 180 2HG2 THR 22 HG22 THR 22 13.715 -1.469 -6.322 181 3HG2 THR 22 HG21 THR 22 12.650 -0.425 -7.263 182 HA PRO 23 HA PRO 23 16.564 -1.628 -12.004 183 1HB PRO 23 HB2 PRO 23 19.252 -1.979 -11.131 184 2HB PRO 23 HB1 PRO 23 18.689 -0.824 -12.348 185 1HG PRO 23 HG2 PRO 23 19.535 -0.307 -9.567 186 2HG PRO 23 HG1 PRO 23 19.338 0.841 -10.901 187 1HD PRO 23 HD2 PRO 23 17.581 0.544 -8.687 188 2HD PRO 23 HD1 PRO 23 17.252 1.450 -10.181 189 H ASP 24 HN ASP 24 16.195 -2.154 -8.755 190 HA ASP 24 HA ASP 24 17.448 -4.687 -8.320 191 1HB ASP 24 HB2 ASP 24 14.978 -3.422 -7.099 192 2HB ASP 24 HB1 ASP 24 15.673 -4.941 -6.530 193 H LEU 25 HN LEU 25 14.266 -3.803 -9.621 194 HA LEU 25 HA LEU 25 14.038 -6.522 -10.798 195 1HB LEU 25 HB2 LEU 25 11.914 -5.141 -9.123 196 2HB LEU 25 HB1 LEU 25 11.593 -6.550 -10.123 197 HG LEU 25 HG LEU 25 13.667 -6.493 -7.907 198 1HD1 LEU 25 HD13 LEU 25 10.823 -7.544 -7.890 199 2HD1 LEU 25 HD12 LEU 25 12.002 -7.782 -6.600 200 3HD1 LEU 25 HD11 LEU 25 11.424 -6.159 -6.977 201 1HD2 LEU 25 HD23 LEU 25 12.558 -8.625 -9.741 202 2HD2 LEU 25 HD22 LEU 25 14.239 -8.283 -9.335 203 3HD2 LEU 25 HD21 LEU 25 13.192 -9.063 -8.156 204 HA PRO 26 HA PRO 26 12.851 -4.107 -14.325 205 1HB PRO 26 HB2 PRO 26 10.768 -5.844 -15.286 206 2HB PRO 26 HB1 PRO 26 12.450 -5.782 -15.833 207 1HG PRO 26 HG2 PRO 26 11.161 -7.799 -14.135 208 2HG PRO 26 HG1 PRO 26 12.756 -7.856 -14.900 209 1HD PRO 26 HD2 PRO 26 12.243 -7.486 -12.128 210 2HD PRO 26 HD1 PRO 26 13.800 -7.255 -12.949 211 H ARG 27 HN ARG 27 11.115 -2.672 -14.973 212 HA ARG 27 HA ARG 27 9.351 -1.902 -12.843 213 1HB ARG 27 HB2 ARG 27 8.416 -0.305 -14.477 214 2HB ARG 27 HB1 ARG 27 10.179 -0.293 -14.519 215 1HG ARG 27 HG2 ARG 27 10.043 -1.955 -16.419 216 2HG ARG 27 HG1 ARG 27 8.307 -1.669 -16.461 217 1HD ARG 27 HD2 ARG 27 8.787 0.780 -16.736 218 2HD ARG 27 HD1 ARG 27 10.497 0.395 -16.884 219 HE ARG 27 HE ARG 27 8.499 0.226 -18.953 220 1HH1 ARG 27 HH21 ARG 27 11.192 -1.530 -17.686 221 2HH1 ARG 27 HH22 ARG 27 11.387 -2.491 -19.112 222 1HH2 ARG 27 HH11 ARG 27 8.757 -1.007 -20.803 223 2HH2 ARG 27 HH12 ARG 27 10.017 -2.193 -20.873 224 H ALA 28 HN ALA 28 8.940 -3.971 -15.657 225 HA ALA 28 HA ALA 28 6.100 -4.019 -15.755 226 1HB ALA 28 HB1 ALA 28 7.777 -5.059 -17.398 227 2HB ALA 28 HB3 ALA 28 7.835 -6.432 -16.291 228 3HB ALA 28 HB2 ALA 28 6.315 -5.986 -17.065 229 H ASP 29 HN ASP 29 8.363 -5.932 -13.775 230 HA ASP 29 HA ASP 29 6.223 -7.524 -12.601 231 1HB ASP 29 HB2 ASP 29 9.145 -7.139 -11.903 232 2HB ASP 29 HB1 ASP 29 8.070 -8.177 -10.963 233 H VAL 30 HN VAL 30 7.947 -4.574 -11.753 234 HA VAL 30 HA VAL 30 6.937 -4.419 -9.049 235 HB VAL 30 HB VAL 30 8.025 -2.329 -10.953 236 1HG1 VAL 30 HG13 VAL 30 7.185 -2.126 -8.054 237 2HG1 VAL 30 HG12 VAL 30 8.311 -0.989 -8.797 238 3HG1 VAL 30 HG11 VAL 30 6.661 -1.121 -9.406 239 1HG2 VAL 30 HG22 VAL 30 9.193 -3.837 -8.594 240 2HG2 VAL 30 HG21 VAL 30 9.680 -3.974 -10.284 241 3HG2 VAL 30 HG23 VAL 30 9.995 -2.485 -9.393 242 H ASP 31 HN ASP 31 5.888 -3.003 -12.159 243 HA ASP 31 HA ASP 31 3.719 -1.464 -11.145 244 1HB ASP 31 HB2 ASP 31 4.565 -1.252 -13.462 245 2HB ASP 31 HB1 ASP 31 3.949 -2.861 -13.831 246 H HIS 32 HN HIS 32 3.816 -4.824 -12.320 247 HA HIS 32 HA HIS 32 1.040 -5.383 -11.994 248 1HB HIS 32 HB2 HIS 32 2.576 -6.867 -13.225 249 2HB HIS 32 HB1 HIS 32 3.404 -7.261 -11.719 250 HD1 HIS 32 HD1 HIS 32 -0.135 -7.435 -13.150 251 HD2 HIS 32 HD2 HIS 32 2.303 -9.428 -10.418 252 HE1 HIS 32 HE1 HIS 32 -1.449 -9.449 -12.352 253 H ALA 33 HN ALA 33 3.772 -5.838 -9.750 254 HA ALA 33 HA ALA 33 2.313 -7.008 -7.624 255 1HB ALA 33 HB2 ALA 33 4.721 -5.167 -7.522 256 2HB ALA 33 HB1 ALA 33 4.143 -6.142 -6.171 257 3HB ALA 33 HB3 ALA 33 4.755 -6.927 -7.626 258 H ILE 34 HN ILE 34 3.003 -3.553 -8.260 259 HA ILE 34 HA ILE 34 1.497 -2.634 -5.974 260 HB ILE 34 HB ILE 34 2.280 -1.212 -8.539 261 1HG1 ILE 34 HG12 ILE 34 4.102 -2.157 -6.951 262 2HG1 ILE 34 HG11 ILE 34 4.225 -0.471 -7.435 263 1HG2 ILE 34 HG23 ILE 34 1.015 -0.237 -5.984 264 2HG2 ILE 34 HG22 ILE 34 2.005 0.839 -6.969 265 3HG2 ILE 34 HG21 ILE 34 0.556 0.103 -7.653 266 1HD1 ILE 34 HD11 ILE 34 2.683 -0.992 -4.934 267 2HD1 ILE 34 HD13 ILE 34 4.419 -1.280 -4.862 268 3HD1 ILE 34 HD12 ILE 34 3.806 0.306 -5.320 269 H GLU 35 HN GLU 35 0.748 -2.885 -9.447 270 HA GLU 35 HA GLU 35 -1.901 -1.850 -9.302 271 1HB GLU 35 HB2 GLU 35 -0.674 -2.185 -11.418 272 2HB GLU 35 HB1 GLU 35 -0.764 -3.932 -11.192 273 1HG GLU 35 HG2 GLU 35 -3.172 -3.900 -11.358 274 2HG GLU 35 HG1 GLU 35 -3.197 -2.135 -11.348 275 H LYS 36 HN LYS 36 -0.661 -5.158 -8.892 276 HA LYS 36 HA LYS 36 -3.196 -6.467 -8.732 277 1HB LYS 36 HB2 LYS 36 -0.980 -7.611 -9.012 278 2HB LYS 36 HB1 LYS 36 -0.632 -7.252 -7.321 279 1HG LYS 36 HG2 LYS 36 -2.627 -8.526 -6.628 280 2HG LYS 36 HG1 LYS 36 -2.985 -8.886 -8.318 281 1HD LYS 36 HD2 LYS 36 -0.823 -10.053 -8.535 282 2HD LYS 36 HD1 LYS 36 -0.458 -9.697 -6.846 283 1HE LYS 36 HE2 LYS 36 -2.387 -11.009 -6.117 284 2HE LYS 36 HE1 LYS 36 -2.854 -11.300 -7.793 285 1HZ LYS 36 HZ1 LYS 36 -0.300 -12.163 -6.545 286 2HZ LYS 36 HZ3 LYS 36 -1.629 -13.170 -6.852 287 3HZ LYS 36 HZ2 LYS 36 -0.780 -12.468 -8.146 288 H ALA 37 HN ALA 37 -1.176 -4.950 -6.220 289 HA ALA 37 HA ALA 37 -2.768 -5.795 -3.996 290 1HB ALA 37 HB2 ALA 37 -0.419 -4.657 -4.040 291 2HB ALA 37 HB1 ALA 37 -1.323 -3.147 -4.042 292 3HB ALA 37 HB3 ALA 37 -1.510 -4.285 -2.707 293 H PHE 38 HN PHE 38 -2.884 -2.822 -5.979 294 HA PHE 38 HA PHE 38 -4.995 -1.569 -4.536 295 1HB PHE 38 HB2 PHE 38 -4.037 -1.381 -7.392 296 2HB PHE 38 HB1 PHE 38 -5.479 -0.507 -6.882 297 HD1 PHE 38 HD2 PHE 38 -5.212 0.828 -4.601 298 HD2 PHE 38 HD1 PHE 38 -1.962 -0.289 -7.178 299 HE1 PHE 38 HE2 PHE 38 -3.824 2.640 -3.635 300 HE2 PHE 38 HE1 PHE 38 -0.577 1.530 -6.211 301 HZ PHE 38 HZ PHE 38 -1.508 2.992 -4.443 302 H GLN 39 HN GLN 39 -5.078 -3.910 -7.219 303 HA GLN 39 HA GLN 39 -7.896 -3.827 -7.627 304 1HB GLN 39 HB2 GLN 39 -5.877 -6.039 -8.061 305 2HB GLN 39 HB1 GLN 39 -7.565 -6.156 -8.563 306 1HG GLN 39 HG2 GLN 39 -7.303 -4.122 -9.937 307 2HG GLN 39 HG1 GLN 39 -5.614 -4.007 -9.441 308 1HE2 GLN 39 HE22 GLN 39 -6.659 -7.155 -11.885 309 2HE2 GLN 39 HE21 GLN 39 -7.794 -6.567 -10.768 310 H LEU 40 HN LEU 40 -5.930 -5.807 -5.402 311 HA LEU 40 HA LEU 40 -8.049 -7.458 -4.463 312 1HB LEU 40 HB2 LEU 40 -5.560 -6.458 -3.054 313 2HB LEU 40 HB1 LEU 40 -6.632 -7.685 -2.386 314 HG LEU 40 HG LEU 40 -5.232 -7.900 -5.070 315 1HD1 LEU 40 HD11 LEU 40 -4.556 -9.002 -2.333 316 2HD1 LEU 40 HD13 LEU 40 -3.893 -9.678 -3.822 317 3HD1 LEU 40 HD12 LEU 40 -3.543 -8.006 -3.379 318 1HD2 LEU 40 HD22 LEU 40 -7.157 -9.640 -3.546 319 2HD2 LEU 40 HD21 LEU 40 -7.030 -9.362 -5.283 320 3HD2 LEU 40 HD23 LEU 40 -5.886 -10.431 -4.476 321 H TRP 41 HN TRP 41 -6.961 -4.248 -3.359 322 HA TRP 41 HA TRP 41 -8.883 -4.156 -1.182 323 1HB TRP 41 HB2 TRP 41 -7.253 -2.015 -2.570 324 2HB TRP 41 HB1 TRP 41 -8.296 -1.695 -1.184 325 HD1 TRP 41 HD1 TRP 41 -4.865 -2.661 -2.017 326 HE1 TRP 41 HE1 TRP 41 -3.628 -3.560 0.058 327 HE3 TRP 41 HE3 TRP 41 -8.819 -3.337 1.140 328 HZ2 TRP 41 HZ2 TRP 41 -4.237 -4.450 2.708 329 HZ3 TRP 41 HZ3 TRP 41 -8.464 -4.212 3.431 330 HH2 TRP 41 HH2 TRP 41 -6.180 -4.769 4.218 331 H SER 42 HN SER 42 -8.784 -2.810 -4.477 332 HA SER 42 HA SER 42 -11.305 -1.428 -4.270 333 1HB SER 42 HB2 SER 42 -9.642 -0.841 -5.980 334 2HB SER 42 HB1 SER 42 -9.821 -2.430 -6.717 335 HG SER 42 HG SER 42 -11.805 -0.414 -6.437 336 H ASN 43 HN ASN 43 -10.394 -4.639 -5.464 337 HA ASN 43 HA ASN 43 -12.824 -5.402 -6.635 338 1HB ASN 43 HB2 ASN 43 -10.799 -7.032 -5.087 339 2HB ASN 43 HB1 ASN 43 -12.149 -7.752 -5.967 340 1HD2 ASN 43 HD21 ASN 43 -9.324 -8.140 -6.667 341 2HD2 ASN 43 HD22 ASN 43 -9.102 -7.476 -8.214 342 H VAL 44 HN VAL 44 -12.074 -5.008 -3.237 343 HA VAL 44 HA VAL 44 -14.732 -6.206 -2.513 344 HB VAL 44 HB VAL 44 -13.796 -6.229 -0.182 345 1HG1 VAL 44 HG12 VAL 44 -12.354 -7.712 -2.391 346 2HG1 VAL 44 HG11 VAL 44 -12.145 -8.090 -0.681 347 3HG1 VAL 44 HG13 VAL 44 -13.728 -8.273 -1.436 348 1HG2 VAL 44 HG22 VAL 44 -11.289 -5.371 -1.661 349 2HG2 VAL 44 HG21 VAL 44 -12.103 -4.502 -0.363 350 3HG2 VAL 44 HG23 VAL 44 -11.288 -6.029 -0.027 351 H THR 45 HN THR 45 -13.645 -3.270 -3.337 352 HA THR 45 HA THR 45 -15.572 -1.934 -1.523 353 HB THR 45 HB THR 45 -13.875 -0.003 -1.308 354 HG1 THR 45 HG1 THR 45 -11.695 -1.307 -1.296 355 1HG2 THR 45 HG22 THR 45 -13.480 -2.662 0.074 356 2HG2 THR 45 HG21 THR 45 -12.663 -1.187 0.577 357 3HG2 THR 45 HG23 THR 45 -14.422 -1.285 0.640 358 HA PRO 46 HA PRO 46 -16.561 0.054 -5.388 359 1HB PRO 46 HB2 PRO 46 -17.545 2.508 -4.401 360 2HB PRO 46 HB1 PRO 46 -18.491 1.024 -4.589 361 1HG PRO 46 HG2 PRO 46 -17.440 2.254 -2.104 362 2HG PRO 46 HG1 PRO 46 -18.758 1.087 -2.301 363 1HD PRO 46 HD2 PRO 46 -16.160 0.497 -1.331 364 2HD PRO 46 HD1 PRO 46 -17.375 -0.685 -1.867 365 H LEU 47 HN LEU 47 -14.029 0.884 -3.481 366 HA LEU 47 HA LEU 47 -13.349 3.499 -4.549 367 1HB LEU 47 HB2 LEU 47 -11.610 1.417 -3.191 368 2HB LEU 47 HB1 LEU 47 -11.138 3.084 -3.508 369 HG LEU 47 HG LEU 47 -13.516 2.260 -1.810 370 1HD1 LEU 47 HD13 LEU 47 -10.719 3.161 -1.068 371 2HD1 LEU 47 HD12 LEU 47 -12.062 3.094 0.072 372 3HD1 LEU 47 HD11 LEU 47 -11.475 1.614 -0.686 373 1HD2 LEU 47 HD23 LEU 47 -12.317 4.904 -2.639 374 2HD2 LEU 47 HD22 LEU 47 -14.014 4.433 -2.541 375 3HD2 LEU 47 HD21 LEU 47 -13.110 4.768 -1.070 376 H THR 48 HN THR 48 -11.907 3.989 -6.211 377 HA THR 48 HA THR 48 -10.881 1.698 -7.861 378 HB THR 48 HB THR 48 -11.481 2.910 -9.889 379 HG1 THR 48 HG1 THR 48 -13.038 4.801 -8.756 380 1HG2 THR 48 HG23 THR 48 -13.199 1.465 -8.730 381 2HG2 THR 48 HG22 THR 48 -13.872 2.938 -8.033 382 3HG2 THR 48 HG21 THR 48 -13.880 2.707 -9.781 383 H PHE 49 HN PHE 49 -8.817 2.059 -8.742 384 HA PHE 49 HA PHE 49 -7.461 4.619 -7.921 385 1HB PHE 49 HB2 PHE 49 -6.358 1.799 -8.082 386 2HB PHE 49 HB1 PHE 49 -5.383 3.238 -7.777 387 HD1 PHE 49 HD2 PHE 49 -5.597 4.492 -5.678 388 HD2 PHE 49 HD1 PHE 49 -7.911 0.946 -6.403 389 HE1 PHE 49 HE2 PHE 49 -6.182 4.381 -3.271 390 HE2 PHE 49 HE1 PHE 49 -8.497 0.837 -3.993 391 HZ PHE 49 HZ PHE 49 -7.631 2.554 -2.429 392 H THR 50 HN THR 50 -6.451 5.730 -9.528 393 HA THR 50 HA THR 50 -6.170 4.410 -12.215 394 HB THR 50 HB THR 50 -6.761 7.319 -11.581 395 HG1 THR 50 HG1 THR 50 -8.520 5.861 -13.078 396 1HG2 THR 50 HG21 THR 50 -6.317 5.792 -14.147 397 2HG2 THR 50 HG23 THR 50 -7.219 7.307 -14.112 398 3HG2 THR 50 HG22 THR 50 -5.529 7.275 -13.608 399 H LYS 51 HN LYS 51 -4.127 4.390 -13.022 400 HA LYS 51 HA LYS 51 -1.951 5.609 -11.491 401 1HB LYS 51 HB2 LYS 51 -1.684 3.392 -12.560 402 2HB LYS 51 HB1 LYS 51 -1.914 4.132 -14.143 403 1HG LYS 51 HG2 LYS 51 0.095 5.520 -13.798 404 2HG LYS 51 HG1 LYS 51 0.322 4.803 -12.202 405 1HD LYS 51 HD2 LYS 51 0.546 2.571 -13.250 406 2HD LYS 51 HD1 LYS 51 0.353 3.307 -14.841 407 1HE LYS 51 HE2 LYS 51 2.564 3.948 -12.865 408 2HE LYS 51 HE1 LYS 51 2.740 2.954 -14.310 409 1HZ LYS 51 HZ3 LYS 51 1.788 5.015 -15.497 410 2HZ LYS 51 HZ2 LYS 51 2.267 5.852 -14.098 411 3HZ LYS 51 HZ1 LYS 51 3.417 5.019 -15.029 412 H VAL 52 HN VAL 52 -0.659 7.358 -12.165 413 HA VAL 52 HA VAL 52 -1.556 8.830 -14.630 414 HB VAL 52 HB VAL 52 -1.196 10.945 -13.420 415 1HG1 VAL 52 HG11 VAL 52 -3.444 9.905 -13.419 416 2HG1 VAL 52 HG13 VAL 52 -3.039 9.051 -11.930 417 3HG1 VAL 52 HG12 VAL 52 -3.150 10.810 -11.934 418 1HG2 VAL 52 HG23 VAL 52 -0.425 9.050 -11.198 419 2HG2 VAL 52 HG22 VAL 52 0.434 10.472 -11.787 420 3HG2 VAL 52 HG21 VAL 52 -1.034 10.665 -10.829 421 H SER 53 HN SER 53 0.104 9.307 -15.983 422 HA SER 53 HA SER 53 2.859 8.643 -15.119 423 1HB SER 53 HB2 SER 53 1.905 7.825 -17.301 424 2HB SER 53 HB1 SER 53 1.872 9.497 -17.854 425 HG SER 53 HG SER 53 3.915 7.783 -17.815 426 H GLU 54 HN GLU 54 0.942 11.383 -15.129 427 HA GLU 54 HA GLU 54 3.340 13.115 -14.931 428 1HB GLU 54 HB2 GLU 54 1.074 13.603 -16.886 429 2HB GLU 54 HB1 GLU 54 2.215 14.852 -16.392 430 1HG GLU 54 HG2 GLU 54 4.086 13.476 -17.239 431 2HG GLU 54 HG1 GLU 54 2.941 12.231 -17.740 432 H GLY 55 HN GLY 55 2.863 15.142 -13.847 433 1HA GLY 55 HA2 GLY 55 1.613 16.572 -12.438 434 2HA GLY 55 HA1 GLY 55 0.183 15.594 -12.765 435 H GLN 56 HN GLN 56 0.639 16.413 -10.184 436 HA GLN 56 HA GLN 56 2.063 14.327 -8.695 437 1HB GLN 56 HB2 GLN 56 1.259 15.545 -6.698 438 2HB GLN 56 HB1 GLN 56 2.013 16.646 -7.851 439 1HG GLN 56 HG2 GLN 56 -0.229 17.239 -8.732 440 2HG GLN 56 HG1 GLN 56 -0.969 16.176 -7.536 441 1HE2 GLN 56 HE22 GLN 56 -1.128 18.937 -5.352 442 2HE2 GLN 56 HE21 GLN 56 -1.972 17.712 -6.169 443 H ALA 57 HN ALA 57 0.817 13.159 -6.896 444 HA ALA 57 HA ALA 57 -2.004 12.543 -7.666 445 1HB ALA 57 HB2 ALA 57 -0.120 10.896 -8.571 446 2HB ALA 57 HB1 ALA 57 -0.179 10.268 -6.925 447 3HB ALA 57 HB3 ALA 57 -1.632 10.259 -7.928 448 H ASP 58 HN ASP 58 -3.200 11.507 -5.884 449 HA ASP 58 HA ASP 58 -2.681 12.708 -3.356 450 1HB ASP 58 HB2 ASP 58 -4.391 10.337 -4.142 451 2HB ASP 58 HB1 ASP 58 -4.346 10.976 -2.499 452 H ILE 59 HN ILE 59 -1.932 9.459 -4.594 453 HA ILE 59 HA ILE 59 -0.284 8.961 -2.128 454 HB ILE 59 HB ILE 59 -1.460 6.982 -4.106 455 1HG1 ILE 59 HG12 ILE 59 -2.210 7.451 -1.207 456 2HG1 ILE 59 HG11 ILE 59 -3.080 8.190 -2.552 457 1HG2 ILE 59 HG23 ILE 59 0.113 6.642 -1.535 458 2HG2 ILE 59 HG22 ILE 59 -0.736 5.329 -2.352 459 3HG2 ILE 59 HG21 ILE 59 0.608 6.142 -3.153 460 1HD1 ILE 59 HD11 ILE 59 -2.641 5.204 -2.286 461 2HD1 ILE 59 HD13 ILE 59 -4.094 6.030 -1.723 462 3HD1 ILE 59 HD12 ILE 59 -3.689 6.031 -3.439 463 H MET 60 HN MET 60 1.802 9.485 -2.601 464 HA MET 60 HA MET 60 2.860 8.929 -5.339 465 1HB MET 60 HB2 MET 60 4.059 10.516 -3.049 466 2HB MET 60 HB1 MET 60 4.750 10.356 -4.662 467 1HG MET 60 HG2 MET 60 2.721 11.390 -5.631 468 2HG MET 60 HG1 MET 60 2.050 11.576 -4.011 469 1HE MET 60 HE2 MET 60 4.027 12.988 -6.785 470 2HE MET 60 HE1 MET 60 5.337 13.937 -6.088 471 3HE MET 60 HE3 MET 60 5.377 12.171 -6.004 472 H ILE 61 HN ILE 61 4.144 7.186 -5.638 473 HA ILE 61 HA ILE 61 5.306 5.815 -3.228 474 HB ILE 61 HB ILE 61 4.537 4.683 -5.939 475 1HG1 ILE 61 HG12 ILE 61 3.264 4.218 -3.225 476 2HG1 ILE 61 HG11 ILE 61 2.651 5.391 -4.391 477 1HG2 ILE 61 HG22 ILE 61 5.745 3.482 -3.440 478 2HG2 ILE 61 HG21 ILE 61 4.873 2.496 -4.613 479 3HG2 ILE 61 HG23 ILE 61 6.329 3.364 -5.101 480 1HD1 ILE 61 HD12 ILE 61 2.519 3.499 -6.073 481 2HD1 ILE 61 HD11 ILE 61 2.872 2.391 -4.746 482 3HD1 ILE 61 HD13 ILE 61 1.400 3.363 -4.717 483 H SER 62 HN SER 62 7.531 5.737 -3.158 484 HA SER 62 HA SER 62 9.075 5.872 -5.686 485 1HB SER 62 HB2 SER 62 10.362 7.804 -5.017 486 2HB SER 62 HB1 SER 62 8.656 8.237 -4.949 487 HG SER 62 HG SER 62 9.032 7.340 -2.625 488 H PHE 63 HN PHE 63 11.484 5.702 -5.183 489 HA PHE 63 HA PHE 63 11.920 3.873 -2.837 490 1HB PHE 63 HB2 PHE 63 13.174 3.912 -5.601 491 2HB PHE 63 HB1 PHE 63 13.743 2.895 -4.277 492 HD1 PHE 63 HD2 PHE 63 12.398 1.032 -3.440 493 HD2 PHE 63 HD1 PHE 63 11.011 3.500 -6.671 494 HE1 PHE 63 HE2 PHE 63 10.643 -0.640 -3.965 495 HE2 PHE 63 HE1 PHE 63 9.255 1.828 -7.195 496 HZ PHE 63 HZ PHE 63 9.072 -0.242 -5.841 497 H VAL 64 HN VAL 64 13.674 4.357 -1.497 498 HA VAL 64 HA VAL 64 15.485 6.604 -2.325 499 HB VAL 64 HB VAL 64 15.318 7.472 0.022 500 1HG1 VAL 64 HG12 VAL 64 12.715 7.326 -1.532 501 2HG1 VAL 64 HG11 VAL 64 13.109 8.529 -0.303 502 3HG1 VAL 64 HG13 VAL 64 14.014 8.483 -1.815 503 1HG2 VAL 64 HG22 VAL 64 14.491 5.341 1.022 504 2HG2 VAL 64 HG21 VAL 64 13.447 6.708 1.411 505 3HG2 VAL 64 HG23 VAL 64 12.967 5.559 0.163 506 H ARG 65 HN ARG 65 17.460 6.716 -0.952 507 HA ARG 65 HA ARG 65 18.265 4.032 0.138 508 1HB ARG 65 HB2 ARG 65 19.841 5.970 -1.581 509 2HB ARG 65 HB1 ARG 65 20.572 4.616 -0.722 510 1HG ARG 65 HG2 ARG 65 19.221 3.031 -1.954 511 2HG ARG 65 HG1 ARG 65 18.318 4.335 -2.728 512 1HD ARG 65 HD2 ARG 65 20.406 5.135 -3.789 513 2HD ARG 65 HD1 ARG 65 21.292 3.816 -3.029 514 HE ARG 65 HE ARG 65 19.243 2.558 -4.431 515 1HH1 ARG 65 HH21 ARG 65 21.783 4.792 -5.098 516 2HH1 ARG 65 HH22 ARG 65 21.974 4.288 -6.745 517 1HH2 ARG 65 HH11 ARG 65 19.475 1.890 -6.578 518 2HH2 ARG 65 HH12 ARG 65 20.666 2.646 -7.582 519 H GLY 66 HN GLY 66 19.352 4.095 2.084 520 1HA GLY 66 HA2 GLY 66 19.987 5.012 4.153 521 2HA GLY 66 HA1 GLY 66 20.973 6.072 3.149 522 H ASP 67 HN ASP 67 20.685 7.917 4.410 523 HA ASP 67 HA ASP 67 18.106 8.841 5.320 524 1HB ASP 67 HB2 ASP 67 20.332 9.473 6.327 525 2HB ASP 67 HB1 ASP 67 20.614 10.489 4.914 526 H HIS 68 HN HIS 68 16.614 10.048 4.261 527 HA HIS 68 HA HIS 68 17.389 11.418 1.713 528 1HB HIS 68 HB2 HIS 68 15.116 10.716 0.831 529 2HB HIS 68 HB1 HIS 68 16.290 9.411 0.993 530 HD1 HIS 68 HD1 HIS 68 16.090 8.044 3.377 531 HD2 HIS 68 HD2 HIS 68 12.740 10.202 2.153 532 HE1 HIS 68 HE1 HIS 68 14.123 7.107 4.668 533 H ARG 69 HN ARG 69 17.365 12.944 3.863 534 HA ARG 69 HA ARG 69 16.348 14.771 4.917 535 1HB ARG 69 HB2 ARG 69 14.791 14.675 2.318 536 2HB ARG 69 HB1 ARG 69 14.629 15.975 3.495 537 1HG ARG 69 HG2 ARG 69 17.054 16.438 3.311 538 2HG ARG 69 HG1 ARG 69 17.200 15.153 2.110 539 1HD ARG 69 HD2 ARG 69 15.540 16.359 0.680 540 2HD ARG 69 HD1 ARG 69 15.533 17.674 1.854 541 HE ARG 69 HE ARG 69 18.219 17.354 1.202 542 1HH1 ARG 69 HH21 ARG 69 15.252 17.861 -0.477 543 2HH1 ARG 69 HH22 ARG 69 15.983 18.732 -1.784 544 1HH2 ARG 69 HH11 ARG 69 19.195 18.492 -0.502 545 2HH2 ARG 69 HH12 ARG 69 18.213 19.088 -1.798 546 H ASP 70 HN ASP 70 15.473 12.419 5.974 547 HA ASP 70 HA ASP 70 12.591 12.996 6.545 548 1HB ASP 70 HB2 ASP 70 13.840 10.341 5.816 549 2HB ASP 70 HB1 ASP 70 12.328 10.440 6.720 550 H ASN 71 HN ASN 71 11.909 11.950 8.642 551 HA ASN 71 HA ASN 71 14.067 12.312 10.633 552 1HB ASN 71 HB2 ASN 71 11.081 11.873 10.931 553 2HB ASN 71 HB1 ASN 71 12.192 12.146 12.275 554 1HD2 ASN 71 HD22 ASN 71 12.919 15.562 11.031 555 2HD2 ASN 71 HD21 ASN 71 13.822 14.180 11.426 556 H SER 72 HN SER 72 13.278 9.745 8.819 557 HA SER 72 HA SER 72 13.914 7.823 11.029 558 1HB SER 72 HB2 SER 72 11.467 7.746 10.522 559 2HB SER 72 HB1 SER 72 11.859 7.332 8.856 560 HG SER 72 HG SER 72 12.132 5.361 9.503 561 HA PRO 73 HA PRO 73 16.549 7.360 7.184 562 1HB PRO 73 HB2 PRO 73 18.901 7.279 8.855 563 2HB PRO 73 HB1 PRO 73 18.433 8.550 7.716 564 1HG PRO 73 HG2 PRO 73 18.384 8.669 10.612 565 2HG PRO 73 HG1 PRO 73 17.948 9.946 9.466 566 1HD PRO 73 HD2 PRO 73 16.164 8.347 11.104 567 2HD PRO 73 HD1 PRO 73 15.738 9.651 9.979 568 H PHE 74 HN PHE 74 17.361 5.307 6.553 569 HA PHE 74 HA PHE 74 16.647 3.072 8.277 570 1HB PHE 74 HB2 PHE 74 18.111 3.166 5.621 571 2HB PHE 74 HB1 PHE 74 17.565 1.687 6.413 572 HD1 PHE 74 HD1 PHE 74 15.126 1.275 6.755 573 HD2 PHE 74 HD2 PHE 74 16.577 4.614 4.476 574 HE1 PHE 74 HE1 PHE 74 12.874 1.574 5.758 575 HE2 PHE 74 HE2 PHE 74 14.326 4.913 3.480 576 HZ PHE 74 HZ PHE 74 12.474 3.393 4.121 577 H ASP 75 HN ASP 75 18.007 1.855 9.557 578 HA ASP 75 HA ASP 75 20.829 2.791 9.802 579 1HB ASP 75 HB2 ASP 75 19.379 2.669 11.842 580 2HB ASP 75 HB1 ASP 75 19.253 0.926 11.601 581 H GLY 76 HN GLY 76 20.821 1.482 7.544 582 1HA GLY 76 HA2 GLY 76 22.113 -0.264 6.574 583 2HA GLY 76 HA1 GLY 76 22.201 -1.044 8.154 584 HA PRO 77 HA PRO 77 19.111 -3.206 5.351 585 1HB PRO 77 HB2 PRO 77 20.355 -5.720 6.095 586 2HB PRO 77 HB1 PRO 77 20.301 -4.966 4.496 587 1HG PRO 77 HG2 PRO 77 22.586 -5.187 6.247 588 2HG PRO 77 HG1 PRO 77 22.514 -4.397 4.665 589 1HD PRO 77 HD2 PRO 77 22.674 -3.138 7.278 590 2HD PRO 77 HD1 PRO 77 22.664 -2.351 5.687 591 H GLY 78 HN GLY 78 19.944 -2.868 8.538 592 1HA GLY 78 HA2 GLY 78 17.949 -4.822 9.581 593 2HA GLY 78 HA1 GLY 78 19.088 -3.889 10.557 594 H GLY 79 HN GLY 79 16.572 -3.766 11.464 595 1HA GLY 79 HA2 GLY 79 15.139 -2.020 12.199 596 2HA GLY 79 HA1 GLY 79 15.868 -0.952 11.001 597 H ASN 80 HN ASN 80 13.639 -0.302 10.510 598 HA ASN 80 HA ASN 80 11.726 -2.184 9.448 599 1HB ASN 80 HB2 ASN 80 11.917 0.822 9.108 600 2HB ASN 80 HB1 ASN 80 10.507 -0.162 8.710 601 1HD2 ASN 80 HD22 ASN 80 10.726 1.175 12.401 602 2HD2 ASN 80 HD21 ASN 80 11.406 1.906 11.028 603 H LEU 81 HN LEU 81 11.106 -2.478 7.250 604 HA LEU 81 HA LEU 81 13.350 -2.169 5.336 605 1HB LEU 81 HB2 LEU 81 10.683 -3.526 4.878 606 2HB LEU 81 HB1 LEU 81 12.185 -3.771 3.987 607 HG LEU 81 HG LEU 81 11.655 -4.518 6.878 608 1HD1 LEU 81 HD12 LEU 81 10.713 -5.991 5.059 609 2HD1 LEU 81 HD11 LEU 81 12.365 -6.253 4.499 610 3HD1 LEU 81 HD13 LEU 81 11.884 -6.793 6.107 611 1HD2 LEU 81 HD23 LEU 81 14.181 -4.497 5.218 612 2HD2 LEU 81 HD22 LEU 81 13.931 -3.848 6.837 613 3HD2 LEU 81 HD21 LEU 81 13.995 -5.591 6.586 614 H ALA 82 HN ALA 82 10.447 -0.577 6.175 615 HA ALA 82 HA ALA 82 10.752 1.433 4.149 616 1HB ALA 82 HB1 ALA 82 8.478 -0.535 3.724 617 2HB ALA 82 HB3 ALA 82 8.684 0.984 2.853 618 3HB ALA 82 HB2 ALA 82 9.859 -0.313 2.652 619 H HIS 83 HN HIS 83 8.571 2.811 4.104 620 HA HIS 83 HA HIS 83 6.828 2.544 6.395 621 1HB HIS 83 HB2 HIS 83 7.571 4.551 7.622 622 2HB HIS 83 HB1 HIS 83 8.837 3.325 7.586 623 HD1 HIS 83 HD1 HIS 83 11.058 4.288 7.070 624 HD2 HIS 83 HD2 HIS 83 8.019 6.430 5.183 625 HE1 HIS 83 HE1 HIS 83 12.184 6.171 5.807 626 H ALA 84 HN ALA 84 5.464 4.616 6.620 627 HA ALA 84 HA ALA 84 5.360 6.246 4.144 628 1HB ALA 84 HB3 ALA 84 3.128 4.432 5.098 629 2HB ALA 84 HB2 ALA 84 2.884 5.748 3.950 630 3HB ALA 84 HB1 ALA 84 3.937 4.396 3.531 631 H PHE 85 HN PHE 85 3.670 8.007 4.408 632 HA PHE 85 HA PHE 85 3.717 8.968 7.228 633 1HB PHE 85 HB2 PHE 85 3.093 10.357 4.607 634 2HB PHE 85 HB1 PHE 85 2.989 11.136 6.186 635 HD1 PHE 85 HD1 PHE 85 4.990 11.590 7.510 636 HD2 PHE 85 HD2 PHE 85 5.253 9.717 3.654 637 HE1 PHE 85 HE1 PHE 85 7.429 12.030 7.464 638 HE2 PHE 85 HE2 PHE 85 7.694 10.157 3.607 639 HZ PHE 85 HZ PHE 85 8.782 11.313 5.513 640 H GLN 86 HN GLN 86 1.683 10.036 8.036 641 HA GLN 86 HA GLN 86 -0.523 8.245 7.779 642 1HB GLN 86 HB2 GLN 86 -0.272 11.004 8.987 643 2HB GLN 86 HB1 GLN 86 -1.768 10.074 9.060 644 1HG GLN 86 HG2 GLN 86 -0.473 9.691 11.099 645 2HG GLN 86 HG1 GLN 86 -0.524 8.210 10.145 646 1HE2 GLN 86 HE22 GLN 86 3.036 10.148 10.675 647 2HE2 GLN 86 HE21 GLN 86 1.586 10.888 11.151 648 HA PRO 87 HA PRO 87 -2.486 9.796 4.117 649 1HB PRO 87 HB2 PRO 87 -5.201 9.619 5.051 650 2HB PRO 87 HB1 PRO 87 -4.321 8.428 4.081 651 1HG PRO 87 HG2 PRO 87 -5.014 8.303 6.931 652 2HG PRO 87 HG1 PRO 87 -4.377 7.020 5.891 653 1HD PRO 87 HD2 PRO 87 -2.938 8.404 7.920 654 2HD PRO 87 HD1 PRO 87 -2.255 7.321 6.688 655 H GLY 88 HN GLY 88 -2.318 11.965 3.731 656 1HA GLY 88 HA2 GLY 88 -4.283 13.825 4.634 657 2HA GLY 88 HA1 GLY 88 -2.814 14.046 5.585 658 HA PRO 89 HA PRO 89 -2.616 16.207 1.340 659 1HB PRO 89 HB2 PRO 89 -2.352 18.778 2.603 660 2HB PRO 89 HB1 PRO 89 -3.716 18.193 1.639 661 1HG PRO 89 HG2 PRO 89 -3.582 18.564 4.535 662 2HG PRO 89 HG1 PRO 89 -4.989 18.149 3.545 663 1HD PRO 89 HD2 PRO 89 -3.541 16.396 5.304 664 2HD PRO 89 HD1 PRO 89 -4.865 15.963 4.202 665 H GLY 90 HN GLY 90 -0.703 17.837 0.820 666 1HA GLY 90 HA2 GLY 90 1.585 18.348 0.943 667 2HA GLY 90 HA1 GLY 90 1.516 17.956 2.661 668 H ILE 91 HN ILE 91 3.130 16.510 3.003 669 HA ILE 91 HA ILE 91 3.898 14.542 0.987 670 HB ILE 91 HB ILE 91 5.490 15.670 2.600 671 1HG1 ILE 91 HG12 ILE 91 5.473 12.647 2.821 672 2HG1 ILE 91 HG11 ILE 91 5.973 13.515 1.370 673 1HG2 ILE 91 HG21 ILE 91 3.829 15.289 4.558 674 2HG2 ILE 91 HG23 ILE 91 4.510 13.663 4.632 675 3HG2 ILE 91 HG22 ILE 91 5.549 15.067 4.880 676 1HD1 ILE 91 HD11 ILE 91 7.697 14.706 2.673 677 2HD1 ILE 91 HD13 ILE 91 7.212 13.818 4.117 678 3HD1 ILE 91 HD12 ILE 91 7.928 12.960 2.753 679 H GLY 92 HN GLY 92 1.480 14.672 3.329 680 1HA GLY 92 HA2 GLY 92 1.446 12.055 4.408 681 2HA GLY 92 HA1 GLY 92 0.010 13.044 4.154 682 H GLY 93 HN GLY 93 0.460 10.126 3.709 683 1HA GLY 93 HA2 GLY 93 -0.657 8.672 2.192 684 2HA GLY 93 HA1 GLY 93 -0.768 9.995 1.033 685 H ASP 94 HN ASP 94 2.260 10.437 1.618 686 HA ASP 94 HA ASP 94 3.202 8.964 -0.662 687 1HB ASP 94 HB2 ASP 94 4.677 10.470 1.507 688 2HB ASP 94 HB1 ASP 94 5.482 9.740 0.115 689 H ALA 95 HN ALA 95 4.873 7.308 -0.680 690 HA ALA 95 HA ALA 95 5.174 5.722 1.828 691 1HB ALA 95 HB3 ALA 95 3.216 4.843 0.459 692 2HB ALA 95 HB2 ALA 95 4.379 4.457 -0.810 693 3HB ALA 95 HB1 ALA 95 4.499 3.671 0.764 694 H HIS 96 HN HIS 96 7.332 5.442 2.054 695 HA HIS 96 HA HIS 96 9.062 5.422 -0.387 696 1HB HIS 96 HB2 HIS 96 9.797 5.798 2.532 697 2HB HIS 96 HB1 HIS 96 10.890 5.953 1.158 698 HD2 HIS 96 HD2 HIS 96 7.831 7.788 -0.138 699 HE1 HIS 96 HE1 HIS 96 10.026 10.532 2.258 700 HE2 HIS 96 HE2 HIS 96 8.188 10.295 0.530 701 H PHE 97 HN PHE 97 10.376 3.677 -0.837 702 HA PHE 97 HA PHE 97 10.129 1.270 0.951 703 1HB PHE 97 HB2 PHE 97 10.356 1.534 -2.054 704 2HB PHE 97 HB1 PHE 97 10.703 0.018 -1.223 705 HD1 PHE 97 HD1 PHE 97 8.075 2.668 -1.528 706 HD2 PHE 97 HD2 PHE 97 8.943 -1.456 -0.692 707 HE1 PHE 97 HE1 PHE 97 5.647 2.172 -1.445 708 HE2 PHE 97 HE2 PHE 97 6.515 -1.950 -0.612 709 HZ PHE 97 HZ PHE 97 4.867 -0.137 -0.986 710 H ASP 98 HN ASP 98 12.028 0.375 1.675 711 HA ASP 98 HA ASP 98 14.494 1.842 1.370 712 1HB ASP 98 HB2 ASP 98 13.937 0.460 3.375 713 2HB ASP 98 HB1 ASP 98 14.094 -0.992 2.384 714 H GLU 99 HN GLU 99 15.580 1.849 -0.550 715 HA GLU 99 HA GLU 99 15.335 -0.366 -2.438 716 1HB GLU 99 HB2 GLU 99 15.575 2.067 -3.082 717 2HB GLU 99 HB1 GLU 99 17.248 1.975 -2.548 718 1HG GLU 99 HG2 GLU 99 17.739 0.252 -4.187 719 2HG GLU 99 HG1 GLU 99 16.038 0.159 -4.649 720 H ASP 100 HN ASP 100 17.282 0.202 0.279 721 HA ASP 100 HA ASP 100 19.688 -1.121 -0.734 722 1HB ASP 100 HB2 ASP 100 18.802 -0.349 2.059 723 2HB ASP 100 HB1 ASP 100 20.352 -1.108 1.702 724 H GLU 101 HN GLU 101 16.651 -2.153 0.446 725 HA GLU 101 HA GLU 101 17.613 -4.720 1.510 726 1HB GLU 101 HB2 GLU 101 14.818 -3.707 0.896 727 2HB GLU 101 HB1 GLU 101 15.181 -5.238 1.694 728 1HG GLU 101 HG2 GLU 101 16.143 -2.565 2.737 729 2HG GLU 101 HG1 GLU 101 14.639 -3.320 3.262 730 H ARG 102 HN ARG 102 16.913 -6.798 0.515 731 HA ARG 102 HA ARG 102 17.113 -6.647 -2.447 732 1HB ARG 102 HB2 ARG 102 18.536 -8.235 -1.072 733 2HB ARG 102 HB1 ARG 102 17.055 -9.117 -0.694 734 1HG ARG 102 HG2 ARG 102 16.640 -9.467 -3.100 735 2HG ARG 102 HG1 ARG 102 18.120 -8.587 -3.485 736 1HD ARG 102 HD2 ARG 102 18.032 -11.076 -1.758 737 2HD ARG 102 HD1 ARG 102 18.410 -11.084 -3.482 738 HE ARG 102 HE ARG 102 20.195 -9.250 -2.457 739 1HH1 ARG 102 HH21 ARG 102 19.262 -12.485 -1.726 740 2HH1 ARG 102 HH22 ARG 102 20.819 -12.940 -1.121 741 1HH2 ARG 102 HH11 ARG 102 22.235 -9.822 -1.669 742 2HH2 ARG 102 HH12 ARG 102 22.504 -11.431 -1.087 743 H TRP 103 HN TRP 103 15.172 -6.405 -3.450 744 HA TRP 103 HA TRP 103 12.735 -7.613 -2.260 745 1HB TRP 103 HB2 TRP 103 13.142 -5.772 -4.637 746 2HB TRP 103 HB1 TRP 103 11.570 -6.339 -4.065 747 HD1 TRP 103 HD1 TRP 103 14.018 -3.633 -3.569 748 HE1 TRP 103 HE1 TRP 103 13.449 -2.259 -1.462 749 HE3 TRP 103 HE3 TRP 103 10.559 -6.711 -1.418 750 HZ2 TRP 103 HZ2 TRP 103 11.751 -2.443 0.832 751 HZ3 TRP 103 HZ3 TRP 103 9.485 -6.091 0.724 752 HH2 TRP 103 HH2 TRP 103 10.074 -3.962 1.853 753 H THR 104 HN THR 104 11.729 -9.386 -3.140 754 HA THR 104 HA THR 104 12.736 -10.438 -5.764 755 HB THR 104 HB THR 104 12.666 -12.712 -4.838 756 HG1 THR 104 HG1 THR 104 11.524 -12.979 -3.118 757 1HG2 THR 104 HG23 THR 104 14.749 -11.326 -4.654 758 2HG2 THR 104 HG22 THR 104 14.254 -10.883 -3.020 759 3HG2 THR 104 HG21 THR 104 14.616 -12.566 -3.406 760 H ASN 105 HN ASN 105 11.167 -11.884 -6.816 761 HA ASN 105 HA ASN 105 8.343 -11.164 -6.103 762 1HB ASN 105 HB2 ASN 105 9.585 -11.992 -8.744 763 2HB ASN 105 HB1 ASN 105 7.861 -11.713 -8.493 764 1HD2 ASN 105 HD22 ASN 105 8.471 -8.128 -7.824 765 2HD2 ASN 105 HD21 ASN 105 7.678 -9.418 -7.056 766 H ASN 106 HN ASN 106 10.011 -13.446 -4.999 767 HA ASN 106 HA ASN 106 8.006 -15.563 -5.573 768 1HB ASN 106 HB2 ASN 106 9.841 -17.258 -5.833 769 2HB ASN 106 HB1 ASN 106 9.754 -16.094 -7.153 770 1HD2 ASN 106 HD22 ASN 106 12.589 -14.630 -4.752 771 2HD2 ASN 106 HD21 ASN 106 10.928 -14.499 -4.425 772 H PHE 107 HN PHE 107 9.299 -17.617 -4.160 773 HA PHE 107 HA PHE 107 8.643 -16.881 -1.451 774 1HB PHE 107 HB2 PHE 107 9.285 -19.185 -0.911 775 2HB PHE 107 HB1 PHE 107 8.302 -19.150 -2.376 776 HD1 PHE 107 HD2 PHE 107 9.288 -19.564 -4.575 777 HD2 PHE 107 HD1 PHE 107 11.682 -19.656 -1.010 778 HE1 PHE 107 HE2 PHE 107 11.125 -20.654 -5.836 779 HE2 PHE 107 HE1 PHE 107 13.519 -20.745 -2.271 780 HZ PHE 107 HZ PHE 107 13.240 -21.244 -4.684 781 H ARG 108 HN ARG 108 11.364 -15.995 -3.057 782 HA ARG 108 HA ARG 108 13.509 -16.806 -1.385 783 1HB ARG 108 HB2 ARG 108 13.096 -14.327 -3.058 784 2HB ARG 108 HB1 ARG 108 14.606 -14.655 -2.211 785 1HG ARG 108 HG2 ARG 108 14.803 -16.820 -3.362 786 2HG ARG 108 HG1 ARG 108 13.300 -16.508 -4.219 787 1HD ARG 108 HD2 ARG 108 14.317 -14.493 -5.244 788 2HD ARG 108 HD1 ARG 108 15.826 -14.843 -4.401 789 HE ARG 108 HE ARG 108 15.271 -17.179 -5.798 790 1HH1 ARG 108 HH21 ARG 108 15.583 -13.825 -6.511 791 2HH1 ARG 108 HH22 ARG 108 16.157 -14.083 -8.124 792 1HH2 ARG 108 HH11 ARG 108 16.017 -17.542 -7.901 793 2HH2 ARG 108 HH12 ARG 108 16.403 -16.190 -8.913 794 H GLU 109 HN GLU 109 14.603 -14.275 -0.530 795 HA GLU 109 HA GLU 109 14.004 -14.232 2.147 796 1HB GLU 109 HB2 GLU 109 14.795 -11.911 0.378 797 2HB GLU 109 HB1 GLU 109 14.758 -11.813 2.137 798 1HG GLU 109 HG2 GLU 109 16.354 -13.691 2.278 799 2HG GLU 109 HG1 GLU 109 16.394 -13.786 0.517 800 H TYR 110 HN TYR 110 12.629 -11.665 0.005 801 HA TYR 110 HA TYR 110 10.113 -11.834 1.620 802 1HB TYR 110 HB2 TYR 110 11.550 -9.234 1.018 803 2HB TYR 110 HB1 TYR 110 10.069 -9.435 1.954 804 HD1 TYR 110 HD2 TYR 110 10.148 -10.762 4.117 805 HD2 TYR 110 HD1 TYR 110 13.684 -9.510 2.025 806 HE1 TYR 110 HE2 TYR 110 11.490 -11.121 6.171 807 HE2 TYR 110 HE1 TYR 110 15.028 -9.866 4.077 808 HH TYR 110 HH TYR 110 13.902 -9.996 7.008 809 H ASN 111 HN ASN 111 8.262 -11.176 0.525 810 HA ASN 111 HA ASN 111 8.561 -10.929 -2.424 811 1HB ASN 111 HB2 ASN 111 6.976 -12.617 -1.405 812 2HB ASN 111 HB1 ASN 111 6.022 -11.261 -0.807 813 1HD2 ASN 111 HD22 ASN 111 4.740 -12.305 -4.201 814 2HD2 ASN 111 HD21 ASN 111 4.987 -13.142 -2.745 815 H LEU 112 HN LEU 112 8.414 -8.959 -3.324 816 HA LEU 112 HA LEU 112 8.083 -6.558 -1.874 817 1HB LEU 112 HB2 LEU 112 9.174 -6.672 -4.066 818 2HB LEU 112 HB1 LEU 112 7.642 -7.094 -4.824 819 HG LEU 112 HG LEU 112 6.700 -4.911 -4.148 820 1HD1 LEU 112 HD12 LEU 112 9.386 -4.648 -2.806 821 2HD1 LEU 112 HD11 LEU 112 8.535 -3.205 -3.360 822 3HD1 LEU 112 HD13 LEU 112 7.785 -4.269 -2.172 823 1HD2 LEU 112 HD21 LEU 112 8.026 -5.271 -6.299 824 2HD2 LEU 112 HD23 LEU 112 7.888 -3.598 -5.758 825 3HD2 LEU 112 HD22 LEU 112 9.383 -4.493 -5.484 826 H HIS 113 HN HIS 113 5.669 -8.430 -3.706 827 HA HIS 113 HA HIS 113 3.579 -6.522 -3.582 828 1HB HIS 113 HB2 HIS 113 3.493 -8.550 -4.983 829 2HB HIS 113 HB1 HIS 113 3.350 -9.543 -3.533 830 HD1 HIS 113 HD1 HIS 113 0.955 -10.356 -4.069 831 HD2 HIS 113 HD2 HIS 113 1.287 -6.209 -3.854 832 HE1 HIS 113 HE1 HIS 113 -1.410 -9.449 -4.046 833 H ARG 114 HN ARG 114 4.479 -9.036 -1.198 834 HA ARG 114 HA ARG 114 2.231 -8.694 0.507 835 1HB ARG 114 HB2 ARG 114 5.075 -9.523 1.121 836 2HB ARG 114 HB1 ARG 114 3.778 -9.561 2.316 837 1HG ARG 114 HG2 ARG 114 2.470 -11.044 0.859 838 2HG ARG 114 HG1 ARG 114 3.756 -11.021 -0.342 839 1HD ARG 114 HD2 ARG 114 5.300 -11.887 1.486 840 2HD ARG 114 HD1 ARG 114 3.865 -12.164 2.466 841 HE ARG 114 HE ARG 114 4.860 -13.856 0.367 842 1HH1 ARG 114 HH21 ARG 114 1.902 -12.550 1.576 843 2HH1 ARG 114 HH22 ARG 114 0.910 -13.660 0.692 844 1HH2 ARG 114 HH11 ARG 114 3.582 -15.303 -0.772 845 2HH2 ARG 114 HH12 ARG 114 1.858 -15.217 -0.630 846 H VAL 115 HN VAL 115 5.350 -6.943 0.496 847 HA VAL 115 HA VAL 115 4.674 -5.390 2.840 848 HB VAL 115 HB VAL 115 6.694 -4.915 0.629 849 1HG1 VAL 115 HG13 VAL 115 6.144 -3.406 3.194 850 2HG1 VAL 115 HG12 VAL 115 7.692 -3.316 2.355 851 3HG1 VAL 115 HG11 VAL 115 6.222 -2.760 1.556 852 1HG2 VAL 115 HG23 VAL 115 6.800 -6.107 3.409 853 2HG2 VAL 115 HG22 VAL 115 7.334 -6.825 1.890 854 3HG2 VAL 115 HG21 VAL 115 8.248 -5.499 2.609 855 H ALA 116 HN ALA 116 4.344 -4.822 -0.658 856 HA ALA 116 HA ALA 116 3.515 -2.116 -0.530 857 1HB ALA 116 HB3 ALA 116 2.583 -4.299 -2.422 858 2HB ALA 116 HB2 ALA 116 2.343 -2.570 -2.675 859 3HB ALA 116 HB1 ALA 116 3.974 -3.241 -2.664 860 H ALA 117 HN ALA 117 1.574 -5.103 -0.306 861 HA ALA 117 HA ALA 117 -0.967 -3.870 -0.042 862 1HB ALA 117 HB1 ALA 117 -0.608 -6.314 -0.355 863 2HB ALA 117 HB3 ALA 117 -0.002 -6.414 1.297 864 3HB ALA 117 HB2 ALA 117 -1.681 -5.967 0.999 865 H HIS 118 HN HIS 118 1.402 -4.782 2.472 866 HA HIS 118 HA HIS 118 -0.146 -3.940 4.705 867 1HB HIS 118 HB2 HIS 118 1.915 -5.302 4.885 868 2HB HIS 118 HB1 HIS 118 2.870 -3.902 4.398 869 HD1 HIS 118 HD1 HIS 118 0.796 -5.232 7.240 870 HD2 HIS 118 HD2 HIS 118 3.197 -1.926 6.412 871 HE1 HIS 118 HE1 HIS 118 1.148 -4.034 9.443 872 H GLU 119 HN GLU 119 2.353 -2.114 2.871 873 HA GLU 119 HA GLU 119 2.100 0.289 4.377 874 1HB GLU 119 HB2 GLU 119 2.890 -0.156 1.484 875 2HB GLU 119 HB1 GLU 119 2.989 1.411 2.286 876 1HG GLU 119 HG2 GLU 119 4.485 0.436 4.000 877 2HG GLU 119 HG1 GLU 119 4.404 -1.121 3.173 878 H LEU 120 HN LEU 120 0.315 -0.871 1.531 879 HA LEU 120 HA LEU 120 -1.210 1.525 1.143 880 1HB LEU 120 HB2 LEU 120 -1.788 -1.366 0.462 881 2HB LEU 120 HB1 LEU 120 -2.824 -0.032 -0.037 882 HG LEU 120 HG LEU 120 0.138 -0.191 -0.668 883 1HD1 LEU 120 HD13 LEU 120 -2.270 -0.977 -2.330 884 2HD1 LEU 120 HD12 LEU 120 -0.638 -0.797 -2.973 885 3HD1 LEU 120 HD11 LEU 120 -0.980 -2.039 -1.768 886 1HD2 LEU 120 HD22 LEU 120 -2.084 1.727 -1.339 887 2HD2 LEU 120 HD21 LEU 120 -0.397 2.058 -0.950 888 3HD2 LEU 120 HD23 LEU 120 -0.830 1.449 -2.543 889 H GLY 121 HN GLY 121 -1.757 -1.378 3.128 890 1HA GLY 121 HA2 GLY 121 -4.390 -0.888 3.974 891 2HA GLY 121 HA1 GLY 121 -3.165 -1.640 5.001 892 H HIS 122 HN HIS 122 -1.350 0.523 5.163 893 HA HIS 122 HA HIS 122 -2.566 2.089 7.254 894 1HB HIS 122 HB2 HIS 122 0.037 2.343 5.731 895 2HB HIS 122 HB1 HIS 122 -0.432 3.501 6.977 896 HD1 HIS 122 HD1 HIS 122 -1.196 2.245 9.343 897 HD2 HIS 122 HD2 HIS 122 1.361 0.158 6.797 898 HE1 HIS 122 HE1 HIS 122 -0.122 0.429 10.741 899 H SER 123 HN SER 123 -1.876 2.719 3.830 900 HA SER 123 HA SER 123 -2.601 5.475 3.806 901 1HB SER 123 HB2 SER 123 -2.921 3.385 1.630 902 2HB SER 123 HB1 SER 123 -3.056 5.123 1.384 903 HG SER 123 HG SER 123 -0.950 5.321 1.585 904 H LEU 124 HN LEU 124 -4.544 2.526 3.717 905 HA LEU 124 HA LEU 124 -7.027 3.975 3.167 906 1HB LEU 124 HB2 LEU 124 -6.560 1.131 4.103 907 2HB LEU 124 HB1 LEU 124 -8.109 1.782 3.575 908 HG LEU 124 HG LEU 124 -5.610 1.696 1.858 909 1HD1 LEU 124 HD13 LEU 124 -6.568 -0.559 2.456 910 2HD1 LEU 124 HD12 LEU 124 -8.077 -0.057 1.692 911 3HD1 LEU 124 HD11 LEU 124 -6.604 -0.197 0.731 912 1HD2 LEU 124 HD21 LEU 124 -8.453 2.617 1.425 913 2HD2 LEU 124 HD23 LEU 124 -6.947 3.400 0.945 914 3HD2 LEU 124 HD22 LEU 124 -7.523 1.990 0.065 915 H GLY 125 HN GLY 125 -5.097 3.825 5.841 916 1HA GLY 125 HA2 GLY 125 -5.596 4.790 7.959 917 2HA GLY 125 HA1 GLY 125 -7.311 4.719 7.566 918 H LEU 126 HN LEU 126 -5.739 1.746 6.969 919 HA LEU 126 HA LEU 126 -7.195 0.504 9.174 920 1HB LEU 126 HB2 LEU 126 -5.149 -0.680 7.270 921 2HB LEU 126 HB1 LEU 126 -6.185 -1.600 8.357 922 HG LEU 126 HG LEU 126 -7.175 0.231 6.154 923 1HD1 LEU 126 HD12 LEU 126 -6.034 -1.840 5.343 924 2HD1 LEU 126 HD11 LEU 126 -7.167 -2.798 6.296 925 3HD1 LEU 126 HD13 LEU 126 -7.755 -1.811 4.957 926 1HD2 LEU 126 HD23 LEU 126 -8.522 -1.414 8.286 927 2HD2 LEU 126 HD22 LEU 126 -8.940 0.188 7.678 928 3HD2 LEU 126 HD21 LEU 126 -9.316 -1.240 6.719 929 H SER 127 HN SER 127 -6.255 -0.522 11.001 930 HA SER 127 HA SER 127 -3.521 0.493 11.712 931 1HB SER 127 HB2 SER 127 -5.895 -0.278 13.425 932 2HB SER 127 HB1 SER 127 -4.296 0.066 14.076 933 HG SER 127 HG SER 127 -4.464 2.140 13.401 934 H HIS 128 HN HIS 128 -2.161 -0.966 12.974 935 HA HIS 128 HA HIS 128 -1.896 -3.562 11.891 936 1HB HIS 128 HB2 HIS 128 -0.990 -2.546 14.604 937 2HB HIS 128 HB1 HIS 128 -0.422 -4.028 13.840 938 HD1 HIS 128 HD1 HIS 128 1.384 -1.477 14.505 939 HD2 HIS 128 HD2 HIS 128 -0.176 -2.455 10.764 940 HE1 HIS 128 HE1 HIS 128 2.869 -0.350 12.791 941 H SER 129 HN SER 129 -2.006 -5.605 13.386 942 HA SER 129 HA SER 129 -4.243 -5.570 15.300 943 1HB SER 129 HB2 SER 129 -5.371 -5.787 13.101 944 2HB SER 129 HB1 SER 129 -4.390 -7.206 12.748 945 HG SER 129 HG SER 129 -5.586 -7.343 15.188 946 H THR 130 HN THR 130 -4.442 -7.692 16.395 947 HA THR 130 HA THR 130 -1.792 -9.034 16.536 948 HB THR 130 HB THR 130 -2.649 -9.999 18.635 949 HG1 THR 130 HG1 THR 130 -5.013 -8.804 17.697 950 1HG2 THR 130 HG23 THR 130 -1.666 -7.664 18.514 951 2HG2 THR 130 HG22 THR 130 -3.320 -7.052 18.524 952 3HG2 THR 130 HG21 THR 130 -2.709 -7.965 19.903 953 H ASP 131 HN ASP 131 -4.254 -9.439 14.569 954 HA ASP 131 HA ASP 131 -4.821 -12.295 14.991 955 1HB ASP 131 HB2 ASP 131 -6.546 -10.777 14.057 956 2HB ASP 131 HB1 ASP 131 -5.508 -10.471 12.666 957 H ILE 132 HN ILE 132 -3.336 -13.778 14.394 958 HA ILE 132 HA ILE 132 -1.035 -13.237 12.819 959 HB ILE 132 HB ILE 132 -2.427 -15.849 13.476 960 1HG1 ILE 132 HG12 ILE 132 0.116 -14.626 14.583 961 2HG1 ILE 132 HG11 ILE 132 -1.464 -14.409 15.335 962 1HG2 ILE 132 HG21 ILE 132 0.245 -15.293 12.158 963 2HG2 ILE 132 HG23 ILE 132 -0.159 -16.838 12.905 964 3HG2 ILE 132 HG22 ILE 132 -1.082 -16.264 11.518 965 1HD1 ILE 132 HD13 ILE 132 -0.330 -17.146 14.723 966 2HD1 ILE 132 HD12 ILE 132 -0.035 -16.323 16.254 967 3HD1 ILE 132 HD11 ILE 132 -1.682 -16.743 15.782 968 H GLY 133 HN GLY 133 -4.192 -14.604 11.889 969 1HA GLY 133 HA2 GLY 133 -3.394 -15.185 9.173 970 2HA GLY 133 HA1 GLY 133 -5.052 -15.119 9.762 971 H ALA 134 HN ALA 134 -3.509 -12.231 10.557 972 HA ALA 134 HA ALA 134 -4.846 -10.871 8.257 973 1HB ALA 134 HB2 ALA 134 -3.838 -9.852 10.924 974 2HB ALA 134 HB1 ALA 134 -4.433 -8.796 9.646 975 3HB ALA 134 HB3 ALA 134 -5.511 -9.978 10.383 976 H LEU 135 HN LEU 135 -3.700 -9.661 6.789 977 HA LEU 135 HA LEU 135 -0.863 -10.146 6.507 978 1HB LEU 135 HB2 LEU 135 -2.631 -8.093 5.134 979 2HB LEU 135 HB1 LEU 135 -1.018 -8.573 4.608 980 HG LEU 135 HG LEU 135 -3.372 -10.472 4.855 981 1HD1 LEU 135 HD11 LEU 135 -3.561 -8.672 3.064 982 2HD1 LEU 135 HD13 LEU 135 -2.124 -9.377 2.321 983 3HD1 LEU 135 HD12 LEU 135 -3.599 -10.332 2.471 984 1HD2 LEU 135 HD21 LEU 135 -0.499 -10.752 3.964 985 2HD2 LEU 135 HD23 LEU 135 -1.444 -11.809 5.013 986 3HD2 LEU 135 HD22 LEU 135 -1.737 -11.803 3.277 987 H MET 136 HN MET 136 -2.784 -7.687 8.031 988 HA MET 136 HA MET 136 -0.764 -5.630 8.091 989 1HB MET 136 HB2 MET 136 -3.090 -6.072 9.989 990 2HB MET 136 HB1 MET 136 -2.203 -4.566 9.758 991 1HG MET 136 HG2 MET 136 -3.805 -6.000 7.619 992 2HG MET 136 HG1 MET 136 -4.336 -4.566 8.494 993 1HE MET 136 HE2 MET 136 -3.291 -2.500 8.619 994 2HE MET 136 HE1 MET 136 -1.538 -2.660 8.570 995 3HE MET 136 HE3 MET 136 -2.377 -1.703 7.343 996 H TYR 137 HN TYR 137 -0.233 -8.534 9.185 997 HA TYR 137 HA TYR 137 0.275 -8.205 11.976 998 1HB TYR 137 HB2 TYR 137 0.198 -10.387 10.543 999 2HB TYR 137 HB1 TYR 137 1.903 -10.059 10.235 1000 HD1 TYR 137 HD2 TYR 137 -0.581 -10.360 13.012 1001 HD2 TYR 137 HD1 TYR 137 3.531 -10.730 11.824 1002 HE1 TYR 137 HE2 TYR 137 -0.027 -11.309 15.233 1003 HE2 TYR 137 HE1 TYR 137 4.082 -11.681 14.052 1004 HH TYR 137 HH TYR 137 3.238 -11.754 16.276 1005 HA PRO 138 HA PRO 138 3.781 -5.443 11.622 1006 1HB PRO 138 HB2 PRO 138 5.086 -6.363 14.022 1007 2HB PRO 138 HB1 PRO 138 4.072 -4.926 13.827 1008 1HG PRO 138 HG2 PRO 138 3.398 -7.454 15.137 1009 2HG PRO 138 HG1 PRO 138 2.474 -5.945 15.117 1010 1HD PRO 138 HD2 PRO 138 1.832 -8.342 13.707 1011 2HD PRO 138 HD1 PRO 138 1.052 -6.756 13.522 1012 H SER 139 HN SER 139 4.553 -8.791 12.680 1013 HA SER 139 HA SER 139 7.210 -8.628 11.438 1014 1HB SER 139 HB2 SER 139 5.779 -11.024 12.608 1015 2HB SER 139 HB1 SER 139 7.493 -10.918 12.222 1016 HG SER 139 HG SER 139 6.018 -9.676 14.265 1017 H TYR 140 HN TYR 140 7.901 -9.836 9.641 1018 HA TYR 140 HA TYR 140 5.978 -10.170 7.518 1019 1HB TYR 140 HB2 TYR 140 8.316 -9.597 7.042 1020 2HB TYR 140 HB1 TYR 140 8.851 -11.124 7.745 1021 HD1 TYR 140 HD1 TYR 140 8.346 -13.274 6.634 1022 HD2 TYR 140 HD2 TYR 140 7.284 -9.512 4.852 1023 HE1 TYR 140 HE1 TYR 140 7.991 -14.406 4.456 1024 HE2 TYR 140 HE2 TYR 140 6.929 -10.645 2.675 1025 HH TYR 140 HH TYR 140 7.162 -14.171 2.378 1026 H THR 141 HN THR 141 5.120 -12.090 6.657 1027 HA THR 141 HA THR 141 5.886 -14.685 7.838 1028 HB THR 141 HB THR 141 3.493 -15.201 8.416 1029 HG1 THR 141 HG1 THR 141 3.230 -12.703 7.368 1030 1HG2 THR 141 HG22 THR 141 5.260 -14.384 10.070 1031 2HG2 THR 141 HG21 THR 141 4.508 -12.794 9.935 1032 3HG2 THR 141 HG23 THR 141 3.581 -14.158 10.559 1033 H PHE 142 HN PHE 142 5.590 -16.321 6.364 1034 HA PHE 142 HA PHE 142 4.745 -15.567 3.666 1035 1HB PHE 142 HB2 PHE 142 6.669 -17.106 4.115 1036 2HB PHE 142 HB1 PHE 142 5.522 -18.296 4.732 1037 HD1 PHE 142 HD2 PHE 142 3.874 -19.360 3.232 1038 HD2 PHE 142 HD1 PHE 142 6.825 -16.616 1.746 1039 HE1 PHE 142 HE2 PHE 142 3.418 -20.124 0.917 1040 HE2 PHE 142 HE1 PHE 142 6.368 -17.378 -0.570 1041 HZ PHE 142 HZ PHE 142 4.665 -19.133 -0.984 1042 H SER 143 HN SER 143 2.759 -15.909 2.804 1043 HA SER 143 HA SER 143 0.782 -17.537 4.368 1044 1HB SER 143 HB2 SER 143 -0.938 -16.210 3.284 1045 2HB SER 143 HB1 SER 143 0.254 -15.110 3.970 1046 HG SER 143 HG SER 143 1.221 -15.479 1.687 1047 H GLY 144 HN GLY 144 -0.346 -19.194 3.278 1048 1HA GLY 144 HA2 GLY 144 0.954 -20.472 1.090 1049 2HA GLY 144 HA1 GLY 144 -0.695 -20.821 1.616 1050 H ASP 145 HN ASP 145 -1.893 -18.340 1.201 1051 HA ASP 145 HA ASP 145 -1.527 -17.804 -1.726 1052 1HB ASP 145 HB2 ASP 145 -4.107 -18.322 -0.226 1053 2HB ASP 145 HB1 ASP 145 -4.052 -17.569 -1.821 1054 H VAL 146 HN VAL 146 -2.073 -15.643 -2.354 1055 HA VAL 146 HA VAL 146 -1.889 -13.707 -0.109 1056 HB VAL 146 HB VAL 146 -1.735 -13.303 -3.114 1057 1HG1 VAL 146 HG12 VAL 146 -1.196 -11.436 -0.783 1058 2HG1 VAL 146 HG11 VAL 146 -0.783 -11.083 -2.460 1059 3HG1 VAL 146 HG13 VAL 146 -2.472 -11.264 -1.988 1060 1HG2 VAL 146 HG22 VAL 146 0.107 -14.652 -1.964 1061 2HG2 VAL 146 HG21 VAL 146 0.640 -13.205 -2.820 1062 3HG2 VAL 146 HG23 VAL 146 0.487 -13.185 -1.065 1063 H GLN 147 HN GLN 147 -3.963 -13.540 0.736 1064 HA GLN 147 HA GLN 147 -5.976 -12.232 -1.018 1065 1HB GLN 147 HB2 GLN 147 -6.463 -14.727 0.638 1066 2HB GLN 147 HB1 GLN 147 -7.759 -13.708 0.010 1067 1HG GLN 147 HG2 GLN 147 -6.941 -14.070 -2.287 1068 2HG GLN 147 HG1 GLN 147 -5.638 -15.083 -1.668 1069 1HE2 GLN 147 HE22 GLN 147 -8.793 -17.072 -2.630 1070 2HE2 GLN 147 HE21 GLN 147 -8.053 -15.769 -3.429 1071 H LEU 148 HN LEU 148 -7.640 -11.099 0.311 1072 HA LEU 148 HA LEU 148 -6.439 -9.925 2.693 1073 1HB LEU 148 HB2 LEU 148 -9.248 -9.637 1.577 1074 2HB LEU 148 HB1 LEU 148 -8.548 -8.640 2.849 1075 HG LEU 148 HG LEU 148 -7.390 -8.883 0.056 1076 1HD1 LEU 148 HD12 LEU 148 -9.343 -6.924 1.271 1077 2HD1 LEU 148 HD11 LEU 148 -8.298 -6.453 -0.069 1078 3HD1 LEU 148 HD13 LEU 148 -9.449 -7.773 -0.271 1079 1HD2 LEU 148 HD23 LEU 148 -6.713 -7.264 2.516 1080 2HD2 LEU 148 HD22 LEU 148 -5.634 -8.149 1.437 1081 3HD2 LEU 148 HD21 LEU 148 -6.341 -6.624 0.915 1082 H ALA 149 HN ALA 149 -7.501 -9.971 4.835 1083 HA ALA 149 HA ALA 149 -8.632 -12.674 5.400 1084 1HB ALA 149 HB1 ALA 149 -6.614 -11.761 6.664 1085 2HB ALA 149 HB3 ALA 149 -7.712 -10.592 7.397 1086 3HB ALA 149 HB2 ALA 149 -7.952 -12.318 7.670 1087 H GLN 150 HN GLN 150 -10.488 -12.804 6.882 1088 HA GLN 150 HA GLN 150 -12.640 -11.103 6.127 1089 1HB GLN 150 HB2 GLN 150 -12.959 -13.377 7.053 1090 2HB GLN 150 HB1 GLN 150 -12.365 -12.820 8.617 1091 1HG GLN 150 HG2 GLN 150 -14.231 -11.204 8.755 1092 2HG GLN 150 HG1 GLN 150 -14.825 -11.761 7.190 1093 1HE2 GLN 150 HE22 GLN 150 -16.808 -14.098 8.935 1094 2HE2 GLN 150 HE21 GLN 150 -16.766 -12.793 7.852 1095 H ASP 151 HN ASP 151 -10.487 -11.048 8.949 1096 HA ASP 151 HA ASP 151 -11.805 -8.985 10.393 1097 1HB ASP 151 HB2 ASP 151 -9.963 -10.371 11.319 1098 2HB ASP 151 HB1 ASP 151 -8.829 -9.557 10.242 1099 H ASP 152 HN ASP 152 -9.332 -8.817 7.828 1100 HA ASP 152 HA ASP 152 -9.185 -5.909 7.938 1101 1HB ASP 152 HB2 ASP 152 -8.211 -7.947 5.919 1102 2HB ASP 152 HB1 ASP 152 -7.926 -6.213 5.761 1103 H ILE 153 HN ILE 153 -10.819 -8.283 5.841 1104 HA ILE 153 HA ILE 153 -11.865 -6.414 3.963 1105 HB ILE 153 HB ILE 153 -12.912 -9.093 4.920 1106 1HG1 ILE 153 HG12 ILE 153 -11.591 -8.282 2.315 1107 2HG1 ILE 153 HG11 ILE 153 -10.701 -8.932 3.692 1108 1HG2 ILE 153 HG23 ILE 153 -13.888 -7.254 2.721 1109 2HG2 ILE 153 HG22 ILE 153 -14.243 -8.981 2.742 1110 3HG2 ILE 153 HG21 ILE 153 -14.827 -7.945 4.044 1111 1HD1 ILE 153 HD12 ILE 153 -13.026 -10.352 2.368 1112 2HD1 ILE 153 HD11 ILE 153 -11.333 -10.666 1.983 1113 3HD1 ILE 153 HD13 ILE 153 -11.946 -11.003 3.602 1114 H ASP 154 HN ASP 154 -13.346 -7.743 6.936 1115 HA ASP 154 HA ASP 154 -15.750 -6.232 6.787 1116 1HB ASP 154 HB2 ASP 154 -14.217 -7.324 9.159 1117 2HB ASP 154 HB1 ASP 154 -15.811 -6.584 9.296 1118 H GLY 155 HN GLY 155 -12.594 -5.447 8.220 1119 1HA GLY 155 HA2 GLY 155 -13.345 -3.021 9.496 1120 2HA GLY 155 HA1 GLY 155 -11.715 -3.406 8.956 1121 H ILE 156 HN ILE 156 -11.842 -3.427 6.244 1122 HA ILE 156 HA ILE 156 -12.133 -0.624 5.629 1123 HB ILE 156 HB ILE 156 -10.489 -2.190 4.522 1124 1HG1 ILE 156 HG12 ILE 156 -10.881 -1.219 2.200 1125 2HG1 ILE 156 HG11 ILE 156 -12.389 -0.551 2.817 1126 1HG2 ILE 156 HG22 ILE 156 -12.177 -4.021 4.178 1127 2HG2 ILE 156 HG21 ILE 156 -12.890 -3.051 2.891 1128 3HG2 ILE 156 HG23 ILE 156 -11.232 -3.630 2.745 1129 1HD1 ILE 156 HD13 ILE 156 -9.846 0.008 4.323 1130 2HD1 ILE 156 HD12 ILE 156 -10.177 0.898 2.841 1131 3HD1 ILE 156 HD11 ILE 156 -11.307 0.988 4.187 1132 H GLN 157 HN GLN 157 -14.104 -3.494 4.906 1133 HA GLN 157 HA GLN 157 -15.992 -2.083 3.245 1134 1HB GLN 157 HB2 GLN 157 -16.236 -4.637 4.860 1135 2HB GLN 157 HB1 GLN 157 -17.511 -4.032 3.801 1136 1HG GLN 157 HG2 GLN 157 -15.975 -4.104 1.883 1137 2HG GLN 157 HG1 GLN 157 -14.679 -4.678 2.932 1138 1HE2 GLN 157 HE22 GLN 157 -16.330 -7.643 1.318 1139 2HE2 GLN 157 HE21 GLN 157 -15.560 -6.252 0.721 1140 H ALA 158 HN ALA 158 -15.789 -2.734 6.727 1141 HA ALA 158 HA ALA 158 -18.371 -1.774 7.434 1142 1HB ALA 158 HB3 ALA 158 -15.764 -1.680 8.982 1143 2HB ALA 158 HB2 ALA 158 -17.348 -1.336 9.679 1144 3HB ALA 158 HB1 ALA 158 -16.988 -2.948 9.060 1145 H ILE 159 HN ILE 159 -15.289 -0.052 6.960 1146 HA ILE 159 HA ILE 159 -16.296 2.518 7.791 1147 HB ILE 159 HB ILE 159 -14.017 1.774 5.930 1148 1HG1 ILE 159 HG12 ILE 159 -13.959 2.730 8.808 1149 2HG1 ILE 159 HG11 ILE 159 -13.916 1.026 8.353 1150 1HG2 ILE 159 HG23 ILE 159 -14.852 4.424 7.139 1151 2HG2 ILE 159 HG22 ILE 159 -13.235 4.127 6.503 1152 3HG2 ILE 159 HG21 ILE 159 -14.632 4.045 5.431 1153 1HD1 ILE 159 HD12 ILE 159 -11.946 3.004 7.197 1154 2HD1 ILE 159 HD11 ILE 159 -11.649 2.208 8.741 1155 3HD1 ILE 159 HD13 ILE 159 -11.821 1.247 7.274 1156 H TYR 160 HN TYR 160 -15.827 1.067 4.550 1157 HA TYR 160 HA TYR 160 -17.538 3.207 3.380 1158 1HB TYR 160 HB2 TYR 160 -15.764 1.085 2.147 1159 2HB TYR 160 HB1 TYR 160 -16.824 2.127 1.197 1160 HD1 TYR 160 HD2 TYR 160 -16.450 4.567 1.111 1161 HD2 TYR 160 HD1 TYR 160 -13.770 1.951 3.212 1162 HE1 TYR 160 HE2 TYR 160 -14.754 6.374 1.196 1163 HE2 TYR 160 HE1 TYR 160 -12.074 3.759 3.300 1164 HH TYR 160 HH TYR 160 -12.815 7.011 2.504 1165 H GLY 161 HN GLY 161 -17.237 -0.305 2.744 1166 1HA GLY 161 HA2 GLY 161 -19.615 -1.341 3.570 1167 2HA GLY 161 HA1 GLY 161 -20.115 -0.431 2.145 1168 H ARG 162 HN ARG 162 -20.696 -2.573 1.242 1169 HA ARG 162 HA ARG 162 -18.458 -4.385 0.569 1170 1HB ARG 162 HB2 ARG 162 -21.412 -4.489 -0.123 1171 2HB ARG 162 HB1 ARG 162 -20.239 -5.746 -0.515 1172 1HG ARG 162 HG2 ARG 162 -19.724 -5.968 1.909 1173 2HG ARG 162 HG1 ARG 162 -20.994 -4.800 2.264 1174 1HD ARG 162 HD2 ARG 162 -22.539 -6.374 0.899 1175 2HD ARG 162 HD1 ARG 162 -21.272 -7.580 1.104 1176 HE ARG 162 HE ARG 162 -23.231 -6.841 3.051 1177 1HH1 ARG 162 HH21 ARG 162 -19.836 -7.424 2.798 1178 2HH1 ARG 162 HH22 ARG 162 -19.621 -7.620 4.502 1179 1HH2 ARG 162 HH11 ARG 162 -22.960 -7.116 5.257 1180 2HH2 ARG 162 HH12 ARG 162 -21.385 -7.457 5.890 1181 H SER 163 HN SER 163 -18.378 -5.119 -1.824 1182 HA SER 163 HA SER 163 -17.949 -2.762 -3.474 1183 1HB SER 163 HB2 SER 163 -17.796 -5.738 -3.996 1184 2HB SER 163 HB1 SER 163 -17.547 -4.557 -5.277 1185 HG SER 163 HG SER 163 -15.755 -3.843 -4.284 1186 H GLN 164 HN GLN 164 -20.272 -2.042 -3.204 1187 HA GLN 164 HA GLN 164 -22.368 -3.545 -4.535 1188 1HB GLN 164 HB2 GLN 164 -22.199 -0.691 -3.532 1189 2HB GLN 164 HB1 GLN 164 -23.659 -1.383 -4.247 1190 1HG GLN 164 HG2 GLN 164 -23.708 -3.134 -2.543 1191 2HG GLN 164 HG1 GLN 164 -22.193 -2.547 -1.862 1192 1HE2 GLN 164 HE22 GLN 164 -24.954 -1.094 0.172 1193 2HE2 GLN 164 HE21 GLN 164 -24.394 -2.660 -0.164 1194 H ASN 165 HN ASN 165 -23.042 -3.390 -6.644 1195 HA ASN 165 HA ASN 165 -22.137 -1.147 -8.342 1196 1HB ASN 165 HB2 ASN 165 -21.423 -4.020 -9.002 1197 2HB ASN 165 HB1 ASN 165 -21.076 -2.603 -9.995 1198 1HD2 ASN 165 HD22 ASN 165 -18.394 -3.634 -7.267 1199 2HD2 ASN 165 HD21 ASN 165 -19.562 -4.674 -7.925 1200 HA PRO 166 HA PRO 166 -26.328 -3.074 -9.180 1201 1HB PRO 166 HB2 PRO 166 -27.494 -0.435 -9.199 1202 2HB PRO 166 HB1 PRO 166 -27.739 -1.713 -8.001 1203 1HG PRO 166 HG2 PRO 166 -26.225 0.741 -7.687 1204 2HG PRO 166 HG1 PRO 166 -26.511 -0.520 -6.479 1205 1HD PRO 166 HD2 PRO 166 -24.054 0.038 -7.908 1206 2HD PRO 166 HD1 PRO 166 -24.338 -1.215 -6.683 1207 H VAL 167 HN VAL 167 -26.155 -3.569 -11.343 1208 HA VAL 167 HA VAL 167 -25.333 -1.542 -13.301 1209 HB VAL 167 HB VAL 167 -25.525 -3.403 -14.915 1210 1HG1 VAL 167 HG13 VAL 167 -23.468 -3.130 -13.563 1211 2HG1 VAL 167 HG12 VAL 167 -24.149 -4.196 -12.333 1212 3HG1 VAL 167 HG11 VAL 167 -23.777 -4.826 -13.937 1213 1HG2 VAL 167 HG21 VAL 167 -26.728 -4.798 -12.518 1214 2HG2 VAL 167 HG23 VAL 167 -27.399 -4.646 -14.141 1215 3HG2 VAL 167 HG22 VAL 167 -26.017 -5.702 -13.854 1216 H GLN 168 HN GLN 168 -26.692 -0.645 -14.887 1217 HA GLN 168 HA GLN 168 -29.526 -0.563 -14.213 1218 1HB GLN 168 HB2 GLN 168 -27.929 0.641 -16.494 1219 2HB GLN 168 HB1 GLN 168 -29.637 0.964 -16.224 1220 1HG GLN 168 HG2 GLN 168 -28.974 1.686 -13.856 1221 2HG GLN 168 HG1 GLN 168 -27.308 1.669 -14.435 1222 1HE2 GLN 168 HE22 GLN 168 -28.108 5.094 -15.194 1223 2HE2 GLN 168 HE21 GLN 168 -27.444 4.099 -13.989 1224 HA PRO 169 HA PRO 169 -30.912 -3.900 -16.768 1225 1HB PRO 169 HB2 PRO 169 -33.049 -2.402 -18.064 1226 2HB PRO 169 HB1 PRO 169 -33.183 -3.622 -16.788 1227 1HG PRO 169 HG2 PRO 169 -33.459 -0.739 -16.532 1228 2HG PRO 169 HG1 PRO 169 -33.669 -1.968 -15.276 1229 1HD PRO 169 HD2 PRO 169 -31.516 -0.104 -15.483 1230 2HD PRO 169 HD1 PRO 169 -31.630 -1.471 -14.359 No H/Q in entry = 1230 Start of MODEL 4 1 1H VAL 1 HT3 VAL 1 -5.848 20.014 38.346 2 2H VAL 1 HT2 VAL 1 -7.397 19.322 38.430 3 3H VAL 1 HT1 VAL 1 -7.079 20.796 39.211 4 HA VAL 1 HA VAL 1 -6.801 19.550 41.034 5 HB VAL 1 HB VAL 1 -6.131 17.070 40.770 6 1HG1 VAL 1 HG12 VAL 1 -8.694 18.190 39.608 7 2HG1 VAL 1 HG11 VAL 1 -8.452 16.477 39.951 8 3HG1 VAL 1 HG13 VAL 1 -8.415 17.653 41.264 9 1HG2 VAL 1 HG21 VAL 1 -5.271 17.502 38.400 10 2HG2 VAL 1 HG23 VAL 1 -6.319 16.097 38.592 11 3HG2 VAL 1 HG22 VAL 1 -6.962 17.588 37.906 12 H LEU 2 HN LEU 2 -4.785 17.891 41.834 13 HA LEU 2 HA LEU 2 -2.440 19.607 41.492 14 1HB LEU 2 HB2 LEU 2 -3.067 17.159 43.137 15 2HB LEU 2 HB1 LEU 2 -1.406 17.728 42.999 16 HG LEU 2 HG LEU 2 -2.651 18.636 44.998 17 1HD1 LEU 2 HD11 LEU 2 -0.768 19.879 43.518 18 2HD1 LEU 2 HD13 LEU 2 -2.084 21.032 43.289 19 3HD1 LEU 2 HD12 LEU 2 -1.521 20.642 44.912 20 1HD2 LEU 2 HD22 LEU 2 -4.835 18.818 43.688 21 2HD2 LEU 2 HD21 LEU 2 -4.437 20.205 44.702 22 3HD2 LEU 2 HD23 LEU 2 -4.171 20.281 42.960 23 H THR 3 HN THR 3 -0.819 19.277 40.083 24 HA THR 3 HA THR 3 -0.869 16.823 38.399 25 HB THR 3 HB THR 3 0.620 18.108 36.909 26 HG1 THR 3 HG1 THR 3 1.402 19.322 38.904 27 1HG2 THR 3 HG22 THR 3 -1.859 18.364 36.757 28 2HG2 THR 3 HG21 THR 3 -1.748 19.762 37.829 29 3HG2 THR 3 HG23 THR 3 -0.991 19.808 36.237 30 H GLU 4 HN GLU 4 1.654 16.468 37.618 31 HA GLU 4 HA GLU 4 2.946 15.278 39.906 32 1HB GLU 4 HB2 GLU 4 3.138 14.550 37.458 33 2HB GLU 4 HB1 GLU 4 4.234 15.911 37.234 34 1HG GLU 4 HG2 GLU 4 5.798 15.013 38.834 35 2HG GLU 4 HG1 GLU 4 4.652 13.767 39.333 36 H GLY 5 HN GLY 5 5.382 15.890 40.346 37 1HA GLY 5 HA2 GLY 5 5.455 18.576 41.341 38 2HA GLY 5 HA1 GLY 5 6.845 17.495 41.244 39 H ASN 6 HN ASN 6 4.850 18.619 38.534 40 HA ASN 6 HA ASN 6 6.880 20.532 37.636 41 1HB ASN 6 HB2 ASN 6 6.379 17.912 36.205 42 2HB ASN 6 HB1 ASN 6 7.132 19.304 35.427 43 1HD2 ASN 6 HD22 ASN 6 10.079 19.113 37.570 44 2HD2 ASN 6 HD21 ASN 6 9.019 20.274 36.929 45 HA PRO 7 HA PRO 7 2.358 21.092 36.460 46 1HB PRO 7 HB2 PRO 7 2.511 23.826 37.386 47 2HB PRO 7 HB1 PRO 7 1.581 22.497 38.091 48 1HG PRO 7 HG2 PRO 7 3.994 23.719 39.137 49 2HG PRO 7 HG1 PRO 7 3.032 22.421 39.859 50 1HD PRO 7 HD2 PRO 7 5.624 22.201 38.596 51 2HD PRO 7 HD1 PRO 7 4.653 20.899 39.310 52 H ARG 8 HN ARG 8 1.976 21.737 34.390 53 HA ARG 8 HA ARG 8 4.051 23.272 32.947 54 1HB ARG 8 HB2 ARG 8 1.441 22.152 31.883 55 2HB ARG 8 HB1 ARG 8 2.860 22.629 30.950 56 1HG ARG 8 HG2 ARG 8 2.752 20.363 32.955 57 2HG ARG 8 HG1 ARG 8 2.745 20.174 31.204 58 1HD ARG 8 HD2 ARG 8 4.953 21.557 31.280 59 2HD ARG 8 HD1 ARG 8 4.985 21.131 32.989 60 HE ARG 8 HE ARG 8 5.737 19.438 30.806 61 1HH1 ARG 8 HH21 ARG 8 3.907 19.352 33.729 62 2HH1 ARG 8 HH22 ARG 8 3.897 17.625 33.817 63 1HH2 ARG 8 HH11 ARG 8 5.735 17.196 30.916 64 2HH2 ARG 8 HH12 ARG 8 4.933 16.407 32.233 65 H TRP 9 HN TRP 9 3.103 25.021 31.370 66 HA TRP 9 HA TRP 9 1.816 27.033 32.969 67 1HB TRP 9 HB2 TRP 9 2.209 26.827 29.966 68 2HB TRP 9 HB1 TRP 9 1.600 28.263 30.788 69 HD1 TRP 9 HD1 TRP 9 4.755 26.264 30.174 70 HE1 TRP 9 HE1 TRP 9 6.783 27.577 31.076 71 HE3 TRP 9 HE3 TRP 9 2.344 30.028 32.646 72 HZ2 TRP 9 HZ2 TRP 9 7.313 29.913 32.639 73 HZ3 TRP 9 HZ3 TRP 9 3.635 31.782 33.831 74 HH2 TRP 9 HH2 TRP 9 6.114 31.727 33.833 75 H GLU 10 HN GLU 10 -0.301 27.054 33.509 76 HA GLU 10 HA GLU 10 -2.216 25.335 32.112 77 1HB GLU 10 HB2 GLU 10 -2.464 27.251 34.442 78 2HB GLU 10 HB1 GLU 10 -3.817 26.309 33.814 79 1HG GLU 10 HG2 GLU 10 -2.597 24.225 34.248 80 2HG GLU 10 HG1 GLU 10 -1.206 25.142 34.827 81 H GLN 11 HN GLN 11 -1.141 28.558 31.776 82 HA GLN 11 HA GLN 11 -3.684 29.585 30.705 83 1HB GLN 11 HB2 GLN 11 -0.894 30.756 30.860 84 2HB GLN 11 HB1 GLN 11 -2.283 31.610 30.188 85 1HG GLN 11 HG2 GLN 11 -3.473 31.389 32.329 86 2HG GLN 11 HG1 GLN 11 -2.104 30.509 33.007 87 1HE2 GLN 11 HE22 GLN 11 -1.531 34.506 32.177 88 2HE2 GLN 11 HE21 GLN 11 -2.556 33.599 31.174 89 H THR 12 HN THR 12 -4.059 30.067 28.507 90 HA THR 12 HA THR 12 -2.416 28.495 26.589 91 HB THR 12 HB THR 12 -4.271 28.746 25.074 92 HG1 THR 12 HG1 THR 12 -5.113 30.673 25.169 93 1HG2 THR 12 HG22 THR 12 -4.545 27.194 27.052 94 2HG2 THR 12 HG21 THR 12 -5.471 28.471 27.839 95 3HG2 THR 12 HG23 THR 12 -6.060 27.750 26.341 96 H HIS 13 HN HIS 13 -2.547 31.579 27.834 97 HA HIS 13 HA HIS 13 -1.350 32.796 25.359 98 1HB HIS 13 HB2 HIS 13 -2.969 34.094 27.577 99 2HB HIS 13 HB1 HIS 13 -2.151 34.977 26.288 100 HD1 HIS 13 HD1 HIS 13 -4.902 32.417 26.801 101 HD2 HIS 13 HD2 HIS 13 -3.548 35.048 23.866 102 HE1 HIS 13 HE1 HIS 13 -6.634 32.381 24.954 103 H LEU 14 HN LEU 14 0.728 33.512 25.623 104 HA LEU 14 HA LEU 14 1.754 33.949 28.409 105 1HB LEU 14 HB2 LEU 14 3.189 32.508 26.154 106 2HB LEU 14 HB1 LEU 14 3.869 32.861 27.741 107 HG LEU 14 HG LEU 14 1.375 31.186 27.296 108 1HD1 LEU 14 HD13 LEU 14 4.288 30.433 27.579 109 2HD1 LEU 14 HD12 LEU 14 3.002 29.309 28.022 110 3HD1 LEU 14 HD11 LEU 14 3.128 29.895 26.365 111 1HD2 LEU 14 HD21 LEU 14 3.049 31.920 29.706 112 2HD2 LEU 14 HD23 LEU 14 1.297 31.991 29.520 113 3HD2 LEU 14 HD22 LEU 14 2.098 30.435 29.693 114 H THR 15 HN THR 15 3.633 35.389 28.468 115 HA THR 15 HA THR 15 3.891 37.156 26.052 116 HB THR 15 HB THR 15 3.918 39.105 27.506 117 HG1 THR 15 HG1 THR 15 3.177 37.629 29.736 118 1HG2 THR 15 HG21 THR 15 1.602 37.238 28.078 119 2HG2 THR 15 HG23 THR 15 1.598 38.962 28.450 120 3HG2 THR 15 HG22 THR 15 1.713 38.421 26.778 121 H TYR 16 HN TYR 16 5.976 38.227 25.900 122 HA TYR 16 HA TYR 16 8.077 37.292 27.790 123 1HB TYR 16 HB2 TYR 16 9.520 36.470 26.009 124 2HB TYR 16 HB1 TYR 16 7.985 35.608 25.947 125 HD1 TYR 16 HD1 TYR 16 10.019 38.265 24.365 126 HD2 TYR 16 HD2 TYR 16 6.464 35.871 24.101 127 HE1 TYR 16 HE1 TYR 16 9.702 38.996 22.017 128 HE2 TYR 16 HE2 TYR 16 6.144 36.604 21.753 129 HH TYR 16 HH TYR 16 7.231 37.570 19.969 130 H ARG 17 HN ARG 17 10.095 38.527 27.548 131 HA ARG 17 HA ARG 17 9.887 41.010 25.904 132 1HB ARG 17 HB2 ARG 17 8.906 41.568 28.108 133 2HB ARG 17 HB1 ARG 17 10.370 40.996 28.904 134 1HG ARG 17 HG2 ARG 17 11.692 42.724 27.722 135 2HG ARG 17 HG1 ARG 17 10.227 43.295 26.925 136 1HD ARG 17 HD2 ARG 17 10.615 44.736 28.810 137 2HD ARG 17 HD1 ARG 17 9.257 43.692 29.234 138 HE ARG 17 HE ARG 17 11.435 42.314 30.214 139 1HH1 ARG 17 HH21 ARG 17 10.207 45.526 30.464 140 2HH1 ARG 17 HH22 ARG 17 10.854 45.794 32.048 141 1HH2 ARG 17 HH11 ARG 17 12.292 42.648 32.280 142 2HH2 ARG 17 HH12 ARG 17 12.026 44.159 33.080 143 H ILE 18 HN ILE 18 11.867 41.640 25.117 144 HA ILE 18 HA ILE 18 14.243 40.047 25.927 145 HB ILE 18 HB ILE 18 13.863 42.085 23.698 146 1HG1 ILE 18 HG12 ILE 18 14.126 39.062 23.593 147 2HG1 ILE 18 HG11 ILE 18 12.601 39.931 23.454 148 1HG2 ILE 18 HG21 ILE 18 16.185 40.239 24.346 149 2HG2 ILE 18 HG23 ILE 18 16.043 41.203 22.877 150 3HG2 ILE 18 HG22 ILE 18 16.200 41.999 24.440 151 1HD1 ILE 18 HD13 ILE 18 14.976 40.249 21.592 152 2HD1 ILE 18 HD12 ILE 18 13.499 39.359 21.225 153 3HD1 ILE 18 HD11 ILE 18 13.443 41.107 21.455 154 H GLU 19 HN GLU 19 15.429 40.872 27.587 155 HA GLU 19 HA GLU 19 15.064 43.534 28.589 156 1HB GLU 19 HB2 GLU 19 15.875 41.553 29.924 157 2HB GLU 19 HB1 GLU 19 17.434 41.729 29.116 158 1HG GLU 19 HG2 GLU 19 17.615 44.042 29.947 159 2HG GLU 19 HG1 GLU 19 16.055 43.875 30.754 160 H ASN 20 HN ASN 20 17.588 42.103 26.519 161 HA ASN 20 HA ASN 20 18.243 44.774 25.500 162 1HB ASN 20 HB2 ASN 20 19.548 44.515 27.673 163 2HB ASN 20 HB1 ASN 20 20.431 43.208 26.885 164 1HD2 ASN 20 HD22 ASN 20 22.662 45.795 25.881 165 2HD2 ASN 20 HD21 ASN 20 22.436 44.492 26.945 166 H TYR 21 HN TYR 21 19.671 44.658 23.644 167 HA TYR 21 HA TYR 21 19.703 41.947 22.372 168 1HB TYR 21 HB2 TYR 21 19.885 44.746 21.218 169 2HB TYR 21 HB1 TYR 21 20.104 43.278 20.265 170 HD1 TYR 21 HD1 TYR 21 18.237 41.760 19.827 171 HD2 TYR 21 HD2 TYR 21 17.697 45.354 22.117 172 HE1 TYR 21 HE1 TYR 21 15.780 41.552 19.573 173 HE2 TYR 21 HE2 TYR 21 15.239 45.145 21.864 174 HH TYR 21 HH TYR 21 13.807 42.750 19.742 175 H THR 22 HN THR 22 21.675 40.992 21.961 176 HA THR 22 HA THR 22 24.050 42.251 23.034 177 HB THR 22 HB THR 22 23.948 39.894 23.265 178 HG1 THR 22 HG1 THR 22 25.596 40.003 21.018 179 1HG2 THR 22 HG23 THR 22 23.210 39.937 20.342 180 2HG2 THR 22 HG22 THR 22 23.822 38.472 21.105 181 3HG2 THR 22 HG21 THR 22 22.334 39.213 21.691 182 HA PRO 23 HA PRO 23 25.216 44.352 19.268 183 1HB PRO 23 HB2 PRO 23 28.040 44.194 19.636 184 2HB PRO 23 HB1 PRO 23 26.985 45.519 20.154 185 1HG PRO 23 HG2 PRO 23 28.250 43.419 21.800 186 2HG PRO 23 HG1 PRO 23 27.525 44.950 22.315 187 1HD PRO 23 HD2 PRO 23 26.378 42.379 22.658 188 2HD PRO 23 HD1 PRO 23 25.539 43.935 22.842 189 H ASP 24 HN ASP 24 25.692 41.138 19.939 190 HA ASP 24 HA ASP 24 27.538 40.289 17.931 191 1HB ASP 24 HB2 ASP 24 25.172 38.901 19.209 192 2HB ASP 24 HB1 ASP 24 26.285 38.092 18.106 193 H LEU 25 HN LEU 25 24.018 40.798 17.832 194 HA LEU 25 HA LEU 25 24.191 40.956 14.867 195 1HB LEU 25 HB2 LEU 25 22.263 39.227 16.449 196 2HB LEU 25 HB1 LEU 25 22.012 39.639 14.759 197 HG LEU 25 HG LEU 25 24.598 38.359 15.662 198 1HD1 LEU 25 HD12 LEU 25 21.994 36.986 14.968 199 2HD1 LEU 25 HD11 LEU 25 23.559 36.174 14.963 200 3HD1 LEU 25 HD13 LEU 25 22.915 36.837 16.464 201 1HD2 LEU 25 HD22 LEU 25 23.073 38.530 13.046 202 2HD2 LEU 25 HD21 LEU 25 24.661 39.207 13.408 203 3HD2 LEU 25 HD23 LEU 25 24.453 37.462 13.288 204 HA PRO 26 HA PRO 26 21.623 44.506 15.653 205 1HB PRO 26 HB2 PRO 26 19.913 44.210 13.347 206 2HB PRO 26 HB1 PRO 26 21.318 45.273 13.515 207 1HG PRO 26 HG2 PRO 26 21.109 42.794 11.983 208 2HG PRO 26 HG1 PRO 26 22.450 43.948 12.025 209 1HD PRO 26 HD2 PRO 26 22.399 41.340 13.212 210 2HD PRO 26 HD1 PRO 26 23.662 42.576 13.395 211 H ARG 27 HN ARG 27 19.381 44.977 16.339 212 HA ARG 27 HA ARG 27 18.091 42.721 17.567 213 1HB ARG 27 HB2 ARG 27 16.314 44.340 18.166 214 2HB ARG 27 HB1 ARG 27 17.921 44.974 18.523 215 1HG ARG 27 HG2 ARG 27 17.900 46.227 16.394 216 2HG ARG 27 HG1 ARG 27 16.286 45.605 16.045 217 1HD ARG 27 HD2 ARG 27 15.995 47.793 16.991 218 2HD ARG 27 HD1 ARG 27 15.529 46.633 18.236 219 HE ARG 27 HE ARG 27 18.199 47.088 18.764 220 1HH1 ARG 27 HH21 ARG 27 15.397 49.031 18.260 221 2HH1 ARG 27 HH22 ARG 27 15.933 50.310 19.298 222 1HH2 ARG 27 HH11 ARG 27 18.907 48.734 20.142 223 2HH2 ARG 27 HH12 ARG 27 17.919 50.138 20.368 224 H ALA 28 HN ALA 28 17.567 44.415 14.526 225 HA ALA 28 HA ALA 28 14.966 43.445 13.928 226 1HB ALA 28 HB3 ALA 28 17.295 44.105 12.109 227 2HB ALA 28 HB2 ALA 28 15.672 43.741 11.522 228 3HB ALA 28 HB1 ALA 28 15.946 45.156 12.539 229 H ASP 29 HN ASP 29 18.156 41.963 13.429 230 HA ASP 29 HA ASP 29 17.072 39.632 12.072 231 1HB ASP 29 HB2 ASP 29 19.756 40.193 13.360 232 2HB ASP 29 HB1 ASP 29 19.378 38.683 12.529 233 H VAL 30 HN VAL 30 18.022 40.402 15.403 234 HA VAL 30 HA VAL 30 17.644 37.720 16.398 235 HB VAL 30 HB VAL 30 17.692 40.423 17.766 236 1HG1 VAL 30 HG12 VAL 30 17.402 37.638 18.901 237 2HG1 VAL 30 HG11 VAL 30 18.077 38.961 19.852 238 3HG1 VAL 30 HG13 VAL 30 16.424 39.064 19.244 239 1HG2 VAL 30 HG23 VAL 30 19.688 38.172 17.406 240 2HG2 VAL 30 HG22 VAL 30 19.843 39.849 16.885 241 3HG2 VAL 30 HG21 VAL 30 19.901 39.450 18.601 242 H ASP 31 HN ASP 31 15.536 40.636 16.440 243 HA ASP 31 HA ASP 31 13.362 39.431 17.811 244 1HB ASP 31 HB2 ASP 31 13.434 41.579 15.679 245 2HB ASP 31 HB1 ASP 31 11.940 41.087 16.479 246 H HIS 32 HN HIS 32 14.133 39.479 14.333 247 HA HIS 32 HA HIS 32 11.835 38.039 13.456 248 1HB HIS 32 HB2 HIS 32 13.389 39.166 11.901 249 2HB HIS 32 HB1 HIS 32 14.645 37.998 12.315 250 HD1 HIS 32 HD1 HIS 32 11.056 37.923 11.007 251 HD2 HIS 32 HD2 HIS 32 14.626 35.802 10.649 252 HE1 HIS 32 HE1 HIS 32 10.639 36.104 9.297 253 H ALA 33 HN ALA 33 15.073 36.883 14.390 254 HA ALA 33 HA ALA 33 14.617 34.109 14.009 255 1HB ALA 33 HB3 ALA 33 16.832 35.196 14.472 256 2HB ALA 33 HB2 ALA 33 16.337 35.379 16.155 257 3HB ALA 33 HB1 ALA 33 16.525 33.768 15.462 258 H ILE 34 HN ILE 34 14.187 36.098 16.945 259 HA ILE 34 HA ILE 34 13.204 33.902 18.541 260 HB ILE 34 HB ILE 34 12.818 36.890 18.902 261 1HG1 ILE 34 HG12 ILE 34 15.191 36.328 18.878 262 2HG1 ILE 34 HG11 ILE 34 14.701 36.658 20.534 263 1HG2 ILE 34 HG22 ILE 34 12.318 34.514 20.687 264 2HG2 ILE 34 HG21 ILE 34 12.585 36.127 21.351 265 3HG2 ILE 34 HG23 ILE 34 11.219 35.830 20.275 266 1HD1 ILE 34 HD12 ILE 34 14.311 34.041 20.621 267 2HD1 ILE 34 HD11 ILE 34 15.427 34.041 19.258 268 3HD1 ILE 34 HD13 ILE 34 15.932 34.704 20.809 269 H GLU 35 HN GLU 35 11.628 36.434 16.613 270 HA GLU 35 HA GLU 35 8.954 35.903 17.396 271 1HB GLU 35 HB2 GLU 35 9.622 37.843 16.000 272 2HB GLU 35 HB1 GLU 35 9.971 36.749 14.662 273 1HG GLU 35 HG2 GLU 35 7.611 36.010 14.647 274 2HG GLU 35 HG1 GLU 35 7.263 37.101 15.987 275 H LYS 36 HN LYS 36 10.943 34.400 14.836 276 HA LYS 36 HA LYS 36 8.863 32.699 13.839 277 1HB LYS 36 HB2 LYS 36 11.873 32.427 13.775 278 2HB LYS 36 HB1 LYS 36 10.782 31.306 12.957 279 1HG LYS 36 HG2 LYS 36 9.767 33.262 11.761 280 2HG LYS 36 HG1 LYS 36 11.014 34.287 12.474 281 1HD LYS 36 HD2 LYS 36 11.596 31.836 10.784 282 2HD LYS 36 HD1 LYS 36 11.572 33.480 10.151 283 1HE LYS 36 HE2 LYS 36 13.282 33.993 12.054 284 2HE LYS 36 HE1 LYS 36 13.499 32.244 12.112 285 1HZ LYS 36 HZ3 LYS 36 13.731 32.524 9.551 286 2HZ LYS 36 HZ2 LYS 36 14.135 34.126 9.952 287 3HZ LYS 36 HZ1 LYS 36 15.054 32.836 10.567 288 H ALA 37 HN ALA 37 11.289 32.192 16.409 289 HA ALA 37 HA ALA 37 10.720 29.438 16.808 290 1HB ALA 37 HB1 ALA 37 12.599 30.823 17.854 291 2HB ALA 37 HB3 ALA 37 11.406 31.361 19.038 292 3HB ALA 37 HB2 ALA 37 11.816 29.649 18.910 293 H PHE 38 HN PHE 38 9.338 32.270 18.541 294 HA PHE 38 HA PHE 38 7.455 30.747 20.044 295 1HB PHE 38 HB2 PHE 38 7.514 33.623 19.123 296 2HB PHE 38 HB1 PHE 38 6.138 32.987 20.024 297 HD1 PHE 38 HD2 PHE 38 6.601 31.821 22.273 298 HD2 PHE 38 HD1 PHE 38 9.477 34.287 20.255 299 HE1 PHE 38 HE2 PHE 38 7.847 32.104 24.396 300 HE2 PHE 38 HE1 PHE 38 10.724 34.573 22.380 301 HZ PHE 38 HZ PHE 38 9.910 33.479 24.449 302 H GLN 39 HN GLN 39 7.147 32.304 16.842 303 HA GLN 39 HA GLN 39 4.400 31.654 16.445 304 1HB GLN 39 HB2 GLN 39 6.658 32.096 14.474 305 2HB GLN 39 HB1 GLN 39 4.978 31.882 13.984 306 1HG GLN 39 HG2 GLN 39 5.894 34.001 15.947 307 2HG GLN 39 HG1 GLN 39 5.674 34.294 14.224 308 1HE2 GLN 39 HE22 GLN 39 2.506 34.712 16.513 309 2HE2 GLN 39 HE21 GLN 39 4.122 34.912 16.991 310 H LEU 40 HN LEU 40 7.362 29.809 15.695 311 HA LEU 40 HA LEU 40 6.077 27.681 14.299 312 1HB LEU 40 HB2 LEU 40 8.582 27.761 15.990 313 2HB LEU 40 HB1 LEU 40 8.064 26.303 15.154 314 HG LEU 40 HG LEU 40 8.477 28.957 13.744 315 1HD1 LEU 40 HD11 LEU 40 10.392 26.652 14.188 316 2HD1 LEU 40 HD13 LEU 40 10.636 27.896 12.961 317 3HD1 LEU 40 HD12 LEU 40 10.614 28.335 14.669 318 1HD2 LEU 40 HD23 LEU 40 7.907 26.128 12.872 319 2HD2 LEU 40 HD22 LEU 40 7.210 27.638 12.285 320 3HD2 LEU 40 HD21 LEU 40 8.841 27.183 11.812 321 H TRP 41 HN TRP 41 6.605 28.176 17.791 322 HA TRP 41 HA TRP 41 5.535 25.597 18.539 323 1HB TRP 41 HB2 TRP 41 5.904 28.178 20.083 324 2HB TRP 41 HB1 TRP 41 5.323 26.685 20.817 325 HD1 TRP 41 HD1 TRP 41 8.412 28.495 20.225 326 HE1 TRP 41 HE1 TRP 41 10.467 26.955 20.451 327 HE3 TRP 41 HE3 TRP 41 6.112 23.942 20.097 328 HZ2 TRP 41 HZ2 TRP 41 11.054 24.157 20.562 329 HZ3 TRP 41 HZ3 TRP 41 7.438 21.857 20.263 330 HH2 TRP 41 HH2 TRP 41 9.907 21.957 20.495 331 H SER 42 HN SER 42 4.128 28.855 18.286 332 HA SER 42 HA SER 42 1.520 28.067 19.261 333 1HB SER 42 HB2 SER 42 2.134 30.389 19.382 334 2HB SER 42 HB1 SER 42 2.469 30.449 17.653 335 HG SER 42 HG SER 42 0.011 29.522 17.973 336 H ASN 43 HN ASN 43 3.059 28.030 16.120 337 HA ASN 43 HA ASN 43 0.763 27.957 14.463 338 1HB ASN 43 HB2 ASN 43 3.497 26.710 14.144 339 2HB ASN 43 HB1 ASN 43 2.282 26.698 12.867 340 1HD2 ASN 43 HD22 ASN 43 4.495 29.768 12.579 341 2HD2 ASN 43 HD21 ASN 43 4.851 28.114 12.715 342 H VAL 44 HN VAL 44 2.414 25.274 16.155 343 HA VAL 44 HA VAL 44 0.295 23.418 15.144 344 HB VAL 44 HB VAL 44 1.756 21.617 15.731 345 1HG1 VAL 44 HG12 VAL 44 2.295 23.055 13.694 346 2HG1 VAL 44 HG11 VAL 44 3.573 23.787 14.664 347 3HG1 VAL 44 HG13 VAL 44 3.618 22.061 14.304 348 1HG2 VAL 44 HG23 VAL 44 3.243 23.746 17.276 349 2HG2 VAL 44 HG22 VAL 44 2.637 22.190 17.844 350 3HG2 VAL 44 HG21 VAL 44 4.046 22.251 16.789 351 H THR 45 HN THR 45 0.386 25.466 17.596 352 HA THR 45 HA THR 45 -1.082 23.604 19.387 353 HB THR 45 HB THR 45 0.079 24.392 21.365 354 HG1 THR 45 HG1 THR 45 1.385 26.063 19.499 355 1HG2 THR 45 HG21 THR 45 1.121 22.591 19.785 356 2HG2 THR 45 HG23 THR 45 2.305 23.850 19.428 357 3HG2 THR 45 HG22 THR 45 2.103 23.270 21.077 358 HA PRO 46 HA PRO 46 -3.781 27.161 19.518 359 1HB PRO 46 HB2 PRO 46 -4.956 26.723 22.049 360 2HB PRO 46 HB1 PRO 46 -5.518 26.030 20.519 361 1HG PRO 46 HG2 PRO 46 -4.052 24.705 22.729 362 2HG PRO 46 HG1 PRO 46 -5.028 23.977 21.442 363 1HD PRO 46 HD2 PRO 46 -2.196 23.983 21.566 364 2HD PRO 46 HD1 PRO 46 -3.182 23.579 20.144 365 H LEU 47 HN LEU 47 -1.029 26.843 21.197 366 HA LEU 47 HA LEU 47 -1.352 28.823 23.301 367 1HB LEU 47 HB2 LEU 47 1.169 27.801 21.954 368 2HB LEU 47 HB1 LEU 47 1.110 28.729 23.451 369 HG LEU 47 HG LEU 47 -0.145 26.000 23.031 370 1HD1 LEU 47 HD13 LEU 47 2.383 26.098 23.103 371 2HD1 LEU 47 HD12 LEU 47 2.247 26.768 24.727 372 3HD1 LEU 47 HD11 LEU 47 1.653 25.141 24.392 373 1HD2 LEU 47 HD23 LEU 47 -0.117 27.958 25.323 374 2HD2 LEU 47 HD22 LEU 47 -1.455 26.986 24.707 375 3HD2 LEU 47 HD21 LEU 47 -0.182 26.227 25.658 376 H THR 48 HN THR 48 -0.711 30.998 23.252 377 HA THR 48 HA THR 48 0.104 32.136 20.599 378 HB THR 48 HB THR 48 -1.414 34.027 20.969 379 HG1 THR 48 HG1 THR 48 -1.302 33.555 23.368 380 1HG2 THR 48 HG21 THR 48 -2.208 31.907 19.829 381 2HG2 THR 48 HG23 THR 48 -2.958 31.456 21.360 382 3HG2 THR 48 HG22 THR 48 -3.489 32.909 20.513 383 H PHE 49 HN PHE 49 1.575 33.858 20.780 384 HA PHE 49 HA PHE 49 2.482 34.543 23.564 385 1HB PHE 49 HB2 PHE 49 4.154 34.148 21.068 386 2HB PHE 49 HB1 PHE 49 4.771 34.712 22.622 387 HD1 PHE 49 HD2 PHE 49 4.785 33.213 24.592 388 HD2 PHE 49 HD1 PHE 49 3.555 31.835 20.715 389 HE1 PHE 49 HE2 PHE 49 5.011 30.866 25.357 390 HE2 PHE 49 HE1 PHE 49 3.785 29.486 21.477 391 HZ PHE 49 HZ PHE 49 4.512 29.000 23.799 392 H THR 50 HN THR 50 2.696 36.698 23.988 393 HA THR 50 HA THR 50 2.427 38.622 21.694 394 HB THR 50 HB THR 50 1.402 38.926 24.530 395 HG1 THR 50 HG1 THR 50 0.167 38.405 22.042 396 1HG2 THR 50 HG21 THR 50 1.368 40.743 22.113 397 2HG2 THR 50 HG23 THR 50 0.277 40.958 23.484 398 3HG2 THR 50 HG22 THR 50 2.022 41.085 23.716 399 H LYS 51 HN LYS 51 4.051 40.054 21.497 400 HA LYS 51 HA LYS 51 6.290 40.009 23.381 401 1HB LYS 51 HB2 LYS 51 6.562 40.221 20.890 402 2HB LYS 51 HB1 LYS 51 5.835 41.823 20.995 403 1HG LYS 51 HG2 LYS 51 7.624 42.540 22.536 404 2HG LYS 51 HG1 LYS 51 8.356 40.938 22.430 405 1HD LYS 51 HD2 LYS 51 8.643 41.234 19.991 406 2HD LYS 51 HD1 LYS 51 7.936 42.845 20.109 407 1HE LYS 51 HE2 LYS 51 10.440 41.940 21.559 408 2HE LYS 51 HE1 LYS 51 10.421 42.917 20.092 409 1HZ LYS 51 HZ2 LYS 51 8.718 44.232 21.736 410 2HZ LYS 51 HZ1 LYS 51 9.922 43.694 22.808 411 3HZ LYS 51 HZ3 LYS 51 10.344 44.646 21.469 412 H VAL 52 HN VAL 52 6.638 41.479 25.011 413 HA VAL 52 HA VAL 52 4.923 43.950 25.084 414 HB VAL 52 HB VAL 52 4.842 43.769 27.494 415 1HG1 VAL 52 HG12 VAL 52 4.271 41.096 26.177 416 2HG1 VAL 52 HG11 VAL 52 3.613 41.628 27.724 417 3HG1 VAL 52 HG13 VAL 52 3.171 42.474 26.240 418 1HG2 VAL 52 HG21 VAL 52 6.797 41.511 27.040 419 2HG2 VAL 52 HG23 VAL 52 6.959 42.902 28.109 420 3HG2 VAL 52 HG22 VAL 52 5.839 41.604 28.517 421 H SER 53 HN SER 53 6.043 45.832 25.238 422 HA SER 53 HA SER 53 8.991 45.700 25.302 423 1HB SER 53 HB2 SER 53 7.725 47.143 23.678 424 2HB SER 53 HB1 SER 53 7.182 48.117 25.041 425 HG SER 53 HG SER 53 9.901 47.597 24.897 426 H GLU 54 HN GLU 54 6.446 46.282 27.529 427 HA GLU 54 HA GLU 54 8.433 47.105 29.583 428 1HB GLU 54 HB2 GLU 54 5.915 48.652 28.906 429 2HB GLU 54 HB1 GLU 54 6.778 48.837 30.430 430 1HG GLU 54 HG2 GLU 54 8.070 49.227 27.714 431 2HG GLU 54 HG1 GLU 54 7.403 50.539 28.679 432 H GLY 55 HN GLY 55 7.545 46.825 31.789 433 1HA GLY 55 HA2 GLY 55 6.019 45.853 33.359 434 2HA GLY 55 HA1 GLY 55 5.058 45.233 32.014 435 H GLN 56 HN GLN 56 5.750 43.548 34.142 436 HA GLN 56 HA GLN 56 8.128 42.003 33.382 437 1HB GLN 56 HB2 GLN 56 7.450 42.225 35.753 438 2HB GLN 56 HB1 GLN 56 5.940 41.388 35.393 439 1HG GLN 56 HG2 GLN 56 7.191 39.389 34.702 440 2HG GLN 56 HG1 GLN 56 8.714 40.223 35.013 441 1HE2 GLN 56 HE22 GLN 56 8.661 39.133 38.350 442 2HE2 GLN 56 HE21 GLN 56 9.556 39.408 36.935 443 H ALA 57 HN ALA 57 8.126 40.195 32.099 444 HA ALA 57 HA ALA 57 5.495 39.307 30.976 445 1HB ALA 57 HB2 ALA 57 7.429 40.188 29.490 446 2HB ALA 57 HB1 ALA 57 8.208 38.644 29.829 447 3HB ALA 57 HB3 ALA 57 6.645 38.683 29.015 448 H ASP 58 HN ASP 58 5.167 36.999 30.691 449 HA ASP 58 HA ASP 58 5.842 35.449 32.977 450 1HB ASP 58 HB2 ASP 58 4.878 34.635 30.221 451 2HB ASP 58 HB1 ASP 58 5.031 33.507 31.568 452 H ILE 59 HN ILE 59 7.307 35.603 29.737 453 HA ILE 59 HA ILE 59 9.545 33.848 30.718 454 HB ILE 59 HB ILE 59 8.704 34.504 27.872 455 1HG1 ILE 59 HG12 ILE 59 8.496 31.876 29.375 456 2HG1 ILE 59 HG11 ILE 59 7.151 33.006 29.213 457 1HG2 ILE 59 HG22 ILE 59 10.855 32.732 29.058 458 2HG2 ILE 59 HG21 ILE 59 10.310 32.587 27.388 459 3HG2 ILE 59 HG23 ILE 59 11.070 34.080 27.943 460 1HD1 ILE 59 HD12 ILE 59 8.668 31.868 26.850 461 2HD1 ILE 59 HD11 ILE 59 7.176 31.171 27.477 462 3HD1 ILE 59 HD13 ILE 59 7.173 32.802 26.807 463 H MET 60 HN MET 60 11.283 35.061 31.323 464 HA MET 60 HA MET 60 11.713 37.727 30.044 465 1HB MET 60 HB2 MET 60 13.043 36.521 32.488 466 2HB MET 60 HB1 MET 60 13.170 38.191 31.938 467 1HG MET 60 HG2 MET 60 10.596 36.831 32.781 468 2HG MET 60 HG1 MET 60 11.517 37.952 33.781 469 1HE MET 60 HE2 MET 60 12.301 40.036 33.115 470 2HE MET 60 HE1 MET 60 12.273 40.499 31.416 471 3HE MET 60 HE3 MET 60 11.174 41.273 32.566 472 H ILE 61 HN ILE 61 13.279 37.915 28.536 473 HA ILE 61 HA ILE 61 15.414 35.803 28.392 474 HB ILE 61 HB ILE 61 14.257 37.539 26.184 475 1HG1 ILE 61 HG12 ILE 61 14.015 34.547 26.607 476 2HG1 ILE 61 HG11 ILE 61 12.779 35.696 27.119 477 1HG2 ILE 61 HG22 ILE 61 16.450 35.462 26.286 478 2HG2 ILE 61 HG21 ILE 61 15.586 35.802 24.788 479 3HG2 ILE 61 HG23 ILE 61 16.503 37.078 25.586 480 1HD1 ILE 61 HD11 ILE 61 13.805 35.638 24.277 481 2HD1 ILE 61 HD13 ILE 61 12.473 34.608 24.803 482 3HD1 ILE 61 HD12 ILE 61 12.317 36.362 24.889 483 H SER 62 HN SER 62 17.474 36.530 28.695 484 HA SER 62 HA SER 62 18.106 39.386 28.153 485 1HB SER 62 HB2 SER 62 19.155 39.657 30.354 486 2HB SER 62 HB1 SER 62 17.451 39.257 30.543 487 HG SER 62 HG SER 62 18.495 37.888 31.885 488 H PHE 63 HN PHE 63 20.426 39.776 28.085 489 HA PHE 63 HA PHE 63 22.005 37.316 27.393 490 1HB PHE 63 HB2 PHE 63 22.069 40.158 26.350 491 2HB PHE 63 HB1 PHE 63 23.361 39.007 26.029 492 HD1 PHE 63 HD1 PHE 63 19.793 39.770 25.477 493 HD2 PHE 63 HD2 PHE 63 23.038 37.120 24.545 494 HE1 PHE 63 HE1 PHE 63 18.458 38.787 23.631 495 HE2 PHE 63 HE2 PHE 63 21.708 36.136 22.700 496 HZ PHE 63 HZ PHE 63 19.416 36.969 22.244 497 H VAL 64 HN VAL 64 23.798 36.926 28.651 498 HA VAL 64 HA VAL 64 24.885 39.198 30.303 499 HB VAL 64 HB VAL 64 25.168 37.623 32.173 500 1HG1 VAL 64 HG11 VAL 64 22.380 37.827 31.005 501 2HG1 VAL 64 HG13 VAL 64 22.709 37.275 32.648 502 3HG1 VAL 64 HG12 VAL 64 23.131 38.919 32.168 503 1HG2 VAL 64 HG22 VAL 64 23.873 35.710 30.218 504 2HG2 VAL 64 HG21 VAL 64 25.410 35.520 31.064 505 3HG2 VAL 64 HG23 VAL 64 23.892 35.413 31.956 506 H ARG 65 HN ARG 65 27.107 38.876 31.012 507 HA ARG 65 HA ARG 65 28.693 37.041 29.236 508 1HB ARG 65 HB2 ARG 65 29.305 39.858 30.179 509 2HB ARG 65 HB1 ARG 65 30.505 38.799 29.438 510 1HG ARG 65 HG2 ARG 65 29.101 38.607 27.430 511 2HG ARG 65 HG1 ARG 65 27.897 39.667 28.168 512 1HD ARG 65 HD2 ARG 65 30.767 40.426 27.563 513 2HD ARG 65 HD1 ARG 65 29.361 40.914 26.620 514 HE ARG 65 HE ARG 65 28.807 41.711 29.245 515 1HH1 ARG 65 HH21 ARG 65 31.251 42.221 26.868 516 2HH1 ARG 65 HH22 ARG 65 31.666 43.801 27.444 517 1HH2 ARG 65 HH11 ARG 65 29.331 43.764 30.009 518 2HH2 ARG 65 HH12 ARG 65 30.578 44.675 29.224 519 H GLY 66 HN GLY 66 30.198 35.787 30.277 520 1HA GLY 66 HA2 GLY 66 31.188 34.684 32.101 521 2HA GLY 66 HA1 GLY 66 31.645 36.314 32.586 522 H ASP 67 HN ASP 67 31.381 35.794 34.807 523 HA ASP 67 HA ASP 67 28.973 34.688 35.917 524 1HB ASP 67 HB2 ASP 67 31.237 34.760 37.034 525 2HB ASP 67 HB1 ASP 67 30.973 36.480 37.313 526 H HIS 68 HN HIS 68 27.076 35.652 36.421 527 HA HIS 68 HA HIS 68 26.934 38.643 36.510 528 1HB HIS 68 HB2 HIS 68 24.645 38.327 35.385 529 2HB HIS 68 HB1 HIS 68 26.066 38.109 34.362 530 HD1 HIS 68 HD1 HIS 68 26.960 35.377 34.618 531 HD2 HIS 68 HD2 HIS 68 22.897 36.247 34.936 532 HE1 HIS 68 HE1 HIS 68 25.728 33.215 34.147 533 H ARG 69 HN ARG 69 27.137 37.645 38.885 534 HA ARG 69 HA ARG 69 26.107 37.289 40.955 535 1HB ARG 69 HB2 ARG 69 23.813 38.615 39.479 536 2HB ARG 69 HB1 ARG 69 23.809 38.274 41.207 537 1HG ARG 69 HG2 ARG 69 25.892 39.623 41.446 538 2HG ARG 69 HG1 ARG 69 25.788 40.029 39.734 539 1HD ARG 69 HD2 ARG 69 23.594 41.081 40.096 540 2HD ARG 69 HD1 ARG 69 23.660 40.648 41.806 541 HE ARG 69 HE ARG 69 25.993 42.095 41.375 542 1HH1 ARG 69 HH21 ARG 69 22.607 42.570 40.883 543 2HH1 ARG 69 HH22 ARG 69 22.690 44.288 41.086 544 1HH2 ARG 69 HH11 ARG 69 26.112 44.325 41.648 545 2HH2 ARG 69 HH12 ARG 69 24.673 45.281 41.522 546 H ASP 70 HN ASP 70 26.215 34.983 39.506 547 HA ASP 70 HA ASP 70 23.668 33.640 40.298 548 1HB ASP 70 HB2 ASP 70 25.038 33.423 37.604 549 2HB ASP 70 HB1 ASP 70 23.884 32.226 38.192 550 H ASN 71 HN ASN 71 23.973 31.288 40.568 551 HA ASN 71 HA ASN 71 26.662 30.723 41.662 552 1HB ASN 71 HB2 ASN 71 25.634 28.818 42.719 553 2HB ASN 71 HB1 ASN 71 24.520 30.170 42.907 554 1HD2 ASN 71 HD22 ASN 71 22.620 27.172 41.639 555 2HD2 ASN 71 HD21 ASN 71 23.599 27.446 42.997 556 H SER 72 HN SER 72 25.523 30.640 38.651 557 HA SER 72 HA SER 72 27.097 28.191 37.947 558 1HB SER 72 HB2 SER 72 24.568 27.818 37.911 559 2HB SER 72 HB1 SER 72 24.524 28.949 36.560 560 HG SER 72 HG SER 72 25.007 26.411 36.429 561 HA PRO 73 HA PRO 73 28.238 31.987 35.450 562 1HB PRO 73 HB2 PRO 73 31.025 31.363 35.921 563 2HB PRO 73 HB1 PRO 73 30.113 32.749 36.532 564 1HG PRO 73 HG2 PRO 73 31.048 30.473 38.040 565 2HG PRO 73 HG1 PRO 73 30.106 31.847 38.636 566 1HD PRO 73 HD2 PRO 73 29.197 29.122 38.158 567 2HD PRO 73 HD1 PRO 73 28.284 30.476 38.854 568 H PHE 74 HN PHE 74 29.372 31.865 33.326 569 HA PHE 74 HA PHE 74 29.170 29.199 32.157 570 1HB PHE 74 HB2 PHE 74 30.024 31.882 31.044 571 2HB PHE 74 HB1 PHE 74 30.033 30.403 30.081 572 HD1 PHE 74 HD1 PHE 74 27.946 29.227 29.551 573 HD2 PHE 74 HD2 PHE 74 27.928 32.916 31.746 574 HE1 PHE 74 HE1 PHE 74 25.519 29.463 29.126 575 HE2 PHE 74 HE2 PHE 74 25.495 33.153 31.325 576 HZ PHE 74 HZ PHE 74 24.290 31.424 30.015 577 H ASP 75 HN ASP 75 30.890 27.934 31.365 578 HA ASP 75 HA ASP 75 33.517 28.468 32.646 579 1HB ASP 75 HB2 ASP 75 32.448 26.252 32.975 580 2HB ASP 75 HB1 ASP 75 32.480 25.989 31.232 581 H GLY 76 HN GLY 76 33.718 30.241 30.926 582 1HA GLY 76 HA2 GLY 76 34.830 31.001 29.002 583 2HA GLY 76 HA1 GLY 76 35.575 29.402 28.919 584 HA PRO 77 HA PRO 77 32.577 30.010 25.372 585 1HB PRO 77 HB2 PRO 77 34.640 28.897 23.640 586 2HB PRO 77 HB1 PRO 77 33.938 30.520 23.598 587 1HG PRO 77 HG2 PRO 77 36.577 29.828 24.464 588 2HG PRO 77 HG1 PRO 77 35.805 31.416 24.587 589 1HD PRO 77 HD2 PRO 77 36.347 29.489 26.727 590 2HD PRO 77 HD1 PRO 77 35.767 31.161 26.868 591 H GLY 78 HN GLY 78 34.018 27.598 27.124 592 1HA GLY 78 HA2 GLY 78 32.928 25.359 25.474 593 2HA GLY 78 HA1 GLY 78 34.024 25.183 26.844 594 H GLY 79 HN GLY 79 31.855 23.590 26.941 595 1HA GLY 79 HA2 GLY 79 30.333 23.022 28.696 596 2HA GLY 79 HA1 GLY 79 30.358 24.702 29.236 597 H ASN 80 HN ASN 80 27.967 24.504 29.300 598 HA ASN 80 HA ASN 80 26.469 24.038 26.871 599 1HB ASN 80 HB2 ASN 80 25.719 25.379 29.489 600 2HB ASN 80 HB1 ASN 80 24.573 25.063 28.184 601 1HD2 ASN 80 HD22 ASN 80 24.559 22.164 30.596 602 2HD2 ASN 80 HD21 ASN 80 24.314 23.834 30.779 603 H LEU 81 HN LEU 81 25.316 25.694 25.627 604 HA LEU 81 HA LEU 81 26.917 28.173 25.375 605 1HB LEU 81 HB2 LEU 81 24.526 27.310 23.727 606 2HB LEU 81 HB1 LEU 81 25.758 28.490 23.288 607 HG LEU 81 HG LEU 81 26.113 25.496 23.594 608 1HD1 LEU 81 HD11 LEU 81 26.412 27.425 21.275 609 2HD1 LEU 81 HD13 LEU 81 26.849 25.717 21.216 610 3HD1 LEU 81 HD12 LEU 81 25.168 26.189 21.461 611 1HD2 LEU 81 HD22 LEU 81 28.134 27.729 23.348 612 2HD2 LEU 81 HD21 LEU 81 28.125 26.387 24.491 613 3HD2 LEU 81 HD23 LEU 81 28.504 26.099 22.793 614 H ALA 82 HN ALA 82 24.114 27.161 26.977 615 HA ALA 82 HA ALA 82 23.502 29.786 27.971 616 1HB ALA 82 HB2 ALA 82 21.581 28.647 25.914 617 2HB ALA 82 HB1 ALA 82 21.268 30.058 26.924 618 3HB ALA 82 HB3 ALA 82 22.549 30.106 25.714 619 H HIS 83 HN HIS 83 21.164 29.616 29.090 620 HA HIS 83 HA HIS 83 20.297 26.918 29.736 621 1HB HIS 83 HB2 HIS 83 20.959 26.957 32.121 622 2HB HIS 83 HB1 HIS 83 22.364 26.958 31.058 623 HD1 HIS 83 HD1 HIS 83 22.910 28.040 33.778 624 HD2 HIS 83 HD2 HIS 83 21.423 30.468 30.736 625 HE1 HIS 83 HE1 HIS 83 23.487 30.423 34.417 626 H ALA 84 HN ALA 84 18.627 27.012 31.580 627 HA ALA 84 HA ALA 84 17.448 29.697 31.993 628 1HB ALA 84 HB2 ALA 84 15.937 27.440 30.640 629 2HB ALA 84 HB1 ALA 84 15.241 28.979 31.145 630 3HB ALA 84 HB3 ALA 84 16.456 28.937 29.867 631 H PHE 85 HN PHE 85 15.593 29.577 33.530 632 HA PHE 85 HA PHE 85 16.144 27.525 35.611 633 1HB PHE 85 HB2 PHE 85 14.633 30.150 35.614 634 2HB PHE 85 HB1 PHE 85 14.648 29.052 36.994 635 HD1 PHE 85 HD2 PHE 85 16.668 31.335 34.913 636 HD2 PHE 85 HD1 PHE 85 16.687 28.655 38.275 637 HE1 PHE 85 HE2 PHE 85 18.869 32.233 35.619 638 HE2 PHE 85 HE1 PHE 85 18.889 29.555 38.978 639 HZ PHE 85 HZ PHE 85 19.979 31.343 37.651 640 H GLN 86 HN GLN 86 14.117 26.711 36.812 641 HA GLN 86 HA GLN 86 12.423 25.358 34.955 642 1HB GLN 86 HB2 GLN 86 12.163 25.807 37.941 643 2HB GLN 86 HB1 GLN 86 11.090 24.752 37.024 644 1HG GLN 86 HG2 GLN 86 14.104 24.443 37.071 645 2HG GLN 86 HG1 GLN 86 13.011 23.552 38.130 646 1HE2 GLN 86 HE22 GLN 86 11.467 22.004 35.066 647 2HE2 GLN 86 HE21 GLN 86 10.885 23.043 36.275 648 HA PRO 87 HA PRO 87 9.360 28.487 34.174 649 1HB PRO 87 HB2 PRO 87 7.061 26.746 34.281 650 2HB PRO 87 HB1 PRO 87 7.916 27.313 32.840 651 1HG PRO 87 HG2 PRO 87 7.979 24.652 34.043 652 2HG PRO 87 HG1 PRO 87 8.690 25.182 32.512 653 1HD PRO 87 HD2 PRO 87 10.102 24.554 34.923 654 2HD PRO 87 HD1 PRO 87 10.775 25.266 33.442 655 H GLY 88 HN GLY 88 8.441 29.907 35.618 656 1HA GLY 88 HA2 GLY 88 6.522 29.401 37.553 657 2HA GLY 88 HA1 GLY 88 8.050 29.129 38.390 658 HA PRO 89 HA PRO 89 6.856 33.737 38.172 659 1HB PRO 89 HB2 PRO 89 6.743 33.894 41.038 660 2HB PRO 89 HB1 PRO 89 5.386 34.025 39.909 661 1HG PRO 89 HG2 PRO 89 6.073 31.783 41.668 662 2HG PRO 89 HG1 PRO 89 4.605 32.020 40.709 663 1HD PRO 89 HD2 PRO 89 6.722 30.176 40.154 664 2HD PRO 89 HD1 PRO 89 5.345 30.568 39.104 665 H GLY 90 HN GLY 90 8.123 35.377 39.887 666 1HA GLY 90 HA2 GLY 90 10.240 36.175 40.500 667 2HA GLY 90 HA1 GLY 90 10.577 34.525 41.023 668 H ILE 91 HN ILE 91 12.492 33.970 40.139 669 HA ILE 91 HA ILE 91 13.335 34.966 37.522 670 HB ILE 91 HB ILE 91 14.901 34.601 39.440 671 1HG1 ILE 91 HG12 ILE 91 15.603 32.799 37.111 672 2HG1 ILE 91 HG11 ILE 91 15.579 34.557 36.967 673 1HG2 ILE 91 HG21 ILE 91 13.688 32.396 40.065 674 2HG2 ILE 91 HG23 ILE 91 14.691 31.653 38.819 675 3HG2 ILE 91 HG22 ILE 91 15.444 32.435 40.209 676 1HD1 ILE 91 HD11 ILE 91 17.175 34.666 38.914 677 2HD1 ILE 91 HD13 ILE 91 17.290 32.907 38.847 678 3HD1 ILE 91 HD12 ILE 91 17.846 33.880 37.485 679 H GLY 92 HN GLY 92 11.374 32.415 38.531 680 1HA GLY 92 HA2 GLY 92 12.176 30.285 36.825 681 2HA GLY 92 HA1 GLY 92 10.529 30.537 37.403 682 H GLY 93 HN GLY 93 11.883 29.915 34.658 683 1HA GLY 93 HA2 GLY 93 10.874 30.172 32.504 684 2HA GLY 93 HA1 GLY 93 10.013 31.594 33.095 685 H ASP 94 HN ASP 94 12.834 32.369 34.256 686 HA ASP 94 HA ASP 94 13.520 34.170 32.114 687 1HB ASP 94 HB2 ASP 94 15.014 33.374 34.625 688 2HB ASP 94 HB1 ASP 94 15.543 34.655 33.533 689 H ALA 95 HN ALA 95 15.438 34.137 30.783 690 HA ALA 95 HA ALA 95 16.951 31.562 30.681 691 1HB ALA 95 HB1 ALA 95 15.532 32.857 28.334 692 2HB ALA 95 HB3 ALA 95 16.697 31.541 28.193 693 3HB ALA 95 HB2 ALA 95 15.172 31.281 29.039 694 H HIS 96 HN HIS 96 19.092 31.998 30.548 695 HA HIS 96 HA HIS 96 19.944 34.729 29.657 696 1HB HIS 96 HB2 HIS 96 21.427 32.678 31.320 697 2HB HIS 96 HB1 HIS 96 21.998 34.293 30.927 698 HD2 HIS 96 HD2 HIS 96 18.352 34.958 31.806 699 HE1 HIS 96 HE1 HIS 96 20.534 34.800 35.456 700 HE2 HIS 96 HE2 HIS 96 18.344 35.476 34.372 701 H PHE 97 HN PHE 97 21.265 34.937 27.910 702 HA PHE 97 HA PHE 97 22.122 32.439 26.494 703 1HB PHE 97 HB2 PHE 97 21.442 35.235 25.568 704 2HB PHE 97 HB1 PHE 97 22.395 34.152 24.550 705 HD1 PHE 97 HD1 PHE 97 19.152 34.459 26.374 706 HD2 PHE 97 HD2 PHE 97 21.368 32.402 23.324 707 HE1 PHE 97 HE1 PHE 97 17.081 33.306 25.644 708 HE2 PHE 97 HE2 PHE 97 19.299 31.253 22.593 709 HZ PHE 97 HZ PHE 97 17.153 31.702 23.750 710 H ASP 98 HN ASP 98 24.280 32.110 26.077 711 HA ASP 98 HA ASP 98 26.246 33.593 27.571 712 1HB ASP 98 HB2 ASP 98 26.527 31.205 26.943 713 2HB ASP 98 HB1 ASP 98 26.656 31.677 25.247 714 H GLU 99 HN GLU 99 26.284 35.752 26.973 715 HA GLU 99 HA GLU 99 26.293 36.607 24.196 716 1HB GLU 99 HB2 GLU 99 25.367 37.929 26.085 717 2HB GLU 99 HB1 GLU 99 26.989 38.144 26.697 718 1HG GLU 99 HG2 GLU 99 27.653 39.389 24.743 719 2HG GLU 99 HG1 GLU 99 26.142 38.993 23.920 720 H ASP 100 HN ASP 100 28.718 35.293 26.156 721 HA ASP 100 HA ASP 100 30.927 36.918 25.134 722 1HB ASP 100 HB2 ASP 100 30.843 34.275 26.617 723 2HB ASP 100 HB1 ASP 100 32.341 35.068 26.135 724 H GLU 101 HN GLU 101 29.106 34.203 24.049 725 HA GLU 101 HA GLU 101 31.173 33.280 22.157 726 1HB GLU 101 HB2 GLU 101 28.311 32.441 22.682 727 2HB GLU 101 HB1 GLU 101 29.323 31.717 21.428 728 1HG GLU 101 HG2 GLU 101 30.926 30.952 23.055 729 2HG GLU 101 HG1 GLU 101 30.137 31.867 24.341 730 H ARG 102 HN ARG 102 30.581 33.133 19.797 731 HA ARG 102 HA ARG 102 29.403 35.707 18.927 732 1HB ARG 102 HB2 ARG 102 31.592 34.973 18.011 733 2HB ARG 102 HB1 ARG 102 30.832 33.524 17.368 734 1HG ARG 102 HG2 ARG 102 30.977 35.030 15.540 735 2HG ARG 102 HG1 ARG 102 29.297 35.088 16.037 736 1HD ARG 102 HD2 ARG 102 29.660 37.164 17.233 737 2HD ARG 102 HD1 ARG 102 31.397 37.073 16.980 738 HE ARG 102 HE ARG 102 29.401 38.163 15.188 739 1HH1 ARG 102 HH21 ARG 102 32.300 36.282 15.182 740 2HH1 ARG 102 HH22 ARG 102 32.604 36.540 13.496 741 1HH2 ARG 102 HH11 ARG 102 29.798 38.511 13.015 742 2HH2 ARG 102 HH12 ARG 102 31.196 37.804 12.274 743 H TRP 103 HN TRP 103 27.234 35.704 18.541 744 HA TRP 103 HA TRP 103 25.859 33.180 17.825 745 1HB TRP 103 HB2 TRP 103 24.852 35.976 18.425 746 2HB TRP 103 HB1 TRP 103 23.797 34.647 17.948 747 HD1 TRP 103 HD1 TRP 103 25.108 36.256 20.924 748 HE1 TRP 103 HE1 TRP 103 24.908 34.729 22.992 749 HE3 TRP 103 HE3 TRP 103 24.140 31.789 18.639 750 HZ2 TRP 103 HZ2 TRP 103 24.412 31.979 23.597 751 HZ3 TRP 103 HZ3 TRP 103 23.810 29.736 19.987 752 HH2 TRP 103 HH2 TRP 103 23.944 29.825 22.460 753 H THR 104 HN THR 104 25.141 32.728 15.766 754 HA THR 104 HA THR 104 25.196 34.909 13.717 755 HB THR 104 HB THR 104 26.258 33.289 12.133 756 HG1 THR 104 HG1 THR 104 27.251 31.778 14.195 757 1HG2 THR 104 HG21 THR 104 27.520 35.031 13.501 758 2HG2 THR 104 HG23 THR 104 27.963 33.719 14.592 759 3HG2 THR 104 HG22 THR 104 28.484 33.680 12.908 760 H ASN 105 HN ASN 105 24.125 34.111 11.641 761 HA ASN 105 HA ASN 105 21.806 32.318 12.301 762 1HB ASN 105 HB2 ASN 105 21.937 34.816 10.601 763 2HB ASN 105 HB1 ASN 105 20.568 33.703 10.581 764 1HD2 ASN 105 HD22 ASN 105 20.004 36.415 13.154 765 2HD2 ASN 105 HD21 ASN 105 20.396 36.460 11.504 766 H ASN 106 HN ASN 106 24.489 31.701 10.954 767 HA ASN 106 HA ASN 106 23.274 30.312 8.627 768 1HB ASN 106 HB2 ASN 106 24.863 31.107 7.028 769 2HB ASN 106 HB1 ASN 106 24.204 32.532 7.831 770 1HD2 ASN 106 HD22 ASN 106 27.287 33.406 9.384 771 2HD2 ASN 106 HD21 ASN 106 25.612 33.676 9.368 772 H PHE 107 HN PHE 107 25.584 29.317 7.492 773 HA PHE 107 HA PHE 107 26.166 27.057 9.086 774 1HB PHE 107 HB2 PHE 107 26.459 27.188 6.626 775 2HB PHE 107 HB1 PHE 107 27.844 28.251 6.860 776 HD1 PHE 107 HD2 PHE 107 26.569 24.814 7.208 777 HD2 PHE 107 HD1 PHE 107 29.962 27.395 7.742 778 HE1 PHE 107 HE2 PHE 107 28.034 22.833 7.482 779 HE2 PHE 107 HE1 PHE 107 31.427 25.411 8.016 780 HZ PHE 107 HZ PHE 107 30.462 23.131 7.886 781 H ARG 108 HN ARG 108 27.135 30.126 9.848 782 HA ARG 108 HA ARG 108 29.898 29.853 10.462 783 1HB ARG 108 HB2 ARG 108 27.673 31.515 11.600 784 2HB ARG 108 HB1 ARG 108 29.253 31.546 12.366 785 1HG ARG 108 HG2 ARG 108 28.994 31.957 9.389 786 2HG ARG 108 HG1 ARG 108 28.713 33.300 10.489 787 1HD ARG 108 HD2 ARG 108 31.011 32.698 11.509 788 2HD ARG 108 HD1 ARG 108 31.264 31.716 10.073 789 HE ARG 108 HE ARG 108 31.543 34.570 10.278 790 1HH1 ARG 108 HH21 ARG 108 30.237 32.161 8.175 791 2HH1 ARG 108 HH22 ARG 108 30.151 33.225 6.813 792 1HH2 ARG 108 HH11 ARG 108 31.447 35.947 8.515 793 2HH2 ARG 108 HH12 ARG 108 30.843 35.360 7.001 794 H GLU 109 HN GLU 109 30.088 30.240 13.250 795 HA GLU 109 HA GLU 109 30.484 27.674 14.220 796 1HB GLU 109 HB2 GLU 109 29.759 30.189 15.734 797 2HB GLU 109 HB1 GLU 109 30.334 28.712 16.510 798 1HG GLU 109 HG2 GLU 109 32.397 28.794 15.183 799 2HG GLU 109 HG1 GLU 109 31.824 30.249 14.364 800 H TYR 110 HN TYR 110 27.616 29.648 15.210 801 HA TYR 110 HA TYR 110 26.057 27.091 15.353 802 1HB TYR 110 HB2 TYR 110 26.087 29.190 17.538 803 2HB TYR 110 HB1 TYR 110 25.199 27.667 17.550 804 HD1 TYR 110 HD2 TYR 110 26.474 25.485 17.571 805 HD2 TYR 110 HD1 TYR 110 28.386 29.290 18.140 806 HE1 TYR 110 HE2 TYR 110 28.456 24.348 18.537 807 HE2 TYR 110 HE1 TYR 110 30.364 28.154 19.105 808 HH TYR 110 HH TYR 110 31.382 25.685 18.835 809 H ASN 111 HN ASN 111 23.721 27.446 15.366 810 HA ASN 111 HA ASN 111 22.967 29.974 13.965 811 1HB ASN 111 HB2 ASN 111 21.544 27.307 14.261 812 2HB ASN 111 HB1 ASN 111 20.849 28.716 13.457 813 1HD2 ASN 111 HD22 ASN 111 23.644 28.563 10.952 814 2HD2 ASN 111 HD21 ASN 111 23.162 29.703 12.114 815 H LEU 112 HN LEU 112 22.095 31.516 15.222 816 HA LEU 112 HA LEU 112 21.498 31.211 17.970 817 1HB LEU 112 HB2 LEU 112 21.997 33.374 16.908 818 2HB LEU 112 HB1 LEU 112 20.483 33.293 16.014 819 HG LEU 112 HG LEU 112 19.221 33.314 18.145 820 1HD1 LEU 112 HD11 LEU 112 22.010 33.249 19.285 821 2HD1 LEU 112 HD13 LEU 112 20.721 34.050 20.186 822 3HD1 LEU 112 HD12 LEU 112 20.582 32.341 19.782 823 1HD2 LEU 112 HD22 LEU 112 19.804 35.435 16.982 824 2HD2 LEU 112 HD21 LEU 112 19.687 35.649 18.728 825 3HD2 LEU 112 HD23 LEU 112 21.270 35.547 17.955 826 H HIS 113 HN HIS 113 19.277 31.203 15.172 827 HA HIS 113 HA HIS 113 16.869 31.131 16.660 828 1HB HIS 113 HB2 HIS 113 16.943 31.521 14.236 829 2HB HIS 113 HB1 HIS 113 17.445 29.853 13.976 830 HD1 HIS 113 HD1 HIS 113 15.673 27.984 14.873 831 HD2 HIS 113 HD2 HIS 113 14.202 31.851 14.399 832 HE1 HIS 113 HE1 HIS 113 13.146 27.794 14.854 833 H ARG 114 HN ARG 114 18.734 28.347 15.364 834 HA ARG 114 HA ARG 114 16.990 26.352 16.375 835 1HB ARG 114 HB2 ARG 114 18.818 25.956 14.720 836 2HB ARG 114 HB1 ARG 114 19.987 26.107 16.033 837 1HG ARG 114 HG2 ARG 114 19.029 24.206 17.188 838 2HG ARG 114 HG1 ARG 114 17.701 24.116 16.031 839 1HD ARG 114 HD2 ARG 114 19.300 23.605 14.225 840 2HD ARG 114 HD1 ARG 114 20.635 23.704 15.375 841 HE ARG 114 HE ARG 114 18.961 21.810 16.497 842 1HH1 ARG 114 HH21 ARG 114 20.393 22.333 13.408 843 2HH1 ARG 114 HH22 ARG 114 20.552 20.648 13.046 844 1HH2 ARG 114 HH11 ARG 114 19.171 19.601 16.049 845 2HH2 ARG 114 HH12 ARG 114 19.862 19.099 14.541 846 H VAL 115 HN VAL 115 19.833 27.869 17.929 847 HA VAL 115 HA VAL 115 19.658 26.209 20.288 848 HB VAL 115 HB VAL 115 20.988 28.880 19.770 849 1HG1 VAL 115 HG11 VAL 115 20.942 27.144 22.249 850 2HG1 VAL 115 HG13 VAL 115 22.237 28.301 21.931 851 3HG1 VAL 115 HG12 VAL 115 20.576 28.865 22.124 852 1HG2 VAL 115 HG22 VAL 115 21.847 26.811 18.619 853 2HG2 VAL 115 HG21 VAL 115 23.017 27.552 19.711 854 3HG2 VAL 115 HG23 VAL 115 22.137 26.109 20.211 855 H ALA 116 HN ALA 116 18.368 29.421 19.453 856 HA ALA 116 HA ALA 116 17.310 30.056 22.024 857 1HB ALA 116 HB3 ALA 116 16.358 30.787 19.239 858 2HB ALA 116 HB2 ALA 116 15.670 31.471 20.714 859 3HB ALA 116 HB1 ALA 116 17.363 31.761 20.313 860 H ALA 117 HN ALA 117 15.922 28.278 19.281 861 HA ALA 117 HA ALA 117 13.348 27.806 20.385 862 1HB ALA 117 HB3 ALA 117 15.006 26.081 18.521 863 2HB ALA 117 HB2 ALA 117 13.283 25.861 18.825 864 3HB ALA 117 HB1 ALA 117 13.859 27.332 18.039 865 H HIS 118 HN HIS 118 16.396 26.020 20.728 866 HA HIS 118 HA HIS 118 15.369 23.776 22.132 867 1HB HIS 118 HB2 HIS 118 17.685 23.935 21.235 868 2HB HIS 118 HB1 HIS 118 18.066 25.119 22.484 869 HD1 HIS 118 HD1 HIS 118 16.707 21.556 22.283 870 HD2 HIS 118 HD2 HIS 118 19.023 23.946 24.795 871 HE1 HIS 118 HE1 HIS 118 17.517 20.055 24.154 872 H GLU 119 HN GLU 119 16.581 26.909 23.378 873 HA GLU 119 HA GLU 119 16.257 26.297 26.142 874 1HB GLU 119 HB2 GLU 119 16.077 28.930 24.653 875 2HB GLU 119 HB1 GLU 119 16.049 28.805 26.413 876 1HG GLU 119 HG2 GLU 119 18.239 27.671 26.373 877 2HG GLU 119 HG1 GLU 119 18.273 27.796 24.613 878 H LEU 120 HN LEU 120 13.986 27.644 23.766 879 HA LEU 120 HA LEU 120 11.835 28.098 25.605 880 1HB LEU 120 HB2 LEU 120 11.854 27.546 22.624 881 2HB LEU 120 HB1 LEU 120 10.401 27.987 23.518 882 HG LEU 120 HG LEU 120 12.933 29.657 23.459 883 1HD1 LEU 120 HD12 LEU 120 10.364 29.911 21.870 884 2HD1 LEU 120 HD11 LEU 120 11.621 31.148 21.940 885 3HD1 LEU 120 HD13 LEU 120 11.972 29.571 21.230 886 1HD2 LEU 120 HD22 LEU 120 10.226 29.949 24.745 887 2HD2 LEU 120 HD21 LEU 120 11.816 30.395 25.364 888 3HD2 LEU 120 HD23 LEU 120 11.028 31.405 24.155 889 H GLY 121 HN GLY 121 12.789 25.278 23.667 890 1HA GLY 121 HA2 GLY 121 10.548 23.630 24.142 891 2HA GLY 121 HA1 GLY 121 12.193 23.019 23.932 892 H HIS 122 HN HIS 122 13.377 24.297 26.182 893 HA HIS 122 HA HIS 122 12.694 22.429 28.263 894 1HB HIS 122 HB2 HIS 122 14.429 24.902 28.141 895 2HB HIS 122 HB1 HIS 122 14.155 24.072 29.672 896 HD1 HIS 122 HD1 HIS 122 14.675 21.369 29.545 897 HD2 HIS 122 HD2 HIS 122 16.500 23.780 26.674 898 HE1 HIS 122 HE1 HIS 122 16.594 20.021 28.596 899 H SER 123 HN SER 123 11.912 25.851 27.708 900 HA SER 123 HA SER 123 10.574 26.262 30.212 901 1HB SER 123 HB2 SER 123 9.587 28.231 29.124 902 2HB SER 123 HB1 SER 123 11.301 28.117 28.738 903 HG SER 123 HG SER 123 10.726 27.189 26.753 904 H LEU 124 HN LEU 124 9.614 24.695 27.247 905 HA LEU 124 HA LEU 124 6.748 24.757 27.935 906 1HB LEU 124 HB2 LEU 124 8.238 23.310 25.726 907 2HB LEU 124 HB1 LEU 124 6.485 23.388 25.881 908 HG LEU 124 HG LEU 124 8.280 25.822 25.630 909 1HD1 LEU 124 HD13 LEU 124 8.286 24.356 23.599 910 2HD1 LEU 124 HD12 LEU 124 6.532 24.527 23.519 911 3HD1 LEU 124 HD11 LEU 124 7.565 25.940 23.309 912 1HD2 LEU 124 HD22 LEU 124 5.297 25.384 25.800 913 2HD2 LEU 124 HD21 LEU 124 6.292 26.589 26.619 914 3HD2 LEU 124 HD23 LEU 124 5.925 26.767 24.906 915 H GLY 125 HN GLY 125 9.354 23.004 29.014 916 1HA GLY 125 HA2 GLY 125 9.265 21.190 30.555 917 2HA GLY 125 HA1 GLY 125 7.577 20.928 30.120 918 H LEU 126 HN LEU 126 9.552 21.238 27.369 919 HA LEU 126 HA LEU 126 9.160 18.425 26.712 920 1HB LEU 126 HB2 LEU 126 10.673 20.638 25.289 921 2HB LEU 126 HB1 LEU 126 10.431 19.023 24.628 922 HG LEU 126 HG LEU 126 8.198 20.922 25.424 923 1HD1 LEU 126 HD11 LEU 126 9.612 21.579 23.411 924 2HD1 LEU 126 HD13 LEU 126 9.051 20.095 22.639 925 3HD1 LEU 126 HD12 LEU 126 7.893 21.349 23.084 926 1HD2 LEU 126 HD22 LEU 126 8.290 18.102 24.370 927 2HD2 LEU 126 HD21 LEU 126 7.204 18.814 25.563 928 3HD2 LEU 126 HD23 LEU 126 6.972 19.151 23.851 929 H SER 127 HN SER 127 10.776 16.840 26.514 930 HA SER 127 HA SER 127 13.287 17.410 28.043 931 1HB SER 127 HB2 SER 127 11.857 14.804 27.450 932 2HB SER 127 HB1 SER 127 13.377 14.937 28.330 933 HG SER 127 HG SER 127 11.091 14.993 29.412 934 H HIS 128 HN HIS 128 15.199 16.075 27.287 935 HA HIS 128 HA HIS 128 15.774 16.654 24.531 936 1HB HIS 128 HB2 HIS 128 17.201 14.865 26.519 937 2HB HIS 128 HB1 HIS 128 17.858 15.339 24.953 938 HD1 HIS 128 HD1 HIS 128 19.313 16.183 27.542 939 HD2 HIS 128 HD2 HIS 128 16.476 18.564 25.630 940 HE1 HIS 128 HE1 HIS 128 19.776 18.567 28.258 941 H SER 129 HN SER 129 16.619 14.836 23.031 942 HA SER 129 HA SER 129 15.148 12.278 23.309 943 1HB SER 129 HB2 SER 129 13.608 13.911 22.159 944 2HB SER 129 HB1 SER 129 14.804 14.053 20.875 945 HG SER 129 HG SER 129 12.956 12.358 20.858 946 H THR 130 HN THR 130 15.871 10.691 21.678 947 HA THR 130 HA THR 130 18.705 11.172 20.896 948 HB THR 130 HB THR 130 18.717 8.693 20.519 949 HG1 THR 130 HG1 THR 130 16.761 7.978 20.200 950 1HG2 THR 130 HG22 THR 130 17.779 9.716 23.210 951 2HG2 THR 130 HG21 THR 130 18.437 8.101 22.950 952 3HG2 THR 130 HG23 THR 130 19.447 9.519 22.670 953 H ASP 131 HN ASP 131 15.908 11.821 19.465 954 HA ASP 131 HA ASP 131 16.307 10.447 16.898 955 1HB ASP 131 HB2 ASP 131 14.037 11.010 17.743 956 2HB ASP 131 HB1 ASP 131 14.442 12.723 17.630 957 H ILE 132 HN ILE 132 17.710 11.167 15.398 958 HA ILE 132 HA ILE 132 19.249 13.541 15.663 959 HB ILE 132 HB ILE 132 18.651 11.899 13.182 960 1HG1 ILE 132 HG12 ILE 132 21.101 11.863 14.961 961 2HG1 ILE 132 HG11 ILE 132 19.735 10.776 15.216 962 1HG2 ILE 132 HG21 ILE 132 20.746 14.008 13.774 963 2HG2 ILE 132 HG23 ILE 132 20.833 12.903 12.401 964 3HG2 ILE 132 HG22 ILE 132 19.510 14.062 12.517 965 1HD1 ILE 132 HD11 ILE 132 21.344 11.002 12.655 966 2HD1 ILE 132 HD13 ILE 132 21.482 9.701 13.839 967 3HD1 ILE 132 HD12 ILE 132 19.988 9.908 12.924 968 H GLY 133 HN GLY 133 16.250 12.904 13.879 969 1HA GLY 133 HA2 GLY 133 16.214 15.472 12.548 970 2HA GLY 133 HA1 GLY 133 14.851 14.368 12.681 971 H ALA 134 HN ALA 134 16.047 14.949 15.771 972 HA ALA 134 HA ALA 134 13.822 16.867 16.291 973 1HB ALA 134 HB2 ALA 134 15.513 15.144 18.117 974 2HB ALA 134 HB1 ALA 134 14.367 16.341 18.712 975 3HB ALA 134 HB3 ALA 134 13.796 14.971 17.762 976 H LEU 135 HN LEU 135 14.186 18.918 17.054 977 HA LEU 135 HA LEU 135 16.758 20.145 16.628 978 1HB LEU 135 HB2 LEU 135 14.338 21.155 18.168 979 2HB LEU 135 HB1 LEU 135 15.696 22.147 17.634 980 HG LEU 135 HG LEU 135 13.904 20.554 15.775 981 1HD1 LEU 135 HD13 LEU 135 12.803 22.493 16.990 982 2HD1 LEU 135 HD12 LEU 135 13.962 23.554 16.187 983 3HD1 LEU 135 HD11 LEU 135 12.810 22.621 15.230 984 1HD2 LEU 135 HD22 LEU 135 16.288 22.359 15.389 985 2HD2 LEU 135 HD21 LEU 135 15.896 20.841 14.585 986 3HD2 LEU 135 HD23 LEU 135 15.039 22.316 14.147 987 H MET 136 HN MET 136 15.079 18.878 19.447 988 HA MET 136 HA MET 136 16.923 19.978 21.384 989 1HB MET 136 HB2 MET 136 15.093 17.583 21.685 990 2HB MET 136 HB1 MET 136 15.782 18.557 22.983 991 1HG MET 136 HG2 MET 136 14.587 20.556 21.978 992 2HG MET 136 HG1 MET 136 13.746 19.425 20.916 993 1HE MET 136 HE2 MET 136 14.832 19.941 24.602 994 2HE MET 136 HE1 MET 136 13.768 21.264 24.134 995 3HE MET 136 HE3 MET 136 13.266 20.122 25.387 996 H TYR 137 HN TYR 137 18.162 18.423 19.135 997 HA TYR 137 HA TYR 137 19.052 15.899 20.148 998 1HB TYR 137 HB2 TYR 137 19.214 16.810 17.733 999 2HB TYR 137 HB1 TYR 137 20.677 17.631 18.275 1000 HD1 TYR 137 HD2 TYR 137 19.055 14.273 18.048 1001 HD2 TYR 137 HD1 TYR 137 22.733 16.452 18.462 1002 HE1 TYR 137 HE2 TYR 137 20.338 12.167 17.780 1003 HE2 TYR 137 HE1 TYR 137 24.013 14.346 18.195 1004 HH TYR 137 HH TYR 137 23.183 11.619 18.700 1005 HA PRO 138 HA PRO 138 21.706 17.367 23.421 1006 1HB PRO 138 HB2 PRO 138 23.725 15.311 22.927 1007 2HB PRO 138 HB1 PRO 138 22.585 15.441 24.275 1008 1HG PRO 138 HG2 PRO 138 22.452 13.626 22.028 1009 2HG PRO 138 HG1 PRO 138 21.310 13.764 23.374 1010 1HD PRO 138 HD2 PRO 138 20.866 14.550 20.653 1011 2HD PRO 138 HD1 PRO 138 19.781 14.811 22.031 1012 H SER 139 HN SER 139 23.700 16.163 20.660 1013 HA SER 139 HA SER 139 25.596 18.364 21.072 1014 1HB SER 139 HB2 SER 139 26.875 17.356 19.299 1015 2HB SER 139 HB1 SER 139 26.266 16.053 20.317 1016 HG SER 139 HG SER 139 25.891 15.576 18.145 1017 H TYR 140 HN TYR 140 26.126 19.932 19.393 1018 HA TYR 140 HA TYR 140 23.716 20.972 18.064 1019 1HB TYR 140 HB2 TYR 140 25.231 22.545 19.186 1020 2HB TYR 140 HB1 TYR 140 26.561 22.024 18.152 1021 HD1 TYR 140 HD1 TYR 140 26.560 22.540 15.736 1022 HD2 TYR 140 HD2 TYR 140 23.473 23.998 18.346 1023 HE1 TYR 140 HE1 TYR 140 25.860 24.168 14.000 1024 HE2 TYR 140 HE2 TYR 140 22.774 25.625 16.608 1025 HH TYR 140 HH TYR 140 23.116 26.381 14.558 1026 H THR 141 HN THR 141 23.477 21.184 15.796 1027 HA THR 141 HA THR 141 25.591 20.128 14.015 1028 HB THR 141 HB THR 141 23.992 18.528 12.943 1029 HG1 THR 141 HG1 THR 141 22.007 18.522 13.575 1030 1HG2 THR 141 HG21 THR 141 25.642 17.837 14.734 1031 2HG2 THR 141 HG23 THR 141 24.321 17.953 15.897 1032 3HG2 THR 141 HG22 THR 141 24.235 16.784 14.581 1033 H PHE 142 HN PHE 142 25.283 20.821 11.823 1034 HA PHE 142 HA PHE 142 23.547 23.169 11.547 1035 1HB PHE 142 HB2 PHE 142 25.793 23.186 10.542 1036 2HB PHE 142 HB1 PHE 142 25.363 21.803 9.536 1037 HD1 PHE 142 HD1 PHE 142 24.800 25.402 10.132 1038 HD2 PHE 142 HD2 PHE 142 23.855 22.033 7.641 1039 HE1 PHE 142 HE1 PHE 142 23.824 26.929 8.435 1040 HE2 PHE 142 HE2 PHE 142 22.878 23.558 5.947 1041 HZ PHE 142 HZ PHE 142 22.864 26.006 6.344 1042 H SER 143 HN SER 143 21.553 23.174 10.641 1043 HA SER 143 HA SER 143 20.640 20.720 9.162 1044 1HB SER 143 HB2 SER 143 19.191 22.550 11.079 1045 2HB SER 143 HB1 SER 143 18.328 21.485 9.971 1046 HG SER 143 HG SER 143 18.610 20.190 11.653 1047 H GLY 144 HN GLY 144 19.384 21.069 7.287 1048 1HA GLY 144 HA2 GLY 144 19.966 23.448 5.794 1049 2HA GLY 144 HA1 GLY 144 18.789 22.218 5.329 1050 H ASP 145 HN ASP 145 16.610 22.395 6.205 1051 HA ASP 145 HA ASP 145 15.840 25.228 6.715 1052 1HB ASP 145 HB2 ASP 145 14.253 22.756 5.958 1053 2HB ASP 145 HB1 ASP 145 13.511 24.314 6.320 1054 H VAL 146 HN VAL 146 14.707 25.829 8.612 1055 HA VAL 146 HA VAL 146 14.941 23.902 10.867 1056 HB VAL 146 HB VAL 146 14.058 26.805 10.926 1057 1HG1 VAL 146 HG13 VAL 146 13.455 25.403 12.893 1058 2HG1 VAL 146 HG12 VAL 146 15.157 24.979 13.086 1059 3HG1 VAL 146 HG11 VAL 146 14.634 26.650 13.301 1060 1HG2 VAL 146 HG21 VAL 146 16.359 26.501 9.977 1061 2HG2 VAL 146 HG23 VAL 146 16.356 27.352 11.523 1062 3HG2 VAL 146 HG22 VAL 146 16.813 25.651 11.454 1063 H GLN 147 HN GLN 147 13.201 22.554 11.015 1064 HA GLN 147 HA GLN 147 10.482 23.784 11.061 1065 1HB GLN 147 HB2 GLN 147 11.324 21.368 9.433 1066 2HB GLN 147 HB1 GLN 147 9.643 21.763 9.787 1067 1HG GLN 147 HG2 GLN 147 11.570 23.666 8.424 1068 2HG GLN 147 HG1 GLN 147 10.439 22.625 7.559 1069 1HE2 GLN 147 HE22 GLN 147 9.057 26.122 8.712 1070 2HE2 GLN 147 HE21 GLN 147 10.674 25.754 8.353 1071 H LEU 148 HN LEU 148 8.939 22.502 12.278 1072 HA LEU 148 HA LEU 148 10.165 21.176 14.553 1073 1HB LEU 148 HB2 LEU 148 7.243 21.377 13.758 1074 2HB LEU 148 HB1 LEU 148 7.844 20.854 15.332 1075 HG LEU 148 HG LEU 148 8.352 23.579 14.092 1076 1HD1 LEU 148 HD12 LEU 148 6.397 22.600 16.180 1077 2HD1 LEU 148 HD11 LEU 148 6.867 24.296 16.059 1078 3HD1 LEU 148 HD13 LEU 148 6.053 23.507 14.707 1079 1HD2 LEU 148 HD22 LEU 148 9.232 22.230 16.642 1080 2HD2 LEU 148 HD21 LEU 148 10.165 23.246 15.541 1081 3HD2 LEU 148 HD23 LEU 148 8.988 23.976 16.629 1082 H ALA 149 HN ALA 149 9.844 18.974 15.174 1083 HA ALA 149 HA ALA 149 9.549 17.129 12.841 1084 1HB ALA 149 HB3 ALA 149 11.667 17.016 14.123 1085 2HB ALA 149 HB2 ALA 149 10.752 16.666 15.588 1086 3HB ALA 149 HB1 ALA 149 10.754 15.512 14.256 1087 H GLN 150 HN GLN 150 8.431 15.049 13.291 1088 HA GLN 150 HA GLN 150 5.825 15.422 14.377 1089 1HB GLN 150 HB2 GLN 150 6.365 13.663 12.721 1090 2HB GLN 150 HB1 GLN 150 7.345 12.833 13.928 1091 1HG GLN 150 HG2 GLN 150 5.388 12.484 15.338 1092 2HG GLN 150 HG1 GLN 150 4.384 13.414 14.228 1093 1HE2 GLN 150 HE22 GLN 150 3.942 9.797 13.398 1094 2HE2 GLN 150 HE21 GLN 150 3.647 10.761 14.764 1095 H ASP 151 HN ASP 151 8.777 14.029 15.762 1096 HA ASP 151 HA ASP 151 7.662 13.026 18.168 1097 1HB ASP 151 HB2 ASP 151 9.984 12.579 17.443 1098 2HB ASP 151 HB1 ASP 151 10.397 14.269 17.733 1099 H ASP 152 HN ASP 152 8.786 16.316 17.338 1100 HA ASP 152 HA ASP 152 8.270 17.325 20.025 1101 1HB ASP 152 HB2 ASP 152 8.788 18.695 17.374 1102 2HB ASP 152 HB1 ASP 152 8.529 19.577 18.879 1103 H ILE 153 HN ILE 153 6.558 17.496 16.896 1104 HA ILE 153 HA ILE 153 4.412 19.140 17.794 1105 HB ILE 153 HB ILE 153 4.543 17.028 15.624 1106 1HG1 ILE 153 HG12 ILE 153 4.514 20.045 15.376 1107 2HG1 ILE 153 HG11 ILE 153 6.015 19.133 15.548 1108 1HG2 ILE 153 HG21 ILE 153 2.352 18.942 16.426 1109 2HG2 ILE 153 HG23 ILE 153 2.529 18.434 14.746 1110 3HG2 ILE 153 HG22 ILE 153 2.228 17.236 16.002 1111 1HD1 ILE 153 HD13 ILE 153 3.944 18.677 13.380 1112 2HD1 ILE 153 HD12 ILE 153 5.458 19.556 13.165 1113 3HD1 ILE 153 HD11 ILE 153 5.483 17.832 13.541 1114 H ASP 154 HN ASP 154 4.610 15.564 17.582 1115 HA ASP 154 HA ASP 154 2.037 15.073 18.719 1116 1HB ASP 154 HB2 ASP 154 4.570 13.420 18.631 1117 2HB ASP 154 HB1 ASP 154 3.071 12.815 19.337 1118 H GLY 155 HN GLY 155 5.225 15.480 20.230 1119 1HA GLY 155 HA2 GLY 155 4.385 14.813 22.890 1120 2HA GLY 155 HA1 GLY 155 5.830 15.729 22.481 1121 H ILE 156 HN ILE 156 4.809 18.042 21.340 1122 HA ILE 156 HA ILE 156 3.869 19.411 23.694 1123 HB ILE 156 HB ILE 156 5.288 20.413 21.821 1124 1HG1 ILE 156 HG12 ILE 156 4.114 22.647 21.983 1125 2HG1 ILE 156 HG11 ILE 156 2.780 21.826 22.791 1126 1HG2 ILE 156 HG22 ILE 156 3.670 19.545 20.036 1127 2HG2 ILE 156 HG21 ILE 156 2.619 20.886 20.489 1128 3HG2 ILE 156 HG23 ILE 156 4.231 21.205 19.849 1129 1HD1 ILE 156 HD13 ILE 156 5.549 21.426 23.881 1130 2HD1 ILE 156 HD12 ILE 156 4.748 22.966 24.176 1131 3HD1 ILE 156 HD11 ILE 156 4.003 21.470 24.728 1132 H GLN 157 HN GLN 157 2.264 18.201 20.782 1133 HA GLN 157 HA GLN 157 -0.283 19.445 21.346 1134 1HB GLN 157 HB2 GLN 157 0.521 17.077 19.646 1135 2HB GLN 157 HB1 GLN 157 -1.161 17.588 19.811 1136 1HG GLN 157 HG2 GLN 157 -0.577 19.828 18.993 1137 2HG GLN 157 HG1 GLN 157 1.114 19.347 18.854 1138 1HE2 GLN 157 HE22 GLN 157 -0.924 18.842 15.614 1139 2HE2 GLN 157 HE21 GLN 157 -0.990 20.118 16.731 1140 H ALA 158 HN ALA 158 1.165 16.310 22.174 1141 HA ALA 158 HA ALA 158 -1.145 15.124 23.337 1142 1HB ALA 158 HB2 ALA 158 0.996 13.919 22.870 1143 2HB ALA 158 HB1 ALA 158 1.740 14.782 24.215 1144 3HB ALA 158 HB3 ALA 158 0.415 13.659 24.514 1145 H ILE 159 HN ILE 159 1.311 17.294 24.707 1146 HA ILE 159 HA ILE 159 0.330 17.195 27.404 1147 HB ILE 159 HB ILE 159 1.880 19.323 25.898 1148 1HG1 ILE 159 HG12 ILE 159 2.808 17.343 27.998 1149 2HG1 ILE 159 HG11 ILE 159 2.893 17.015 26.267 1150 1HG2 ILE 159 HG21 ILE 159 1.234 19.068 28.853 1151 2HG2 ILE 159 HG23 ILE 159 2.483 20.133 28.208 1152 3HG2 ILE 159 HG22 ILE 159 0.793 20.403 27.786 1153 1HD1 ILE 159 HD12 ILE 159 4.095 19.508 27.483 1154 2HD1 ILE 159 HD11 ILE 159 5.002 18.000 27.350 1155 3HD1 ILE 159 HD13 ILE 159 4.413 18.806 25.895 1156 H TYR 160 HN TYR 160 -0.251 19.547 24.764 1157 HA TYR 160 HA TYR 160 -2.493 20.717 26.336 1158 1HB TYR 160 HB2 TYR 160 -1.141 21.545 23.752 1159 2HB TYR 160 HB1 TYR 160 -2.542 22.373 24.430 1160 HD1 TYR 160 HD2 TYR 160 -2.368 23.658 26.515 1161 HD2 TYR 160 HD1 TYR 160 1.042 21.654 24.839 1162 HE1 TYR 160 HE2 TYR 160 -0.872 24.949 28.015 1163 HE2 TYR 160 HE1 TYR 160 2.538 22.945 26.339 1164 HH TYR 160 HH TYR 160 2.642 24.747 27.725 1165 H GLY 161 HN GLY 161 -2.096 19.931 22.862 1166 1HA GLY 161 HA2 GLY 161 -3.886 17.906 22.464 1167 2HA GLY 161 HA1 GLY 161 -4.957 19.292 22.675 1168 H ARG 162 HN ARG 162 -5.603 18.922 20.412 1169 HA ARG 162 HA ARG 162 -3.576 19.482 18.331 1170 1HB ARG 162 HB2 ARG 162 -6.550 18.885 18.167 1171 2HB ARG 162 HB1 ARG 162 -5.514 19.152 16.767 1172 1HG ARG 162 HG2 ARG 162 -4.099 17.254 17.456 1173 2HG ARG 162 HG1 ARG 162 -5.147 16.972 18.844 1174 1HD ARG 162 HD2 ARG 162 -7.067 16.772 17.168 1175 2HD ARG 162 HD1 ARG 162 -5.844 16.699 15.906 1176 HE ARG 162 HE ARG 162 -6.677 14.542 17.606 1177 1HH1 ARG 162 HH21 ARG 162 -3.811 15.971 16.316 1178 2HH1 ARG 162 HH22 ARG 162 -2.824 14.590 16.655 1179 1HH2 ARG 162 HH11 ARG 162 -5.410 12.745 18.033 1180 2HH2 ARG 162 HH12 ARG 162 -3.728 12.766 17.618 1181 H SER 163 HN SER 163 -3.595 21.387 17.066 1182 HA SER 163 HA SER 163 -4.722 23.731 18.379 1183 1HB SER 163 HB2 SER 163 -3.377 23.543 15.670 1184 2HB SER 163 HB1 SER 163 -3.629 25.005 16.618 1185 HG SER 163 HG SER 163 -1.791 22.954 16.922 1186 H GLN 164 HN GLN 164 -7.004 22.636 18.037 1187 HA GLN 164 HA GLN 164 -8.129 22.868 15.362 1188 1HB GLN 164 HB2 GLN 164 -9.407 22.576 18.099 1189 2HB GLN 164 HB1 GLN 164 -10.323 22.594 16.592 1190 1HG GLN 164 HG2 GLN 164 -8.065 20.655 17.159 1191 2HG GLN 164 HG1 GLN 164 -9.768 20.278 17.419 1192 1HE2 GLN 164 HE22 GLN 164 -8.381 19.582 13.817 1193 2HE2 GLN 164 HE21 GLN 164 -7.507 19.518 15.271 1194 H ASN 165 HN ASN 165 -8.942 24.710 14.436 1195 HA ASN 165 HA ASN 165 -9.827 26.960 16.133 1196 1HB ASN 165 HB2 ASN 165 -7.433 27.104 14.301 1197 2HB ASN 165 HB1 ASN 165 -8.285 28.530 14.893 1198 1HD2 ASN 165 HD22 ASN 165 -7.382 27.650 18.386 1199 2HD2 ASN 165 HD21 ASN 165 -8.818 27.948 17.531 1200 HA PRO 166 HA PRO 166 -12.245 26.426 12.227 1201 1HB PRO 166 HB2 PRO 166 -14.392 27.889 13.581 1202 2HB PRO 166 HB1 PRO 166 -14.391 26.213 13.009 1203 1HG PRO 166 HG2 PRO 166 -14.287 27.050 15.725 1204 2HG PRO 166 HG1 PRO 166 -14.005 25.408 15.125 1205 1HD PRO 166 HD2 PRO 166 -12.052 27.348 16.144 1206 2HD PRO 166 HD1 PRO 166 -11.819 25.618 15.808 1207 H VAL 167 HN VAL 167 -12.522 28.012 10.610 1208 HA VAL 167 HA VAL 167 -11.287 30.607 11.151 1209 HB VAL 167 HB VAL 167 -11.612 30.971 8.729 1210 1HG1 VAL 167 HG11 VAL 167 -9.659 29.685 9.529 1211 2HG1 VAL 167 HG13 VAL 167 -10.598 28.198 9.412 1212 3HG1 VAL 167 HG12 VAL 167 -10.200 29.106 7.954 1213 1HG2 VAL 167 HG23 VAL 167 -13.166 28.383 8.961 1214 2HG2 VAL 167 HG22 VAL 167 -13.738 29.929 8.335 1215 3HG2 VAL 167 HG21 VAL 167 -12.554 28.993 7.425 1216 H GLN 168 HN GLN 168 -12.352 32.644 10.944 1217 HA GLN 168 HA GLN 168 -15.141 32.607 11.766 1218 1HB GLN 168 HB2 GLN 168 -13.321 34.925 11.040 1219 2HB GLN 168 HB1 GLN 168 -14.891 35.080 11.821 1220 1HG GLN 168 HG2 GLN 168 -14.037 33.636 13.690 1221 2HG GLN 168 HG1 GLN 168 -12.443 33.686 12.933 1222 1HE2 GLN 168 HE22 GLN 168 -13.828 37.374 14.105 1223 2HE2 GLN 168 HE21 GLN 168 -14.848 36.347 13.216 1224 HA PRO 169 HA PRO 169 -16.987 32.857 7.732 1225 1HB PRO 169 HB2 PRO 169 -18.899 34.936 8.391 1226 2HB PRO 169 HB1 PRO 169 -19.190 33.197 8.251 1227 1HG PRO 169 HG2 PRO 169 -19.036 34.791 10.680 1228 2HG PRO 169 HG1 PRO 169 -19.421 33.071 10.526 1229 1HD PRO 169 HD2 PRO 169 -17.002 34.199 11.569 1230 2HD PRO 169 HD1 PRO 169 -17.338 32.485 11.260 No H/Q in entry = 1230 Start of MODEL 5 1 1H VAL 1 HT1 VAL 1 7.859 20.511 40.101 2 2H VAL 1 HT3 VAL 1 8.960 19.870 41.219 3 3H VAL 1 HT2 VAL 1 9.035 19.399 39.588 4 HA VAL 1 HA VAL 1 6.910 18.305 39.750 5 HB VAL 1 HB VAL 1 7.582 16.561 41.461 6 1HG1 VAL 1 HG13 VAL 1 8.362 16.537 39.095 7 2HG1 VAL 1 HG12 VAL 1 9.756 17.507 39.568 8 3HG1 VAL 1 HG11 VAL 1 9.568 15.870 40.199 9 1HG2 VAL 1 HG23 VAL 1 8.701 18.249 42.976 10 2HG2 VAL 1 HG22 VAL 1 9.697 16.839 42.616 11 3HG2 VAL 1 HG21 VAL 1 9.998 18.366 41.788 12 H LEU 2 HN LEU 2 7.002 20.855 41.599 13 HA LEU 2 HA LEU 2 5.735 20.175 44.058 14 1HB LEU 2 HB2 LEU 2 5.448 22.677 42.369 15 2HB LEU 2 HB1 LEU 2 4.928 22.533 44.046 16 HG LEU 2 HG LEU 2 7.785 22.065 43.139 17 1HD1 LEU 2 HD11 LEU 2 6.971 24.409 42.727 18 2HD1 LEU 2 HD13 LEU 2 6.628 24.537 44.453 19 3HD1 LEU 2 HD12 LEU 2 8.286 24.303 43.900 20 1HD2 LEU 2 HD22 LEU 2 6.405 22.285 45.820 21 2HD2 LEU 2 HD21 LEU 2 7.489 21.022 45.248 22 3HD2 LEU 2 HD23 LEU 2 8.130 22.609 45.657 23 H THR 3 HN THR 3 4.390 20.813 40.841 24 HA THR 3 HA THR 3 1.639 20.339 41.844 25 HB THR 3 HB THR 3 0.941 20.877 39.556 26 HG1 THR 3 HG1 THR 3 3.636 21.347 38.919 27 1HG2 THR 3 HG21 THR 3 2.941 22.706 40.876 28 2HG2 THR 3 HG23 THR 3 2.101 23.181 39.398 29 3HG2 THR 3 HG22 THR 3 1.180 22.825 40.857 30 H GLU 4 HN GLU 4 0.281 18.785 40.444 31 HA GLU 4 HA GLU 4 1.503 16.175 40.541 32 1HB GLU 4 HB2 GLU 4 -0.970 16.684 40.832 33 2HB GLU 4 HB1 GLU 4 -1.046 16.948 39.092 34 1HG GLU 4 HG2 GLU 4 -1.718 14.659 39.569 35 2HG GLU 4 HG1 GLU 4 -0.161 14.636 38.742 36 H GLY 5 HN GLY 5 2.462 15.013 38.897 37 1HA GLY 5 HA2 GLY 5 3.293 14.517 36.754 38 2HA GLY 5 HA1 GLY 5 2.080 15.616 36.095 39 H ASN 6 HN ASN 6 3.926 16.272 34.640 40 HA ASN 6 HA ASN 6 6.144 17.714 35.839 41 1HB ASN 6 HB2 ASN 6 5.156 17.442 32.994 42 2HB ASN 6 HB1 ASN 6 6.568 18.407 33.424 43 1HD2 ASN 6 HD22 ASN 6 8.204 15.302 34.743 44 2HD2 ASN 6 HD21 ASN 6 7.715 16.771 35.438 45 HA PRO 7 HA PRO 7 4.094 21.633 36.348 46 1HB PRO 7 HB2 PRO 7 6.279 23.274 35.432 47 2HB PRO 7 HB1 PRO 7 5.854 22.887 37.106 48 1HG PRO 7 HG2 PRO 7 8.065 21.827 35.504 49 2HG PRO 7 HG1 PRO 7 7.768 21.636 37.236 50 1HD PRO 7 HD2 PRO 7 7.461 19.620 35.251 51 2HD PRO 7 HD1 PRO 7 6.908 19.539 36.938 52 H ARG 8 HN ARG 8 2.933 23.100 35.045 53 HA ARG 8 HA ARG 8 3.643 23.379 32.178 54 1HB ARG 8 HB2 ARG 8 0.977 22.285 33.147 55 2HB ARG 8 HB1 ARG 8 1.323 22.776 31.487 56 1HG ARG 8 HG2 ARG 8 3.159 21.090 31.408 57 2HG ARG 8 HG1 ARG 8 2.701 20.558 33.021 58 1HD ARG 8 HD2 ARG 8 0.857 20.564 30.625 59 2HD ARG 8 HD1 ARG 8 1.701 19.138 31.216 60 HE ARG 8 HE ARG 8 -0.765 20.281 32.229 61 1HH1 ARG 8 HH21 ARG 8 2.165 18.810 33.310 62 2HH1 ARG 8 HH22 ARG 8 1.519 18.392 34.862 63 1HH2 ARG 8 HH11 ARG 8 -1.603 19.729 34.233 64 2HH2 ARG 8 HH12 ARG 8 -0.602 18.909 35.382 65 H TRP 9 HN TRP 9 2.680 25.290 31.244 66 HA TRP 9 HA TRP 9 2.069 27.388 33.135 67 1HB TRP 9 HB2 TRP 9 1.820 27.207 30.122 68 2HB TRP 9 HB1 TRP 9 1.413 28.665 31.024 69 HD1 TRP 9 HD1 TRP 9 4.332 26.624 29.789 70 HE1 TRP 9 HE1 TRP 9 6.530 27.845 30.354 71 HE3 TRP 9 HE3 TRP 9 2.536 30.330 32.810 72 HZ2 TRP 9 HZ2 TRP 9 7.412 30.099 31.889 73 HZ3 TRP 9 HZ3 TRP 9 4.072 31.998 33.806 74 HH2 TRP 9 HH2 TRP 9 6.503 31.888 33.348 75 H GLU 10 HN GLU 10 0.118 27.878 34.023 76 HA GLU 10 HA GLU 10 -2.213 26.272 33.384 77 1HB GLU 10 HB2 GLU 10 -1.801 28.666 35.190 78 2HB GLU 10 HB1 GLU 10 -3.352 27.844 35.022 79 1HG GLU 10 HG2 GLU 10 -2.305 25.722 35.724 80 2HG GLU 10 HG1 GLU 10 -0.751 26.541 35.892 81 H GLN 11 HN GLN 11 -1.007 29.387 32.396 82 HA GLN 11 HA GLN 11 -3.603 30.221 31.290 83 1HB GLN 11 HB2 GLN 11 -0.832 31.432 31.199 84 2HB GLN 11 HB1 GLN 11 -2.224 32.145 30.382 85 1HG GLN 11 HG2 GLN 11 -3.422 32.241 32.552 86 2HG GLN 11 HG1 GLN 11 -1.989 31.586 33.354 87 1HE2 GLN 11 HE22 GLN 11 -0.213 34.658 33.274 88 2HE2 GLN 11 HE21 GLN 11 -0.130 32.994 33.598 89 H THR 12 HN THR 12 -4.062 30.359 29.066 90 HA THR 12 HA THR 12 -2.514 28.484 27.359 91 HB THR 12 HB THR 12 -4.410 28.750 25.788 92 HG1 THR 12 HG1 THR 12 -6.205 29.996 26.604 93 1HG2 THR 12 HG23 THR 12 -5.000 28.121 28.679 94 2HG2 THR 12 HG22 THR 12 -6.233 27.942 27.430 95 3HG2 THR 12 HG21 THR 12 -4.748 26.999 27.342 96 H HIS 13 HN HIS 13 -2.453 31.679 28.147 97 HA HIS 13 HA HIS 13 -1.253 32.482 25.517 98 1HB HIS 13 HB2 HIS 13 -2.848 34.181 27.462 99 2HB HIS 13 HB1 HIS 13 -2.043 34.783 26.012 100 HD1 HIS 13 HD1 HIS 13 -4.579 32.043 26.855 101 HD2 HIS 13 HD2 HIS 13 -3.738 34.811 23.853 102 HE1 HIS 13 HE1 HIS 13 -6.422 31.814 25.131 103 H LEU 14 HN LEU 14 0.795 33.355 25.695 104 HA LEU 14 HA LEU 14 1.805 34.059 28.434 105 1HB LEU 14 HB2 LEU 14 3.275 32.508 26.283 106 2HB LEU 14 HB1 LEU 14 3.948 33.000 27.836 107 HG LEU 14 HG LEU 14 1.530 31.200 27.499 108 1HD1 LEU 14 HD11 LEU 14 4.436 30.589 28.114 109 2HD1 LEU 14 HD13 LEU 14 3.122 29.430 28.324 110 3HD1 LEU 14 HD12 LEU 14 3.508 30.042 26.715 111 1HD2 LEU 14 HD22 LEU 14 3.037 32.299 29.875 112 2HD2 LEU 14 HD21 LEU 14 1.300 32.150 29.640 113 3HD2 LEU 14 HD23 LEU 14 2.261 30.722 29.995 114 H THR 15 HN THR 15 3.677 35.515 28.378 115 HA THR 15 HA THR 15 3.892 37.131 25.861 116 HB THR 15 HB THR 15 3.866 39.164 27.206 117 HG1 THR 15 HG1 THR 15 4.523 38.878 29.179 118 1HG2 THR 15 HG22 THR 15 1.701 38.019 26.494 119 2HG2 THR 15 HG21 THR 15 1.580 37.430 28.155 120 3HG2 THR 15 HG23 THR 15 1.560 39.164 27.826 121 H TYR 16 HN TYR 16 5.983 38.195 25.607 122 HA TYR 16 HA TYR 16 8.112 37.343 27.528 123 1HB TYR 16 HB2 TYR 16 9.516 36.521 25.683 124 2HB TYR 16 HB1 TYR 16 8.008 35.613 25.770 125 HD1 TYR 16 HD2 TYR 16 6.179 36.048 24.136 126 HD2 TYR 16 HD1 TYR 16 10.019 37.944 23.809 127 HE1 TYR 16 HE2 TYR 16 5.681 36.654 21.782 128 HE2 TYR 16 HE1 TYR 16 9.521 38.546 21.454 129 HH TYR 16 HH TYR 16 6.458 38.425 20.128 130 H ARG 17 HN ARG 17 10.026 38.636 27.416 131 HA ARG 17 HA ARG 17 9.961 41.017 25.623 132 1HB ARG 17 HB2 ARG 17 8.827 41.677 27.731 133 2HB ARG 17 HB1 ARG 17 10.255 41.183 28.642 134 1HG ARG 17 HG2 ARG 17 11.611 42.853 27.407 135 2HG ARG 17 HG1 ARG 17 10.172 43.340 26.505 136 1HD ARG 17 HD2 ARG 17 9.080 43.963 28.648 137 2HD ARG 17 HD1 ARG 17 10.560 43.537 29.505 138 HE ARG 17 HE ARG 17 11.377 45.376 27.577 139 1HH1 ARG 17 HH21 ARG 17 9.073 45.192 30.120 140 2HH1 ARG 17 HH22 ARG 17 9.080 46.893 30.439 141 1HH2 ARG 17 HH11 ARG 17 11.412 47.609 27.970 142 2HH2 ARG 17 HH12 ARG 17 10.408 48.265 29.220 143 H ILE 18 HN ILE 18 12.005 41.622 24.986 144 HA ILE 18 HA ILE 18 14.281 40.011 26.009 145 HB ILE 18 HB ILE 18 14.149 42.027 23.738 146 1HG1 ILE 18 HG12 ILE 18 14.279 38.999 23.623 147 2HG1 ILE 18 HG11 ILE 18 12.774 39.910 23.486 148 1HG2 ILE 18 HG23 ILE 18 16.295 40.097 24.663 149 2HG2 ILE 18 HG22 ILE 18 16.311 40.897 23.087 150 3HG2 ILE 18 HG21 ILE 18 16.409 41.854 24.563 151 1HD1 ILE 18 HD11 ILE 18 13.751 41.143 21.539 152 2HD1 ILE 18 HD13 ILE 18 15.175 40.108 21.645 153 3HD1 ILE 18 HD12 ILE 18 13.606 39.409 21.250 154 H GLU 19 HN GLU 19 15.472 40.836 27.659 155 HA GLU 19 HA GLU 19 15.076 43.481 28.678 156 1HB GLU 19 HB2 GLU 19 17.258 41.441 29.175 157 2HB GLU 19 HB1 GLU 19 17.149 42.971 30.045 158 1HG GLU 19 HG2 GLU 19 14.877 42.377 30.813 159 2HG GLU 19 HG1 GLU 19 14.986 40.842 29.944 160 H ASN 20 HN ASN 20 17.590 42.101 26.573 161 HA ASN 20 HA ASN 20 18.166 44.760 25.534 162 1HB ASN 20 HB2 ASN 20 19.417 44.693 27.722 163 2HB ASN 20 HB1 ASN 20 20.366 43.355 27.070 164 1HD2 ASN 20 HD22 ASN 20 22.553 45.543 25.424 165 2HD2 ASN 20 HD21 ASN 20 22.300 44.048 26.183 166 H TYR 21 HN TYR 21 19.661 44.683 23.741 167 HA TYR 21 HA TYR 21 19.814 41.973 22.484 168 1HB TYR 21 HB2 TYR 21 19.996 44.782 21.344 169 2HB TYR 21 HB1 TYR 21 20.223 43.315 20.393 170 HD1 TYR 21 HD2 TYR 21 17.782 45.379 22.242 171 HD2 TYR 21 HD1 TYR 21 18.360 41.833 19.886 172 HE1 TYR 21 HE2 TYR 21 15.326 45.184 21.932 173 HE2 TYR 21 HE1 TYR 21 15.910 41.642 19.574 174 HH TYR 21 HH TYR 21 13.713 42.938 21.360 175 H THR 22 HN THR 22 21.843 41.093 22.020 176 HA THR 22 HA THR 22 24.141 42.325 23.263 177 HB THR 22 HB THR 22 24.137 39.946 23.239 178 HG1 THR 22 HG1 THR 22 25.857 40.455 21.085 179 1HG2 THR 22 HG21 THR 22 23.663 40.198 20.260 180 2HG2 THR 22 HG23 THR 22 24.063 38.682 21.063 181 3HG2 THR 22 HG22 THR 22 22.567 39.523 21.462 182 HA PRO 23 HA PRO 23 25.256 44.861 19.745 183 1HB PRO 23 HB2 PRO 23 28.066 44.910 20.257 184 2HB PRO 23 HB1 PRO 23 26.873 46.107 20.787 185 1HG PRO 23 HG2 PRO 23 28.236 44.040 22.384 186 2HG PRO 23 HG1 PRO 23 27.315 45.443 22.940 187 1HD PRO 23 HD2 PRO 23 26.447 42.734 23.027 188 2HD PRO 23 HD1 PRO 23 25.441 44.178 23.295 189 H ASP 24 HN ASP 24 25.884 41.669 20.155 190 HA ASP 24 HA ASP 24 27.892 41.138 18.166 191 1HB ASP 24 HB2 ASP 24 25.692 39.423 19.348 192 2HB ASP 24 HB1 ASP 24 26.892 38.809 18.210 193 H LEU 25 HN LEU 25 24.345 41.343 18.051 194 HA LEU 25 HA LEU 25 24.516 41.567 15.080 195 1HB LEU 25 HB2 LEU 25 22.612 39.796 16.645 196 2HB LEU 25 HB1 LEU 25 22.451 40.120 14.928 197 HG LEU 25 HG LEU 25 24.974 38.933 16.113 198 1HD1 LEU 25 HD13 LEU 25 22.483 37.544 15.102 199 2HD1 LEU 25 HD12 LEU 25 24.040 36.738 15.287 200 3HD1 LEU 25 HD11 LEU 25 23.219 37.399 16.697 201 1HD2 LEU 25 HD22 LEU 25 23.788 39.102 13.325 202 2HD2 LEU 25 HD21 LEU 25 25.314 39.784 13.884 203 3HD2 LEU 25 HD23 LEU 25 25.133 38.040 13.733 204 HA PRO 26 HA PRO 26 21.806 45.028 15.817 205 1HB PRO 26 HB2 PRO 26 20.128 44.707 13.515 206 2HB PRO 26 HB1 PRO 26 21.557 45.740 13.655 207 1HG PRO 26 HG2 PRO 26 21.275 43.175 12.238 208 2HG PRO 26 HG1 PRO 26 22.589 44.359 12.135 209 1HD PRO 26 HD2 PRO 26 22.714 41.838 13.433 210 2HD PRO 26 HD1 PRO 26 23.897 43.149 13.573 211 H ARG 27 HN ARG 27 19.642 45.429 16.613 212 HA ARG 27 HA ARG 27 18.315 43.168 17.754 213 1HB ARG 27 HB2 ARG 27 16.629 44.732 18.499 214 2HB ARG 27 HB1 ARG 27 18.202 45.515 18.644 215 1HG ARG 27 HG2 ARG 27 17.782 46.537 16.356 216 2HG ARG 27 HG1 ARG 27 16.128 45.929 16.478 217 1HD ARG 27 HD2 ARG 27 15.904 47.142 18.663 218 2HD ARG 27 HD1 ARG 27 17.486 47.864 18.369 219 HE ARG 27 HE ARG 27 16.093 48.502 16.085 220 1HH1 ARG 27 HH21 ARG 27 15.536 48.758 19.478 221 2HH1 ARG 27 HH22 ARG 27 14.570 50.192 19.347 222 1HH2 ARG 27 HH11 ARG 27 14.837 50.373 15.896 223 2HH2 ARG 27 HH12 ARG 27 14.173 51.103 17.319 224 H ALA 28 HN ALA 28 17.750 44.978 14.762 225 HA ALA 28 HA ALA 28 15.172 43.965 14.132 226 1HB ALA 28 HB1 ALA 28 16.373 45.782 12.880 227 2HB ALA 28 HB3 ALA 28 17.405 44.541 12.164 228 3HB ALA 28 HB2 ALA 28 15.673 44.546 11.826 229 H ASP 29 HN ASP 29 18.390 42.570 13.501 230 HA ASP 29 HA ASP 29 17.270 40.276 12.088 231 1HB ASP 29 HB2 ASP 29 20.029 40.906 13.162 232 2HB ASP 29 HB1 ASP 29 19.645 39.403 12.329 233 H VAL 30 HN VAL 30 18.323 40.954 15.400 234 HA VAL 30 HA VAL 30 18.205 38.204 16.276 235 HB VAL 30 HB VAL 30 18.079 40.838 17.765 236 1HG1 VAL 30 HG12 VAL 30 17.989 37.990 18.773 237 2HG1 VAL 30 HG11 VAL 30 18.627 39.294 19.773 238 3HG1 VAL 30 HG13 VAL 30 16.953 39.343 19.223 239 1HG2 VAL 30 HG21 VAL 30 20.218 38.714 17.413 240 2HG2 VAL 30 HG23 VAL 30 20.228 40.332 16.711 241 3HG2 VAL 30 HG22 VAL 30 20.373 40.128 18.456 242 H ASP 31 HN ASP 31 15.888 40.921 16.444 243 HA ASP 31 HA ASP 31 13.828 39.516 17.815 244 1HB ASP 31 HB2 ASP 31 13.793 41.809 15.845 245 2HB ASP 31 HB1 ASP 31 12.305 41.176 16.544 246 H HIS 32 HN HIS 32 14.611 39.737 14.360 247 HA HIS 32 HA HIS 32 12.322 38.403 13.341 248 1HB HIS 32 HB2 HIS 32 14.003 39.606 11.955 249 2HB HIS 32 HB1 HIS 32 15.170 38.328 12.289 250 HD1 HIS 32 HD1 HIS 32 11.836 38.886 10.574 251 HD2 HIS 32 HD2 HIS 32 14.908 36.068 10.651 252 HE1 HIS 32 HE1 HIS 32 11.330 37.226 8.731 253 H ALA 33 HN ALA 33 15.513 37.041 14.241 254 HA ALA 33 HA ALA 33 14.874 34.320 13.696 255 1HB ALA 33 HB2 ALA 33 16.770 35.483 15.754 256 2HB ALA 33 HB1 ALA 33 16.755 33.801 15.227 257 3HB ALA 33 HB3 ALA 33 17.165 35.078 14.082 258 H ILE 34 HN ILE 34 14.558 36.172 16.731 259 HA ILE 34 HA ILE 34 13.568 33.941 18.268 260 HB ILE 34 HB ILE 34 13.240 36.927 18.707 261 1HG1 ILE 34 HG12 ILE 34 15.592 36.325 18.600 262 2HG1 ILE 34 HG11 ILE 34 15.161 36.619 20.279 263 1HG2 ILE 34 HG22 ILE 34 12.819 34.548 20.527 264 2HG2 ILE 34 HG21 ILE 34 13.008 36.195 21.124 265 3HG2 ILE 34 HG23 ILE 34 11.646 35.786 20.083 266 1HD1 ILE 34 HD12 ILE 34 14.722 34.004 20.300 267 2HD1 ILE 34 HD11 ILE 34 15.812 34.030 18.915 268 3HD1 ILE 34 HD13 ILE 34 16.357 34.639 20.476 269 H GLU 35 HN GLU 35 11.986 36.549 16.467 270 HA GLU 35 HA GLU 35 9.318 36.046 17.280 271 1HB GLU 35 HB2 GLU 35 10.006 38.009 15.957 272 2HB GLU 35 HB1 GLU 35 10.346 36.965 14.577 273 1HG GLU 35 HG2 GLU 35 7.969 36.281 14.507 274 2HG GLU 35 HG1 GLU 35 7.632 37.325 15.888 275 H LYS 36 HN LYS 36 11.194 34.577 14.605 276 HA LYS 36 HA LYS 36 9.016 32.958 13.667 277 1HB LYS 36 HB2 LYS 36 12.009 32.727 13.340 278 2HB LYS 36 HB1 LYS 36 10.892 31.569 12.623 279 1HG LYS 36 HG2 LYS 36 9.738 33.400 11.439 280 2HG LYS 36 HG1 LYS 36 10.859 34.563 12.153 281 1HD LYS 36 HD2 LYS 36 12.720 33.649 10.979 282 2HD LYS 36 HD1 LYS 36 11.823 32.206 10.523 283 1HE LYS 36 HE2 LYS 36 10.920 34.937 9.620 284 2HE LYS 36 HE1 LYS 36 12.152 34.048 8.729 285 1HZ LYS 36 HZ1 LYS 36 10.240 32.184 9.142 286 2HZ LYS 36 HZ3 LYS 36 9.321 33.586 8.891 287 3HZ LYS 36 HZ2 LYS 36 10.439 33.081 7.714 288 H ALA 37 HN ALA 37 11.490 32.408 16.161 289 HA ALA 37 HA ALA 37 11.040 29.609 16.466 290 1HB ALA 37 HB2 ALA 37 12.834 31.109 17.578 291 2HB ALA 37 HB1 ALA 37 11.605 31.446 18.798 292 3HB ALA 37 HB3 ALA 37 12.160 29.791 18.536 293 H PHE 38 HN PHE 38 9.530 32.344 18.218 294 HA PHE 38 HA PHE 38 7.702 30.762 19.726 295 1HB PHE 38 HB2 PHE 38 7.659 33.633 18.775 296 2HB PHE 38 HB1 PHE 38 6.313 32.958 19.696 297 HD1 PHE 38 HD2 PHE 38 6.908 31.723 21.903 298 HD2 PHE 38 HD1 PHE 38 9.541 34.467 19.914 299 HE1 PHE 38 HE2 PHE 38 8.179 32.025 24.009 300 HE2 PHE 38 HE1 PHE 38 10.814 34.770 22.022 301 HZ PHE 38 HZ PHE 38 10.131 33.548 24.068 302 H GLN 39 HN GLN 39 7.414 32.226 16.498 303 HA GLN 39 HA GLN 39 4.677 31.515 16.101 304 1HB GLN 39 HB2 GLN 39 6.925 32.026 14.142 305 2HB GLN 39 HB1 GLN 39 5.260 31.739 13.640 306 1HG GLN 39 HG2 GLN 39 6.050 33.908 15.604 307 2HG GLN 39 HG1 GLN 39 5.881 34.185 13.872 308 1HE2 GLN 39 HE22 GLN 39 2.259 33.324 14.089 309 2HE2 GLN 39 HE21 GLN 39 3.593 32.736 13.220 310 H LEU 40 HN LEU 40 7.698 29.727 15.361 311 HA LEU 40 HA LEU 40 6.441 27.576 13.974 312 1HB LEU 40 HB2 LEU 40 8.957 27.614 15.654 313 2HB LEU 40 HB1 LEU 40 8.438 26.205 14.732 314 HG LEU 40 HG LEU 40 8.899 28.945 13.509 315 1HD1 LEU 40 HD12 LEU 40 10.973 27.890 14.491 316 2HD1 LEU 40 HD11 LEU 40 10.726 26.529 13.396 317 3HD1 LEU 40 HD13 LEU 40 11.043 28.138 12.746 318 1HD2 LEU 40 HD21 LEU 40 8.171 26.224 12.430 319 2HD2 LEU 40 HD23 LEU 40 7.543 27.810 11.975 320 3HD2 LEU 40 HD22 LEU 40 9.141 27.308 11.431 321 H TRP 41 HN TRP 41 7.091 27.922 17.491 322 HA TRP 41 HA TRP 41 5.930 25.344 18.114 323 1HB TRP 41 HB2 TRP 41 6.461 27.792 19.817 324 2HB TRP 41 HB1 TRP 41 5.829 26.278 20.465 325 HD1 TRP 41 HD1 TRP 41 8.997 27.985 19.602 326 HE1 TRP 41 HE1 TRP 41 10.982 26.354 19.812 327 HE3 TRP 41 HE3 TRP 41 6.467 23.569 20.001 328 HZ2 TRP 41 HZ2 TRP 41 11.437 23.546 20.106 329 HZ3 TRP 41 HZ3 TRP 41 7.697 21.429 20.250 330 HH2 TRP 41 HH2 TRP 41 10.179 21.412 20.303 331 H SER 42 HN SER 42 4.670 28.673 18.116 332 HA SER 42 HA SER 42 2.082 27.995 19.169 333 1HB SER 42 HB2 SER 42 3.140 30.318 19.008 334 2HB SER 42 HB1 SER 42 2.674 30.309 17.312 335 HG SER 42 HG SER 42 1.085 30.341 19.625 336 H ASN 43 HN ASN 43 3.353 28.201 15.855 337 HA ASN 43 HA ASN 43 0.927 27.989 14.438 338 1HB ASN 43 HB2 ASN 43 3.681 26.932 13.781 339 2HB ASN 43 HB1 ASN 43 2.334 26.884 12.644 340 1HD2 ASN 43 HD22 ASN 43 4.280 30.083 12.173 341 2HD2 ASN 43 HD21 ASN 43 4.719 28.445 12.162 342 H VAL 44 HN VAL 44 2.579 25.530 16.301 343 HA VAL 44 HA VAL 44 0.745 23.439 15.164 344 HB VAL 44 HB VAL 44 2.334 21.826 16.296 345 1HG1 VAL 44 HG12 VAL 44 2.399 22.434 13.854 346 2HG1 VAL 44 HG11 VAL 44 3.617 23.649 14.239 347 3HG1 VAL 44 HG13 VAL 44 3.959 21.941 14.507 348 1HG2 VAL 44 HG22 VAL 44 3.275 23.560 17.860 349 2HG2 VAL 44 HG21 VAL 44 4.506 22.646 16.991 350 3HG2 VAL 44 HG23 VAL 44 4.101 24.286 16.480 351 H THR 45 HN THR 45 0.575 25.558 17.581 352 HA THR 45 HA THR 45 -0.961 23.663 19.255 353 HB THR 45 HB THR 45 0.156 24.768 21.320 354 HG1 THR 45 HG1 THR 45 1.805 25.506 19.177 355 1HG2 THR 45 HG22 THR 45 0.476 22.404 20.624 356 2HG2 THR 45 HG21 THR 45 1.803 22.917 19.580 357 3HG2 THR 45 HG23 THR 45 1.934 23.103 21.329 358 HA PRO 46 HA PRO 46 -3.644 27.231 19.461 359 1HB PRO 46 HB2 PRO 46 -4.886 26.702 21.932 360 2HB PRO 46 HB1 PRO 46 -5.383 26.028 20.373 361 1HG PRO 46 HG2 PRO 46 -3.912 24.705 22.591 362 2HG PRO 46 HG1 PRO 46 -4.897 23.976 21.312 363 1HD PRO 46 HD2 PRO 46 -2.080 23.961 21.390 364 2HD PRO 46 HD1 PRO 46 -3.078 23.650 19.954 365 H LEU 47 HN LEU 47 -0.939 26.881 21.290 366 HA LEU 47 HA LEU 47 -1.444 28.853 23.376 367 1HB LEU 47 HB2 LEU 47 1.191 27.865 22.236 368 2HB LEU 47 HB1 LEU 47 1.003 28.803 23.715 369 HG LEU 47 HG LEU 47 -0.177 26.051 23.227 370 1HD1 LEU 47 HD13 LEU 47 2.302 26.090 23.458 371 2HD1 LEU 47 HD12 LEU 47 2.125 26.930 24.998 372 3HD1 LEU 47 HD11 LEU 47 1.520 25.281 24.818 373 1HD2 LEU 47 HD21 LEU 47 -0.324 28.017 25.511 374 2HD2 LEU 47 HD23 LEU 47 -1.613 27.046 24.803 375 3HD2 LEU 47 HD22 LEU 47 -0.408 26.287 25.838 376 H THR 48 HN THR 48 -0.747 31.034 23.384 377 HA THR 48 HA THR 48 0.021 32.166 20.701 378 HB THR 48 HB THR 48 -1.410 34.107 21.199 379 HG1 THR 48 HG1 THR 48 -2.554 32.704 23.328 380 1HG2 THR 48 HG22 THR 48 -2.337 32.126 19.993 381 2HG2 THR 48 HG21 THR 48 -2.928 31.505 21.534 382 3HG2 THR 48 HG23 THR 48 -3.567 33.018 20.890 383 H PHE 49 HN PHE 49 1.548 33.812 20.771 384 HA PHE 49 HA PHE 49 2.613 34.564 23.475 385 1HB PHE 49 HB2 PHE 49 4.148 33.861 20.960 386 2HB PHE 49 HB1 PHE 49 4.872 34.563 22.410 387 HD1 PHE 49 HD1 PHE 49 3.255 31.588 20.971 388 HD2 PHE 49 HD2 PHE 49 5.089 33.288 24.464 389 HE1 PHE 49 HE1 PHE 49 3.408 29.327 21.987 390 HE2 PHE 49 HE2 PHE 49 5.241 31.033 25.484 391 HZ PHE 49 HZ PHE 49 4.404 29.052 24.245 392 H THR 50 HN THR 50 2.671 36.714 23.757 393 HA THR 50 HA THR 50 2.683 38.491 21.336 394 HB THR 50 HB THR 50 1.370 39.012 24.018 395 HG1 THR 50 HG1 THR 50 -0.537 38.843 22.712 396 1HG2 THR 50 HG23 THR 50 1.538 40.575 21.430 397 2HG2 THR 50 HG22 THR 50 0.389 40.945 22.716 398 3HG2 THR 50 HG21 THR 50 2.122 41.070 23.020 399 H LYS 51 HN LYS 51 4.333 39.901 21.241 400 HA LYS 51 HA LYS 51 6.349 39.945 23.351 401 1HB LYS 51 HB2 LYS 51 6.895 40.133 20.903 402 2HB LYS 51 HB1 LYS 51 6.120 41.716 20.897 403 1HG LYS 51 HG2 LYS 51 7.707 42.510 22.611 404 2HG LYS 51 HG1 LYS 51 8.485 40.926 22.630 405 1HD LYS 51 HD2 LYS 51 9.068 41.186 20.242 406 2HD LYS 51 HD1 LYS 51 8.298 42.774 20.228 407 1HE LYS 51 HE2 LYS 51 9.894 43.640 21.824 408 2HE LYS 51 HE1 LYS 51 10.571 42.033 22.090 409 1HZ LYS 51 HZ3 LYS 51 10.604 42.673 19.332 410 2HZ LYS 51 HZ2 LYS 51 11.382 43.896 20.219 411 3HZ LYS 51 HZ1 LYS 51 11.900 42.285 20.353 412 H VAL 52 HN VAL 52 6.733 41.651 24.801 413 HA VAL 52 HA VAL 52 4.797 43.949 24.735 414 HB VAL 52 HB VAL 52 4.660 43.852 27.181 415 1HG1 VAL 52 HG11 VAL 52 3.020 42.580 25.839 416 2HG1 VAL 52 HG13 VAL 52 4.081 41.173 25.878 417 3HG1 VAL 52 HG12 VAL 52 3.352 41.771 27.368 418 1HG2 VAL 52 HG23 VAL 52 6.471 41.442 26.839 419 2HG2 VAL 52 HG22 VAL 52 6.810 42.911 27.757 420 3HG2 VAL 52 HG21 VAL 52 5.579 41.784 28.322 421 H SER 53 HN SER 53 5.770 45.903 24.892 422 HA SER 53 HA SER 53 8.714 45.972 25.242 423 1HB SER 53 HB2 SER 53 7.597 47.178 23.339 424 2HB SER 53 HB1 SER 53 6.816 48.224 24.521 425 HG SER 53 HG SER 53 8.649 49.222 24.839 426 H GLU 54 HN GLU 54 6.024 46.252 27.214 427 HA GLU 54 HA GLU 54 7.620 47.619 29.283 428 1HB GLU 54 HB2 GLU 54 5.622 49.078 29.791 429 2HB GLU 54 HB1 GLU 54 6.501 49.491 28.329 430 1HG GLU 54 HG2 GLU 54 4.851 48.236 26.983 431 2HG GLU 54 HG1 GLU 54 3.972 47.818 28.455 432 H GLY 55 HN GLY 55 6.665 47.398 31.402 433 1HA GLY 55 HA2 GLY 55 5.306 46.339 33.042 434 2HA GLY 55 HA1 GLY 55 4.392 45.563 31.750 435 H GLN 56 HN GLN 56 4.956 43.872 33.714 436 HA GLN 56 HA GLN 56 7.570 42.578 33.319 437 1HB GLN 56 HB2 GLN 56 6.533 42.640 35.559 438 2HB GLN 56 HB1 GLN 56 5.158 41.720 34.951 439 1HG GLN 56 HG2 GLN 56 6.617 39.829 34.412 440 2HG GLN 56 HG1 GLN 56 8.031 40.754 34.924 441 1HE2 GLN 56 HE22 GLN 56 6.892 38.591 37.779 442 2HE2 GLN 56 HE21 GLN 56 7.369 38.277 36.180 443 H ALA 57 HN ALA 57 7.887 40.600 32.243 444 HA ALA 57 HA ALA 57 5.595 39.658 30.543 445 1HB ALA 57 HB2 ALA 57 7.787 40.608 29.510 446 2HB ALA 57 HB1 ALA 57 8.505 39.073 29.991 447 3HB ALA 57 HB3 ALA 57 7.146 39.099 28.864 448 H ASP 58 HN ASP 58 5.190 37.401 30.424 449 HA ASP 58 HA ASP 58 5.689 35.873 32.768 450 1HB ASP 58 HB2 ASP 58 4.931 35.008 29.964 451 2HB ASP 58 HB1 ASP 58 5.008 33.896 31.330 452 H ILE 59 HN ILE 59 7.408 35.957 29.649 453 HA ILE 59 HA ILE 59 9.595 34.307 30.892 454 HB ILE 59 HB ILE 59 8.820 34.504 27.966 455 1HG1 ILE 59 HG12 ILE 59 8.639 32.118 29.824 456 2HG1 ILE 59 HG11 ILE 59 7.265 33.174 29.480 457 1HG2 ILE 59 HG21 ILE 59 10.955 32.942 29.431 458 2HG2 ILE 59 HG23 ILE 59 10.482 32.621 27.767 459 3HG2 ILE 59 HG22 ILE 59 11.202 34.170 28.194 460 1HD1 ILE 59 HD12 ILE 59 7.603 32.713 27.036 461 2HD1 ILE 59 HD11 ILE 59 8.854 31.551 27.469 462 3HD1 ILE 59 HD13 ILE 59 7.184 31.272 27.961 463 H MET 60 HN MET 60 11.386 35.505 31.269 464 HA MET 60 HA MET 60 11.845 37.972 29.631 465 1HB MET 60 HB2 MET 60 12.987 37.149 32.314 466 2HB MET 60 HB1 MET 60 13.355 38.650 31.465 467 1HG MET 60 HG2 MET 60 10.918 39.200 31.476 468 2HG MET 60 HG1 MET 60 10.633 37.762 32.456 469 1HE MET 60 HE3 MET 60 12.803 40.865 32.046 470 2HE MET 60 HE2 MET 60 11.213 41.471 32.510 471 3HE MET 60 HE1 MET 60 12.589 41.715 33.584 472 H ILE 61 HN ILE 61 13.533 38.058 28.285 473 HA ILE 61 HA ILE 61 15.570 35.854 28.359 474 HB ILE 61 HB ILE 61 14.570 37.512 26.030 475 1HG1 ILE 61 HG12 ILE 61 14.255 34.545 26.556 476 2HG1 ILE 61 HG11 ILE 61 13.012 35.734 26.952 477 1HG2 ILE 61 HG22 ILE 61 16.682 35.366 26.281 478 2HG2 ILE 61 HG21 ILE 61 15.940 35.784 24.737 479 3HG2 ILE 61 HG23 ILE 61 16.861 36.995 25.630 480 1HD1 ILE 61 HD13 ILE 61 14.205 35.471 24.183 481 2HD1 ILE 61 HD12 ILE 61 12.758 34.602 24.684 482 3HD1 ILE 61 HD11 ILE 61 12.760 36.364 24.653 483 H SER 62 HN SER 62 17.693 36.481 28.556 484 HA SER 62 HA SER 62 18.453 39.278 27.916 485 1HB SER 62 HB2 SER 62 19.342 39.738 30.098 486 2HB SER 62 HB1 SER 62 17.691 39.170 30.332 487 HG SER 62 HG SER 62 20.125 37.765 30.677 488 H PHE 63 HN PHE 63 20.795 39.557 27.859 489 HA PHE 63 HA PHE 63 22.257 36.977 27.371 490 1HB PHE 63 HB2 PHE 63 22.582 39.747 26.179 491 2HB PHE 63 HB1 PHE 63 23.737 38.442 25.932 492 HD1 PHE 63 HD1 PHE 63 20.274 39.565 25.300 493 HD2 PHE 63 HD2 PHE 63 23.229 36.546 24.536 494 HE1 PHE 63 HE1 PHE 63 18.856 38.633 23.486 495 HE2 PHE 63 HE2 PHE 63 21.814 35.611 22.726 496 HZ PHE 63 HZ PHE 63 19.626 36.656 22.202 497 H VAL 64 HN VAL 64 24.014 36.576 28.663 498 HA VAL 64 HA VAL 64 25.173 38.851 30.252 499 HB VAL 64 HB VAL 64 25.342 37.321 32.180 500 1HG1 VAL 64 HG12 VAL 64 23.313 38.794 31.757 501 2HG1 VAL 64 HG11 VAL 64 22.508 37.363 31.112 502 3HG1 VAL 64 HG13 VAL 64 23.019 37.403 32.800 503 1HG2 VAL 64 HG21 VAL 64 23.933 35.440 30.270 504 2HG2 VAL 64 HG23 VAL 64 25.459 35.172 31.112 505 3HG2 VAL 64 HG22 VAL 64 23.946 35.189 32.015 506 H ARG 65 HN ARG 65 27.364 38.443 31.044 507 HA ARG 65 HA ARG 65 28.920 36.565 29.282 508 1HB ARG 65 HB2 ARG 65 29.612 39.299 30.399 509 2HB ARG 65 HB1 ARG 65 30.815 38.222 29.691 510 1HG ARG 65 HG2 ARG 65 29.550 38.194 27.581 511 2HG ARG 65 HG1 ARG 65 28.343 39.273 28.281 512 1HD ARG 65 HD2 ARG 65 30.107 40.970 28.654 513 2HD ARG 65 HD1 ARG 65 31.297 39.910 27.912 514 HE ARG 65 HE ARG 65 29.441 41.681 26.573 515 1HH1 ARG 65 HH21 ARG 65 30.801 38.521 26.325 516 2HH1 ARG 65 HH22 ARG 65 30.417 38.357 24.643 517 1HH2 ARG 65 HH11 ARG 65 28.947 41.480 24.391 518 2HH2 ARG 65 HH12 ARG 65 29.373 40.026 23.552 519 H GLY 66 HN GLY 66 30.381 35.209 30.290 520 1HA GLY 66 HA2 GLY 66 31.184 33.908 32.085 521 2HA GLY 66 HA1 GLY 66 31.824 35.464 32.603 522 H ASP 67 HN ASP 67 31.530 35.222 34.799 523 HA ASP 67 HA ASP 67 29.169 34.143 36.027 524 1HB ASP 67 HB2 ASP 67 31.392 34.281 37.145 525 2HB ASP 67 HB1 ASP 67 31.216 36.036 37.217 526 H HIS 68 HN HIS 68 27.245 35.097 36.462 527 HA HIS 68 HA HIS 68 27.068 38.085 36.494 528 1HB HIS 68 HB2 HIS 68 24.949 37.918 35.181 529 2HB HIS 68 HB1 HIS 68 26.370 37.424 34.261 530 HD1 HIS 68 HD1 HIS 68 26.800 34.736 34.197 531 HD2 HIS 68 HD2 HIS 68 22.982 35.965 35.336 532 HE1 HIS 68 HE1 HIS 68 25.297 32.712 33.963 533 H ARG 69 HN ARG 69 27.108 36.992 38.873 534 HA ARG 69 HA ARG 69 25.901 36.552 40.836 535 1HB ARG 69 HB2 ARG 69 23.833 38.122 39.270 536 2HB ARG 69 HB1 ARG 69 23.694 37.732 40.984 537 1HG ARG 69 HG2 ARG 69 25.826 38.914 41.419 538 2HG ARG 69 HG1 ARG 69 25.934 39.326 39.706 539 1HD ARG 69 HD2 ARG 69 23.690 40.146 41.573 540 2HD ARG 69 HD1 ARG 69 24.982 41.199 40.998 541 HE ARG 69 HE ARG 69 23.836 40.208 38.674 542 1HH1 ARG 69 HH21 ARG 69 22.801 41.859 41.518 543 2HH1 ARG 69 HH22 ARG 69 21.454 42.628 40.745 544 1HH2 ARG 69 HH11 ARG 69 22.083 41.200 37.646 545 2HH2 ARG 69 HH12 ARG 69 21.050 42.258 38.551 546 H ASP 70 HN ASP 70 26.000 34.312 39.440 547 HA ASP 70 HA ASP 70 23.286 33.134 39.783 548 1HB ASP 70 HB2 ASP 70 23.439 31.958 37.648 549 2HB ASP 70 HB1 ASP 70 23.575 33.694 37.364 550 H ASN 71 HN ASN 71 23.437 30.707 39.869 551 HA ASN 71 HA ASN 71 25.908 29.929 41.307 552 1HB ASN 71 HB2 ASN 71 23.289 28.455 40.898 553 2HB ASN 71 HB1 ASN 71 24.617 27.912 41.926 554 1HD2 ASN 71 HD22 ASN 71 21.967 30.274 43.611 555 2HD2 ASN 71 HD21 ASN 71 21.685 29.208 42.323 556 H SER 72 HN SER 72 25.242 30.088 38.164 557 HA SER 72 HA SER 72 26.804 27.610 37.557 558 1HB SER 72 HB2 SER 72 24.386 28.568 36.011 559 2HB SER 72 HB1 SER 72 25.413 27.207 35.581 560 HG SER 72 HG SER 72 24.847 26.292 37.634 561 HA PRO 73 HA PRO 73 28.473 31.481 35.556 562 1HB PRO 73 HB2 PRO 73 31.119 30.772 36.452 563 2HB PRO 73 HB1 PRO 73 30.119 32.117 37.023 564 1HG PRO 73 HG2 PRO 73 30.775 29.677 38.443 565 2HG PRO 73 HG1 PRO 73 29.799 31.036 39.018 566 1HD PRO 73 HD2 PRO 73 28.880 28.409 38.177 567 2HD PRO 73 HD1 PRO 73 27.915 29.751 38.820 568 H PHE 74 HN PHE 74 29.512 31.369 33.513 569 HA PHE 74 HA PHE 74 29.702 28.713 32.343 570 1HB PHE 74 HB2 PHE 74 30.386 31.469 31.281 571 2HB PHE 74 HB1 PHE 74 30.441 29.996 30.307 572 HD1 PHE 74 HD1 PHE 74 28.379 28.727 29.831 573 HD2 PHE 74 HD2 PHE 74 28.271 32.462 31.951 574 HE1 PHE 74 HE1 PHE 74 25.939 28.888 29.428 575 HE2 PHE 74 HE2 PHE 74 25.828 32.617 31.551 576 HZ PHE 74 HZ PHE 74 24.663 30.832 30.288 577 H ASP 75 HN ASP 75 31.551 27.518 31.934 578 HA ASP 75 HA ASP 75 34.095 28.551 33.105 579 1HB ASP 75 HB2 ASP 75 33.288 26.351 33.884 580 2HB ASP 75 HB1 ASP 75 33.306 25.753 32.226 581 H GLY 76 HN GLY 76 33.810 29.903 30.869 582 1HA GLY 76 HA2 GLY 76 35.266 30.368 29.022 583 2HA GLY 76 HA1 GLY 76 35.783 28.681 29.031 584 HA PRO 77 HA PRO 77 32.632 29.444 25.625 585 1HB PRO 77 HB2 PRO 77 34.434 28.258 23.715 586 2HB PRO 77 HB1 PRO 77 33.952 29.959 23.817 587 1HG PRO 77 HG2 PRO 77 36.524 28.780 24.517 588 2HG PRO 77 HG1 PRO 77 36.074 30.491 24.510 589 1HD PRO 77 HD2 PRO 77 36.469 28.790 26.811 590 2HD PRO 77 HD1 PRO 77 35.970 30.493 26.803 591 H GLY 78 HN GLY 78 34.016 27.057 27.393 592 1HA GLY 78 HA2 GLY 78 32.889 24.779 25.824 593 2HA GLY 78 HA1 GLY 78 34.004 24.637 27.185 594 H GLY 79 HN GLY 79 31.884 23.043 27.418 595 1HA GLY 79 HA2 GLY 79 30.315 22.530 29.121 596 2HA GLY 79 HA1 GLY 79 30.444 24.197 29.699 597 H ASN 80 HN ASN 80 28.094 24.273 29.807 598 HA ASN 80 HA ASN 80 26.463 23.854 27.458 599 1HB ASN 80 HB2 ASN 80 25.879 25.419 29.986 600 2HB ASN 80 HB1 ASN 80 24.684 24.921 28.791 601 1HD2 ASN 80 HD22 ASN 80 25.387 22.361 31.670 602 2HD2 ASN 80 HD21 ASN 80 25.488 24.049 31.766 603 H LEU 81 HN LEU 81 25.466 25.434 26.142 604 HA LEU 81 HA LEU 81 27.077 27.888 25.758 605 1HB LEU 81 HB2 LEU 81 24.690 26.971 24.133 606 2HB LEU 81 HB1 LEU 81 26.002 28.038 23.623 607 HG LEU 81 HG LEU 81 26.221 25.079 24.241 608 1HD1 LEU 81 HD11 LEU 81 26.495 26.688 21.687 609 2HD1 LEU 81 HD13 LEU 81 26.899 24.979 21.836 610 3HD1 LEU 81 HD12 LEU 81 25.235 25.513 22.059 611 1HD2 LEU 81 HD21 LEU 81 28.300 27.173 23.590 612 2HD2 LEU 81 HD23 LEU 81 28.267 26.078 24.973 613 3HD2 LEU 81 HD22 LEU 81 28.590 25.449 23.360 614 H ALA 82 HN ALA 82 24.306 26.946 27.415 615 HA ALA 82 HA ALA 82 23.636 29.618 28.225 616 1HB ALA 82 HB1 ALA 82 21.910 28.301 26.115 617 2HB ALA 82 HB3 ALA 82 21.314 29.592 27.159 618 3HB ALA 82 HB2 ALA 82 22.654 29.899 26.054 619 H HIS 83 HN HIS 83 21.227 29.440 29.275 620 HA HIS 83 HA HIS 83 20.460 26.795 30.183 621 1HB HIS 83 HB2 HIS 83 21.073 27.050 32.549 622 2HB HIS 83 HB1 HIS 83 22.520 27.116 31.539 623 HD1 HIS 83 HD1 HIS 83 23.535 29.540 31.095 624 HD2 HIS 83 HD2 HIS 83 20.566 29.377 34.016 625 HE1 HIS 83 HE1 HIS 83 23.694 31.706 32.396 626 H ALA 84 HN ALA 84 18.646 26.992 31.832 627 HA ALA 84 HA ALA 84 17.424 29.698 31.972 628 1HB ALA 84 HB2 ALA 84 16.541 28.680 29.886 629 2HB ALA 84 HB1 ALA 84 16.005 27.275 30.805 630 3HB ALA 84 HB3 ALA 84 15.269 28.850 31.094 631 H PHE 85 HN PHE 85 15.398 29.589 33.417 632 HA PHE 85 HA PHE 85 16.004 27.778 35.705 633 1HB PHE 85 HB2 PHE 85 14.342 30.302 35.471 634 2HB PHE 85 HB1 PHE 85 14.415 29.318 36.933 635 HD1 PHE 85 HD1 PHE 85 16.487 29.105 38.217 636 HD2 PHE 85 HD2 PHE 85 16.277 31.601 34.734 637 HE1 PHE 85 HE1 PHE 85 18.613 30.199 38.873 638 HE2 PHE 85 HE2 PHE 85 18.400 32.695 35.384 639 HZ PHE 85 HZ PHE 85 19.572 31.996 37.454 640 H GLN 86 HN GLN 86 14.086 26.796 36.847 641 HA GLN 86 HA GLN 86 12.512 25.286 35.044 642 1HB GLN 86 HB2 GLN 86 12.021 25.894 37.972 643 2HB GLN 86 HB1 GLN 86 11.159 24.658 37.057 644 1HG GLN 86 HG2 GLN 86 14.177 24.700 37.236 645 2HG GLN 86 HG1 GLN 86 13.182 23.866 38.429 646 1HE2 GLN 86 HE22 GLN 86 12.168 21.285 36.149 647 2HE2 GLN 86 HE21 GLN 86 11.710 22.109 37.558 648 HA PRO 87 HA PRO 87 9.326 28.191 33.942 649 1HB PRO 87 HB2 PRO 87 7.147 26.319 33.911 650 2HB PRO 87 HB1 PRO 87 8.118 26.842 32.530 651 1HG PRO 87 HG2 PRO 87 8.208 24.279 33.957 652 2HG PRO 87 HG1 PRO 87 8.958 24.711 32.414 653 1HD PRO 87 HD2 PRO 87 10.308 24.345 34.891 654 2HD PRO 87 HD1 PRO 87 10.988 25.051 33.408 655 H GLY 88 HN GLY 88 8.958 29.509 35.774 656 1HA GLY 88 HA2 GLY 88 6.659 28.922 37.421 657 2HA GLY 88 HA1 GLY 88 8.152 28.696 38.330 658 HA PRO 89 HA PRO 89 6.726 33.243 38.225 659 1HB PRO 89 HB2 PRO 89 6.636 33.237 41.114 660 2HB PRO 89 HB1 PRO 89 5.281 33.438 39.993 661 1HG PRO 89 HG2 PRO 89 5.932 31.110 41.621 662 2HG PRO 89 HG1 PRO 89 4.518 31.358 40.588 663 1HD PRO 89 HD2 PRO 89 6.747 29.618 40.073 664 2HD PRO 89 HD1 PRO 89 5.383 29.970 38.993 665 H GLY 90 HN GLY 90 7.871 34.803 40.187 666 1HA GLY 90 HA2 GLY 90 9.942 35.743 40.771 667 2HA GLY 90 HA1 GLY 90 10.396 34.100 41.208 668 H ILE 91 HN ILE 91 12.401 33.851 40.341 669 HA ILE 91 HA ILE 91 13.178 35.011 37.787 670 HB ILE 91 HB ILE 91 14.753 34.598 39.711 671 1HG1 ILE 91 HG12 ILE 91 15.607 33.039 37.260 672 2HG1 ILE 91 HG11 ILE 91 15.444 34.798 37.235 673 1HG2 ILE 91 HG21 ILE 91 13.701 32.300 40.170 674 2HG2 ILE 91 HG23 ILE 91 14.677 31.707 38.828 675 3HG2 ILE 91 HG22 ILE 91 15.462 32.387 40.251 676 1HD1 ILE 91 HD11 ILE 91 17.009 34.903 39.199 677 2HD1 ILE 91 HD13 ILE 91 17.258 33.167 39.030 678 3HD1 ILE 91 HD12 ILE 91 17.754 34.255 37.737 679 H GLY 92 HN GLY 92 11.349 32.328 38.600 680 1HA GLY 92 HA2 GLY 92 12.300 30.346 36.780 681 2HA GLY 92 HA1 GLY 92 10.641 30.456 37.374 682 H GLY 93 HN GLY 93 11.664 29.867 34.634 683 1HA GLY 93 HA2 GLY 93 10.611 30.263 32.535 684 2HA GLY 93 HA1 GLY 93 9.894 31.735 33.197 685 H ASP 94 HN ASP 94 12.626 32.533 34.252 686 HA ASP 94 HA ASP 94 13.398 34.192 32.058 687 1HB ASP 94 HB2 ASP 94 14.858 33.402 34.589 688 2HB ASP 94 HB1 ASP 94 15.484 34.588 33.448 689 H ALA 95 HN ALA 95 15.395 34.113 30.805 690 HA ALA 95 HA ALA 95 16.768 31.471 30.663 691 1HB ALA 95 HB2 ALA 95 14.831 31.499 29.029 692 2HB ALA 95 HB1 ALA 95 15.643 32.827 28.201 693 3HB ALA 95 HB3 ALA 95 16.413 31.243 28.292 694 H HIS 96 HN HIS 96 18.932 31.837 30.573 695 HA HIS 96 HA HIS 96 19.889 34.523 29.642 696 1HB HIS 96 HB2 HIS 96 21.205 32.466 31.437 697 2HB HIS 96 HB1 HIS 96 21.932 33.998 30.952 698 HD2 HIS 96 HD2 HIS 96 18.325 34.992 31.653 699 HE1 HIS 96 HE1 HIS 96 20.420 35.069 35.354 700 HE2 HIS 96 HE2 HIS 96 18.305 35.779 34.149 701 H PHE 97 HN PHE 97 21.311 34.661 27.951 702 HA PHE 97 HA PHE 97 22.147 32.098 26.628 703 1HB PHE 97 HB2 PHE 97 21.565 34.865 25.565 704 2HB PHE 97 HB1 PHE 97 22.470 33.687 24.618 705 HD1 PHE 97 HD1 PHE 97 19.247 34.193 26.443 706 HD2 PHE 97 HD2 PHE 97 21.348 31.998 23.405 707 HE1 PHE 97 HE1 PHE 97 17.117 33.136 25.727 708 HE2 PHE 97 HE2 PHE 97 19.223 30.945 22.694 709 HZ PHE 97 HZ PHE 97 17.109 31.512 23.847 710 H ASP 98 HN ASP 98 24.335 31.752 26.259 711 HA ASP 98 HA ASP 98 26.274 33.280 27.745 712 1HB ASP 98 HB2 ASP 98 26.554 30.874 27.160 713 2HB ASP 98 HB1 ASP 98 26.736 31.321 25.462 714 H GLU 99 HN GLU 99 26.567 35.397 27.140 715 HA GLU 99 HA GLU 99 26.492 36.210 24.338 716 1HB GLU 99 HB2 GLU 99 25.790 37.577 26.419 717 2HB GLU 99 HB1 GLU 99 27.500 37.899 26.618 718 1HG GLU 99 HG2 GLU 99 27.614 38.819 24.332 719 2HG GLU 99 HG1 GLU 99 25.890 38.507 24.129 720 H ASP 100 HN ASP 100 28.920 34.883 26.323 721 HA ASP 100 HA ASP 100 31.167 36.364 25.205 722 1HB ASP 100 HB2 ASP 100 31.037 33.736 26.718 723 2HB ASP 100 HB1 ASP 100 32.538 34.536 26.249 724 H GLU 101 HN GLU 101 29.179 33.810 24.124 725 HA GLU 101 HA GLU 101 31.189 32.698 22.269 726 1HB GLU 101 HB2 GLU 101 28.236 32.128 22.665 727 2HB GLU 101 HB1 GLU 101 29.282 31.258 21.540 728 1HG GLU 101 HG2 GLU 101 30.694 30.488 23.349 729 2HG GLU 101 HG1 GLU 101 29.817 31.482 24.511 730 H ARG 102 HN ARG 102 30.777 32.762 19.917 731 HA ARG 102 HA ARG 102 29.736 35.401 19.109 732 1HB ARG 102 HB2 ARG 102 31.858 34.567 18.172 733 2HB ARG 102 HB1 ARG 102 31.012 33.177 17.488 734 1HG ARG 102 HG2 ARG 102 29.629 34.682 16.113 735 2HG ARG 102 HG1 ARG 102 30.452 36.080 16.811 736 1HD ARG 102 HD2 ARG 102 32.609 35.185 15.947 737 2HD ARG 102 HD1 ARG 102 31.716 33.875 15.164 738 HE ARG 102 HE ARG 102 30.479 36.170 14.237 739 1HH1 ARG 102 HH21 ARG 102 33.688 34.948 14.414 740 2HH1 ARG 102 HH22 ARG 102 34.223 35.768 12.987 741 1HH2 ARG 102 HH11 ARG 102 31.141 37.247 12.380 742 2HH2 ARG 102 HH12 ARG 102 32.775 37.073 11.828 743 H TRP 103 HN TRP 103 27.601 35.581 18.700 744 HA TRP 103 HA TRP 103 26.037 33.195 17.873 745 1HB TRP 103 HB2 TRP 103 25.188 36.000 18.658 746 2HB TRP 103 HB1 TRP 103 24.083 34.681 18.273 747 HD1 TRP 103 HD1 TRP 103 25.956 36.171 21.087 748 HE1 TRP 103 HE1 TRP 103 25.874 34.625 23.149 749 HE3 TRP 103 HE3 TRP 103 24.098 31.932 18.933 750 HZ2 TRP 103 HZ2 TRP 103 25.110 31.937 23.800 751 HZ3 TRP 103 HZ3 TRP 103 23.699 29.900 20.293 752 HH2 TRP 103 HH2 TRP 103 24.202 29.898 22.719 753 H THR 104 HN THR 104 25.085 33.018 15.857 754 HA THR 104 HA THR 104 25.326 35.324 13.964 755 HB THR 104 HB THR 104 26.168 33.895 12.224 756 HG1 THR 104 HG1 THR 104 26.121 31.783 14.100 757 1HG2 THR 104 HG23 THR 104 27.842 34.794 13.774 758 2HG2 THR 104 HG22 THR 104 27.675 33.361 14.792 759 3HG2 THR 104 HG21 THR 104 28.334 33.215 13.163 760 H ASN 105 HN ASN 105 23.752 35.239 12.228 761 HA ASN 105 HA ASN 105 21.368 33.542 12.892 762 1HB ASN 105 HB2 ASN 105 21.579 36.236 11.516 763 2HB ASN 105 HB1 ASN 105 20.091 35.292 11.613 764 1HD2 ASN 105 HD22 ASN 105 20.270 37.678 14.529 765 2HD2 ASN 105 HD21 ASN 105 20.375 37.886 12.850 766 H ASN 106 HN ASN 106 23.704 32.781 11.262 767 HA ASN 106 HA ASN 106 22.229 32.073 8.765 768 1HB ASN 106 HB2 ASN 106 24.547 32.449 7.608 769 2HB ASN 106 HB1 ASN 106 23.537 33.856 7.952 770 1HD2 ASN 106 HD22 ASN 106 26.312 35.230 9.639 771 2HD2 ASN 106 HD21 ASN 106 25.215 35.384 8.354 772 H PHE 107 HN PHE 107 24.328 30.663 7.573 773 HA PHE 107 HA PHE 107 24.311 28.248 9.210 774 1HB PHE 107 HB2 PHE 107 25.543 28.866 6.516 775 2HB PHE 107 HB1 PHE 107 25.479 27.268 7.248 776 HD1 PHE 107 HD1 PHE 107 23.345 26.113 7.591 777 HD2 PHE 107 HD2 PHE 107 23.544 29.918 5.620 778 HE1 PHE 107 HE1 PHE 107 21.042 25.789 6.742 779 HE2 PHE 107 HE2 PHE 107 21.240 29.597 4.765 780 HZ PHE 107 HZ PHE 107 19.986 27.531 5.328 781 H ARG 108 HN ARG 108 26.186 30.844 9.599 782 HA ARG 108 HA ARG 108 28.859 29.919 9.407 783 1HB ARG 108 HB2 ARG 108 27.577 31.936 11.259 784 2HB ARG 108 HB1 ARG 108 29.318 31.652 11.212 785 1HG ARG 108 HG2 ARG 108 29.247 32.095 8.723 786 2HG ARG 108 HG1 ARG 108 27.573 32.596 8.921 787 1HD ARG 108 HD2 ARG 108 29.867 33.812 10.477 788 2HD ARG 108 HD1 ARG 108 29.260 34.483 8.959 789 HE ARG 108 HE ARG 108 26.987 34.313 10.490 790 1HH1 ARG 108 HH21 ARG 108 30.168 35.570 10.948 791 2HH1 ARG 108 HH22 ARG 108 29.660 36.835 12.016 792 1HH2 ARG 108 HH11 ARG 108 26.306 35.969 11.872 793 2HH2 ARG 108 HH12 ARG 108 27.470 37.060 12.538 794 H GLU 109 HN GLU 109 29.768 30.253 12.151 795 HA GLU 109 HA GLU 109 30.039 27.616 12.941 796 1HB GLU 109 HB2 GLU 109 30.024 30.102 14.659 797 2HB GLU 109 HB1 GLU 109 30.540 28.520 15.240 798 1HG GLU 109 HG2 GLU 109 32.234 28.411 13.449 799 2HG GLU 109 HG1 GLU 109 31.723 29.995 12.870 800 H TYR 110 HN TYR 110 27.700 29.838 14.577 801 HA TYR 110 HA TYR 110 25.952 27.434 15.031 802 1HB TYR 110 HB2 TYR 110 26.535 29.553 17.122 803 2HB TYR 110 HB1 TYR 110 25.556 28.101 17.329 804 HD1 TYR 110 HD2 TYR 110 26.643 25.835 17.254 805 HD2 TYR 110 HD1 TYR 110 28.915 29.482 17.239 806 HE1 TYR 110 HE2 TYR 110 28.686 24.569 17.873 807 HE2 TYR 110 HE1 TYR 110 30.955 28.215 17.856 808 HH TYR 110 HH TYR 110 30.899 25.102 19.033 809 H ASN 111 HN ASN 111 23.779 27.852 14.815 810 HA ASN 111 HA ASN 111 23.033 30.576 13.880 811 1HB ASN 111 HB2 ASN 111 22.350 28.459 12.635 812 2HB ASN 111 HB1 ASN 111 21.299 28.107 14.001 813 1HD2 ASN 111 HD22 ASN 111 19.294 30.025 11.500 814 2HD2 ASN 111 HD21 ASN 111 20.113 28.538 11.489 815 H LEU 112 HN LEU 112 22.126 31.968 15.321 816 HA LEU 112 HA LEU 112 21.647 31.327 18.029 817 1HB LEU 112 HB2 LEU 112 21.956 33.632 17.214 818 2HB LEU 112 HB1 LEU 112 20.412 33.546 16.372 819 HG LEU 112 HG LEU 112 19.246 33.233 18.530 820 1HD1 LEU 112 HD12 LEU 112 22.075 33.224 19.569 821 2HD1 LEU 112 HD11 LEU 112 20.769 33.809 20.599 822 3HD1 LEU 112 HD13 LEU 112 20.732 32.158 19.987 823 1HD2 LEU 112 HD22 LEU 112 21.129 35.596 18.340 824 2HD2 LEU 112 HD21 LEU 112 19.480 35.495 17.729 825 3HD2 LEU 112 HD23 LEU 112 19.775 35.515 19.465 826 H HIS 113 HN HIS 113 19.342 31.447 15.298 827 HA HIS 113 HA HIS 113 16.995 31.040 16.838 828 1HB HIS 113 HB2 HIS 113 16.970 31.642 14.428 829 2HB HIS 113 HB1 HIS 113 17.520 30.017 14.036 830 HD1 HIS 113 HD1 HIS 113 15.867 28.132 15.482 831 HD2 HIS 113 HD2 HIS 113 14.231 31.740 14.194 832 HE1 HIS 113 HE1 HIS 113 13.352 27.815 15.470 833 H ARG 114 HN ARG 114 19.226 28.634 15.414 834 HA ARG 114 HA ARG 114 17.700 26.333 16.066 835 1HB ARG 114 HB2 ARG 114 20.692 26.750 15.859 836 2HB ARG 114 HB1 ARG 114 19.967 25.164 16.090 837 1HG ARG 114 HG2 ARG 114 19.021 26.920 13.825 838 2HG ARG 114 HG1 ARG 114 20.513 25.997 13.651 839 1HD ARG 114 HD2 ARG 114 17.873 24.740 14.441 840 2HD ARG 114 HD1 ARG 114 18.472 24.811 12.790 841 HE ARG 114 HE ARG 114 20.566 23.698 14.259 842 1HH1 ARG 114 HH21 ARG 114 17.221 23.077 13.746 843 2HH1 ARG 114 HH22 ARG 114 17.373 21.361 13.923 844 1HH2 ARG 114 HH11 ARG 114 20.795 21.461 14.491 845 2HH2 ARG 114 HH12 ARG 114 19.400 20.443 14.343 846 H VAL 115 HN VAL 115 20.220 27.985 18.002 847 HA VAL 115 HA VAL 115 19.914 26.189 20.250 848 HB VAL 115 HB VAL 115 21.073 28.986 20.042 849 1HG1 VAL 115 HG13 VAL 115 20.890 27.052 22.354 850 2HG1 VAL 115 HG12 VAL 115 22.214 28.214 22.251 851 3HG1 VAL 115 HG11 VAL 115 20.544 28.782 22.331 852 1HG2 VAL 115 HG23 VAL 115 22.208 26.185 19.912 853 2HG2 VAL 115 HG22 VAL 115 22.461 27.530 18.805 854 3HG2 VAL 115 HG21 VAL 115 23.220 27.546 20.396 855 H ALA 116 HN ALA 116 18.555 29.388 19.454 856 HA ALA 116 HA ALA 116 17.221 29.871 21.893 857 1HB ALA 116 HB1 ALA 116 16.335 30.564 19.076 858 2HB ALA 116 HB3 ALA 116 15.660 31.265 20.548 859 3HB ALA 116 HB2 ALA 116 17.348 31.559 20.121 860 H ALA 117 HN ALA 117 16.101 28.028 19.032 861 HA ALA 117 HA ALA 117 13.497 27.417 19.996 862 1HB ALA 117 HB2 ALA 117 15.375 25.822 18.228 863 2HB ALA 117 HB1 ALA 117 13.696 25.373 18.519 864 3HB ALA 117 HB3 ALA 117 14.074 26.889 17.707 865 H HIS 118 HN HIS 118 16.593 25.723 20.461 866 HA HIS 118 HA HIS 118 15.570 23.511 21.922 867 1HB HIS 118 HB2 HIS 118 17.865 23.620 21.030 868 2HB HIS 118 HB1 HIS 118 18.259 24.882 22.201 869 HD1 HIS 118 HD1 HIS 118 17.719 21.211 21.871 870 HD2 HIS 118 HD2 HIS 118 18.419 23.958 24.925 871 HE1 HIS 118 HE1 HIS 118 18.328 19.860 23.922 872 H GLU 119 HN GLU 119 16.814 26.659 23.147 873 HA GLU 119 HA GLU 119 16.400 26.031 25.906 874 1HB GLU 119 HB2 GLU 119 16.428 28.697 24.458 875 2HB GLU 119 HB1 GLU 119 16.360 28.537 26.217 876 1HG GLU 119 HG2 GLU 119 18.478 27.287 26.204 877 2HG GLU 119 HG1 GLU 119 18.548 27.396 24.447 878 H LEU 120 HN LEU 120 14.256 27.491 23.462 879 HA LEU 120 HA LEU 120 12.104 28.082 25.255 880 1HB LEU 120 HB2 LEU 120 12.056 27.411 22.295 881 2HB LEU 120 HB1 LEU 120 10.673 28.028 23.194 882 HG LEU 120 HG LEU 120 13.337 29.474 23.010 883 1HD1 LEU 120 HD13 LEU 120 10.799 29.814 21.388 884 2HD1 LEU 120 HD12 LEU 120 12.131 30.971 21.400 885 3HD1 LEU 120 HD11 LEU 120 12.385 29.337 20.788 886 1HD2 LEU 120 HD23 LEU 120 10.619 30.134 24.158 887 2HD2 LEU 120 HD22 LEU 120 12.210 30.349 24.887 888 3HD2 LEU 120 HD21 LEU 120 11.681 31.429 23.601 889 H GLY 121 HN GLY 121 12.937 25.159 23.404 890 1HA GLY 121 HA2 GLY 121 10.615 23.639 23.904 891 2HA GLY 121 HA1 GLY 121 12.226 22.939 23.755 892 H HIS 122 HN HIS 122 13.443 24.232 25.986 893 HA HIS 122 HA HIS 122 12.601 22.474 28.100 894 1HB HIS 122 HB2 HIS 122 14.413 24.896 28.028 895 2HB HIS 122 HB1 HIS 122 14.116 23.991 29.511 896 HD1 HIS 122 HD1 HIS 122 14.617 21.317 29.310 897 HD2 HIS 122 HD2 HIS 122 16.375 23.749 26.416 898 HE1 HIS 122 HE1 HIS 122 16.472 19.953 28.260 899 H SER 123 HN SER 123 11.967 25.910 27.436 900 HA SER 123 HA SER 123 10.562 26.424 29.890 901 1HB SER 123 HB2 SER 123 9.753 28.424 28.785 902 2HB SER 123 HB1 SER 123 11.428 28.177 28.310 903 HG SER 123 HG SER 123 10.151 26.830 26.565 904 H LEU 124 HN LEU 124 9.683 24.805 26.942 905 HA LEU 124 HA LEU 124 6.788 24.964 27.493 906 1HB LEU 124 HB2 LEU 124 8.374 23.464 25.391 907 2HB LEU 124 HB1 LEU 124 6.615 23.481 25.484 908 HG LEU 124 HG LEU 124 8.294 25.999 25.270 909 1HD1 LEU 124 HD13 LEU 124 8.557 24.501 23.279 910 2HD1 LEU 124 HD12 LEU 124 6.811 24.552 23.055 911 3HD1 LEU 124 HD11 LEU 124 7.765 26.027 22.899 912 1HD2 LEU 124 HD22 LEU 124 5.337 25.379 25.202 913 2HD2 LEU 124 HD21 LEU 124 6.182 26.659 26.070 914 3HD2 LEU 124 HD23 LEU 124 5.954 26.778 24.329 915 H GLY 125 HN GLY 125 9.341 23.207 28.678 916 1HA GLY 125 HA2 GLY 125 9.131 21.504 30.349 917 2HA GLY 125 HA1 GLY 125 7.501 21.159 29.770 918 H LEU 126 HN LEU 126 9.571 21.388 27.119 919 HA LEU 126 HA LEU 126 9.427 18.501 26.688 920 1HB LEU 126 HB2 LEU 126 10.932 20.614 25.115 921 2HB LEU 126 HB1 LEU 126 10.582 18.974 24.577 922 HG LEU 126 HG LEU 126 8.507 21.084 25.244 923 1HD1 LEU 126 HD12 LEU 126 9.854 21.444 23.143 924 2HD1 LEU 126 HD11 LEU 126 9.254 19.891 22.561 925 3HD1 LEU 126 HD13 LEU 126 8.128 21.215 22.863 926 1HD2 LEU 126 HD23 LEU 126 8.351 18.174 24.449 927 2HD2 LEU 126 HD22 LEU 126 7.427 19.042 25.676 928 3HD2 LEU 126 HD21 LEU 126 7.063 19.283 23.969 929 H SER 127 HN SER 127 11.090 17.019 26.916 930 HA SER 127 HA SER 127 13.577 18.015 28.258 931 1HB SER 127 HB2 SER 127 12.385 15.229 28.173 932 2HB SER 127 HB1 SER 127 13.812 15.718 29.085 933 HG SER 127 HG SER 127 12.111 15.842 30.478 934 H HIS 128 HN HIS 128 15.452 16.306 27.804 935 HA HIS 128 HA HIS 128 16.057 16.549 24.975 936 1HB HIS 128 HB2 HIS 128 17.501 15.063 27.192 937 2HB HIS 128 HB1 HIS 128 18.148 15.344 25.577 938 HD1 HIS 128 HD1 HIS 128 19.291 16.519 28.357 939 HD2 HIS 128 HD2 HIS 128 17.070 18.608 25.510 940 HE1 HIS 128 HE1 HIS 128 19.800 18.970 28.713 941 H SER 129 HN SER 129 16.830 14.518 23.751 942 HA SER 129 HA SER 129 15.395 12.038 24.503 943 1HB SER 129 HB2 SER 129 13.804 13.489 23.153 944 2HB SER 129 HB1 SER 129 14.931 13.347 21.808 945 HG SER 129 HG SER 129 14.295 11.362 21.508 946 H THR 130 HN THR 130 15.922 10.292 22.797 947 HA THR 130 HA THR 130 18.810 10.544 22.100 948 HB THR 130 HB THR 130 18.730 8.089 21.880 949 HG1 THR 130 HG1 THR 130 16.881 7.040 21.917 950 1HG2 THR 130 HG21 THR 130 17.579 9.317 24.389 951 2HG2 THR 130 HG23 THR 130 18.007 7.608 24.291 952 3HG2 THR 130 HG22 THR 130 19.248 8.840 24.073 953 H ASP 131 HN ASP 131 16.003 11.204 20.603 954 HA ASP 131 HA ASP 131 16.486 9.809 18.061 955 1HB ASP 131 HB2 ASP 131 14.188 10.314 18.862 956 2HB ASP 131 HB1 ASP 131 14.542 12.035 18.749 957 H ILE 132 HN ILE 132 18.105 10.544 16.761 958 HA ILE 132 HA ILE 132 19.411 13.059 17.009 959 HB ILE 132 HB ILE 132 20.367 11.082 15.824 960 1HG1 ILE 132 HG12 ILE 132 20.165 13.467 13.964 961 2HG1 ILE 132 HG11 ILE 132 21.124 13.497 15.445 962 1HG2 ILE 132 HG23 ILE 132 18.163 10.582 14.626 963 2HG2 ILE 132 HG22 ILE 132 18.580 11.890 13.520 964 3HG2 ILE 132 HG21 ILE 132 19.617 10.471 13.637 965 1HD1 ILE 132 HD11 ILE 132 21.465 11.352 13.339 966 2HD1 ILE 132 HD13 ILE 132 22.384 12.858 13.311 967 3HD1 ILE 132 HD12 ILE 132 22.551 11.744 14.670 968 H GLY 133 HN GLY 133 16.614 12.093 15.098 969 1HA GLY 133 HA2 GLY 133 16.558 14.491 13.478 970 2HA GLY 133 HA1 GLY 133 15.245 13.332 13.640 971 H ALA 134 HN ALA 134 16.182 14.270 16.712 972 HA ALA 134 HA ALA 134 13.859 16.129 16.895 973 1HB ALA 134 HB1 ALA 134 15.496 14.665 18.978 974 2HB ALA 134 HB3 ALA 134 14.273 15.865 19.386 975 3HB ALA 134 HB2 ALA 134 13.810 14.383 18.545 976 H LEU 135 HN LEU 135 14.113 18.265 17.550 977 HA LEU 135 HA LEU 135 16.696 19.495 17.130 978 1HB LEU 135 HB2 LEU 135 14.151 20.592 18.363 979 2HB LEU 135 HB1 LEU 135 15.555 21.565 17.945 980 HG LEU 135 HG LEU 135 14.041 19.861 15.945 981 1HD1 LEU 135 HD11 LEU 135 13.793 22.803 16.632 982 2HD1 LEU 135 HD13 LEU 135 13.104 22.067 15.185 983 3HD1 LEU 135 HD12 LEU 135 12.539 21.570 16.780 984 1HD2 LEU 135 HD22 LEU 135 16.284 21.881 15.771 985 2HD2 LEU 135 HD21 LEU 135 16.171 20.293 15.022 986 3HD2 LEU 135 HD23 LEU 135 15.212 21.630 14.398 987 H MET 136 HN MET 136 14.971 18.315 19.951 988 HA MET 136 HA MET 136 16.561 19.755 21.897 989 1HB MET 136 HB2 MET 136 15.034 17.161 22.286 990 2HB MET 136 HB1 MET 136 15.537 18.293 23.541 991 1HG MET 136 HG2 MET 136 13.596 18.924 21.299 992 2HG MET 136 HG1 MET 136 13.148 18.592 22.971 993 1HE MET 136 HE3 MET 136 14.017 19.644 24.874 994 2HE MET 136 HE2 MET 136 15.606 20.373 24.651 995 3HE MET 136 HE1 MET 136 14.226 21.392 25.053 996 H TYR 137 HN TYR 137 17.601 17.605 19.708 997 HA TYR 137 HA TYR 137 19.019 15.654 21.208 998 1HB TYR 137 HB2 TYR 137 18.585 15.756 18.674 999 2HB TYR 137 HB1 TYR 137 20.006 16.791 18.598 1000 HD1 TYR 137 HD2 TYR 137 18.952 13.564 20.227 1001 HD2 TYR 137 HD1 TYR 137 22.038 15.725 18.170 1002 HE1 TYR 137 HE2 TYR 137 20.405 11.560 20.300 1003 HE2 TYR 137 HE1 TYR 137 23.491 13.720 18.243 1004 HH TYR 137 HH TYR 137 23.480 11.508 20.031 1005 HA PRO 138 HA PRO 138 21.943 18.685 22.929 1006 1HB PRO 138 HB2 PRO 138 23.511 16.673 24.241 1007 2HB PRO 138 HB1 PRO 138 22.253 17.687 24.959 1008 1HG PRO 138 HG2 PRO 138 22.128 14.842 24.311 1009 2HG PRO 138 HG1 PRO 138 20.945 15.823 25.190 1010 1HD PRO 138 HD2 PRO 138 20.728 14.830 22.496 1011 2HD PRO 138 HD1 PRO 138 19.580 15.878 23.365 1012 H SER 139 HN SER 139 22.381 18.215 20.294 1013 HA SER 139 HA SER 139 25.310 18.131 20.158 1014 1HB SER 139 HB2 SER 139 25.586 16.078 19.204 1015 2HB SER 139 HB1 SER 139 23.918 15.737 19.651 1016 HG SER 139 HG SER 139 23.509 17.006 17.572 1017 H TYR 140 HN TYR 140 25.665 19.978 19.034 1018 HA TYR 140 HA TYR 140 23.709 21.145 17.265 1019 1HB TYR 140 HB2 TYR 140 25.422 22.487 18.478 1020 2HB TYR 140 HB1 TYR 140 26.678 21.744 17.482 1021 HD1 TYR 140 HD1 TYR 140 26.879 22.259 15.105 1022 HD2 TYR 140 HD2 TYR 140 23.830 24.080 17.519 1023 HE1 TYR 140 HE1 TYR 140 26.448 23.914 13.310 1024 HE2 TYR 140 HE2 TYR 140 23.399 25.743 15.725 1025 HH TYR 140 HH TYR 140 24.257 25.385 12.662 1026 H THR 141 HN THR 141 23.584 21.026 15.007 1027 HA THR 141 HA THR 141 25.726 19.625 13.517 1028 HB THR 141 HB THR 141 24.204 18.000 12.522 1029 HG1 THR 141 HG1 THR 141 22.067 17.903 13.202 1030 1HG2 THR 141 HG22 THR 141 25.309 17.470 14.721 1031 2HG2 THR 141 HG21 THR 141 23.817 17.956 15.522 1032 3HG2 THR 141 HG23 THR 141 23.819 16.575 14.431 1033 H PHE 142 HN PHE 142 25.364 19.828 11.145 1034 HA PHE 142 HA PHE 142 24.414 22.496 10.493 1035 1HB PHE 142 HB2 PHE 142 26.355 21.239 9.404 1036 2HB PHE 142 HB1 PHE 142 25.138 20.293 8.548 1037 HD1 PHE 142 HD2 PHE 142 23.551 21.424 6.979 1038 HD2 PHE 142 HD1 PHE 142 26.836 23.497 8.805 1039 HE1 PHE 142 HE2 PHE 142 23.342 23.240 5.299 1040 HE2 PHE 142 HE1 PHE 142 26.635 25.299 7.130 1041 HZ PHE 142 HZ PHE 142 24.884 25.181 5.377 1042 H SER 143 HN SER 143 22.315 22.974 10.112 1043 HA SER 143 HA SER 143 20.512 20.835 9.009 1044 1HB SER 143 HB2 SER 143 19.911 21.388 11.310 1045 2HB SER 143 HB1 SER 143 19.886 23.105 10.921 1046 HG SER 143 HG SER 143 18.197 21.053 9.923 1047 H GLY 144 HN GLY 144 19.447 21.355 7.138 1048 1HA GLY 144 HA2 GLY 144 20.112 23.829 5.771 1049 2HA GLY 144 HA1 GLY 144 18.986 22.603 5.187 1050 H ASP 145 HN ASP 145 16.773 22.671 5.967 1051 HA ASP 145 HA ASP 145 15.915 25.424 6.657 1052 1HB ASP 145 HB2 ASP 145 13.669 24.638 6.126 1053 2HB ASP 145 HB1 ASP 145 14.766 24.141 4.840 1054 H VAL 146 HN VAL 146 14.692 25.881 8.562 1055 HA VAL 146 HA VAL 146 15.134 23.928 10.775 1056 HB VAL 146 HB VAL 146 14.267 26.834 10.845 1057 1HG1 VAL 146 HG12 VAL 146 15.049 24.851 13.000 1058 2HG1 VAL 146 HG11 VAL 146 14.989 26.593 13.266 1059 3HG1 VAL 146 HG13 VAL 146 13.518 25.716 12.844 1060 1HG2 VAL 146 HG21 VAL 146 16.947 25.455 11.119 1061 2HG2 VAL 146 HG23 VAL 146 16.508 26.767 10.026 1062 3HG2 VAL 146 HG22 VAL 146 16.660 27.075 11.754 1063 H GLN 147 HN GLN 147 13.462 22.554 11.053 1064 HA GLN 147 HA GLN 147 10.686 23.666 11.146 1065 1HB GLN 147 HB2 GLN 147 11.608 21.213 9.624 1066 2HB GLN 147 HB1 GLN 147 9.918 21.578 9.963 1067 1HG GLN 147 HG2 GLN 147 11.777 23.470 8.499 1068 2HG GLN 147 HG1 GLN 147 10.709 22.330 7.688 1069 1HE2 GLN 147 HE22 GLN 147 9.095 25.775 8.380 1070 2HE2 GLN 147 HE21 GLN 147 10.686 25.420 7.901 1071 H LEU 148 HN LEU 148 9.229 22.324 12.435 1072 HA LEU 148 HA LEU 148 10.591 21.068 14.694 1073 1HB LEU 148 HB2 LEU 148 7.634 21.228 14.031 1074 2HB LEU 148 HB1 LEU 148 8.305 20.716 15.576 1075 HG LEU 148 HG LEU 148 8.764 23.444 14.325 1076 1HD1 LEU 148 HD11 LEU 148 6.850 22.506 16.481 1077 2HD1 LEU 148 HD13 LEU 148 7.232 24.204 16.184 1078 3HD1 LEU 148 HD12 LEU 148 6.434 23.248 14.934 1079 1HD2 LEU 148 HD21 LEU 148 9.594 22.132 16.919 1080 2HD2 LEU 148 HD23 LEU 148 10.569 23.085 15.800 1081 3HD2 LEU 148 HD22 LEU 148 9.393 23.883 16.837 1082 H ALA 149 HN ALA 149 10.159 18.836 15.375 1083 HA ALA 149 HA ALA 149 9.895 16.995 13.028 1084 1HB ALA 149 HB3 ALA 149 11.134 16.697 15.776 1085 2HB ALA 149 HB2 ALA 149 10.900 15.330 14.690 1086 3HB ALA 149 HB1 ALA 149 11.955 16.665 14.216 1087 H GLN 150 HN GLN 150 8.642 14.985 13.378 1088 HA GLN 150 HA GLN 150 6.051 15.449 14.461 1089 1HB GLN 150 HB2 GLN 150 6.499 13.735 12.750 1090 2HB GLN 150 HB1 GLN 150 7.451 12.809 13.909 1091 1HG GLN 150 HG2 GLN 150 5.460 12.527 15.336 1092 2HG GLN 150 HG1 GLN 150 4.503 13.484 14.199 1093 1HE2 GLN 150 HE22 GLN 150 4.006 9.872 13.371 1094 2HE2 GLN 150 HE21 GLN 150 3.706 10.841 14.732 1095 H ASP 151 HN ASP 151 8.909 13.846 15.829 1096 HA ASP 151 HA ASP 151 7.737 12.822 18.192 1097 1HB ASP 151 HB2 ASP 151 10.122 12.482 17.340 1098 2HB ASP 151 HB1 ASP 151 10.499 14.053 18.044 1099 H ASP 152 HN ASP 152 8.993 16.078 17.485 1100 HA ASP 152 HA ASP 152 8.519 17.026 20.197 1101 1HB ASP 152 HB2 ASP 152 9.108 18.450 17.591 1102 2HB ASP 152 HB1 ASP 152 8.959 19.277 19.144 1103 H ILE 153 HN ILE 153 6.829 17.320 17.077 1104 HA ILE 153 HA ILE 153 4.790 19.106 17.958 1105 HB ILE 153 HB ILE 153 4.735 16.940 15.837 1106 1HG1 ILE 153 HG12 ILE 153 5.030 19.945 15.555 1107 2HG1 ILE 153 HG11 ILE 153 6.408 18.847 15.644 1108 1HG2 ILE 153 HG23 ILE 153 2.754 19.091 16.598 1109 2HG2 ILE 153 HG22 ILE 153 2.854 18.503 14.937 1110 3HG2 ILE 153 HG21 ILE 153 2.456 17.389 16.243 1111 1HD1 ILE 153 HD12 ILE 153 5.431 17.584 13.691 1112 2HD1 ILE 153 HD11 ILE 153 4.228 18.866 13.536 1113 3HD1 ILE 153 HD13 ILE 153 5.938 19.224 13.302 1114 H ASP 154 HN ASP 154 4.775 15.530 17.788 1115 HA ASP 154 HA ASP 154 2.192 15.191 18.960 1116 1HB ASP 154 HB2 ASP 154 4.627 13.393 18.911 1117 2HB ASP 154 HB1 ASP 154 3.065 12.887 19.546 1118 H GLY 155 HN GLY 155 5.428 15.437 20.397 1119 1HA GLY 155 HA2 GLY 155 4.763 14.794 23.070 1120 2HA GLY 155 HA1 GLY 155 6.089 15.852 22.603 1121 H ILE 156 HN ILE 156 5.013 18.097 21.668 1122 HA ILE 156 HA ILE 156 3.891 19.341 24.013 1123 HB ILE 156 HB ILE 156 5.347 20.471 22.282 1124 1HG1 ILE 156 HG12 ILE 156 3.990 22.616 22.328 1125 2HG1 ILE 156 HG11 ILE 156 2.675 21.691 23.041 1126 1HG2 ILE 156 HG21 ILE 156 4.073 19.546 20.322 1127 2HG2 ILE 156 HG23 ILE 156 2.760 20.658 20.711 1128 3HG2 ILE 156 HG22 ILE 156 4.343 21.283 20.249 1129 1HD1 ILE 156 HD13 ILE 156 5.353 21.456 24.356 1130 2HD1 ILE 156 HD12 ILE 156 4.489 22.981 24.538 1131 3HD1 ILE 156 HD11 ILE 156 3.738 21.478 25.070 1132 H GLN 157 HN GLN 157 2.469 18.304 20.909 1133 HA GLN 157 HA GLN 157 -0.127 19.421 21.425 1134 1HB GLN 157 HB2 GLN 157 0.789 17.131 19.670 1135 2HB GLN 157 HB1 GLN 157 -0.894 17.659 19.742 1136 1HG GLN 157 HG2 GLN 157 -0.226 19.927 19.062 1137 2HG GLN 157 HG1 GLN 157 1.465 19.425 19.016 1138 1HE2 GLN 157 HE22 GLN 157 -0.101 19.138 15.571 1139 2HE2 GLN 157 HE21 GLN 157 -0.037 20.411 16.694 1140 H ALA 158 HN ALA 158 1.329 16.267 22.171 1141 HA ALA 158 HA ALA 158 -1.027 15.017 23.177 1142 1HB ALA 158 HB3 ALA 158 1.860 14.655 24.052 1143 2HB ALA 158 HB2 ALA 158 0.540 13.551 24.432 1144 3HB ALA 158 HB1 ALA 158 1.055 13.768 22.760 1145 H ILE 159 HN ILE 159 1.378 17.121 24.754 1146 HA ILE 159 HA ILE 159 0.228 16.925 27.386 1147 HB ILE 159 HB ILE 159 1.926 19.092 26.111 1148 1HG1 ILE 159 HG12 ILE 159 2.679 16.897 28.063 1149 2HG1 ILE 159 HG11 ILE 159 2.859 16.736 26.314 1150 1HG2 ILE 159 HG22 ILE 159 1.111 18.601 28.990 1151 2HG2 ILE 159 HG21 ILE 159 2.433 19.666 28.520 1152 3HG2 ILE 159 HG23 ILE 159 0.785 20.040 28.029 1153 1HD1 ILE 159 HD12 ILE 159 4.246 18.846 26.355 1154 2HD1 ILE 159 HD11 ILE 159 4.208 18.761 28.114 1155 3HD1 ILE 159 HD13 ILE 159 4.977 17.474 27.187 1156 H TYR 160 HN TYR 160 -0.138 19.391 24.796 1157 HA TYR 160 HA TYR 160 -2.410 20.575 26.319 1158 1HB TYR 160 HB2 TYR 160 -0.863 21.494 23.888 1159 2HB TYR 160 HB1 TYR 160 -2.324 22.306 24.459 1160 HD1 TYR 160 HD2 TYR 160 -2.382 23.358 26.707 1161 HD2 TYR 160 HD1 TYR 160 1.224 21.692 25.074 1162 HE1 TYR 160 HE2 TYR 160 -1.049 24.589 28.395 1163 HE2 TYR 160 HE1 TYR 160 2.562 22.930 26.759 1164 HH TYR 160 HH TYR 160 1.583 25.457 28.373 1165 H GLY 161 HN GLY 161 -1.841 19.818 22.853 1166 1HA GLY 161 HA2 GLY 161 -3.769 17.955 22.343 1167 2HA GLY 161 HA1 GLY 161 -4.732 19.425 22.499 1168 H ARG 162 HN ARG 162 -5.105 18.600 20.145 1169 HA ARG 162 HA ARG 162 -2.975 19.375 18.259 1170 1HB ARG 162 HB2 ARG 162 -5.777 18.290 17.890 1171 2HB ARG 162 HB1 ARG 162 -4.700 18.693 16.551 1172 1HG ARG 162 HG2 ARG 162 -3.018 17.110 17.420 1173 2HG ARG 162 HG1 ARG 162 -4.096 16.702 18.759 1174 1HD ARG 162 HD2 ARG 162 -4.272 15.039 16.948 1175 2HD ARG 162 HD1 ARG 162 -5.791 15.911 17.155 1176 HE ARG 162 HE ARG 162 -4.478 17.375 15.219 1177 1HH1 ARG 162 HH21 ARG 162 -5.264 14.060 15.705 1178 2HH1 ARG 162 HH22 ARG 162 -5.423 13.711 14.018 1179 1HH2 ARG 162 HH11 ARG 162 -4.686 16.950 13.020 1180 2HH2 ARG 162 HH12 ARG 162 -5.094 15.353 12.491 1181 H SER 163 HN SER 163 -3.133 21.120 16.841 1182 HA SER 163 HA SER 163 -4.670 23.399 17.811 1183 1HB SER 163 HB2 SER 163 -3.127 23.252 15.219 1184 2HB SER 163 HB1 SER 163 -3.437 24.666 16.225 1185 HG SER 163 HG SER 163 -1.718 22.467 16.692 1186 H GLN 164 HN GLN 164 -6.645 21.685 17.225 1187 HA GLN 164 HA GLN 164 -7.527 21.805 14.454 1188 1HB GLN 164 HB2 GLN 164 -8.940 21.040 17.022 1189 2HB GLN 164 HB1 GLN 164 -9.718 20.985 15.440 1190 1HG GLN 164 HG2 GLN 164 -7.975 19.447 14.628 1191 2HG GLN 164 HG1 GLN 164 -7.191 19.496 16.208 1192 1HE2 GLN 164 HE22 GLN 164 -10.629 18.014 17.325 1193 2HE2 GLN 164 HE21 GLN 164 -10.177 19.650 17.302 1194 H ASN 165 HN ASN 165 -8.862 23.323 13.505 1195 HA ASN 165 HA ASN 165 -10.343 25.228 15.207 1196 1HB ASN 165 HB2 ASN 165 -8.132 26.107 13.335 1197 2HB ASN 165 HB1 ASN 165 -9.309 27.196 14.073 1198 1HD2 ASN 165 HD22 ASN 165 -6.083 26.190 16.188 1199 2HD2 ASN 165 HD21 ASN 165 -6.222 25.993 14.509 1200 HA PRO 166 HA PRO 166 -12.211 24.130 11.060 1201 1HB PRO 166 HB2 PRO 166 -14.678 23.414 12.358 1202 2HB PRO 166 HB1 PRO 166 -13.530 22.324 11.578 1203 1HG PRO 166 HG2 PRO 166 -14.028 22.649 14.427 1204 2HG PRO 166 HG1 PRO 166 -12.951 21.490 13.631 1205 1HD PRO 166 HD2 PRO 166 -12.204 23.859 15.116 1206 2HD PRO 166 HD1 PRO 166 -11.130 22.699 14.310 1207 H VAL 167 HN VAL 167 -11.838 26.664 12.302 1208 HA VAL 167 HA VAL 167 -14.472 27.967 12.529 1209 HB VAL 167 HB VAL 167 -11.774 29.337 12.425 1210 1HG1 VAL 167 HG11 VAL 167 -14.038 30.588 12.357 1211 2HG1 VAL 167 HG13 VAL 167 -14.224 30.077 14.036 1212 3HG1 VAL 167 HG12 VAL 167 -12.865 31.101 13.573 1213 1HG2 VAL 167 HG23 VAL 167 -11.673 27.509 14.100 1214 2HG2 VAL 167 HG22 VAL 167 -11.681 29.088 14.879 1215 3HG2 VAL 167 HG21 VAL 167 -13.154 28.116 14.843 1216 H GLN 168 HN GLN 168 -15.316 29.424 10.994 1217 HA GLN 168 HA GLN 168 -13.879 29.598 8.362 1218 1HB GLN 168 HB2 GLN 168 -16.787 29.020 8.943 1219 2HB GLN 168 HB1 GLN 168 -16.220 29.559 7.360 1220 1HG GLN 168 HG2 GLN 168 -14.760 27.632 7.160 1221 2HG GLN 168 HG1 GLN 168 -15.142 27.125 8.808 1222 1HE2 GLN 168 HE22 GLN 168 -17.406 25.047 6.850 1223 2HE2 GLN 168 HE21 GLN 168 -15.781 25.098 7.341 1224 HA PRO 169 HA PRO 169 -15.012 33.799 10.011 1225 1HB PRO 169 HB2 PRO 169 -12.577 34.825 8.812 1226 2HB PRO 169 HB1 PRO 169 -12.964 34.685 10.533 1227 1HG PRO 169 HG2 PRO 169 -11.087 33.090 9.044 1228 2HG PRO 169 HG1 PRO 169 -11.540 32.904 10.745 1229 1HD PRO 169 HD2 PRO 169 -12.292 31.224 8.483 1230 2HD PRO 169 HD1 PRO 169 -12.635 30.957 10.205 No H/Q in entry = 1230 Start of MODEL 6 1 1H VAL 1 HT1 VAL 1 -2.393 23.855 39.453 2 2H VAL 1 HT3 VAL 1 -3.556 23.282 40.546 3 3H VAL 1 HT2 VAL 1 -2.873 24.822 40.766 4 HA VAL 1 HA VAL 1 -1.324 23.950 42.056 5 HB VAL 1 HB VAL 1 -3.027 22.169 42.480 6 1HG1 VAL 1 HG12 VAL 1 -2.962 21.387 40.043 7 2HG1 VAL 1 HG11 VAL 1 -1.477 20.534 40.463 8 3HG1 VAL 1 HG13 VAL 1 -2.992 20.116 41.265 9 1HG2 VAL 1 HG23 VAL 1 -0.756 22.192 43.575 10 2HG2 VAL 1 HG22 VAL 1 -1.461 20.581 43.440 11 3HG2 VAL 1 HG21 VAL 1 -0.197 21.087 42.320 12 H LEU 2 HN LEU 2 0.860 23.736 41.718 13 HA LEU 2 HA LEU 2 1.873 23.409 39.044 14 1HB LEU 2 HB2 LEU 2 3.338 23.231 41.697 15 2HB LEU 2 HB1 LEU 2 4.097 23.441 40.122 16 HG LEU 2 HG LEU 2 2.082 25.376 41.308 17 1HD1 LEU 2 HD13 LEU 2 5.112 25.485 41.225 18 2HD1 LEU 2 HD12 LEU 2 4.072 26.829 41.697 19 3HD1 LEU 2 HD11 LEU 2 4.107 25.357 42.669 20 1HD2 LEU 2 HD21 LEU 2 3.781 25.336 38.807 21 2HD2 LEU 2 HD23 LEU 2 2.066 25.710 38.970 22 3HD2 LEU 2 HD22 LEU 2 3.273 26.869 39.516 23 H THR 3 HN THR 3 2.750 21.587 38.047 24 HA THR 3 HA THR 3 2.271 18.988 39.431 25 HB THR 3 HB THR 3 2.216 17.996 37.300 26 HG1 THR 3 HG1 THR 3 4.160 19.682 36.817 27 1HG2 THR 3 HG22 THR 3 0.412 19.781 37.763 28 2HG2 THR 3 HG21 THR 3 1.292 20.782 36.607 29 3HG2 THR 3 HG23 THR 3 0.605 19.239 36.096 30 H GLU 4 HN GLU 4 3.955 17.883 40.258 31 HA GLU 4 HA GLU 4 6.650 18.907 40.102 32 1HB GLU 4 HB2 GLU 4 5.784 17.700 42.078 33 2HB GLU 4 HB1 GLU 4 5.626 16.235 41.112 34 1HG GLU 4 HG2 GLU 4 8.064 16.238 40.700 35 2HG GLU 4 HG1 GLU 4 8.221 17.707 41.668 36 H GLY 5 HN GLY 5 8.368 18.195 38.864 37 1HA GLY 5 HA2 GLY 5 9.566 16.774 37.383 38 2HA GLY 5 HA1 GLY 5 8.142 15.746 37.248 39 H ASN 6 HN ASN 6 6.434 18.177 36.599 40 HA ASN 6 HA ASN 6 7.548 19.171 34.075 41 1HB ASN 6 HB2 ASN 6 5.386 17.064 34.136 42 2HB ASN 6 HB1 ASN 6 5.554 18.175 32.776 43 1HD2 ASN 6 HD22 ASN 6 8.483 16.619 31.512 44 2HD2 ASN 6 HD21 ASN 6 7.463 17.972 31.416 45 HA PRO 7 HA PRO 7 4.241 21.678 36.272 46 1HB PRO 7 HB2 PRO 7 5.982 23.984 36.075 47 2HB PRO 7 HB1 PRO 7 5.456 23.145 37.541 48 1HG PRO 7 HG2 PRO 7 8.084 23.095 36.338 49 2HG PRO 7 HG1 PRO 7 7.548 22.251 37.797 50 1HD PRO 7 HD2 PRO 7 8.107 21.109 35.190 51 2HD PRO 7 HD1 PRO 7 7.606 20.258 36.665 52 H ARG 8 HN ARG 8 2.790 21.993 34.626 53 HA ARG 8 HA ARG 8 3.679 23.161 32.047 54 1HB ARG 8 HB2 ARG 8 1.051 21.984 33.001 55 2HB ARG 8 HB1 ARG 8 1.292 22.659 31.389 56 1HG ARG 8 HG2 ARG 8 3.075 21.042 30.945 57 2HG ARG 8 HG1 ARG 8 2.923 20.396 32.580 58 1HD ARG 8 HD2 ARG 8 0.588 19.738 32.101 59 2HD ARG 8 HD1 ARG 8 0.757 20.361 30.458 60 HE ARG 8 HE ARG 8 2.833 18.556 30.662 61 1HH1 ARG 8 HH21 ARG 8 -0.559 18.515 31.282 62 2HH1 ARG 8 HH22 ARG 8 -0.747 16.840 30.886 63 1HH2 ARG 8 HH11 ARG 8 2.607 16.365 30.143 64 2HH2 ARG 8 HH12 ARG 8 1.046 15.621 30.243 65 H TRP 9 HN TRP 9 2.821 25.161 31.257 66 HA TRP 9 HA TRP 9 2.241 27.141 33.267 67 1HB TRP 9 HB2 TRP 9 1.968 27.176 30.249 68 2HB TRP 9 HB1 TRP 9 1.672 28.588 31.263 69 HD1 TRP 9 HD1 TRP 9 4.391 26.675 29.607 70 HE1 TRP 9 HE1 TRP 9 6.691 27.642 30.260 71 HE3 TRP 9 HE3 TRP 9 2.999 29.734 33.449 72 HZ2 TRP 9 HZ2 TRP 9 7.798 29.477 32.167 73 HZ3 TRP 9 HZ3 TRP 9 4.690 31.075 34.667 74 HH2 TRP 9 HH2 TRP 9 7.083 30.949 34.032 75 H GLU 10 HN GLU 10 0.279 27.854 34.030 76 HA GLU 10 HA GLU 10 -2.072 26.238 33.495 77 1HB GLU 10 HB2 GLU 10 -1.684 28.779 35.099 78 2HB GLU 10 HB1 GLU 10 -3.193 27.868 35.045 79 1HG GLU 10 HG2 GLU 10 -2.019 25.869 35.897 80 2HG GLU 10 HG1 GLU 10 -0.512 26.785 35.958 81 H GLN 11 HN GLN 11 -0.980 29.459 32.501 82 HA GLN 11 HA GLN 11 -3.546 30.079 31.219 83 1HB GLN 11 HB2 GLN 11 -0.852 31.465 31.227 84 2HB GLN 11 HB1 GLN 11 -2.254 32.078 30.351 85 1HG GLN 11 HG2 GLN 11 -3.530 32.253 32.412 86 2HG GLN 11 HG1 GLN 11 -2.223 31.496 33.324 87 1HE2 GLN 11 HE22 GLN 11 -1.955 35.255 33.597 88 2HE2 GLN 11 HE21 GLN 11 -3.207 34.155 33.923 89 H THR 12 HN THR 12 -3.908 30.164 28.961 90 HA THR 12 HA THR 12 -2.150 28.390 27.354 91 HB THR 12 HB THR 12 -3.973 28.488 25.694 92 HG1 THR 12 HG1 THR 12 -5.899 29.651 26.454 93 1HG2 THR 12 HG22 THR 12 -4.078 26.935 27.691 94 2HG2 THR 12 HG21 THR 12 -5.142 28.113 28.459 95 3HG2 THR 12 HG23 THR 12 -5.641 27.315 26.966 96 H HIS 13 HN HIS 13 -2.412 31.599 28.092 97 HA HIS 13 HA HIS 13 -1.179 32.496 25.512 98 1HB HIS 13 HB2 HIS 13 -2.888 34.025 27.506 99 2HB HIS 13 HB1 HIS 13 -2.030 34.773 26.161 100 HD1 HIS 13 HD1 HIS 13 -4.578 31.981 26.699 101 HD2 HIS 13 HD2 HIS 13 -3.527 34.832 23.846 102 HE1 HIS 13 HE1 HIS 13 -6.303 31.816 24.852 103 H LEU 14 HN LEU 14 0.864 33.355 25.742 104 HA LEU 14 HA LEU 14 1.794 34.103 28.493 105 1HB LEU 14 HB2 LEU 14 3.334 32.472 26.449 106 2HB LEU 14 HB1 LEU 14 3.949 33.008 28.011 107 HG LEU 14 HG LEU 14 1.498 31.251 27.685 108 1HD1 LEU 14 HD13 LEU 14 4.360 30.483 28.335 109 2HD1 LEU 14 HD12 LEU 14 2.975 29.392 28.392 110 3HD1 LEU 14 HD11 LEU 14 3.492 30.082 26.853 111 1HD2 LEU 14 HD23 LEU 14 3.125 32.239 30.036 112 2HD2 LEU 14 HD22 LEU 14 1.375 32.261 29.820 113 3HD2 LEU 14 HD21 LEU 14 2.199 30.743 30.152 114 H THR 15 HN THR 15 3.641 35.573 28.447 115 HA THR 15 HA THR 15 3.880 37.123 25.885 116 HB THR 15 HB THR 15 3.963 39.174 27.224 117 HG1 THR 15 HG1 THR 15 3.341 37.533 29.442 118 1HG2 THR 15 HG23 THR 15 1.757 38.250 26.460 119 2HG2 THR 15 HG22 THR 15 1.578 37.498 28.046 120 3HG2 THR 15 HG21 THR 15 1.639 39.255 27.905 121 H TYR 16 HN TYR 16 5.958 38.203 25.635 122 HA TYR 16 HA TYR 16 8.102 37.286 27.496 123 1HB TYR 16 HB2 TYR 16 9.490 36.534 25.604 124 2HB TYR 16 HB1 TYR 16 7.998 35.599 25.710 125 HD1 TYR 16 HD2 TYR 16 6.057 36.194 24.209 126 HD2 TYR 16 HD1 TYR 16 9.983 37.853 23.676 127 HE1 TYR 16 HE2 TYR 16 5.464 36.853 21.893 128 HE2 TYR 16 HE1 TYR 16 9.391 38.509 21.358 129 HH TYR 16 HH TYR 16 6.199 37.716 19.983 130 H ARG 17 HN ARG 17 10.022 38.549 27.379 131 HA ARG 17 HA ARG 17 9.938 40.994 25.681 132 1HB ARG 17 HB2 ARG 17 8.838 41.524 27.888 133 2HB ARG 17 HB1 ARG 17 10.353 41.099 28.684 134 1HG ARG 17 HG2 ARG 17 11.528 42.823 27.372 135 2HG ARG 17 HG1 ARG 17 10.019 43.259 26.581 136 1HD ARG 17 HD2 ARG 17 9.059 43.758 28.848 137 2HD ARG 17 HD1 ARG 17 10.657 43.501 29.541 138 HE ARG 17 HE ARG 17 9.704 45.897 28.269 139 1HH1 ARG 17 HH21 ARG 17 12.503 43.872 28.388 140 2HH1 ARG 17 HH22 ARG 17 13.543 45.067 27.691 141 1HH2 ARG 17 HH11 ARG 17 11.054 47.449 27.382 142 2HH2 ARG 17 HH12 ARG 17 12.728 47.086 27.132 143 H ILE 18 HN ILE 18 11.964 41.467 24.940 144 HA ILE 18 HA ILE 18 14.253 39.907 26.002 145 HB ILE 18 HB ILE 18 14.089 41.869 23.685 146 1HG1 ILE 18 HG12 ILE 18 14.240 38.838 23.644 147 2HG1 ILE 18 HG11 ILE 18 12.736 39.741 23.470 148 1HG2 ILE 18 HG21 ILE 18 16.257 39.927 24.546 149 2HG2 ILE 18 HG23 ILE 18 16.263 40.837 23.035 150 3HG2 ILE 18 HG22 ILE 18 16.361 41.687 24.577 151 1HD1 ILE 18 HD12 ILE 18 13.900 40.986 21.541 152 2HD1 ILE 18 HD11 ILE 18 15.123 39.719 21.617 153 3HD1 ILE 18 HD13 ILE 18 13.450 39.308 21.244 154 H GLU 19 HN GLU 19 15.434 40.804 27.638 155 HA GLU 19 HA GLU 19 14.961 43.440 28.607 156 1HB GLU 19 HB2 GLU 19 15.936 41.556 29.944 157 2HB GLU 19 HB1 GLU 19 17.450 41.774 29.062 158 1HG GLU 19 HG2 GLU 19 17.570 44.113 29.841 159 2HG GLU 19 HG1 GLU 19 16.060 43.895 30.727 160 H ASN 20 HN ASN 20 17.527 42.180 26.471 161 HA ASN 20 HA ASN 20 17.889 44.824 25.324 162 1HB ASN 20 HB2 ASN 20 20.203 45.183 26.042 163 2HB ASN 20 HB1 ASN 20 19.152 45.072 27.455 164 1HD2 ASN 20 HD22 ASN 20 20.507 41.377 27.286 165 2HD2 ASN 20 HD21 ASN 20 19.149 41.976 26.462 166 H TYR 21 HN TYR 21 19.675 44.788 23.669 167 HA TYR 21 HA TYR 21 19.960 42.036 22.502 168 1HB TYR 21 HB2 TYR 21 20.073 44.754 21.154 169 2HB TYR 21 HB1 TYR 21 20.232 43.196 20.343 170 HD1 TYR 21 HD1 TYR 21 18.316 41.679 20.130 171 HD2 TYR 21 HD2 TYR 21 17.923 45.531 21.990 172 HE1 TYR 21 HE1 TYR 21 15.852 41.511 19.953 173 HE2 TYR 21 HE2 TYR 21 15.454 45.363 21.813 174 HH TYR 21 HH TYR 21 13.853 43.767 19.956 175 H THR 22 HN THR 22 22.022 41.259 22.214 176 HA THR 22 HA THR 22 24.231 42.735 23.349 177 HB THR 22 HB THR 22 24.372 40.383 23.590 178 HG1 THR 22 HG1 THR 22 26.010 40.392 21.396 179 1HG2 THR 22 HG23 THR 22 23.689 40.324 20.648 180 2HG2 THR 22 HG22 THR 22 24.328 38.913 21.491 181 3HG2 THR 22 HG21 THR 22 22.789 39.616 21.990 182 HA PRO 23 HA PRO 23 25.422 44.892 19.631 183 1HB PRO 23 HB2 PRO 23 28.254 44.799 20.035 184 2HB PRO 23 HB1 PRO 23 27.159 46.102 20.517 185 1HG PRO 23 HG2 PRO 23 28.469 44.096 22.219 186 2HG PRO 23 HG1 PRO 23 27.612 45.567 22.702 187 1HD PRO 23 HD2 PRO 23 26.658 42.890 22.972 188 2HD PRO 23 HD1 PRO 23 25.729 44.384 23.223 189 H ASP 24 HN ASP 24 25.986 41.692 20.258 190 HA ASP 24 HA ASP 24 27.858 40.944 18.220 191 1HB ASP 24 HB2 ASP 24 25.620 39.424 19.576 192 2HB ASP 24 HB1 ASP 24 26.746 38.677 18.443 193 H LEU 25 HN LEU 25 24.315 41.300 18.188 194 HA LEU 25 HA LEU 25 24.420 41.350 15.213 195 1HB LEU 25 HB2 LEU 25 22.665 39.598 16.940 196 2HB LEU 25 HB1 LEU 25 22.238 39.975 15.278 197 HG LEU 25 HG LEU 25 24.949 38.828 15.986 198 1HD1 LEU 25 HD12 LEU 25 22.327 37.391 15.569 199 2HD1 LEU 25 HD11 LEU 25 23.873 36.607 15.239 200 3HD1 LEU 25 HD13 LEU 25 23.503 37.175 16.866 201 1HD2 LEU 25 HD22 LEU 25 23.275 39.046 13.468 202 2HD2 LEU 25 HD21 LEU 25 24.910 39.641 13.746 203 3HD2 LEU 25 HD23 LEU 25 24.618 37.913 13.592 204 HA PRO 26 HA PRO 26 21.755 44.854 15.812 205 1HB PRO 26 HB2 PRO 26 20.013 44.391 13.574 206 2HB PRO 26 HB1 PRO 26 21.432 45.446 13.620 207 1HG PRO 26 HG2 PRO 26 21.154 42.827 12.330 208 2HG PRO 26 HG1 PRO 26 22.472 43.997 12.176 209 1HD PRO 26 HD2 PRO 26 22.569 41.526 13.594 210 2HD PRO 26 HD1 PRO 26 23.783 42.821 13.632 211 H ARG 27 HN ARG 27 19.647 45.280 16.717 212 HA ARG 27 HA ARG 27 18.344 43.007 17.907 213 1HB ARG 27 HB2 ARG 27 16.777 44.586 18.835 214 2HB ARG 27 HB1 ARG 27 18.364 45.350 18.859 215 1HG ARG 27 HG2 ARG 27 17.769 46.446 16.655 216 2HG ARG 27 HG1 ARG 27 16.129 45.836 16.870 217 1HD ARG 27 HD2 ARG 27 15.914 47.046 18.980 218 2HD ARG 27 HD1 ARG 27 17.582 47.607 18.856 219 HE ARG 27 HE ARG 27 16.440 48.509 16.514 220 1HH1 ARG 27 HH21 ARG 27 15.633 48.656 19.862 221 2HH1 ARG 27 HH22 ARG 27 14.876 50.211 19.749 222 1HH2 ARG 27 HH11 ARG 27 15.462 50.540 16.346 223 2HH2 ARG 27 HH12 ARG 27 14.781 51.279 17.757 224 H ALA 28 HN ALA 28 17.762 44.882 14.997 225 HA ALA 28 HA ALA 28 15.102 44.047 14.448 226 1HB ALA 28 HB3 ALA 28 16.396 45.825 13.211 227 2HB ALA 28 HB2 ALA 28 17.277 44.533 12.396 228 3HB ALA 28 HB1 ALA 28 15.537 44.697 12.163 229 H ASP 29 HN ASP 29 18.218 42.491 13.708 230 HA ASP 29 HA ASP 29 16.933 40.294 12.277 231 1HB ASP 29 HB2 ASP 29 19.759 40.723 13.286 232 2HB ASP 29 HB1 ASP 29 19.250 39.268 12.424 233 H VAL 30 HN VAL 30 18.081 40.870 15.568 234 HA VAL 30 HA VAL 30 17.889 38.115 16.412 235 HB VAL 30 HB VAL 30 17.857 40.724 17.942 236 1HG1 VAL 30 HG12 VAL 30 17.777 37.863 18.909 237 2HG1 VAL 30 HG11 VAL 30 18.413 39.167 19.913 238 3HG1 VAL 30 HG13 VAL 30 16.732 39.202 19.381 239 1HG2 VAL 30 HG22 VAL 30 19.956 38.583 17.482 240 2HG2 VAL 30 HG21 VAL 30 19.972 40.225 16.837 241 3HG2 VAL 30 HG23 VAL 30 20.155 39.957 18.570 242 H ASP 31 HN ASP 31 15.619 40.870 16.505 243 HA ASP 31 HA ASP 31 13.578 39.582 18.019 244 1HB ASP 31 HB2 ASP 31 13.417 41.683 15.840 245 2HB ASP 31 HB1 ASP 31 12.026 41.172 16.797 246 H HIS 32 HN HIS 32 14.280 39.580 14.541 247 HA HIS 32 HA HIS 32 11.983 38.114 13.705 248 1HB HIS 32 HB2 HIS 32 13.531 39.241 12.129 249 2HB HIS 32 HB1 HIS 32 14.780 38.060 12.529 250 HD1 HIS 32 HD1 HIS 32 11.121 37.891 11.434 251 HD2 HIS 32 HD2 HIS 32 14.759 35.992 10.706 252 HE1 HIS 32 HE1 HIS 32 10.663 36.111 9.692 253 H ALA 33 HN ALA 33 15.231 37.003 14.663 254 HA ALA 33 HA ALA 33 14.802 34.222 14.307 255 1HB ALA 33 HB2 ALA 33 16.539 35.675 16.323 256 2HB ALA 33 HB1 ALA 33 16.643 33.950 15.974 257 3HB ALA 33 HB3 ALA 33 17.028 35.129 14.718 258 H ILE 34 HN ILE 34 14.356 36.219 17.244 259 HA ILE 34 HA ILE 34 13.338 34.019 18.815 260 HB ILE 34 HB ILE 34 12.958 37.009 19.166 261 1HG1 ILE 34 HG12 ILE 34 15.329 36.438 19.164 262 2HG1 ILE 34 HG11 ILE 34 14.825 36.780 20.814 263 1HG2 ILE 34 HG23 ILE 34 12.519 34.667 21.029 264 2HG2 ILE 34 HG22 ILE 34 12.617 36.340 21.579 265 3HG2 ILE 34 HG21 ILE 34 11.327 35.846 20.482 266 1HD1 ILE 34 HD11 ILE 34 14.415 34.155 20.896 267 2HD1 ILE 34 HD13 ILE 34 15.569 34.158 19.562 268 3HD1 ILE 34 HD12 ILE 34 16.030 34.819 21.129 269 H GLU 35 HN GLU 35 11.753 36.680 17.040 270 HA GLU 35 HA GLU 35 9.079 36.003 17.735 271 1HB GLU 35 HB2 GLU 35 9.782 38.120 16.601 272 2HB GLU 35 HB1 GLU 35 10.037 37.199 15.118 273 1HG GLU 35 HG2 GLU 35 7.683 36.528 15.091 274 2HG GLU 35 HG1 GLU 35 7.407 37.362 16.621 275 H LYS 36 HN LYS 36 11.083 34.925 14.985 276 HA LYS 36 HA LYS 36 9.066 33.352 13.729 277 1HB LYS 36 HB2 LYS 36 11.165 33.988 12.603 278 2HB LYS 36 HB1 LYS 36 12.076 32.974 13.717 279 1HG LYS 36 HG2 LYS 36 11.757 31.774 11.622 280 2HG LYS 36 HG1 LYS 36 10.815 30.980 12.876 281 1HD LYS 36 HD2 LYS 36 8.769 31.831 12.048 282 2HD LYS 36 HD1 LYS 36 9.574 33.091 11.109 283 1HE LYS 36 HE2 LYS 36 9.838 30.120 10.564 284 2HE LYS 36 HE1 LYS 36 8.728 31.190 9.708 285 1HZ LYS 36 HZ2 LYS 36 10.903 32.577 9.377 286 2HZ LYS 36 HZ1 LYS 36 11.653 31.069 9.599 287 3HZ LYS 36 HZ3 LYS 36 10.534 31.281 8.344 288 H ALA 37 HN ALA 37 11.448 32.522 16.246 289 HA ALA 37 HA ALA 37 10.958 29.721 16.289 290 1HB ALA 37 HB1 ALA 37 12.793 31.005 17.517 291 2HB ALA 37 HB3 ALA 37 11.578 31.390 18.735 292 3HB ALA 37 HB2 ALA 37 12.019 29.711 18.430 293 H PHE 38 HN PHE 38 9.411 32.340 18.175 294 HA PHE 38 HA PHE 38 7.622 30.650 19.615 295 1HB PHE 38 HB2 PHE 38 7.526 33.560 18.806 296 2HB PHE 38 HB1 PHE 38 6.162 32.816 19.640 297 HD1 PHE 38 HD2 PHE 38 6.863 31.314 21.740 298 HD2 PHE 38 HD1 PHE 38 9.187 34.554 20.141 299 HE1 PHE 38 HE2 PHE 38 8.029 31.549 23.914 300 HE2 PHE 38 HE1 PHE 38 10.351 34.789 22.321 301 HZ PHE 38 HZ PHE 38 9.773 33.287 24.205 302 H GLN 39 HN GLN 39 7.345 32.188 16.424 303 HA GLN 39 HA GLN 39 4.635 31.499 15.915 304 1HB GLN 39 HB2 GLN 39 6.999 31.846 14.054 305 2HB GLN 39 HB1 GLN 39 5.347 31.615 13.480 306 1HG GLN 39 HG2 GLN 39 4.606 33.626 14.597 307 2HG GLN 39 HG1 GLN 39 6.163 33.809 15.402 308 1HE2 GLN 39 HE22 GLN 39 6.061 35.988 12.320 309 2HE2 GLN 39 HE21 GLN 39 5.049 35.847 13.676 310 H LEU 40 HN LEU 40 7.632 29.628 15.368 311 HA LEU 40 HA LEU 40 6.416 27.445 14.002 312 1HB LEU 40 HB2 LEU 40 8.834 27.538 15.821 313 2HB LEU 40 HB1 LEU 40 8.362 26.103 14.917 314 HG LEU 40 HG LEU 40 8.960 28.805 13.669 315 1HD1 LEU 40 HD11 LEU 40 10.929 27.661 14.748 316 2HD1 LEU 40 HD13 LEU 40 10.654 26.290 13.673 317 3HD1 LEU 40 HD12 LEU 40 11.087 27.861 13.004 318 1HD2 LEU 40 HD22 LEU 40 8.085 26.129 12.600 319 2HD2 LEU 40 HD21 LEU 40 7.638 27.748 12.068 320 3HD2 LEU 40 HD23 LEU 40 9.207 27.082 11.632 321 H TRP 41 HN TRP 41 6.956 27.948 17.496 322 HA TRP 41 HA TRP 41 5.776 25.418 18.239 323 1HB TRP 41 HB2 TRP 41 6.281 27.965 19.800 324 2HB TRP 41 HB1 TRP 41 5.663 26.483 20.530 325 HD1 TRP 41 HD1 TRP 41 8.804 28.183 19.675 326 HE1 TRP 41 HE1 TRP 41 10.811 26.578 19.884 327 HE3 TRP 41 HE3 TRP 41 6.335 23.725 20.029 328 HZ2 TRP 41 HZ2 TRP 41 11.303 23.775 20.162 329 HZ3 TRP 41 HZ3 TRP 41 7.598 21.605 20.264 330 HH2 TRP 41 HH2 TRP 41 10.077 21.624 20.330 331 H SER 42 HN SER 42 4.499 28.726 17.987 332 HA SER 42 HA SER 42 1.893 28.106 19.053 333 1HB SER 42 HB2 SER 42 2.853 30.420 18.826 334 2HB SER 42 HB1 SER 42 2.631 30.295 17.083 335 HG SER 42 HG SER 42 0.401 29.979 17.479 336 H ASN 43 HN ASN 43 3.226 28.159 15.763 337 HA ASN 43 HA ASN 43 0.852 27.815 14.297 338 1HB ASN 43 HB2 ASN 43 3.646 26.778 13.787 339 2HB ASN 43 HB1 ASN 43 2.338 26.643 12.610 340 1HD2 ASN 43 HD22 ASN 43 4.246 29.879 12.093 341 2HD2 ASN 43 HD21 ASN 43 4.747 28.261 12.206 342 H VAL 44 HN VAL 44 2.576 25.446 16.249 343 HA VAL 44 HA VAL 44 0.760 23.292 15.218 344 HB VAL 44 HB VAL 44 2.357 21.769 16.450 345 1HG1 VAL 44 HG13 VAL 44 3.263 23.563 14.193 346 2HG1 VAL 44 HG12 VAL 44 4.256 22.221 14.763 347 3HG1 VAL 44 HG11 VAL 44 2.652 21.911 14.102 348 1HG2 VAL 44 HG23 VAL 44 3.947 24.344 16.663 349 2HG2 VAL 44 HG22 VAL 44 3.254 23.453 18.013 350 3HG2 VAL 44 HG21 VAL 44 4.554 22.738 17.060 351 H THR 45 HN THR 45 0.544 25.531 17.537 352 HA THR 45 HA THR 45 -1.042 23.730 19.255 353 HB THR 45 HB THR 45 0.027 24.878 21.313 354 HG1 THR 45 HG1 THR 45 1.191 26.432 20.173 355 1HG2 THR 45 HG22 THR 45 0.357 22.498 20.718 356 2HG2 THR 45 HG21 THR 45 1.699 22.959 19.673 357 3HG2 THR 45 HG23 THR 45 1.811 23.214 21.411 358 HA PRO 46 HA PRO 46 -3.612 27.377 19.246 359 1HB PRO 46 HB2 PRO 46 -4.940 26.983 21.708 360 2HB PRO 46 HB1 PRO 46 -5.439 26.307 20.150 361 1HG PRO 46 HG2 PRO 46 -4.153 24.936 22.439 362 2HG PRO 46 HG1 PRO 46 -5.060 24.238 21.088 363 1HD PRO 46 HD2 PRO 46 -2.237 24.176 21.404 364 2HD PRO 46 HD1 PRO 46 -3.145 23.778 19.928 365 H LEU 47 HN LEU 47 -0.999 26.952 21.187 366 HA LEU 47 HA LEU 47 -1.418 28.986 23.212 367 1HB LEU 47 HB2 LEU 47 1.150 27.835 22.076 368 2HB LEU 47 HB1 LEU 47 1.047 28.844 23.515 369 HG LEU 47 HG LEU 47 -0.396 26.199 23.184 370 1HD1 LEU 47 HD12 LEU 47 2.112 26.014 23.212 371 2HD1 LEU 47 HD11 LEU 47 2.103 26.800 24.791 372 3HD1 LEU 47 HD13 LEU 47 1.327 25.230 24.583 373 1HD2 LEU 47 HD22 LEU 47 -0.134 28.220 25.414 374 2HD2 LEU 47 HD21 LEU 47 -1.571 27.368 24.850 375 3HD2 LEU 47 HD23 LEU 47 -0.362 26.517 25.806 376 H THR 48 HN THR 48 -0.609 31.140 23.222 377 HA THR 48 HA THR 48 0.305 32.203 20.560 378 HB THR 48 HB THR 48 -1.137 34.139 20.836 379 HG1 THR 48 HG1 THR 48 -2.256 32.920 23.113 380 1HG2 THR 48 HG22 THR 48 -2.041 31.853 19.951 381 2HG2 THR 48 HG21 THR 48 -2.935 31.811 21.470 382 3HG2 THR 48 HG23 THR 48 -3.195 33.131 20.331 383 H PHE 49 HN PHE 49 1.817 33.871 20.697 384 HA PHE 49 HA PHE 49 2.760 34.612 23.452 385 1HB PHE 49 HB2 PHE 49 4.432 34.067 20.980 386 2HB PHE 49 HB1 PHE 49 5.055 34.639 22.528 387 HD1 PHE 49 HD2 PHE 49 5.106 33.181 24.492 388 HD2 PHE 49 HD1 PHE 49 3.601 31.781 20.720 389 HE1 PHE 49 HE2 PHE 49 5.200 30.848 25.321 390 HE2 PHE 49 HE1 PHE 49 3.695 29.447 21.549 391 HZ PHE 49 HZ PHE 49 4.495 28.979 23.849 392 H THR 50 HN THR 50 2.829 36.769 23.780 393 HA THR 50 HA THR 50 2.719 38.591 21.391 394 HB THR 50 HB THR 50 1.488 38.988 24.132 395 HG1 THR 50 HG1 THR 50 0.640 37.578 22.151 396 1HG2 THR 50 HG21 THR 50 1.653 40.698 21.650 397 2HG2 THR 50 HG23 THR 50 0.376 40.921 22.846 398 3HG2 THR 50 HG22 THR 50 2.065 41.133 23.309 399 H LYS 51 HN LYS 51 4.313 40.058 21.244 400 HA LYS 51 HA LYS 51 6.416 40.159 23.250 401 1HB LYS 51 HB2 LYS 51 7.012 40.395 20.906 402 2HB LYS 51 HB1 LYS 51 5.908 41.752 20.717 403 1HG LYS 51 HG2 LYS 51 8.239 42.529 20.904 404 2HG LYS 51 HG1 LYS 51 7.290 43.098 22.269 405 1HD LYS 51 HD2 LYS 51 8.238 41.456 23.730 406 2HD LYS 51 HD1 LYS 51 8.947 40.568 22.380 407 1HE LYS 51 HE2 LYS 51 10.675 41.891 23.497 408 2HE LYS 51 HE1 LYS 51 10.382 42.542 21.884 409 1HZ LYS 51 HZ3 LYS 51 8.794 44.119 22.969 410 2HZ LYS 51 HZ2 LYS 51 9.393 43.596 24.470 411 3HZ LYS 51 HZ1 LYS 51 10.426 44.363 23.361 412 H VAL 52 HN VAL 52 6.688 41.717 24.839 413 HA VAL 52 HA VAL 52 4.698 43.977 24.915 414 HB VAL 52 HB VAL 52 4.807 43.818 27.378 415 1HG1 VAL 52 HG11 VAL 52 3.060 42.588 26.131 416 2HG1 VAL 52 HG13 VAL 52 4.126 41.187 26.030 417 3HG1 VAL 52 HG12 VAL 52 3.529 41.729 27.599 418 1HG2 VAL 52 HG21 VAL 52 6.686 41.542 26.716 419 2HG2 VAL 52 HG23 VAL 52 6.950 42.897 27.813 420 3HG2 VAL 52 HG22 VAL 52 5.832 41.609 28.257 421 H SER 53 HN SER 53 5.600 45.969 25.002 422 HA SER 53 HA SER 53 8.545 46.185 25.186 423 1HB SER 53 HB2 SER 53 7.032 47.418 23.479 424 2HB SER 53 HB1 SER 53 6.608 48.478 24.822 425 HG SER 53 HG SER 53 8.535 49.334 24.737 426 H GLU 54 HN GLU 54 5.917 46.322 27.295 427 HA GLU 54 HA GLU 54 7.613 47.523 29.396 428 1HB GLU 54 HB2 GLU 54 6.339 49.411 28.268 429 2HB GLU 54 HB1 GLU 54 4.857 48.642 28.834 430 1HG GLU 54 HG2 GLU 54 5.570 48.845 31.145 431 2HG GLU 54 HG1 GLU 54 7.134 49.484 30.639 432 H GLY 55 HN GLY 55 6.686 47.143 31.544 433 1HA GLY 55 HA2 GLY 55 5.213 46.048 33.076 434 2HA GLY 55 HA1 GLY 55 4.355 45.333 31.712 435 H GLN 56 HN GLN 56 4.899 43.612 33.687 436 HA GLN 56 HA GLN 56 7.502 42.308 33.346 437 1HB GLN 56 HB2 GLN 56 4.972 41.517 34.825 438 2HB GLN 56 HB1 GLN 56 6.440 40.541 34.818 439 1HG GLN 56 HG2 GLN 56 7.706 42.432 35.773 440 2HG GLN 56 HG1 GLN 56 6.235 43.407 35.785 441 1HE2 GLN 56 HE22 GLN 56 5.629 42.220 39.056 442 2HE2 GLN 56 HE21 GLN 56 5.872 43.566 38.050 443 H ALA 57 HN ALA 57 7.660 40.039 32.573 444 HA ALA 57 HA ALA 57 5.500 39.273 30.635 445 1HB ALA 57 HB1 ALA 57 7.573 40.376 29.582 446 2HB ALA 57 HB3 ALA 57 8.448 38.923 30.066 447 3HB ALA 57 HB2 ALA 57 7.094 38.805 28.942 448 H ASP 58 HN ASP 58 5.176 37.046 30.423 449 HA ASP 58 HA ASP 58 5.764 35.401 32.666 450 1HB ASP 58 HB2 ASP 58 4.920 34.698 29.844 451 2HB ASP 58 HB1 ASP 58 5.033 33.513 31.146 452 H ILE 59 HN ILE 59 7.377 35.676 29.506 453 HA ILE 59 HA ILE 59 9.597 33.942 30.570 454 HB ILE 59 HB ILE 59 8.729 34.397 27.698 455 1HG1 ILE 59 HG12 ILE 59 8.571 31.878 29.377 456 2HG1 ILE 59 HG11 ILE 59 7.210 32.975 29.150 457 1HG2 ILE 59 HG22 ILE 59 10.940 32.775 28.976 458 2HG2 ILE 59 HG21 ILE 59 10.359 32.459 27.341 459 3HG2 ILE 59 HG23 ILE 59 11.087 34.016 27.733 460 1HD1 ILE 59 HD12 ILE 59 7.410 32.668 26.688 461 2HD1 ILE 59 HD11 ILE 59 8.710 31.507 26.959 462 3HD1 ILE 59 HD13 ILE 59 7.077 31.151 27.523 463 H MET 60 HN MET 60 11.384 35.130 31.002 464 HA MET 60 HA MET 60 11.770 37.741 29.595 465 1HB MET 60 HB2 MET 60 13.103 36.621 32.081 466 2HB MET 60 HB1 MET 60 13.351 38.236 31.417 467 1HG MET 60 HG2 MET 60 10.645 37.170 32.269 468 2HG MET 60 HG1 MET 60 11.678 38.150 33.307 469 1HE MET 60 HE1 MET 60 12.756 40.128 32.657 470 2HE MET 60 HE3 MET 60 12.120 41.414 31.622 471 3HE MET 60 HE2 MET 60 11.348 41.056 33.164 472 H ILE 61 HN ILE 61 13.357 37.919 28.099 473 HA ILE 61 HA ILE 61 15.418 35.736 27.912 474 HB ILE 61 HB ILE 61 14.254 37.499 25.733 475 1HG1 ILE 61 HG12 ILE 61 14.003 34.504 26.113 476 2HG1 ILE 61 HG11 ILE 61 12.785 35.648 26.677 477 1HG2 ILE 61 HG23 ILE 61 16.400 35.370 25.747 478 2HG2 ILE 61 HG22 ILE 61 15.544 35.829 24.276 479 3HG2 ILE 61 HG21 ILE 61 16.512 37.022 25.142 480 1HD1 ILE 61 HD11 ILE 61 13.752 35.592 23.811 481 2HD1 ILE 61 HD13 ILE 61 12.377 34.636 24.366 482 3HD1 ILE 61 HD12 ILE 61 12.321 36.396 24.456 483 H SER 62 HN SER 62 17.518 36.409 28.187 484 HA SER 62 HA SER 62 18.234 39.214 27.536 485 1HB SER 62 HB2 SER 62 19.164 39.653 29.744 486 2HB SER 62 HB1 SER 62 17.459 39.240 29.903 487 HG SER 62 HG SER 62 18.823 38.119 31.394 488 H PHE 63 HN PHE 63 20.601 39.563 27.740 489 HA PHE 63 HA PHE 63 22.155 37.045 27.213 490 1HB PHE 63 HB2 PHE 63 22.432 39.849 26.083 491 2HB PHE 63 HB1 PHE 63 23.639 38.586 25.856 492 HD1 PHE 63 HD1 PHE 63 20.234 39.700 25.025 493 HD2 PHE 63 HD2 PHE 63 23.179 36.622 24.468 494 HE1 PHE 63 HE1 PHE 63 18.914 38.778 23.139 495 HE2 PHE 63 HE2 PHE 63 21.858 35.701 22.583 496 HZ PHE 63 HZ PHE 63 19.726 36.777 21.918 497 H VAL 64 HN VAL 64 24.069 36.806 28.412 498 HA VAL 64 HA VAL 64 24.913 39.103 30.145 499 HB VAL 64 HB VAL 64 25.181 37.518 32.029 500 1HG1 VAL 64 HG12 VAL 64 23.114 38.914 31.709 501 2HG1 VAL 64 HG11 VAL 64 22.362 37.526 30.924 502 3HG1 VAL 64 HG13 VAL 64 22.834 37.430 32.621 503 1HG2 VAL 64 HG21 VAL 64 23.735 35.624 30.156 504 2HG2 VAL 64 HG23 VAL 64 25.386 35.442 30.746 505 3HG2 VAL 64 HG22 VAL 64 24.031 35.316 31.867 506 H ARG 65 HN ARG 65 27.084 38.670 31.162 507 HA ARG 65 HA ARG 65 28.844 37.050 29.342 508 1HB ARG 65 HB2 ARG 65 29.299 39.768 30.594 509 2HB ARG 65 HB1 ARG 65 30.594 38.806 29.882 510 1HG ARG 65 HG2 ARG 65 29.436 38.779 27.735 511 2HG ARG 65 HG1 ARG 65 28.084 39.682 28.425 512 1HD ARG 65 HD2 ARG 65 29.613 41.188 27.202 513 2HD ARG 65 HD1 ARG 65 29.614 41.563 28.927 514 HE ARG 65 HE ARG 65 31.702 39.775 28.656 515 1HH1 ARG 65 HH21 ARG 65 30.731 42.708 27.124 516 2HH1 ARG 65 HH22 ARG 65 32.350 43.220 26.784 517 1HH2 ARG 65 HH11 ARG 65 33.817 40.427 28.225 518 2HH2 ARG 65 HH12 ARG 65 34.098 41.928 27.407 519 H GLY 66 HN GLY 66 30.372 35.774 30.331 520 1HA GLY 66 HA2 GLY 66 31.229 34.457 32.084 521 2HA GLY 66 HA1 GLY 66 31.632 36.029 32.770 522 H ASP 67 HN ASP 67 31.202 35.448 34.918 523 HA ASP 67 HA ASP 67 28.792 34.118 35.759 524 1HB ASP 67 HB2 ASP 67 30.935 34.277 37.094 525 2HB ASP 67 HB1 ASP 67 30.520 35.959 37.431 526 H HIS 68 HN HIS 68 26.826 34.953 36.327 527 HA HIS 68 HA HIS 68 26.503 37.922 36.451 528 1HB HIS 68 HB2 HIS 68 24.430 37.690 35.074 529 2HB HIS 68 HB1 HIS 68 25.904 37.305 34.187 530 HD1 HIS 68 HD1 HIS 68 26.516 34.606 34.211 531 HD2 HIS 68 HD2 HIS 68 22.550 35.662 34.948 532 HE1 HIS 68 HE1 HIS 68 25.135 32.519 33.824 533 H ARG 69 HN ARG 69 26.602 36.576 38.741 534 HA ARG 69 HA ARG 69 25.400 36.025 40.677 535 1HB ARG 69 HB2 ARG 69 23.162 37.514 39.262 536 2HB ARG 69 HB1 ARG 69 23.261 37.179 40.986 537 1HG ARG 69 HG2 ARG 69 25.397 38.747 39.530 538 2HG ARG 69 HG1 ARG 69 23.983 39.523 40.238 539 1HD ARG 69 HD2 ARG 69 24.608 38.419 42.439 540 2HD ARG 69 HD1 ARG 69 26.123 37.936 41.682 541 HE ARG 69 HE ARG 69 25.982 40.665 41.216 542 1HH1 ARG 69 HH21 ARG 69 25.818 38.544 43.928 543 2HH1 ARG 69 HH22 ARG 69 26.467 39.702 45.041 544 1HH2 ARG 69 HH11 ARG 69 26.829 42.190 42.653 545 2HH2 ARG 69 HH12 ARG 69 27.039 41.765 44.320 546 H ASP 70 HN ASP 70 25.565 33.919 39.026 547 HA ASP 70 HA ASP 70 22.890 32.622 39.313 548 1HB ASP 70 HB2 ASP 70 23.320 33.416 36.913 549 2HB ASP 70 HB1 ASP 70 24.627 32.233 36.863 550 H ASN 71 HN ASN 71 23.102 30.224 39.284 551 HA ASN 71 HA ASN 71 25.581 29.407 40.670 552 1HB ASN 71 HB2 ASN 71 24.374 27.351 41.178 553 2HB ASN 71 HB1 ASN 71 23.328 28.727 41.528 554 1HD2 ASN 71 HD22 ASN 71 21.400 26.231 39.488 555 2HD2 ASN 71 HD21 ASN 71 22.214 26.158 40.976 556 H SER 72 HN SER 72 24.945 29.858 37.580 557 HA SER 72 HA SER 72 26.560 27.496 36.698 558 1HB SER 72 HB2 SER 72 24.187 27.127 36.082 559 2HB SER 72 HB1 SER 72 24.175 28.675 35.240 560 HG SER 72 HG SER 72 24.802 27.460 33.626 561 HA PRO 73 HA PRO 73 28.167 31.667 35.255 562 1HB PRO 73 HB2 PRO 73 30.799 31.039 36.185 563 2HB PRO 73 HB1 PRO 73 29.667 32.190 36.909 564 1HG PRO 73 HG2 PRO 73 30.452 29.556 37.910 565 2HG PRO 73 HG1 PRO 73 29.483 30.796 38.719 566 1HD PRO 73 HD2 PRO 73 28.539 28.332 37.565 567 2HD PRO 73 HD1 PRO 73 27.566 29.627 38.287 568 H PHE 74 HN PHE 74 29.220 31.821 33.239 569 HA PHE 74 HA PHE 74 29.722 29.319 31.836 570 1HB PHE 74 HB2 PHE 74 30.171 32.204 31.012 571 2HB PHE 74 HB1 PHE 74 30.310 30.815 29.932 572 HD1 PHE 74 HD2 PHE 74 27.995 32.913 31.884 573 HD2 PHE 74 HD1 PHE 74 28.343 29.537 29.251 574 HE1 PHE 74 HE2 PHE 74 25.542 32.943 31.522 575 HE2 PHE 74 HE1 PHE 74 25.889 29.566 28.890 576 HZ PHE 74 HZ PHE 74 24.489 31.269 30.027 577 H ASP 75 HN ASP 75 31.682 28.351 31.477 578 HA ASP 75 HA ASP 75 34.081 29.608 32.739 579 1HB ASP 75 HB2 ASP 75 33.304 27.256 33.352 580 2HB ASP 75 HB1 ASP 75 33.797 26.771 31.729 581 H GLY 76 HN GLY 76 33.811 30.982 30.542 582 1HA GLY 76 HA2 GLY 76 35.112 31.571 28.653 583 2HA GLY 76 HA1 GLY 76 35.968 30.039 28.818 584 HA PRO 77 HA PRO 77 33.101 29.904 25.129 585 1HB PRO 77 HB2 PRO 77 35.271 28.629 23.670 586 2HB PRO 77 HB1 PRO 77 34.522 30.201 23.357 587 1HG PRO 77 HG2 PRO 77 37.140 29.729 24.434 588 2HG PRO 77 HG1 PRO 77 36.333 31.292 24.240 589 1HD PRO 77 HD2 PRO 77 36.823 29.808 26.705 590 2HD PRO 77 HD1 PRO 77 36.156 31.444 26.523 591 H GLY 78 HN GLY 78 34.519 27.882 27.319 592 1HA GLY 78 HA2 GLY 78 33.676 25.348 25.985 593 2HA GLY 78 HA1 GLY 78 34.651 25.465 27.450 594 H GLY 79 HN GLY 79 32.639 23.761 27.708 595 1HA GLY 79 HA2 GLY 79 30.911 23.316 29.254 596 2HA GLY 79 HA1 GLY 79 30.940 25.018 29.716 597 H ASN 80 HN ASN 80 28.538 24.762 29.658 598 HA ASN 80 HA ASN 80 27.186 24.277 27.153 599 1HB ASN 80 HB2 ASN 80 26.288 25.606 29.724 600 2HB ASN 80 HB1 ASN 80 25.213 25.292 28.361 601 1HD2 ASN 80 HD22 ASN 80 25.599 21.652 28.766 602 2HD2 ASN 80 HD21 ASN 80 25.700 22.796 27.516 603 H LEU 81 HN LEU 81 26.171 25.834 25.785 604 HA LEU 81 HA LEU 81 27.608 28.429 25.687 605 1HB LEU 81 HB2 LEU 81 25.560 27.351 23.731 606 2HB LEU 81 HB1 LEU 81 26.768 28.605 23.447 607 HG LEU 81 HG LEU 81 27.296 25.661 23.945 608 1HD1 LEU 81 HD12 LEU 81 26.517 26.379 21.657 609 2HD1 LEU 81 HD11 LEU 81 27.950 27.402 21.554 610 3HD1 LEU 81 HD13 LEU 81 28.122 25.652 21.677 611 1HD2 LEU 81 HD23 LEU 81 29.129 28.057 23.822 612 2HD2 LEU 81 HD22 LEU 81 29.094 26.765 25.020 613 3HD2 LEU 81 HD21 LEU 81 29.710 26.447 23.400 614 H ALA 82 HN ALA 82 24.738 27.170 26.943 615 HA ALA 82 HA ALA 82 23.752 29.730 27.775 616 1HB ALA 82 HB2 ALA 82 22.414 28.448 25.382 617 2HB ALA 82 HB1 ALA 82 21.587 29.611 26.418 618 3HB ALA 82 HB3 ALA 82 23.028 30.095 25.522 619 H HIS 83 HN HIS 83 21.491 29.450 28.799 620 HA HIS 83 HA HIS 83 20.511 26.765 29.256 621 1HB HIS 83 HB2 HIS 83 21.081 26.607 31.652 622 2HB HIS 83 HB1 HIS 83 22.536 26.650 30.659 623 HD1 HIS 83 HD1 HIS 83 24.196 28.461 31.171 624 HD2 HIS 83 HD2 HIS 83 20.461 29.254 32.842 625 HE1 HIS 83 HE1 HIS 83 24.481 30.522 32.615 626 H ALA 84 HN ALA 84 18.806 26.836 31.095 627 HA ALA 84 HA ALA 84 17.704 29.558 31.557 628 1HB ALA 84 HB1 ALA 84 16.291 27.337 30.061 629 2HB ALA 84 HB3 ALA 84 15.430 28.687 30.798 630 3HB ALA 84 HB2 ALA 84 16.596 28.984 29.509 631 H PHE 85 HN PHE 85 15.825 29.443 33.106 632 HA PHE 85 HA PHE 85 16.370 27.381 35.173 633 1HB PHE 85 HB2 PHE 85 14.793 29.966 35.184 634 2HB PHE 85 HB1 PHE 85 14.793 28.843 36.545 635 HD1 PHE 85 HD1 PHE 85 16.852 28.416 37.831 636 HD2 PHE 85 HD2 PHE 85 16.761 31.273 34.624 637 HE1 PHE 85 HE1 PHE 85 18.999 29.373 38.622 638 HE2 PHE 85 HE2 PHE 85 18.909 32.230 35.415 639 HZ PHE 85 HZ PHE 85 20.028 31.279 37.414 640 H GLN 86 HN GLN 86 14.315 26.542 36.337 641 HA GLN 86 HA GLN 86 12.727 25.160 34.405 642 1HB GLN 86 HB2 GLN 86 12.297 25.527 37.382 643 2HB GLN 86 HB1 GLN 86 11.428 24.364 36.381 644 1HG GLN 86 HG2 GLN 86 14.445 24.439 36.677 645 2HG GLN 86 HG1 GLN 86 13.384 23.362 37.588 646 1HE2 GLN 86 HE21 GLN 86 15.207 23.584 34.736 647 2HE2 GLN 86 HE22 GLN 86 14.479 22.316 33.876 648 HA PRO 87 HA PRO 87 9.553 28.168 33.593 649 1HB PRO 87 HB2 PRO 87 7.347 26.306 33.594 650 2HB PRO 87 HB1 PRO 87 8.210 26.955 32.192 651 1HG PRO 87 HG2 PRO 87 8.394 24.273 33.351 652 2HG PRO 87 HG1 PRO 87 9.090 24.869 31.837 653 1HD PRO 87 HD2 PRO 87 10.522 24.265 34.228 654 2HD PRO 87 HD1 PRO 87 11.156 25.091 32.789 655 H GLY 88 HN GLY 88 9.312 29.394 35.468 656 1HA GLY 88 HA2 GLY 88 7.095 28.697 37.232 657 2HA GLY 88 HA1 GLY 88 8.661 28.673 38.043 658 HA PRO 89 HA PRO 89 6.797 33.075 37.553 659 1HB PRO 89 HB2 PRO 89 6.444 33.329 40.394 660 2HB PRO 89 HB1 PRO 89 5.175 33.247 39.164 661 1HG PRO 89 HG2 PRO 89 6.013 31.167 41.061 662 2HG PRO 89 HG1 PRO 89 4.582 31.200 40.020 663 1HD PRO 89 HD2 PRO 89 6.891 29.575 39.646 664 2HD PRO 89 HD1 PRO 89 5.576 29.832 38.477 665 H GLY 90 HN GLY 90 7.794 35.004 38.928 666 1HA GLY 90 HA2 GLY 90 9.715 36.086 39.726 667 2HA GLY 90 HA1 GLY 90 10.188 34.546 40.440 668 H ILE 91 HN ILE 91 12.243 34.164 39.775 669 HA ILE 91 HA ILE 91 13.215 35.051 37.177 670 HB ILE 91 HB ILE 91 14.620 34.916 39.264 671 1HG1 ILE 91 HG12 ILE 91 15.691 33.183 37.021 672 2HG1 ILE 91 HG11 ILE 91 15.537 34.936 36.891 673 1HG2 ILE 91 HG23 ILE 91 13.644 32.657 39.922 674 2HG2 ILE 91 HG22 ILE 91 14.684 31.946 38.689 675 3HG2 ILE 91 HG21 ILE 91 15.396 32.797 40.060 676 1HD1 ILE 91 HD12 ILE 91 16.935 35.148 38.969 677 2HD1 ILE 91 HD11 ILE 91 17.196 33.405 38.913 678 3HD1 ILE 91 HD13 ILE 91 17.797 34.429 37.609 679 H GLY 92 HN GLY 92 11.531 32.292 38.264 680 1HA GLY 92 HA2 GLY 92 12.646 30.246 36.633 681 2HA GLY 92 HA1 GLY 92 10.967 30.291 37.173 682 H GLY 93 HN GLY 93 12.302 29.687 34.477 683 1HA GLY 93 HA2 GLY 93 11.289 29.812 32.316 684 2HA GLY 93 HA1 GLY 93 10.346 31.200 32.857 685 H ASP 94 HN ASP 94 13.092 32.201 33.995 686 HA ASP 94 HA ASP 94 13.665 33.995 31.832 687 1HB ASP 94 HB2 ASP 94 15.189 33.278 34.344 688 2HB ASP 94 HB1 ASP 94 15.747 34.508 33.209 689 H ALA 95 HN ALA 95 14.988 33.752 30.092 690 HA ALA 95 HA ALA 95 16.682 31.284 29.933 691 1HB ALA 95 HB1 ALA 95 14.940 31.576 28.176 692 2HB ALA 95 HB3 ALA 95 15.695 33.101 27.711 693 3HB ALA 95 HB2 ALA 95 16.572 31.584 27.505 694 H HIS 96 HN HIS 96 18.874 31.533 29.913 695 HA HIS 96 HA HIS 96 19.986 34.304 29.553 696 1HB HIS 96 HB2 HIS 96 20.954 31.952 31.199 697 2HB HIS 96 HB1 HIS 96 21.930 33.390 30.895 698 HD2 HIS 96 HD2 HIS 96 18.361 34.722 31.460 699 HE1 HIS 96 HE1 HIS 96 20.312 34.444 35.231 700 HE2 HIS 96 HE2 HIS 96 18.308 35.381 33.993 701 H PHE 97 HN PHE 97 21.240 34.585 27.790 702 HA PHE 97 HA PHE 97 22.307 32.163 26.369 703 1HB PHE 97 HB2 PHE 97 21.555 34.936 25.432 704 2HB PHE 97 HB1 PHE 97 22.510 33.836 24.438 705 HD1 PHE 97 HD1 PHE 97 19.272 34.183 26.254 706 HD2 PHE 97 HD2 PHE 97 21.475 32.071 23.230 707 HE1 PHE 97 HE1 PHE 97 17.192 33.044 25.533 708 HE2 PHE 97 HE2 PHE 97 19.393 30.932 22.510 709 HZ PHE 97 HZ PHE 97 17.251 31.420 23.662 710 H ASP 98 HN ASP 98 24.504 31.965 26.138 711 HA ASP 98 HA ASP 98 26.259 33.666 27.677 712 1HB ASP 98 HB2 ASP 98 26.655 31.220 27.127 713 2HB ASP 98 HB1 ASP 98 27.065 31.728 25.489 714 H GLU 99 HN GLU 99 26.662 35.717 27.045 715 HA GLU 99 HA GLU 99 26.563 36.528 24.247 716 1HB GLU 99 HB2 GLU 99 25.877 38.016 26.123 717 2HB GLU 99 HB1 GLU 99 27.541 38.048 26.677 718 1HG GLU 99 HG2 GLU 99 28.268 39.112 24.616 719 2HG GLU 99 HG1 GLU 99 26.655 38.946 23.922 720 H ASP 100 HN ASP 100 28.918 35.058 26.190 721 HA ASP 100 HA ASP 100 31.263 36.342 25.018 722 1HB ASP 100 HB2 ASP 100 30.901 33.774 26.589 723 2HB ASP 100 HB1 ASP 100 32.467 34.361 26.039 724 H GLU 101 HN GLU 101 29.050 33.908 24.054 725 HA GLU 101 HA GLU 101 30.904 32.568 22.205 726 1HB GLU 101 HB2 GLU 101 27.899 32.361 22.569 727 2HB GLU 101 HB1 GLU 101 28.853 31.340 21.492 728 1HG GLU 101 HG2 GLU 101 29.371 31.583 24.466 729 2HG GLU 101 HG1 GLU 101 28.385 30.309 23.746 730 H ARG 102 HN ARG 102 30.578 32.631 19.857 731 HA ARG 102 HA ARG 102 29.736 35.323 18.951 732 1HB ARG 102 HB2 ARG 102 31.867 34.357 18.123 733 2HB ARG 102 HB1 ARG 102 30.972 33.014 17.411 734 1HG ARG 102 HG2 ARG 102 29.780 34.520 15.929 735 2HG ARG 102 HG1 ARG 102 30.498 35.926 16.715 736 1HD ARG 102 HD2 ARG 102 32.740 35.188 15.995 737 2HD ARG 102 HD1 ARG 102 32.024 33.784 15.204 738 HE ARG 102 HE ARG 102 30.684 35.925 14.071 739 1HH1 ARG 102 HH21 ARG 102 33.976 35.016 14.559 740 2HH1 ARG 102 HH22 ARG 102 34.548 35.827 13.138 741 1HH2 ARG 102 HH11 ARG 102 31.413 36.987 12.217 742 2HH2 ARG 102 HH12 ARG 102 33.096 36.943 11.812 743 H TRP 103 HN TRP 103 27.555 35.474 18.691 744 HA TRP 103 HA TRP 103 26.003 33.147 17.733 745 1HB TRP 103 HB2 TRP 103 25.150 35.934 18.566 746 2HB TRP 103 HB1 TRP 103 24.050 34.619 18.156 747 HD1 TRP 103 HD1 TRP 103 25.890 36.083 20.997 748 HE1 TRP 103 HE1 TRP 103 25.774 34.531 23.052 749 HE3 TRP 103 HE3 TRP 103 24.080 31.844 18.800 750 HZ2 TRP 103 HZ2 TRP 103 25.014 31.847 23.681 751 HZ3 TRP 103 HZ3 TRP 103 23.670 29.807 20.149 752 HH2 TRP 103 HH2 TRP 103 24.133 29.803 22.585 753 H THR 104 HN THR 104 24.945 33.070 15.762 754 HA THR 104 HA THR 104 25.308 35.364 13.873 755 HB THR 104 HB THR 104 25.952 33.837 12.103 756 HG1 THR 104 HG1 THR 104 26.180 31.687 13.835 757 1HG2 THR 104 HG23 THR 104 27.706 34.675 13.704 758 2HG2 THR 104 HG22 THR 104 27.574 33.135 14.555 759 3HG2 THR 104 HG21 THR 104 28.129 33.174 12.880 760 H ASN 105 HN ASN 105 23.695 35.385 12.178 761 HA ASN 105 HA ASN 105 21.202 33.878 12.898 762 1HB ASN 105 HB2 ASN 105 21.620 36.543 11.516 763 2HB ASN 105 HB1 ASN 105 20.057 35.730 11.613 764 1HD2 ASN 105 HD22 ASN 105 20.614 38.093 14.566 765 2HD2 ASN 105 HD21 ASN 105 20.843 38.320 12.899 766 H ASN 106 HN ASN 106 23.403 32.846 11.257 767 HA ASN 106 HA ASN 106 21.828 32.258 8.799 768 1HB ASN 106 HB2 ASN 106 24.097 32.516 7.537 769 2HB ASN 106 HB1 ASN 106 23.194 33.978 7.940 770 1HD2 ASN 106 HD22 ASN 106 26.109 35.184 9.520 771 2HD2 ASN 106 HD21 ASN 106 24.937 35.430 8.316 772 H PHE 107 HN PHE 107 23.787 30.735 7.510 773 HA PHE 107 HA PHE 107 23.738 28.323 9.151 774 1HB PHE 107 HB2 PHE 107 25.004 28.815 6.439 775 2HB PHE 107 HB1 PHE 107 24.703 27.239 7.172 776 HD1 PHE 107 HD1 PHE 107 22.380 26.429 7.514 777 HD2 PHE 107 HD2 PHE 107 23.221 30.109 5.464 778 HE1 PHE 107 HE1 PHE 107 20.071 26.454 6.607 779 HE2 PHE 107 HE2 PHE 107 20.914 30.133 4.558 780 HZ PHE 107 HZ PHE 107 19.338 28.306 5.129 781 H ARG 108 HN ARG 108 25.631 30.825 9.594 782 HA ARG 108 HA ARG 108 28.309 29.969 9.284 783 1HB ARG 108 HB2 ARG 108 27.007 31.781 11.322 784 2HB ARG 108 HB1 ARG 108 28.746 31.529 11.275 785 1HG ARG 108 HG2 ARG 108 27.301 32.322 8.753 786 2HG ARG 108 HG1 ARG 108 27.673 33.545 9.956 787 1HD ARG 108 HD2 ARG 108 29.757 31.665 8.832 788 2HD ARG 108 HD1 ARG 108 29.424 33.235 8.123 789 HE ARG 108 HE ARG 108 31.037 32.675 10.453 790 1HH1 ARG 108 HH21 ARG 108 28.668 34.922 9.315 791 2HH1 ARG 108 HH22 ARG 108 29.103 36.141 10.465 792 1HH2 ARG 108 HH11 ARG 108 31.605 34.250 11.931 793 2HH2 ARG 108 HH12 ARG 108 30.760 35.763 11.941 794 H GLU 109 HN GLU 109 29.406 30.019 11.870 795 HA GLU 109 HA GLU 109 29.571 27.336 12.548 796 1HB GLU 109 HB2 GLU 109 29.874 29.756 14.341 797 2HB GLU 109 HB1 GLU 109 30.418 28.131 14.762 798 1HG GLU 109 HG2 GLU 109 31.876 28.093 12.779 799 2HG GLU 109 HG1 GLU 109 31.329 29.712 12.339 800 H TYR 110 HN TYR 110 27.608 29.705 14.451 801 HA TYR 110 HA TYR 110 25.897 27.374 15.305 802 1HB TYR 110 HB2 TYR 110 26.699 29.874 16.809 803 2HB TYR 110 HB1 TYR 110 25.434 28.772 17.352 804 HD1 TYR 110 HD2 TYR 110 26.013 26.337 17.756 805 HD2 TYR 110 HD1 TYR 110 28.996 29.372 17.163 806 HE1 TYR 110 HE2 TYR 110 27.724 24.853 18.766 807 HE2 TYR 110 HE1 TYR 110 30.706 27.890 18.174 808 HH TYR 110 HH TYR 110 30.419 25.734 20.001 809 H ASN 111 HN ASN 111 23.711 27.585 15.131 810 HA ASN 111 HA ASN 111 22.681 30.027 13.765 811 1HB ASN 111 HB2 ASN 111 22.190 27.787 12.775 812 2HB ASN 111 HB1 ASN 111 21.354 27.340 14.259 813 1HD2 ASN 111 HD22 ASN 111 19.583 30.504 12.346 814 2HD2 ASN 111 HD21 ASN 111 21.243 30.555 12.692 815 H LEU 112 HN LEU 112 22.051 31.545 15.244 816 HA LEU 112 HA LEU 112 21.440 31.053 17.963 817 1HB LEU 112 HB2 LEU 112 22.007 33.286 17.081 818 2HB LEU 112 HB1 LEU 112 20.488 33.326 16.192 819 HG LEU 112 HG LEU 112 19.249 33.173 18.354 820 1HD1 LEU 112 HD12 LEU 112 22.062 33.119 19.435 821 2HD1 LEU 112 HD11 LEU 112 20.750 33.780 20.408 822 3HD1 LEU 112 HD13 LEU 112 20.690 32.102 19.875 823 1HD2 LEU 112 HD21 LEU 112 19.753 35.362 17.323 824 2HD2 LEU 112 HD23 LEU 112 19.750 35.472 19.083 825 3HD2 LEU 112 HD22 LEU 112 21.278 35.423 18.205 826 H HIS 113 HN HIS 113 19.284 31.268 15.146 827 HA HIS 113 HA HIS 113 16.828 31.168 16.564 828 1HB HIS 113 HB2 HIS 113 16.991 31.678 14.162 829 2HB HIS 113 HB1 HIS 113 17.505 30.023 13.839 830 HD1 HIS 113 HD1 HIS 113 15.248 30.049 12.312 831 HD2 HIS 113 HD2 HIS 113 14.691 30.080 16.443 832 HE1 HIS 113 HE1 HIS 113 12.850 29.354 12.714 833 H ARG 114 HN ARG 114 18.737 28.456 15.181 834 HA ARG 114 HA ARG 114 17.008 26.389 16.103 835 1HB ARG 114 HB2 ARG 114 18.866 26.051 14.467 836 2HB ARG 114 HB1 ARG 114 20.016 26.236 15.792 837 1HG ARG 114 HG2 ARG 114 19.135 24.300 16.929 838 2HG ARG 114 HG1 ARG 114 17.802 24.173 15.779 839 1HD ARG 114 HD2 ARG 114 19.359 23.675 13.968 840 2HD ARG 114 HD1 ARG 114 20.733 23.902 15.052 841 HE ARG 114 HE ARG 114 19.246 21.938 16.304 842 1HH1 ARG 114 HH21 ARG 114 20.520 22.455 13.144 843 2HH1 ARG 114 HH22 ARG 114 20.761 20.771 12.820 844 1HH2 ARG 114 HH11 ARG 114 19.553 19.735 15.903 845 2HH2 ARG 114 HH12 ARG 114 20.213 19.228 14.384 846 H VAL 115 HN VAL 115 19.799 27.951 17.669 847 HA VAL 115 HA VAL 115 19.708 26.273 20.016 848 HB VAL 115 HB VAL 115 20.905 29.016 19.521 849 1HG1 VAL 115 HG11 VAL 115 21.004 27.215 21.946 850 2HG1 VAL 115 HG13 VAL 115 22.231 28.442 21.633 851 3HG1 VAL 115 HG12 VAL 115 20.551 28.918 21.874 852 1HG2 VAL 115 HG23 VAL 115 21.990 26.190 19.559 853 2HG2 VAL 115 HG22 VAL 115 22.057 27.364 18.244 854 3HG2 VAL 115 HG21 VAL 115 23.038 27.602 19.689 855 H ALA 116 HN ALA 116 18.320 29.448 19.204 856 HA ALA 116 HA ALA 116 17.251 30.025 21.783 857 1HB ALA 116 HB3 ALA 116 17.337 31.606 19.801 858 2HB ALA 116 HB2 ALA 116 15.963 30.727 19.130 859 3HB ALA 116 HB1 ALA 116 15.796 31.589 20.660 860 H ALA 117 HN ALA 117 16.000 28.144 19.059 861 HA ALA 117 HA ALA 117 13.404 27.614 20.081 862 1HB ALA 117 HB2 ALA 117 15.220 25.971 18.297 863 2HB ALA 117 HB1 ALA 117 13.541 25.545 18.629 864 3HB ALA 117 HB3 ALA 117 13.920 27.051 17.793 865 H HIS 118 HN HIS 118 16.504 25.940 20.623 866 HA HIS 118 HA HIS 118 15.464 23.727 22.081 867 1HB HIS 118 HB2 HIS 118 17.812 23.851 21.319 868 2HB HIS 118 HB1 HIS 118 18.113 25.156 22.467 869 HD1 HIS 118 HD1 HIS 118 17.746 21.466 22.223 870 HD2 HIS 118 HD2 HIS 118 18.042 24.320 25.248 871 HE1 HIS 118 HE1 HIS 118 18.207 20.196 24.365 872 H GLU 119 HN GLU 119 16.682 26.873 23.286 873 HA GLU 119 HA GLU 119 16.105 26.360 26.036 874 1HB GLU 119 HB2 GLU 119 16.247 28.963 24.483 875 2HB GLU 119 HB1 GLU 119 16.124 28.874 26.241 876 1HG GLU 119 HG2 GLU 119 18.313 27.522 24.645 877 2HG GLU 119 HG1 GLU 119 18.484 29.114 25.384 878 H LEU 120 HN LEU 120 14.151 27.777 23.433 879 HA LEU 120 HA LEU 120 11.914 28.493 25.079 880 1HB LEU 120 HB2 LEU 120 12.105 27.797 22.134 881 2HB LEU 120 HB1 LEU 120 10.637 28.404 22.895 882 HG LEU 120 HG LEU 120 13.303 29.850 22.966 883 1HD1 LEU 120 HD12 LEU 120 10.948 30.079 21.086 884 2HD1 LEU 120 HD11 LEU 120 12.093 31.400 21.318 885 3HD1 LEU 120 HD13 LEU 120 12.650 29.852 20.682 886 1HD2 LEU 120 HD21 LEU 120 10.532 30.443 23.987 887 2HD2 LEU 120 HD23 LEU 120 12.097 30.769 24.733 888 3HD2 LEU 120 HD22 LEU 120 11.522 31.786 23.418 889 H GLY 121 HN GLY 121 12.806 25.530 23.359 890 1HA GLY 121 HA2 GLY 121 10.388 24.101 23.701 891 2HA GLY 121 HA1 GLY 121 11.979 23.348 23.586 892 H HIS 122 HN HIS 122 13.167 24.483 25.912 893 HA HIS 122 HA HIS 122 12.110 22.718 27.933 894 1HB HIS 122 HB2 HIS 122 14.108 24.993 28.066 895 2HB HIS 122 HB1 HIS 122 13.689 24.001 29.463 896 HD1 HIS 122 HD1 HIS 122 13.683 21.222 28.546 897 HD2 HIS 122 HD2 HIS 122 16.418 23.953 26.982 898 HE1 HIS 122 HE1 HIS 122 15.598 19.858 27.603 899 H SER 123 HN SER 123 11.838 26.207 27.331 900 HA SER 123 HA SER 123 10.497 26.983 29.684 901 1HB SER 123 HB2 SER 123 11.210 28.537 27.844 902 2HB SER 123 HB1 SER 123 9.870 27.940 26.871 903 HG SER 123 HG SER 123 9.879 29.767 28.858 904 H LEU 124 HN LEU 124 9.371 25.161 26.909 905 HA LEU 124 HA LEU 124 6.554 25.290 27.722 906 1HB LEU 124 HB2 LEU 124 7.948 23.511 25.696 907 2HB LEU 124 HB1 LEU 124 6.204 23.675 25.882 908 HG LEU 124 HG LEU 124 8.069 25.977 25.226 909 1HD1 LEU 124 HD11 LEU 124 6.298 24.295 23.428 910 2HD1 LEU 124 HD13 LEU 124 7.103 25.783 22.933 911 3HD1 LEU 124 HD12 LEU 124 8.059 24.372 23.386 912 1HD2 LEU 124 HD22 LEU 124 5.074 25.672 25.501 913 2HD2 LEU 124 HD21 LEU 124 6.123 26.929 26.157 914 3HD2 LEU 124 HD23 LEU 124 5.743 26.908 24.437 915 H GLY 125 HN GLY 125 9.212 23.725 28.928 916 1HA GLY 125 HA2 GLY 125 9.245 22.133 30.688 917 2HA GLY 125 HA1 GLY 125 7.529 21.839 30.421 918 H LEU 126 HN LEU 126 9.771 21.700 27.736 919 HA LEU 126 HA LEU 126 9.022 18.919 27.241 920 1HB LEU 126 HB2 LEU 126 10.939 20.813 25.864 921 2HB LEU 126 HB1 LEU 126 10.649 19.169 25.307 922 HG LEU 126 HG LEU 126 8.434 21.211 25.689 923 1HD1 LEU 126 HD11 LEU 126 10.218 21.778 23.904 924 2HD1 LEU 126 HD13 LEU 126 9.601 20.381 23.027 925 3HD1 LEU 126 HD12 LEU 126 8.538 21.741 23.383 926 1HD2 LEU 126 HD21 LEU 126 8.606 18.418 24.549 927 2HD2 LEU 126 HD23 LEU 126 7.406 19.094 25.649 928 3HD2 LEU 126 HD22 LEU 126 7.381 19.530 23.946 929 H SER 127 HN SER 127 10.557 17.144 27.142 930 HA SER 127 HA SER 127 12.817 17.471 29.086 931 1HB SER 127 HB2 SER 127 11.214 15.042 28.251 932 2HB SER 127 HB1 SER 127 12.621 14.979 29.308 933 HG SER 127 HG SER 127 11.227 15.403 30.822 934 H HIS 128 HN HIS 128 14.782 16.232 28.638 935 HA HIS 128 HA HIS 128 15.684 16.538 25.911 936 1HB HIS 128 HB2 HIS 128 16.912 15.200 28.336 937 2HB HIS 128 HB1 HIS 128 17.743 15.342 26.787 938 HD1 HIS 128 HD1 HIS 128 16.889 17.239 29.833 939 HD2 HIS 128 HD2 HIS 128 18.211 18.129 25.980 940 HE1 HIS 128 HE1 HIS 128 17.711 19.635 29.892 941 H SER 129 HN SER 129 16.531 14.722 24.567 942 HA SER 129 HA SER 129 15.411 12.042 25.163 943 1HB SER 129 HB2 SER 129 13.607 13.280 23.965 944 2HB SER 129 HB1 SER 129 14.717 13.557 22.628 945 HG SER 129 HG SER 129 14.122 10.982 23.652 946 H THR 130 HN THR 130 16.163 10.427 23.532 947 HA THR 130 HA THR 130 18.932 11.072 22.648 948 HB THR 130 HB THR 130 19.158 8.614 22.414 949 HG1 THR 130 HG1 THR 130 16.617 8.377 23.588 950 1HG2 THR 130 HG21 THR 130 19.493 9.831 24.622 951 2HG2 THR 130 HG23 THR 130 17.880 9.278 25.071 952 3HG2 THR 130 HG22 THR 130 19.156 8.104 24.750 953 H ASP 131 HN ASP 131 16.121 11.586 21.286 954 HA ASP 131 HA ASP 131 16.396 10.082 18.785 955 1HB ASP 131 HB2 ASP 131 14.173 10.767 19.684 956 2HB ASP 131 HB1 ASP 131 14.623 12.455 19.440 957 H ILE 132 HN ILE 132 17.879 10.655 17.304 958 HA ILE 132 HA ILE 132 19.401 13.054 17.351 959 HB ILE 132 HB ILE 132 18.839 11.112 15.091 960 1HG1 ILE 132 HG12 ILE 132 21.290 11.430 16.845 961 2HG1 ILE 132 HG11 ILE 132 19.990 10.294 17.205 962 1HG2 ILE 132 HG21 ILE 132 20.789 13.415 15.331 963 2HG2 ILE 132 HG23 ILE 132 21.009 12.098 14.179 964 3HG2 ILE 132 HG22 ILE 132 19.592 13.142 14.066 965 1HD1 ILE 132 HD13 ILE 132 20.328 9.223 14.998 966 2HD1 ILE 132 HD12 ILE 132 21.654 10.339 14.669 967 3HD1 ILE 132 HD11 ILE 132 21.793 9.163 15.978 968 H GLY 133 HN GLY 133 16.469 12.201 15.524 969 1HA GLY 133 HA2 GLY 133 16.437 14.638 13.978 970 2HA GLY 133 HA1 GLY 133 15.082 13.532 14.174 971 H ALA 134 HN ALA 134 16.098 14.332 17.251 972 HA ALA 134 HA ALA 134 13.905 16.341 17.489 973 1HB ALA 134 HB3 ALA 134 15.409 14.692 19.534 974 2HB ALA 134 HB2 ALA 134 14.290 15.978 19.977 975 3HB ALA 134 HB1 ALA 134 13.708 14.572 19.087 976 H LEU 135 HN LEU 135 14.306 18.452 18.009 977 HA LEU 135 HA LEU 135 16.986 19.493 17.736 978 1HB LEU 135 HB2 LEU 135 14.417 20.783 18.704 979 2HB LEU 135 HB1 LEU 135 15.913 21.667 18.416 980 HG LEU 135 HG LEU 135 14.444 20.025 16.329 981 1HD1 LEU 135 HD12 LEU 135 13.284 22.134 17.159 982 2HD1 LEU 135 HD11 LEU 135 14.660 23.039 16.530 983 3HD1 LEU 135 HD13 LEU 135 13.645 22.102 15.433 984 1HD2 LEU 135 HD21 LEU 135 17.012 21.597 16.351 985 2HD2 LEU 135 HD23 LEU 135 16.632 20.084 15.527 986 3HD2 LEU 135 HD22 LEU 135 16.039 21.610 14.880 987 H MET 136 HN MET 136 14.981 18.605 20.467 988 HA MET 136 HA MET 136 16.466 20.012 22.479 989 1HB MET 136 HB2 MET 136 14.130 18.913 22.643 990 2HB MET 136 HB1 MET 136 15.000 17.409 22.935 991 1HG MET 136 HG2 MET 136 14.464 18.393 25.081 992 2HG MET 136 HG1 MET 136 16.197 18.551 24.834 993 1HE MET 136 HE1 MET 136 12.840 19.903 24.364 994 2HE MET 136 HE3 MET 136 12.892 21.604 24.840 995 3HE MET 136 HE2 MET 136 13.276 21.138 23.186 996 H TYR 137 HN TYR 137 17.617 17.722 20.430 997 HA TYR 137 HA TYR 137 18.956 15.870 22.108 998 1HB TYR 137 HB2 TYR 137 18.756 15.950 19.511 999 2HB TYR 137 HB1 TYR 137 20.199 16.958 19.579 1000 HD1 TYR 137 HD2 TYR 137 18.810 13.607 20.265 1001 HD2 TYR 137 HD1 TYR 137 22.354 16.030 20.231 1002 HE1 TYR 137 HE2 TYR 137 20.204 11.568 20.496 1003 HE2 TYR 137 HE1 TYR 137 23.749 13.990 20.467 1004 HH TYR 137 HH TYR 137 22.299 10.824 21.012 1005 HA PRO 138 HA PRO 138 21.729 18.736 24.172 1006 1HB PRO 138 HB2 PRO 138 23.786 16.840 24.747 1007 2HB PRO 138 HB1 PRO 138 22.446 17.306 25.805 1008 1HG PRO 138 HG2 PRO 138 22.789 14.821 24.256 1009 2HG PRO 138 HG1 PRO 138 21.660 15.159 25.577 1010 1HD PRO 138 HD2 PRO 138 20.988 14.954 22.826 1011 2HD PRO 138 HD1 PRO 138 19.950 15.599 24.117 1012 H SER 139 HN SER 139 23.138 16.476 21.791 1013 HA SER 139 HA SER 139 25.446 18.225 21.345 1014 1HB SER 139 HB2 SER 139 24.601 15.956 19.546 1015 2HB SER 139 HB1 SER 139 26.222 16.572 19.852 1016 HG SER 139 HG SER 139 26.335 15.276 21.491 1017 H TYR 140 HN TYR 140 25.535 19.869 19.938 1018 HA TYR 140 HA TYR 140 23.231 20.605 18.328 1019 1HB TYR 140 HB2 TYR 140 24.721 22.302 19.340 1020 2HB TYR 140 HB1 TYR 140 26.058 21.715 18.350 1021 HD1 TYR 140 HD1 TYR 140 26.089 22.076 15.925 1022 HD2 TYR 140 HD2 TYR 140 22.893 23.582 18.365 1023 HE1 TYR 140 HE1 TYR 140 25.363 23.545 14.064 1024 HE2 TYR 140 HE2 TYR 140 22.165 25.052 16.505 1025 HH TYR 140 HH TYR 140 23.259 24.675 13.334 1026 H THR 141 HN THR 141 23.146 20.612 15.996 1027 HA THR 141 HA THR 141 25.350 19.240 14.549 1028 HB THR 141 HB THR 141 23.888 17.577 13.569 1029 HG1 THR 141 HG1 THR 141 21.695 17.486 14.352 1030 1HG2 THR 141 HG22 THR 141 24.877 17.167 15.863 1031 2HG2 THR 141 HG21 THR 141 23.312 17.622 16.539 1032 3HG2 THR 141 HG23 THR 141 23.444 16.210 15.491 1033 H PHE 142 HN PHE 142 25.276 19.610 12.273 1034 HA PHE 142 HA PHE 142 24.018 22.139 11.534 1035 1HB PHE 142 HB2 PHE 142 26.292 21.474 10.763 1036 2HB PHE 142 HB1 PHE 142 25.573 20.151 9.850 1037 HD1 PHE 142 HD2 PHE 142 24.193 20.589 7.864 1038 HD2 PHE 142 HD1 PHE 142 26.049 23.785 10.051 1039 HE1 PHE 142 HE2 PHE 142 23.773 22.130 5.968 1040 HE2 PHE 142 HE1 PHE 142 25.630 25.325 8.155 1041 HZ PHE 142 HZ PHE 142 24.493 24.498 6.113 1042 H SER 143 HN SER 143 21.940 22.237 10.822 1043 HA SER 143 HA SER 143 20.807 19.886 9.326 1044 1HB SER 143 HB2 SER 143 19.428 21.835 11.192 1045 2HB SER 143 HB1 SER 143 18.592 20.635 10.211 1046 HG SER 143 HG SER 143 18.979 19.786 12.253 1047 H GLY 144 HN GLY 144 20.055 20.338 7.297 1048 1HA GLY 144 HA2 GLY 144 20.593 22.691 5.903 1049 2HA GLY 144 HA1 GLY 144 19.280 21.599 5.460 1050 H ASP 145 HN ASP 145 17.147 22.030 6.307 1051 HA ASP 145 HA ASP 145 16.737 24.901 6.990 1052 1HB ASP 145 HB2 ASP 145 15.408 23.722 5.151 1053 2HB ASP 145 HB1 ASP 145 14.607 22.824 6.439 1054 H VAL 146 HN VAL 146 15.563 25.494 8.877 1055 HA VAL 146 HA VAL 146 15.748 23.497 11.069 1056 HB VAL 146 HB VAL 146 15.148 26.465 11.085 1057 1HG1 VAL 146 HG11 VAL 146 15.472 24.400 13.264 1058 2HG1 VAL 146 HG13 VAL 146 15.874 26.091 13.571 1059 3HG1 VAL 146 HG12 VAL 146 14.235 25.645 13.097 1060 1HG2 VAL 146 HG22 VAL 146 17.426 25.927 10.310 1061 2HG2 VAL 146 HG21 VAL 146 17.475 26.664 11.911 1062 3HG2 VAL 146 HG23 VAL 146 17.680 24.922 11.736 1063 H GLN 147 HN GLN 147 13.948 22.249 11.245 1064 HA GLN 147 HA GLN 147 11.284 23.602 11.371 1065 1HB GLN 147 HB2 GLN 147 11.938 21.074 9.819 1066 2HB GLN 147 HB1 GLN 147 10.308 21.671 10.119 1067 1HG GLN 147 HG2 GLN 147 12.450 23.291 8.715 1068 2HG GLN 147 HG1 GLN 147 11.246 22.321 7.869 1069 1HE2 GLN 147 HE22 GLN 147 10.198 25.992 8.810 1070 2HE2 GLN 147 HE21 GLN 147 11.780 25.444 8.531 1071 H LEU 148 HN LEU 148 9.698 22.284 12.611 1072 HA LEU 148 HA LEU 148 10.968 20.959 14.877 1073 1HB LEU 148 HB2 LEU 148 8.026 21.108 14.130 1074 2HB LEU 148 HB1 LEU 148 8.669 20.603 15.688 1075 HG LEU 148 HG LEU 148 9.134 23.338 14.464 1076 1HD1 LEU 148 HD13 LEU 148 6.743 22.903 15.041 1077 2HD1 LEU 148 HD12 LEU 148 7.240 22.518 16.689 1078 3HD1 LEU 148 HD11 LEU 148 7.469 24.149 16.058 1079 1HD2 LEU 148 HD23 LEU 148 9.865 22.027 17.089 1080 2HD2 LEU 148 HD22 LEU 148 10.885 22.974 16.006 1081 3HD2 LEU 148 HD21 LEU 148 9.667 23.776 16.992 1082 H ALA 149 HN ALA 149 10.554 18.708 15.482 1083 HA ALA 149 HA ALA 149 10.273 16.941 13.084 1084 1HB ALA 149 HB3 ALA 149 12.347 16.713 14.433 1085 2HB ALA 149 HB2 ALA 149 11.368 16.319 15.846 1086 3HB ALA 149 HB1 ALA 149 11.383 15.236 14.453 1087 H GLN 150 HN GLN 150 8.980 14.960 13.372 1088 HA GLN 150 HA GLN 150 6.405 15.482 14.425 1089 1HB GLN 150 HB2 GLN 150 6.924 13.755 12.688 1090 2HB GLN 150 HB1 GLN 150 7.628 12.751 13.957 1091 1HG GLN 150 HG2 GLN 150 5.507 12.648 15.133 1092 2HG GLN 150 HG1 GLN 150 4.782 13.794 14.003 1093 1HE2 GLN 150 HE22 GLN 150 3.797 10.398 12.853 1094 2HE2 GLN 150 HE21 GLN 150 3.502 11.353 14.225 1095 H ASP 151 HN ASP 151 9.195 13.825 15.867 1096 HA ASP 151 HA ASP 151 7.941 12.703 18.129 1097 1HB ASP 151 HB2 ASP 151 10.345 12.386 17.548 1098 2HB ASP 151 HB1 ASP 151 10.661 14.051 18.037 1099 H ASP 152 HN ASP 152 9.052 16.029 17.555 1100 HA ASP 152 HA ASP 152 8.318 16.928 20.227 1101 1HB ASP 152 HB2 ASP 152 8.988 18.399 17.663 1102 2HB ASP 152 HB1 ASP 152 8.646 19.214 19.189 1103 H ILE 153 HN ILE 153 6.819 17.053 16.993 1104 HA ILE 153 HA ILE 153 4.579 18.681 17.666 1105 HB ILE 153 HB ILE 153 4.710 16.364 15.715 1106 1HG1 ILE 153 HG12 ILE 153 6.429 18.334 15.527 1107 2HG1 ILE 153 HG11 ILE 153 5.562 17.820 14.086 1108 1HG2 ILE 153 HG23 ILE 153 2.781 18.656 16.070 1109 2HG2 ILE 153 HG22 ILE 153 2.921 17.781 14.546 1110 3HG2 ILE 153 HG21 ILE 153 2.431 16.928 16.009 1111 1HD1 ILE 153 HD13 ILE 153 4.605 20.091 15.847 1112 2HD1 ILE 153 HD12 ILE 153 5.672 20.331 14.467 1113 3HD1 ILE 153 HD11 ILE 153 4.054 19.676 14.225 1114 H ASP 154 HN ASP 154 4.871 15.119 17.610 1115 HA ASP 154 HA ASP 154 2.255 14.595 18.619 1116 1HB ASP 154 HB2 ASP 154 4.818 12.987 18.744 1117 2HB ASP 154 HB1 ASP 154 3.259 12.366 19.288 1118 H GLY 155 HN GLY 155 5.353 15.096 20.271 1119 1HA GLY 155 HA2 GLY 155 4.391 14.466 22.902 1120 2HA GLY 155 HA1 GLY 155 5.848 15.387 22.543 1121 H ILE 156 HN ILE 156 4.889 17.651 21.306 1122 HA ILE 156 HA ILE 156 3.827 19.097 23.557 1123 HB ILE 156 HB ILE 156 5.323 20.046 21.728 1124 1HG1 ILE 156 HG12 ILE 156 4.047 22.263 21.696 1125 2HG1 ILE 156 HG11 ILE 156 2.747 21.421 22.533 1126 1HG2 ILE 156 HG21 ILE 156 3.837 19.077 19.889 1127 2HG2 ILE 156 HG23 ILE 156 2.728 20.405 20.225 1128 3HG2 ILE 156 HG22 ILE 156 4.367 20.743 19.665 1129 1HD1 ILE 156 HD11 ILE 156 5.520 21.237 23.675 1130 2HD1 ILE 156 HD13 ILE 156 4.606 22.727 23.898 1131 3HD1 ILE 156 HD12 ILE 156 3.960 21.204 24.499 1132 H GLN 157 HN GLN 157 2.354 17.851 20.574 1133 HA GLN 157 HA GLN 157 -0.198 19.121 20.974 1134 1HB GLN 157 HB2 GLN 157 0.629 16.647 19.441 1135 2HB GLN 157 HB1 GLN 157 -1.035 17.232 19.472 1136 1HG GLN 157 HG2 GLN 157 -0.370 19.358 18.517 1137 2HG GLN 157 HG1 GLN 157 1.335 18.921 18.630 1138 1HE2 GLN 157 HE22 GLN 157 0.205 18.189 15.140 1139 2HE2 GLN 157 HE21 GLN 157 0.314 19.586 16.099 1140 H ALA 158 HN ALA 158 1.128 15.988 22.004 1141 HA ALA 158 HA ALA 158 -1.277 14.915 23.077 1142 1HB ALA 158 HB2 ALA 158 0.998 13.750 22.769 1143 2HB ALA 158 HB1 ALA 158 1.448 14.479 24.311 1144 3HB ALA 158 HB3 ALA 158 0.092 13.353 24.229 1145 H ILE 159 HN ILE 159 1.161 17.077 24.527 1146 HA ILE 159 HA ILE 159 0.031 17.063 27.162 1147 HB ILE 159 HB ILE 159 1.637 19.181 25.701 1148 1HG1 ILE 159 HG12 ILE 159 2.472 17.222 27.861 1149 2HG1 ILE 159 HG11 ILE 159 2.678 16.907 26.139 1150 1HG2 ILE 159 HG22 ILE 159 0.697 18.978 28.569 1151 2HG2 ILE 159 HG21 ILE 159 2.112 19.929 28.122 1152 3HG2 ILE 159 HG23 ILE 159 0.531 20.340 27.461 1153 1HD1 ILE 159 HD11 ILE 159 3.764 19.391 27.481 1154 2HD1 ILE 159 HD13 ILE 159 4.703 17.906 27.323 1155 3HD1 ILE 159 HD12 ILE 159 4.163 18.765 25.881 1156 H TYR 160 HN TYR 160 -0.435 19.358 24.441 1157 HA TYR 160 HA TYR 160 -2.781 20.510 25.882 1158 1HB TYR 160 HB2 TYR 160 -1.226 21.403 23.442 1159 2HB TYR 160 HB1 TYR 160 -2.720 22.178 23.968 1160 HD1 TYR 160 HD2 TYR 160 -2.827 23.438 26.056 1161 HD2 TYR 160 HD1 TYR 160 0.820 21.571 24.771 1162 HE1 TYR 160 HE2 TYR 160 -1.563 24.754 27.735 1163 HE2 TYR 160 HE1 TYR 160 2.085 22.883 26.451 1164 HH TYR 160 HH TYR 160 1.077 25.546 27.838 1165 H GLY 161 HN GLY 161 -2.131 19.774 22.442 1166 1HA GLY 161 HA2 GLY 161 -3.836 17.744 21.851 1167 2HA GLY 161 HA1 GLY 161 -4.970 19.080 22.066 1168 H ARG 162 HN ARG 162 -5.510 18.908 19.787 1169 HA ARG 162 HA ARG 162 -3.399 19.543 17.825 1170 1HB ARG 162 HB2 ARG 162 -6.363 18.976 17.543 1171 2HB ARG 162 HB1 ARG 162 -5.301 19.351 16.185 1172 1HG ARG 162 HG2 ARG 162 -3.886 17.410 16.750 1173 2HG ARG 162 HG1 ARG 162 -4.951 17.031 18.105 1174 1HD ARG 162 HD2 ARG 162 -5.828 17.156 15.205 1175 2HD ARG 162 HD1 ARG 162 -5.473 15.668 16.086 1176 HE ARG 162 HE ARG 162 -7.362 16.884 17.675 1177 1HH1 ARG 162 HH21 ARG 162 -7.088 16.139 14.320 1178 2HH1 ARG 162 HH22 ARG 162 -8.785 15.872 14.103 1179 1HH2 ARG 162 HH11 ARG 162 -9.582 16.535 17.414 1180 2HH2 ARG 162 HH12 ARG 162 -10.199 16.096 15.855 1181 H SER 163 HN SER 163 -3.409 21.456 16.570 1182 HA SER 163 HA SER 163 -4.452 23.788 17.974 1183 1HB SER 163 HB2 SER 163 -3.026 23.507 15.313 1184 2HB SER 163 HB1 SER 163 -3.422 25.046 16.074 1185 HG SER 163 HG SER 163 -1.740 22.980 17.058 1186 H GLN 164 HN GLN 164 -6.749 23.460 17.845 1187 HA GLN 164 HA GLN 164 -8.119 23.077 15.333 1188 1HB GLN 164 HB2 GLN 164 -9.074 24.244 17.969 1189 2HB GLN 164 HB1 GLN 164 -10.133 23.879 16.607 1190 1HG GLN 164 HG2 GLN 164 -10.271 21.956 17.988 1191 2HG GLN 164 HG1 GLN 164 -9.148 21.494 16.710 1192 1HE2 GLN 164 HE22 GLN 164 -7.158 20.450 19.505 1193 2HE2 GLN 164 HE21 GLN 164 -8.265 19.901 18.342 1194 H ASN 165 HN ASN 165 -8.530 24.562 13.764 1195 HA ASN 165 HA ASN 165 -8.751 27.427 14.406 1196 1HB ASN 165 HB2 ASN 165 -6.469 26.271 12.796 1197 2HB ASN 165 HB1 ASN 165 -6.988 27.948 12.613 1198 1HD2 ASN 165 HD22 ASN 165 -4.406 27.290 15.465 1199 2HD2 ASN 165 HD21 ASN 165 -4.536 26.468 13.985 1200 HA PRO 166 HA PRO 166 -11.304 25.640 10.902 1201 1HB PRO 166 HB2 PRO 166 -13.495 27.275 11.932 1202 2HB PRO 166 HB1 PRO 166 -13.409 25.513 11.796 1203 1HG PRO 166 HG2 PRO 166 -13.260 27.051 14.209 1204 2HG PRO 166 HG1 PRO 166 -13.014 25.306 14.045 1205 1HD PRO 166 HD2 PRO 166 -11.014 27.364 14.546 1206 2HD PRO 166 HD1 PRO 166 -10.787 25.603 14.511 1207 H VAL 167 HN VAL 167 -10.867 26.742 9.050 1208 HA VAL 167 HA VAL 167 -10.451 29.651 9.104 1209 HB VAL 167 HB VAL 167 -10.350 27.657 6.819 1210 1HG1 VAL 167 HG13 VAL 167 -9.609 30.585 7.028 1211 2HG1 VAL 167 HG12 VAL 167 -9.016 29.538 5.739 1212 3HG1 VAL 167 HG11 VAL 167 -10.745 29.840 5.905 1213 1HG2 VAL 167 HG23 VAL 167 -8.652 27.316 8.622 1214 2HG2 VAL 167 HG22 VAL 167 -7.926 27.806 7.091 1215 3HG2 VAL 167 HG21 VAL 167 -8.117 28.982 8.392 1216 H GLN 168 HN GLN 168 -11.951 31.143 8.474 1217 HA GLN 168 HA GLN 168 -14.638 30.237 7.802 1218 1HB GLN 168 HB2 GLN 168 -13.678 33.101 7.692 1219 2HB GLN 168 HB1 GLN 168 -15.283 32.502 8.112 1220 1HG GLN 168 HG2 GLN 168 -14.291 31.430 10.148 1221 2HG GLN 168 HG1 GLN 168 -12.755 32.204 9.755 1222 1HE2 GLN 168 HE22 GLN 168 -13.716 35.161 11.385 1223 2HE2 GLN 168 HE21 GLN 168 -12.478 34.086 10.949 1224 HA PRO 169 HA PRO 169 -14.186 30.296 3.391 1225 1HB PRO 169 HB2 PRO 169 -16.632 31.746 2.825 1226 2HB PRO 169 HB1 PRO 169 -16.346 30.004 2.695 1227 1HG PRO 169 HG2 PRO 169 -17.856 31.424 4.743 1228 2HG PRO 169 HG1 PRO 169 -17.673 29.677 4.534 1229 1HD PRO 169 HD2 PRO 169 -16.492 31.279 6.585 1230 2HD PRO 169 HD1 PRO 169 -16.158 29.570 6.247 No H/Q in entry = 1230 Start of MODEL 7 1 1H VAL 1 HT2 VAL 1 9.306 25.819 48.758 2 2H VAL 1 HT1 VAL 1 7.634 26.029 48.970 3 3H VAL 1 HT3 VAL 1 8.499 25.016 50.019 4 HA VAL 1 HA VAL 1 8.696 23.331 48.500 5 HB VAL 1 HB VAL 1 6.163 24.558 47.405 6 1HG1 VAL 1 HG12 VAL 1 7.008 22.210 46.826 7 2HG1 VAL 1 HG11 VAL 1 6.684 21.787 48.506 8 3HG1 VAL 1 HG13 VAL 1 5.364 22.306 47.458 9 1HG2 VAL 1 HG21 VAL 1 6.691 23.639 50.240 10 2HG2 VAL 1 HG23 VAL 1 6.033 25.187 49.711 11 3HG2 VAL 1 HG22 VAL 1 5.070 23.718 49.549 12 H LEU 2 HN LEU 2 7.023 23.745 45.903 13 HA LEU 2 HA LEU 2 8.597 25.531 44.272 14 1HB LEU 2 HB2 LEU 2 9.477 23.487 42.834 15 2HB LEU 2 HB1 LEU 2 10.376 24.024 44.240 16 HG LEU 2 HG LEU 2 9.231 22.271 45.608 17 1HD1 LEU 2 HD11 LEU 2 8.066 21.587 42.909 18 2HD1 LEU 2 HD13 LEU 2 8.107 20.439 44.246 19 3HD1 LEU 2 HD12 LEU 2 7.188 21.936 44.400 20 1HD2 LEU 2 HD22 LEU 2 11.440 21.946 44.351 21 2HD2 LEU 2 HD21 LEU 2 10.586 20.479 44.822 22 3HD2 LEU 2 HD23 LEU 2 10.506 21.049 43.155 23 H THR 3 HN THR 3 8.056 23.415 41.958 24 HA THR 3 HA THR 3 5.265 24.339 41.560 25 HB THR 3 HB THR 3 5.570 23.588 39.245 26 HG1 THR 3 HG1 THR 3 8.236 23.046 39.540 27 1HG2 THR 3 HG21 THR 3 6.445 25.822 40.054 28 2HG2 THR 3 HG23 THR 3 8.041 25.078 40.153 29 3HG2 THR 3 HG22 THR 3 7.221 25.206 38.595 30 H GLU 4 HN GLU 4 3.780 22.688 40.469 31 HA GLU 4 HA GLU 4 3.457 20.419 42.226 32 1HB GLU 4 HB2 GLU 4 1.605 21.672 41.036 33 2HB GLU 4 HB1 GLU 4 2.124 20.889 39.544 34 1HG GLU 4 HG2 GLU 4 1.629 18.706 40.426 35 2HG GLU 4 HG1 GLU 4 1.360 19.358 42.044 36 H GLY 5 HN GLY 5 3.285 18.128 41.332 37 1HA GLY 5 HA2 GLY 5 5.754 17.318 40.151 38 2HA GLY 5 HA1 GLY 5 4.338 16.285 40.332 39 H ASN 6 HN ASN 6 3.969 19.237 38.538 40 HA ASN 6 HA ASN 6 4.465 17.971 35.934 41 1HB ASN 6 HB2 ASN 6 1.696 18.883 36.781 42 2HB ASN 6 HB1 ASN 6 2.150 18.374 35.153 43 1HD2 ASN 6 HD22 ASN 6 1.301 15.579 37.947 44 2HD2 ASN 6 HD21 ASN 6 1.128 17.239 38.258 45 HA PRO 7 HA PRO 7 5.173 22.580 36.546 46 1HB PRO 7 HB2 PRO 7 7.649 22.226 35.053 47 2HB PRO 7 HB1 PRO 7 7.446 22.740 36.733 48 1HG PRO 7 HG2 PRO 7 8.405 20.191 35.805 49 2HG PRO 7 HG1 PRO 7 8.117 20.679 37.481 50 1HD PRO 7 HD2 PRO 7 6.558 18.840 35.869 51 2HD PRO 7 HD1 PRO 7 6.298 19.285 37.568 52 H ARG 8 HN ARG 8 3.487 22.990 35.075 53 HA ARG 8 HA ARG 8 4.334 23.297 32.237 54 1HB ARG 8 HB2 ARG 8 1.852 21.840 33.203 55 2HB ARG 8 HB1 ARG 8 2.067 22.402 31.546 56 1HG ARG 8 HG2 ARG 8 4.088 21.027 31.318 57 2HG ARG 8 HG1 ARG 8 3.925 20.489 32.990 58 1HD ARG 8 HD2 ARG 8 1.845 20.040 30.832 59 2HD ARG 8 HD1 ARG 8 3.008 18.829 31.376 60 HE ARG 8 HE ARG 8 1.759 19.639 33.712 61 1HH1 ARG 8 HH21 ARG 8 0.761 18.485 30.619 62 2HH1 ARG 8 HH22 ARG 8 -0.662 17.706 31.223 63 1HH2 ARG 8 HH11 ARG 8 -0.091 18.630 34.516 64 2HH2 ARG 8 HH12 ARG 8 -1.145 17.787 33.430 65 H TRP 9 HN TRP 9 3.298 25.091 31.243 66 HA TRP 9 HA TRP 9 2.270 27.091 33.058 67 1HB TRP 9 HB2 TRP 9 2.351 26.951 30.032 68 2HB TRP 9 HB1 TRP 9 1.805 28.368 30.931 69 HD1 TRP 9 HD1 TRP 9 4.905 26.471 29.924 70 HE1 TRP 9 HE1 TRP 9 6.997 27.756 30.711 71 HE3 TRP 9 HE3 TRP 9 2.706 30.020 32.866 72 HZ2 TRP 9 HZ2 TRP 9 7.654 29.994 32.369 73 HZ3 TRP 9 HZ3 TRP 9 4.086 31.715 34.035 74 HH2 TRP 9 HH2 TRP 9 6.554 31.706 33.791 75 H GLU 10 HN GLU 10 0.225 27.242 33.796 76 HA GLU 10 HA GLU 10 -1.863 25.485 32.780 77 1HB GLU 10 HB2 GLU 10 -1.918 27.714 34.837 78 2HB GLU 10 HB1 GLU 10 -3.272 26.635 34.500 79 1HG GLU 10 HG2 GLU 10 -2.136 25.687 36.377 80 2HG GLU 10 HG1 GLU 10 -1.682 24.698 34.989 81 H GLN 11 HN GLN 11 -0.917 28.809 32.262 82 HA GLN 11 HA GLN 11 -3.497 29.611 31.144 83 1HB GLN 11 HB2 GLN 11 -0.751 30.894 31.120 84 2HB GLN 11 HB1 GLN 11 -2.171 31.633 30.382 85 1HG GLN 11 HG2 GLN 11 -3.330 31.636 32.536 86 2HG GLN 11 HG1 GLN 11 -1.968 30.812 33.294 87 1HE2 GLN 11 HE22 GLN 11 -1.627 34.520 33.856 88 2HE2 GLN 11 HE21 GLN 11 -2.844 33.390 34.206 89 H THR 12 HN THR 12 -3.970 29.887 28.923 90 HA THR 12 HA THR 12 -2.367 28.183 27.103 91 HB THR 12 HB THR 12 -4.259 28.479 25.544 92 HG1 THR 12 HG1 THR 12 -6.020 29.714 26.211 93 1HG2 THR 12 HG21 THR 12 -4.967 27.762 28.399 94 2HG2 THR 12 HG23 THR 12 -6.047 27.476 27.034 95 3HG2 THR 12 HG22 THR 12 -4.484 26.666 27.105 96 H HIS 13 HN HIS 13 -2.392 31.357 28.061 97 HA HIS 13 HA HIS 13 -1.194 32.292 25.471 98 1HB HIS 13 HB2 HIS 13 -2.639 34.066 27.458 99 2HB HIS 13 HB1 HIS 13 -2.130 34.467 25.819 100 HD1 HIS 13 HD1 HIS 13 -5.146 34.275 27.198 101 HD2 HIS 13 HD2 HIS 13 -3.452 31.803 24.299 102 HE1 HIS 13 HE1 HIS 13 -7.074 33.187 25.968 103 H LEU 14 HN LEU 14 0.783 33.334 25.700 104 HA LEU 14 HA LEU 14 1.771 33.900 28.471 105 1HB LEU 14 HB2 LEU 14 3.296 32.419 26.304 106 2HB LEU 14 HB1 LEU 14 3.940 32.878 27.877 107 HG LEU 14 HG LEU 14 1.515 31.091 27.524 108 1HD1 LEU 14 HD13 LEU 14 4.445 30.417 27.840 109 2HD1 LEU 14 HD12 LEU 14 3.156 29.267 28.193 110 3HD1 LEU 14 HD11 LEU 14 3.350 29.899 26.558 111 1HD2 LEU 14 HD21 LEU 14 3.234 31.934 29.868 112 2HD2 LEU 14 HD23 LEU 14 1.477 31.981 29.724 113 3HD2 LEU 14 HD22 LEU 14 2.302 30.438 29.919 114 H THR 15 HN THR 15 3.620 35.400 28.461 115 HA THR 15 HA THR 15 3.828 37.052 25.963 116 HB THR 15 HB THR 15 3.642 39.066 27.224 117 HG1 THR 15 HG1 THR 15 4.852 37.975 29.036 118 1HG2 THR 15 HG23 THR 15 1.485 37.921 26.816 119 2HG2 THR 15 HG22 THR 15 1.634 37.107 28.373 120 3HG2 THR 15 HG21 THR 15 1.450 38.860 28.308 121 H TYR 16 HN TYR 16 5.874 38.210 25.792 122 HA TYR 16 HA TYR 16 8.001 37.413 27.719 123 1HB TYR 16 HB2 TYR 16 9.471 36.604 25.937 124 2HB TYR 16 HB1 TYR 16 7.981 35.660 25.953 125 HD1 TYR 16 HD1 TYR 16 9.923 38.221 24.155 126 HD2 TYR 16 HD2 TYR 16 6.306 35.906 24.195 127 HE1 TYR 16 HE1 TYR 16 9.493 38.852 21.795 128 HE2 TYR 16 HE2 TYR 16 5.876 36.537 21.836 129 HH TYR 16 HH TYR 16 7.877 38.909 20.175 130 H ARG 17 HN ARG 17 10.000 38.674 27.383 131 HA ARG 17 HA ARG 17 9.715 41.081 25.655 132 1HB ARG 17 HB2 ARG 17 8.746 41.702 27.855 133 2HB ARG 17 HB1 ARG 17 10.248 41.218 28.640 134 1HG ARG 17 HG2 ARG 17 11.484 42.922 27.341 135 2HG ARG 17 HG1 ARG 17 9.984 43.404 26.550 136 1HD ARG 17 HD2 ARG 17 10.364 44.947 28.356 137 2HD ARG 17 HD1 ARG 17 9.049 43.884 28.855 138 HE ARG 17 HE ARG 17 11.357 42.647 29.808 139 1HH1 ARG 17 HH21 ARG 17 9.828 45.725 30.060 140 2HH1 ARG 17 HH22 ARG 17 10.462 46.059 31.637 141 1HH2 ARG 17 HH11 ARG 17 12.203 43.070 31.859 142 2HH2 ARG 17 HH12 ARG 17 11.805 44.554 32.657 143 H ILE 18 HN ILE 18 11.685 41.753 24.864 144 HA ILE 18 HA ILE 18 14.084 40.217 25.706 145 HB ILE 18 HB ILE 18 13.689 42.220 23.459 146 1HG1 ILE 18 HG12 ILE 18 14.055 39.213 23.332 147 2HG1 ILE 18 HG11 ILE 18 12.478 40.002 23.276 148 1HG2 ILE 18 HG22 ILE 18 16.030 40.464 24.248 149 2HG2 ILE 18 HG21 ILE 18 15.894 41.262 22.681 150 3HG2 ILE 18 HG23 ILE 18 16.003 42.225 24.154 151 1HD1 ILE 18 HD11 ILE 18 14.744 40.585 21.351 152 2HD1 ILE 18 HD13 ILE 18 13.401 39.497 21.004 153 3HD1 ILE 18 HD12 ILE 18 13.100 41.215 21.263 154 H GLU 19 HN GLU 19 15.319 41.089 27.295 155 HA GLU 19 HA GLU 19 14.858 43.733 28.299 156 1HB GLU 19 HB2 GLU 19 15.804 41.789 29.605 157 2HB GLU 19 HB1 GLU 19 17.327 42.043 28.753 158 1HG GLU 19 HG2 GLU 19 17.412 44.363 29.591 159 2HG GLU 19 HG1 GLU 19 15.889 44.106 30.446 160 H ASN 20 HN ASN 20 17.371 42.403 26.145 161 HA ASN 20 HA ASN 20 17.781 45.023 24.968 162 1HB ASN 20 HB2 ASN 20 20.104 45.350 25.652 163 2HB ASN 20 HB1 ASN 20 19.070 45.274 27.079 164 1HD2 ASN 20 HD22 ASN 20 22.004 43.016 27.643 165 2HD2 ASN 20 HD21 ASN 20 21.820 44.675 27.335 166 H TYR 21 HN TYR 21 19.575 44.935 23.307 167 HA TYR 21 HA TYR 21 19.787 42.171 22.152 168 1HB TYR 21 HB2 TYR 21 19.838 44.893 20.810 169 2HB TYR 21 HB1 TYR 21 20.079 43.358 19.978 170 HD1 TYR 21 HD1 TYR 21 18.232 41.780 19.667 171 HD2 TYR 21 HD2 TYR 21 17.650 45.523 21.693 172 HE1 TYR 21 HE1 TYR 21 15.775 41.507 19.463 173 HE2 TYR 21 HE2 TYR 21 15.194 45.250 21.494 174 HH TYR 21 HH TYR 21 13.785 42.480 19.760 175 H THR 22 HN THR 22 21.837 41.396 21.689 176 HA THR 22 HA THR 22 24.094 42.822 22.832 177 HB THR 22 HB THR 22 24.211 40.485 23.104 178 HG1 THR 22 HG1 THR 22 25.975 39.874 21.717 179 1HG2 THR 22 HG23 THR 22 23.414 40.370 20.192 180 2HG2 THR 22 HG22 THR 22 24.031 38.962 21.057 181 3HG2 THR 22 HG21 THR 22 22.537 39.737 21.584 182 HA PRO 23 HA PRO 23 25.283 44.927 19.067 183 1HB PRO 23 HB2 PRO 23 28.100 44.902 19.515 184 2HB PRO 23 HB1 PRO 23 26.974 46.181 19.991 185 1HG PRO 23 HG2 PRO 23 28.287 44.153 21.689 186 2HG PRO 23 HG1 PRO 23 27.482 45.655 22.171 187 1HD PRO 23 HD2 PRO 23 26.441 43.038 22.509 188 2HD PRO 23 HD1 PRO 23 25.531 44.557 22.662 189 H ASP 24 HN ASP 24 25.914 41.752 19.817 190 HA ASP 24 HA ASP 24 27.827 40.991 17.823 191 1HB ASP 24 HB2 ASP 24 25.588 39.464 19.177 192 2HB ASP 24 HB1 ASP 24 26.752 38.710 18.086 193 H LEU 25 HN LEU 25 24.290 41.280 17.782 194 HA LEU 25 HA LEU 25 24.376 41.326 14.811 195 1HB LEU 25 HB2 LEU 25 22.562 39.566 16.492 196 2HB LEU 25 HB1 LEU 25 22.339 39.833 14.770 197 HG LEU 25 HG LEU 25 24.894 38.706 15.954 198 1HD1 LEU 25 HD12 LEU 25 22.965 37.239 16.453 199 2HD1 LEU 25 HD11 LEU 25 22.560 37.214 14.736 200 3HD1 LEU 25 HD13 LEU 25 24.074 36.503 15.296 201 1HD2 LEU 25 HD23 LEU 25 23.772 38.992 13.158 202 2HD2 LEU 25 HD22 LEU 25 25.339 39.526 13.765 203 3HD2 LEU 25 HD21 LEU 25 25.027 37.811 13.529 204 HA PRO 26 HA PRO 26 21.616 44.740 15.505 205 1HB PRO 26 HB2 PRO 26 19.886 44.280 13.258 206 2HB PRO 26 HB1 PRO 26 21.273 45.376 13.330 207 1HG PRO 26 HG2 PRO 26 21.073 42.768 11.990 208 2HG PRO 26 HG1 PRO 26 22.338 43.995 11.837 209 1HD PRO 26 HD2 PRO 26 22.577 41.514 13.200 210 2HD PRO 26 HD1 PRO 26 23.715 42.874 13.285 211 H ARG 27 HN ARG 27 19.415 45.118 16.257 212 HA ARG 27 HA ARG 27 18.208 42.854 17.555 213 1HB ARG 27 HB2 ARG 27 16.533 44.408 18.322 214 2HB ARG 27 HB1 ARG 27 18.075 45.264 18.324 215 1HG ARG 27 HG2 ARG 27 17.484 46.105 16.009 216 2HG ARG 27 HG1 ARG 27 15.865 45.461 16.258 217 1HD ARG 27 HD2 ARG 27 15.853 46.818 18.445 218 2HD ARG 27 HD1 ARG 27 17.249 47.669 17.792 219 HE ARG 27 HE ARG 27 14.517 48.157 17.118 220 1HH1 ARG 27 HH21 ARG 27 17.583 47.748 15.573 221 2HH1 ARG 27 HH22 ARG 27 17.055 48.443 14.079 222 1HH2 ARG 27 HH11 ARG 27 13.843 49.080 15.194 223 2HH2 ARG 27 HH12 ARG 27 14.952 49.204 13.869 224 H ALA 28 HN ALA 28 17.593 44.523 14.528 225 HA ALA 28 HA ALA 28 15.006 43.541 13.944 226 1HB ALA 28 HB1 ALA 28 17.311 44.111 12.057 227 2HB ALA 28 HB3 ALA 28 15.631 43.903 11.562 228 3HB ALA 28 HB2 ALA 28 16.086 45.265 12.586 229 H ASP 29 HN ASP 29 18.186 42.065 13.240 230 HA ASP 29 HA ASP 29 16.949 39.723 12.021 231 1HB ASP 29 HB2 ASP 29 19.786 40.324 12.906 232 2HB ASP 29 HB1 ASP 29 19.308 38.805 12.143 233 H VAL 30 HN VAL 30 18.307 40.517 15.203 234 HA VAL 30 HA VAL 30 18.103 37.827 16.246 235 HB VAL 30 HB VAL 30 18.238 40.536 17.590 236 1HG1 VAL 30 HG13 VAL 30 18.149 37.750 18.747 237 2HG1 VAL 30 HG12 VAL 30 18.924 39.080 19.610 238 3HG1 VAL 30 HG11 VAL 30 17.207 39.166 19.217 239 1HG2 VAL 30 HG21 VAL 30 20.278 38.330 17.181 240 2HG2 VAL 30 HG23 VAL 30 20.247 39.881 16.341 241 3HG2 VAL 30 HG22 VAL 30 20.562 39.823 18.075 242 H ASP 31 HN ASP 31 15.997 40.694 16.366 243 HA ASP 31 HA ASP 31 13.994 39.635 18.073 244 1HB ASP 31 HB2 ASP 31 14.090 42.012 17.358 245 2HB ASP 31 HB1 ASP 31 13.652 41.525 15.721 246 H HIS 32 HN HIS 32 14.359 39.455 14.539 247 HA HIS 32 HA HIS 32 11.942 38.059 13.995 248 1HB HIS 32 HB2 HIS 32 13.349 39.070 12.237 249 2HB HIS 32 HB1 HIS 32 14.602 37.868 12.551 250 HD1 HIS 32 HD1 HIS 32 10.844 37.743 11.864 251 HD2 HIS 32 HD2 HIS 32 14.354 35.776 10.777 252 HE1 HIS 32 HE1 HIS 32 10.171 35.934 10.225 253 H ALA 33 HN ALA 33 15.172 36.853 14.894 254 HA ALA 33 HA ALA 33 14.657 34.082 14.526 255 1HB ALA 33 HB2 ALA 33 16.445 35.517 16.508 256 2HB ALA 33 HB1 ALA 33 16.448 33.768 16.284 257 3HB ALA 33 HB3 ALA 33 16.912 34.829 14.954 258 H ILE 34 HN ILE 34 14.135 36.150 17.383 259 HA ILE 34 HA ILE 34 13.110 34.016 19.037 260 HB ILE 34 HB ILE 34 12.648 37.010 19.202 261 1HG1 ILE 34 HG12 ILE 34 15.035 36.488 19.264 262 2HG1 ILE 34 HG11 ILE 34 14.495 36.951 20.873 263 1HG2 ILE 34 HG21 ILE 34 12.211 34.754 21.167 264 2HG2 ILE 34 HG23 ILE 34 12.316 36.443 21.662 265 3HG2 ILE 34 HG22 ILE 34 11.028 35.920 20.576 266 1HD1 ILE 34 HD13 ILE 34 14.156 34.343 21.183 267 2HD1 ILE 34 HD12 ILE 34 15.302 34.248 19.848 268 3HD1 ILE 34 HD11 ILE 34 15.759 35.055 21.346 269 H GLU 35 HN GLU 35 11.527 36.597 17.145 270 HA GLU 35 HA GLU 35 8.841 35.888 17.744 271 1HB GLU 35 HB2 GLU 35 9.479 38.009 16.661 272 2HB GLU 35 HB1 GLU 35 9.967 37.126 15.215 273 1HG GLU 35 HG2 GLU 35 7.667 36.328 14.896 274 2HG GLU 35 HG1 GLU 35 7.163 37.150 16.374 275 H LYS 36 HN LYS 36 10.984 34.774 15.132 276 HA LYS 36 HA LYS 36 9.045 33.215 13.745 277 1HB LYS 36 HB2 LYS 36 11.247 33.801 12.796 278 2HB LYS 36 HB1 LYS 36 12.036 32.769 13.987 279 1HG LYS 36 HG2 LYS 36 10.867 30.801 13.077 280 2HG LYS 36 HG1 LYS 36 10.044 31.827 11.901 281 1HD LYS 36 HD2 LYS 36 12.216 32.478 10.937 282 2HD LYS 36 HD1 LYS 36 13.048 31.466 12.117 283 1HE LYS 36 HE2 LYS 36 12.781 30.330 9.915 284 2HE LYS 36 HE1 LYS 36 11.970 29.466 11.220 285 1HZ LYS 36 HZ1 LYS 36 10.522 31.463 9.603 286 2HZ LYS 36 HZ3 LYS 36 10.704 29.871 9.046 287 3HZ LYS 36 HZ2 LYS 36 9.899 30.169 10.512 288 H ALA 37 HN ALA 37 11.196 32.383 16.452 289 HA ALA 37 HA ALA 37 10.630 29.593 16.501 290 1HB ALA 37 HB1 ALA 37 12.416 30.885 17.817 291 2HB ALA 37 HB3 ALA 37 11.133 31.265 18.967 292 3HB ALA 37 HB2 ALA 37 11.589 29.586 18.676 293 H PHE 38 HN PHE 38 9.045 32.267 18.296 294 HA PHE 38 HA PHE 38 7.162 30.627 19.662 295 1HB PHE 38 HB2 PHE 38 7.140 33.523 18.802 296 2HB PHE 38 HB1 PHE 38 5.751 32.813 19.626 297 HD1 PHE 38 HD2 PHE 38 6.335 31.396 21.788 298 HD2 PHE 38 HD1 PHE 38 8.849 34.452 20.118 299 HE1 PHE 38 HE2 PHE 38 7.473 31.655 23.976 300 HE2 PHE 38 HE1 PHE 38 9.987 34.711 22.307 301 HZ PHE 38 HZ PHE 38 9.298 33.313 24.235 302 H GLN 39 HN GLN 39 6.976 32.158 16.447 303 HA GLN 39 HA GLN 39 4.267 31.468 15.909 304 1HB GLN 39 HB2 GLN 39 6.634 31.860 14.064 305 2HB GLN 39 HB1 GLN 39 4.988 31.604 13.480 306 1HG GLN 39 HG2 GLN 39 4.227 33.579 14.747 307 2HG GLN 39 HG1 GLN 39 5.870 33.837 15.333 308 1HE2 GLN 39 HE22 GLN 39 7.039 35.212 12.263 309 2HE2 GLN 39 HE21 GLN 39 7.501 34.550 13.757 310 H LEU 40 HN LEU 40 7.272 29.633 15.410 311 HA LEU 40 HA LEU 40 6.125 27.459 13.983 312 1HB LEU 40 HB2 LEU 40 8.474 27.530 15.897 313 2HB LEU 40 HB1 LEU 40 8.074 26.144 14.885 314 HG LEU 40 HG LEU 40 8.611 28.931 13.819 315 1HD1 LEU 40 HD11 LEU 40 10.584 27.758 14.930 316 2HD1 LEU 40 HD13 LEU 40 10.449 26.535 13.667 317 3HD1 LEU 40 HD12 LEU 40 10.814 28.206 13.241 318 1HD2 LEU 40 HD21 LEU 40 7.914 26.287 12.568 319 2HD2 LEU 40 HD23 LEU 40 7.401 27.911 12.114 320 3HD2 LEU 40 HD22 LEU 40 9.017 27.352 11.700 321 H TRP 41 HN TRP 41 6.453 27.983 17.505 322 HA TRP 41 HA TRP 41 5.294 25.407 18.169 323 1HB TRP 41 HB2 TRP 41 5.646 27.947 19.788 324 2HB TRP 41 HB1 TRP 41 5.023 26.442 20.457 325 HD1 TRP 41 HD1 TRP 41 8.162 28.247 19.927 326 HE1 TRP 41 HE1 TRP 41 10.195 26.700 20.256 327 HE3 TRP 41 HE3 TRP 41 5.829 23.697 19.874 328 HZ2 TRP 41 HZ2 TRP 41 10.760 23.909 20.461 329 HZ3 TRP 41 HZ3 TRP 41 7.146 21.613 20.139 330 HH2 TRP 41 HH2 TRP 41 9.606 21.713 20.431 331 H SER 42 HN SER 42 4.007 28.705 17.867 332 HA SER 42 HA SER 42 1.343 28.040 18.761 333 1HB SER 42 HB2 SER 42 2.252 30.359 18.723 334 2HB SER 42 HB1 SER 42 2.235 30.315 16.962 335 HG SER 42 HG SER 42 0.110 30.372 18.796 336 H ASN 43 HN ASN 43 2.990 27.801 15.691 337 HA ASN 43 HA ASN 43 0.753 27.739 13.949 338 1HB ASN 43 HB2 ASN 43 3.448 26.373 13.785 339 2HB ASN 43 HB1 ASN 43 2.262 26.312 12.482 340 1HD2 ASN 43 HD22 ASN 43 2.475 30.054 12.221 341 2HD2 ASN 43 HD21 ASN 43 1.233 28.968 12.622 342 H VAL 44 HN VAL 44 2.236 25.108 15.858 343 HA VAL 44 HA VAL 44 0.074 23.273 14.899 344 HB VAL 44 HB VAL 44 1.480 21.462 15.772 345 1HG1 VAL 44 HG13 VAL 44 2.854 23.472 13.973 346 2HG1 VAL 44 HG12 VAL 44 3.443 21.829 14.223 347 3HG1 VAL 44 HG11 VAL 44 1.865 22.097 13.483 348 1HG2 VAL 44 HG22 VAL 44 3.124 23.786 16.772 349 2HG2 VAL 44 HG21 VAL 44 2.633 22.323 17.624 350 3HG2 VAL 44 HG23 VAL 44 3.905 22.247 16.409 351 H THR 45 HN THR 45 0.210 25.418 17.284 352 HA THR 45 HA THR 45 -1.335 23.656 19.112 353 HB THR 45 HB THR 45 -0.213 24.491 21.095 354 HG1 THR 45 HG1 THR 45 1.757 25.776 19.632 355 1HG2 THR 45 HG21 THR 45 0.847 22.618 19.571 356 2HG2 THR 45 HG23 THR 45 2.086 23.839 19.284 357 3HG2 THR 45 HG22 THR 45 1.769 23.275 20.922 358 HA PRO 46 HA PRO 46 -3.937 27.292 19.050 359 1HB PRO 46 HB2 PRO 46 -5.334 26.871 21.453 360 2HB PRO 46 HB1 PRO 46 -5.757 26.153 19.890 361 1HG PRO 46 HG2 PRO 46 -4.494 24.865 22.245 362 2HG PRO 46 HG1 PRO 46 -5.365 24.118 20.894 363 1HD PRO 46 HD2 PRO 46 -2.542 24.130 21.255 364 2HD PRO 46 HD1 PRO 46 -3.420 23.673 19.778 365 H LEU 47 HN LEU 47 -1.348 26.897 21.015 366 HA LEU 47 HA LEU 47 -1.857 28.876 23.075 367 1HB LEU 47 HB2 LEU 47 0.785 27.845 21.991 368 2HB LEU 47 HB1 LEU 47 0.570 28.743 23.491 369 HG LEU 47 HG LEU 47 -0.701 26.048 22.892 370 1HD1 LEU 47 HD11 LEU 47 1.760 26.849 24.458 371 2HD1 LEU 47 HD13 LEU 47 0.936 25.311 24.713 372 3HD1 LEU 47 HD12 LEU 47 1.643 25.681 23.141 373 1HD2 LEU 47 HD21 LEU 47 -0.742 27.923 25.263 374 2HD2 LEU 47 HD23 LEU 47 -2.092 27.090 24.494 375 3HD2 LEU 47 HD22 LEU 47 -0.961 26.188 25.494 376 H THR 48 HN THR 48 -1.138 31.050 23.138 377 HA THR 48 HA THR 48 -0.216 32.214 20.523 378 HB THR 48 HB THR 48 -1.701 34.124 20.897 379 HG1 THR 48 HG1 THR 48 -2.074 34.384 22.961 380 1HG2 THR 48 HG23 THR 48 -3.132 31.465 21.169 381 2HG2 THR 48 HG22 THR 48 -3.888 32.972 20.652 382 3HG2 THR 48 HG21 THR 48 -2.635 32.228 19.659 383 H PHE 49 HN PHE 49 1.352 33.815 20.725 384 HA PHE 49 HA PHE 49 2.266 34.469 23.516 385 1HB PHE 49 HB2 PHE 49 3.863 34.030 20.980 386 2HB PHE 49 HB1 PHE 49 4.544 34.688 22.467 387 HD1 PHE 49 HD1 PHE 49 3.142 31.698 20.842 388 HD2 PHE 49 HD2 PHE 49 4.809 33.297 24.464 389 HE1 PHE 49 HE1 PHE 49 3.439 29.398 21.721 390 HE2 PHE 49 HE2 PHE 49 5.105 30.996 25.342 391 HZ PHE 49 HZ PHE 49 4.420 29.047 23.970 392 H THR 50 HN THR 50 2.496 36.626 23.982 393 HA THR 50 HA THR 50 2.238 38.594 21.725 394 HB THR 50 HB THR 50 1.218 38.848 24.568 395 HG1 THR 50 HG1 THR 50 -0.378 37.800 23.714 396 1HG2 THR 50 HG23 THR 50 1.308 40.727 22.213 397 2HG2 THR 50 HG22 THR 50 0.061 40.884 23.448 398 3HG2 THR 50 HG21 THR 50 1.762 41.035 23.890 399 H LYS 51 HN LYS 51 3.873 40.026 21.555 400 HA LYS 51 HA LYS 51 6.066 39.969 23.507 401 1HB LYS 51 HB2 LYS 51 6.421 40.116 21.013 402 2HB LYS 51 HB1 LYS 51 5.748 41.745 21.071 403 1HG LYS 51 HG2 LYS 51 7.499 42.415 22.677 404 2HG LYS 51 HG1 LYS 51 8.176 40.787 22.615 405 1HD LYS 51 HD2 LYS 51 8.505 41.075 20.147 406 2HD LYS 51 HD1 LYS 51 7.976 42.750 20.315 407 1HE LYS 51 HE2 LYS 51 10.338 41.507 21.757 408 2HE LYS 51 HE1 LYS 51 10.446 42.580 20.361 409 1HZ LYS 51 HZ2 LYS 51 8.799 43.724 22.355 410 2HZ LYS 51 HZ1 LYS 51 10.304 43.305 23.024 411 3HZ LYS 51 HZ3 LYS 51 10.232 44.331 21.675 412 H VAL 52 HN VAL 52 6.390 41.500 25.101 413 HA VAL 52 HA VAL 52 4.634 43.946 25.071 414 HB VAL 52 HB VAL 52 4.550 43.833 27.490 415 1HG1 VAL 52 HG11 VAL 52 4.026 41.135 26.209 416 2HG1 VAL 52 HG13 VAL 52 3.389 41.645 27.772 417 3HG1 VAL 52 HG12 VAL 52 2.894 42.483 26.301 418 1HG2 VAL 52 HG22 VAL 52 6.526 41.574 27.104 419 2HG2 VAL 52 HG21 VAL 52 6.700 43.019 28.102 420 3HG2 VAL 52 HG23 VAL 52 5.586 41.741 28.588 421 H SER 53 HN SER 53 5.728 45.845 25.097 422 HA SER 53 HA SER 53 8.679 45.776 25.367 423 1HB SER 53 HB2 SER 53 7.580 46.987 23.472 424 2HB SER 53 HB1 SER 53 6.856 48.088 24.640 425 HG SER 53 HG SER 53 9.212 48.260 25.356 426 H GLU 54 HN GLU 54 6.081 46.229 27.427 427 HA GLU 54 HA GLU 54 7.824 47.615 29.397 428 1HB GLU 54 HB2 GLU 54 5.081 48.586 28.546 429 2HB GLU 54 HB1 GLU 54 5.873 49.102 30.034 430 1HG GLU 54 HG2 GLU 54 7.781 49.961 28.721 431 2HG GLU 54 HG1 GLU 54 6.985 49.449 27.232 432 H GLY 55 HN GLY 55 7.196 47.205 31.579 433 1HA GLY 55 HA2 GLY 55 5.935 46.176 33.318 434 2HA GLY 55 HA1 GLY 55 4.840 45.515 32.104 435 H GLN 56 HN GLN 56 5.609 43.797 34.048 436 HA GLN 56 HA GLN 56 8.003 42.301 33.232 437 1HB GLN 56 HB2 GLN 56 5.852 41.798 35.306 438 2HB GLN 56 HB1 GLN 56 7.177 40.673 35.003 439 1HG GLN 56 HG2 GLN 56 8.820 42.334 35.607 440 2HG GLN 56 HG1 GLN 56 7.589 43.595 35.691 441 1HE2 GLN 56 HE22 GLN 56 8.194 42.430 39.179 442 2HE2 GLN 56 HE21 GLN 56 9.120 43.196 37.980 443 H ALA 57 HN ALA 57 8.011 40.393 32.064 444 HA ALA 57 HA ALA 57 5.402 39.568 30.831 445 1HB ALA 57 HB3 ALA 57 7.373 40.456 29.402 446 2HB ALA 57 HB2 ALA 57 8.138 38.903 29.742 447 3HB ALA 57 HB1 ALA 57 6.594 38.959 28.890 448 H ASP 58 HN ASP 58 5.138 37.251 30.432 449 HA ASP 58 HA ASP 58 5.662 35.643 32.714 450 1HB ASP 58 HB2 ASP 58 4.896 34.911 29.879 451 2HB ASP 58 HB1 ASP 58 4.973 33.735 31.193 452 H ILE 59 HN ILE 59 7.374 35.875 29.599 453 HA ILE 59 HA ILE 59 9.567 34.166 30.756 454 HB ILE 59 HB ILE 59 8.793 34.545 27.846 455 1HG1 ILE 59 HG12 ILE 59 8.612 32.040 29.538 456 2HG1 ILE 59 HG11 ILE 59 7.248 33.137 29.321 457 1HG2 ILE 59 HG21 ILE 59 10.973 32.986 29.248 458 2HG2 ILE 59 HG23 ILE 59 10.438 32.590 27.614 459 3HG2 ILE 59 HG22 ILE 59 11.144 34.170 27.953 460 1HD1 ILE 59 HD11 ILE 59 8.769 31.911 27.006 461 2HD1 ILE 59 HD13 ILE 59 7.314 31.191 27.696 462 3HD1 ILE 59 HD12 ILE 59 7.236 32.783 26.942 463 H MET 60 HN MET 60 11.360 35.320 31.184 464 HA MET 60 HA MET 60 11.760 37.953 29.845 465 1HB MET 60 HB2 MET 60 13.240 36.722 32.188 466 2HB MET 60 HB1 MET 60 13.354 38.391 31.634 467 1HG MET 60 HG2 MET 60 10.823 37.071 32.653 468 2HG MET 60 HG1 MET 60 11.831 38.170 33.590 469 1HE MET 60 HE2 MET 60 12.452 40.327 33.062 470 2HE MET 60 HE1 MET 60 12.554 40.655 31.336 471 3HE MET 60 HE3 MET 60 11.402 41.540 32.341 472 H ILE 61 HN ILE 61 13.400 38.255 28.401 473 HA ILE 61 HA ILE 61 15.407 36.046 28.032 474 HB ILE 61 HB ILE 61 14.235 37.909 25.943 475 1HG1 ILE 61 HG12 ILE 61 13.940 34.906 26.172 476 2HG1 ILE 61 HG11 ILE 61 12.751 36.032 26.828 477 1HG2 ILE 61 HG21 ILE 61 16.350 35.753 25.859 478 2HG2 ILE 61 HG23 ILE 61 15.491 36.279 24.413 479 3HG2 ILE 61 HG22 ILE 61 16.479 37.426 25.318 480 1HD1 ILE 61 HD12 ILE 61 13.663 36.154 23.948 481 2HD1 ILE 61 HD11 ILE 61 12.296 35.164 24.460 482 3HD1 ILE 61 HD13 ILE 61 12.246 36.914 24.672 483 H SER 62 HN SER 62 17.460 36.705 28.422 484 HA SER 62 HA SER 62 18.262 39.474 27.752 485 1HB SER 62 HB2 SER 62 19.083 39.985 29.961 486 2HB SER 62 HB1 SER 62 17.399 39.496 30.125 487 HG SER 62 HG SER 62 19.514 37.636 30.326 488 H PHE 63 HN PHE 63 20.666 39.727 28.069 489 HA PHE 63 HA PHE 63 22.083 37.132 27.538 490 1HB PHE 63 HB2 PHE 63 22.565 39.939 26.500 491 2HB PHE 63 HB1 PHE 63 23.700 38.614 26.283 492 HD1 PHE 63 HD1 PHE 63 20.342 39.883 25.403 493 HD2 PHE 63 HD2 PHE 63 23.240 36.775 24.780 494 HE1 PHE 63 HE1 PHE 63 19.061 39.080 23.430 495 HE2 PHE 63 HE2 PHE 63 21.963 35.976 22.811 496 HZ PHE 63 HZ PHE 63 19.875 37.128 22.138 497 H VAL 64 HN VAL 64 23.905 36.696 28.761 498 HA VAL 64 HA VAL 64 24.868 38.803 30.670 499 HB VAL 64 HB VAL 64 25.070 37.068 32.402 500 1HG1 VAL 64 HG11 VAL 64 22.978 38.418 32.178 501 2HG1 VAL 64 HG13 VAL 64 22.291 37.126 31.193 502 3HG1 VAL 64 HG12 VAL 64 22.694 36.827 32.884 503 1HG2 VAL 64 HG23 VAL 64 23.740 35.308 30.318 504 2HG2 VAL 64 HG22 VAL 64 25.372 35.109 30.958 505 3HG2 VAL 64 HG21 VAL 64 23.976 34.860 32.006 506 H ARG 65 HN ARG 65 27.068 38.420 31.470 507 HA ARG 65 HA ARG 65 28.752 36.811 29.566 508 1HB ARG 65 HB2 ARG 65 29.259 39.491 30.881 509 2HB ARG 65 HB1 ARG 65 30.542 38.537 30.137 510 1HG ARG 65 HG2 ARG 65 29.357 38.575 27.994 511 2HG ARG 65 HG1 ARG 65 28.034 39.492 28.723 512 1HD ARG 65 HD2 ARG 65 30.922 40.400 28.524 513 2HD ARG 65 HD1 ARG 65 29.587 40.991 27.529 514 HE ARG 65 HE ARG 65 28.720 41.434 30.119 515 1HH1 ARG 65 HH21 ARG 65 31.512 42.201 28.244 516 2HH1 ARG 65 HH22 ARG 65 31.857 43.660 29.112 517 1HH2 ARG 65 HH11 ARG 65 29.155 43.329 31.264 518 2HH2 ARG 65 HH12 ARG 65 30.522 44.297 30.824 519 H GLY 66 HN GLY 66 30.188 35.407 30.487 520 1HA GLY 66 HA2 GLY 66 31.043 34.023 32.189 521 2HA GLY 66 HA1 GLY 66 31.630 35.559 32.819 522 H ASP 67 HN ASP 67 31.340 35.042 34.999 523 HA ASP 67 HA ASP 67 29.003 33.847 36.116 524 1HB ASP 67 HB2 ASP 67 31.247 34.111 37.259 525 2HB ASP 67 HB1 ASP 67 30.838 35.807 37.519 526 H HIS 68 HN HIS 68 27.056 34.695 36.677 527 HA HIS 68 HA HIS 68 26.727 37.665 36.731 528 1HB HIS 68 HB2 HIS 68 24.569 37.367 35.477 529 2HB HIS 68 HB1 HIS 68 26.008 37.016 34.522 530 HD1 HIS 68 HD1 HIS 68 26.706 34.310 34.628 531 HD2 HIS 68 HD2 HIS 68 22.726 35.322 35.345 532 HE1 HIS 68 HE1 HIS 68 25.354 32.199 34.269 533 H ARG 69 HN ARG 69 26.959 36.400 39.038 534 HA ARG 69 HA ARG 69 25.905 35.925 41.065 535 1HB ARG 69 HB2 ARG 69 23.691 37.486 39.704 536 2HB ARG 69 HB1 ARG 69 23.680 37.029 41.405 537 1HG ARG 69 HG2 ARG 69 25.785 38.256 41.754 538 2HG ARG 69 HG1 ARG 69 25.802 38.722 40.054 539 1HD ARG 69 HD2 ARG 69 23.523 39.763 40.430 540 2HD ARG 69 HD1 ARG 69 23.754 39.501 42.154 541 HE ARG 69 HE ARG 69 24.838 41.650 40.576 542 1HH1 ARG 69 HH21 ARG 69 25.752 39.433 43.062 543 2HH1 ARG 69 HH22 ARG 69 27.138 40.355 43.539 544 1HH2 ARG 69 HH11 ARG 69 26.619 42.852 41.198 545 2HH2 ARG 69 HH12 ARG 69 27.625 42.288 42.489 546 H ASP 70 HN ASP 70 25.871 33.812 39.287 547 HA ASP 70 HA ASP 70 23.287 32.484 40.004 548 1HB ASP 70 HB2 ASP 70 24.680 32.466 37.312 549 2HB ASP 70 HB1 ASP 70 23.498 31.242 37.781 550 H ASN 71 HN ASN 71 23.569 30.046 39.973 551 HA ASN 71 HA ASN 71 26.186 29.402 41.189 552 1HB ASN 71 HB2 ASN 71 23.602 27.847 40.920 553 2HB ASN 71 HB1 ASN 71 25.062 27.183 41.652 554 1HD2 ASN 71 HD22 ASN 71 22.833 28.905 44.236 555 2HD2 ASN 71 HD21 ASN 71 22.457 27.799 43.004 556 H SER 72 HN SER 72 25.340 29.630 38.097 557 HA SER 72 HA SER 72 26.995 27.258 37.294 558 1HB SER 72 HB2 SER 72 24.483 28.261 35.929 559 2HB SER 72 HB1 SER 72 25.545 27.005 35.298 560 HG SER 72 HG SER 72 25.007 26.372 37.794 561 HA PRO 73 HA PRO 73 28.521 31.278 35.452 562 1HB PRO 73 HB2 PRO 73 31.203 30.680 36.274 563 2HB PRO 73 HB1 PRO 73 30.129 31.907 36.962 564 1HG PRO 73 HG2 PRO 73 30.959 29.390 38.162 565 2HG PRO 73 HG1 PRO 73 29.965 30.667 38.879 566 1HD PRO 73 HD2 PRO 73 29.089 28.080 37.891 567 2HD PRO 73 HD1 PRO 73 28.109 29.353 38.641 568 H PHE 74 HN PHE 74 29.594 31.329 33.407 569 HA PHE 74 HA PHE 74 29.916 28.744 32.101 570 1HB PHE 74 HB2 PHE 74 30.463 31.572 31.148 571 2HB PHE 74 HB1 PHE 74 30.563 30.139 30.122 572 HD1 PHE 74 HD1 PHE 74 28.487 28.624 29.964 573 HD2 PHE 74 HD2 PHE 74 28.376 32.625 31.528 574 HE1 PHE 74 HE1 PHE 74 26.034 28.696 29.610 575 HE2 PHE 74 HE2 PHE 74 25.923 32.696 31.170 576 HZ PHE 74 HZ PHE 74 24.752 30.732 30.213 577 H ASP 75 HN ASP 75 31.846 27.738 31.517 578 HA ASP 75 HA ASP 75 34.295 28.760 32.868 579 1HB ASP 75 HB2 ASP 75 33.458 26.365 33.156 580 2HB ASP 75 HB1 ASP 75 33.929 26.098 31.477 581 H GLY 76 HN GLY 76 34.041 30.427 30.893 582 1HA GLY 76 HA2 GLY 76 35.445 31.235 29.147 583 2HA GLY 76 HA1 GLY 76 36.104 29.610 28.958 584 HA PRO 77 HA PRO 77 33.081 30.592 25.509 585 1HB PRO 77 HB2 PRO 77 35.055 29.535 23.656 586 2HB PRO 77 HB1 PRO 77 34.440 31.190 23.767 587 1HG PRO 77 HG2 PRO 77 37.053 30.265 24.533 588 2HG PRO 77 HG1 PRO 77 36.393 31.894 24.737 589 1HD PRO 77 HD2 PRO 77 36.854 29.872 26.786 590 2HD PRO 77 HD1 PRO 77 36.316 31.550 27.003 591 H GLY 78 HN GLY 78 34.472 28.011 27.062 592 1HA GLY 78 HA2 GLY 78 33.163 25.951 25.316 593 2HA GLY 78 HA1 GLY 78 34.431 25.617 26.496 594 H GLY 79 HN GLY 79 32.293 24.047 26.784 595 1HA GLY 79 HA2 GLY 79 31.032 23.349 28.691 596 2HA GLY 79 HA1 GLY 79 31.128 24.988 29.334 597 H ASN 80 HN ASN 80 28.857 25.060 29.719 598 HA ASN 80 HA ASN 80 26.909 24.519 27.661 599 1HB ASN 80 HB2 ASN 80 26.766 26.096 30.243 600 2HB ASN 80 HB1 ASN 80 25.368 25.809 29.206 601 1HD2 ASN 80 HD22 ASN 80 25.780 23.076 31.848 602 2HD2 ASN 80 HD21 ASN 80 25.850 24.767 31.978 603 H LEU 81 HN LEU 81 25.858 25.966 26.275 604 HA LEU 81 HA LEU 81 27.284 28.528 25.790 605 1HB LEU 81 HB2 LEU 81 25.049 27.235 24.194 606 2HB LEU 81 HB1 LEU 81 26.076 28.571 23.678 607 HG LEU 81 HG LEU 81 26.979 25.732 24.252 608 1HD1 LEU 81 HD12 LEU 81 25.729 26.166 22.108 609 2HD1 LEU 81 HD11 LEU 81 26.987 27.321 21.672 610 3HD1 LEU 81 HD13 LEU 81 27.388 25.615 21.871 611 1HD2 LEU 81 HD22 LEU 81 28.483 28.276 23.638 612 2HD2 LEU 81 HD21 LEU 81 28.822 27.073 24.880 613 3HD2 LEU 81 HD23 LEU 81 29.151 26.711 23.187 614 H ALA 82 HN ALA 82 24.517 27.358 27.377 615 HA ALA 82 HA ALA 82 23.668 29.946 28.239 616 1HB ALA 82 HB2 ALA 82 22.117 28.709 25.954 617 2HB ALA 82 HB1 ALA 82 21.415 29.906 27.044 618 3HB ALA 82 HB3 ALA 82 22.799 30.331 26.039 619 H HIS 83 HN HIS 83 21.228 29.669 29.134 620 HA HIS 83 HA HIS 83 20.427 26.978 29.818 621 1HB HIS 83 HB2 HIS 83 20.926 27.109 32.245 622 2HB HIS 83 HB1 HIS 83 22.402 27.119 31.280 623 HD1 HIS 83 HD1 HIS 83 23.563 29.488 30.924 624 HD2 HIS 83 HD2 HIS 83 20.526 29.422 33.778 625 HE1 HIS 83 HE1 HIS 83 23.803 31.616 32.273 626 H ALA 84 HN ALA 84 18.640 27.100 31.555 627 HA ALA 84 HA ALA 84 17.386 29.780 31.777 628 1HB ALA 84 HB3 ALA 84 16.515 28.810 29.660 629 2HB ALA 84 HB2 ALA 84 15.965 27.391 30.552 630 3HB ALA 84 HB1 ALA 84 15.246 28.969 30.876 631 H PHE 85 HN PHE 85 15.588 29.745 33.357 632 HA PHE 85 HA PHE 85 16.128 27.754 35.495 633 1HB PHE 85 HB2 PHE 85 14.542 30.335 35.426 634 2HB PHE 85 HB1 PHE 85 14.625 29.279 36.837 635 HD1 PHE 85 HD2 PHE 85 16.508 31.579 34.664 636 HD2 PHE 85 HD1 PHE 85 16.695 29.011 38.101 637 HE1 PHE 85 HE2 PHE 85 18.672 32.600 35.309 638 HE2 PHE 85 HE1 PHE 85 18.860 30.033 38.747 639 HZ PHE 85 HZ PHE 85 19.848 31.828 37.352 640 H GLN 86 HN GLN 86 14.367 26.566 36.488 641 HA GLN 86 HA GLN 86 12.536 25.441 34.636 642 1HB GLN 86 HB2 GLN 86 12.454 25.474 37.670 643 2HB GLN 86 HB1 GLN 86 11.464 24.424 36.661 644 1HG GLN 86 HG2 GLN 86 14.496 24.474 36.635 645 2HG GLN 86 HG1 GLN 86 13.519 23.283 37.495 646 1HE2 GLN 86 HE22 GLN 86 12.146 22.265 34.103 647 2HE2 GLN 86 HE21 GLN 86 11.441 23.073 35.418 648 HA PRO 87 HA PRO 87 9.314 28.471 34.435 649 1HB PRO 87 HB2 PRO 87 7.116 26.594 34.701 650 2HB PRO 87 HB1 PRO 87 7.715 27.368 33.227 651 1HG PRO 87 HG2 PRO 87 8.097 24.607 34.092 652 2HG PRO 87 HG1 PRO 87 8.566 25.349 32.555 653 1HD PRO 87 HD2 PRO 87 10.329 24.547 34.648 654 2HD PRO 87 HD1 PRO 87 10.752 25.508 33.217 655 H GLY 88 HN GLY 88 9.106 29.706 36.238 656 1HA GLY 88 HA2 GLY 88 7.290 28.941 38.343 657 2HA GLY 88 HA1 GLY 88 8.962 28.905 38.904 658 HA PRO 89 HA PRO 89 7.178 33.311 38.826 659 1HB PRO 89 HB2 PRO 89 7.185 33.583 41.653 660 2HB PRO 89 HB1 PRO 89 5.756 33.361 40.631 661 1HG PRO 89 HG2 PRO 89 7.067 31.407 42.416 662 2HG PRO 89 HG1 PRO 89 5.450 31.345 41.696 663 1HD PRO 89 HD2 PRO 89 7.712 29.815 40.881 664 2HD PRO 89 HD1 PRO 89 6.173 29.978 40.004 665 H GLY 90 HN GLY 90 8.406 35.196 40.048 666 1HA GLY 90 HA2 GLY 90 10.440 36.216 40.616 667 2HA GLY 90 HA1 GLY 90 10.956 34.654 41.246 668 H ILE 91 HN ILE 91 12.798 34.009 40.285 669 HA ILE 91 HA ILE 91 13.578 35.033 37.663 670 HB ILE 91 HB ILE 91 15.191 34.693 39.545 671 1HG1 ILE 91 HG12 ILE 91 15.894 32.918 37.200 672 2HG1 ILE 91 HG11 ILE 91 15.804 34.671 37.049 673 1HG2 ILE 91 HG22 ILE 91 14.112 32.515 40.279 674 2HG2 ILE 91 HG21 ILE 91 14.905 31.747 38.903 675 3HG2 ILE 91 HG23 ILE 91 15.873 32.480 40.183 676 1HD1 ILE 91 HD13 ILE 91 17.442 34.851 38.948 677 2HD1 ILE 91 HD12 ILE 91 17.614 33.097 38.901 678 3HD1 ILE 91 HD11 ILE 91 18.105 34.068 37.514 679 H GLY 92 HN GLY 92 11.706 32.410 38.672 680 1HA GLY 92 HA2 GLY 92 12.551 30.340 36.914 681 2HA GLY 92 HA1 GLY 92 10.908 30.526 37.517 682 H GLY 93 HN GLY 93 12.108 29.906 34.758 683 1HA GLY 93 HA2 GLY 93 11.083 30.192 32.630 684 2HA GLY 93 HA1 GLY 93 10.205 31.582 33.261 685 H ASP 94 HN ASP 94 12.943 32.590 34.327 686 HA ASP 94 HA ASP 94 13.481 34.353 32.138 687 1HB ASP 94 HB2 ASP 94 15.124 33.641 34.581 688 2HB ASP 94 HB1 ASP 94 15.576 34.911 33.442 689 H ALA 95 HN ALA 95 14.739 34.086 30.357 690 HA ALA 95 HA ALA 95 16.383 31.592 30.136 691 1HB ALA 95 HB3 ALA 95 14.505 32.196 28.460 692 2HB ALA 95 HB2 ALA 95 15.618 33.425 27.858 693 3HB ALA 95 HB1 ALA 95 16.066 31.720 27.795 694 H HIS 96 HN HIS 96 18.578 31.850 30.304 695 HA HIS 96 HA HIS 96 19.731 34.584 29.842 696 1HB HIS 96 HB2 HIS 96 20.661 32.227 31.499 697 2HB HIS 96 HB1 HIS 96 21.686 33.622 31.160 698 HD2 HIS 96 HD2 HIS 96 18.088 34.957 31.782 699 HE1 HIS 96 HE1 HIS 96 20.229 34.947 35.457 700 HE2 HIS 96 HE2 HIS 96 18.145 35.765 34.271 701 H PHE 97 HN PHE 97 21.115 34.869 28.163 702 HA PHE 97 HA PHE 97 22.038 32.449 26.642 703 1HB PHE 97 HB2 PHE 97 21.394 35.274 25.801 704 2HB PHE 97 HB1 PHE 97 22.309 34.181 24.764 705 HD1 PHE 97 HD1 PHE 97 19.103 34.533 26.635 706 HD2 PHE 97 HD2 PHE 97 21.195 32.550 23.452 707 HE1 PHE 97 HE1 PHE 97 16.975 33.505 25.874 708 HE2 PHE 97 HE2 PHE 97 19.068 31.529 22.690 709 HZ PHE 97 HZ PHE 97 16.959 32.007 23.903 710 H ASP 98 HN ASP 98 24.231 32.148 26.414 711 HA ASP 98 HA ASP 98 26.066 33.768 27.949 712 1HB ASP 98 HB2 ASP 98 26.368 31.323 27.466 713 2HB ASP 98 HB1 ASP 98 26.734 31.740 25.788 714 H GLU 99 HN GLU 99 26.644 35.794 27.310 715 HA GLU 99 HA GLU 99 26.570 36.596 24.501 716 1HB GLU 99 HB2 GLU 99 25.926 38.257 26.076 717 2HB GLU 99 HB1 GLU 99 27.347 37.991 27.063 718 1HG GLU 99 HG2 GLU 99 27.430 40.088 25.667 719 2HG GLU 99 HG1 GLU 99 28.776 38.994 25.377 720 H ASP 100 HN ASP 100 28.880 35.045 26.441 721 HA ASP 100 HA ASP 100 31.250 36.251 25.232 722 1HB ASP 100 HB2 ASP 100 30.829 33.723 26.854 723 2HB ASP 100 HB1 ASP 100 32.409 34.252 26.277 724 H GLU 101 HN GLU 101 28.909 34.040 24.220 725 HA GLU 101 HA GLU 101 30.673 32.498 22.434 726 1HB GLU 101 HB2 GLU 101 27.648 32.576 22.684 727 2HB GLU 101 HB1 GLU 101 28.570 31.405 21.740 728 1HG GLU 101 HG2 GLU 101 28.841 31.807 24.732 729 2HG GLU 101 HG1 GLU 101 27.919 30.511 23.972 730 H ARG 102 HN ARG 102 30.511 32.615 20.099 731 HA ARG 102 HA ARG 102 29.787 35.338 19.149 732 1HB ARG 102 HB2 ARG 102 31.975 34.317 18.507 733 2HB ARG 102 HB1 ARG 102 31.100 33.038 17.664 734 1HG ARG 102 HG2 ARG 102 30.086 34.653 16.157 735 2HG ARG 102 HG1 ARG 102 30.801 35.993 17.056 736 1HD ARG 102 HD2 ARG 102 32.162 35.568 15.085 737 2HD ARG 102 HD1 ARG 102 33.068 35.078 16.516 738 HE ARG 102 HE ARG 102 31.785 32.756 15.731 739 1HH1 ARG 102 HH21 ARG 102 33.788 35.129 14.235 740 2HH1 ARG 102 HH22 ARG 102 34.502 34.014 13.118 741 1HH2 ARG 102 HH11 ARG 102 32.705 31.287 14.282 742 2HH2 ARG 102 HH12 ARG 102 33.889 31.838 13.144 743 H TRP 103 HN TRP 103 27.721 35.601 18.486 744 HA TRP 103 HA TRP 103 26.157 33.266 17.552 745 1HB TRP 103 HB2 TRP 103 25.345 36.136 18.089 746 2HB TRP 103 HB1 TRP 103 24.242 34.814 17.705 747 HD1 TRP 103 HD1 TRP 103 25.806 36.507 20.558 748 HE1 TRP 103 HE1 TRP 103 25.546 35.119 22.715 749 HE3 TRP 103 HE3 TRP 103 24.284 32.053 18.571 750 HZ2 TRP 103 HZ2 TRP 103 24.798 32.472 23.496 751 HZ3 TRP 103 HZ3 TRP 103 23.807 30.118 20.043 752 HH2 TRP 103 HH2 TRP 103 24.060 30.322 22.503 753 H THR 104 HN THR 104 25.269 33.094 15.492 754 HA THR 104 HA THR 104 25.935 35.215 13.491 755 HB THR 104 HB THR 104 26.595 33.471 11.880 756 HG1 THR 104 HG1 THR 104 26.962 31.496 13.676 757 1HG2 THR 104 HG22 THR 104 28.266 34.558 13.424 758 2HG2 THR 104 HG21 THR 104 28.137 33.135 14.457 759 3HG2 THR 104 HG23 THR 104 28.752 32.978 12.811 760 H ASN 105 HN ASN 105 24.654 34.810 11.415 761 HA ASN 105 HA ASN 105 21.954 33.644 12.051 762 1HB ASN 105 HB2 ASN 105 22.693 36.128 10.478 763 2HB ASN 105 HB1 ASN 105 21.082 35.410 10.468 764 1HD2 ASN 105 HD22 ASN 105 21.377 38.031 13.202 765 2HD2 ASN 105 HD21 ASN 105 21.750 38.070 11.547 766 H ASN 106 HN ASN 106 24.334 32.410 10.687 767 HA ASN 106 HA ASN 106 22.895 31.577 8.217 768 1HB ASN 106 HB2 ASN 106 25.047 31.793 6.915 769 2HB ASN 106 HB1 ASN 106 24.335 33.336 7.391 770 1HD2 ASN 106 HD22 ASN 106 26.997 32.668 10.262 771 2HD2 ASN 106 HD21 ASN 106 25.462 31.952 10.197 772 H PHE 107 HN PHE 107 24.971 30.007 7.157 773 HA PHE 107 HA PHE 107 24.825 27.705 8.911 774 1HB PHE 107 HB2 PHE 107 26.546 28.045 6.445 775 2HB PHE 107 HB1 PHE 107 25.967 26.533 7.147 776 HD1 PHE 107 HD2 PHE 107 23.414 26.194 7.318 777 HD2 PHE 107 HD1 PHE 107 25.244 29.186 4.838 778 HE1 PHE 107 HE2 PHE 107 21.325 26.372 5.994 779 HE2 PHE 107 HE1 PHE 107 23.154 29.367 3.515 780 HZ PHE 107 HZ PHE 107 21.195 27.959 4.094 781 H ARG 108 HN ARG 108 26.555 30.265 9.584 782 HA ARG 108 HA ARG 108 29.264 29.393 9.674 783 1HB ARG 108 HB2 ARG 108 27.735 31.401 11.338 784 2HB ARG 108 HB1 ARG 108 29.453 31.107 11.580 785 1HG ARG 108 HG2 ARG 108 28.424 31.701 8.809 786 2HG ARG 108 HG1 ARG 108 28.692 33.022 9.943 787 1HD ARG 108 HD2 ARG 108 31.013 32.553 10.118 788 2HD ARG 108 HD1 ARG 108 30.842 30.967 9.378 789 HE ARG 108 HE ARG 108 29.969 32.726 7.415 790 1HH1 ARG 108 HH21 ARG 108 32.763 32.358 9.399 791 2HH1 ARG 108 HH22 ARG 108 33.851 33.009 8.219 792 1HH2 ARG 108 HH11 ARG 108 31.375 33.573 5.858 793 2HH2 ARG 108 HH12 ARG 108 33.066 33.696 6.215 794 H GLU 109 HN GLU 109 30.030 29.618 12.349 795 HA GLU 109 HA GLU 109 29.988 26.975 13.224 796 1HB GLU 109 HB2 GLU 109 30.295 29.492 14.873 797 2HB GLU 109 HB1 GLU 109 30.716 27.870 15.427 798 1HG GLU 109 HG2 GLU 109 32.313 27.639 13.564 799 2HG GLU 109 HG1 GLU 109 31.894 29.257 13.000 800 H TYR 110 HN TYR 110 28.008 29.577 14.802 801 HA TYR 110 HA TYR 110 26.040 27.413 15.533 802 1HB TYR 110 HB2 TYR 110 26.956 29.675 17.327 803 2HB TYR 110 HB1 TYR 110 25.781 28.427 17.737 804 HD1 TYR 110 HD2 TYR 110 26.544 25.987 17.750 805 HD2 TYR 110 HD1 TYR 110 29.275 29.298 17.587 806 HE1 TYR 110 HE2 TYR 110 28.385 24.506 18.506 807 HE2 TYR 110 HE1 TYR 110 31.114 27.826 18.348 808 HH TYR 110 HH TYR 110 31.016 24.560 18.232 809 H ASN 111 HN ASN 111 23.878 28.040 15.679 810 HA ASN 111 HA ASN 111 23.213 30.726 14.517 811 1HB ASN 111 HB2 ASN 111 21.585 28.166 14.564 812 2HB ASN 111 HB1 ASN 111 21.095 29.684 13.812 813 1HD2 ASN 111 HD22 ASN 111 23.145 27.195 11.559 814 2HD2 ASN 111 HD21 ASN 111 22.149 26.769 12.866 815 H LEU 112 HN LEU 112 22.283 32.136 15.932 816 HA LEU 112 HA LEU 112 21.744 31.514 18.649 817 1HB LEU 112 HB2 LEU 112 22.158 33.806 17.892 818 2HB LEU 112 HB1 LEU 112 20.665 33.789 16.960 819 HG LEU 112 HG LEU 112 19.361 33.509 19.047 820 1HD1 LEU 112 HD11 LEU 112 22.123 33.427 20.260 821 2HD1 LEU 112 HD13 LEU 112 20.745 33.984 21.210 822 3HD1 LEU 112 HD12 LEU 112 20.756 32.352 20.553 823 1HD2 LEU 112 HD23 LEU 112 19.935 35.776 18.171 824 2HD2 LEU 112 HD22 LEU 112 19.719 35.754 19.921 825 3HD2 LEU 112 HD21 LEU 112 21.343 35.796 19.234 826 H HIS 113 HN HIS 113 19.545 31.670 15.860 827 HA HIS 113 HA HIS 113 17.112 31.429 17.288 828 1HB HIS 113 HB2 HIS 113 17.223 31.948 14.885 829 2HB HIS 113 HB1 HIS 113 17.811 30.320 14.555 830 HD1 HIS 113 HD1 HIS 113 15.801 29.427 13.285 831 HD2 HIS 113 HD2 HIS 113 14.763 31.046 16.983 832 HE1 HIS 113 HE1 HIS 113 13.372 28.827 13.672 833 H ARG 114 HN ARG 114 19.306 28.861 16.109 834 HA ARG 114 HA ARG 114 17.618 26.684 16.814 835 1HB ARG 114 HB2 ARG 114 20.630 26.894 16.653 836 2HB ARG 114 HB1 ARG 114 19.790 25.375 16.976 837 1HG ARG 114 HG2 ARG 114 18.508 25.655 14.880 838 2HG ARG 114 HG1 ARG 114 19.390 27.142 14.543 839 1HD ARG 114 HD2 ARG 114 21.518 25.840 14.596 840 2HD ARG 114 HD1 ARG 114 20.590 24.363 14.809 841 HE ARG 114 HE ARG 114 21.112 25.751 12.328 842 1HH1 ARG 114 HH21 ARG 114 18.587 24.100 14.012 843 2HH1 ARG 114 HH22 ARG 114 17.638 23.849 12.586 844 1HH2 ARG 114 HH11 ARG 114 19.891 25.420 10.480 845 2HH2 ARG 114 HH12 ARG 114 18.375 24.590 10.592 846 H VAL 115 HN VAL 115 19.983 28.489 18.790 847 HA VAL 115 HA VAL 115 19.669 26.757 21.090 848 HB VAL 115 HB VAL 115 20.673 29.610 20.825 849 1HG1 VAL 115 HG13 VAL 115 20.592 27.767 23.232 850 2HG1 VAL 115 HG12 VAL 115 21.621 29.195 23.135 851 3HG1 VAL 115 HG11 VAL 115 19.869 29.369 23.093 852 1HG2 VAL 115 HG23 VAL 115 22.000 26.900 21.097 853 2HG2 VAL 115 HG22 VAL 115 22.166 28.055 19.775 854 3HG2 VAL 115 HG21 VAL 115 22.863 28.417 21.355 855 H ALA 116 HN ALA 116 18.130 29.784 20.035 856 HA ALA 116 HA ALA 116 16.599 30.270 22.379 857 1HB ALA 116 HB3 ALA 116 15.918 30.844 19.478 858 2HB ALA 116 HB2 ALA 116 15.060 31.520 20.863 859 3HB ALA 116 HB1 ALA 116 16.753 31.931 20.589 860 H ALA 117 HN ALA 117 15.775 28.392 19.455 861 HA ALA 117 HA ALA 117 13.170 27.606 20.279 862 1HB ALA 117 HB2 ALA 117 14.215 27.289 17.985 863 2HB ALA 117 HB1 ALA 117 15.085 25.909 18.657 864 3HB ALA 117 HB3 ALA 117 13.323 25.896 18.597 865 H HIS 118 HN HIS 118 16.327 25.995 20.785 866 HA HIS 118 HA HIS 118 15.313 23.712 22.150 867 1HB HIS 118 HB2 HIS 118 17.658 23.906 21.363 868 2HB HIS 118 HB1 HIS 118 17.958 25.138 22.590 869 HD1 HIS 118 HD1 HIS 118 17.075 21.469 22.259 870 HD2 HIS 118 HD2 HIS 118 18.452 24.123 25.165 871 HE1 HIS 118 HE1 HIS 118 17.714 20.066 24.266 872 H GLU 119 HN GLU 119 16.452 26.846 23.433 873 HA GLU 119 HA GLU 119 15.997 26.253 26.180 874 1HB GLU 119 HB2 GLU 119 15.977 28.874 24.664 875 2HB GLU 119 HB1 GLU 119 15.858 28.770 26.422 876 1HG GLU 119 HG2 GLU 119 17.998 27.559 26.512 877 2HG GLU 119 HG1 GLU 119 18.121 27.630 24.755 878 H LEU 120 HN LEU 120 13.823 27.594 23.687 879 HA LEU 120 HA LEU 120 11.642 28.103 25.485 880 1HB LEU 120 HB2 LEU 120 11.697 27.525 22.510 881 2HB LEU 120 HB1 LEU 120 10.228 27.954 23.381 882 HG LEU 120 HG LEU 120 12.736 29.664 23.346 883 1HD1 LEU 120 HD11 LEU 120 10.237 29.730 21.643 884 2HD1 LEU 120 HD13 LEU 120 11.288 31.133 21.831 885 3HD1 LEU 120 HD12 LEU 120 11.914 29.654 21.103 886 1HD2 LEU 120 HD21 LEU 120 9.981 29.945 24.540 887 2HD2 LEU 120 HD23 LEU 120 11.545 30.384 25.226 888 3HD2 LEU 120 HD22 LEU 120 10.815 31.395 23.986 889 H GLY 121 HN GLY 121 12.629 25.257 23.623 890 1HA GLY 121 HA2 GLY 121 10.364 23.632 24.046 891 2HA GLY 121 HA1 GLY 121 12.006 23.008 23.884 892 H HIS 122 HN HIS 122 13.186 24.165 26.184 893 HA HIS 122 HA HIS 122 12.271 22.325 28.214 894 1HB HIS 122 HB2 HIS 122 14.180 24.675 28.326 895 2HB HIS 122 HB1 HIS 122 13.868 23.613 29.700 896 HD1 HIS 122 HD1 HIS 122 13.798 20.883 28.370 897 HD2 HIS 122 HD2 HIS 122 16.643 23.779 27.422 898 HE1 HIS 122 HE1 HIS 122 15.779 19.647 27.391 899 H SER 123 HN SER 123 11.868 25.813 27.702 900 HA SER 123 HA SER 123 10.561 26.393 30.167 901 1HB SER 123 HB2 SER 123 9.770 28.407 29.083 902 2HB SER 123 HB1 SER 123 11.401 28.090 28.498 903 HG SER 123 HG SER 123 9.367 28.480 27.015 904 H LEU 124 HN LEU 124 9.469 24.817 27.258 905 HA LEU 124 HA LEU 124 6.625 25.071 27.933 906 1HB LEU 124 HB2 LEU 124 8.120 23.490 25.833 907 2HB LEU 124 HB1 LEU 124 6.369 23.437 26.008 908 HG LEU 124 HG LEU 124 7.950 25.991 25.588 909 1HD1 LEU 124 HD12 LEU 124 6.555 24.166 23.619 910 2HD1 LEU 124 HD11 LEU 124 6.973 25.838 23.246 911 3HD1 LEU 124 HD13 LEU 124 8.245 24.672 23.610 912 1HD2 LEU 124 HD21 LEU 124 5.021 25.305 25.804 913 2HD2 LEU 124 HD23 LEU 124 5.897 26.687 26.461 914 3HD2 LEU 124 HD22 LEU 124 5.505 26.630 24.748 915 H GLY 125 HN GLY 125 9.150 23.189 29.080 916 1HA GLY 125 HA2 GLY 125 8.918 21.535 30.796 917 2HA GLY 125 HA1 GLY 125 7.228 21.324 30.343 918 H LEU 126 HN LEU 126 9.341 21.318 27.653 919 HA LEU 126 HA LEU 126 8.787 18.484 27.184 920 1HB LEU 126 HB2 LEU 126 10.569 20.396 25.641 921 2HB LEU 126 HB1 LEU 126 10.014 18.819 25.082 922 HG LEU 126 HG LEU 126 8.224 21.172 25.759 923 1HD1 LEU 126 HD13 LEU 126 9.555 21.453 23.676 924 2HD1 LEU 126 HD12 LEU 126 8.911 19.923 23.082 925 3HD1 LEU 126 HD11 LEU 126 7.830 21.292 23.345 926 1HD2 LEU 126 HD22 LEU 126 7.690 18.320 24.931 927 2HD2 LEU 126 HD21 LEU 126 6.887 19.284 26.170 928 3HD2 LEU 126 HD23 LEU 126 6.562 19.593 24.467 929 H SER 127 HN SER 127 10.391 16.823 27.064 930 HA SER 127 HA SER 127 12.811 17.371 28.744 931 1HB SER 127 HB2 SER 127 11.276 14.834 28.140 932 2HB SER 127 HB1 SER 127 12.822 14.849 28.983 933 HG SER 127 HG SER 127 10.910 14.916 30.350 934 H HIS 128 HN HIS 128 14.830 16.357 28.100 935 HA HIS 128 HA HIS 128 15.545 16.718 25.394 936 1HB HIS 128 HB2 HIS 128 16.792 14.993 27.551 937 2HB HIS 128 HB1 HIS 128 17.531 15.240 25.969 938 HD1 HIS 128 HD1 HIS 128 17.045 16.845 29.261 939 HD2 HIS 128 HD2 HIS 128 18.270 18.024 25.455 940 HE1 HIS 128 HE1 HIS 128 18.146 19.109 29.533 941 H SER 129 HN SER 129 16.399 14.841 23.971 942 HA SER 129 HA SER 129 14.881 12.321 24.260 943 1HB SER 129 HB2 SER 129 13.336 13.873 23.062 944 2HB SER 129 HB1 SER 129 14.563 14.093 21.818 945 HG SER 129 HG SER 129 12.820 12.369 21.605 946 H THR 130 HN THR 130 15.608 10.710 22.662 947 HA THR 130 HA THR 130 18.463 11.146 21.934 948 HB THR 130 HB THR 130 18.573 8.718 21.742 949 HG1 THR 130 HG1 THR 130 16.813 7.511 21.642 950 1HG2 THR 130 HG23 THR 130 18.573 9.846 24.029 951 2HG2 THR 130 HG22 THR 130 16.889 9.340 24.175 952 3HG2 THR 130 HG21 THR 130 18.163 8.131 24.022 953 H ASP 131 HN ASP 131 15.695 11.835 20.498 954 HA ASP 131 HA ASP 131 16.063 10.464 17.927 955 1HB ASP 131 HB2 ASP 131 13.803 11.042 18.793 956 2HB ASP 131 HB1 ASP 131 14.219 12.751 18.672 957 H ILE 132 HN ILE 132 17.622 11.134 16.577 958 HA ILE 132 HA ILE 132 19.064 13.573 16.781 959 HB ILE 132 HB ILE 132 18.679 11.719 14.415 960 1HG1 ILE 132 HG12 ILE 132 20.990 11.941 16.363 961 2HG1 ILE 132 HG11 ILE 132 19.664 10.798 16.573 962 1HG2 ILE 132 HG21 ILE 132 20.532 14.056 14.903 963 2HG2 ILE 132 HG23 ILE 132 20.960 12.763 13.783 964 3HG2 ILE 132 HG22 ILE 132 19.517 13.735 13.497 965 1HD1 ILE 132 HD13 ILE 132 21.322 10.943 14.045 966 2HD1 ILE 132 HD12 ILE 132 21.713 9.870 15.390 967 3HD1 ILE 132 HD11 ILE 132 20.191 9.676 14.522 968 H GLY 133 HN GLY 133 16.263 12.713 14.755 969 1HA GLY 133 HA2 GLY 133 16.268 15.192 13.280 970 2HA GLY 133 HA1 GLY 133 14.923 14.057 13.370 971 H ALA 134 HN ALA 134 15.798 14.803 16.505 972 HA ALA 134 HA ALA 134 13.553 16.761 16.711 973 1HB ALA 134 HB2 ALA 134 15.015 15.134 18.812 974 2HB ALA 134 HB1 ALA 134 13.755 16.311 19.173 975 3HB ALA 134 HB3 ALA 134 13.373 14.876 18.224 976 H LEU 135 HN LEU 135 13.893 18.843 17.436 977 HA LEU 135 HA LEU 135 16.559 19.937 17.240 978 1HB LEU 135 HB2 LEU 135 14.026 21.162 18.380 979 2HB LEU 135 HB1 LEU 135 15.488 22.048 17.943 980 HG LEU 135 HG LEU 135 13.850 20.380 16.009 981 1HD1 LEU 135 HD13 LEU 135 12.718 22.466 16.898 982 2HD1 LEU 135 HD12 LEU 135 14.034 23.400 16.184 983 3HD1 LEU 135 HD11 LEU 135 12.968 22.447 15.152 984 1HD2 LEU 135 HD23 LEU 135 16.372 22.015 15.784 985 2HD2 LEU 135 HD22 LEU 135 15.981 20.457 15.055 986 3HD2 LEU 135 HD21 LEU 135 15.282 21.933 14.400 987 H MET 136 HN MET 136 14.624 18.692 19.842 988 HA MET 136 HA MET 136 16.086 19.969 21.994 989 1HB MET 136 HB2 MET 136 14.426 17.426 22.014 990 2HB MET 136 HB1 MET 136 14.913 18.352 23.432 991 1HG MET 136 HG2 MET 136 13.155 19.371 21.180 992 2HG MET 136 HG1 MET 136 12.591 18.884 22.777 993 1HE MET 136 HE3 MET 136 13.357 19.682 24.830 994 2HE MET 136 HE2 MET 136 15.019 20.265 24.771 995 3HE MET 136 HE1 MET 136 13.721 21.371 25.213 996 H TYR 137 HN TYR 137 17.392 18.124 19.769 997 HA TYR 137 HA TYR 137 18.534 15.928 21.171 998 1HB TYR 137 HB2 TYR 137 18.471 16.413 18.628 999 2HB TYR 137 HB1 TYR 137 19.931 17.357 18.913 1000 HD1 TYR 137 HD2 TYR 137 18.492 14.010 19.852 1001 HD2 TYR 137 HD1 TYR 137 21.965 16.235 18.660 1002 HE1 TYR 137 HE2 TYR 137 19.823 11.921 19.836 1003 HE2 TYR 137 HE1 TYR 137 23.299 14.141 18.641 1004 HH TYR 137 HH TYR 137 21.781 10.996 19.118 1005 HA PRO 138 HA PRO 138 21.278 18.285 23.831 1006 1HB PRO 138 HB2 PRO 138 23.179 16.175 24.218 1007 2HB PRO 138 HB1 PRO 138 21.827 16.605 25.277 1008 1HG PRO 138 HG2 PRO 138 22.061 14.319 23.445 1009 2HG PRO 138 HG1 PRO 138 20.863 14.601 24.717 1010 1HD PRO 138 HD2 PRO 138 20.414 14.794 21.917 1011 2HD PRO 138 HD1 PRO 138 19.314 15.337 23.203 1012 H SER 139 HN SER 139 22.649 16.422 21.108 1013 HA SER 139 HA SER 139 25.116 18.022 21.144 1014 1HB SER 139 HB2 SER 139 24.851 15.560 20.343 1015 2HB SER 139 HB1 SER 139 24.259 16.268 18.846 1016 HG SER 139 HG SER 139 26.595 17.307 19.965 1017 H TYR 140 HN TYR 140 25.633 19.682 19.741 1018 HA TYR 140 HA TYR 140 23.388 21.116 18.546 1019 1HB TYR 140 HB2 TYR 140 25.263 22.260 19.732 1020 2HB TYR 140 HB1 TYR 140 26.351 21.744 18.444 1021 HD1 TYR 140 HD1 TYR 140 26.170 22.676 16.183 1022 HD2 TYR 140 HD2 TYR 140 23.576 23.979 19.350 1023 HE1 TYR 140 HE1 TYR 140 25.499 24.640 14.825 1024 HE2 TYR 140 HE2 TYR 140 22.903 25.941 17.990 1025 HH TYR 140 HH TYR 140 24.313 26.510 14.762 1026 H THR 141 HN THR 141 22.790 21.060 16.437 1027 HA THR 141 HA THR 141 24.730 20.353 14.326 1028 HB THR 141 HB THR 141 23.216 18.594 13.396 1029 HG1 THR 141 HG1 THR 141 21.826 19.252 15.744 1030 1HG2 THR 141 HG22 THR 141 25.165 18.079 14.941 1031 2HG2 THR 141 HG21 THR 141 23.989 17.946 16.247 1032 3HG2 THR 141 HG23 THR 141 23.910 16.842 14.875 1033 H PHE 142 HN PHE 142 24.371 21.992 12.879 1034 HA PHE 142 HA PHE 142 21.784 23.365 12.834 1035 1HB PHE 142 HB2 PHE 142 22.855 25.054 11.652 1036 2HB PHE 142 HB1 PHE 142 24.227 24.342 12.493 1037 HD1 PHE 142 HD2 PHE 142 22.361 24.322 9.268 1038 HD2 PHE 142 HD1 PHE 142 26.035 23.366 11.278 1039 HE1 PHE 142 HE2 PHE 142 23.431 23.853 7.083 1040 HE2 PHE 142 HE1 PHE 142 27.107 22.899 9.089 1041 HZ PHE 142 HZ PHE 142 25.801 23.144 6.992 1042 H SER 143 HN SER 143 20.144 22.992 11.424 1043 HA SER 143 HA SER 143 20.571 20.970 9.271 1044 1HB SER 143 HB2 SER 143 18.133 20.808 9.218 1045 2HB SER 143 HB1 SER 143 18.690 20.640 10.880 1046 HG SER 143 HG SER 143 17.975 23.144 9.783 1047 H GLY 144 HN GLY 144 19.626 21.459 7.116 1048 1HA GLY 144 HA2 GLY 144 20.415 24.012 6.128 1049 2HA GLY 144 HA1 GLY 144 19.389 22.874 5.254 1050 H ASP 145 HN ASP 145 17.246 22.752 7.114 1051 HA ASP 145 HA ASP 145 16.184 25.564 7.105 1052 1HB ASP 145 HB2 ASP 145 14.795 22.996 6.269 1053 2HB ASP 145 HB1 ASP 145 13.953 24.522 6.550 1054 H VAL 146 HN VAL 146 15.046 26.118 8.989 1055 HA VAL 146 HA VAL 146 15.203 24.149 11.208 1056 HB VAL 146 HB VAL 146 14.269 27.032 11.296 1057 1HG1 VAL 146 HG13 VAL 146 15.294 25.124 13.422 1058 2HG1 VAL 146 HG12 VAL 146 14.863 26.813 13.692 1059 3HG1 VAL 146 HG11 VAL 146 13.622 25.649 13.225 1060 1HG2 VAL 146 HG23 VAL 146 17.029 25.827 11.635 1061 2HG2 VAL 146 HG22 VAL 146 16.535 27.029 10.444 1062 3HG2 VAL 146 HG21 VAL 146 16.609 27.459 12.153 1063 H GLN 147 HN GLN 147 13.481 22.779 11.298 1064 HA GLN 147 HA GLN 147 10.747 23.966 11.294 1065 1HB GLN 147 HB2 GLN 147 11.666 21.605 9.620 1066 2HB GLN 147 HB1 GLN 147 9.970 21.977 9.931 1067 1HG GLN 147 HG2 GLN 147 11.939 23.892 8.644 1068 2HG GLN 147 HG1 GLN 147 10.779 22.905 7.757 1069 1HE2 GLN 147 HE22 GLN 147 9.523 26.416 9.032 1070 2HE2 GLN 147 HE21 GLN 147 11.134 25.998 8.701 1071 H LEU 148 HN LEU 148 9.177 22.577 12.382 1072 HA LEU 148 HA LEU 148 10.347 21.170 14.652 1073 1HB LEU 148 HB2 LEU 148 7.457 21.351 13.739 1074 2HB LEU 148 HB1 LEU 148 8.001 20.741 15.301 1075 HG LEU 148 HG LEU 148 8.549 23.547 14.278 1076 1HD1 LEU 148 HD13 LEU 148 6.137 23.159 14.661 1077 2HD1 LEU 148 HD12 LEU 148 6.492 22.575 16.286 1078 3HD1 LEU 148 HD11 LEU 148 6.807 24.259 15.867 1079 1HD2 LEU 148 HD21 LEU 148 9.166 22.047 16.825 1080 2HD2 LEU 148 HD23 LEU 148 10.197 23.133 15.894 1081 3HD2 LEU 148 HD22 LEU 148 8.903 23.789 16.889 1082 H ALA 149 HN ALA 149 9.915 18.900 15.136 1083 HA ALA 149 HA ALA 149 9.742 17.225 12.656 1084 1HB ALA 149 HB3 ALA 149 10.962 16.712 15.382 1085 2HB ALA 149 HB2 ALA 149 10.768 15.458 14.156 1086 3HB ALA 149 HB1 ALA 149 11.805 16.849 13.839 1087 H GLN 150 HN GLN 150 8.548 15.158 12.911 1088 HA GLN 150 HA GLN 150 5.927 15.553 13.933 1089 1HB GLN 150 HB2 GLN 150 6.511 13.900 12.169 1090 2HB GLN 150 HB1 GLN 150 7.351 12.931 13.379 1091 1HG GLN 150 HG2 GLN 150 5.269 12.618 14.621 1092 2HG GLN 150 HG1 GLN 150 4.410 13.656 13.482 1093 1HE2 GLN 150 HE22 GLN 150 3.698 10.906 11.415 1094 2HE2 GLN 150 HE21 GLN 150 3.185 12.375 12.095 1095 H ASP 151 HN ASP 151 8.759 13.925 15.329 1096 HA ASP 151 HA ASP 151 7.483 12.846 17.631 1097 1HB ASP 151 HB2 ASP 151 9.784 12.258 16.940 1098 2HB ASP 151 HB1 ASP 151 10.320 13.884 17.356 1099 H ASP 152 HN ASP 152 8.909 16.078 17.070 1100 HA ASP 152 HA ASP 152 8.409 16.934 19.804 1101 1HB ASP 152 HB2 ASP 152 9.083 18.454 17.271 1102 2HB ASP 152 HB1 ASP 152 8.888 19.230 18.844 1103 H ILE 153 HN ILE 153 6.708 17.326 16.699 1104 HA ILE 153 HA ILE 153 4.690 19.109 17.629 1105 HB ILE 153 HB ILE 153 4.609 16.970 15.479 1106 1HG1 ILE 153 HG12 ILE 153 4.787 19.990 15.257 1107 2HG1 ILE 153 HG11 ILE 153 6.198 18.932 15.247 1108 1HG2 ILE 153 HG21 ILE 153 2.602 19.106 16.251 1109 2HG2 ILE 153 HG23 ILE 153 2.623 18.357 14.655 1110 3HG2 ILE 153 HG22 ILE 153 2.322 17.373 16.086 1111 1HD1 ILE 153 HD12 ILE 153 3.884 18.780 13.292 1112 2HD1 ILE 153 HD11 ILE 153 5.469 19.471 12.946 1113 3HD1 ILE 153 HD13 ILE 153 5.312 17.746 13.279 1114 H ASP 154 HN ASP 154 4.679 15.532 17.459 1115 HA ASP 154 HA ASP 154 2.115 15.178 18.636 1116 1HB ASP 154 HB2 ASP 154 4.576 13.415 18.635 1117 2HB ASP 154 HB1 ASP 154 3.017 12.896 19.277 1118 H GLY 155 HN GLY 155 5.325 15.499 20.132 1119 1HA GLY 155 HA2 GLY 155 4.560 14.887 22.798 1120 2HA GLY 155 HA1 GLY 155 5.934 15.896 22.359 1121 H ILE 156 HN ILE 156 4.838 18.148 21.284 1122 HA ILE 156 HA ILE 156 3.769 19.460 23.620 1123 HB ILE 156 HB ILE 156 5.177 20.560 21.824 1124 1HG1 ILE 156 HG12 ILE 156 3.833 22.703 21.884 1125 2HG1 ILE 156 HG11 ILE 156 2.518 21.789 22.617 1126 1HG2 ILE 156 HG22 ILE 156 3.816 19.589 19.934 1127 2HG2 ILE 156 HG21 ILE 156 2.551 20.748 20.336 1128 3HG2 ILE 156 HG23 ILE 156 4.133 21.314 19.804 1129 1HD1 ILE 156 HD11 ILE 156 5.212 21.547 23.905 1130 2HD1 ILE 156 HD13 ILE 156 4.354 23.075 24.095 1131 3HD1 ILE 156 HD12 ILE 156 3.609 21.573 24.635 1132 H GLN 157 HN GLN 157 2.291 18.186 20.663 1133 HA GLN 157 HA GLN 157 -0.319 19.321 21.165 1134 1HB GLN 157 HB2 GLN 157 0.571 16.934 19.524 1135 2HB GLN 157 HB1 GLN 157 -1.097 17.503 19.583 1136 1HG GLN 157 HG2 GLN 157 -0.427 19.683 18.720 1137 2HG GLN 157 HG1 GLN 157 1.271 19.206 18.755 1138 1HE2 GLN 157 HE22 GLN 157 -0.005 18.635 15.284 1139 2HE2 GLN 157 HE21 GLN 157 0.152 19.993 16.292 1140 H ALA 158 HN ALA 158 1.240 16.245 22.013 1141 HA ALA 158 HA ALA 158 -1.041 14.937 23.090 1142 1HB ALA 158 HB3 ALA 158 1.866 14.740 23.934 1143 2HB ALA 158 HB2 ALA 158 0.602 13.597 24.390 1144 3HB ALA 158 HB1 ALA 158 1.075 13.763 22.698 1145 H ILE 159 HN ILE 159 1.271 17.185 24.605 1146 HA ILE 159 HA ILE 159 0.178 16.954 27.256 1147 HB ILE 159 HB ILE 159 1.687 19.235 25.947 1148 1HG1 ILE 159 HG12 ILE 159 2.703 17.090 27.827 1149 2HG1 ILE 159 HG11 ILE 159 2.776 16.927 26.071 1150 1HG2 ILE 159 HG23 ILE 159 0.981 18.628 28.828 1151 2HG2 ILE 159 HG22 ILE 159 2.253 19.760 28.368 1152 3HG2 ILE 159 HG21 ILE 159 0.580 20.077 27.907 1153 1HD1 ILE 159 HD12 ILE 159 4.047 19.071 25.962 1154 2HD1 ILE 159 HD11 ILE 159 4.048 19.128 27.726 1155 3HD1 ILE 159 HD13 ILE 159 4.895 17.830 26.884 1156 H TYR 160 HN TYR 160 -0.346 19.390 24.683 1157 HA TYR 160 HA TYR 160 -2.670 20.459 26.208 1158 1HB TYR 160 HB2 TYR 160 -1.141 21.409 23.773 1159 2HB TYR 160 HB1 TYR 160 -2.685 22.126 24.237 1160 HD1 TYR 160 HD2 TYR 160 -2.928 23.331 26.370 1161 HD2 TYR 160 HD1 TYR 160 0.858 21.754 25.104 1162 HE1 TYR 160 HE2 TYR 160 -1.780 24.718 28.077 1163 HE2 TYR 160 HE1 TYR 160 2.008 23.136 26.812 1164 HH TYR 160 HH TYR 160 1.293 25.491 28.052 1165 H GLY 161 HN GLY 161 -2.079 19.709 22.761 1166 1HA GLY 161 HA2 GLY 161 -3.833 17.675 22.273 1167 2HA GLY 161 HA1 GLY 161 -4.917 19.063 22.396 1168 H ARG 162 HN ARG 162 -5.181 18.205 20.021 1169 HA ARG 162 HA ARG 162 -3.070 19.219 18.205 1170 1HB ARG 162 HB2 ARG 162 -5.688 17.778 17.691 1171 2HB ARG 162 HB1 ARG 162 -4.569 18.285 16.424 1172 1HG ARG 162 HG2 ARG 162 -2.775 16.963 17.596 1173 2HG ARG 162 HG1 ARG 162 -4.019 16.324 18.666 1174 1HD ARG 162 HD2 ARG 162 -5.258 15.640 16.507 1175 2HD ARG 162 HD1 ARG 162 -3.726 15.916 15.682 1176 HE ARG 162 HE ARG 162 -4.440 13.598 17.205 1177 1HH1 ARG 162 HH21 ARG 162 -1.800 15.791 16.791 1178 2HH1 ARG 162 HH22 ARG 162 -0.650 14.732 17.532 1179 1HH2 ARG 162 HH11 ARG 162 -2.948 12.220 18.148 1180 2HH2 ARG 162 HH12 ARG 162 -1.295 12.715 18.291 1181 H SER 163 HN SER 163 -3.418 20.973 16.785 1182 HA SER 163 HA SER 163 -5.290 22.967 17.759 1183 1HB SER 163 HB2 SER 163 -3.663 22.999 15.202 1184 2HB SER 163 HB1 SER 163 -4.392 24.388 16.001 1185 HG SER 163 HG SER 163 -2.350 24.378 16.737 1186 H GLN 164 HN GLN 164 -7.338 21.958 17.468 1187 HA GLN 164 HA GLN 164 -8.224 20.958 14.901 1188 1HB GLN 164 HB2 GLN 164 -9.748 21.837 17.371 1189 2HB GLN 164 HB1 GLN 164 -10.509 21.100 15.959 1190 1HG GLN 164 HG2 GLN 164 -9.088 19.104 16.225 1191 2HG GLN 164 HG1 GLN 164 -8.317 19.835 17.633 1192 1HE2 GLN 164 HE22 GLN 164 -10.796 18.031 19.456 1193 2HE2 GLN 164 HE21 GLN 164 -9.162 18.057 18.996 1194 H ASN 165 HN ASN 165 -7.050 23.474 14.527 1195 HA ASN 165 HA ASN 165 -9.312 24.938 13.334 1196 1HB ASN 165 HB2 ASN 165 -7.495 26.104 15.447 1197 2HB ASN 165 HB1 ASN 165 -8.442 27.102 14.343 1198 1HD2 ASN 165 HD22 ASN 165 -10.256 25.773 17.598 1199 2HD2 ASN 165 HD21 ASN 165 -8.578 25.952 17.417 1200 HA PRO 166 HA PRO 166 -5.697 24.750 10.523 1201 1HB PRO 166 HB2 PRO 166 -7.367 26.211 8.586 1202 2HB PRO 166 HB1 PRO 166 -6.669 24.590 8.451 1203 1HG PRO 166 HG2 PRO 166 -9.404 25.178 8.890 1204 2HG PRO 166 HG1 PRO 166 -8.640 23.592 9.081 1205 1HD PRO 166 HD2 PRO 166 -9.612 25.409 11.161 1206 2HD PRO 166 HD1 PRO 166 -9.062 23.727 11.336 1207 H VAL 167 HN VAL 167 -4.259 26.215 11.332 1208 HA VAL 167 HA VAL 167 -4.944 29.051 11.630 1209 HB VAL 167 HB VAL 167 -2.418 27.453 12.135 1210 1HG1 VAL 167 HG13 VAL 167 -2.968 30.415 12.397 1211 2HG1 VAL 167 HG12 VAL 167 -1.718 29.612 13.349 1212 3HG1 VAL 167 HG11 VAL 167 -1.615 29.623 11.588 1213 1HG2 VAL 167 HG21 VAL 167 -4.510 28.745 13.912 1214 2HG2 VAL 167 HG23 VAL 167 -4.166 27.022 13.751 1215 3HG2 VAL 167 HG22 VAL 167 -2.987 28.088 14.513 1216 H GLN 168 HN GLN 168 -4.118 30.740 10.363 1217 HA GLN 168 HA GLN 168 -3.321 30.023 7.660 1218 1HB GLN 168 HB2 GLN 168 -3.316 32.774 8.937 1219 2HB GLN 168 HB1 GLN 168 -3.392 32.409 7.217 1220 1HG GLN 168 HG2 GLN 168 -5.580 31.288 7.570 1221 2HG GLN 168 HG1 GLN 168 -5.511 31.736 9.276 1222 1HE2 GLN 168 HE22 GLN 168 -7.282 34.656 8.280 1223 2HE2 GLN 168 HE21 GLN 168 -7.380 33.177 9.107 1224 HA PRO 169 HA PRO 169 1.075 29.996 8.339 1225 1HB PRO 169 HB2 PRO 169 1.758 31.513 5.969 1226 2HB PRO 169 HB1 PRO 169 1.845 29.760 6.197 1227 1HG PRO 169 HG2 PRO 169 -0.129 31.287 4.676 1228 2HG PRO 169 HG1 PRO 169 0.072 29.530 4.760 1229 1HD PRO 169 HD2 PRO 169 -2.036 31.039 5.940 1230 2HD PRO 169 HD1 PRO 169 -1.673 29.326 6.232 No H/Q in entry = 1230 Start of MODEL 8 1 1H VAL 1 HT2 VAL 1 -3.997 21.302 44.180 2 2H VAL 1 HT1 VAL 1 -4.534 21.194 45.789 3 3H VAL 1 HT3 VAL 1 -4.753 22.632 44.917 4 HA VAL 1 HA VAL 1 -2.863 23.368 45.768 5 HB VAL 1 HB VAL 1 -1.423 21.896 47.140 6 1HG1 VAL 1 HG13 VAL 1 -3.527 22.863 48.066 7 2HG1 VAL 1 HG12 VAL 1 -4.378 21.390 47.604 8 3HG1 VAL 1 HG11 VAL 1 -3.101 21.327 48.820 9 1HG2 VAL 1 HG22 VAL 1 -3.203 19.759 45.944 10 2HG2 VAL 1 HG21 VAL 1 -1.442 19.846 45.909 11 3HG2 VAL 1 HG23 VAL 1 -2.277 19.496 47.422 12 H LEU 2 HN LEU 2 -0.251 22.188 45.750 13 HA LEU 2 HA LEU 2 0.413 22.530 42.960 14 1HB LEU 2 HB2 LEU 2 1.971 21.668 45.404 15 2HB LEU 2 HB1 LEU 2 2.707 21.623 43.804 16 HG LEU 2 HG LEU 2 2.073 24.049 43.522 17 1HD1 LEU 2 HD12 LEU 2 1.246 23.643 46.405 18 2HD1 LEU 2 HD11 LEU 2 1.646 25.234 45.758 19 3HD1 LEU 2 HD13 LEU 2 0.295 24.324 45.086 20 1HD2 LEU 2 HD21 LEU 2 4.344 23.334 44.235 21 2HD2 LEU 2 HD23 LEU 2 3.889 24.879 44.954 22 3HD2 LEU 2 HD22 LEU 2 3.822 23.403 45.919 23 H THR 3 HN THR 3 1.063 20.944 41.450 24 HA THR 3 HA THR 3 -0.002 18.231 41.991 25 HB THR 3 HB THR 3 0.447 17.887 39.547 26 HG1 THR 3 HG1 THR 3 0.763 20.500 38.983 27 1HG2 THR 3 HG21 THR 3 -1.717 18.797 40.449 28 2HG2 THR 3 HG23 THR 3 -1.106 20.421 40.128 29 3HG2 THR 3 HG22 THR 3 -1.366 19.296 38.794 30 H GLU 4 HN GLU 4 1.307 16.346 41.725 31 HA GLU 4 HA GLU 4 3.999 16.620 42.722 32 1HB GLU 4 HB2 GLU 4 2.533 14.638 43.139 33 2HB GLU 4 HB1 GLU 4 2.689 14.203 41.437 34 1HG GLU 4 HG2 GLU 4 5.134 14.015 41.701 35 2HG GLU 4 HG1 GLU 4 4.983 14.457 43.405 36 H GLY 5 HN GLY 5 5.944 16.544 41.612 37 1HA GLY 5 HA2 GLY 5 7.328 16.023 39.686 38 2HA GLY 5 HA1 GLY 5 5.892 16.062 38.666 39 H ASN 6 HN ASN 6 5.296 18.012 37.729 40 HA ASN 6 HA ASN 6 6.439 20.542 38.698 41 1HB ASN 6 HB2 ASN 6 7.210 19.326 36.044 42 2HB ASN 6 HB1 ASN 6 7.427 21.034 36.423 43 1HD2 ASN 6 HD22 ASN 6 10.374 18.700 37.467 44 2HD2 ASN 6 HD21 ASN 6 9.341 18.525 36.130 45 HA PRO 7 HA PRO 7 2.225 21.124 36.974 46 1HB PRO 7 HB2 PRO 7 2.444 23.929 37.821 47 2HB PRO 7 HB1 PRO 7 1.324 22.684 38.393 48 1HG PRO 7 HG2 PRO 7 3.541 23.726 39.832 49 2HG PRO 7 HG1 PRO 7 2.589 22.300 40.270 50 1HD PRO 7 HD2 PRO 7 5.316 22.414 39.217 51 2HD PRO 7 HD1 PRO 7 4.438 21.002 39.848 52 H ARG 8 HN ARG 8 1.671 21.896 34.935 53 HA ARG 8 HA ARG 8 3.815 23.221 33.372 54 1HB ARG 8 HB2 ARG 8 1.096 22.338 32.366 55 2HB ARG 8 HB1 ARG 8 2.565 22.599 31.429 56 1HG ARG 8 HG2 ARG 8 2.264 20.446 33.544 57 2HG ARG 8 HG1 ARG 8 2.036 20.179 31.820 58 1HD ARG 8 HD2 ARG 8 4.385 21.031 31.453 59 2HD ARG 8 HD1 ARG 8 4.587 21.053 33.205 60 HE ARG 8 HE ARG 8 3.694 18.480 32.650 61 1HH1 ARG 8 HH21 ARG 8 6.255 20.537 31.585 62 2HH1 ARG 8 HH22 ARG 8 7.354 19.231 31.291 63 1HH2 ARG 8 HH11 ARG 8 5.116 16.774 32.275 64 2HH2 ARG 8 HH12 ARG 8 6.709 17.102 31.682 65 H TRP 9 HN TRP 9 2.944 24.963 31.753 66 HA TRP 9 HA TRP 9 1.892 27.160 33.287 67 1HB TRP 9 HB2 TRP 9 2.170 26.732 30.292 68 2HB TRP 9 HB1 TRP 9 1.613 28.244 31.001 69 HD1 TRP 9 HD1 TRP 9 4.708 26.199 30.360 70 HE1 TRP 9 HE1 TRP 9 6.789 27.530 31.097 71 HE3 TRP 9 HE3 TRP 9 2.453 30.076 32.806 72 HZ2 TRP 9 HZ2 TRP 9 7.417 29.928 32.529 73 HZ3 TRP 9 HZ3 TRP 9 3.815 31.868 33.844 74 HH2 TRP 9 HH2 TRP 9 6.290 31.797 33.711 75 H GLU 10 HN GLU 10 -0.222 27.402 33.881 76 HA GLU 10 HA GLU 10 -2.293 25.727 32.667 77 1HB GLU 10 HB2 GLU 10 -2.357 27.859 34.816 78 2HB GLU 10 HB1 GLU 10 -3.788 26.977 34.285 79 1HG GLU 10 HG2 GLU 10 -2.773 24.855 34.924 80 2HG GLU 10 HG1 GLU 10 -1.267 25.671 35.348 81 H GLN 11 HN GLN 11 -0.949 28.765 31.961 82 HA GLN 11 HA GLN 11 -3.436 29.902 30.844 83 1HB GLN 11 HB2 GLN 11 -0.567 30.865 30.925 84 2HB GLN 11 HB1 GLN 11 -1.862 31.752 30.118 85 1HG GLN 11 HG2 GLN 11 -3.092 31.968 32.191 86 2HG GLN 11 HG1 GLN 11 -1.957 30.908 33.027 87 1HE2 GLN 11 HE22 GLN 11 -1.056 34.534 33.638 88 2HE2 GLN 11 HE21 GLN 11 -2.499 33.660 33.831 89 H THR 12 HN THR 12 -3.914 30.015 28.652 90 HA THR 12 HA THR 12 -2.318 28.253 26.873 91 HB THR 12 HB THR 12 -4.228 28.490 25.327 92 HG1 THR 12 HG1 THR 12 -4.710 30.606 26.945 93 1HG2 THR 12 HG21 THR 12 -5.064 27.940 28.189 94 2HG2 THR 12 HG23 THR 12 -5.935 27.414 26.748 95 3HG2 THR 12 HG22 THR 12 -4.327 26.775 27.090 96 H HIS 13 HN HIS 13 -2.413 31.461 27.739 97 HA HIS 13 HA HIS 13 -1.209 32.339 25.130 98 1HB HIS 13 HB2 HIS 13 -2.805 34.012 27.104 99 2HB HIS 13 HB1 HIS 13 -2.059 34.605 25.624 100 HD1 HIS 13 HD1 HIS 13 -5.182 34.620 26.246 101 HD2 HIS 13 HD2 HIS 13 -3.193 31.845 23.858 102 HE1 HIS 13 HE1 HIS 13 -6.924 33.634 24.696 103 H LEU 14 HN LEU 14 0.802 33.326 25.346 104 HA LEU 14 HA LEU 14 1.766 33.962 28.112 105 1HB LEU 14 HB2 LEU 14 3.280 32.375 26.015 106 2HB LEU 14 HB1 LEU 14 3.931 32.893 27.566 107 HG LEU 14 HG LEU 14 1.477 31.130 27.281 108 1HD1 LEU 14 HD12 LEU 14 3.490 30.008 26.377 109 2HD1 LEU 14 HD11 LEU 14 4.347 30.349 27.880 110 3HD1 LEU 14 HD13 LEU 14 2.960 29.259 27.884 111 1HD2 LEU 14 HD22 LEU 14 3.175 32.079 29.597 112 2HD2 LEU 14 HD21 LEU 14 1.422 32.118 29.433 113 3HD2 LEU 14 HD23 LEU 14 2.245 30.588 29.717 114 H THR 15 HN THR 15 3.656 35.395 28.104 115 HA THR 15 HA THR 15 3.942 37.024 25.599 116 HB THR 15 HB THR 15 3.923 39.054 26.953 117 HG1 THR 15 HG1 THR 15 3.079 38.428 29.252 118 1HG2 THR 15 HG21 THR 15 1.744 37.947 26.172 119 2HG2 THR 15 HG23 THR 15 1.552 37.409 27.840 120 3HG2 THR 15 HG22 THR 15 1.605 39.132 27.470 121 H TYR 16 HN TYR 16 5.999 38.289 25.584 122 HA TYR 16 HA TYR 16 8.056 37.374 27.522 123 1HB TYR 16 HB2 TYR 16 9.580 36.568 25.830 124 2HB TYR 16 HB1 TYR 16 8.052 35.713 25.640 125 HD1 TYR 16 HD1 TYR 16 10.300 38.252 24.219 126 HD2 TYR 16 HD2 TYR 16 6.581 36.159 23.731 127 HE1 TYR 16 HE1 TYR 16 10.169 39.034 21.870 128 HE2 TYR 16 HE2 TYR 16 6.449 36.942 21.381 129 HH TYR 16 HH TYR 16 8.100 37.696 19.605 130 H ARG 17 HN ARG 17 10.034 38.671 27.405 131 HA ARG 17 HA ARG 17 9.801 41.200 25.822 132 1HB ARG 17 HB2 ARG 17 8.834 41.606 28.088 133 2HB ARG 17 HB1 ARG 17 10.357 41.086 28.805 134 1HG ARG 17 HG2 ARG 17 11.544 42.912 27.634 135 2HG ARG 17 HG1 ARG 17 10.021 43.436 26.912 136 1HD ARG 17 HD2 ARG 17 9.099 43.795 29.199 137 2HD ARG 17 HD1 ARG 17 10.671 43.353 29.871 138 HE ARG 17 HE ARG 17 11.294 45.398 28.131 139 1HH1 ARG 17 HH21 ARG 17 9.014 44.923 30.669 140 2HH1 ARG 17 HH22 ARG 17 9.009 46.584 31.159 141 1HH2 ARG 17 HH11 ARG 17 11.302 47.574 28.753 142 2HH2 ARG 17 HH12 ARG 17 10.305 48.087 30.074 143 H ILE 18 HN ILE 18 11.769 41.911 25.089 144 HA ILE 18 HA ILE 18 14.159 40.285 25.768 145 HB ILE 18 HB ILE 18 13.714 42.474 23.707 146 1HG1 ILE 18 HG12 ILE 18 14.085 39.488 23.324 147 2HG1 ILE 18 HG11 ILE 18 12.505 40.267 23.388 148 1HG2 ILE 18 HG21 ILE 18 16.087 40.689 24.308 149 2HG2 ILE 18 HG23 ILE 18 15.897 41.567 22.790 150 3HG2 ILE 18 HG22 ILE 18 16.042 42.453 24.308 151 1HD1 ILE 18 HD13 ILE 18 14.702 40.989 21.426 152 2HD1 ILE 18 HD12 ILE 18 13.318 39.961 21.051 153 3HD1 ILE 18 HD11 ILE 18 13.070 41.659 21.462 154 H GLU 19 HN GLU 19 15.420 41.006 27.424 155 HA GLU 19 HA GLU 19 15.027 43.539 28.692 156 1HB GLU 19 HB2 GLU 19 16.031 41.477 29.757 157 2HB GLU 19 HB1 GLU 19 17.512 41.817 28.860 158 1HG GLU 19 HG2 GLU 19 17.638 44.048 29.915 159 2HG GLU 19 HG1 GLU 19 16.164 43.696 30.818 160 H ASN 20 HN ASN 20 17.460 42.423 26.340 161 HA ASN 20 HA ASN 20 17.880 45.148 25.424 162 1HB ASN 20 HB2 ASN 20 20.250 45.319 26.075 163 2HB ASN 20 HB1 ASN 20 19.224 45.181 27.504 164 1HD2 ASN 20 HD22 ASN 20 21.965 42.737 28.003 165 2HD2 ASN 20 HD21 ASN 20 21.815 44.426 27.940 166 H TYR 21 HN TYR 21 19.382 45.207 23.590 167 HA TYR 21 HA TYR 21 19.565 42.553 22.230 168 1HB TYR 21 HB2 TYR 21 19.717 45.393 21.170 169 2HB TYR 21 HB1 TYR 21 19.944 43.954 20.176 170 HD1 TYR 21 HD1 TYR 21 18.070 42.366 19.815 171 HD2 TYR 21 HD2 TYR 21 17.532 46.053 21.954 172 HE1 TYR 21 HE1 TYR 21 15.613 42.158 19.560 173 HE2 TYR 21 HE2 TYR 21 15.072 45.839 21.702 174 HH TYR 21 HH TYR 21 13.640 43.523 19.597 175 H THR 22 HN THR 22 21.540 41.629 21.970 176 HA THR 22 HA THR 22 23.891 42.976 23.014 177 HB THR 22 HB THR 22 23.779 40.640 23.430 178 HG1 THR 22 HG1 THR 22 25.489 40.215 21.406 179 1HG2 THR 22 HG23 THR 22 23.261 40.390 20.458 180 2HG2 THR 22 HG22 THR 22 23.633 39.014 21.496 181 3HG2 THR 22 HG21 THR 22 22.173 39.961 21.778 182 HA PRO 23 HA PRO 23 25.149 44.741 19.111 183 1HB PRO 23 HB2 PRO 23 27.966 44.611 19.550 184 2HB PRO 23 HB1 PRO 23 26.907 45.977 19.926 185 1HG PRO 23 HG2 PRO 23 28.137 44.041 21.778 186 2HG PRO 23 HG1 PRO 23 27.379 45.599 22.143 187 1HD PRO 23 HD2 PRO 23 26.260 43.037 22.657 188 2HD PRO 23 HD1 PRO 23 25.410 44.596 22.731 189 H ASP 24 HN ASP 24 25.599 41.592 20.058 190 HA ASP 24 HA ASP 24 27.472 40.589 18.136 191 1HB ASP 24 HB2 ASP 24 25.122 39.286 19.533 192 2HB ASP 24 HB1 ASP 24 26.246 38.402 18.500 193 H LEU 25 HN LEU 25 23.969 41.126 18.014 194 HA LEU 25 HA LEU 25 24.109 41.048 15.052 195 1HB LEU 25 HB2 LEU 25 22.277 39.377 16.788 196 2HB LEU 25 HB1 LEU 25 21.885 39.733 15.113 197 HG LEU 25 HG LEU 25 24.535 38.498 15.903 198 1HD1 LEU 25 HD12 LEU 25 21.876 37.173 15.358 199 2HD1 LEU 25 HD11 LEU 25 23.408 36.323 15.152 200 3HD1 LEU 25 HD13 LEU 25 22.947 36.939 16.739 201 1HD2 LEU 25 HD21 LEU 25 22.968 38.806 13.327 202 2HD2 LEU 25 HD23 LEU 25 24.632 39.285 13.661 203 3HD2 LEU 25 HD22 LEU 25 24.225 37.583 13.492 204 HA PRO 26 HA PRO 26 21.578 44.649 15.604 205 1HB PRO 26 HB2 PRO 26 19.847 44.295 13.354 206 2HB PRO 26 HB1 PRO 26 21.347 45.231 13.398 207 1HG PRO 26 HG2 PRO 26 20.864 42.597 12.172 208 2HG PRO 26 HG1 PRO 26 22.238 43.690 11.944 209 1HD PRO 26 HD2 PRO 26 22.269 41.266 13.422 210 2HD PRO 26 HD1 PRO 26 23.522 42.525 13.442 211 H ARG 27 HN ARG 27 19.326 45.251 16.165 212 HA ARG 27 HA ARG 27 17.950 43.160 17.586 213 1HB ARG 27 HB2 ARG 27 16.192 44.902 17.940 214 2HB ARG 27 HB1 ARG 27 17.808 45.476 18.348 215 1HG ARG 27 HG2 ARG 27 17.985 46.520 16.108 216 2HG ARG 27 HG1 ARG 27 16.342 46.004 15.753 217 1HD ARG 27 HD2 ARG 27 17.186 47.846 17.999 218 2HD ARG 27 HD1 ARG 27 16.361 48.347 16.529 219 HE ARG 27 HE ARG 27 15.150 47.311 18.931 220 1HH1 ARG 27 HH21 ARG 27 14.928 47.045 15.494 221 2HH1 ARG 27 HH22 ARG 27 13.335 46.369 15.533 222 1HH2 ARG 27 HH11 ARG 27 13.086 46.449 18.979 223 2HH2 ARG 27 HH12 ARG 27 12.296 46.038 17.495 224 H ALA 28 HN ALA 28 17.594 44.617 14.411 225 HA ALA 28 HA ALA 28 15.004 43.652 13.737 226 1HB ALA 28 HB1 ALA 28 17.422 44.075 11.954 227 2HB ALA 28 HB3 ALA 28 15.767 43.864 11.384 228 3HB ALA 28 HB2 ALA 28 16.194 45.280 12.344 229 H ASP 29 HN ASP 29 18.190 42.083 13.530 230 HA ASP 29 HA ASP 29 17.059 39.681 12.287 231 1HB ASP 29 HB2 ASP 29 19.794 40.363 13.383 232 2HB ASP 29 HB1 ASP 29 19.396 38.772 12.735 233 H VAL 30 HN VAL 30 18.005 40.721 15.532 234 HA VAL 30 HA VAL 30 17.836 38.091 16.719 235 HB VAL 30 HB VAL 30 17.682 40.869 17.916 236 1HG1 VAL 30 HG12 VAL 30 17.685 38.135 19.202 237 2HG1 VAL 30 HG11 VAL 30 18.261 39.564 20.060 238 3HG1 VAL 30 HG13 VAL 30 16.591 39.485 19.503 239 1HG2 VAL 30 HG23 VAL 30 19.827 40.066 16.800 240 2HG2 VAL 30 HG22 VAL 30 19.983 40.518 18.496 241 3HG2 VAL 30 HG21 VAL 30 19.905 38.816 18.042 242 H ASP 31 HN ASP 31 15.537 40.866 16.720 243 HA ASP 31 HA ASP 31 13.508 39.546 18.201 244 1HB ASP 31 HB2 ASP 31 11.947 41.180 17.208 245 2HB ASP 31 HB1 ASP 31 13.447 41.967 17.700 246 H HIS 32 HN HIS 32 14.178 39.534 14.703 247 HA HIS 32 HA HIS 32 11.865 38.074 13.905 248 1HB HIS 32 HB2 HIS 32 13.391 39.142 12.285 249 2HB HIS 32 HB1 HIS 32 14.652 37.984 12.712 250 HD1 HIS 32 HD1 HIS 32 11.034 37.879 11.482 251 HD2 HIS 32 HD2 HIS 32 14.583 35.722 11.128 252 HE1 HIS 32 HE1 HIS 32 10.562 35.983 9.873 253 H ALA 33 HN ALA 33 15.107 36.929 14.845 254 HA ALA 33 HA ALA 33 14.608 34.158 14.516 255 1HB ALA 33 HB3 ALA 33 16.839 35.307 14.978 256 2HB ALA 33 HB2 ALA 33 16.368 35.329 16.677 257 3HB ALA 33 HB1 ALA 33 16.562 33.791 15.836 258 H ILE 34 HN ILE 34 14.151 36.211 17.425 259 HA ILE 34 HA ILE 34 13.174 34.014 19.036 260 HB ILE 34 HB ILE 34 12.734 37.000 19.352 261 1HG1 ILE 34 HG12 ILE 34 15.120 36.456 19.370 262 2HG1 ILE 34 HG11 ILE 34 14.596 36.840 21.006 263 1HG2 ILE 34 HG21 ILE 34 12.270 34.647 21.189 264 2HG2 ILE 34 HG23 ILE 34 12.427 36.298 21.793 265 3HG2 ILE 34 HG22 ILE 34 11.115 35.882 20.689 266 1HD1 ILE 34 HD11 ILE 34 14.230 34.222 21.181 267 2HD1 ILE 34 HD13 ILE 34 15.369 34.182 19.835 268 3HD1 ILE 34 HD12 ILE 34 15.842 34.903 21.371 269 H GLU 35 HN GLU 35 11.523 36.685 17.324 270 HA GLU 35 HA GLU 35 8.870 35.878 17.959 271 1HB GLU 35 HB2 GLU 35 9.407 38.078 16.975 272 2HB GLU 35 HB1 GLU 35 9.877 37.293 15.468 273 1HG GLU 35 HG2 GLU 35 7.591 36.425 15.189 274 2HG GLU 35 HG1 GLU 35 7.114 37.161 16.718 275 H LYS 36 HN LYS 36 10.972 35.000 15.233 276 HA LYS 36 HA LYS 36 9.075 33.438 13.802 277 1HB LYS 36 HB2 LYS 36 11.276 34.128 12.883 278 2HB LYS 36 HB1 LYS 36 12.072 33.013 13.994 279 1HG LYS 36 HG2 LYS 36 10.959 31.112 12.972 280 2HG LYS 36 HG1 LYS 36 10.000 32.178 11.944 281 1HD LYS 36 HD2 LYS 36 12.014 32.953 10.804 282 2HD LYS 36 HD1 LYS 36 13.027 31.996 11.886 283 1HE LYS 36 HE2 LYS 36 10.859 30.692 10.238 284 2HE LYS 36 HE1 LYS 36 12.460 30.993 9.561 285 1HZ LYS 36 HZ3 LYS 36 12.161 29.654 12.170 286 2HZ LYS 36 HZ2 LYS 36 12.021 28.770 10.726 287 3HZ LYS 36 HZ1 LYS 36 13.463 29.593 11.085 288 H ALA 37 HN ALA 37 11.280 32.572 16.447 289 HA ALA 37 HA ALA 37 10.835 29.768 16.427 290 1HB ALA 37 HB3 ALA 37 12.587 30.946 17.772 291 2HB ALA 37 HB2 ALA 37 11.318 31.529 18.849 292 3HB ALA 37 HB1 ALA 37 11.645 29.800 18.726 293 H PHE 38 HN PHE 38 9.100 32.339 18.223 294 HA PHE 38 HA PHE 38 7.278 30.606 19.561 295 1HB PHE 38 HB2 PHE 38 7.130 33.502 18.715 296 2HB PHE 38 HB1 PHE 38 5.754 32.718 19.490 297 HD1 PHE 38 HD2 PHE 38 6.400 31.273 21.661 298 HD2 PHE 38 HD1 PHE 38 8.683 34.568 20.107 299 HE1 PHE 38 HE2 PHE 38 7.451 31.596 23.884 300 HE2 PHE 38 HE1 PHE 38 9.730 34.889 22.331 301 HZ PHE 38 HZ PHE 38 9.115 33.403 24.219 302 H GLN 39 HN GLN 39 7.131 32.120 16.351 303 HA GLN 39 HA GLN 39 4.470 31.383 15.692 304 1HB GLN 39 HB2 GLN 39 6.919 31.757 13.950 305 2HB GLN 39 HB1 GLN 39 5.298 31.505 13.304 306 1HG GLN 39 HG2 GLN 39 5.938 33.705 15.275 307 2HG GLN 39 HG1 GLN 39 6.016 33.936 13.527 308 1HE2 GLN 39 HE22 GLN 39 2.377 33.189 13.263 309 2HE2 GLN 39 HE21 GLN 39 3.802 32.543 12.601 310 H LEU 40 HN LEU 40 7.522 29.573 15.251 311 HA LEU 40 HA LEU 40 6.383 27.383 13.839 312 1HB LEU 40 HB2 LEU 40 8.741 27.502 15.734 313 2HB LEU 40 HB1 LEU 40 8.334 26.075 14.785 314 HG LEU 40 HG LEU 40 8.857 28.813 13.587 315 1HD1 LEU 40 HD13 LEU 40 10.687 26.411 13.883 316 2HD1 LEU 40 HD12 LEU 40 11.048 27.834 12.903 317 3HD1 LEU 40 HD11 LEU 40 10.890 27.985 14.654 318 1HD2 LEU 40 HD23 LEU 40 8.262 26.075 12.471 319 2HD2 LEU 40 HD22 LEU 40 7.653 27.646 11.953 320 3HD2 LEU 40 HD21 LEU 40 9.296 27.168 11.551 321 H TRP 41 HN TRP 41 6.761 27.915 17.350 322 HA TRP 41 HA TRP 41 5.580 25.355 18.035 323 1HB TRP 41 HB2 TRP 41 6.018 27.886 19.642 324 2HB TRP 41 HB1 TRP 41 5.357 26.402 20.329 325 HD1 TRP 41 HD1 TRP 41 8.512 28.113 19.872 326 HE1 TRP 41 HE1 TRP 41 10.515 26.509 20.116 327 HE3 TRP 41 HE3 TRP 41 6.093 23.624 19.554 328 HZ2 TRP 41 HZ2 TRP 41 11.026 23.699 20.156 329 HZ3 TRP 41 HZ3 TRP 41 7.365 21.502 19.692 330 HH2 TRP 41 HH2 TRP 41 9.826 21.533 19.992 331 H SER 42 HN SER 42 4.326 28.668 17.747 332 HA SER 42 HA SER 42 1.682 28.045 18.708 333 1HB SER 42 HB2 SER 42 2.394 30.348 18.680 334 2HB SER 42 HB1 SER 42 2.733 30.279 16.953 335 HG SER 42 HG SER 42 0.380 29.648 16.852 336 H ASN 43 HN ASN 43 3.254 27.758 15.603 337 HA ASN 43 HA ASN 43 0.961 27.608 13.938 338 1HB ASN 43 HB2 ASN 43 3.680 26.298 13.710 339 2HB ASN 43 HB1 ASN 43 2.458 26.217 12.440 340 1HD2 ASN 43 HD22 ASN 43 4.734 29.237 11.980 341 2HD2 ASN 43 HD21 ASN 43 5.080 27.600 12.265 342 H VAL 44 HN VAL 44 2.575 25.074 15.866 343 HA VAL 44 HA VAL 44 0.405 23.170 15.061 344 HB VAL 44 HB VAL 44 1.880 21.398 15.803 345 1HG1 VAL 44 HG12 VAL 44 2.166 22.423 13.520 346 2HG1 VAL 44 HG11 VAL 44 3.489 23.386 14.178 347 3HG1 VAL 44 HG13 VAL 44 3.612 21.626 14.139 348 1HG2 VAL 44 HG23 VAL 44 3.486 23.702 16.897 349 2HG2 VAL 44 HG22 VAL 44 3.064 22.171 17.664 350 3HG2 VAL 44 HG21 VAL 44 4.313 22.217 16.426 351 H THR 45 HN THR 45 0.461 25.378 17.315 352 HA THR 45 HA THR 45 -0.793 23.588 19.323 353 HB THR 45 HB THR 45 0.362 24.699 21.184 354 HG1 THR 45 HG1 THR 45 1.945 25.917 19.182 355 1HG2 THR 45 HG23 THR 45 1.319 22.654 19.984 356 2HG2 THR 45 HG22 THR 45 2.442 23.772 19.211 357 3HG2 THR 45 HG21 THR 45 2.446 23.590 20.963 358 HA PRO 46 HA PRO 46 -3.698 26.999 19.295 359 1HB PRO 46 HB2 PRO 46 -4.861 26.556 21.832 360 2HB PRO 46 HB1 PRO 46 -5.374 25.794 20.320 361 1HG PRO 46 HG2 PRO 46 -3.867 24.606 22.574 362 2HG PRO 46 HG1 PRO 46 -4.767 23.795 21.282 363 1HD PRO 46 HD2 PRO 46 -1.933 24.003 21.468 364 2HD PRO 46 HD1 PRO 46 -2.867 23.464 20.054 365 H LEU 47 HN LEU 47 -0.935 26.905 20.961 366 HA LEU 47 HA LEU 47 -1.398 28.889 23.035 367 1HB LEU 47 HB2 LEU 47 1.179 27.908 21.771 368 2HB LEU 47 HB1 LEU 47 1.076 28.900 23.225 369 HG LEU 47 HG LEU 47 -0.184 26.152 22.924 370 1HD1 LEU 47 HD13 LEU 47 2.379 27.047 24.274 371 2HD1 LEU 47 HD12 LEU 47 1.645 25.458 24.492 372 3HD1 LEU 47 HD11 LEU 47 2.232 25.946 22.903 373 1HD2 LEU 47 HD21 LEU 47 -0.070 28.198 25.137 374 2HD2 LEU 47 HD23 LEU 47 -1.423 27.192 24.617 375 3HD2 LEU 47 HD22 LEU 47 -0.109 26.485 25.553 376 H THR 48 HN THR 48 -0.694 31.072 23.023 377 HA THR 48 HA THR 48 -0.092 32.262 20.332 378 HB THR 48 HB THR 48 -1.584 34.108 20.822 379 HG1 THR 48 HG1 THR 48 -1.266 34.208 23.045 380 1HG2 THR 48 HG22 THR 48 -2.610 32.047 19.885 381 2HG2 THR 48 HG21 THR 48 -2.974 31.508 21.525 382 3HG2 THR 48 HG23 THR 48 -3.742 32.960 20.883 383 H PHE 49 HN PHE 49 1.425 33.980 20.411 384 HA PHE 49 HA PHE 49 2.562 34.611 23.123 385 1HB PHE 49 HB2 PHE 49 4.053 34.186 20.523 386 2HB PHE 49 HB1 PHE 49 4.782 34.725 22.035 387 HD1 PHE 49 HD2 PHE 49 4.943 33.216 23.970 388 HD2 PHE 49 HD1 PHE 49 3.307 31.894 20.226 389 HE1 PHE 49 HE2 PHE 49 5.155 30.862 24.711 390 HE2 PHE 49 HE1 PHE 49 3.519 29.537 20.965 391 HZ PHE 49 HZ PHE 49 4.446 29.020 23.208 392 H THR 50 HN THR 50 2.634 36.733 23.574 393 HA THR 50 HA THR 50 2.521 38.706 21.311 394 HB THR 50 HB THR 50 1.301 38.961 24.078 395 HG1 THR 50 HG1 THR 50 -0.345 38.070 23.168 396 1HG2 THR 50 HG21 THR 50 1.528 40.822 21.715 397 2HG2 THR 50 HG23 THR 50 0.238 41.000 22.903 398 3HG2 THR 50 HG22 THR 50 1.922 41.138 23.404 399 H LYS 51 HN LYS 51 4.193 40.136 21.285 400 HA LYS 51 HA LYS 51 6.223 39.983 23.392 401 1HB LYS 51 HB2 LYS 51 6.820 40.248 20.970 402 2HB LYS 51 HB1 LYS 51 6.093 41.855 21.008 403 1HG LYS 51 HG2 LYS 51 7.660 42.530 22.792 404 2HG LYS 51 HG1 LYS 51 8.391 40.926 22.755 405 1HD LYS 51 HD2 LYS 51 9.048 41.268 20.407 406 2HD LYS 51 HD1 LYS 51 8.310 42.869 20.429 407 1HE LYS 51 HE2 LYS 51 9.881 43.669 22.056 408 2HE LYS 51 HE1 LYS 51 10.485 42.040 22.363 409 1HZ LYS 51 HZ2 LYS 51 11.270 41.959 20.066 410 2HZ LYS 51 HZ1 LYS 51 10.744 43.557 19.823 411 3HZ LYS 51 HZ3 LYS 51 11.989 43.233 20.929 412 H VAL 52 HN VAL 52 6.380 41.376 25.109 413 HA VAL 52 HA VAL 52 4.707 43.877 25.053 414 HB VAL 52 HB VAL 52 4.608 43.629 27.553 415 1HG1 VAL 52 HG11 VAL 52 3.453 41.477 25.769 416 2HG1 VAL 52 HG13 VAL 52 3.001 41.641 27.466 417 3HG1 VAL 52 HG12 VAL 52 2.670 42.952 26.335 418 1HG2 VAL 52 HG21 VAL 52 5.873 40.955 26.885 419 2HG2 VAL 52 HG23 VAL 52 6.512 42.199 27.959 420 3HG2 VAL 52 HG22 VAL 52 5.071 41.296 28.416 421 H SER 53 HN SER 53 5.850 45.727 25.293 422 HA SER 53 HA SER 53 8.750 45.522 25.900 423 1HB SER 53 HB2 SER 53 7.866 46.794 23.890 424 2HB SER 53 HB1 SER 53 7.192 47.965 25.021 425 HG SER 53 HG SER 53 9.152 48.653 25.485 426 H GLU 54 HN GLU 54 5.997 45.928 27.682 427 HA GLU 54 HA GLU 54 7.506 47.353 29.812 428 1HB GLU 54 HB2 GLU 54 4.804 48.221 28.746 429 2HB GLU 54 HB1 GLU 54 5.452 48.746 30.301 430 1HG GLU 54 HG2 GLU 54 7.469 49.625 29.108 431 2HG GLU 54 HG1 GLU 54 6.696 49.212 27.577 432 H GLY 55 HN GLY 55 6.487 47.068 31.938 433 1HA GLY 55 HA2 GLY 55 5.228 45.866 33.537 434 2HA GLY 55 HA1 GLY 55 4.282 45.173 32.217 435 H GLN 56 HN GLN 56 4.927 43.376 34.086 436 HA GLN 56 HA GLN 56 7.520 42.123 33.545 437 1HB GLN 56 HB2 GLN 56 5.097 41.221 35.131 438 2HB GLN 56 HB1 GLN 56 6.602 40.306 35.026 439 1HG GLN 56 HG2 GLN 56 6.457 43.178 35.974 440 2HG GLN 56 HG1 GLN 56 6.433 41.790 37.063 441 1HE2 GLN 56 HE22 GLN 56 9.965 43.129 35.840 442 2HE2 GLN 56 HE21 GLN 56 8.528 44.031 35.805 443 H ALA 57 HN ALA 57 7.707 39.973 32.596 444 HA ALA 57 HA ALA 57 5.442 39.243 30.763 445 1HB ALA 57 HB2 ALA 57 7.479 40.371 29.664 446 2HB ALA 57 HB1 ALA 57 8.366 38.904 30.075 447 3HB ALA 57 HB3 ALA 57 6.971 38.820 28.999 448 H ASP 58 HN ASP 58 5.151 37.013 30.437 449 HA ASP 58 HA ASP 58 5.749 35.315 32.630 450 1HB ASP 58 HB2 ASP 58 4.925 34.674 29.786 451 2HB ASP 58 HB1 ASP 58 5.052 33.456 31.056 452 H ILE 59 HN ILE 59 7.384 35.708 29.490 453 HA ILE 59 HA ILE 59 9.628 33.988 30.536 454 HB ILE 59 HB ILE 59 8.765 34.471 27.662 455 1HG1 ILE 59 HG12 ILE 59 8.646 31.912 29.283 456 2HG1 ILE 59 HG11 ILE 59 7.267 32.997 29.102 457 1HG2 ILE 59 HG22 ILE 59 10.992 32.868 28.940 458 2HG2 ILE 59 HG21 ILE 59 10.418 32.541 27.305 459 3HG2 ILE 59 HG23 ILE 59 11.126 34.110 27.693 460 1HD1 ILE 59 HD13 ILE 59 8.777 31.874 26.733 461 2HD1 ILE 59 HD12 ILE 59 7.374 31.069 27.435 462 3HD1 ILE 59 HD11 ILE 59 7.208 32.677 26.733 463 H MET 60 HN MET 60 11.396 35.207 30.986 464 HA MET 60 HA MET 60 11.749 37.832 29.599 465 1HB MET 60 HB2 MET 60 13.094 36.732 32.085 466 2HB MET 60 HB1 MET 60 13.349 38.337 31.407 467 1HG MET 60 HG2 MET 60 10.638 37.298 32.281 468 2HG MET 60 HG1 MET 60 11.686 38.275 33.309 469 1HE MET 60 HE2 MET 60 12.832 40.284 32.531 470 2HE MET 60 HE1 MET 60 12.049 41.594 31.654 471 3HE MET 60 HE3 MET 60 11.427 41.083 33.228 472 H ILE 61 HN ILE 61 13.502 38.206 28.315 473 HA ILE 61 HA ILE 61 15.499 35.986 27.967 474 HB ILE 61 HB ILE 61 14.424 37.928 25.895 475 1HG1 ILE 61 HG12 ILE 61 14.122 34.916 26.017 476 2HG1 ILE 61 HG11 ILE 61 12.909 36.020 26.668 477 1HG2 ILE 61 HG22 ILE 61 16.521 35.749 25.808 478 2HG2 ILE 61 HG21 ILE 61 15.732 36.361 24.354 479 3HG2 ILE 61 HG23 ILE 61 16.700 37.444 25.354 480 1HD1 ILE 61 HD12 ILE 61 12.710 37.093 24.444 481 2HD1 ILE 61 HD11 ILE 61 13.894 35.955 23.799 482 3HD1 ILE 61 HD13 ILE 61 12.329 35.372 24.369 483 H SER 62 HN SER 62 17.607 36.610 28.319 484 HA SER 62 HA SER 62 18.349 39.455 27.922 485 1HB SER 62 HB2 SER 62 19.279 39.685 30.163 486 2HB SER 62 HB1 SER 62 17.567 39.290 30.278 487 HG SER 62 HG SER 62 19.161 37.083 30.138 488 H PHE 63 HN PHE 63 20.664 39.788 27.997 489 HA PHE 63 HA PHE 63 22.235 37.315 27.345 490 1HB PHE 63 HB2 PHE 63 22.411 40.167 26.334 491 2HB PHE 63 HB1 PHE 63 23.666 38.968 26.039 492 HD1 PHE 63 HD1 PHE 63 20.189 39.946 25.317 493 HD2 PHE 63 HD2 PHE 63 23.267 37.038 24.597 494 HE1 PHE 63 HE1 PHE 63 18.867 39.012 23.438 495 HE2 PHE 63 HE2 PHE 63 21.945 36.104 22.720 496 HZ PHE 63 HZ PHE 63 19.744 37.089 22.139 497 H VAL 64 HN VAL 64 23.978 36.910 28.661 498 HA VAL 64 HA VAL 64 24.966 39.120 30.441 499 HB VAL 64 HB VAL 64 25.151 37.479 32.268 500 1HG1 VAL 64 HG13 VAL 64 23.086 38.843 31.965 501 2HG1 VAL 64 HG12 VAL 64 22.385 37.531 31.015 502 3HG1 VAL 64 HG11 VAL 64 22.754 37.286 32.724 503 1HG2 VAL 64 HG23 VAL 64 23.779 35.624 30.290 504 2HG2 VAL 64 HG22 VAL 64 25.426 35.445 30.894 505 3HG2 VAL 64 HG21 VAL 64 24.058 35.262 31.992 506 H ARG 65 HN ARG 65 27.163 38.748 31.284 507 HA ARG 65 HA ARG 65 28.830 36.995 29.496 508 1HB ARG 65 HB2 ARG 65 29.386 39.813 30.478 509 2HB ARG 65 HB1 ARG 65 30.579 38.777 29.692 510 1HG ARG 65 HG2 ARG 65 29.318 38.698 27.669 511 2HG ARG 65 HG1 ARG 65 27.916 39.440 28.433 512 1HD ARG 65 HD2 ARG 65 29.033 41.118 27.106 513 2HD ARG 65 HD1 ARG 65 29.269 41.522 28.796 514 HE ARG 65 HE ARG 65 31.259 40.633 26.750 515 1HH1 ARG 65 HH21 ARG 65 30.625 41.066 30.109 516 2HH1 ARG 65 HH22 ARG 65 32.288 40.910 30.565 517 1HH2 ARG 65 HH11 ARG 65 33.407 40.445 27.313 518 2HH2 ARG 65 HH12 ARG 65 33.866 40.560 28.980 519 H GLY 66 HN GLY 66 30.564 35.956 30.510 520 1HA GLY 66 HA2 GLY 66 31.640 34.899 32.310 521 2HA GLY 66 HA1 GLY 66 31.799 36.540 32.931 522 H ASP 67 HN ASP 67 31.482 35.923 35.097 523 HA ASP 67 HA ASP 67 29.193 34.358 35.944 524 1HB ASP 67 HB2 ASP 67 31.300 34.485 37.255 525 2HB ASP 67 HB1 ASP 67 30.987 36.193 37.565 526 H HIS 68 HN HIS 68 27.156 35.076 36.343 527 HA HIS 68 HA HIS 68 26.702 38.004 36.769 528 1HB HIS 68 HB2 HIS 68 24.714 37.868 35.294 529 2HB HIS 68 HB1 HIS 68 26.202 37.516 34.416 530 HD1 HIS 68 HD1 HIS 68 26.741 34.883 34.084 531 HD2 HIS 68 HD2 HIS 68 22.836 35.823 35.196 532 HE1 HIS 68 HE1 HIS 68 25.342 32.834 33.581 533 H ARG 69 HN ARG 69 26.733 36.755 39.001 534 HA ARG 69 HA ARG 69 25.510 35.982 40.847 535 1HB ARG 69 HB2 ARG 69 23.360 37.430 39.278 536 2HB ARG 69 HB1 ARG 69 23.111 36.792 40.903 537 1HG ARG 69 HG2 ARG 69 25.009 38.158 41.721 538 2HG ARG 69 HG1 ARG 69 25.214 38.825 40.100 539 1HD ARG 69 HD2 ARG 69 23.894 40.380 41.444 540 2HD ARG 69 HD1 ARG 69 22.867 39.675 40.197 541 HE ARG 69 HE ARG 69 22.547 37.998 42.398 542 1HH1 ARG 69 HH21 ARG 69 22.223 41.355 41.699 543 2HH1 ARG 69 HH22 ARG 69 20.989 41.619 42.884 544 1HH2 ARG 69 HH11 ARG 69 20.938 38.317 43.950 545 2HH2 ARG 69 HH12 ARG 69 20.258 39.897 44.161 546 H ASP 70 HN ASP 70 25.989 33.926 39.214 547 HA ASP 70 HA ASP 70 23.461 32.345 39.327 548 1HB ASP 70 HB2 ASP 70 23.969 31.344 37.126 549 2HB ASP 70 HB1 ASP 70 23.728 33.086 36.985 550 H ASN 71 HN ASN 71 23.925 29.985 39.330 551 HA ASN 71 HA ASN 71 26.478 29.440 40.753 552 1HB ASN 71 HB2 ASN 71 25.414 27.367 41.458 553 2HB ASN 71 HB1 ASN 71 24.290 28.698 41.729 554 1HD2 ASN 71 HD22 ASN 71 22.318 26.075 40.028 555 2HD2 ASN 71 HD21 ASN 71 23.067 26.279 41.538 556 H SER 72 HN SER 72 25.667 29.551 37.626 557 HA SER 72 HA SER 72 27.499 27.293 36.920 558 1HB SER 72 HB2 SER 72 24.880 27.928 35.537 559 2HB SER 72 HB1 SER 72 26.051 26.727 35.004 560 HG SER 72 HG SER 72 24.140 26.543 36.896 561 HA PRO 73 HA PRO 73 28.499 31.398 34.903 562 1HB PRO 73 HB2 PRO 73 31.269 31.063 35.611 563 2HB PRO 73 HB1 PRO 73 30.123 32.229 36.289 564 1HG PRO 73 HG2 PRO 73 31.212 29.860 37.569 565 2HG PRO 73 HG1 PRO 73 30.114 31.063 38.262 566 1HD PRO 73 HD2 PRO 73 29.483 28.361 37.409 567 2HD PRO 73 HD1 PRO 73 28.390 29.554 38.138 568 H PHE 74 HN PHE 74 29.560 31.573 32.845 569 HA PHE 74 HA PHE 74 30.019 29.035 31.487 570 1HB PHE 74 HB2 PHE 74 30.490 31.885 30.559 571 2HB PHE 74 HB1 PHE 74 30.535 30.454 29.527 572 HD1 PHE 74 HD1 PHE 74 28.405 28.890 29.669 573 HD2 PHE 74 HD2 PHE 74 28.459 33.039 30.786 574 HE1 PHE 74 HE1 PHE 74 25.941 28.996 29.401 575 HE2 PHE 74 HE2 PHE 74 25.996 33.144 30.515 576 HZ PHE 74 HZ PHE 74 24.736 31.122 29.823 577 H ASP 75 HN ASP 75 32.043 28.310 30.650 578 HA ASP 75 HA ASP 75 34.483 29.669 31.741 579 1HB ASP 75 HB2 ASP 75 33.855 27.729 33.175 580 2HB ASP 75 HB1 ASP 75 33.939 26.682 31.758 581 H GLY 76 HN GLY 76 34.444 30.450 29.447 582 1HA GLY 76 HA2 GLY 76 35.686 30.367 27.429 583 2HA GLY 76 HA1 GLY 76 36.122 28.697 27.801 584 HA PRO 77 HA PRO 77 32.785 28.866 24.501 585 1HB PRO 77 HB2 PRO 77 34.352 27.217 22.765 586 2HB PRO 77 HB1 PRO 77 34.024 28.944 22.572 587 1HG PRO 77 HG2 PRO 77 36.526 27.658 23.377 588 2HG PRO 77 HG1 PRO 77 36.243 29.360 22.984 589 1HD PRO 77 HD2 PRO 77 36.656 28.229 25.594 590 2HD PRO 77 HD1 PRO 77 36.260 29.917 25.210 591 H GLY 78 HN GLY 78 34.355 26.753 26.539 592 1HA GLY 78 HA2 GLY 78 33.007 24.291 25.595 593 2HA GLY 78 HA1 GLY 78 34.116 24.411 26.964 594 H GLY 79 HN GLY 79 32.036 23.020 27.665 595 1HA GLY 79 HA2 GLY 79 30.383 22.958 29.342 596 2HA GLY 79 HA1 GLY 79 30.646 24.683 29.596 597 H ASN 80 HN ASN 80 28.193 24.598 29.750 598 HA ASN 80 HA ASN 80 26.654 24.108 27.349 599 1HB ASN 80 HB2 ASN 80 25.957 25.728 29.820 600 2HB ASN 80 HB1 ASN 80 24.811 25.188 28.592 601 1HD2 ASN 80 HD22 ASN 80 25.207 21.681 29.575 602 2HD2 ASN 80 HD21 ASN 80 25.151 22.614 28.158 603 H LEU 81 HN LEU 81 25.690 25.700 25.969 604 HA LEU 81 HA LEU 81 27.330 28.155 25.664 605 1HB LEU 81 HB2 LEU 81 25.042 27.201 23.921 606 2HB LEU 81 HB1 LEU 81 26.309 28.348 23.493 607 HG LEU 81 HG LEU 81 26.630 25.378 23.998 608 1HD1 LEU 81 HD12 LEU 81 27.103 27.139 21.574 609 2HD1 LEU 81 HD11 LEU 81 27.449 25.410 21.656 610 3HD1 LEU 81 HD13 LEU 81 25.786 25.984 21.776 611 1HD2 LEU 81 HD22 LEU 81 28.659 27.602 23.738 612 2HD2 LEU 81 HD21 LEU 81 28.589 26.317 24.944 613 3HD2 LEU 81 HD23 LEU 81 29.063 25.947 23.285 614 H ALA 82 HN ALA 82 24.466 27.157 27.121 615 HA ALA 82 HA ALA 82 23.734 29.766 28.025 616 1HB ALA 82 HB3 ALA 82 22.167 28.635 25.696 617 2HB ALA 82 HB2 ALA 82 21.492 29.837 26.794 618 3HB ALA 82 HB1 ALA 82 22.910 30.229 25.821 619 H HIS 83 HN HIS 83 21.300 29.565 28.927 620 HA HIS 83 HA HIS 83 20.407 26.879 29.540 621 1HB HIS 83 HB2 HIS 83 20.895 26.942 31.962 622 2HB HIS 83 HB1 HIS 83 22.381 26.958 31.011 623 HD1 HIS 83 HD1 HIS 83 23.880 28.995 31.203 624 HD2 HIS 83 HD2 HIS 83 20.199 29.547 33.078 625 HE1 HIS 83 HE1 HIS 83 24.045 31.179 32.471 626 H ALA 84 HN ALA 84 18.684 27.013 31.356 627 HA ALA 84 HA ALA 84 17.434 29.690 31.590 628 1HB ALA 84 HB2 ALA 84 16.512 28.684 29.499 629 2HB ALA 84 HB1 ALA 84 15.956 27.300 30.441 630 3HB ALA 84 HB3 ALA 84 15.281 28.900 30.743 631 H PHE 85 HN PHE 85 15.675 29.659 33.206 632 HA PHE 85 HA PHE 85 16.280 27.724 35.364 633 1HB PHE 85 HB2 PHE 85 14.560 30.218 35.235 634 2HB PHE 85 HB1 PHE 85 14.703 29.209 36.674 635 HD1 PHE 85 HD2 PHE 85 16.458 31.520 34.410 636 HD2 PHE 85 HD1 PHE 85 16.802 29.098 37.943 637 HE1 PHE 85 HE2 PHE 85 18.577 32.664 34.989 638 HE2 PHE 85 HE1 PHE 85 18.926 30.245 38.520 639 HZ PHE 85 HZ PHE 85 19.812 32.028 37.043 640 H GLN 86 HN GLN 86 14.507 26.540 36.418 641 HA GLN 86 HA GLN 86 12.866 25.150 34.592 642 1HB GLN 86 HB2 GLN 86 12.508 25.506 37.581 643 2HB GLN 86 HB1 GLN 86 11.735 24.251 36.615 644 1HG GLN 86 HG2 GLN 86 13.831 23.230 36.091 645 2HG GLN 86 HG1 GLN 86 14.735 24.614 36.709 646 1HE2 GLN 86 HE22 GLN 86 14.819 22.088 39.414 647 2HE2 GLN 86 HE21 GLN 86 15.472 22.255 37.856 648 HA PRO 87 HA PRO 87 9.467 27.942 33.943 649 1HB PRO 87 HB2 PRO 87 7.367 25.974 34.037 650 2HB PRO 87 HB1 PRO 87 8.154 26.632 32.595 651 1HG PRO 87 HG2 PRO 87 8.505 23.988 33.816 652 2HG PRO 87 HG1 PRO 87 9.095 24.567 32.250 653 1HD PRO 87 HD2 PRO 87 10.673 24.100 34.576 654 2HD PRO 87 HD1 PRO 87 11.195 24.920 33.091 655 H GLY 88 HN GLY 88 8.950 29.222 35.688 656 1HA GLY 88 HA2 GLY 88 6.949 28.456 37.567 657 2HA GLY 88 HA1 GLY 88 8.527 28.309 38.341 658 HA PRO 89 HA PRO 89 6.890 32.762 38.414 659 1HB PRO 89 HB2 PRO 89 6.945 32.796 41.280 660 2HB PRO 89 HB1 PRO 89 5.509 32.784 40.248 661 1HG PRO 89 HG2 PRO 89 6.608 30.595 41.863 662 2HG PRO 89 HG1 PRO 89 5.048 30.677 41.030 663 1HD PRO 89 HD2 PRO 89 7.325 29.135 40.235 664 2HD PRO 89 HD1 PRO 89 5.827 29.384 39.313 665 H GLY 90 HN GLY 90 8.104 34.547 39.809 666 1HA GLY 90 HA2 GLY 90 10.123 35.535 40.475 667 2HA GLY 90 HA1 GLY 90 10.690 33.923 40.900 668 H ILE 91 HN ILE 91 12.621 33.697 39.922 669 HA ILE 91 HA ILE 91 13.250 34.923 37.357 670 HB ILE 91 HB ILE 91 14.909 34.582 39.197 671 1HG1 ILE 91 HG12 ILE 91 15.705 32.993 36.746 672 2HG1 ILE 91 HG11 ILE 91 15.529 34.746 36.719 673 1HG2 ILE 91 HG23 ILE 91 13.940 32.276 39.760 674 2HG2 ILE 91 HG22 ILE 91 14.872 31.667 38.392 675 3HG2 ILE 91 HG21 ILE 91 15.698 32.407 39.763 676 1HD1 ILE 91 HD12 ILE 91 17.357 33.205 38.578 677 2HD1 ILE 91 HD11 ILE 91 17.873 34.096 37.147 678 3HD1 ILE 91 HD13 ILE 91 17.185 34.957 38.521 679 H GLY 92 HN GLY 92 11.598 32.109 38.224 680 1HA GLY 92 HA2 GLY 92 12.524 30.172 36.387 681 2HA GLY 92 HA1 GLY 92 10.856 30.289 36.941 682 H GLY 93 HN GLY 93 12.163 29.823 34.201 683 1HA GLY 93 HA2 GLY 93 11.159 30.168 32.060 684 2HA GLY 93 HA1 GLY 93 10.279 31.550 32.714 685 H ASP 94 HN ASP 94 12.985 32.460 33.906 686 HA ASP 94 HA ASP 94 13.650 34.265 31.770 687 1HB ASP 94 HB2 ASP 94 15.146 33.551 34.308 688 2HB ASP 94 HB1 ASP 94 15.586 34.881 33.235 689 H ALA 95 HN ALA 95 15.010 33.984 30.078 690 HA ALA 95 HA ALA 95 16.703 31.513 29.998 691 1HB ALA 95 HB2 ALA 95 15.528 33.259 27.820 692 2HB ALA 95 HB1 ALA 95 16.722 32.001 27.503 693 3HB ALA 95 HB3 ALA 95 15.145 31.573 28.171 694 H HIS 96 HN HIS 96 18.875 31.790 30.165 695 HA HIS 96 HA HIS 96 20.014 34.530 29.719 696 1HB HIS 96 HB2 HIS 96 20.951 32.173 31.376 697 2HB HIS 96 HB1 HIS 96 21.970 33.575 31.042 698 HD2 HIS 96 HD2 HIS 96 18.281 34.732 31.708 699 HE1 HIS 96 HE1 HIS 96 20.571 35.033 35.280 700 HE2 HIS 96 HE2 HIS 96 18.383 35.647 34.158 701 H PHE 97 HN PHE 97 21.406 34.819 28.029 702 HA PHE 97 HA PHE 97 22.317 32.380 26.527 703 1HB PHE 97 HB2 PHE 97 21.685 35.200 25.648 704 2HB PHE 97 HB1 PHE 97 22.574 34.075 24.621 705 HD1 PHE 97 HD1 PHE 97 19.377 34.538 26.480 706 HD2 PHE 97 HD2 PHE 97 21.442 32.378 23.394 707 HE1 PHE 97 HE1 PHE 97 17.235 33.520 25.757 708 HE2 PHE 97 HE2 PHE 97 19.300 31.360 22.675 709 HZ PHE 97 HZ PHE 97 17.196 31.931 23.856 710 H ASP 98 HN ASP 98 24.488 32.076 26.170 711 HA ASP 98 HA ASP 98 26.427 33.612 27.671 712 1HB ASP 98 HB2 ASP 98 26.657 31.180 27.059 713 2HB ASP 98 HB1 ASP 98 26.934 31.670 25.387 714 H GLU 99 HN GLU 99 26.581 35.766 27.010 715 HA GLU 99 HA GLU 99 26.581 36.481 24.180 716 1HB GLU 99 HB2 GLU 99 25.696 37.904 26.108 717 2HB GLU 99 HB1 GLU 99 27.375 38.271 26.476 718 1HG GLU 99 HG2 GLU 99 27.716 39.252 24.290 719 2HG GLU 99 HG1 GLU 99 26.122 38.721 23.754 720 H ASP 100 HN ASP 100 28.989 35.242 26.189 721 HA ASP 100 HA ASP 100 31.193 36.868 25.211 722 1HB ASP 100 HB2 ASP 100 31.105 34.180 26.596 723 2HB ASP 100 HB1 ASP 100 32.607 34.990 26.154 724 H GLU 101 HN GLU 101 29.467 34.095 24.021 725 HA GLU 101 HA GLU 101 31.578 33.444 22.049 726 1HB GLU 101 HB2 GLU 101 28.823 32.294 22.585 727 2HB GLU 101 HB1 GLU 101 29.867 31.750 21.269 728 1HG GLU 101 HG2 GLU 101 31.638 31.196 22.889 729 2HG GLU 101 HG1 GLU 101 30.607 31.740 24.212 730 H ARG 102 HN ARG 102 30.977 33.464 19.687 731 HA ARG 102 HA ARG 102 29.535 35.974 19.074 732 1HB ARG 102 HB2 ARG 102 31.746 35.429 18.014 733 2HB ARG 102 HB1 ARG 102 30.962 34.084 17.181 734 1HG ARG 102 HG2 ARG 102 29.392 35.636 16.111 735 2HG ARG 102 HG1 ARG 102 30.128 36.987 16.958 736 1HD ARG 102 HD2 ARG 102 31.539 35.164 14.996 737 2HD ARG 102 HD1 ARG 102 30.983 36.792 14.631 738 HE ARG 102 HE ARG 102 33.460 36.055 15.901 739 1HH1 ARG 102 HH21 ARG 102 30.908 38.375 16.189 740 2HH1 ARG 102 HH22 ARG 102 31.849 39.460 17.154 741 1HH2 ARG 102 HH11 ARG 102 34.680 37.473 17.125 742 2HH2 ARG 102 HH12 ARG 102 33.975 38.956 17.679 743 H TRP 103 HN TRP 103 27.414 35.909 18.641 744 HA TRP 103 HA TRP 103 26.130 33.349 17.889 745 1HB TRP 103 HB2 TRP 103 25.046 36.060 18.693 746 2HB TRP 103 HB1 TRP 103 24.020 34.709 18.213 747 HD1 TRP 103 HD1 TRP 103 25.521 36.199 21.172 748 HE1 TRP 103 HE1 TRP 103 25.531 34.551 23.154 749 HE3 TRP 103 HE3 TRP 103 24.466 31.856 18.707 750 HZ2 TRP 103 HZ2 TRP 103 25.146 31.756 23.629 751 HZ3 TRP 103 HZ3 TRP 103 24.295 29.717 19.945 752 HH2 TRP 103 HH2 TRP 103 24.635 29.661 22.400 753 H THR 104 HN THR 104 25.283 32.946 15.892 754 HA THR 104 HA THR 104 25.118 35.184 13.907 755 HB THR 104 HB THR 104 25.912 33.557 12.172 756 HG1 THR 104 HG1 THR 104 25.543 31.838 14.046 757 1HG2 THR 104 HG22 THR 104 27.723 34.283 14.480 758 2HG2 THR 104 HG21 THR 104 28.329 33.582 12.981 759 3HG2 THR 104 HG23 THR 104 27.512 35.144 12.955 760 H ASN 105 HN ASN 105 23.701 34.502 12.012 761 HA ASN 105 HA ASN 105 21.444 32.771 12.983 762 1HB ASN 105 HB2 ASN 105 21.376 35.159 11.113 763 2HB ASN 105 HB1 ASN 105 19.981 34.191 11.591 764 1HD2 ASN 105 HD21 ASN 105 20.335 33.859 14.319 765 2HD2 ASN 105 HD22 ASN 105 20.357 35.366 15.102 766 H ASN 106 HN ASN 106 23.893 32.029 11.315 767 HA ASN 106 HA ASN 106 22.352 30.701 9.150 768 1HB ASN 106 HB2 ASN 106 23.997 31.389 7.434 769 2HB ASN 106 HB1 ASN 106 23.137 32.772 8.111 770 1HD2 ASN 106 HD22 ASN 106 26.418 32.868 10.277 771 2HD2 ASN 106 HD21 ASN 106 25.011 31.989 10.633 772 H PHE 107 HN PHE 107 24.478 29.646 7.740 773 HA PHE 107 HA PHE 107 25.189 27.390 9.323 774 1HB PHE 107 HB2 PHE 107 25.073 27.230 6.910 775 2HB PHE 107 HB1 PHE 107 26.343 28.436 6.726 776 HD1 PHE 107 HD2 PHE 107 25.605 24.984 7.866 777 HD2 PHE 107 HD1 PHE 107 28.662 27.867 6.981 778 HE1 PHE 107 HE2 PHE 107 27.323 23.199 7.992 779 HE2 PHE 107 HE1 PHE 107 30.382 26.085 7.107 780 HZ PHE 107 HZ PHE 107 29.712 23.751 7.612 781 H ARG 108 HN ARG 108 26.403 30.434 9.756 782 HA ARG 108 HA ARG 108 29.214 30.025 9.848 783 1HB ARG 108 HB2 ARG 108 27.400 31.846 11.431 784 2HB ARG 108 HB1 ARG 108 29.145 31.829 11.676 785 1HG ARG 108 HG2 ARG 108 29.498 32.318 9.287 786 2HG ARG 108 HG1 ARG 108 27.755 32.339 9.029 787 1HD ARG 108 HD2 ARG 108 27.562 34.203 10.662 788 2HD ARG 108 HD1 ARG 108 29.311 34.199 10.851 789 HE ARG 108 HE ARG 108 28.906 34.495 8.112 790 1HH1 ARG 108 HH21 ARG 108 27.910 36.076 11.013 791 2HH1 ARG 108 HH22 ARG 108 27.766 37.635 10.272 792 1HH2 ARG 108 HH11 ARG 108 28.722 36.520 7.129 793 2HH2 ARG 108 HH12 ARG 108 28.226 37.886 8.072 794 H GLU 109 HN GLU 109 29.974 30.505 12.505 795 HA GLU 109 HA GLU 109 30.459 27.989 13.508 796 1HB GLU 109 HB2 GLU 109 30.096 30.587 15.007 797 2HB GLU 109 HB1 GLU 109 30.738 29.121 15.752 798 1HG GLU 109 HG2 GLU 109 32.526 29.037 14.057 799 2HG GLU 109 HG1 GLU 109 31.889 30.504 13.314 800 H TYR 110 HN TYR 110 27.836 30.062 14.897 801 HA TYR 110 HA TYR 110 26.323 27.525 15.462 802 1HB TYR 110 HB2 TYR 110 26.696 29.817 17.415 803 2HB TYR 110 HB1 TYR 110 25.765 28.345 17.696 804 HD1 TYR 110 HD2 TYR 110 26.894 26.160 17.925 805 HD2 TYR 110 HD1 TYR 110 29.116 29.810 17.487 806 HE1 TYR 110 HE2 TYR 110 28.947 25.001 18.695 807 HE2 TYR 110 HE1 TYR 110 31.169 28.652 18.258 808 HH TYR 110 HH TYR 110 31.145 25.723 19.821 809 H ASN 111 HN ASN 111 24.053 27.749 15.476 810 HA ASN 111 HA ASN 111 23.046 30.223 14.156 811 1HB ASN 111 HB2 ASN 111 22.480 28.029 13.139 812 2HB ASN 111 HB1 ASN 111 21.672 27.558 14.634 813 1HD2 ASN 111 HD22 ASN 111 19.942 30.672 12.558 814 2HD2 ASN 111 HD21 ASN 111 21.635 30.586 12.647 815 H LEU 112 HN LEU 112 22.281 31.754 15.525 816 HA LEU 112 HA LEU 112 21.711 31.351 18.273 817 1HB LEU 112 HB2 LEU 112 22.206 33.561 17.309 818 2HB LEU 112 HB1 LEU 112 20.691 33.519 16.415 819 HG LEU 112 HG LEU 112 19.429 33.444 18.539 820 1HD1 LEU 112 HD12 LEU 112 22.213 33.315 19.691 821 2HD1 LEU 112 HD11 LEU 112 20.915 34.062 20.625 822 3HD1 LEU 112 HD13 LEU 112 20.782 32.378 20.125 823 1HD2 LEU 112 HD22 LEU 112 20.089 35.618 17.464 824 2HD2 LEU 112 HD21 LEU 112 19.843 35.737 19.207 825 3HD2 LEU 112 HD23 LEU 112 21.478 35.679 18.549 826 H HIS 113 HN HIS 113 19.476 31.487 15.486 827 HA HIS 113 HA HIS 113 17.080 31.303 16.996 828 1HB HIS 113 HB2 HIS 113 17.094 31.842 14.592 829 2HB HIS 113 HB1 HIS 113 17.604 30.193 14.223 830 HD1 HIS 113 HD1 HIS 113 15.546 29.115 13.239 831 HD2 HIS 113 HD2 HIS 113 14.674 31.274 16.696 832 HE1 HIS 113 HE1 HIS 113 13.101 28.688 13.755 833 H ARG 114 HN ARG 114 19.212 28.729 15.770 834 HA ARG 114 HA ARG 114 17.522 26.542 16.415 835 1HB ARG 114 HB2 ARG 114 19.666 26.373 15.112 836 2HB ARG 114 HB1 ARG 114 20.546 26.573 16.630 837 1HG ARG 114 HG2 ARG 114 19.424 24.585 17.549 838 2HG ARG 114 HG1 ARG 114 18.544 24.369 16.039 839 1HD ARG 114 HD2 ARG 114 20.757 24.202 14.868 840 2HD ARG 114 HD1 ARG 114 21.550 24.221 16.437 841 HE ARG 114 HE ARG 114 20.299 21.956 15.153 842 1HH1 ARG 114 HH21 ARG 114 20.612 23.454 18.250 843 2HH1 ARG 114 HH22 ARG 114 20.081 22.052 19.116 844 1HH2 ARG 114 HH11 ARG 114 19.613 20.134 16.270 845 2HH2 ARG 114 HH12 ARG 114 19.515 20.179 17.999 846 H VAL 115 HN VAL 115 19.980 28.189 18.415 847 HA VAL 115 HA VAL 115 19.518 26.501 20.712 848 HB VAL 115 HB VAL 115 20.792 29.239 20.424 849 1HG1 VAL 115 HG11 VAL 115 20.473 27.447 22.844 850 2HG1 VAL 115 HG13 VAL 115 21.711 28.699 22.743 851 3HG1 VAL 115 HG12 VAL 115 20.004 29.138 22.690 852 1HG2 VAL 115 HG21 VAL 115 21.876 26.435 20.829 853 2HG2 VAL 115 HG23 VAL 115 22.043 27.425 19.380 854 3HG2 VAL 115 HG22 VAL 115 22.862 27.896 20.871 855 H ALA 116 HN ALA 116 18.232 29.660 19.681 856 HA ALA 116 HA ALA 116 16.811 30.337 22.021 857 1HB ALA 116 HB3 ALA 116 16.098 30.764 19.106 858 2HB ALA 116 HB2 ALA 116 15.196 31.484 20.438 859 3HB ALA 116 HB1 ALA 116 16.890 31.907 20.191 860 H ALA 117 HN ALA 117 15.710 28.341 19.259 861 HA ALA 117 HA ALA 117 13.149 27.701 20.323 862 1HB ALA 117 HB1 ALA 117 15.005 26.207 18.456 863 2HB ALA 117 HB3 ALA 117 13.400 25.606 18.870 864 3HB ALA 117 HB2 ALA 117 13.575 27.149 18.034 865 H HIS 118 HN HIS 118 16.314 26.140 20.730 866 HA HIS 118 HA HIS 118 15.440 23.895 22.243 867 1HB HIS 118 HB2 HIS 118 17.737 24.172 21.307 868 2HB HIS 118 HB1 HIS 118 18.051 25.422 22.509 869 HD1 HIS 118 HD1 HIS 118 17.485 21.726 22.159 870 HD2 HIS 118 HD2 HIS 118 18.530 24.448 25.133 871 HE1 HIS 118 HE1 HIS 118 18.250 20.354 24.143 872 H GLU 119 HN GLU 119 16.458 27.157 23.288 873 HA GLU 119 HA GLU 119 16.150 26.674 26.095 874 1HB GLU 119 HB2 GLU 119 15.934 29.238 24.486 875 2HB GLU 119 HB1 GLU 119 15.980 29.180 26.246 876 1HG GLU 119 HG2 GLU 119 18.144 28.077 24.427 877 2HG GLU 119 HG1 GLU 119 18.221 29.632 25.253 878 H LEU 120 HN LEU 120 13.896 27.835 23.608 879 HA LEU 120 HA LEU 120 11.739 28.378 25.433 880 1HB LEU 120 HB2 LEU 120 11.777 27.765 22.465 881 2HB LEU 120 HB1 LEU 120 10.318 28.225 23.337 882 HG LEU 120 HG LEU 120 12.849 29.899 23.297 883 1HD1 LEU 120 HD11 LEU 120 10.356 30.054 21.583 884 2HD1 LEU 120 HD13 LEU 120 11.556 31.343 21.692 885 3HD1 LEU 120 HD12 LEU 120 12.007 29.771 21.034 886 1HD2 LEU 120 HD21 LEU 120 10.060 30.264 24.397 887 2HD2 LEU 120 HD23 LEU 120 11.609 30.650 25.144 888 3HD2 LEU 120 HD22 LEU 120 10.969 31.677 23.868 889 H GLY 121 HN GLY 121 12.719 25.496 23.610 890 1HA GLY 121 HA2 GLY 121 10.428 23.905 24.082 891 2HA GLY 121 HA1 GLY 121 12.056 23.257 23.876 892 H HIS 122 HN HIS 122 13.327 24.373 26.126 893 HA HIS 122 HA HIS 122 12.477 22.556 28.184 894 1HB HIS 122 HB2 HIS 122 14.366 24.919 28.167 895 2HB HIS 122 HB1 HIS 122 14.049 23.994 29.636 896 HD1 HIS 122 HD1 HIS 122 14.184 21.190 28.996 897 HD2 HIS 122 HD2 HIS 122 16.588 23.883 26.908 898 HE1 HIS 122 HE1 HIS 122 16.091 19.839 28.017 899 H SER 123 HN SER 123 11.955 26.026 27.668 900 HA SER 123 HA SER 123 10.672 26.614 30.133 901 1HB SER 123 HB2 SER 123 10.125 27.781 27.386 902 2HB SER 123 HB1 SER 123 9.620 28.493 28.916 903 HG SER 123 HG SER 123 12.318 27.827 28.404 904 H LEU 124 HN LEU 124 9.504 25.016 27.224 905 HA LEU 124 HA LEU 124 6.703 25.091 28.094 906 1HB LEU 124 HB2 LEU 124 8.067 23.512 25.895 907 2HB LEU 124 HB1 LEU 124 6.324 23.614 26.134 908 HG LEU 124 HG LEU 124 8.147 25.979 25.606 909 1HD1 LEU 124 HD13 LEU 124 6.215 24.519 23.778 910 2HD1 LEU 124 HD12 LEU 124 7.081 26.000 23.370 911 3HD1 LEU 124 HD11 LEU 124 7.973 24.505 23.648 912 1HD2 LEU 124 HD23 LEU 124 5.199 25.667 26.152 913 2HD2 LEU 124 HD22 LEU 124 6.316 26.914 26.708 914 3HD2 LEU 124 HD21 LEU 124 5.730 26.940 25.050 915 H GLY 125 HN GLY 125 9.382 23.305 29.027 916 1HA GLY 125 HA2 GLY 125 9.325 21.587 30.698 917 2HA GLY 125 HA1 GLY 125 7.631 21.287 30.308 918 H LEU 126 HN LEU 126 9.537 21.538 27.506 919 HA LEU 126 HA LEU 126 9.187 18.694 26.948 920 1HB LEU 126 HB2 LEU 126 10.643 20.856 25.394 921 2HB LEU 126 HB1 LEU 126 10.303 19.236 24.792 922 HG LEU 126 HG LEU 126 8.178 21.199 25.704 923 1HD1 LEU 126 HD12 LEU 126 9.549 21.727 23.536 924 2HD1 LEU 126 HD11 LEU 126 8.661 20.368 22.845 925 3HD1 LEU 126 HD13 LEU 126 7.789 21.774 23.456 926 1HD2 LEU 126 HD22 LEU 126 8.143 18.388 24.623 927 2HD2 LEU 126 HD21 LEU 126 7.171 19.101 25.911 928 3HD2 LEU 126 HD23 LEU 126 6.808 19.468 24.228 929 H SER 127 HN SER 127 10.796 17.121 26.894 930 HA SER 127 HA SER 127 13.399 17.880 28.181 931 1HB SER 127 HB2 SER 127 11.862 15.274 28.095 932 2HB SER 127 HB1 SER 127 13.509 15.408 28.707 933 HG SER 127 HG SER 127 11.298 16.945 29.621 934 H HIS 128 HN HIS 128 15.331 16.841 27.368 935 HA HIS 128 HA HIS 128 15.722 16.956 24.604 936 1HB HIS 128 HB2 HIS 128 17.158 15.191 26.608 937 2HB HIS 128 HB1 HIS 128 17.745 15.558 24.987 938 HD1 HIS 128 HD1 HIS 128 19.238 16.412 27.645 939 HD2 HIS 128 HD2 HIS 128 16.765 18.891 25.380 940 HE1 HIS 128 HE1 HIS 128 19.942 18.791 28.154 941 H SER 129 HN SER 129 16.455 14.909 23.271 942 HA SER 129 HA SER 129 14.775 12.531 23.801 943 1HB SER 129 HB2 SER 129 13.359 14.169 22.496 944 2HB SER 129 HB1 SER 129 14.537 14.054 21.192 945 HG SER 129 HG SER 129 13.458 12.347 20.627 946 H THR 130 HN THR 130 15.336 10.755 22.299 947 HA THR 130 HA THR 130 18.211 10.873 21.576 948 HB THR 130 HB THR 130 17.945 8.404 21.306 949 HG1 THR 130 HG1 THR 130 15.457 9.002 21.047 950 1HG2 THR 130 HG23 THR 130 18.547 9.443 23.491 951 2HG2 THR 130 HG22 THR 130 16.835 9.483 23.913 952 3HG2 THR 130 HG21 THR 130 17.651 7.937 23.684 953 H ASP 131 HN ASP 131 15.446 11.674 20.034 954 HA ASP 131 HA ASP 131 15.908 10.259 17.502 955 1HB ASP 131 HB2 ASP 131 13.623 10.954 18.297 956 2HB ASP 131 HB1 ASP 131 14.102 12.630 18.036 957 H ILE 132 HN ILE 132 17.383 10.916 16.054 958 HA ILE 132 HA ILE 132 19.028 13.210 16.347 959 HB ILE 132 HB ILE 132 18.397 11.571 13.875 960 1HG1 ILE 132 HG12 ILE 132 20.781 11.425 15.740 961 2HG1 ILE 132 HG11 ILE 132 19.359 10.398 15.920 962 1HG2 ILE 132 HG22 ILE 132 20.533 13.629 14.477 963 2HG2 ILE 132 HG21 ILE 132 20.701 12.439 13.187 964 3HG2 ILE 132 HG23 ILE 132 19.389 13.615 13.134 965 1HD1 ILE 132 HD12 ILE 132 19.688 9.612 13.565 966 2HD1 ILE 132 HD11 ILE 132 21.185 10.545 13.503 967 3HD1 ILE 132 HD13 ILE 132 21.033 9.195 14.628 968 H GLY 133 HN GLY 133 16.098 12.715 14.384 969 1HA GLY 133 HA2 GLY 133 16.263 15.274 13.065 970 2HA GLY 133 HA1 GLY 133 14.830 14.252 13.138 971 H ALA 134 HN ALA 134 15.978 14.821 16.268 972 HA ALA 134 HA ALA 134 13.831 16.851 16.698 973 1HB ALA 134 HB3 ALA 134 15.385 15.124 18.644 974 2HB ALA 134 HB2 ALA 134 14.174 16.314 19.117 975 3HB ALA 134 HB1 ALA 134 13.705 14.915 18.153 976 H LEU 135 HN LEU 135 14.288 18.902 17.378 977 HA LEU 135 HA LEU 135 16.961 19.943 17.066 978 1HB LEU 135 HB2 LEU 135 14.532 21.202 18.387 979 2HB LEU 135 HB1 LEU 135 15.985 22.061 17.876 980 HG LEU 135 HG LEU 135 14.125 20.525 16.034 981 1HD1 LEU 135 HD13 LEU 135 13.232 22.678 17.034 982 2HD1 LEU 135 HD12 LEU 135 14.558 23.518 16.230 983 3HD1 LEU 135 HD11 LEU 135 13.344 22.670 15.274 984 1HD2 LEU 135 HD23 LEU 135 16.727 22.001 15.633 985 2HD2 LEU 135 HD22 LEU 135 16.203 20.462 14.947 986 3HD2 LEU 135 HD21 LEU 135 15.538 21.970 14.331 987 H MET 136 HN MET 136 15.027 18.957 19.843 988 HA MET 136 HA MET 136 16.807 20.110 21.805 989 1HB MET 136 HB2 MET 136 14.852 17.839 22.218 990 2HB MET 136 HB1 MET 136 15.477 18.953 23.432 991 1HG MET 136 HG2 MET 136 14.439 20.832 22.023 992 2HG MET 136 HG1 MET 136 13.582 19.559 21.161 993 1HE MET 136 HE2 MET 136 14.204 21.554 24.196 994 2HE MET 136 HE1 MET 136 12.999 21.100 25.396 995 3HE MET 136 HE3 MET 136 14.432 20.094 25.156 996 H TYR 137 HN TYR 137 17.697 17.871 19.696 997 HA TYR 137 HA TYR 137 18.619 15.685 21.289 998 1HB TYR 137 HB2 TYR 137 18.507 15.857 18.723 999 2HB TYR 137 HB1 TYR 137 20.042 16.719 18.830 1000 HD1 TYR 137 HD1 TYR 137 22.069 15.585 19.660 1001 HD2 TYR 137 HD2 TYR 137 18.351 13.488 19.225 1002 HE1 TYR 137 HE1 TYR 137 23.267 13.423 19.845 1003 HE2 TYR 137 HE2 TYR 137 19.544 11.327 19.410 1004 HH TYR 137 HH TYR 137 22.762 10.963 19.013 1005 HA PRO 138 HA PRO 138 21.814 17.901 23.528 1006 1HB PRO 138 HB2 PRO 138 23.487 15.660 24.062 1007 2HB PRO 138 HB1 PRO 138 22.186 16.274 25.091 1008 1HG PRO 138 HG2 PRO 138 22.203 13.876 23.360 1009 2HG PRO 138 HG1 PRO 138 21.124 14.271 24.707 1010 1HD PRO 138 HD2 PRO 138 20.439 14.379 21.969 1011 2HD PRO 138 HD1 PRO 138 19.524 15.119 23.297 1012 H SER 139 HN SER 139 22.055 17.891 20.627 1013 HA SER 139 HA SER 139 24.965 18.298 20.453 1014 1HB SER 139 HB2 SER 139 25.447 16.740 18.766 1015 2HB SER 139 HB1 SER 139 24.397 15.826 19.843 1016 HG SER 139 HG SER 139 23.794 15.684 17.613 1017 H TYR 140 HN TYR 140 25.508 19.746 18.759 1018 HA TYR 140 HA TYR 140 23.275 21.350 17.783 1019 1HB TYR 140 HB2 TYR 140 25.405 22.419 18.417 1020 2HB TYR 140 HB1 TYR 140 26.236 21.524 17.145 1021 HD1 TYR 140 HD1 TYR 140 25.657 21.927 14.747 1022 HD2 TYR 140 HD2 TYR 140 24.084 24.365 17.913 1023 HE1 TYR 140 HE1 TYR 140 25.028 23.664 13.095 1024 HE2 TYR 140 HE2 TYR 140 23.455 26.105 16.260 1025 HH TYR 140 HH TYR 140 22.909 26.130 13.740 1026 H THR 141 HN THR 141 22.125 20.751 16.030 1027 HA THR 141 HA THR 141 23.476 20.008 13.541 1028 HB THR 141 HB THR 141 22.121 17.885 13.302 1029 HG1 THR 141 HG1 THR 141 20.938 18.753 15.388 1030 1HG2 THR 141 HG22 THR 141 24.570 18.004 14.073 1031 2HG2 THR 141 HG21 THR 141 23.947 17.717 15.699 1032 3HG2 THR 141 HG23 THR 141 23.692 16.519 14.432 1033 H PHE 142 HN PHE 142 22.024 20.285 11.726 1034 HA PHE 142 HA PHE 142 19.185 20.679 12.144 1035 1HB PHE 142 HB2 PHE 142 18.994 23.027 11.894 1036 2HB PHE 142 HB1 PHE 142 20.291 22.814 13.064 1037 HD1 PHE 142 HD1 PHE 142 22.728 22.777 12.149 1038 HD2 PHE 142 HD2 PHE 142 19.364 24.259 9.929 1039 HE1 PHE 142 HE1 PHE 142 24.263 24.041 10.663 1040 HE2 PHE 142 HE2 PHE 142 20.894 25.517 8.442 1041 HZ PHE 142 HZ PHE 142 23.345 25.408 8.808 1042 H SER 143 HN SER 143 18.059 20.977 10.131 1043 HA SER 143 HA SER 143 19.639 20.086 7.791 1044 1HB SER 143 HB2 SER 143 16.651 20.473 8.143 1045 2HB SER 143 HB1 SER 143 17.430 19.763 6.732 1046 HG SER 143 HG SER 143 18.297 18.169 8.170 1047 H GLY 144 HN GLY 144 18.852 21.163 5.617 1048 1HA GLY 144 HA2 GLY 144 19.742 23.814 5.511 1049 2HA GLY 144 HA1 GLY 144 18.657 23.112 4.310 1050 H ASP 145 HN ASP 145 16.527 22.574 6.234 1051 HA ASP 145 HA ASP 145 15.595 25.383 6.777 1052 1HB ASP 145 HB2 ASP 145 14.028 22.929 5.914 1053 2HB ASP 145 HB1 ASP 145 13.284 24.435 6.454 1054 H VAL 146 HN VAL 146 14.766 25.767 8.826 1055 HA VAL 146 HA VAL 146 15.141 23.591 10.818 1056 HB VAL 146 HB VAL 146 14.492 26.532 11.203 1057 1HG1 VAL 146 HG12 VAL 146 15.314 24.333 13.121 1058 2HG1 VAL 146 HG11 VAL 146 15.310 26.048 13.535 1059 3HG1 VAL 146 HG13 VAL 146 13.798 25.236 13.126 1060 1HG2 VAL 146 HG21 VAL 146 16.716 26.031 10.126 1061 2HG2 VAL 146 HG23 VAL 146 16.844 26.818 11.699 1062 3HG2 VAL 146 HG22 VAL 146 17.132 25.085 11.554 1063 H GLN 147 HN GLN 147 13.374 22.326 11.148 1064 HA GLN 147 HA GLN 147 10.711 23.652 11.462 1065 1HB GLN 147 HB2 GLN 147 11.353 21.245 9.735 1066 2HB GLN 147 HB1 GLN 147 9.714 21.683 10.221 1067 1HG GLN 147 HG2 GLN 147 9.937 23.866 9.138 1068 2HG GLN 147 HG1 GLN 147 11.615 23.515 8.726 1069 1HE2 GLN 147 HE22 GLN 147 9.380 22.683 5.795 1070 2HE2 GLN 147 HE21 GLN 147 9.598 24.087 6.724 1071 H LEU 148 HN LEU 148 9.189 22.299 12.701 1072 HA LEU 148 HA LEU 148 10.527 20.953 14.906 1073 1HB LEU 148 HB2 LEU 148 7.585 21.212 14.220 1074 2HB LEU 148 HB1 LEU 148 8.209 20.582 15.743 1075 HG LEU 148 HG LEU 148 8.843 23.349 14.669 1076 1HD1 LEU 148 HD11 LEU 148 6.726 22.391 16.609 1077 2HD1 LEU 148 HD13 LEU 148 7.255 24.072 16.527 1078 3HD1 LEU 148 HD12 LEU 148 6.492 23.317 15.127 1079 1HD2 LEU 148 HD23 LEU 148 9.473 21.849 17.214 1080 2HD2 LEU 148 HD22 LEU 148 10.536 22.844 16.220 1081 3HD2 LEU 148 HD21 LEU 148 9.331 23.606 17.250 1082 H ALA 149 HN ALA 149 10.030 18.711 15.556 1083 HA ALA 149 HA ALA 149 9.770 16.923 13.167 1084 1HB ALA 149 HB3 ALA 149 10.965 16.514 15.919 1085 2HB ALA 149 HB2 ALA 149 10.744 15.208 14.754 1086 3HB ALA 149 HB1 ALA 149 11.818 16.555 14.374 1087 H GLN 150 HN GLN 150 8.538 14.896 13.510 1088 HA GLN 150 HA GLN 150 5.923 15.383 14.518 1089 1HB GLN 150 HB2 GLN 150 6.461 13.633 12.828 1090 2HB GLN 150 HB1 GLN 150 7.256 12.691 14.090 1091 1HG GLN 150 HG2 GLN 150 5.145 12.569 15.351 1092 2HG GLN 150 HG1 GLN 150 4.342 13.541 14.117 1093 1HE2 GLN 150 HE22 GLN 150 3.624 9.994 13.284 1094 2HE2 GLN 150 HE21 GLN 150 3.241 11.055 14.553 1095 H ASP 151 HN ASP 151 8.733 13.770 15.973 1096 HA ASP 151 HA ASP 151 7.449 12.805 18.319 1097 1HB ASP 151 HB2 ASP 151 9.750 12.165 17.669 1098 2HB ASP 151 HB1 ASP 151 10.295 13.808 17.999 1099 H ASP 152 HN ASP 152 8.899 15.986 17.596 1100 HA ASP 152 HA ASP 152 8.397 16.983 20.287 1101 1HB ASP 152 HB2 ASP 152 9.141 18.352 17.694 1102 2HB ASP 152 HB1 ASP 152 8.930 19.220 19.215 1103 H ILE 153 HN ILE 153 6.779 17.303 17.125 1104 HA ILE 153 HA ILE 153 4.782 19.157 17.975 1105 HB ILE 153 HB ILE 153 4.691 16.992 15.846 1106 1HG1 ILE 153 HG12 ILE 153 4.996 19.993 15.548 1107 2HG1 ILE 153 HG11 ILE 153 6.381 18.907 15.673 1108 1HG2 ILE 153 HG22 ILE 153 2.765 19.214 16.556 1109 2HG2 ILE 153 HG21 ILE 153 2.820 18.509 14.941 1110 3HG2 ILE 153 HG23 ILE 153 2.415 17.500 16.330 1111 1HD1 ILE 153 HD12 ILE 153 4.183 18.582 13.616 1112 2HD1 ILE 153 HD11 ILE 153 5.691 19.439 13.303 1113 3HD1 ILE 153 HD13 ILE 153 5.719 17.717 13.681 1114 H ASP 154 HN ASP 154 4.689 15.582 17.821 1115 HA ASP 154 HA ASP 154 2.089 15.301 18.950 1116 1HB ASP 154 HB2 ASP 154 4.487 13.460 18.977 1117 2HB ASP 154 HB1 ASP 154 2.906 12.991 19.601 1118 H GLY 155 HN GLY 155 5.282 15.493 20.486 1119 1HA GLY 155 HA2 GLY 155 4.436 14.870 23.128 1120 2HA GLY 155 HA1 GLY 155 5.877 15.800 22.728 1121 H ILE 156 HN ILE 156 4.908 18.114 21.635 1122 HA ILE 156 HA ILE 156 3.886 19.455 23.972 1123 HB ILE 156 HB ILE 156 5.380 20.507 22.219 1124 1HG1 ILE 156 HG12 ILE 156 4.162 22.711 22.281 1125 2HG1 ILE 156 HG11 ILE 156 2.764 21.867 22.943 1126 1HG2 ILE 156 HG21 ILE 156 4.003 19.618 20.292 1127 2HG2 ILE 156 HG23 ILE 156 2.793 20.839 20.681 1128 3HG2 ILE 156 HG22 ILE 156 4.412 21.327 20.182 1129 1HD1 ILE 156 HD12 ILE 156 5.397 21.471 24.325 1130 2HD1 ILE 156 HD11 ILE 156 4.583 23.020 24.527 1131 3HD1 ILE 156 HD13 ILE 156 3.767 21.533 24.998 1132 H GLN 157 HN GLN 157 2.365 18.351 20.954 1133 HA GLN 157 HA GLN 157 -0.169 19.630 21.450 1134 1HB GLN 157 HB2 GLN 157 0.617 17.215 19.806 1135 2HB GLN 157 HB1 GLN 157 -1.046 17.797 19.894 1136 1HG GLN 157 HG2 GLN 157 -0.322 20.007 19.080 1137 2HG GLN 157 HG1 GLN 157 1.343 19.427 18.988 1138 1HE2 GLN 157 HE22 GLN 157 -0.261 16.900 16.484 1139 2HE2 GLN 157 HE21 GLN 157 0.011 16.681 18.146 1140 H ALA 158 HN ALA 158 1.154 16.446 22.318 1141 HA ALA 158 HA ALA 158 -1.232 15.351 23.418 1142 1HB ALA 158 HB1 ALA 158 0.842 14.044 22.992 1143 2HB ALA 158 HB3 ALA 158 1.621 14.879 24.336 1144 3HB ALA 158 HB2 ALA 158 0.241 13.822 24.634 1145 H ILE 159 HN ILE 159 1.286 17.400 24.897 1146 HA ILE 159 HA ILE 159 0.191 17.290 27.552 1147 HB ILE 159 HB ILE 159 1.860 19.450 26.223 1148 1HG1 ILE 159 HG12 ILE 159 2.704 17.226 28.106 1149 2HG1 ILE 159 HG11 ILE 159 2.823 17.103 26.350 1150 1HG2 ILE 159 HG21 ILE 159 0.984 18.979 29.077 1151 2HG2 ILE 159 HG23 ILE 159 2.474 19.852 28.720 1152 3HG2 ILE 159 HG22 ILE 159 0.930 20.471 28.140 1153 1HD1 ILE 159 HD13 ILE 159 4.141 19.246 28.051 1154 2HD1 ILE 159 HD12 ILE 159 4.964 17.853 27.348 1155 3HD1 ILE 159 HD11 ILE 159 4.277 19.092 26.298 1156 H TYR 160 HN TYR 160 -0.173 19.727 24.950 1157 HA TYR 160 HA TYR 160 -2.394 20.984 26.481 1158 1HB TYR 160 HB2 TYR 160 -0.902 21.784 23.970 1159 2HB TYR 160 HB1 TYR 160 -2.320 22.650 24.560 1160 HD1 TYR 160 HD2 TYR 160 -2.256 23.910 26.651 1161 HD2 TYR 160 HD1 TYR 160 1.207 21.834 25.194 1162 HE1 TYR 160 HE2 TYR 160 -0.834 25.154 28.257 1163 HE2 TYR 160 HE1 TYR 160 2.630 23.075 26.803 1164 HH TYR 160 HH TYR 160 2.034 24.283 29.230 1165 H GLY 161 HN GLY 161 -1.927 20.164 23.024 1166 1HA GLY 161 HA2 GLY 161 -3.820 18.259 22.563 1167 2HA GLY 161 HA1 GLY 161 -4.823 19.697 22.756 1168 H ARG 162 HN ARG 162 -5.384 19.181 20.459 1169 HA ARG 162 HA ARG 162 -3.335 19.702 18.420 1170 1HB ARG 162 HB2 ARG 162 -6.315 19.157 18.278 1171 2HB ARG 162 HB1 ARG 162 -5.312 19.442 16.855 1172 1HG ARG 162 HG2 ARG 162 -3.888 17.531 17.453 1173 2HG ARG 162 HG1 ARG 162 -4.855 17.253 18.903 1174 1HD ARG 162 HD2 ARG 162 -5.551 15.737 17.083 1175 2HD ARG 162 HD1 ARG 162 -6.847 16.856 17.500 1176 HE ARG 162 HE ARG 162 -5.496 18.130 15.439 1177 1HH1 ARG 162 HH21 ARG 162 -6.931 15.036 15.966 1178 2HH1 ARG 162 HH22 ARG 162 -7.373 14.814 14.305 1179 1HH2 ARG 162 HH11 ARG 162 -6.063 17.852 13.272 1180 2HH2 ARG 162 HH12 ARG 162 -6.880 16.406 12.782 1181 H SER 163 HN SER 163 -3.699 21.466 16.787 1182 HA SER 163 HA SER 163 -4.256 23.972 18.145 1183 1HB SER 163 HB2 SER 163 -3.558 23.281 15.287 1184 2HB SER 163 HB1 SER 163 -3.868 24.934 15.813 1185 HG SER 163 HG SER 163 -2.184 24.718 17.298 1186 H GLN 164 HN GLN 164 -6.612 22.687 18.402 1187 HA GLN 164 HA GLN 164 -8.445 23.251 16.201 1188 1HB GLN 164 HB2 GLN 164 -8.874 22.436 19.087 1189 2HB GLN 164 HB1 GLN 164 -10.204 22.720 17.963 1190 1HG GLN 164 HG2 GLN 164 -9.347 20.988 16.461 1191 2HG GLN 164 HG1 GLN 164 -7.950 20.739 17.508 1192 1HE2 GLN 164 HE22 GLN 164 -10.666 18.233 18.336 1193 2HE2 GLN 164 HE21 GLN 164 -9.898 18.658 16.883 1194 H ASN 165 HN ASN 165 -9.694 25.101 15.925 1195 HA ASN 165 HA ASN 165 -9.928 27.026 18.146 1196 1HB ASN 165 HB2 ASN 165 -8.634 27.765 15.507 1197 2HB ASN 165 HB1 ASN 165 -9.031 28.898 16.799 1198 1HD2 ASN 165 HD22 ASN 165 -5.564 26.917 16.985 1199 2HD2 ASN 165 HD21 ASN 165 -6.521 27.002 15.585 1200 HA PRO 166 HA PRO 166 -13.911 27.569 16.222 1201 1HB PRO 166 HB2 PRO 166 -14.132 30.398 16.793 1202 2HB PRO 166 HB1 PRO 166 -14.875 29.055 17.674 1203 1HG PRO 166 HG2 PRO 166 -12.619 30.705 18.495 1204 2HG PRO 166 HG1 PRO 166 -13.440 29.440 19.418 1205 1HD PRO 166 HD2 PRO 166 -10.825 29.287 18.246 1206 2HD PRO 166 HD1 PRO 166 -11.727 27.982 19.047 1207 H VAL 167 HN VAL 167 -13.738 27.480 14.001 1208 HA VAL 167 HA VAL 167 -12.269 29.566 12.516 1209 HB VAL 167 HB VAL 167 -12.081 27.192 11.841 1210 1HG1 VAL 167 HG12 VAL 167 -14.529 26.729 12.528 1211 2HG1 VAL 167 HG11 VAL 167 -14.962 27.365 10.940 1212 3HG1 VAL 167 HG13 VAL 167 -13.936 25.935 11.070 1213 1HG2 VAL 167 HG22 VAL 167 -11.937 29.116 10.184 1214 2HG2 VAL 167 HG21 VAL 167 -12.360 27.555 9.479 1215 3HG2 VAL 167 HG23 VAL 167 -13.612 28.767 9.752 1216 H GLN 168 HN GLN 168 -13.252 31.138 11.245 1217 HA GLN 168 HA GLN 168 -16.063 31.694 11.788 1218 1HB GLN 168 HB2 GLN 168 -14.052 33.077 9.982 1219 2HB GLN 168 HB1 GLN 168 -15.640 33.721 10.393 1220 1HG GLN 168 HG2 GLN 168 -15.003 33.620 12.810 1221 2HG GLN 168 HG1 GLN 168 -13.383 33.123 12.323 1222 1HE2 GLN 168 HE22 GLN 168 -13.233 36.802 12.719 1223 2HE2 GLN 168 HE21 GLN 168 -13.449 35.459 13.734 1224 HA PRO 169 HA PRO 169 -17.827 29.580 8.310 1225 1HB PRO 169 HB2 PRO 169 -19.442 31.848 7.421 1226 2HB PRO 169 HB1 PRO 169 -19.974 30.370 8.235 1227 1HG PRO 169 HG2 PRO 169 -19.728 33.016 9.377 1228 2HG PRO 169 HG1 PRO 169 -20.257 31.536 10.187 1229 1HD PRO 169 HD2 PRO 169 -17.779 32.927 10.587 1230 2HD PRO 169 HD1 PRO 169 -18.264 31.374 11.296 No H/Q in entry = 1230 Start of MODEL 9 1 1H VAL 1 HT3 VAL 1 9.535 14.260 43.450 2 2H VAL 1 HT2 VAL 1 10.884 13.250 43.668 3 3H VAL 1 HT1 VAL 1 10.751 14.698 44.548 4 HA VAL 1 HA VAL 1 11.931 15.700 42.986 5 HB VAL 1 HB VAL 1 12.643 14.489 40.959 6 1HG1 VAL 1 HG13 VAL 1 13.615 13.997 43.262 7 2HG1 VAL 1 HG12 VAL 1 12.573 12.575 43.308 8 3HG1 VAL 1 HG11 VAL 1 13.822 12.714 42.070 9 1HG2 VAL 1 HG21 VAL 1 10.530 12.504 41.856 10 2HG2 VAL 1 HG23 VAL 1 10.595 13.374 40.322 11 3HG2 VAL 1 HG22 VAL 1 11.783 12.119 40.677 12 H LEU 2 HN LEU 2 8.864 14.300 42.049 13 HA LEU 2 HA LEU 2 8.431 16.021 39.750 14 1HB LEU 2 HB2 LEU 2 6.435 14.537 41.488 15 2HB LEU 2 HB1 LEU 2 6.083 15.264 39.923 16 HG LEU 2 HG LEU 2 8.128 13.075 40.398 17 1HD1 LEU 2 HD13 LEU 2 5.280 13.033 39.366 18 2HD1 LEU 2 HD12 LEU 2 6.419 11.719 39.065 19 3HD1 LEU 2 HD11 LEU 2 5.959 12.125 40.718 20 1HD2 LEU 2 HD23 LEU 2 7.252 14.663 37.986 21 2HD2 LEU 2 HD22 LEU 2 8.872 14.143 38.453 22 3HD2 LEU 2 HD21 LEU 2 7.742 12.982 37.767 23 H THR 3 HN THR 3 7.023 17.893 39.695 24 HA THR 3 HA THR 3 7.067 19.424 42.230 25 HB THR 3 HB THR 3 6.412 21.331 40.813 26 HG1 THR 3 HG1 THR 3 6.295 20.913 38.538 27 1HG2 THR 3 HG22 THR 3 8.636 19.645 39.636 28 2HG2 THR 3 HG21 THR 3 8.438 21.383 39.407 29 3HG2 THR 3 HG23 THR 3 8.791 20.740 41.009 30 H GLU 4 HN GLU 4 5.108 20.593 42.914 31 HA GLU 4 HA GLU 4 2.839 18.855 43.123 32 1HB GLU 4 HB2 GLU 4 3.401 20.566 44.818 33 2HB GLU 4 HB1 GLU 4 3.056 21.838 43.647 34 1HG GLU 4 HG2 GLU 4 0.731 21.165 43.513 35 2HG GLU 4 HG1 GLU 4 1.039 19.761 44.540 36 H GLY 5 HN GLY 5 0.994 18.737 41.887 37 1HA GLY 5 HA2 GLY 5 -0.547 19.237 40.178 38 2HA GLY 5 HA1 GLY 5 0.135 20.864 40.114 39 H ASN 6 HN ASN 6 -0.328 20.131 37.685 40 HA ASN 6 HA ASN 6 1.743 18.429 36.536 41 1HB ASN 6 HB2 ASN 6 -0.288 20.229 35.192 42 2HB ASN 6 HB1 ASN 6 0.710 19.026 34.377 43 1HD2 ASN 6 HD22 ASN 6 -1.434 16.361 35.205 44 2HD2 ASN 6 HD21 ASN 6 -0.099 16.905 34.308 45 HA PRO 7 HA PRO 7 4.532 22.010 36.293 46 1HB PRO 7 HB2 PRO 7 6.359 20.677 34.515 47 2HB PRO 7 HB1 PRO 7 6.525 20.880 36.262 48 1HG PRO 7 HG2 PRO 7 5.861 18.450 34.783 49 2HG PRO 7 HG1 PRO 7 6.205 18.626 36.510 50 1HD PRO 7 HD2 PRO 7 3.645 18.161 35.296 51 2HD PRO 7 HD1 PRO 7 3.979 18.464 37.016 52 H ARG 8 HN ARG 8 2.645 22.881 34.997 53 HA ARG 8 HA ARG 8 3.478 23.332 32.176 54 1HB ARG 8 HB2 ARG 8 0.699 22.426 33.002 55 2HB ARG 8 HB1 ARG 8 1.172 22.923 31.378 56 1HG ARG 8 HG2 ARG 8 2.822 21.075 31.306 57 2HG ARG 8 HG1 ARG 8 2.310 20.568 32.915 58 1HD ARG 8 HD2 ARG 8 -0.011 20.276 32.038 59 2HD ARG 8 HD1 ARG 8 0.598 20.632 30.422 60 HE ARG 8 HE ARG 8 2.233 18.580 31.283 61 1HH1 ARG 8 HH21 ARG 8 -1.167 19.124 31.150 62 2HH1 ARG 8 HH22 ARG 8 -1.555 17.466 30.835 63 1HH2 ARG 8 HH11 ARG 8 1.752 16.413 30.860 64 2HH2 ARG 8 HH12 ARG 8 0.100 15.927 30.672 65 H TRP 9 HN TRP 9 2.604 25.328 31.332 66 HA TRP 9 HA TRP 9 2.158 27.362 33.333 67 1HB TRP 9 HB2 TRP 9 1.949 27.303 30.314 68 2HB TRP 9 HB1 TRP 9 1.525 28.745 31.236 69 HD1 TRP 9 HD1 TRP 9 4.490 26.554 30.275 70 HE1 TRP 9 HE1 TRP 9 6.675 27.799 30.852 71 HE3 TRP 9 HE3 TRP 9 2.580 30.541 32.808 72 HZ2 TRP 9 HZ2 TRP 9 7.504 30.180 32.217 73 HZ3 TRP 9 HZ3 TRP 9 4.077 32.283 33.734 74 HH2 TRP 9 HH2 TRP 9 6.534 32.111 33.443 75 H GLU 10 HN GLU 10 0.241 28.042 34.193 76 HA GLU 10 HA GLU 10 -2.184 26.546 33.563 77 1HB GLU 10 HB2 GLU 10 -1.609 28.858 35.437 78 2HB GLU 10 HB1 GLU 10 -3.198 28.108 35.288 79 1HG GLU 10 HG2 GLU 10 -0.692 26.522 35.898 80 2HG GLU 10 HG1 GLU 10 -1.730 27.186 37.161 81 H GLN 11 HN GLN 11 -0.742 29.465 32.457 82 HA GLN 11 HA GLN 11 -3.299 30.612 31.506 83 1HB GLN 11 HB2 GLN 11 -0.430 31.522 31.088 84 2HB GLN 11 HB1 GLN 11 -1.872 32.434 30.644 85 1HG GLN 11 HG2 GLN 11 -1.226 31.545 33.469 86 2HG GLN 11 HG1 GLN 11 -0.875 33.151 32.831 87 1HE2 GLN 11 HE22 GLN 11 -4.366 32.811 34.472 88 2HE2 GLN 11 HE21 GLN 11 -2.900 32.100 34.947 89 H THR 12 HN THR 12 -3.943 30.551 29.329 90 HA THR 12 HA THR 12 -2.505 28.627 27.593 91 HB THR 12 HB THR 12 -4.459 29.049 26.047 92 HG1 THR 12 HG1 THR 12 -6.131 30.283 26.830 93 1HG2 THR 12 HG22 THR 12 -5.017 28.196 28.898 94 2HG2 THR 12 HG21 THR 12 -6.136 27.944 27.558 95 3HG2 THR 12 HG23 THR 12 -4.558 27.158 27.547 96 H HIS 13 HN HIS 13 -2.354 31.829 28.307 97 HA HIS 13 HA HIS 13 -1.192 32.547 25.645 98 1HB HIS 13 HB2 HIS 13 -2.682 34.384 27.553 99 2HB HIS 13 HB1 HIS 13 -2.035 34.817 25.969 100 HD1 HIS 13 HD1 HIS 13 -5.163 34.660 27.031 101 HD2 HIS 13 HD2 HIS 13 -3.229 32.119 24.351 102 HE1 HIS 13 HE1 HIS 13 -6.976 33.584 25.627 103 H LEU 14 HN LEU 14 0.846 33.491 25.811 104 HA LEU 14 HA LEU 14 1.863 34.212 28.539 105 1HB LEU 14 HB2 LEU 14 3.310 32.541 26.457 106 2HB LEU 14 HB1 LEU 14 3.998 33.081 27.986 107 HG LEU 14 HG LEU 14 1.522 31.338 27.756 108 1HD1 LEU 14 HD12 LEU 14 3.562 30.197 26.906 109 2HD1 LEU 14 HD11 LEU 14 4.378 30.561 28.426 110 3HD1 LEU 14 HD13 LEU 14 2.988 29.477 28.410 111 1HD2 LEU 14 HD22 LEU 14 3.204 32.369 30.053 112 2HD2 LEU 14 HD21 LEU 14 1.451 32.389 29.880 113 3HD2 LEU 14 HD23 LEU 14 2.283 30.877 30.217 114 H THR 15 HN THR 15 3.769 35.643 28.435 115 HA THR 15 HA THR 15 4.000 37.151 25.845 116 HB THR 15 HB THR 15 4.037 39.237 27.050 117 HG1 THR 15 HG1 THR 15 3.953 37.582 29.349 118 1HG2 THR 15 HG23 THR 15 1.795 38.296 26.573 119 2HG2 THR 15 HG22 THR 15 1.798 37.513 28.154 120 3HG2 THR 15 HG21 THR 15 1.793 39.273 28.041 121 H TYR 16 HN TYR 16 6.082 38.319 25.665 122 HA TYR 16 HA TYR 16 8.210 37.392 27.531 123 1HB TYR 16 HB2 TYR 16 9.624 36.565 25.720 124 2HB TYR 16 HB1 TYR 16 8.099 35.685 25.734 125 HD1 TYR 16 HD1 TYR 16 10.142 38.172 23.941 126 HD2 TYR 16 HD2 TYR 16 6.432 36.008 23.986 127 HE1 TYR 16 HE1 TYR 16 9.740 38.813 21.581 128 HE2 TYR 16 HE2 TYR 16 6.029 36.651 21.625 129 HH TYR 16 HH TYR 16 8.412 37.875 19.630 130 H ARG 17 HN ARG 17 10.188 38.638 27.306 131 HA ARG 17 HA ARG 17 9.974 41.116 25.665 132 1HB ARG 17 HB2 ARG 17 8.976 41.649 27.863 133 2HB ARG 17 HB1 ARG 17 10.444 41.087 28.662 134 1HG ARG 17 HG2 ARG 17 11.753 42.834 27.497 135 2HG ARG 17 HG1 ARG 17 10.286 43.392 26.693 136 1HD ARG 17 HD2 ARG 17 9.280 43.892 28.890 137 2HD ARG 17 HD1 ARG 17 10.757 43.348 29.686 138 HE ARG 17 HE ARG 17 11.618 45.299 27.905 139 1HH1 ARG 17 HH21 ARG 17 9.345 45.008 30.475 140 2HH1 ARG 17 HH22 ARG 17 9.388 46.690 30.883 141 1HH2 ARG 17 HH11 ARG 17 11.680 47.495 28.407 142 2HH2 ARG 17 HH12 ARG 17 10.712 48.104 29.707 143 H ILE 18 HN ILE 18 11.931 41.767 24.900 144 HA ILE 18 HA ILE 18 14.324 40.190 25.681 145 HB ILE 18 HB ILE 18 13.937 42.258 23.492 146 1HG1 ILE 18 HG12 ILE 18 14.130 39.239 23.268 147 2HG1 ILE 18 HG11 ILE 18 12.597 40.114 23.295 148 1HG2 ILE 18 HG22 ILE 18 16.185 40.336 24.146 149 2HG2 ILE 18 HG21 ILE 18 16.060 41.222 22.626 150 3HG2 ILE 18 HG23 ILE 18 16.264 42.098 24.142 151 1HD1 ILE 18 HD12 ILE 18 14.824 40.654 21.315 152 2HD1 ILE 18 HD11 ILE 18 13.420 39.644 20.975 153 3HD1 ILE 18 HD13 ILE 18 13.211 41.363 21.309 154 H GLU 19 HN GLU 19 15.558 41.022 27.284 155 HA GLU 19 HA GLU 19 15.204 43.682 28.301 156 1HB GLU 19 HB2 GLU 19 17.341 41.597 28.757 157 2HB GLU 19 HB1 GLU 19 17.289 43.133 29.625 158 1HG GLU 19 HG2 GLU 19 14.959 41.198 29.535 159 2HG GLU 19 HG1 GLU 19 16.160 41.207 30.826 160 H ASN 20 HN ASN 20 17.685 42.268 26.159 161 HA ASN 20 HA ASN 20 18.277 44.930 25.127 162 1HB ASN 20 HB2 ASN 20 19.515 44.858 27.303 163 2HB ASN 20 HB1 ASN 20 20.441 43.493 26.683 164 1HD2 ASN 20 HD22 ASN 20 22.742 45.955 25.583 165 2HD2 ASN 20 HD21 ASN 20 22.441 44.732 26.722 166 H TYR 21 HN TYR 21 19.678 44.864 23.286 167 HA TYR 21 HA TYR 21 19.902 42.149 22.056 168 1HB TYR 21 HB2 TYR 21 20.023 44.925 20.827 169 2HB TYR 21 HB1 TYR 21 20.152 43.413 19.930 170 HD1 TYR 21 HD1 TYR 21 18.233 41.948 19.641 171 HD2 TYR 21 HD2 TYR 21 17.905 45.623 21.820 172 HE1 TYR 21 HE1 TYR 21 15.763 41.796 19.510 173 HE2 TYR 21 HE2 TYR 21 15.434 45.472 21.706 174 HH TYR 21 HH TYR 21 13.706 44.394 20.795 175 H THR 22 HN THR 22 21.923 41.303 21.677 176 HA THR 22 HA THR 22 24.235 42.663 22.745 177 HB THR 22 HB THR 22 24.312 40.322 22.940 178 HG1 THR 22 HG1 THR 22 26.291 40.901 22.259 179 1HG2 THR 22 HG22 THR 22 23.336 40.344 20.087 180 2HG2 THR 22 HG21 THR 22 24.079 38.903 20.779 181 3HG2 THR 22 HG23 THR 22 22.611 39.566 21.494 182 HA PRO 23 HA PRO 23 25.403 44.779 18.984 183 1HB PRO 23 HB2 PRO 23 28.207 44.761 19.336 184 2HB PRO 23 HB1 PRO 23 27.099 45.988 19.970 185 1HG PRO 23 HG2 PRO 23 28.489 43.814 21.428 186 2HG PRO 23 HG1 PRO 23 27.772 45.303 22.063 187 1HD PRO 23 HD2 PRO 23 26.657 42.708 22.292 188 2HD PRO 23 HD1 PRO 23 25.813 44.242 22.598 189 H ASP 24 HN ASP 24 25.962 41.593 19.666 190 HA ASP 24 HA ASP 24 27.851 40.787 17.673 191 1HB ASP 24 HB2 ASP 24 25.558 39.320 19.000 192 2HB ASP 24 HB1 ASP 24 26.692 38.539 17.897 193 H LEU 25 HN LEU 25 24.326 41.199 17.568 194 HA LEU 25 HA LEU 25 24.495 41.199 14.599 195 1HB LEU 25 HB2 LEU 25 22.622 39.550 16.305 196 2HB LEU 25 HB1 LEU 25 22.285 39.891 14.613 197 HG LEU 25 HG LEU 25 24.866 38.620 15.570 198 1HD1 LEU 25 HD11 LEU 25 22.261 37.362 14.678 199 2HD1 LEU 25 HD13 LEU 25 23.796 36.494 14.665 200 3HD1 LEU 25 HD12 LEU 25 23.133 37.092 16.185 201 1HD2 LEU 25 HD22 LEU 25 23.613 39.178 12.879 202 2HD2 LEU 25 HD21 LEU 25 25.281 39.401 13.399 203 3HD2 LEU 25 HD23 LEU 25 24.676 37.785 13.062 204 HA PRO 26 HA PRO 26 22.017 44.843 14.997 205 1HB PRO 26 HB2 PRO 26 20.179 44.135 12.848 206 2HB PRO 26 HB1 PRO 26 21.482 45.330 12.820 207 1HG PRO 26 HG2 PRO 26 21.456 42.722 11.558 208 2HG PRO 26 HG1 PRO 26 22.751 43.927 11.527 209 1HD PRO 26 HD2 PRO 26 22.757 41.428 12.939 210 2HD PRO 26 HD1 PRO 26 23.994 42.703 12.997 211 H ARG 27 HN ARG 27 20.078 45.384 16.098 212 HA ARG 27 HA ARG 27 18.713 43.286 17.476 213 1HB ARG 27 HB2 ARG 27 17.239 45.022 18.316 214 2HB ARG 27 HB1 ARG 27 18.882 45.658 18.268 215 1HG ARG 27 HG2 ARG 27 18.341 46.648 16.007 216 2HG ARG 27 HG1 ARG 27 16.659 46.188 16.279 217 1HD ARG 27 HD2 ARG 27 18.277 47.930 18.163 218 2HD ARG 27 HD1 ARG 27 17.147 48.552 16.959 219 HE ARG 27 HE ARG 27 15.608 46.775 18.395 220 1HH1 ARG 27 HH21 ARG 27 17.676 49.441 19.117 221 2HH1 ARG 27 HH22 ARG 27 16.836 49.869 20.570 222 1HH2 ARG 27 HH11 ARG 27 14.499 47.323 20.285 223 2HH2 ARG 27 HH12 ARG 27 15.039 48.669 21.232 224 H ALA 28 HN ALA 28 18.028 44.991 14.480 225 HA ALA 28 HA ALA 28 15.325 44.204 14.110 226 1HB ALA 28 HB1 ALA 28 16.534 45.869 12.701 227 2HB ALA 28 HB3 ALA 28 17.453 44.550 11.979 228 3HB ALA 28 HB2 ALA 28 15.708 44.643 11.739 229 H ASP 29 HN ASP 29 18.348 42.513 13.324 230 HA ASP 29 HA ASP 29 16.931 40.284 12.067 231 1HB ASP 29 HB2 ASP 29 19.823 40.748 12.813 232 2HB ASP 29 HB1 ASP 29 19.251 39.259 12.060 233 H VAL 30 HN VAL 30 18.246 40.985 15.259 234 HA VAL 30 HA VAL 30 18.255 38.251 16.181 235 HB VAL 30 HB VAL 30 18.154 40.904 17.624 236 1HG1 VAL 30 HG13 VAL 30 18.255 38.077 18.683 237 2HG1 VAL 30 HG12 VAL 30 18.922 39.423 19.608 238 3HG1 VAL 30 HG11 VAL 30 17.208 39.402 19.195 239 1HG2 VAL 30 HG22 VAL 30 20.353 38.858 17.193 240 2HG2 VAL 30 HG21 VAL 30 20.230 40.426 16.395 241 3HG2 VAL 30 HG23 VAL 30 20.514 40.342 18.133 242 H ASP 31 HN ASP 31 15.879 40.915 16.739 243 HA ASP 31 HA ASP 31 14.024 39.339 18.197 244 1HB ASP 31 HB2 ASP 31 12.350 41.010 17.601 245 2HB ASP 31 HB1 ASP 31 13.879 41.820 17.942 246 H HIS 32 HN HIS 32 14.550 39.648 14.723 247 HA HIS 32 HA HIS 32 12.187 38.354 13.833 248 1HB HIS 32 HB2 HIS 32 13.976 39.565 12.436 249 2HB HIS 32 HB1 HIS 32 14.884 38.054 12.497 250 HD1 HIS 32 HD1 HIS 32 11.117 38.242 12.223 251 HD2 HIS 32 HD2 HIS 32 14.394 37.270 9.838 252 HE1 HIS 32 HE1 HIS 32 10.180 37.231 10.098 253 H ALA 33 HN ALA 33 15.397 36.966 14.620 254 HA ALA 33 HA ALA 33 14.728 34.256 14.059 255 1HB ALA 33 HB1 ALA 33 16.651 35.432 16.086 256 2HB ALA 33 HB3 ALA 33 16.557 33.711 15.706 257 3HB ALA 33 HB2 ALA 33 17.031 34.866 14.460 258 H ILE 34 HN ILE 34 14.278 36.206 16.980 259 HA ILE 34 HA ILE 34 13.301 34.037 18.616 260 HB ILE 34 HB ILE 34 12.800 37.025 18.829 261 1HG1 ILE 34 HG12 ILE 34 15.192 36.543 18.899 262 2HG1 ILE 34 HG11 ILE 34 14.639 36.957 20.517 263 1HG2 ILE 34 HG21 ILE 34 12.222 34.698 20.649 264 2HG2 ILE 34 HG23 ILE 34 12.566 36.285 21.341 265 3HG2 ILE 34 HG22 ILE 34 11.203 36.078 20.243 266 1HD1 ILE 34 HD12 ILE 34 14.353 34.365 20.807 267 2HD1 ILE 34 HD11 ILE 34 15.446 34.272 19.425 268 3HD1 ILE 34 HD13 ILE 34 15.966 35.068 20.908 269 H GLU 35 HN GLU 35 11.735 36.474 16.556 270 HA GLU 35 HA GLU 35 9.043 35.875 17.244 271 1HB GLU 35 HB2 GLU 35 9.715 37.849 15.912 272 2HB GLU 35 HB1 GLU 35 10.148 36.791 14.571 273 1HG GLU 35 HG2 GLU 35 7.814 35.999 14.433 274 2HG GLU 35 HG1 GLU 35 7.382 37.048 15.785 275 H LYS 36 HN LYS 36 11.146 34.401 14.732 276 HA LYS 36 HA LYS 36 9.110 32.681 13.687 277 1HB LYS 36 HB2 LYS 36 12.118 32.378 13.732 278 2HB LYS 36 HB1 LYS 36 11.046 31.253 12.896 279 1HG LYS 36 HG2 LYS 36 10.141 33.109 11.550 280 2HG LYS 36 HG1 LYS 36 11.213 34.237 12.382 281 1HD LYS 36 HD2 LYS 36 13.178 32.963 11.553 282 2HD LYS 36 HD1 LYS 36 12.091 31.867 10.700 283 1HE LYS 36 HE2 LYS 36 11.156 34.066 9.602 284 2HE LYS 36 HE1 LYS 36 12.694 34.755 10.122 285 1HZ LYS 36 HZ1 LYS 36 12.513 32.242 8.568 286 2HZ LYS 36 HZ3 LYS 36 12.655 33.764 7.834 287 3HZ LYS 36 HZ2 LYS 36 13.891 33.197 8.852 288 H ALA 37 HN ALA 37 11.379 32.282 16.394 289 HA ALA 37 HA ALA 37 10.847 29.528 16.873 290 1HB ALA 37 HB1 ALA 37 12.609 31.004 17.995 291 2HB ALA 37 HB3 ALA 37 11.315 31.578 19.044 292 3HB ALA 37 HB2 ALA 37 11.764 29.873 19.052 293 H PHE 38 HN PHE 38 9.245 32.418 18.300 294 HA PHE 38 HA PHE 38 7.314 30.940 19.795 295 1HB PHE 38 HB2 PHE 38 7.359 33.744 18.667 296 2HB PHE 38 HB1 PHE 38 5.935 33.134 19.512 297 HD1 PHE 38 HD2 PHE 38 6.474 31.865 21.790 298 HD2 PHE 38 HD1 PHE 38 9.008 34.806 19.954 299 HE1 PHE 38 HE2 PHE 38 7.559 32.295 23.978 300 HE2 PHE 38 HE1 PHE 38 10.096 35.236 22.139 301 HZ PHE 38 HZ PHE 38 9.371 33.980 24.152 302 H GLN 39 HN GLN 39 7.237 32.172 16.462 303 HA GLN 39 HA GLN 39 4.530 31.491 15.905 304 1HB GLN 39 HB2 GLN 39 6.953 31.727 14.109 305 2HB GLN 39 HB1 GLN 39 5.317 31.468 13.500 306 1HG GLN 39 HG2 GLN 39 4.549 33.527 14.549 307 2HG GLN 39 HG1 GLN 39 6.124 33.773 15.297 308 1HE2 GLN 39 HE22 GLN 39 7.229 33.961 11.553 309 2HE2 GLN 39 HE21 GLN 39 7.211 32.587 12.548 310 H LEU 40 HN LEU 40 7.528 29.599 15.433 311 HA LEU 40 HA LEU 40 6.282 27.351 14.209 312 1HB LEU 40 HB2 LEU 40 8.728 27.504 15.989 313 2HB LEU 40 HB1 LEU 40 8.256 26.056 15.104 314 HG LEU 40 HG LEU 40 8.789 28.747 13.815 315 1HD1 LEU 40 HD13 LEU 40 10.549 26.334 14.267 316 2HD1 LEU 40 HD12 LEU 40 10.872 27.492 12.977 317 3HD1 LEU 40 HD11 LEU 40 10.884 28.021 14.659 318 1HD2 LEU 40 HD21 LEU 40 8.012 26.024 12.787 319 2HD2 LEU 40 HD23 LEU 40 7.473 27.618 12.260 320 3HD2 LEU 40 HD22 LEU 40 9.067 27.034 11.797 321 H TRP 41 HN TRP 41 6.782 28.063 17.682 322 HA TRP 41 HA TRP 41 5.644 25.527 18.508 323 1HB TRP 41 HB2 TRP 41 6.131 28.106 20.020 324 2HB TRP 41 HB1 TRP 41 5.563 26.619 20.777 325 HD1 TRP 41 HD1 TRP 41 8.632 28.413 20.149 326 HE1 TRP 41 HE1 TRP 41 10.693 26.871 20.253 327 HE3 TRP 41 HE3 TRP 41 6.346 23.832 19.930 328 HZ2 TRP 41 HZ2 TRP 41 11.299 24.087 20.239 329 HZ3 TRP 41 HZ3 TRP 41 7.701 21.759 19.971 330 HH2 TRP 41 HH2 TRP 41 10.175 21.880 20.127 331 H SER 42 HN SER 42 4.355 28.821 18.163 332 HA SER 42 HA SER 42 1.748 28.173 19.233 333 1HB SER 42 HB2 SER 42 2.551 30.498 19.114 334 2HB SER 42 HB1 SER 42 2.586 30.407 17.357 335 HG SER 42 HG SER 42 0.474 30.572 17.305 336 H ASN 43 HN ASN 43 3.148 28.222 15.988 337 HA ASN 43 HA ASN 43 0.827 27.851 14.452 338 1HB ASN 43 HB2 ASN 43 3.635 26.803 14.048 339 2HB ASN 43 HB1 ASN 43 2.366 26.645 12.835 340 1HD2 ASN 43 HD22 ASN 43 4.285 29.842 12.254 341 2HD2 ASN 43 HD21 ASN 43 4.749 28.213 12.386 342 H VAL 44 HN VAL 44 2.517 25.505 16.476 343 HA VAL 44 HA VAL 44 0.651 23.371 15.485 344 HB VAL 44 HB VAL 44 2.228 21.747 16.412 345 1HG1 VAL 44 HG13 VAL 44 2.504 22.559 14.092 346 2HG1 VAL 44 HG12 VAL 44 3.593 23.819 14.671 347 3HG1 VAL 44 HG11 VAL 44 4.053 22.123 14.819 348 1HG2 VAL 44 HG22 VAL 44 3.554 24.228 17.470 349 2HG2 VAL 44 HG21 VAL 44 3.338 22.657 18.237 350 3HG2 VAL 44 HG23 VAL 44 4.581 22.871 17.010 351 H THR 45 HN THR 45 0.525 25.587 17.816 352 HA THR 45 HA THR 45 -0.929 23.746 19.632 353 HB THR 45 HB THR 45 0.115 24.681 21.645 354 HG1 THR 45 HG1 THR 45 1.966 26.061 21.300 355 1HG2 THR 45 HG22 THR 45 1.206 22.763 20.270 356 2HG2 THR 45 HG21 THR 45 2.408 23.979 19.841 357 3HG2 THR 45 HG23 THR 45 2.161 23.541 21.528 358 HA PRO 46 HA PRO 46 -3.729 27.246 19.546 359 1HB PRO 46 HB2 PRO 46 -5.022 26.789 22.019 360 2HB PRO 46 HB1 PRO 46 -5.486 26.075 20.466 361 1HG PRO 46 HG2 PRO 46 -4.091 24.802 22.752 362 2HG PRO 46 HG1 PRO 46 -4.992 24.042 21.432 363 1HD PRO 46 HD2 PRO 46 -2.171 24.101 21.673 364 2HD PRO 46 HD1 PRO 46 -3.092 23.696 20.206 365 H LEU 47 HN LEU 47 -1.072 27.000 21.394 366 HA LEU 47 HA LEU 47 -1.543 29.002 23.445 367 1HB LEU 47 HB2 LEU 47 1.057 28.002 22.237 368 2HB LEU 47 HB1 LEU 47 0.922 28.966 23.704 369 HG LEU 47 HG LEU 47 -0.357 26.241 23.329 370 1HD1 LEU 47 HD12 LEU 47 2.214 27.075 24.695 371 2HD1 LEU 47 HD11 LEU 47 1.460 25.493 24.889 372 3HD1 LEU 47 HD13 LEU 47 2.053 25.999 23.307 373 1HD2 LEU 47 HD23 LEU 47 -0.183 28.218 25.607 374 2HD2 LEU 47 HD22 LEU 47 -1.581 27.307 25.031 375 3HD2 LEU 47 HD21 LEU 47 -0.315 26.493 25.946 376 H THR 48 HN THR 48 -0.769 31.184 23.434 377 HA THR 48 HA THR 48 -0.027 32.283 20.736 378 HB THR 48 HB THR 48 -1.471 34.208 21.139 379 HG1 THR 48 HG1 THR 48 -1.286 33.436 23.613 380 1HG2 THR 48 HG22 THR 48 -2.845 31.534 21.529 381 2HG2 THR 48 HG21 THR 48 -3.696 33.029 21.133 382 3HG2 THR 48 HG23 THR 48 -2.526 32.353 19.999 383 H PHE 49 HN PHE 49 1.481 33.981 20.822 384 HA PHE 49 HA PHE 49 2.530 34.686 23.541 385 1HB PHE 49 HB2 PHE 49 4.109 34.121 21.021 386 2HB PHE 49 HB1 PHE 49 4.796 34.747 22.521 387 HD1 PHE 49 HD1 PHE 49 3.239 31.836 20.893 388 HD2 PHE 49 HD2 PHE 49 4.999 33.339 24.509 389 HE1 PHE 49 HE1 PHE 49 3.401 29.522 21.772 390 HE2 PHE 49 HE2 PHE 49 5.157 31.026 25.395 391 HZ PHE 49 HZ PHE 49 4.359 29.117 24.027 392 H THR 50 HN THR 50 2.617 36.825 23.911 393 HA THR 50 HA THR 50 2.474 38.714 21.579 394 HB THR 50 HB THR 50 1.303 39.038 24.365 395 HG1 THR 50 HG1 THR 50 0.132 37.601 23.087 396 1HG2 THR 50 HG21 THR 50 1.440 40.831 21.940 397 2HG2 THR 50 HG23 THR 50 0.150 41.000 23.133 398 3HG2 THR 50 HG22 THR 50 1.831 41.216 23.617 399 H LYS 51 HN LYS 51 4.150 40.153 21.475 400 HA LYS 51 HA LYS 51 6.205 40.098 23.570 401 1HB LYS 51 HB2 LYS 51 6.834 40.191 21.172 402 2HB LYS 51 HB1 LYS 51 6.054 41.768 21.040 403 1HG LYS 51 HG2 LYS 51 7.587 42.686 22.733 404 2HG LYS 51 HG1 LYS 51 8.348 41.107 22.911 405 1HD LYS 51 HD2 LYS 51 9.023 41.183 20.522 406 2HD LYS 51 HD1 LYS 51 8.297 42.786 20.386 407 1HE LYS 51 HE2 LYS 51 10.506 42.069 22.336 408 2HE LYS 51 HE1 LYS 51 10.761 42.884 20.792 409 1HZ LYS 51 HZ2 LYS 51 8.902 44.446 21.766 410 2HZ LYS 51 HZ1 LYS 51 9.524 43.886 23.245 411 3HZ LYS 51 HZ3 LYS 51 10.542 44.679 22.142 412 H VAL 52 HN VAL 52 6.733 41.820 24.955 413 HA VAL 52 HA VAL 52 4.863 44.178 24.946 414 HB VAL 52 HB VAL 52 4.902 44.110 27.414 415 1HG1 VAL 52 HG13 VAL 52 3.135 42.923 26.086 416 2HG1 VAL 52 HG12 VAL 52 4.082 41.443 26.232 417 3HG1 VAL 52 HG11 VAL 52 3.416 42.209 27.674 418 1HG2 VAL 52 HG21 VAL 52 6.587 41.653 26.896 419 2HG2 VAL 52 HG23 VAL 52 6.983 43.049 27.897 420 3HG2 VAL 52 HG22 VAL 52 5.748 41.907 28.425 421 H SER 53 HN SER 53 5.858 46.136 25.173 422 HA SER 53 HA SER 53 8.816 46.151 25.299 423 1HB SER 53 HB2 SER 53 7.723 47.479 23.554 424 2HB SER 53 HB1 SER 53 6.813 48.369 24.772 425 HG SER 53 HG SER 53 9.034 49.119 23.837 426 H GLU 54 HN GLU 54 6.242 46.474 27.489 427 HA GLU 54 HA GLU 54 8.103 47.558 29.527 428 1HB GLU 54 HB2 GLU 54 5.469 48.862 28.802 429 2HB GLU 54 HB1 GLU 54 6.278 49.136 30.343 430 1HG GLU 54 HG2 GLU 54 8.282 49.945 29.145 431 2HG GLU 54 HG1 GLU 54 7.465 49.682 27.605 432 H GLY 55 HN GLY 55 7.308 47.200 31.722 433 1HA GLY 55 HA2 GLY 55 5.926 46.147 33.354 434 2HA GLY 55 HA1 GLY 55 4.927 45.486 32.057 435 H GLN 56 HN GLN 56 5.632 43.778 34.056 436 HA GLN 56 HA GLN 56 8.092 42.327 33.373 437 1HB GLN 56 HB2 GLN 56 7.303 42.460 35.720 438 2HB GLN 56 HB1 GLN 56 5.828 41.608 35.265 439 1HG GLN 56 HG2 GLN 56 7.124 39.642 34.601 440 2HG GLN 56 HG1 GLN 56 8.630 40.494 34.949 441 1HE2 GLN 56 HE22 GLN 56 8.485 39.157 38.217 442 2HE2 GLN 56 HE21 GLN 56 9.375 39.320 36.781 443 H ALA 57 HN ALA 57 8.204 40.506 32.099 444 HA ALA 57 HA ALA 57 5.653 39.545 30.850 445 1HB ALA 57 HB3 ALA 57 7.388 40.470 29.308 446 2HB ALA 57 HB2 ALA 57 8.507 39.227 29.869 447 3HB ALA 57 HB1 ALA 57 7.041 38.770 29.002 448 H ASP 58 HN ASP 58 5.349 37.253 30.667 449 HA ASP 58 HA ASP 58 6.120 35.731 32.941 450 1HB ASP 58 HB2 ASP 58 5.121 34.871 30.211 451 2HB ASP 58 HB1 ASP 58 5.316 33.763 31.569 452 H ILE 59 HN ILE 59 7.465 35.831 29.645 453 HA ILE 59 HA ILE 59 9.740 34.095 30.555 454 HB ILE 59 HB ILE 59 8.762 34.790 27.771 455 1HG1 ILE 59 HG12 ILE 59 8.725 32.127 29.208 456 2HG1 ILE 59 HG11 ILE 59 7.338 33.218 29.165 457 1HG2 ILE 59 HG21 ILE 59 11.017 33.024 28.754 458 2HG2 ILE 59 HG23 ILE 59 10.384 32.979 27.109 459 3HG2 ILE 59 HG22 ILE 59 11.150 34.444 27.717 460 1HD1 ILE 59 HD13 ILE 59 8.748 32.136 26.707 461 2HD1 ILE 59 HD12 ILE 59 7.253 31.476 27.372 462 3HD1 ILE 59 HD11 ILE 59 7.283 33.118 26.730 463 H MET 60 HN MET 60 11.479 35.267 31.133 464 HA MET 60 HA MET 60 11.946 37.931 29.873 465 1HB MET 60 HB2 MET 60 13.195 36.620 32.303 466 2HB MET 60 HB1 MET 60 13.537 38.256 31.739 467 1HG MET 60 HG2 MET 60 10.770 37.261 32.465 468 2HG MET 60 HG1 MET 60 11.807 38.149 33.575 469 1HE MET 60 HE3 MET 60 12.637 40.307 33.390 470 2HE MET 60 HE2 MET 60 13.182 40.551 31.732 471 3HE MET 60 HE1 MET 60 11.991 41.645 32.429 472 H ILE 61 HN ILE 61 13.575 38.202 28.431 473 HA ILE 61 HA ILE 61 15.619 36.017 28.121 474 HB ILE 61 HB ILE 61 14.421 37.849 26.023 475 1HG1 ILE 61 HG12 ILE 61 14.254 34.834 26.295 476 2HG1 ILE 61 HG11 ILE 61 12.996 35.936 26.852 477 1HG2 ILE 61 HG22 ILE 61 16.672 35.835 25.953 478 2HG2 ILE 61 HG21 ILE 61 15.771 36.257 24.496 479 3HG2 ILE 61 HG23 ILE 61 16.665 37.499 25.369 480 1HD1 ILE 61 HD11 ILE 61 12.826 36.858 24.537 481 2HD1 ILE 61 HD13 ILE 61 13.998 35.649 24.005 482 3HD1 ILE 61 HD12 ILE 61 12.425 35.142 24.619 483 H SER 62 HN SER 62 17.691 36.681 28.476 484 HA SER 62 HA SER 62 18.448 39.482 27.855 485 1HB SER 62 HB2 SER 62 19.428 39.838 30.086 486 2HB SER 62 HB1 SER 62 17.693 39.566 30.198 487 HG SER 62 HG SER 62 18.861 38.319 31.719 488 H PHE 63 HN PHE 63 20.793 39.788 27.893 489 HA PHE 63 HA PHE 63 22.304 37.230 27.433 490 1HB PHE 63 HB2 PHE 63 22.629 40.003 26.245 491 2HB PHE 63 HB1 PHE 63 23.751 38.676 25.967 492 HD1 PHE 63 HD1 PHE 63 20.354 39.953 25.312 493 HD2 PHE 63 HD2 PHE 63 23.121 36.740 24.618 494 HE1 PHE 63 HE1 PHE 63 18.888 39.078 23.505 495 HE2 PHE 63 HE2 PHE 63 21.659 35.871 22.812 496 HZ PHE 63 HZ PHE 63 19.545 37.039 22.259 497 H VAL 64 HN VAL 64 24.134 36.922 28.722 498 HA VAL 64 HA VAL 64 25.183 39.285 30.245 499 HB VAL 64 HB VAL 64 25.322 37.912 32.279 500 1HG1 VAL 64 HG12 VAL 64 23.308 39.328 31.750 501 2HG1 VAL 64 HG11 VAL 64 22.518 37.874 31.137 502 3HG1 VAL 64 HG13 VAL 64 22.973 37.978 32.836 503 1HG2 VAL 64 HG22 VAL 64 23.880 35.861 30.568 504 2HG2 VAL 64 HG21 VAL 64 25.474 35.685 31.302 505 3HG2 VAL 64 HG23 VAL 64 24.036 35.752 32.320 506 H ARG 65 HN ARG 65 27.348 38.908 31.180 507 HA ARG 65 HA ARG 65 28.957 36.917 29.599 508 1HB ARG 65 HB2 ARG 65 29.633 39.763 30.405 509 2HB ARG 65 HB1 ARG 65 30.832 38.616 29.810 510 1HG ARG 65 HG2 ARG 65 29.560 38.344 27.736 511 2HG ARG 65 HG1 ARG 65 28.345 39.477 28.320 512 1HD ARG 65 HD2 ARG 65 31.269 40.107 27.870 513 2HD ARG 65 HD1 ARG 65 29.972 40.566 26.777 514 HE ARG 65 HE ARG 65 30.827 41.971 29.140 515 1HH1 ARG 65 HH21 ARG 65 27.929 41.004 27.523 516 2HH1 ARG 65 HH22 ARG 65 26.946 42.163 28.350 517 1HH2 ARG 65 HH11 ARG 65 29.563 43.479 30.188 518 2HH2 ARG 65 HH12 ARG 65 27.865 43.558 29.854 519 H GLY 66 HN GLY 66 30.400 35.688 30.765 520 1HA GLY 66 HA2 GLY 66 31.464 34.748 32.626 521 2HA GLY 66 HA1 GLY 66 31.609 36.398 33.227 522 H ASP 67 HN ASP 67 31.117 35.938 35.370 523 HA ASP 67 HA ASP 67 28.979 34.278 36.274 524 1HB ASP 67 HB2 ASP 67 30.936 35.141 37.648 525 2HB ASP 67 HB1 ASP 67 30.098 36.691 37.727 526 H HIS 68 HN HIS 68 26.813 34.689 36.527 527 HA HIS 68 HA HIS 68 25.842 37.505 36.177 528 1HB HIS 68 HB2 HIS 68 23.913 36.541 34.881 529 2HB HIS 68 HB1 HIS 68 25.465 36.418 34.056 530 HD1 HIS 68 HD1 HIS 68 26.756 33.982 34.733 531 HD2 HIS 68 HD2 HIS 68 22.592 34.130 34.829 532 HE1 HIS 68 HE1 HIS 68 25.949 31.588 34.559 533 H ARG 69 HN ARG 69 26.001 36.962 38.658 534 HA ARG 69 HA ARG 69 24.879 36.499 40.662 535 1HB ARG 69 HB2 ARG 69 22.539 37.038 38.809 536 2HB ARG 69 HB1 ARG 69 22.399 36.914 40.564 537 1HG ARG 69 HG2 ARG 69 24.025 38.768 40.816 538 2HG ARG 69 HG1 ARG 69 24.130 38.898 39.062 539 1HD ARG 69 HD2 ARG 69 21.731 39.431 38.942 540 2HD ARG 69 HD1 ARG 69 21.605 39.291 40.697 541 HE ARG 69 HE ARG 69 23.622 41.160 40.305 542 1HH1 ARG 69 HH21 ARG 69 20.347 40.748 39.298 543 2HH1 ARG 69 HH22 ARG 69 20.034 42.448 39.188 544 1HH2 ARG 69 HH11 ARG 69 23.223 43.372 40.171 545 2HH2 ARG 69 HH12 ARG 69 21.661 43.930 39.674 546 H ASP 70 HN ASP 70 25.719 34.199 39.404 547 HA ASP 70 HA ASP 70 23.583 32.290 40.207 548 1HB ASP 70 HB2 ASP 70 24.946 32.402 37.514 549 2HB ASP 70 HB1 ASP 70 24.311 30.883 38.143 550 H ASN 71 HN ASN 71 24.454 30.115 40.592 551 HA ASN 71 HA ASN 71 27.206 30.257 41.692 552 1HB ASN 71 HB2 ASN 71 26.626 28.161 42.812 553 2HB ASN 71 HB1 ASN 71 25.358 29.354 43.087 554 1HD2 ASN 71 HD22 ASN 71 23.870 26.056 41.934 555 2HD2 ASN 71 HD21 ASN 71 24.964 26.443 43.173 556 H SER 72 HN SER 72 26.093 29.715 38.729 557 HA SER 72 HA SER 72 28.114 27.575 38.150 558 1HB SER 72 HB2 SER 72 25.396 27.859 36.844 559 2HB SER 72 HB1 SER 72 26.621 26.660 36.439 560 HG SER 72 HG SER 72 24.990 26.888 38.707 561 HA PRO 73 HA PRO 73 28.702 31.476 35.642 562 1HB PRO 73 HB2 PRO 73 31.551 31.243 36.084 563 2HB PRO 73 HB1 PRO 73 30.460 32.490 36.704 564 1HG PRO 73 HG2 PRO 73 31.709 30.364 38.201 565 2HG PRO 73 HG1 PRO 73 30.586 31.590 38.803 566 1HD PRO 73 HD2 PRO 73 30.068 28.767 38.324 567 2HD PRO 73 HD1 PRO 73 28.978 29.980 39.021 568 H PHE 74 HN PHE 74 29.782 31.568 33.543 569 HA PHE 74 HA PHE 74 29.946 28.957 32.266 570 1HB PHE 74 HB2 PHE 74 30.496 31.743 31.215 571 2HB PHE 74 HB1 PHE 74 30.403 30.289 30.220 572 HD1 PHE 74 HD1 PHE 74 28.278 29.132 29.871 573 HD2 PHE 74 HD2 PHE 74 28.496 32.689 32.260 574 HE1 PHE 74 HE1 PHE 74 25.815 29.346 29.763 575 HE2 PHE 74 HE2 PHE 74 26.026 32.906 32.158 576 HZ PHE 74 HZ PHE 74 24.687 31.235 30.907 577 H ASP 75 HN ASP 75 31.829 28.074 31.253 578 HA ASP 75 HA ASP 75 34.446 29.219 32.189 579 1HB ASP 75 HB2 ASP 75 33.752 27.186 33.487 580 2HB ASP 75 HB1 ASP 75 33.739 26.277 31.975 581 H GLY 76 HN GLY 76 34.258 30.196 29.955 582 1HA GLY 76 HA2 GLY 76 35.263 30.238 27.825 583 2HA GLY 76 HA1 GLY 76 35.775 28.566 28.065 584 HA PRO 77 HA PRO 77 32.125 28.859 25.093 585 1HB PRO 77 HB2 PRO 77 33.601 27.467 23.067 586 2HB PRO 77 HB1 PRO 77 33.133 29.173 23.063 587 1HG PRO 77 HG2 PRO 77 35.793 28.036 23.481 588 2HG PRO 77 HG1 PRO 77 35.342 29.739 23.307 589 1HD PRO 77 HD2 PRO 77 36.116 28.384 25.730 590 2HD PRO 77 HD1 PRO 77 35.575 30.066 25.559 591 H GLY 78 HN GLY 78 33.879 26.679 26.849 592 1HA GLY 78 HA2 GLY 78 32.706 24.216 25.726 593 2HA GLY 78 HA1 GLY 78 33.748 24.316 27.147 594 H GLY 79 HN GLY 79 31.662 22.738 27.571 595 1HA GLY 79 HA2 GLY 79 29.901 22.439 29.102 596 2HA GLY 79 HA1 GLY 79 30.158 24.103 29.626 597 H ASN 80 HN ASN 80 27.715 24.065 29.664 598 HA ASN 80 HA ASN 80 26.246 23.915 27.182 599 1HB ASN 80 HB2 ASN 80 25.575 25.058 29.905 600 2HB ASN 80 HB1 ASN 80 24.433 25.061 28.558 601 1HD2 ASN 80 HD22 ASN 80 24.212 21.864 30.656 602 2HD2 ASN 80 HD21 ASN 80 24.314 23.489 31.135 603 H LEU 81 HN LEU 81 25.389 25.634 25.931 604 HA LEU 81 HA LEU 81 27.036 28.106 25.976 605 1HB LEU 81 HB2 LEU 81 24.919 27.222 23.987 606 2HB LEU 81 HB1 LEU 81 26.105 28.506 23.761 607 HG LEU 81 HG LEU 81 26.687 25.546 24.067 608 1HD1 LEU 81 HD13 LEU 81 25.774 26.397 21.860 609 2HD1 LEU 81 HD12 LEU 81 27.212 27.410 21.735 610 3HD1 LEU 81 HD11 LEU 81 27.371 25.655 21.755 611 1HD2 LEU 81 HD21 LEU 81 28.459 27.994 24.054 612 2HD2 LEU 81 HD23 LEU 81 28.549 26.562 25.082 613 3HD2 LEU 81 HD22 LEU 81 29.064 26.471 23.399 614 H ALA 82 HN ALA 82 24.017 27.027 27.100 615 HA ALA 82 HA ALA 82 23.263 29.635 28.063 616 1HB ALA 82 HB3 ALA 82 22.689 29.735 25.550 617 2HB ALA 82 HB2 ALA 82 21.430 28.558 25.908 618 3HB ALA 82 HB1 ALA 82 21.396 30.148 26.671 619 H HIS 83 HN HIS 83 20.928 29.483 28.998 620 HA HIS 83 HA HIS 83 19.851 26.819 29.403 621 1HB HIS 83 HB2 HIS 83 20.328 26.683 31.831 622 2HB HIS 83 HB1 HIS 83 21.808 26.645 30.874 623 HD1 HIS 83 HD1 HIS 83 23.551 28.305 31.519 624 HD2 HIS 83 HD2 HIS 83 19.772 29.457 32.843 625 HE1 HIS 83 HE1 HIS 83 23.888 30.384 32.925 626 H ALA 84 HN ALA 84 18.100 26.909 31.179 627 HA ALA 84 HA ALA 84 16.986 29.640 31.578 628 1HB ALA 84 HB1 ALA 84 16.034 28.596 29.449 629 2HB ALA 84 HB3 ALA 84 15.308 27.366 30.483 630 3HB ALA 84 HB2 ALA 84 14.843 29.057 30.664 631 H PHE 85 HN PHE 85 15.234 29.605 33.221 632 HA PHE 85 HA PHE 85 15.796 27.540 35.284 633 1HB PHE 85 HB2 PHE 85 14.303 30.171 35.331 634 2HB PHE 85 HB1 PHE 85 14.340 29.063 36.703 635 HD1 PHE 85 HD2 PHE 85 16.319 31.343 34.601 636 HD2 PHE 85 HD1 PHE 85 16.403 28.649 37.947 637 HE1 PHE 85 HE2 PHE 85 18.530 32.243 35.269 638 HE2 PHE 85 HE1 PHE 85 18.616 29.550 38.615 639 HZ PHE 85 HZ PHE 85 19.682 31.347 37.278 640 H GLN 86 HN GLN 86 13.796 26.808 36.569 641 HA GLN 86 HA GLN 86 12.033 25.425 34.800 642 1HB GLN 86 HB2 GLN 86 11.992 25.898 37.787 643 2HB GLN 86 HB1 GLN 86 10.783 24.904 36.975 644 1HG GLN 86 HG2 GLN 86 13.763 24.427 36.697 645 2HG GLN 86 HG1 GLN 86 12.771 23.629 37.919 646 1HE2 GLN 86 HE22 GLN 86 10.796 21.953 35.271 647 2HE2 GLN 86 HE21 GLN 86 10.471 22.943 36.611 648 HA PRO 87 HA PRO 87 8.918 28.535 34.149 649 1HB PRO 87 HB2 PRO 87 6.629 26.815 34.301 650 2HB PRO 87 HB1 PRO 87 7.481 27.330 32.839 651 1HG PRO 87 HG2 PRO 87 7.537 24.706 34.146 652 2HG PRO 87 HG1 PRO 87 8.180 25.164 32.562 653 1HD PRO 87 HD2 PRO 87 9.703 24.608 34.916 654 2HD PRO 87 HD1 PRO 87 10.309 25.285 33.387 655 H GLY 88 HN GLY 88 8.521 29.898 35.848 656 1HA GLY 88 HA2 GLY 88 6.471 29.452 37.744 657 2HA GLY 88 HA1 GLY 88 8.002 29.048 38.525 658 HA PRO 89 HA PRO 89 7.041 33.737 38.482 659 1HB PRO 89 HB2 PRO 89 7.040 33.766 41.364 660 2HB PRO 89 HB1 PRO 89 5.670 34.064 40.285 661 1HG PRO 89 HG2 PRO 89 6.220 31.683 41.901 662 2HG PRO 89 HG1 PRO 89 4.753 32.087 40.996 663 1HD PRO 89 HD2 PRO 89 6.683 30.104 40.293 664 2HD PRO 89 HD1 PRO 89 5.342 30.686 39.283 665 H GLY 90 HN GLY 90 8.414 35.261 40.184 666 1HA GLY 90 HA2 GLY 90 10.562 35.973 40.771 667 2HA GLY 90 HA1 GLY 90 10.880 34.296 41.213 668 H ILE 91 HN ILE 91 12.753 33.754 40.244 669 HA ILE 91 HA ILE 91 13.541 34.861 37.662 670 HB ILE 91 HB ILE 91 15.128 34.355 39.551 671 1HG1 ILE 91 HG12 ILE 91 15.799 32.774 37.054 672 2HG1 ILE 91 HG11 ILE 91 15.807 34.538 37.100 673 1HG2 ILE 91 HG22 ILE 91 14.000 32.160 40.113 674 2HG2 ILE 91 HG21 ILE 91 14.778 31.476 38.686 675 3HG2 ILE 91 HG23 ILE 91 15.759 32.089 40.017 676 1HD1 ILE 91 HD12 ILE 91 17.368 32.847 39.067 677 2HD1 ILE 91 HD11 ILE 91 18.057 33.428 37.551 678 3HD1 ILE 91 HD13 ILE 91 17.523 34.580 38.775 679 H GLY 92 HN GLY 92 11.598 32.256 38.609 680 1HA GLY 92 HA2 GLY 92 12.278 30.199 36.792 681 2HA GLY 92 HA1 GLY 92 10.651 30.491 37.396 682 H GLY 93 HN GLY 93 11.960 29.903 34.620 683 1HA GLY 93 HA2 GLY 93 10.952 30.238 32.485 684 2HA GLY 93 HA1 GLY 93 10.098 31.640 33.124 685 H ASP 94 HN ASP 94 12.943 32.405 34.254 686 HA ASP 94 HA ASP 94 13.546 34.291 32.179 687 1HB ASP 94 HB2 ASP 94 15.128 33.353 34.580 688 2HB ASP 94 HB1 ASP 94 15.680 34.641 33.509 689 H ALA 95 HN ALA 95 14.662 33.999 30.322 690 HA ALA 95 HA ALA 95 16.258 31.499 29.962 691 1HB ALA 95 HB3 ALA 95 14.425 32.185 28.314 692 2HB ALA 95 HB2 ALA 95 15.484 33.515 27.841 693 3HB ALA 95 HB1 ALA 95 16.005 31.846 27.607 694 H HIS 96 HN HIS 96 18.454 31.685 30.113 695 HA HIS 96 HA HIS 96 19.689 34.407 29.818 696 1HB HIS 96 HB2 HIS 96 20.532 31.929 31.341 697 2HB HIS 96 HB1 HIS 96 21.615 33.294 31.065 698 HD2 HIS 96 HD2 HIS 96 18.167 34.872 31.737 699 HE1 HIS 96 HE1 HIS 96 20.164 34.362 35.458 700 HE2 HIS 96 HE2 HIS 96 18.215 35.478 34.283 701 H PHE 97 HN PHE 97 21.195 34.744 28.254 702 HA PHE 97 HA PHE 97 22.033 32.399 26.564 703 1HB PHE 97 HB2 PHE 97 21.463 35.291 25.903 704 2HB PHE 97 HB1 PHE 97 22.390 34.259 24.816 705 HD1 PHE 97 HD1 PHE 97 19.145 34.460 26.661 706 HD2 PHE 97 HD2 PHE 97 21.281 32.802 23.321 707 HE1 PHE 97 HE1 PHE 97 17.031 33.514 25.777 708 HE2 PHE 97 HE2 PHE 97 19.164 31.855 22.441 709 HZ PHE 97 HZ PHE 97 17.040 32.211 23.670 710 H ASP 98 HN ASP 98 24.186 31.968 26.552 711 HA ASP 98 HA ASP 98 26.063 33.538 28.092 712 1HB ASP 98 HB2 ASP 98 26.227 31.057 27.617 713 2HB ASP 98 HB1 ASP 98 26.697 31.470 25.968 714 H GLU 99 HN GLU 99 26.482 35.562 27.388 715 HA GLU 99 HA GLU 99 26.574 36.286 24.580 716 1HB GLU 99 HB2 GLU 99 25.837 37.790 26.428 717 2HB GLU 99 HB1 GLU 99 27.474 37.796 27.037 718 1HG GLU 99 HG2 GLU 99 26.975 39.820 25.685 719 2HG GLU 99 HG1 GLU 99 28.269 38.874 24.967 720 H ASP 100 HN ASP 100 28.720 34.545 26.372 721 HA ASP 100 HA ASP 100 31.216 35.834 25.658 722 1HB ASP 100 HB2 ASP 100 30.547 33.028 26.574 723 2HB ASP 100 HB1 ASP 100 32.196 33.587 26.293 724 H GLU 101 HN GLU 101 29.266 33.246 24.190 725 HA GLU 101 HA GLU 101 31.264 32.785 22.085 726 1HB GLU 101 HB2 GLU 101 28.417 31.784 22.428 727 2HB GLU 101 HB1 GLU 101 29.518 31.260 21.154 728 1HG GLU 101 HG2 GLU 101 29.753 29.611 22.840 729 2HG GLU 101 HG1 GLU 101 31.157 30.655 23.055 730 H ARG 102 HN ARG 102 30.724 33.121 19.777 731 HA ARG 102 HA ARG 102 29.310 35.700 19.387 732 1HB ARG 102 HB2 ARG 102 31.552 35.360 18.374 733 2HB ARG 102 HB1 ARG 102 30.918 34.005 17.443 734 1HG ARG 102 HG2 ARG 102 29.310 35.519 16.330 735 2HG ARG 102 HG1 ARG 102 29.943 36.874 17.263 736 1HD ARG 102 HD2 ARG 102 30.968 36.848 15.040 737 2HD ARG 102 HD1 ARG 102 32.186 36.480 16.265 738 HE ARG 102 HE ARG 102 31.269 33.986 15.507 739 1HH1 ARG 102 HH21 ARG 102 32.500 36.787 13.926 740 2HH1 ARG 102 HH22 ARG 102 33.180 35.904 12.599 741 1HH2 ARG 102 HH11 ARG 102 32.136 32.815 13.784 742 2HH2 ARG 102 HH12 ARG 102 32.976 33.651 12.520 743 H TRP 103 HN TRP 103 27.216 35.713 18.706 744 HA TRP 103 HA TRP 103 25.985 33.195 17.772 745 1HB TRP 103 HB2 TRP 103 24.841 35.935 18.366 746 2HB TRP 103 HB1 TRP 103 23.879 34.558 17.836 747 HD1 TRP 103 HD1 TRP 103 24.983 36.196 20.878 748 HE1 TRP 103 HE1 TRP 103 24.779 34.637 22.922 749 HE3 TRP 103 HE3 TRP 103 24.321 31.722 18.513 750 HZ2 TRP 103 HZ2 TRP 103 24.389 31.858 23.482 751 HZ3 TRP 103 HZ3 TRP 103 24.039 29.638 19.818 752 HH2 TRP 103 HH2 TRP 103 24.072 29.698 22.300 753 H THR 104 HN THR 104 25.013 32.944 15.726 754 HA THR 104 HA THR 104 25.539 35.093 13.701 755 HB THR 104 HB THR 104 26.115 33.257 12.098 756 HG1 THR 104 HG1 THR 104 26.780 31.281 13.142 757 1HG2 THR 104 HG22 THR 104 27.846 33.640 14.538 758 2HG2 THR 104 HG21 THR 104 28.403 32.854 13.061 759 3HG2 THR 104 HG23 THR 104 27.913 34.548 13.028 760 H ASN 105 HN ASN 105 24.188 34.848 11.758 761 HA ASN 105 HA ASN 105 21.539 33.582 12.380 762 1HB ASN 105 HB2 ASN 105 22.270 35.978 10.668 763 2HB ASN 105 HB1 ASN 105 20.658 35.265 10.726 764 1HD2 ASN 105 HD22 ASN 105 21.078 38.054 13.300 765 2HD2 ASN 105 HD21 ASN 105 21.484 37.987 11.652 766 H ASN 106 HN ASN 106 23.879 32.239 11.164 767 HA ASN 106 HA ASN 106 22.547 31.349 8.655 768 1HB ASN 106 HB2 ASN 106 24.933 31.387 7.605 769 2HB ASN 106 HB1 ASN 106 24.046 32.906 7.716 770 1HD2 ASN 106 HD22 ASN 106 26.862 34.238 9.381 771 2HD2 ASN 106 HD21 ASN 106 25.823 34.342 8.043 772 H PHE 107 HN PHE 107 24.653 29.648 7.816 773 HA PHE 107 HA PHE 107 24.321 27.473 9.752 774 1HB PHE 107 HB2 PHE 107 25.939 27.435 7.198 775 2HB PHE 107 HB1 PHE 107 25.188 26.070 8.030 776 HD1 PHE 107 HD2 PHE 107 22.593 26.202 8.365 777 HD2 PHE 107 HD1 PHE 107 24.771 28.497 5.457 778 HE1 PHE 107 HE2 PHE 107 20.502 26.570 7.084 779 HE2 PHE 107 HE1 PHE 107 22.677 28.861 4.178 780 HZ PHE 107 HZ PHE 107 20.544 27.896 4.991 781 H ARG 108 HN ARG 108 26.275 29.957 9.975 782 HA ARG 108 HA ARG 108 28.923 28.936 10.006 783 1HB ARG 108 HB2 ARG 108 27.592 31.179 11.532 784 2HB ARG 108 HB1 ARG 108 29.305 30.817 11.712 785 1HG ARG 108 HG2 ARG 108 29.659 31.096 9.309 786 2HG ARG 108 HG1 ARG 108 27.943 31.404 9.067 787 1HD ARG 108 HD2 ARG 108 28.091 33.421 10.469 788 2HD ARG 108 HD1 ARG 108 29.799 33.096 10.770 789 HE ARG 108 HE ARG 108 29.626 33.186 8.009 790 1HH1 ARG 108 HH21 ARG 108 28.646 35.226 10.617 791 2HH1 ARG 108 HH22 ARG 108 28.905 36.693 9.734 792 1HH2 ARG 108 HH11 ARG 108 29.956 35.079 6.852 793 2HH2 ARG 108 HH12 ARG 108 29.641 36.610 7.598 794 H GLU 109 HN GLU 109 29.827 29.414 12.626 795 HA GLU 109 HA GLU 109 29.883 26.935 13.777 796 1HB GLU 109 HB2 GLU 109 29.915 29.627 15.145 797 2HB GLU 109 HB1 GLU 109 30.312 28.119 15.967 798 1HG GLU 109 HG2 GLU 109 31.691 29.048 13.435 799 2HG GLU 109 HG1 GLU 109 32.312 29.366 15.055 800 H TYR 110 HN TYR 110 27.578 29.453 15.024 801 HA TYR 110 HA TYR 110 25.745 27.170 15.738 802 1HB TYR 110 HB2 TYR 110 26.311 29.583 17.479 803 2HB TYR 110 HB1 TYR 110 25.261 28.224 17.869 804 HD1 TYR 110 HD2 TYR 110 26.274 25.904 18.079 805 HD2 TYR 110 HD1 TYR 110 28.654 29.474 17.861 806 HE1 TYR 110 HE2 TYR 110 28.214 24.672 19.018 807 HE2 TYR 110 HE1 TYR 110 30.590 28.243 18.797 808 HH TYR 110 HH TYR 110 30.533 25.707 20.445 809 H ASN 111 HN ASN 111 23.534 27.627 15.641 810 HA ASN 111 HA ASN 111 22.799 30.125 14.182 811 1HB ASN 111 HB2 ASN 111 22.117 27.860 13.270 812 2HB ASN 111 HB1 ASN 111 21.082 27.679 14.688 813 1HD2 ASN 111 HD22 ASN 111 18.559 29.269 12.780 814 2HD2 ASN 111 HD21 ASN 111 19.057 27.842 13.552 815 H LEU 112 HN LEU 112 21.957 31.737 15.415 816 HA LEU 112 HA LEU 112 21.401 31.496 18.184 817 1HB LEU 112 HB2 LEU 112 21.890 33.646 17.071 818 2HB LEU 112 HB1 LEU 112 20.362 33.550 16.203 819 HG LEU 112 HG LEU 112 19.130 33.618 18.345 820 1HD1 LEU 112 HD12 LEU 112 21.933 33.551 19.455 821 2HD1 LEU 112 HD11 LEU 112 20.655 34.358 20.363 822 3HD1 LEU 112 HD13 LEU 112 20.510 32.647 19.975 823 1HD2 LEU 112 HD21 LEU 112 19.811 35.719 17.118 824 2HD2 LEU 112 HD23 LEU 112 19.558 35.949 18.849 825 3HD2 LEU 112 HD22 LEU 112 21.196 35.833 18.205 826 H HIS 113 HN HIS 113 19.210 31.390 15.387 827 HA HIS 113 HA HIS 113 16.753 31.359 16.791 828 1HB HIS 113 HB2 HIS 113 16.905 31.669 14.369 829 2HB HIS 113 HB1 HIS 113 17.455 30.006 14.178 830 HD1 HIS 113 HD1 HIS 113 15.357 29.338 12.808 831 HD2 HIS 113 HD2 HIS 113 14.487 30.709 16.646 832 HE1 HIS 113 HE1 HIS 113 12.939 28.733 13.251 833 H ARG 114 HN ARG 114 18.716 28.534 15.732 834 HA ARG 114 HA ARG 114 16.901 26.575 16.692 835 1HB ARG 114 HB2 ARG 114 18.776 25.980 15.239 836 2HB ARG 114 HB1 ARG 114 19.919 26.396 16.517 837 1HG ARG 114 HG2 ARG 114 19.112 24.632 17.935 838 2HG ARG 114 HG1 ARG 114 17.736 24.331 16.876 839 1HD ARG 114 HD2 ARG 114 19.159 23.458 15.146 840 2HD ARG 114 HD1 ARG 114 20.616 23.976 16.007 841 HE ARG 114 HE ARG 114 19.416 22.302 17.821 842 1HH1 ARG 114 HH21 ARG 114 20.144 22.086 14.467 843 2HH1 ARG 114 HH22 ARG 114 20.491 20.389 14.515 844 1HH2 ARG 114 HH11 ARG 114 19.861 20.091 17.906 845 2HH2 ARG 114 HH12 ARG 114 20.327 19.259 16.461 846 H VAL 115 HN VAL 115 19.529 28.258 18.399 847 HA VAL 115 HA VAL 115 19.235 26.687 20.802 848 HB VAL 115 HB VAL 115 20.465 29.407 20.284 849 1HG1 VAL 115 HG11 VAL 115 20.227 27.796 22.834 850 2HG1 VAL 115 HG13 VAL 115 21.524 28.966 22.594 851 3HG1 VAL 115 HG12 VAL 115 19.842 29.499 22.582 852 1HG2 VAL 115 HG22 VAL 115 21.571 26.624 20.800 853 2HG2 VAL 115 HG21 VAL 115 21.668 27.534 19.291 854 3HG2 VAL 115 HG23 VAL 115 22.561 28.078 20.709 855 H ALA 116 HN ALA 116 17.839 29.756 19.685 856 HA ALA 116 HA ALA 116 16.510 30.501 22.071 857 1HB ALA 116 HB1 ALA 116 16.608 31.853 19.942 858 2HB ALA 116 HB3 ALA 116 15.403 30.761 19.255 859 3HB ALA 116 HB2 ALA 116 14.995 31.762 20.648 860 H ALA 117 HN ALA 117 15.344 28.435 19.398 861 HA ALA 117 HA ALA 117 12.848 27.723 20.560 862 1HB ALA 117 HB3 ALA 117 14.642 26.196 18.654 863 2HB ALA 117 HB2 ALA 117 12.985 25.729 19.041 864 3HB ALA 117 HB1 ALA 117 13.303 27.258 18.223 865 H HIS 118 HN HIS 118 16.055 26.191 20.825 866 HA HIS 118 HA HIS 118 15.242 23.900 22.290 867 1HB HIS 118 HB2 HIS 118 17.495 24.161 21.317 868 2HB HIS 118 HB1 HIS 118 17.851 25.433 22.486 869 HD1 HIS 118 HD1 HIS 118 17.226 21.731 22.242 870 HD2 HIS 118 HD2 HIS 118 18.473 24.502 25.089 871 HE1 HIS 118 HE1 HIS 118 18.086 20.393 24.207 872 H GLU 119 HN GLU 119 16.341 27.083 23.467 873 HA GLU 119 HA GLU 119 16.142 26.489 26.246 874 1HB GLU 119 HB2 GLU 119 15.800 29.086 24.719 875 2HB GLU 119 HB1 GLU 119 15.856 28.993 26.480 876 1HG GLU 119 HG2 GLU 119 18.084 27.959 26.372 877 2HG GLU 119 HG1 GLU 119 18.031 28.011 24.610 878 H LEU 120 HN LEU 120 13.761 27.684 23.904 879 HA LEU 120 HA LEU 120 11.636 28.052 25.809 880 1HB LEU 120 HB2 LEU 120 11.591 27.557 22.818 881 2HB LEU 120 HB1 LEU 120 10.155 27.941 23.760 882 HG LEU 120 HG LEU 120 12.625 29.703 23.662 883 1HD1 LEU 120 HD12 LEU 120 10.056 29.791 22.059 884 2HD1 LEU 120 HD11 LEU 120 11.179 31.145 22.174 885 3HD1 LEU 120 HD13 LEU 120 11.698 29.628 21.437 886 1HD2 LEU 120 HD23 LEU 120 9.858 29.960 24.855 887 2HD2 LEU 120 HD22 LEU 120 11.416 30.314 25.598 888 3HD2 LEU 120 HD21 LEU 120 10.758 31.400 24.383 889 H GLY 121 HN GLY 121 12.838 25.293 23.991 890 1HA GLY 121 HA2 GLY 121 10.612 23.558 24.323 891 2HA GLY 121 HA1 GLY 121 12.284 23.016 24.161 892 H HIS 122 HN HIS 122 13.402 24.204 26.443 893 HA HIS 122 HA HIS 122 12.622 22.321 28.478 894 1HB HIS 122 HB2 HIS 122 14.378 24.786 28.531 895 2HB HIS 122 HB1 HIS 122 14.131 23.762 29.948 896 HD1 HIS 122 HD1 HIS 122 14.787 21.164 29.610 897 HD2 HIS 122 HD2 HIS 122 16.277 23.793 26.737 898 HE1 HIS 122 HE1 HIS 122 16.632 19.928 28.402 899 H SER 123 HN SER 123 11.926 25.758 27.950 900 HA SER 123 HA SER 123 10.611 26.267 30.421 901 1HB SER 123 HB2 SER 123 10.164 27.449 27.670 902 2HB SER 123 HB1 SER 123 9.410 28.072 29.135 903 HG SER 123 HG SER 123 12.187 27.654 29.065 904 H LEU 124 HN LEU 124 9.406 24.870 27.387 905 HA LEU 124 HA LEU 124 6.657 24.748 28.370 906 1HB LEU 124 HB2 LEU 124 7.961 23.426 25.977 907 2HB LEU 124 HB1 LEU 124 6.228 23.454 26.301 908 HG LEU 124 HG LEU 124 7.961 25.917 25.935 909 1HD1 LEU 124 HD12 LEU 124 7.510 24.384 23.890 910 2HD1 LEU 124 HD11 LEU 124 5.837 24.928 24.029 911 3HD1 LEU 124 HD13 LEU 124 7.124 26.097 23.736 912 1HD2 LEU 124 HD21 LEU 124 5.062 25.469 26.615 913 2HD2 LEU 124 HD23 LEU 124 6.175 26.701 27.208 914 3HD2 LEU 124 HD22 LEU 124 5.477 26.849 25.599 915 H GLY 125 HN GLY 125 9.375 23.018 29.167 916 1HA GLY 125 HA2 GLY 125 9.390 21.170 30.687 917 2HA GLY 125 HA1 GLY 125 7.716 20.830 30.264 918 H LEU 126 HN LEU 126 9.644 21.315 27.489 919 HA LEU 126 HA LEU 126 9.382 18.489 26.794 920 1HB LEU 126 HB2 LEU 126 10.817 20.741 25.347 921 2HB LEU 126 HB1 LEU 126 10.460 19.150 24.671 922 HG LEU 126 HG LEU 126 8.381 21.129 25.668 923 1HD1 LEU 126 HD13 LEU 126 9.711 21.587 23.446 924 2HD1 LEU 126 HD12 LEU 126 8.725 20.277 22.796 925 3HD1 LEU 126 HD11 LEU 126 7.954 21.723 23.445 926 1HD2 LEU 126 HD23 LEU 126 8.261 18.305 24.631 927 2HD2 LEU 126 HD22 LEU 126 7.320 19.067 25.915 928 3HD2 LEU 126 HD21 LEU 126 6.940 19.404 24.229 929 H SER 127 HN SER 127 11.042 16.982 26.598 930 HA SER 127 HA SER 127 13.578 17.677 28.037 931 1HB SER 127 HB2 SER 127 12.104 15.062 27.650 932 2HB SER 127 HB1 SER 127 13.708 15.178 28.368 933 HG SER 127 HG SER 127 12.610 15.520 30.135 934 H HIS 128 HN HIS 128 15.558 16.736 27.212 935 HA HIS 128 HA HIS 128 16.023 17.075 24.465 936 1HB HIS 128 HB2 HIS 128 17.491 15.265 26.411 937 2HB HIS 128 HB1 HIS 128 18.110 15.759 24.834 938 HD1 HIS 128 HD1 HIS 128 19.571 16.568 27.480 939 HD2 HIS 128 HD2 HIS 128 16.801 18.974 25.509 940 HE1 HIS 128 HE1 HIS 128 20.052 18.951 28.191 941 H SER 129 HN SER 129 16.933 15.099 23.066 942 HA SER 129 HA SER 129 15.259 12.675 23.382 943 1HB SER 129 HB2 SER 129 13.858 14.273 22.088 944 2HB SER 129 HB1 SER 129 15.146 14.410 20.895 945 HG SER 129 HG SER 129 14.149 12.757 20.040 946 H THR 130 HN THR 130 15.866 11.025 21.702 947 HA THR 130 HA THR 130 18.795 11.175 21.175 948 HB THR 130 HB THR 130 18.640 8.739 20.891 949 HG1 THR 130 HG1 THR 130 16.559 8.665 19.996 950 1HG2 THR 130 HG23 THR 130 18.813 9.787 23.180 951 2HG2 THR 130 HG22 THR 130 17.068 9.591 23.331 952 3HG2 THR 130 HG21 THR 130 18.103 8.172 23.174 953 H ASP 131 HN ASP 131 16.127 12.061 19.578 954 HA ASP 131 HA ASP 131 16.660 10.759 16.993 955 1HB ASP 131 HB2 ASP 131 14.355 11.436 17.720 956 2HB ASP 131 HB1 ASP 131 14.871 13.119 17.622 957 H ILE 132 HN ILE 132 18.337 11.435 15.785 958 HA ILE 132 HA ILE 132 19.866 13.776 16.277 959 HB ILE 132 HB ILE 132 19.590 12.152 13.727 960 1HG1 ILE 132 HG12 ILE 132 21.758 12.086 15.847 961 2HG1 ILE 132 HG11 ILE 132 20.391 10.971 15.829 962 1HG2 ILE 132 HG21 ILE 132 21.547 14.294 14.582 963 2HG2 ILE 132 HG23 ILE 132 21.906 13.145 13.295 964 3HG2 ILE 132 HG22 ILE 132 20.551 14.260 13.127 965 1HD1 ILE 132 HD11 ILE 132 21.033 10.218 13.566 966 2HD1 ILE 132 HD13 ILE 132 22.402 11.329 13.586 967 3HD1 ILE 132 HD12 ILE 132 22.353 9.971 14.711 968 H GLY 133 HN GLY 133 17.203 13.204 13.992 969 1HA GLY 133 HA2 GLY 133 17.432 15.775 12.707 970 2HA GLY 133 HA1 GLY 133 16.046 14.694 12.601 971 H ALA 134 HN ALA 134 16.686 15.264 15.858 972 HA ALA 134 HA ALA 134 14.417 17.186 15.975 973 1HB ALA 134 HB1 ALA 134 15.844 15.541 18.077 974 2HB ALA 134 HB3 ALA 134 14.614 16.742 18.470 975 3HB ALA 134 HB2 ALA 134 14.193 15.340 17.486 976 H LEU 135 HN LEU 135 14.644 19.277 16.809 977 HA LEU 135 HA LEU 135 17.261 20.486 16.668 978 1HB LEU 135 HB2 LEU 135 14.748 21.590 17.974 979 2HB LEU 135 HB1 LEU 135 16.153 22.518 17.446 980 HG LEU 135 HG LEU 135 14.307 20.929 15.639 981 1HD1 LEU 135 HD12 LEU 135 13.349 23.033 16.574 982 2HD1 LEU 135 HD11 LEU 135 14.715 23.925 15.905 983 3HD1 LEU 135 HD13 LEU 135 13.577 23.115 14.829 984 1HD2 LEU 135 HD23 LEU 135 16.886 22.428 15.171 985 2HD2 LEU 135 HD22 LEU 135 16.384 20.860 14.540 986 3HD2 LEU 135 HD21 LEU 135 15.680 22.336 13.887 987 H MET 136 HN MET 136 15.334 19.089 19.193 988 HA MET 136 HA MET 136 16.817 20.249 21.397 989 1HB MET 136 HB2 MET 136 14.995 17.831 21.304 990 2HB MET 136 HB1 MET 136 15.537 18.655 22.767 991 1HG MET 136 HG2 MET 136 13.990 20.004 20.538 992 2HG MET 136 HG1 MET 136 13.247 19.367 22.003 993 1HE MET 136 HE1 MET 136 13.358 20.154 24.167 994 2HE MET 136 HE3 MET 136 15.095 20.173 24.489 995 3HE MET 136 HE2 MET 136 14.127 21.609 24.790 996 H TYR 137 HN TYR 137 17.926 18.242 19.119 997 HA TYR 137 HA TYR 137 19.010 16.055 20.578 998 1HB TYR 137 HB2 TYR 137 18.824 16.406 18.030 999 2HB TYR 137 HB1 TYR 137 20.343 17.286 18.169 1000 HD1 TYR 137 HD2 TYR 137 18.759 14.057 19.231 1001 HD2 TYR 137 HD1 TYR 137 22.344 16.080 18.011 1002 HE1 TYR 137 HE2 TYR 137 19.984 11.902 19.241 1003 HE2 TYR 137 HE1 TYR 137 23.565 13.918 18.023 1004 HH TYR 137 HH TYR 137 23.289 11.653 18.063 1005 HA PRO 138 HA PRO 138 22.068 18.243 23.026 1006 1HB PRO 138 HB2 PRO 138 23.938 16.012 22.988 1007 2HB PRO 138 HB1 PRO 138 22.907 16.557 24.319 1008 1HG PRO 138 HG2 PRO 138 22.550 14.220 22.642 1009 2HG PRO 138 HG1 PRO 138 21.542 14.747 24.000 1010 1HD PRO 138 HD2 PRO 138 20.862 14.826 21.212 1011 2HD PRO 138 HD1 PRO 138 19.916 15.473 22.570 1012 H SER 139 HN SER 139 23.367 16.323 20.257 1013 HA SER 139 HA SER 139 25.677 18.103 20.031 1014 1HB SER 139 HB2 SER 139 25.841 15.733 19.369 1015 2HB SER 139 HB1 SER 139 24.644 15.997 18.109 1016 HG SER 139 HG SER 139 26.464 16.336 17.036 1017 H TYR 140 HN TYR 140 25.881 19.875 18.743 1018 HA TYR 140 HA TYR 140 23.496 21.032 17.564 1019 1HB TYR 140 HB2 TYR 140 25.226 22.429 18.618 1020 2HB TYR 140 HB1 TYR 140 26.396 21.909 17.404 1021 HD1 TYR 140 HD2 TYR 140 23.380 23.932 18.034 1022 HD2 TYR 140 HD1 TYR 140 26.246 22.666 15.097 1023 HE1 TYR 140 HE2 TYR 140 22.577 25.697 16.489 1024 HE2 TYR 140 HE1 TYR 140 25.442 24.429 13.550 1025 HH TYR 140 HH TYR 140 22.828 25.768 13.503 1026 H THR 141 HN THR 141 22.818 20.926 15.480 1027 HA THR 141 HA THR 141 24.692 20.365 13.279 1028 HB THR 141 HB THR 141 23.356 18.419 12.467 1029 HG1 THR 141 HG1 THR 141 21.459 18.918 13.638 1030 1HG2 THR 141 HG21 THR 141 25.440 18.205 13.931 1031 2HG2 THR 141 HG23 THR 141 24.341 17.902 15.278 1032 3HG2 THR 141 HG22 THR 141 24.368 16.805 13.899 1033 H PHE 142 HN PHE 142 23.162 20.181 11.142 1034 HA PHE 142 HA PHE 142 20.624 21.581 11.352 1035 1HB PHE 142 HB2 PHE 142 21.202 23.678 10.364 1036 2HB PHE 142 HB1 PHE 142 22.362 23.428 11.667 1037 HD1 PHE 142 HD1 PHE 142 24.700 22.798 11.165 1038 HD2 PHE 142 HD2 PHE 142 21.861 23.591 8.049 1039 HE1 PHE 142 HE1 PHE 142 26.552 22.989 9.523 1040 HE2 PHE 142 HE2 PHE 142 23.705 23.785 6.407 1041 HZ PHE 142 HZ PHE 142 26.049 23.488 7.144 1042 H SER 143 HN SER 143 19.416 20.865 9.672 1043 HA SER 143 HA SER 143 20.769 19.494 7.423 1044 1HB SER 143 HB2 SER 143 18.585 18.638 6.877 1045 2HB SER 143 HB1 SER 143 18.760 18.528 8.626 1046 HG SER 143 HG SER 143 17.569 20.443 8.805 1047 H GLY 144 HN GLY 144 20.226 22.603 8.014 1048 1HA GLY 144 HA2 GLY 144 20.459 24.353 6.371 1049 2HA GLY 144 HA1 GLY 144 19.846 23.252 5.138 1050 H ASP 145 HN ASP 145 17.751 22.531 7.348 1051 HA ASP 145 HA ASP 145 15.955 24.907 6.962 1052 1HB ASP 145 HB2 ASP 145 15.246 21.965 6.679 1053 2HB ASP 145 HB1 ASP 145 14.076 23.286 6.680 1054 H VAL 146 HN VAL 146 15.146 25.607 8.888 1055 HA VAL 146 HA VAL 146 15.520 23.875 11.285 1056 HB VAL 146 HB VAL 146 14.825 26.813 10.998 1057 1HG1 VAL 146 HG12 VAL 146 15.262 25.033 13.401 1058 2HG1 VAL 146 HG11 VAL 146 15.460 26.783 13.485 1059 3HG1 VAL 146 HG13 VAL 146 13.893 26.092 13.064 1060 1HG2 VAL 146 HG22 VAL 146 17.159 26.030 10.335 1061 2HG2 VAL 146 HG21 VAL 146 17.101 27.237 11.619 1062 3HG2 VAL 146 HG23 VAL 146 17.379 25.542 12.015 1063 H GLN 147 HN GLN 147 13.739 22.523 11.459 1064 HA GLN 147 HA GLN 147 11.084 23.854 11.764 1065 1HB GLN 147 HB2 GLN 147 11.661 21.464 9.986 1066 2HB GLN 147 HB1 GLN 147 10.042 21.979 10.461 1067 1HG GLN 147 HG2 GLN 147 10.415 24.173 9.418 1068 2HG GLN 147 HG1 GLN 147 12.051 23.690 8.963 1069 1HE2 GLN 147 HE22 GLN 147 9.894 20.975 7.072 1070 2HE2 GLN 147 HE21 GLN 147 10.387 20.880 8.693 1071 H LEU 148 HN LEU 148 9.557 22.460 12.972 1072 HA LEU 148 HA LEU 148 10.899 21.038 15.122 1073 1HB LEU 148 HB2 LEU 148 7.934 21.173 14.441 1074 2HB LEU 148 HB1 LEU 148 8.618 20.630 15.971 1075 HG LEU 148 HG LEU 148 8.932 23.406 14.794 1076 1HD1 LEU 148 HD11 LEU 148 7.253 22.346 17.084 1077 2HD1 LEU 148 HD13 LEU 148 7.518 24.061 16.763 1078 3HD1 LEU 148 HD12 LEU 148 6.665 23.063 15.584 1079 1HD2 LEU 148 HD22 LEU 148 10.061 22.037 17.232 1080 2HD2 LEU 148 HD21 LEU 148 10.855 23.131 16.099 1081 3HD2 LEU 148 HD23 LEU 148 9.726 23.768 17.291 1082 H ALA 149 HN ALA 149 10.585 18.755 15.617 1083 HA ALA 149 HA ALA 149 10.347 17.096 13.145 1084 1HB ALA 149 HB2 ALA 149 12.413 16.975 14.629 1085 2HB ALA 149 HB1 ALA 149 11.381 16.239 15.857 1086 3HB ALA 149 HB3 ALA 149 11.620 15.432 14.304 1087 H GLN 150 HN GLN 150 9.142 15.073 13.299 1088 HA GLN 150 HA GLN 150 6.531 15.373 14.326 1089 1HB GLN 150 HB2 GLN 150 7.136 13.754 12.557 1090 2HB GLN 150 HB1 GLN 150 8.025 12.794 13.738 1091 1HG GLN 150 HG2 GLN 150 5.980 12.369 15.000 1092 2HG GLN 150 HG1 GLN 150 5.062 13.424 13.924 1093 1HE2 GLN 150 HE22 GLN 150 6.542 10.114 12.011 1094 2HE2 GLN 150 HE21 GLN 150 7.585 11.094 12.923 1095 H ASP 151 HN ASP 151 9.377 13.799 15.795 1096 HA ASP 151 HA ASP 151 8.030 12.636 18.016 1097 1HB ASP 151 HB2 ASP 151 10.400 12.164 17.465 1098 2HB ASP 151 HB1 ASP 151 10.829 13.811 17.926 1099 H ASP 152 HN ASP 152 9.323 15.909 17.509 1100 HA ASP 152 HA ASP 152 8.711 16.833 20.186 1101 1HB ASP 152 HB2 ASP 152 9.186 18.307 17.575 1102 2HB ASP 152 HB1 ASP 152 8.946 19.119 19.121 1103 H ILE 153 HN ILE 153 7.038 16.922 17.056 1104 HA ILE 153 HA ILE 153 4.840 18.551 17.822 1105 HB ILE 153 HB ILE 153 4.937 16.239 15.861 1106 1HG1 ILE 153 HG12 ILE 153 6.566 18.269 15.634 1107 2HG1 ILE 153 HG11 ILE 153 5.664 17.744 14.220 1108 1HG2 ILE 153 HG22 ILE 153 2.885 18.385 16.388 1109 2HG2 ILE 153 HG21 ILE 153 3.067 17.708 14.769 1110 3HG2 ILE 153 HG23 ILE 153 2.648 16.658 16.121 1111 1HD1 ILE 153 HD11 ILE 153 4.510 19.874 16.001 1112 2HD1 ILE 153 HD13 ILE 153 5.762 20.292 14.835 1113 3HD1 ILE 153 HD12 ILE 153 4.242 19.590 14.286 1114 H ASP 154 HN ASP 154 5.098 14.972 17.845 1115 HA ASP 154 HA ASP 154 2.524 14.515 18.993 1116 1HB ASP 154 HB2 ASP 154 5.093 12.915 19.116 1117 2HB ASP 154 HB1 ASP 154 3.568 12.336 19.786 1118 H GLY 155 HN GLY 155 5.691 15.105 20.456 1119 1HA GLY 155 HA2 GLY 155 4.930 14.623 23.161 1120 2HA GLY 155 HA1 GLY 155 6.305 15.597 22.654 1121 H ILE 156 HN ILE 156 5.220 17.775 21.441 1122 HA ILE 156 HA ILE 156 4.179 19.244 23.682 1123 HB ILE 156 HB ILE 156 5.560 20.220 21.805 1124 1HG1 ILE 156 HG12 ILE 156 4.225 22.354 21.716 1125 2HG1 ILE 156 HG11 ILE 156 2.889 21.497 22.478 1126 1HG2 ILE 156 HG22 ILE 156 4.173 19.077 20.012 1127 2HG2 ILE 156 HG21 ILE 156 2.922 20.281 20.321 1128 3HG2 ILE 156 HG23 ILE 156 4.504 20.786 19.729 1129 1HD1 ILE 156 HD12 ILE 156 5.549 21.332 23.840 1130 2HD1 ILE 156 HD11 ILE 156 4.698 22.872 23.910 1131 3HD1 ILE 156 HD13 ILE 156 3.930 21.415 24.532 1132 H GLN 157 HN GLN 157 2.654 17.917 20.768 1133 HA GLN 157 HA GLN 157 0.080 19.086 21.250 1134 1HB GLN 157 HB2 GLN 157 0.932 16.610 19.729 1135 2HB GLN 157 HB1 GLN 157 -0.729 17.207 19.751 1136 1HG GLN 157 HG2 GLN 157 -0.030 19.334 18.795 1137 2HG GLN 157 HG1 GLN 157 1.665 18.851 18.881 1138 1HE2 GLN 157 HE22 GLN 157 0.273 18.149 15.432 1139 2HE2 GLN 157 HE21 GLN 157 0.291 19.542 16.401 1140 H ALA 158 HN ALA 158 1.544 15.998 22.265 1141 HA ALA 158 HA ALA 158 -0.808 14.894 23.443 1142 1HB ALA 158 HB1 ALA 158 2.138 14.493 23.942 1143 2HB ALA 158 HB3 ALA 158 0.931 13.667 24.928 1144 3HB ALA 158 HB2 ALA 158 0.987 13.390 23.188 1145 H ILE 159 HN ILE 159 1.668 17.081 24.787 1146 HA ILE 159 HA ILE 159 0.705 17.039 27.478 1147 HB ILE 159 HB ILE 159 2.153 19.196 25.907 1148 1HG1 ILE 159 HG12 ILE 159 3.167 17.297 28.047 1149 2HG1 ILE 159 HG11 ILE 159 3.286 16.962 26.319 1150 1HG2 ILE 159 HG22 ILE 159 1.496 19.001 28.859 1151 2HG2 ILE 159 HG21 ILE 159 2.733 20.075 28.210 1152 3HG2 ILE 159 HG23 ILE 159 1.047 20.296 27.752 1153 1HD1 ILE 159 HD13 ILE 159 4.438 19.401 27.706 1154 2HD1 ILE 159 HD12 ILE 159 5.365 17.992 27.186 1155 3HD1 ILE 159 HD11 ILE 159 4.581 19.025 25.989 1156 H TYR 160 HN TYR 160 0.007 19.333 24.810 1157 HA TYR 160 HA TYR 160 -2.326 20.362 26.372 1158 1HB TYR 160 HB2 TYR 160 -0.914 21.373 23.887 1159 2HB TYR 160 HB1 TYR 160 -2.406 22.079 24.506 1160 HD1 TYR 160 HD2 TYR 160 -2.453 23.201 26.714 1161 HD2 TYR 160 HD1 TYR 160 1.200 21.716 25.012 1162 HE1 TYR 160 HE2 TYR 160 -1.146 24.563 28.327 1163 HE2 TYR 160 HE1 TYR 160 2.506 23.072 26.625 1164 HH TYR 160 HH TYR 160 0.898 25.276 28.907 1165 H GLY 161 HN GLY 161 -1.704 19.678 22.918 1166 1HA GLY 161 HA2 GLY 161 -3.397 17.603 22.377 1167 2HA GLY 161 HA1 GLY 161 -4.519 18.956 22.532 1168 H ARG 162 HN ARG 162 -4.841 18.295 20.177 1169 HA ARG 162 HA ARG 162 -2.750 19.186 18.304 1170 1HB ARG 162 HB2 ARG 162 -5.577 18.158 17.907 1171 2HB ARG 162 HB1 ARG 162 -4.465 18.544 16.593 1172 1HG ARG 162 HG2 ARG 162 -2.885 16.862 17.386 1173 2HG ARG 162 HG1 ARG 162 -3.910 16.521 18.777 1174 1HD ARG 162 HD2 ARG 162 -4.765 16.188 15.898 1175 2HD ARG 162 HD1 ARG 162 -4.191 14.866 16.906 1176 HE ARG 162 HE ARG 162 -6.851 16.028 16.860 1177 1HH1 ARG 162 HH21 ARG 162 -4.473 14.809 19.052 1178 2HH1 ARG 162 HH22 ARG 162 -5.619 14.528 20.320 1179 1HH2 ARG 162 HH11 ARG 162 -8.333 15.659 18.497 1180 2HH2 ARG 162 HH12 ARG 162 -7.795 15.002 20.006 1181 H SER 163 HN SER 163 -3.078 20.989 16.845 1182 HA SER 163 HA SER 163 -4.513 23.190 18.103 1183 1HB SER 163 HB2 SER 163 -3.119 23.037 15.410 1184 2HB SER 163 HB1 SER 163 -3.699 24.512 16.178 1185 HG SER 163 HG SER 163 -1.370 23.670 16.466 1186 H GLN 164 HN GLN 164 -6.696 22.456 18.055 1187 HA GLN 164 HA GLN 164 -8.011 21.667 15.600 1188 1HB GLN 164 HB2 GLN 164 -9.083 22.587 18.283 1189 2HB GLN 164 HB1 GLN 164 -10.121 22.063 16.956 1190 1HG GLN 164 HG2 GLN 164 -9.144 19.857 16.965 1191 2HG GLN 164 HG1 GLN 164 -7.885 20.362 18.092 1192 1HE2 GLN 164 HE22 GLN 164 -10.671 18.660 19.992 1193 2HE2 GLN 164 HE21 GLN 164 -9.704 18.188 18.679 1194 H ASN 165 HN ASN 165 -6.575 24.152 15.288 1195 HA ASN 165 HA ASN 165 -8.811 25.825 14.291 1196 1HB ASN 165 HB2 ASN 165 -6.626 27.033 16.004 1197 2HB ASN 165 HB1 ASN 165 -8.069 27.832 15.378 1198 1HD2 ASN 165 HD22 ASN 165 -10.249 26.377 17.821 1199 2HD2 ASN 165 HD21 ASN 165 -10.205 27.020 16.250 1200 HA PRO 166 HA PRO 166 -4.990 25.471 11.647 1201 1HB PRO 166 HB2 PRO 166 -6.571 24.726 9.373 1202 2HB PRO 166 HB1 PRO 166 -5.524 23.674 10.330 1203 1HG PRO 166 HG2 PRO 166 -8.437 23.721 10.266 1204 2HG PRO 166 HG1 PRO 166 -7.378 22.588 11.119 1205 1HD PRO 166 HD2 PRO 166 -8.938 24.751 12.252 1206 2HD PRO 166 HD1 PRO 166 -7.891 23.603 13.110 1207 H VAL 167 HN VAL 167 -5.947 27.867 12.375 1208 HA VAL 167 HA VAL 167 -7.190 29.286 10.125 1209 HB VAL 167 HB VAL 167 -5.968 30.347 12.697 1210 1HG1 VAL 167 HG11 VAL 167 -6.135 32.041 10.877 1211 2HG1 VAL 167 HG13 VAL 167 -7.849 31.659 10.708 1212 3HG1 VAL 167 HG12 VAL 167 -7.248 32.382 12.199 1213 1HG2 VAL 167 HG22 VAL 167 -8.789 29.567 11.920 1214 2HG2 VAL 167 HG21 VAL 167 -7.825 28.931 13.251 1215 3HG2 VAL 167 HG23 VAL 167 -8.427 30.586 13.312 1216 H GLN 168 HN GLN 168 -6.112 30.782 8.792 1217 HA GLN 168 HA GLN 168 -3.285 30.235 8.377 1218 1HB GLN 168 HB2 GLN 168 -4.939 32.380 7.032 1219 2HB GLN 168 HB1 GLN 168 -3.519 31.558 6.394 1220 1HG GLN 168 HG2 GLN 168 -6.209 30.279 6.958 1221 2HG GLN 168 HG1 GLN 168 -5.534 30.627 5.367 1222 1HE2 GLN 168 HE22 GLN 168 -3.060 27.996 5.597 1223 2HE2 GLN 168 HE21 GLN 168 -3.286 29.558 4.971 1224 HA PRO 169 HA PRO 169 -1.632 33.511 10.882 1225 1HB PRO 169 HB2 PRO 169 0.167 34.494 8.789 1226 2HB PRO 169 HB1 PRO 169 0.575 33.615 10.269 1227 1HG PRO 169 HG2 PRO 169 0.577 32.581 7.584 1228 2HG PRO 169 HG1 PRO 169 0.892 31.684 9.077 1229 1HD PRO 169 HD2 PRO 169 -1.438 31.495 7.380 1230 2HD PRO 169 HD1 PRO 169 -1.125 30.630 8.897 No H/Q in entry = 1230 Start of MODEL 10 1 1H VAL 1 HT3 VAL 1 -2.887 15.842 37.292 2 2H VAL 1 HT2 VAL 1 -3.512 15.257 35.825 3 3H VAL 1 HT1 VAL 1 -1.944 14.826 36.316 4 HA VAL 1 HA VAL 1 -1.741 16.478 34.632 5 HB VAL 1 HB VAL 1 -4.083 17.347 35.003 6 1HG1 VAL 1 HG11 VAL 1 -3.728 17.603 37.510 7 2HG1 VAL 1 HG13 VAL 1 -2.798 19.055 37.144 8 3HG1 VAL 1 HG12 VAL 1 -4.505 18.969 36.710 9 1HG2 VAL 1 HG22 VAL 1 -2.367 18.517 33.592 10 2HG2 VAL 1 HG21 VAL 1 -3.552 19.610 34.307 11 3HG2 VAL 1 HG23 VAL 1 -1.935 19.489 34.999 12 H LEU 2 HN LEU 2 -1.371 16.216 37.993 13 HA LEU 2 HA LEU 2 0.293 18.516 38.488 14 1HB LEU 2 HB2 LEU 2 -0.741 17.218 40.320 15 2HB LEU 2 HB1 LEU 2 0.230 15.816 39.881 16 HG LEU 2 HG LEU 2 2.299 17.127 40.358 17 1HD1 LEU 2 HD11 LEU 2 0.253 19.259 40.965 18 2HD1 LEU 2 HD13 LEU 2 1.803 19.259 41.807 19 3HD1 LEU 2 HD12 LEU 2 1.757 19.393 40.052 20 1HD2 LEU 2 HD21 LEU 2 0.201 16.850 42.520 21 2HD2 LEU 2 HD23 LEU 2 1.524 15.747 42.140 22 3HD2 LEU 2 HD22 LEU 2 1.867 17.313 42.876 23 H THR 3 HN THR 3 2.296 18.856 37.685 24 HA THR 3 HA THR 3 3.811 16.562 36.522 25 HB THR 3 HB THR 3 5.050 18.226 35.301 26 HG1 THR 3 HG1 THR 3 5.290 19.755 36.911 27 1HG2 THR 3 HG23 THR 3 2.547 17.738 34.719 28 2HG2 THR 3 HG22 THR 3 2.271 19.376 35.313 29 3HG2 THR 3 HG21 THR 3 3.349 19.105 33.948 30 H GLU 4 HN GLU 4 5.502 15.749 37.675 31 HA GLU 4 HA GLU 4 6.333 17.043 40.152 32 1HB GLU 4 HB2 GLU 4 6.211 14.564 39.892 33 2HB GLU 4 HB1 GLU 4 7.542 14.650 38.739 34 1HG GLU 4 HG2 GLU 4 9.005 15.616 40.451 35 2HG GLU 4 HG1 GLU 4 7.676 15.613 41.612 36 H GLY 5 HN GLY 5 7.506 18.918 39.843 37 1HA GLY 5 HA2 GLY 5 9.519 20.098 39.494 38 2HA GLY 5 HA1 GLY 5 10.208 18.642 38.789 39 H ASN 6 HN ASN 6 7.195 19.744 37.427 40 HA ASN 6 HA ASN 6 8.510 21.402 35.382 41 1HB ASN 6 HB2 ASN 6 7.192 18.801 34.564 42 2HB ASN 6 HB1 ASN 6 7.960 19.976 33.497 43 1HD2 ASN 6 HD22 ASN 6 11.301 19.066 34.562 44 2HD2 ASN 6 HD21 ASN 6 10.386 20.419 34.098 45 HA PRO 7 HA PRO 7 3.959 22.115 36.389 46 1HB PRO 7 HB2 PRO 7 4.579 24.911 36.800 47 2HB PRO 7 HB1 PRO 7 4.023 23.737 38.002 48 1HG PRO 7 HG2 PRO 7 6.681 24.858 37.722 49 2HG PRO 7 HG1 PRO 7 6.107 23.715 38.944 50 1HD PRO 7 HD2 PRO 7 7.865 23.171 36.719 51 2HD PRO 7 HD1 PRO 7 7.256 22.021 37.927 52 H ARG 8 HN ARG 8 2.720 22.524 34.608 53 HA ARG 8 HA ARG 8 3.958 23.855 32.266 54 1HB ARG 8 HB2 ARG 8 1.357 22.349 32.651 55 2HB ARG 8 HB1 ARG 8 1.829 23.111 31.130 56 1HG ARG 8 HG2 ARG 8 3.874 21.749 31.083 57 2HG ARG 8 HG1 ARG 8 3.406 20.977 32.593 58 1HD ARG 8 HD2 ARG 8 1.279 20.246 31.475 59 2HD ARG 8 HD1 ARG 8 1.908 20.862 29.955 60 HE ARG 8 HE ARG 8 2.491 18.317 31.152 61 1HH1 ARG 8 HH21 ARG 8 4.096 20.933 29.558 62 2HH1 ARG 8 HH22 ARG 8 5.494 19.990 29.169 63 1HH2 ARG 8 HH11 ARG 8 4.280 17.092 30.620 64 2HH2 ARG 8 HH12 ARG 8 5.596 17.820 29.761 65 H TRP 9 HN TRP 9 2.984 25.692 31.266 66 HA TRP 9 HA TRP 9 1.839 27.605 33.092 67 1HB TRP 9 HB2 TRP 9 1.963 27.645 30.060 68 2HB TRP 9 HB1 TRP 9 1.614 29.034 31.090 69 HD1 TRP 9 HD1 TRP 9 4.436 26.767 29.953 70 HE1 TRP 9 HE1 TRP 9 6.684 27.775 30.712 71 HE3 TRP 9 HE3 TRP 9 2.741 30.554 32.923 72 HZ2 TRP 9 HZ2 TRP 9 7.637 29.907 32.365 73 HZ3 TRP 9 HZ3 TRP 9 4.336 32.059 34.075 74 HH2 TRP 9 HH2 TRP 9 6.781 31.744 33.798 75 H GLU 10 HN GLU 10 -0.275 27.899 33.614 76 HA GLU 10 HA GLU 10 -2.305 26.190 32.374 77 1HB GLU 10 HB2 GLU 10 -2.417 28.259 34.580 78 2HB GLU 10 HB1 GLU 10 -3.834 27.367 34.021 79 1HG GLU 10 HG2 GLU 10 -2.692 25.235 34.549 80 2HG GLU 10 HG1 GLU 10 -1.286 26.137 35.117 81 H GLN 11 HN GLN 11 -1.032 29.283 31.743 82 HA GLN 11 HA GLN 11 -3.543 30.369 30.634 83 1HB GLN 11 HB2 GLN 11 -0.698 31.413 30.699 84 2HB GLN 11 HB1 GLN 11 -2.019 32.259 29.895 85 1HG GLN 11 HG2 GLN 11 -3.273 32.328 32.014 86 2HG GLN 11 HG1 GLN 11 -1.953 31.485 32.826 87 1HE2 GLN 11 HE22 GLN 11 0.023 34.647 31.688 88 2HE2 GLN 11 HE21 GLN 11 -0.101 33.159 30.882 89 H THR 12 HN THR 12 -3.985 30.559 28.433 90 HA THR 12 HA THR 12 -2.417 28.782 26.649 91 HB THR 12 HB THR 12 -4.289 29.171 25.062 92 HG1 THR 12 HG1 THR 12 -5.383 30.921 25.362 93 1HG2 THR 12 HG23 THR 12 -4.382 27.410 26.875 94 2HG2 THR 12 HG22 THR 12 -5.337 28.544 27.831 95 3HG2 THR 12 HG21 THR 12 -5.956 27.949 26.291 96 H HIS 13 HN HIS 13 -2.404 31.968 27.581 97 HA HIS 13 HA HIS 13 -1.175 32.881 24.997 98 1HB HIS 13 HB2 HIS 13 -2.679 34.508 27.077 99 2HB HIS 13 HB1 HIS 13 -1.873 35.172 25.658 100 HD1 HIS 13 HD1 HIS 13 -2.899 34.548 23.301 101 HD2 HIS 13 HD2 HIS 13 -5.184 33.338 26.571 102 HE1 HIS 13 HE1 HIS 13 -5.192 33.963 22.396 103 H LEU 14 HN LEU 14 0.968 33.295 25.221 104 HA LEU 14 HA LEU 14 2.038 33.865 27.972 105 1HB LEU 14 HB2 LEU 14 3.441 32.515 25.643 106 2HB LEU 14 HB1 LEU 14 4.109 32.775 27.254 107 HG LEU 14 HG LEU 14 1.680 31.079 26.594 108 1HD1 LEU 14 HD13 LEU 14 4.559 30.441 27.253 109 2HD1 LEU 14 HD12 LEU 14 3.271 29.265 27.516 110 3HD1 LEU 14 HD11 LEU 14 3.591 29.873 25.893 111 1HD2 LEU 14 HD23 LEU 14 2.963 31.947 29.183 112 2HD2 LEU 14 HD22 LEU 14 1.252 31.830 28.774 113 3HD2 LEU 14 HD21 LEU 14 2.181 30.369 29.089 114 H THR 15 HN THR 15 3.826 35.343 28.059 115 HA THR 15 HA THR 15 4.137 37.122 25.665 116 HB THR 15 HB THR 15 4.144 39.065 27.176 117 HG1 THR 15 HG1 THR 15 4.794 37.571 28.997 118 1HG2 THR 15 HG23 THR 15 1.757 37.222 27.344 119 2HG2 THR 15 HG22 THR 15 1.726 38.870 27.970 120 3HG2 THR 15 HG21 THR 15 2.000 38.585 26.250 121 H TYR 16 HN TYR 16 6.207 38.215 25.594 122 HA TYR 16 HA TYR 16 8.248 37.311 27.563 123 1HB TYR 16 HB2 TYR 16 9.764 36.521 25.809 124 2HB TYR 16 HB1 TYR 16 8.256 35.613 25.747 125 HD1 TYR 16 HD2 TYR 16 6.589 36.042 23.980 126 HD2 TYR 16 HD1 TYR 16 10.385 38.048 24.030 127 HE1 TYR 16 HE2 TYR 16 6.264 36.717 21.616 128 HE2 TYR 16 HE1 TYR 16 10.059 38.722 21.666 129 HH TYR 16 HH TYR 16 8.486 37.542 19.624 130 H ARG 17 HN ARG 17 10.175 38.630 27.513 131 HA ARG 17 HA ARG 17 10.015 41.101 25.832 132 1HB ARG 17 HB2 ARG 17 8.936 41.549 28.051 133 2HB ARG 17 HB1 ARG 17 10.450 41.100 28.834 134 1HG ARG 17 HG2 ARG 17 11.620 42.903 27.622 135 2HG ARG 17 HG1 ARG 17 10.110 43.363 26.840 136 1HD ARG 17 HD2 ARG 17 9.118 43.724 29.110 137 2HD ARG 17 HD1 ARG 17 10.704 43.438 29.817 138 HE ARG 17 HE ARG 17 9.746 45.895 28.660 139 1HH1 ARG 17 HH21 ARG 17 12.568 43.899 28.739 140 2HH1 ARG 17 HH22 ARG 17 13.612 45.148 28.151 141 1HH2 ARG 17 HH11 ARG 17 11.096 47.515 27.908 142 2HH2 ARG 17 HH12 ARG 17 12.782 47.190 27.682 143 H ILE 18 HN ILE 18 11.996 41.646 25.040 144 HA ILE 18 HA ILE 18 14.358 40.128 25.991 145 HB ILE 18 HB ILE 18 14.006 42.107 23.710 146 1HG1 ILE 18 HG12 ILE 18 14.422 39.101 23.648 147 2HG1 ILE 18 HG11 ILE 18 12.841 39.872 23.517 148 1HG2 ILE 18 HG23 ILE 18 16.368 40.384 24.519 149 2HG2 ILE 18 HG22 ILE 18 16.244 41.241 22.985 150 3HG2 ILE 18 HG21 ILE 18 16.316 42.145 24.495 151 1HD1 ILE 18 HD13 ILE 18 13.671 41.153 21.544 152 2HD1 ILE 18 HD12 ILE 18 15.191 40.265 21.644 153 3HD1 ILE 18 HD11 ILE 18 13.693 39.409 21.279 154 H GLU 19 HN GLU 19 15.551 40.990 27.610 155 HA GLU 19 HA GLU 19 15.095 43.639 28.605 156 1HB GLU 19 HB2 GLU 19 15.965 41.716 29.968 157 2HB GLU 19 HB1 GLU 19 17.507 41.886 29.128 158 1HG GLU 19 HG2 GLU 19 17.688 44.214 29.910 159 2HG GLU 19 HG1 GLU 19 16.147 44.053 30.751 160 H ASN 20 HN ASN 20 17.659 42.290 26.524 161 HA ASN 20 HA ASN 20 18.198 44.978 25.480 162 1HB ASN 20 HB2 ASN 20 20.319 43.483 27.057 163 2HB ASN 20 HB1 ASN 20 20.639 44.886 26.041 164 1HD2 ASN 20 HD22 ASN 20 19.649 45.603 29.774 165 2HD2 ASN 20 HD21 ASN 20 20.415 44.207 29.188 166 H TYR 21 HN TYR 21 19.674 44.886 23.621 167 HA TYR 21 HA TYR 21 19.709 42.178 22.340 168 1HB TYR 21 HB2 TYR 21 19.850 44.971 21.160 169 2HB TYR 21 HB1 TYR 21 19.977 43.484 20.220 170 HD1 TYR 21 HD1 TYR 21 18.052 41.961 20.002 171 HD2 TYR 21 HD2 TYR 21 17.732 45.697 22.100 172 HE1 TYR 21 HE1 TYR 21 15.578 41.801 19.906 173 HE2 TYR 21 HE2 TYR 21 15.258 45.535 22.012 174 HH TYR 21 HH TYR 21 13.554 43.564 21.806 175 H THR 22 HN THR 22 21.676 41.321 21.643 176 HA THR 22 HA THR 22 24.071 42.492 22.778 177 HB THR 22 HB THR 22 23.943 40.103 22.776 178 HG1 THR 22 HG1 THR 22 25.718 39.754 21.027 179 1HG2 THR 22 HG22 THR 22 23.563 40.328 19.777 180 2HG2 THR 22 HG21 THR 22 23.766 38.817 20.658 181 3HG2 THR 22 HG23 THR 22 22.343 39.817 20.943 182 HA PRO 23 HA PRO 23 25.089 44.901 19.136 183 1HB PRO 23 HB2 PRO 23 27.890 45.026 19.566 184 2HB PRO 23 HB1 PRO 23 26.692 46.178 20.176 185 1HG PRO 23 HG2 PRO 23 28.159 44.076 21.654 186 2HG PRO 23 HG1 PRO 23 27.310 45.495 22.286 187 1HD PRO 23 HD2 PRO 23 26.382 42.819 22.418 188 2HD PRO 23 HD1 PRO 23 25.419 44.283 22.723 189 H ASP 24 HN ASP 24 25.944 41.715 19.714 190 HA ASP 24 HA ASP 24 27.863 41.208 17.648 191 1HB ASP 24 HB2 ASP 24 25.781 39.429 18.944 192 2HB ASP 24 HB1 ASP 24 26.970 38.839 17.783 193 H LEU 25 HN LEU 25 24.309 41.244 17.664 194 HA LEU 25 HA LEU 25 24.372 41.323 14.678 195 1HB LEU 25 HB2 LEU 25 22.400 39.739 16.360 196 2HB LEU 25 HB1 LEU 25 22.417 39.822 14.604 197 HG LEU 25 HG LEU 25 24.748 38.778 16.233 198 1HD1 LEU 25 HD13 LEU 25 22.427 37.295 14.978 199 2HD1 LEU 25 HD12 LEU 25 23.911 36.515 15.524 200 3HD1 LEU 25 HD11 LEU 25 22.865 37.331 16.685 201 1HD2 LEU 25 HD23 LEU 25 24.001 38.747 13.295 202 2HD2 LEU 25 HD22 LEU 25 25.473 39.380 14.033 203 3HD2 LEU 25 HD21 LEU 25 25.197 37.641 13.967 204 HA PRO 26 HA PRO 26 21.748 44.860 15.290 205 1HB PRO 26 HB2 PRO 26 19.915 44.217 13.132 206 2HB PRO 26 HB1 PRO 26 21.218 45.415 13.131 207 1HG PRO 26 HG2 PRO 26 21.170 42.818 11.813 208 2HG PRO 26 HG1 PRO 26 22.424 44.065 11.726 209 1HD PRO 26 HD2 PRO 26 22.612 41.558 13.087 210 2HD PRO 26 HD1 PRO 26 23.773 42.900 13.156 211 H ARG 27 HN ARG 27 19.669 45.326 16.228 212 HA ARG 27 HA ARG 27 18.453 43.149 17.652 213 1HB ARG 27 HB2 ARG 27 16.811 44.817 18.400 214 2HB ARG 27 HB1 ARG 27 18.441 45.486 18.482 215 1HG ARG 27 HG2 ARG 27 18.064 46.518 16.223 216 2HG ARG 27 HG1 ARG 27 16.389 45.972 16.300 217 1HD ARG 27 HD2 ARG 27 16.151 47.245 18.461 218 2HD ARG 27 HD1 ARG 27 17.761 47.911 18.183 219 HE ARG 27 HE ARG 27 16.397 48.468 15.837 220 1HH1 ARG 27 HH21 ARG 27 15.886 48.988 19.210 221 2HH1 ARG 27 HH22 ARG 27 14.988 50.450 18.983 222 1HH2 ARG 27 HH11 ARG 27 15.219 50.368 15.523 223 2HH2 ARG 27 HH12 ARG 27 14.612 51.233 16.896 224 H ALA 28 HN ALA 28 17.714 44.729 14.605 225 HA ALA 28 HA ALA 28 15.034 43.843 14.276 226 1HB ALA 28 HB3 ALA 28 16.253 45.488 12.803 227 2HB ALA 28 HB2 ALA 28 17.100 44.123 12.078 228 3HB ALA 28 HB1 ALA 28 15.350 44.258 11.917 229 H ASP 29 HN ASP 29 18.113 42.211 13.574 230 HA ASP 29 HA ASP 29 16.785 39.895 12.399 231 1HB ASP 29 HB2 ASP 29 19.633 40.417 13.286 232 2HB ASP 29 HB1 ASP 29 19.110 38.882 12.592 233 H VAL 30 HN VAL 30 17.847 40.835 15.612 234 HA VAL 30 HA VAL 30 17.823 38.175 16.741 235 HB VAL 30 HB VAL 30 17.533 40.918 17.988 236 1HG1 VAL 30 HG12 VAL 30 17.659 38.170 19.239 237 2HG1 VAL 30 HG11 VAL 30 18.142 39.617 20.122 238 3HG1 VAL 30 HG13 VAL 30 16.486 39.451 19.541 239 1HG2 VAL 30 HG21 VAL 30 19.718 40.174 16.869 240 2HG2 VAL 30 HG23 VAL 30 19.838 40.685 18.553 241 3HG2 VAL 30 HG22 VAL 30 19.838 38.968 18.150 242 H ASP 31 HN ASP 31 15.389 40.777 16.542 243 HA ASP 31 HA ASP 31 13.376 39.507 18.097 244 1HB ASP 31 HB2 ASP 31 13.187 41.419 15.758 245 2HB ASP 31 HB1 ASP 31 11.788 40.917 16.707 246 H HIS 32 HN HIS 32 14.117 39.292 14.632 247 HA HIS 32 HA HIS 32 11.923 37.631 13.891 248 1HB HIS 32 HB2 HIS 32 13.387 38.723 12.242 249 2HB HIS 32 HB1 HIS 32 14.728 37.690 12.736 250 HD1 HIS 32 HD1 HIS 32 11.084 37.026 11.755 251 HD2 HIS 32 HD2 HIS 32 14.917 35.582 10.984 252 HE1 HIS 32 HE1 HIS 32 10.811 35.095 10.139 253 H ALA 33 HN ALA 33 15.189 36.774 15.037 254 HA ALA 33 HA ALA 33 14.929 33.963 14.781 255 1HB ALA 33 HB1 ALA 33 17.014 35.322 15.413 256 2HB ALA 33 HB3 ALA 33 16.385 35.315 17.061 257 3HB ALA 33 HB2 ALA 33 16.787 33.793 16.262 258 H ILE 34 HN ILE 34 14.104 36.087 17.523 259 HA ILE 34 HA ILE 34 13.109 33.939 19.185 260 HB ILE 34 HB ILE 34 12.441 36.900 19.243 261 1HG1 ILE 34 HG12 ILE 34 14.846 36.600 19.450 262 2HG1 ILE 34 HG11 ILE 34 14.189 36.987 21.038 263 1HG2 ILE 34 HG21 ILE 34 12.075 34.655 21.231 264 2HG2 ILE 34 HG23 ILE 34 12.027 36.355 21.696 265 3HG2 ILE 34 HG22 ILE 34 10.842 35.718 20.555 266 1HD1 ILE 34 HD12 ILE 34 14.061 34.365 21.311 267 2HD1 ILE 34 HD11 ILE 34 15.256 34.369 20.016 268 3HD1 ILE 34 HD13 ILE 34 15.600 35.193 21.535 269 H GLU 35 HN GLU 35 11.488 36.389 17.153 270 HA GLU 35 HA GLU 35 8.831 35.521 17.632 271 1HB GLU 35 HB2 GLU 35 9.505 37.657 16.489 272 2HB GLU 35 HB1 GLU 35 9.904 36.707 15.059 273 1HG GLU 35 HG2 GLU 35 7.669 37.556 14.760 274 2HG GLU 35 HG1 GLU 35 7.531 35.830 15.090 275 H LYS 36 HN LYS 36 11.175 34.486 15.151 276 HA LYS 36 HA LYS 36 9.399 32.806 13.699 277 1HB LYS 36 HB2 LYS 36 11.654 33.470 12.904 278 2HB LYS 36 HB1 LYS 36 12.377 32.430 14.132 279 1HG LYS 36 HG2 LYS 36 11.256 30.466 13.138 280 2HG LYS 36 HG1 LYS 36 10.517 31.502 11.917 281 1HD LYS 36 HD2 LYS 36 12.772 32.147 11.120 282 2HD LYS 36 HD1 LYS 36 13.495 31.073 12.318 283 1HE LYS 36 HE2 LYS 36 12.088 29.203 11.267 284 2HE LYS 36 HE1 LYS 36 11.786 30.322 9.937 285 1HZ LYS 36 HZ3 LYS 36 14.532 30.320 10.549 286 2HZ LYS 36 HZ2 LYS 36 14.019 28.715 10.342 287 3HZ LYS 36 HZ1 LYS 36 13.768 29.855 9.109 288 H ALA 37 HN ALA 37 11.432 32.097 16.544 289 HA ALA 37 HA ALA 37 10.876 29.288 16.577 290 1HB ALA 37 HB1 ALA 37 11.549 31.161 18.862 291 2HB ALA 37 HB3 ALA 37 11.576 29.400 18.955 292 3HB ALA 37 HB2 ALA 37 12.701 30.243 17.891 293 H PHE 38 HN PHE 38 9.325 31.966 18.394 294 HA PHE 38 HA PHE 38 7.389 30.340 19.702 295 1HB PHE 38 HB2 PHE 38 7.454 33.255 18.923 296 2HB PHE 38 HB1 PHE 38 6.028 32.560 19.691 297 HD1 PHE 38 HD2 PHE 38 6.583 30.996 21.801 298 HD2 PHE 38 HD1 PHE 38 9.087 34.168 20.337 299 HE1 PHE 38 HE2 PHE 38 7.666 31.170 24.026 300 HE2 PHE 38 HE1 PHE 38 10.167 34.341 22.562 301 HZ PHE 38 HZ PHE 38 9.455 32.843 24.407 302 H GLN 39 HN GLN 39 7.288 31.935 16.519 303 HA GLN 39 HA GLN 39 4.558 31.323 15.954 304 1HB GLN 39 HB2 GLN 39 6.935 31.739 14.122 305 2HB GLN 39 HB1 GLN 39 5.285 31.538 13.531 306 1HG GLN 39 HG2 GLN 39 6.085 33.648 15.551 307 2HG GLN 39 HG1 GLN 39 6.008 33.942 13.816 308 1HE2 GLN 39 HE22 GLN 39 2.357 33.351 13.815 309 2HE2 GLN 39 HE21 GLN 39 3.705 32.775 12.960 310 H LEU 40 HN LEU 40 7.546 29.469 15.380 311 HA LEU 40 HA LEU 40 6.330 27.342 13.922 312 1HB LEU 40 HB2 LEU 40 8.757 27.377 15.733 313 2HB LEU 40 HB1 LEU 40 8.286 25.971 14.783 314 HG LEU 40 HG LEU 40 8.790 28.712 13.583 315 1HD1 LEU 40 HD13 LEU 40 10.840 27.807 14.643 316 2HD1 LEU 40 HD12 LEU 40 10.643 26.311 13.731 317 3HD1 LEU 40 HD11 LEU 40 10.978 27.820 12.885 318 1HD2 LEU 40 HD21 LEU 40 8.171 25.969 12.482 319 2HD2 LEU 40 HD23 LEU 40 7.545 27.539 11.979 320 3HD2 LEU 40 HD22 LEU 40 9.178 27.060 11.535 321 H TRP 41 HN TRP 41 6.734 27.826 17.436 322 HA TRP 41 HA TRP 41 5.601 25.242 18.121 323 1HB TRP 41 HB2 TRP 41 5.977 27.786 19.728 324 2HB TRP 41 HB1 TRP 41 5.373 26.281 20.413 325 HD1 TRP 41 HD1 TRP 41 8.474 28.104 19.912 326 HE1 TRP 41 HE1 TRP 41 10.528 26.571 20.184 327 HE3 TRP 41 HE3 TRP 41 6.198 23.531 19.694 328 HZ2 TRP 41 HZ2 TRP 41 11.128 23.783 20.288 329 HZ3 TRP 41 HZ3 TRP 41 7.541 21.456 19.882 330 HH2 TRP 41 HH2 TRP 41 9.998 21.575 20.178 331 H SER 42 HN SER 42 4.320 28.541 17.852 332 HA SER 42 HA SER 42 1.671 27.902 18.796 333 1HB SER 42 HB2 SER 42 2.508 30.209 18.765 334 2HB SER 42 HB1 SER 42 2.631 30.156 17.009 335 HG SER 42 HG SER 42 0.532 30.384 16.858 336 H ASN 43 HN ASN 43 3.159 28.011 15.590 337 HA ASN 43 HA ASN 43 0.913 27.779 13.948 338 1HB ASN 43 HB2 ASN 43 3.635 26.484 13.708 339 2HB ASN 43 HB1 ASN 43 2.432 26.450 12.418 340 1HD2 ASN 43 HD22 ASN 43 4.709 29.462 12.050 341 2HD2 ASN 43 HD21 ASN 43 5.024 27.806 12.246 342 H VAL 44 HN VAL 44 2.359 25.313 16.007 343 HA VAL 44 HA VAL 44 0.395 23.301 14.947 344 HB VAL 44 HB VAL 44 1.913 21.653 16.115 345 1HG1 VAL 44 HG12 VAL 44 3.133 23.435 13.981 346 2HG1 VAL 44 HG11 VAL 44 3.672 21.803 14.372 347 3HG1 VAL 44 HG13 VAL 44 2.065 22.061 13.692 348 1HG2 VAL 44 HG21 VAL 44 2.884 23.523 17.602 349 2HG2 VAL 44 HG23 VAL 44 4.031 22.364 16.934 350 3HG2 VAL 44 HG22 VAL 44 3.865 23.962 16.206 351 H THR 45 HN THR 45 0.423 25.496 17.358 352 HA THR 45 HA THR 45 -1.231 23.741 19.086 353 HB THR 45 HB THR 45 -0.117 24.811 21.124 354 HG1 THR 45 HG1 THR 45 2.204 25.150 19.732 355 1HG2 THR 45 HG23 THR 45 1.416 22.921 19.326 356 2HG2 THR 45 HG22 THR 45 1.900 23.283 20.977 357 3HG2 THR 45 HG21 THR 45 0.350 22.503 20.663 358 HA PRO 46 HA PRO 46 -3.704 27.459 19.063 359 1HB PRO 46 HB2 PRO 46 -4.999 27.137 21.555 360 2HB PRO 46 HB1 PRO 46 -5.545 26.460 20.014 361 1HG PRO 46 HG2 PRO 46 -4.259 25.076 22.295 362 2HG PRO 46 HG1 PRO 46 -5.217 24.392 20.972 363 1HD PRO 46 HD2 PRO 46 -2.394 24.233 21.230 364 2HD PRO 46 HD1 PRO 46 -3.343 23.860 19.771 365 H LEU 47 HN LEU 47 -1.073 26.984 20.941 366 HA LEU 47 HA LEU 47 -1.380 29.031 22.963 367 1HB LEU 47 HB2 LEU 47 1.088 27.757 21.752 368 2HB LEU 47 HB1 LEU 47 1.115 28.831 23.146 369 HG LEU 47 HG LEU 47 -0.506 26.271 23.020 370 1HD1 LEU 47 HD12 LEU 47 1.911 25.796 22.880 371 2HD1 LEU 47 HD11 LEU 47 2.188 26.778 24.317 372 3HD1 LEU 47 HD13 LEU 47 1.253 25.287 24.434 373 1HD2 LEU 47 HD23 LEU 47 0.007 28.374 25.121 374 2HD2 LEU 47 HD22 LEU 47 -1.488 27.527 24.728 375 3HD2 LEU 47 HD21 LEU 47 -0.224 26.702 25.634 376 H THR 48 HN THR 48 -0.683 31.184 22.903 377 HA THR 48 HA THR 48 0.222 32.244 20.239 378 HB THR 48 HB THR 48 -1.282 34.064 20.398 379 HG1 THR 48 HG1 THR 48 -2.201 34.687 22.262 380 1HG2 THR 48 HG23 THR 48 -2.359 31.841 19.894 381 2HG2 THR 48 HG22 THR 48 -2.830 31.752 21.591 382 3HG2 THR 48 HG21 THR 48 -3.461 33.042 20.567 383 H PHE 49 HN PHE 49 1.837 33.796 20.362 384 HA PHE 49 HA PHE 49 2.823 34.507 23.111 385 1HB PHE 49 HB2 PHE 49 4.353 33.929 20.564 386 2HB PHE 49 HB1 PHE 49 5.090 34.613 22.014 387 HD1 PHE 49 HD2 PHE 49 5.281 33.297 24.077 388 HD2 PHE 49 HD1 PHE 49 3.579 31.619 20.509 389 HE1 PHE 49 HE2 PHE 49 5.471 31.030 25.056 390 HE2 PHE 49 HE1 PHE 49 3.768 29.347 21.489 391 HZ PHE 49 HZ PHE 49 4.716 29.052 23.763 392 H THR 50 HN THR 50 3.218 36.651 23.486 393 HA THR 50 HA THR 50 3.067 38.562 21.184 394 HB THR 50 HB THR 50 1.705 38.894 23.875 395 HG1 THR 50 HG1 THR 50 -0.180 38.696 22.609 396 1HG2 THR 50 HG23 THR 50 1.960 40.635 21.420 397 2HG2 THR 50 HG22 THR 50 0.644 40.843 22.574 398 3HG2 THR 50 HG21 THR 50 2.315 41.051 23.098 399 H LYS 51 HN LYS 51 4.722 39.989 21.195 400 HA LYS 51 HA LYS 51 6.655 39.986 23.391 401 1HB LYS 51 HB2 LYS 51 7.267 40.252 20.946 402 2HB LYS 51 HB1 LYS 51 6.531 41.854 21.004 403 1HG LYS 51 HG2 LYS 51 8.078 42.496 22.826 404 2HG LYS 51 HG1 LYS 51 8.821 40.898 22.747 405 1HD LYS 51 HD2 LYS 51 9.472 41.308 20.401 406 2HD LYS 51 HD1 LYS 51 8.734 42.908 20.477 407 1HE LYS 51 HE2 LYS 51 10.285 43.579 22.241 408 2HE LYS 51 HE1 LYS 51 10.994 41.965 22.262 409 1HZ LYS 51 HZ2 LYS 51 10.931 43.693 19.853 410 2HZ LYS 51 HZ1 LYS 51 12.241 43.649 20.934 411 3HZ LYS 51 HZ3 LYS 51 11.808 42.253 20.070 412 H VAL 52 HN VAL 52 6.998 41.711 24.856 413 HA VAL 52 HA VAL 52 4.943 43.913 24.824 414 HB VAL 52 HB VAL 52 4.951 43.847 27.273 415 1HG1 VAL 52 HG12 VAL 52 4.490 41.125 26.015 416 2HG1 VAL 52 HG11 VAL 52 3.852 41.644 27.575 417 3HG1 VAL 52 HG13 VAL 52 3.319 42.441 26.095 418 1HG2 VAL 52 HG21 VAL 52 6.944 41.614 26.831 419 2HG2 VAL 52 HG23 VAL 52 7.175 43.098 27.755 420 3HG2 VAL 52 HG22 VAL 52 6.090 41.844 28.356 421 H SER 53 HN SER 53 5.780 45.957 25.035 422 HA SER 53 HA SER 53 8.730 46.203 25.082 423 1HB SER 53 HB2 SER 53 7.134 47.441 23.470 424 2HB SER 53 HB1 SER 53 6.752 48.474 24.846 425 HG SER 53 HG SER 53 8.479 49.346 23.684 426 H GLU 54 HN GLU 54 6.201 46.318 27.349 427 HA GLU 54 HA GLU 54 8.036 47.452 29.362 428 1HB GLU 54 HB2 GLU 54 6.762 49.388 28.264 429 2HB GLU 54 HB1 GLU 54 5.310 48.709 28.998 430 1HG GLU 54 HG2 GLU 54 6.298 48.907 31.222 431 2HG GLU 54 HG1 GLU 54 7.803 49.507 30.522 432 H GLY 55 HN GLY 55 7.208 47.126 31.555 433 1HA GLY 55 HA2 GLY 55 5.780 46.101 33.174 434 2HA GLY 55 HA1 GLY 55 4.789 45.459 31.864 435 H GLN 56 HN GLN 56 5.361 43.705 33.818 436 HA GLN 56 HA GLN 56 7.828 42.229 33.280 437 1HB GLN 56 HB2 GLN 56 5.382 41.616 34.966 438 2HB GLN 56 HB1 GLN 56 6.781 40.547 34.856 439 1HG GLN 56 HG2 GLN 56 6.967 43.458 35.676 440 2HG GLN 56 HG1 GLN 56 6.828 42.130 36.830 441 1HE2 GLN 56 HE22 GLN 56 10.098 40.774 35.666 442 2HE2 GLN 56 HE21 GLN 56 8.509 40.187 35.780 443 H ALA 57 HN ALA 57 7.773 39.942 32.531 444 HA ALA 57 HA ALA 57 5.420 39.284 30.794 445 1HB ALA 57 HB3 ALA 57 7.421 40.322 29.534 446 2HB ALA 57 HB2 ALA 57 8.275 38.825 29.906 447 3HB ALA 57 HB1 ALA 57 6.804 38.784 28.932 448 H ASP 58 HN ASP 58 5.193 37.001 30.385 449 HA ASP 58 HA ASP 58 5.741 35.334 32.619 450 1HB ASP 58 HB2 ASP 58 5.021 34.660 29.756 451 2HB ASP 58 HB1 ASP 58 5.115 33.455 31.041 452 H ILE 59 HN ILE 59 7.452 35.708 29.524 453 HA ILE 59 HA ILE 59 9.656 33.968 30.599 454 HB ILE 59 HB ILE 59 8.916 34.606 27.729 455 1HG1 ILE 59 HG12 ILE 59 8.711 31.983 29.231 456 2HG1 ILE 59 HG11 ILE 59 7.351 33.085 29.014 457 1HG2 ILE 59 HG21 ILE 59 11.092 32.933 28.992 458 2HG2 ILE 59 HG23 ILE 59 10.576 32.702 27.322 459 3HG2 ILE 59 HG22 ILE 59 11.269 34.243 27.824 460 1HD1 ILE 59 HD11 ILE 59 7.643 32.934 26.552 461 2HD1 ILE 59 HD13 ILE 59 8.957 31.782 26.795 462 3HD1 ILE 59 HD12 ILE 59 7.314 31.358 27.273 463 H MET 60 HN MET 60 11.387 35.122 31.214 464 HA MET 60 HA MET 60 11.838 37.835 30.054 465 1HB MET 60 HB2 MET 60 13.118 36.492 32.456 466 2HB MET 60 HB1 MET 60 13.323 38.175 31.972 467 1HG MET 60 HG2 MET 60 10.659 36.917 32.681 468 2HG MET 60 HG1 MET 60 11.624 37.880 33.797 469 1HE MET 60 HE1 MET 60 12.354 40.061 33.547 470 2HE MET 60 HE3 MET 60 12.721 40.435 31.858 471 3HE MET 60 HE2 MET 60 11.512 41.373 32.728 472 H ILE 61 HN ILE 61 13.488 38.129 28.632 473 HA ILE 61 HA ILE 61 15.544 35.950 28.342 474 HB ILE 61 HB ILE 61 14.329 37.800 26.268 475 1HG1 ILE 61 HG12 ILE 61 14.318 34.778 26.410 476 2HG1 ILE 61 HG11 ILE 61 13.026 35.766 27.090 477 1HG2 ILE 61 HG21 ILE 61 16.580 35.782 26.079 478 2HG2 ILE 61 HG23 ILE 61 15.740 36.440 24.675 479 3HG2 ILE 61 HG22 ILE 61 16.666 37.509 25.729 480 1HD1 ILE 61 HD11 ILE 61 12.685 36.809 24.858 481 2HD1 ILE 61 HD13 ILE 61 13.921 35.741 24.192 482 3HD1 ILE 61 HD12 ILE 61 12.420 35.065 24.828 483 H SER 62 HN SER 62 17.636 36.595 28.683 484 HA SER 62 HA SER 62 18.348 39.449 28.265 485 1HB SER 62 HB2 SER 62 19.309 39.658 30.495 486 2HB SER 62 HB1 SER 62 17.604 39.242 30.627 487 HG SER 62 HG SER 62 19.372 38.006 31.861 488 H PHE 63 HN PHE 63 20.666 39.793 28.265 489 HA PHE 63 HA PHE 63 22.232 37.327 27.577 490 1HB PHE 63 HB2 PHE 63 22.415 40.192 26.600 491 2HB PHE 63 HB1 PHE 63 23.638 38.974 26.256 492 HD1 PHE 63 HD1 PHE 63 20.101 39.926 25.734 493 HD2 PHE 63 HD2 PHE 63 23.242 37.191 24.684 494 HE1 PHE 63 HE1 PHE 63 18.725 39.066 23.859 495 HE2 PHE 63 HE2 PHE 63 21.866 36.330 22.809 496 HZ PHE 63 HZ PHE 63 19.607 37.267 22.396 497 H VAL 64 HN VAL 64 24.063 36.940 28.804 498 HA VAL 64 HA VAL 64 25.104 39.157 30.539 499 HB VAL 64 HB VAL 64 25.318 37.515 32.395 500 1HG1 VAL 64 HG11 VAL 64 23.377 39.092 32.183 501 2HG1 VAL 64 HG13 VAL 64 22.474 37.800 31.393 502 3HG1 VAL 64 HG12 VAL 64 22.991 37.616 33.069 503 1HG2 VAL 64 HG23 VAL 64 23.753 35.780 30.466 504 2HG2 VAL 64 HG22 VAL 64 25.304 35.416 31.220 505 3HG2 VAL 64 HG21 VAL 64 23.839 35.456 32.196 506 H ARG 65 HN ARG 65 27.260 38.487 31.544 507 HA ARG 65 HA ARG 65 28.825 36.719 29.690 508 1HB ARG 65 HB2 ARG 65 29.540 39.480 30.714 509 2HB ARG 65 HB1 ARG 65 30.706 38.385 29.973 510 1HG ARG 65 HG2 ARG 65 29.336 38.298 27.930 511 2HG ARG 65 HG1 ARG 65 28.163 39.394 28.661 512 1HD ARG 65 HD2 ARG 65 31.089 40.047 28.175 513 2HD ARG 65 HD1 ARG 65 29.751 40.591 27.163 514 HE ARG 65 HE ARG 65 29.054 41.465 29.697 515 1HH1 ARG 65 HH21 ARG 65 31.823 41.696 27.653 516 2HH1 ARG 65 HH22 ARG 65 32.298 43.252 28.247 517 1HH2 ARG 65 HH11 ARG 65 29.651 43.503 30.476 518 2HH2 ARG 65 HH12 ARG 65 31.064 44.279 29.843 519 H GLY 66 HN GLY 66 30.362 35.450 30.668 520 1HA GLY 66 HA2 GLY 66 31.290 34.212 32.437 521 2HA GLY 66 HA1 GLY 66 31.768 35.805 33.015 522 H ASP 67 HN ASP 67 31.444 35.447 35.199 523 HA ASP 67 HA ASP 67 29.232 34.101 36.367 524 1HB ASP 67 HB2 ASP 67 31.388 34.762 37.526 525 2HB ASP 67 HB1 ASP 67 30.753 36.406 37.614 526 H HIS 68 HN HIS 68 27.187 34.767 36.887 527 HA HIS 68 HA HIS 68 26.470 37.646 36.495 528 1HB HIS 68 HB2 HIS 68 24.304 36.809 35.468 529 2HB HIS 68 HB1 HIS 68 25.743 36.596 34.476 530 HD1 HIS 68 HD1 HIS 68 26.980 34.080 35.296 531 HD2 HIS 68 HD2 HIS 68 22.834 34.497 35.272 532 HE1 HIS 68 HE1 HIS 68 26.026 31.740 35.176 533 H ARG 69 HN ARG 69 27.010 36.517 38.951 534 HA ARG 69 HA ARG 69 26.108 36.227 41.083 535 1HB ARG 69 HB2 ARG 69 23.703 37.574 39.815 536 2HB ARG 69 HB1 ARG 69 23.968 37.380 41.543 537 1HG ARG 69 HG2 ARG 69 25.998 38.768 39.800 538 2HG ARG 69 HG1 ARG 69 24.625 39.645 40.460 539 1HD ARG 69 HD2 ARG 69 25.312 38.846 42.753 540 2HD ARG 69 HD1 ARG 69 26.774 38.180 42.040 541 HE ARG 69 HE ARG 69 26.325 40.911 42.791 542 1HH1 ARG 69 HH21 ARG 69 27.686 39.037 40.218 543 2HH1 ARG 69 HH22 ARG 69 28.569 40.372 39.559 544 1HH2 ARG 69 HH11 ARG 69 27.485 42.627 41.955 545 2HH2 ARG 69 HH12 ARG 69 28.468 42.397 40.548 546 H ASP 70 HN ASP 70 26.027 33.944 39.607 547 HA ASP 70 HA ASP 70 23.532 32.666 40.619 548 1HB ASP 70 HB2 ASP 70 24.607 32.503 37.794 549 2HB ASP 70 HB1 ASP 70 23.566 31.250 38.468 550 H ASN 71 HN ASN 71 23.832 30.210 40.577 551 HA ASN 71 HA ASN 71 26.519 29.625 41.657 552 1HB ASN 71 HB2 ASN 71 25.533 27.596 42.508 553 2HB ASN 71 HB1 ASN 71 24.394 28.905 42.816 554 1HD2 ASN 71 HD22 ASN 71 22.563 26.011 41.237 555 2HD2 ASN 71 HD21 ASN 71 23.536 26.156 42.620 556 H SER 72 HN SER 72 25.467 29.791 38.631 557 HA SER 72 HA SER 72 27.063 27.407 37.747 558 1HB SER 72 HB2 SER 72 24.516 28.446 36.481 559 2HB SER 72 HB1 SER 72 25.494 27.111 35.881 560 HG SER 72 HG SER 72 23.982 27.298 38.265 561 HA PRO 73 HA PRO 73 28.487 31.453 35.859 562 1HB PRO 73 HB2 PRO 73 31.221 30.720 36.388 563 2HB PRO 73 HB1 PRO 73 30.284 32.003 37.168 564 1HG PRO 73 HG2 PRO 73 31.102 29.462 38.306 565 2HG PRO 73 HG1 PRO 73 30.215 30.772 39.098 566 1HD PRO 73 HD2 PRO 73 29.177 28.216 38.207 567 2HD PRO 73 HD1 PRO 73 28.298 29.526 39.018 568 H PHE 74 HN PHE 74 29.673 31.608 33.817 569 HA PHE 74 HA PHE 74 29.521 29.157 32.251 570 1HB PHE 74 HB2 PHE 74 30.410 31.975 31.601 571 2HB PHE 74 HB1 PHE 74 30.440 30.665 30.419 572 HD1 PHE 74 HD1 PHE 74 28.377 29.652 29.596 573 HD2 PHE 74 HD2 PHE 74 28.293 32.856 32.457 574 HE1 PHE 74 HE1 PHE 74 25.958 29.973 29.163 575 HE2 PHE 74 HE2 PHE 74 25.869 33.177 32.021 576 HZ PHE 74 HZ PHE 74 24.705 31.733 30.374 577 H ASP 75 HN ASP 75 31.218 27.970 31.399 578 HA ASP 75 HA ASP 75 33.889 28.412 32.663 579 1HB ASP 75 HB2 ASP 75 32.728 26.206 32.993 580 2HB ASP 75 HB1 ASP 75 32.823 25.946 31.252 581 H GLY 76 HN GLY 76 34.058 30.183 30.922 582 1HA GLY 76 HA2 GLY 76 35.124 30.895 28.949 583 2HA GLY 76 HA1 GLY 76 35.781 29.261 28.823 584 HA PRO 77 HA PRO 77 32.596 29.994 25.471 585 1HB PRO 77 HB2 PRO 77 34.456 28.911 23.542 586 2HB PRO 77 HB1 PRO 77 33.885 30.579 23.668 587 1HG PRO 77 HG2 PRO 77 36.517 29.576 24.319 588 2HG PRO 77 HG1 PRO 77 35.933 31.241 24.455 589 1HD PRO 77 HD2 PRO 77 36.436 29.342 26.603 590 2HD PRO 77 HD1 PRO 77 35.930 31.038 26.741 591 H GLY 78 HN GLY 78 34.117 27.556 27.095 592 1HA GLY 78 HA2 GLY 78 32.996 25.325 25.474 593 2HA GLY 78 HA1 GLY 78 34.088 25.156 26.849 594 H GLY 79 HN GLY 79 32.100 23.511 27.120 595 1HA GLY 79 HA2 GLY 79 30.484 22.923 28.740 596 2HA GLY 79 HA1 GLY 79 30.564 24.574 29.358 597 H ASN 80 HN ASN 80 28.199 24.538 29.449 598 HA ASN 80 HA ASN 80 26.613 24.186 27.057 599 1HB ASN 80 HB2 ASN 80 26.033 25.524 29.715 600 2HB ASN 80 HB1 ASN 80 24.829 25.342 28.436 601 1HD2 ASN 80 HD22 ASN 80 24.693 22.377 30.779 602 2HD2 ASN 80 HD21 ASN 80 24.619 24.052 31.041 603 H LEU 81 HN LEU 81 25.680 25.825 25.738 604 HA LEU 81 HA LEU 81 27.301 28.300 25.581 605 1HB LEU 81 HB2 LEU 81 25.019 27.492 23.769 606 2HB LEU 81 HB1 LEU 81 26.371 28.559 23.404 607 HG LEU 81 HG LEU 81 26.451 25.559 23.801 608 1HD1 LEU 81 HD11 LEU 81 25.780 26.407 21.571 609 2HD1 LEU 81 HD13 LEU 81 27.267 27.352 21.496 610 3HD1 LEU 81 HD12 LEU 81 27.342 25.589 21.514 611 1HD2 LEU 81 HD23 LEU 81 28.704 27.577 23.645 612 2HD2 LEU 81 HD22 LEU 81 28.421 26.378 24.906 613 3HD2 LEU 81 HD21 LEU 81 28.933 25.866 23.299 614 H ALA 82 HN ALA 82 24.415 27.260 26.974 615 HA ALA 82 HA ALA 82 23.727 29.845 27.990 616 1HB ALA 82 HB3 ALA 82 21.962 28.794 25.752 617 2HB ALA 82 HB2 ALA 82 21.563 30.151 26.805 618 3HB ALA 82 HB1 ALA 82 22.927 30.267 25.698 619 H HIS 83 HN HIS 83 21.351 29.646 28.980 620 HA HIS 83 HA HIS 83 20.429 26.934 29.481 621 1HB HIS 83 HB2 HIS 83 20.953 26.907 31.898 622 2HB HIS 83 HB1 HIS 83 22.423 26.949 30.924 623 HD1 HIS 83 HD1 HIS 83 24.023 28.823 31.389 624 HD2 HIS 83 HD2 HIS 83 20.220 29.621 32.905 625 HE1 HIS 83 HE1 HIS 83 24.210 30.987 32.693 626 H ALA 84 HN ALA 84 18.669 26.983 31.223 627 HA ALA 84 HA ALA 84 17.462 29.660 31.649 628 1HB ALA 84 HB1 ALA 84 16.090 27.396 30.166 629 2HB ALA 84 HB3 ALA 84 15.272 28.842 30.755 630 3HB ALA 84 HB2 ALA 84 16.512 28.977 29.511 631 H PHE 85 HN PHE 85 15.499 29.441 33.099 632 HA PHE 85 HA PHE 85 16.013 27.316 35.136 633 1HB PHE 85 HB2 PHE 85 14.546 29.966 35.294 634 2HB PHE 85 HB1 PHE 85 14.657 28.809 36.623 635 HD1 PHE 85 HD1 PHE 85 16.826 28.305 37.686 636 HD2 PHE 85 HD2 PHE 85 16.468 31.264 34.596 637 HE1 PHE 85 HE1 PHE 85 19.060 29.199 38.284 638 HE2 PHE 85 HE2 PHE 85 18.703 32.160 35.195 639 HZ PHE 85 HZ PHE 85 20.001 31.127 37.039 640 H GLN 86 HN GLN 86 14.070 26.346 36.177 641 HA GLN 86 HA GLN 86 12.264 25.339 34.213 642 1HB GLN 86 HB2 GLN 86 12.209 25.267 37.237 643 2HB GLN 86 HB1 GLN 86 11.028 24.420 36.238 644 1HG GLN 86 HG2 GLN 86 12.748 23.077 35.214 645 2HG GLN 86 HG1 GLN 86 14.021 24.035 35.971 646 1HE2 GLN 86 HE22 GLN 86 14.076 21.784 38.669 647 2HE2 GLN 86 HE21 GLN 86 14.949 22.673 37.517 648 HA PRO 87 HA PRO 87 9.168 28.529 34.069 649 1HB PRO 87 HB2 PRO 87 6.907 26.700 34.203 650 2HB PRO 87 HB1 PRO 87 7.538 27.554 32.787 651 1HG PRO 87 HG2 PRO 87 7.811 24.736 33.429 652 2HG PRO 87 HG1 PRO 87 8.400 25.585 31.993 653 1HD PRO 87 HD2 PRO 87 9.986 24.553 34.152 654 2HD PRO 87 HD1 PRO 87 10.543 25.527 32.775 655 H GLY 88 HN GLY 88 9.340 29.516 36.111 656 1HA GLY 88 HA2 GLY 88 7.286 28.779 38.071 657 2HA GLY 88 HA1 GLY 88 8.943 28.609 38.653 658 HA PRO 89 HA PRO 89 7.323 33.074 38.955 659 1HB PRO 89 HB2 PRO 89 7.533 33.073 41.807 660 2HB PRO 89 HB1 PRO 89 6.040 33.068 40.858 661 1HG PRO 89 HG2 PRO 89 7.256 30.858 42.372 662 2HG PRO 89 HG1 PRO 89 5.630 30.962 41.676 663 1HD PRO 89 HD2 PRO 89 7.802 29.402 40.672 664 2HD PRO 89 HD1 PRO 89 6.253 29.712 39.860 665 H GLY 90 HN GLY 90 8.675 34.854 40.090 666 1HA GLY 90 HA2 GLY 90 10.751 35.803 40.629 667 2HA GLY 90 HA1 GLY 90 11.277 34.203 41.149 668 H ILE 91 HN ILE 91 13.105 33.696 40.069 669 HA ILE 91 HA ILE 91 13.656 34.772 37.409 670 HB ILE 91 HB ILE 91 15.391 34.411 39.218 671 1HG1 ILE 91 HG12 ILE 91 15.972 32.886 36.663 672 2HG1 ILE 91 HG11 ILE 91 15.900 34.645 36.740 673 1HG2 ILE 91 HG22 ILE 91 14.439 32.117 39.819 674 2HG2 ILE 91 HG21 ILE 91 15.237 31.510 38.369 675 3HG2 ILE 91 HG23 ILE 91 16.195 32.206 39.675 676 1HD1 ILE 91 HD11 ILE 91 17.671 34.640 38.459 677 2HD1 ILE 91 HD13 ILE 91 17.747 32.881 38.371 678 3HD1 ILE 91 HD12 ILE 91 18.219 33.854 36.978 679 H GLY 92 HN GLY 92 11.900 32.128 38.520 680 1HA GLY 92 HA2 GLY 92 12.636 30.050 36.736 681 2HA GLY 92 HA1 GLY 92 11.021 30.256 37.415 682 H GLY 93 HN GLY 93 12.138 29.631 34.600 683 1HA GLY 93 HA2 GLY 93 11.015 29.891 32.513 684 2HA GLY 93 HA1 GLY 93 10.155 31.284 33.168 685 H ASP 94 HN ASP 94 12.981 32.207 34.134 686 HA ASP 94 HA ASP 94 13.455 34.003 31.941 687 1HB ASP 94 HB2 ASP 94 15.182 33.273 34.322 688 2HB ASP 94 HB1 ASP 94 15.537 34.593 33.205 689 H ALA 95 HN ALA 95 15.463 34.111 30.654 690 HA ALA 95 HA ALA 95 16.877 31.504 30.290 691 1HB ALA 95 HB3 ALA 95 14.938 31.720 28.654 692 2HB ALA 95 HB2 ALA 95 15.778 33.108 27.964 693 3HB ALA 95 HB1 ALA 95 16.523 31.510 27.911 694 H HIS 96 HN HIS 96 19.023 31.920 30.329 695 HA HIS 96 HA HIS 96 19.983 34.670 29.626 696 1HB HIS 96 HB2 HIS 96 21.281 32.480 31.278 697 2HB HIS 96 HB1 HIS 96 21.988 34.063 30.955 698 HD2 HIS 96 HD2 HIS 96 18.313 34.866 31.674 699 HE1 HIS 96 HE1 HIS 96 20.361 34.707 35.397 700 HE2 HIS 96 HE2 HIS 96 18.226 35.420 34.227 701 H PHE 97 HN PHE 97 21.559 34.930 28.063 702 HA PHE 97 HA PHE 97 22.436 32.457 26.578 703 1HB PHE 97 HB2 PHE 97 21.712 35.216 25.565 704 2HB PHE 97 HB1 PHE 97 22.576 34.031 24.585 705 HD1 PHE 97 HD1 PHE 97 19.419 34.621 26.479 706 HD2 PHE 97 HD2 PHE 97 21.440 32.209 23.555 707 HE1 PHE 97 HE1 PHE 97 17.274 33.521 25.897 708 HE2 PHE 97 HE2 PHE 97 19.294 31.113 22.980 709 HZ PHE 97 HZ PHE 97 17.214 31.768 24.148 710 H ASP 98 HN ASP 98 24.593 32.262 26.094 711 HA ASP 98 HA ASP 98 26.517 33.847 27.551 712 1HB ASP 98 HB2 ASP 98 26.824 31.438 26.912 713 2HB ASP 98 HB1 ASP 98 26.999 31.943 25.230 714 H GLU 99 HN GLU 99 26.718 35.987 26.945 715 HA GLU 99 HA GLU 99 26.503 36.817 24.151 716 1HB GLU 99 HB2 GLU 99 25.799 38.209 26.135 717 2HB GLU 99 HB1 GLU 99 27.504 38.439 26.500 718 1HG GLU 99 HG2 GLU 99 27.884 39.549 24.394 719 2HG GLU 99 HG1 GLU 99 26.264 39.140 23.827 720 H ASP 100 HN ASP 100 29.060 35.554 26.013 721 HA ASP 100 HA ASP 100 31.196 37.092 24.749 722 1HB ASP 100 HB2 ASP 100 31.185 34.544 26.382 723 2HB ASP 100 HB1 ASP 100 32.659 35.290 25.761 724 H GLU 101 HN GLU 101 29.275 34.395 23.877 725 HA GLU 101 HA GLU 101 31.227 33.275 21.983 726 1HB GLU 101 HB2 GLU 101 28.305 32.703 22.533 727 2HB GLU 101 HB1 GLU 101 29.269 31.823 21.345 728 1HG GLU 101 HG2 GLU 101 30.777 31.027 23.053 729 2HG GLU 101 HG1 GLU 101 30.040 32.080 24.262 730 H ARG 102 HN ARG 102 30.742 33.201 19.631 731 HA ARG 102 HA ARG 102 29.608 35.790 18.730 732 1HB ARG 102 HB2 ARG 102 31.807 34.865 17.847 733 2HB ARG 102 HB1 ARG 102 30.872 33.601 17.051 734 1HG ARG 102 HG2 ARG 102 31.010 35.176 15.346 735 2HG ARG 102 HG1 ARG 102 29.482 35.639 16.084 736 1HD ARG 102 HD2 ARG 102 31.105 37.162 17.586 737 2HD ARG 102 HD1 ARG 102 32.133 37.040 16.162 738 HE ARG 102 HE ARG 102 29.902 38.755 16.410 739 1HH1 ARG 102 HH21 ARG 102 31.113 36.385 14.205 740 2HH1 ARG 102 HH22 ARG 102 30.132 36.930 12.890 741 1HH2 ARG 102 HH11 ARG 102 28.640 39.475 14.705 742 2HH2 ARG 102 HH12 ARG 102 28.728 38.671 13.173 743 H TRP 103 HN TRP 103 27.430 35.780 18.433 744 HA TRP 103 HA TRP 103 26.050 33.281 17.656 745 1HB TRP 103 HB2 TRP 103 25.057 36.039 18.427 746 2HB TRP 103 HB1 TRP 103 23.988 34.725 17.933 747 HD1 TRP 103 HD1 TRP 103 25.526 36.155 20.925 748 HE1 TRP 103 HE1 TRP 103 25.440 34.497 22.898 749 HE3 TRP 103 HE3 TRP 103 24.285 31.878 18.428 750 HZ2 TRP 103 HZ2 TRP 103 24.916 31.724 23.353 751 HZ3 TRP 103 HZ3 TRP 103 24.006 29.746 19.651 752 HH2 TRP 103 HH2 TRP 103 24.317 29.661 22.110 753 H THR 104 HN THR 104 24.891 33.046 15.713 754 HA THR 104 HA THR 104 25.327 35.165 13.630 755 HB THR 104 HB THR 104 25.848 33.463 12.005 756 HG1 THR 104 HG1 THR 104 25.956 31.246 12.783 757 1HG2 THR 104 HG21 THR 104 27.703 34.198 13.482 758 2HG2 THR 104 HG23 THR 104 27.344 32.858 14.570 759 3HG2 THR 104 HG22 THR 104 27.914 32.535 12.935 760 H ASN 105 HN ASN 105 23.762 35.035 11.851 761 HA ASN 105 HA ASN 105 21.098 33.999 12.762 762 1HB ASN 105 HB2 ASN 105 21.817 36.169 10.762 763 2HB ASN 105 HB1 ASN 105 20.175 35.650 11.139 764 1HD2 ASN 105 HD22 ASN 105 21.678 38.506 13.383 765 2HD2 ASN 105 HD21 ASN 105 22.090 38.172 11.771 766 H ASN 106 HN ASN 106 23.350 32.561 11.319 767 HA ASN 106 HA ASN 106 21.671 31.485 9.113 768 1HB ASN 106 HB2 ASN 106 23.883 31.450 7.727 769 2HB ASN 106 HB1 ASN 106 22.989 32.965 7.849 770 1HD2 ASN 106 HD22 ASN 106 25.913 34.527 9.029 771 2HD2 ASN 106 HD21 ASN 106 24.636 34.534 7.911 772 H PHE 107 HN PHE 107 23.592 29.713 8.088 773 HA PHE 107 HA PHE 107 23.566 27.688 10.189 774 1HB PHE 107 HB2 PHE 107 24.772 27.538 7.415 775 2HB PHE 107 HB1 PHE 107 24.328 26.183 8.452 776 HD1 PHE 107 HD1 PHE 107 21.815 26.236 9.337 777 HD2 PHE 107 HD2 PHE 107 23.223 28.237 5.804 778 HE1 PHE 107 HE1 PHE 107 19.504 26.286 8.447 779 HE2 PHE 107 HE2 PHE 107 20.908 28.293 4.916 780 HZ PHE 107 HZ PHE 107 19.050 27.315 6.238 781 H ARG 108 HN ARG 108 25.703 30.158 9.587 782 HA ARG 108 HA ARG 108 28.263 28.952 9.633 783 1HB ARG 108 HB2 ARG 108 27.341 31.547 10.895 784 2HB ARG 108 HB1 ARG 108 29.031 31.079 10.717 785 1HG ARG 108 HG2 ARG 108 28.702 30.897 8.262 786 2HG ARG 108 HG1 ARG 108 27.033 31.427 8.467 787 1HD ARG 108 HD2 ARG 108 29.476 33.031 9.270 788 2HD ARG 108 HD1 ARG 108 28.515 33.305 7.819 789 HE ARG 108 HE ARG 108 26.659 33.438 9.875 790 1HH1 ARG 108 HH21 ARG 108 29.683 34.906 9.122 791 2HH1 ARG 108 HH22 ARG 108 29.315 36.396 9.924 792 1HH2 ARG 108 HH11 ARG 108 26.147 35.382 10.915 793 2HH2 ARG 108 HH12 ARG 108 27.308 36.668 10.934 794 H GLU 109 HN GLU 109 29.758 29.263 11.638 795 HA GLU 109 HA GLU 109 30.025 27.522 13.448 796 1HB GLU 109 HB2 GLU 109 29.643 30.396 14.290 797 2HB GLU 109 HB1 GLU 109 30.250 29.153 15.385 798 1HG GLU 109 HG2 GLU 109 32.086 28.655 13.821 799 2HG GLU 109 HG1 GLU 109 31.491 29.895 12.716 800 H TYR 110 HN TYR 110 27.758 29.839 14.931 801 HA TYR 110 HA TYR 110 26.035 27.503 15.731 802 1HB TYR 110 HB2 TYR 110 26.793 29.901 17.428 803 2HB TYR 110 HB1 TYR 110 25.700 28.604 17.908 804 HD1 TYR 110 HD2 TYR 110 26.585 26.238 18.057 805 HD2 TYR 110 HD1 TYR 110 29.151 29.652 17.611 806 HE1 TYR 110 HE2 TYR 110 28.507 24.888 18.839 807 HE2 TYR 110 HE1 TYR 110 31.081 28.307 18.398 808 HH TYR 110 HH TYR 110 31.491 25.479 18.335 809 H ASN 111 HN ASN 111 23.880 27.791 15.471 810 HA ASN 111 HA ASN 111 22.948 30.391 14.359 811 1HB ASN 111 HB2 ASN 111 22.388 28.212 13.205 812 2HB ASN 111 HB1 ASN 111 21.426 27.778 14.620 813 1HD2 ASN 111 HD22 ASN 111 19.217 29.495 12.092 814 2HD2 ASN 111 HD21 ASN 111 20.229 28.134 12.022 815 H LEU 112 HN LEU 112 22.082 31.804 15.801 816 HA LEU 112 HA LEU 112 21.561 31.199 18.519 817 1HB LEU 112 HB2 LEU 112 21.911 33.500 17.694 818 2HB LEU 112 HB1 LEU 112 20.382 33.422 16.824 819 HG LEU 112 HG LEU 112 19.173 33.124 18.960 820 1HD1 LEU 112 HD12 LEU 112 21.974 33.102 20.059 821 2HD1 LEU 112 HD11 LEU 112 20.652 33.705 21.057 822 3HD1 LEU 112 HD13 LEU 112 20.613 32.053 20.451 823 1HD2 LEU 112 HD21 LEU 112 19.748 35.403 17.987 824 2HD2 LEU 112 HD23 LEU 112 19.373 35.387 19.709 825 3HD2 LEU 112 HD22 LEU 112 21.050 35.486 19.173 826 H HIS 113 HN HIS 113 19.379 31.262 15.713 827 HA HIS 113 HA HIS 113 16.945 30.944 17.124 828 1HB HIS 113 HB2 HIS 113 17.131 31.440 14.686 829 2HB HIS 113 HB1 HIS 113 17.636 29.771 14.419 830 HD1 HIS 113 HD1 HIS 113 15.641 28.648 13.394 831 HD2 HIS 113 HD2 HIS 113 14.586 31.019 16.655 832 HE1 HIS 113 HE1 HIS 113 13.171 28.257 13.797 833 H ARG 114 HN ARG 114 19.172 28.393 15.885 834 HA ARG 114 HA ARG 114 17.542 26.203 16.688 835 1HB ARG 114 HB2 ARG 114 20.546 26.437 16.409 836 2HB ARG 114 HB1 ARG 114 19.722 24.913 16.748 837 1HG ARG 114 HG2 ARG 114 18.353 25.242 14.678 838 2HG ARG 114 HG1 ARG 114 19.299 26.690 14.324 839 1HD ARG 114 HD2 ARG 114 20.225 24.793 13.089 840 2HD ARG 114 HD1 ARG 114 21.370 25.302 14.331 841 HE ARG 114 HE ARG 114 19.884 23.329 15.580 842 1HH1 ARG 114 HH21 ARG 114 21.662 23.637 12.639 843 2HH1 ARG 114 HH22 ARG 114 22.108 21.964 12.578 844 1HH2 ARG 114 HH11 ARG 114 20.456 21.143 15.518 845 2HH2 ARG 114 HH12 ARG 114 21.425 20.550 14.210 846 H VAL 115 HN VAL 115 20.050 27.991 18.501 847 HA VAL 115 HA VAL 115 19.793 26.313 20.843 848 HB VAL 115 HB VAL 115 20.953 29.085 20.432 849 1HG1 VAL 115 HG12 VAL 115 20.833 27.349 22.914 850 2HG1 VAL 115 HG11 VAL 115 22.005 28.650 22.712 851 3HG1 VAL 115 HG13 VAL 115 20.280 29.013 22.741 852 1HG2 VAL 115 HG22 VAL 115 22.157 27.194 19.376 853 2HG2 VAL 115 HG21 VAL 115 23.091 27.877 20.706 854 3HG2 VAL 115 HG23 VAL 115 22.213 26.365 20.933 855 H ALA 116 HN ALA 116 18.343 29.399 19.830 856 HA ALA 116 HA ALA 116 16.981 29.986 22.257 857 1HB ALA 116 HB1 ALA 116 16.309 30.599 19.372 858 2HB ALA 116 HB3 ALA 116 15.362 31.217 20.726 859 3HB ALA 116 HB2 ALA 116 17.057 31.672 20.556 860 H ALA 117 HN ALA 117 15.939 28.075 19.426 861 HA ALA 117 HA ALA 117 13.325 27.459 20.374 862 1HB ALA 117 HB2 ALA 117 14.249 27.010 18.049 863 2HB ALA 117 HB1 ALA 117 15.087 25.618 18.733 864 3HB ALA 117 HB3 ALA 117 13.325 25.680 18.748 865 H HIS 118 HN HIS 118 16.447 25.848 20.905 866 HA HIS 118 HA HIS 118 15.478 23.569 22.305 867 1HB HIS 118 HB2 HIS 118 17.819 23.821 21.522 868 2HB HIS 118 HB1 HIS 118 18.075 25.091 22.718 869 HD1 HIS 118 HD1 HIS 118 18.031 21.431 22.299 870 HD2 HIS 118 HD2 HIS 118 17.923 24.119 25.484 871 HE1 HIS 118 HE1 HIS 118 18.563 20.094 24.382 872 H GLU 119 HN GLU 119 16.535 26.754 23.536 873 HA GLU 119 HA GLU 119 16.017 26.195 26.297 874 1HB GLU 119 HB2 GLU 119 16.100 28.788 24.733 875 2HB GLU 119 HB1 GLU 119 15.939 28.720 26.490 876 1HG GLU 119 HG2 GLU 119 18.044 27.454 26.644 877 2HG GLU 119 HG1 GLU 119 18.207 27.504 24.889 878 H LEU 120 HN LEU 120 13.980 27.567 23.721 879 HA LEU 120 HA LEU 120 11.742 28.134 25.452 880 1HB LEU 120 HB2 LEU 120 11.882 27.646 22.461 881 2HB LEU 120 HB1 LEU 120 10.444 28.215 23.305 882 HG LEU 120 HG LEU 120 13.121 29.641 23.381 883 1HD1 LEU 120 HD11 LEU 120 10.702 30.028 21.608 884 2HD1 LEU 120 HD13 LEU 120 11.915 31.286 21.854 885 3HD1 LEU 120 HD12 LEU 120 12.374 29.749 21.119 886 1HD2 LEU 120 HD22 LEU 120 10.372 30.205 24.490 887 2HD2 LEU 120 HD21 LEU 120 11.950 30.427 25.246 888 3HD2 LEU 120 HD23 LEU 120 11.396 31.560 24.014 889 H GLY 121 HN GLY 121 12.811 25.301 23.648 890 1HA GLY 121 HA2 GLY 121 10.417 23.768 23.807 891 2HA GLY 121 HA1 GLY 121 12.041 23.082 23.710 892 H HIS 122 HN HIS 122 13.116 24.146 26.111 893 HA HIS 122 HA HIS 122 12.083 22.255 28.026 894 1HB HIS 122 HB2 HIS 122 14.017 24.570 28.255 895 2HB HIS 122 HB1 HIS 122 13.563 23.591 29.649 896 HD1 HIS 122 HD1 HIS 122 13.984 20.912 29.322 897 HD2 HIS 122 HD2 HIS 122 16.034 23.442 26.718 898 HE1 HIS 122 HE1 HIS 122 15.859 19.537 28.316 899 H SER 123 HN SER 123 11.674 25.758 27.587 900 HA SER 123 HA SER 123 10.212 26.269 29.976 901 1HB SER 123 HB2 SER 123 9.477 28.288 28.911 902 2HB SER 123 HB1 SER 123 11.104 27.980 28.312 903 HG SER 123 HG SER 123 8.720 28.036 26.986 904 H LEU 124 HN LEU 124 9.290 24.760 26.953 905 HA LEU 124 HA LEU 124 6.415 24.893 27.551 906 1HB LEU 124 HB2 LEU 124 7.969 23.381 25.429 907 2HB LEU 124 HB1 LEU 124 6.211 23.459 25.518 908 HG LEU 124 HG LEU 124 7.999 25.901 25.309 909 1HD1 LEU 124 HD13 LEU 124 8.201 24.475 23.301 910 2HD1 LEU 124 HD12 LEU 124 6.446 24.461 23.136 911 3HD1 LEU 124 HD11 LEU 124 7.338 25.969 22.936 912 1HD2 LEU 124 HD22 LEU 124 5.016 25.429 25.311 913 2HD2 LEU 124 HD21 LEU 124 5.947 26.668 26.150 914 3HD2 LEU 124 HD23 LEU 124 5.675 26.796 24.415 915 H GLY 125 HN GLY 125 8.940 23.108 28.753 916 1HA GLY 125 HA2 GLY 125 8.715 21.360 30.372 917 2HA GLY 125 HA1 GLY 125 7.080 21.052 29.791 918 H LEU 126 HN LEU 126 9.188 21.326 27.168 919 HA LEU 126 HA LEU 126 8.978 18.469 26.620 920 1HB LEU 126 HB2 LEU 126 10.536 20.632 25.171 921 2HB LEU 126 HB1 LEU 126 10.224 19.011 24.556 922 HG LEU 126 HG LEU 126 8.087 21.045 25.266 923 1HD1 LEU 126 HD13 LEU 126 9.335 20.193 22.646 924 2HD1 LEU 126 HD12 LEU 126 7.738 20.937 22.721 925 3HD1 LEU 126 HD11 LEU 126 9.151 21.825 23.290 926 1HD2 LEU 126 HD22 LEU 126 8.035 18.185 24.315 927 2HD2 LEU 126 HD21 LEU 126 7.015 18.977 25.515 928 3HD2 LEU 126 HD23 LEU 126 6.756 19.281 23.800 929 H SER 127 HN SER 127 10.604 16.935 26.762 930 HA SER 127 HA SER 127 13.113 17.779 28.175 931 1HB SER 127 HB2 SER 127 11.715 15.089 28.062 932 2HB SER 127 HB1 SER 127 13.236 15.400 28.895 933 HG SER 127 HG SER 127 12.147 16.876 30.215 934 H HIS 128 HN HIS 128 15.096 16.635 27.531 935 HA HIS 128 HA HIS 128 15.665 16.714 24.794 936 1HB HIS 128 HB2 HIS 128 16.935 14.967 26.922 937 2HB HIS 128 HB1 HIS 128 17.627 15.264 25.329 938 HD1 HIS 128 HD1 HIS 128 18.846 16.194 28.165 939 HD2 HIS 128 HD2 HIS 128 16.837 18.614 25.428 940 HE1 HIS 128 HE1 HIS 128 19.578 18.573 28.636 941 H SER 129 HN SER 129 16.440 14.665 23.520 942 HA SER 129 HA SER 129 14.724 12.293 23.944 943 1HB SER 129 HB2 SER 129 13.297 13.809 22.618 944 2HB SER 129 HB1 SER 129 14.579 13.980 21.422 945 HG SER 129 HG SER 129 14.269 11.938 20.783 946 H THR 130 HN THR 130 15.349 10.520 22.434 947 HA THR 130 HA THR 130 18.259 10.637 21.878 948 HB THR 130 HB THR 130 18.145 8.238 21.685 949 HG1 THR 130 HG1 THR 130 16.391 7.286 21.072 950 1HG2 THR 130 HG23 THR 130 18.035 9.156 23.974 951 2HG2 THR 130 HG22 THR 130 16.273 9.155 23.884 952 3HG2 THR 130 HG21 THR 130 17.160 7.630 23.850 953 H ASP 131 HN ASP 131 15.564 11.463 20.189 954 HA ASP 131 HA ASP 131 16.227 10.161 17.642 955 1HB ASP 131 HB2 ASP 131 13.884 10.770 18.199 956 2HB ASP 131 HB1 ASP 131 14.346 12.471 18.225 957 H ILE 132 HN ILE 132 17.940 10.838 16.494 958 HA ILE 132 HA ILE 132 19.406 13.214 17.000 959 HB ILE 132 HB ILE 132 19.292 11.428 14.551 960 1HG1 ILE 132 HG12 ILE 132 21.402 11.708 16.711 961 2HG1 ILE 132 HG11 ILE 132 20.108 10.515 16.778 962 1HG2 ILE 132 HG22 ILE 132 21.048 13.797 15.221 963 2HG2 ILE 132 HG21 ILE 132 21.577 12.534 14.111 964 3HG2 ILE 132 HG23 ILE 132 20.146 13.493 13.738 965 1HD1 ILE 132 HD11 ILE 132 22.131 10.765 14.536 966 2HD1 ILE 132 HD13 ILE 132 22.182 9.558 15.819 967 3HD1 ILE 132 HD12 ILE 132 20.861 9.548 14.651 968 H GLY 133 HN GLY 133 16.847 12.538 14.628 969 1HA GLY 133 HA2 GLY 133 17.055 15.061 13.270 970 2HA GLY 133 HA1 GLY 133 15.657 13.991 13.227 971 H ALA 134 HN ALA 134 16.395 14.691 16.442 972 HA ALA 134 HA ALA 134 14.144 16.637 16.552 973 1HB ALA 134 HB2 ALA 134 15.612 15.128 18.737 974 2HB ALA 134 HB1 ALA 134 14.288 16.255 19.021 975 3HB ALA 134 HB3 ALA 134 14.001 14.772 18.111 976 H LEU 135 HN LEU 135 14.413 18.741 17.298 977 HA LEU 135 HA LEU 135 17.025 19.932 17.019 978 1HB LEU 135 HB2 LEU 135 14.532 21.085 18.314 979 2HB LEU 135 HB1 LEU 135 15.931 22.000 17.748 980 HG LEU 135 HG LEU 135 14.120 20.313 15.991 981 1HD1 LEU 135 HD12 LEU 135 13.058 22.391 16.825 982 2HD1 LEU 135 HD11 LEU 135 14.426 23.324 16.218 983 3HD1 LEU 135 HD13 LEU 135 13.370 22.475 15.091 984 1HD2 LEU 135 HD21 LEU 135 16.641 21.897 15.481 985 2HD2 LEU 135 HD23 LEU 135 16.204 20.290 14.899 986 3HD2 LEU 135 HD22 LEU 135 15.441 21.714 14.201 987 H MET 136 HN MET 136 15.056 19.006 19.809 988 HA MET 136 HA MET 136 16.790 20.207 21.773 989 1HB MET 136 HB2 MET 136 14.848 17.905 22.107 990 2HB MET 136 HB1 MET 136 15.512 18.906 23.396 991 1HG MET 136 HG2 MET 136 14.502 20.912 22.184 992 2HG MET 136 HG1 MET 136 13.634 19.752 21.181 993 1HE MET 136 HE1 MET 136 13.866 21.731 24.272 994 2HE MET 136 HE3 MET 136 12.997 20.864 25.543 995 3HE MET 136 HE2 MET 136 14.568 20.291 25.001 996 H TYR 137 HN TYR 137 17.926 18.165 19.706 997 HA TYR 137 HA TYR 137 18.779 15.885 21.189 998 1HB TYR 137 HB2 TYR 137 18.926 16.367 18.635 999 2HB TYR 137 HB1 TYR 137 20.450 17.161 19.021 1000 HD1 TYR 137 HD2 TYR 137 18.616 13.960 19.746 1001 HD2 TYR 137 HD1 TYR 137 22.399 15.856 19.008 1002 HE1 TYR 137 HE2 TYR 137 19.737 11.748 19.798 1003 HE2 TYR 137 HE1 TYR 137 23.517 13.646 19.062 1004 HH TYR 137 HH TYR 137 23.270 11.469 19.500 1005 HA PRO 138 HA PRO 138 21.523 17.919 24.070 1006 1HB PRO 138 HB2 PRO 138 23.437 15.731 24.121 1007 2HB PRO 138 HB1 PRO 138 22.237 16.165 25.346 1008 1HG PRO 138 HG2 PRO 138 22.150 13.945 23.473 1009 2HG PRO 138 HG1 PRO 138 20.991 14.336 24.752 1010 1HD PRO 138 HD2 PRO 138 20.584 14.608 21.932 1011 2HD PRO 138 HD1 PRO 138 19.499 15.157 23.226 1012 H SER 139 HN SER 139 23.287 16.060 21.537 1013 HA SER 139 HA SER 139 25.418 18.085 21.498 1014 1HB SER 139 HB2 SER 139 24.922 15.570 19.899 1015 2HB SER 139 HB1 SER 139 26.293 16.635 19.606 1016 HG SER 139 HG SER 139 26.822 14.968 21.071 1017 H TYR 140 HN TYR 140 25.856 19.503 19.782 1018 HA TYR 140 HA TYR 140 23.551 20.420 18.277 1019 1HB TYR 140 HB2 TYR 140 25.336 21.969 19.065 1020 2HB TYR 140 HB1 TYR 140 26.476 21.182 17.973 1021 HD1 TYR 140 HD1 TYR 140 26.174 21.335 15.508 1022 HD2 TYR 140 HD2 TYR 140 23.659 23.501 18.240 1023 HE1 TYR 140 HE1 TYR 140 25.399 22.783 13.648 1024 HE2 TYR 140 HE2 TYR 140 22.878 24.948 16.376 1025 HH TYR 140 HH TYR 140 24.125 25.597 13.915 1026 H THR 141 HN THR 141 23.397 20.427 15.925 1027 HA THR 141 HA THR 141 25.222 18.625 14.437 1028 HB THR 141 HB THR 141 23.293 17.317 13.536 1029 HG1 THR 141 HG1 THR 141 21.342 17.476 14.773 1030 1HG2 THR 141 HG22 THR 141 24.697 16.558 15.501 1031 2HG2 THR 141 HG21 THR 141 23.427 17.175 16.556 1032 3HG2 THR 141 HG23 THR 141 23.080 15.858 15.436 1033 H PHE 142 HN PHE 142 25.159 19.031 12.175 1034 HA PHE 142 HA PHE 142 24.120 21.675 11.465 1035 1HB PHE 142 HB2 PHE 142 26.328 20.682 10.657 1036 2HB PHE 142 HB1 PHE 142 25.372 19.631 9.613 1037 HD1 PHE 142 HD2 PHE 142 24.060 20.552 7.746 1038 HD2 PHE 142 HD1 PHE 142 26.463 23.073 10.259 1039 HE1 PHE 142 HE2 PHE 142 23.871 22.388 6.088 1040 HE2 PHE 142 HE1 PHE 142 26.274 24.906 8.603 1041 HZ PHE 142 HZ PHE 142 24.978 24.566 6.518 1042 H SER 143 HN SER 143 22.044 21.938 10.831 1043 HA SER 143 HA SER 143 20.680 19.699 9.351 1044 1HB SER 143 HB2 SER 143 19.520 21.780 11.231 1045 2HB SER 143 HB1 SER 143 18.562 20.648 10.281 1046 HG SER 143 HG SER 143 20.633 19.816 12.025 1047 H GLY 144 HN GLY 144 19.879 20.225 7.352 1048 1HA GLY 144 HA2 GLY 144 20.623 22.593 6.006 1049 2HA GLY 144 HA1 GLY 144 19.304 21.542 5.485 1050 H ASP 145 HN ASP 145 17.155 21.971 6.318 1051 HA ASP 145 HA ASP 145 16.767 24.835 7.046 1052 1HB ASP 145 HB2 ASP 145 14.407 24.437 6.464 1053 2HB ASP 145 HB1 ASP 145 15.466 23.950 5.140 1054 H VAL 146 HN VAL 146 15.380 25.382 8.862 1055 HA VAL 146 HA VAL 146 15.591 23.393 11.061 1056 HB VAL 146 HB VAL 146 14.792 26.320 11.109 1057 1HG1 VAL 146 HG12 VAL 146 15.464 24.356 13.324 1058 2HG1 VAL 146 HG11 VAL 146 15.231 26.090 13.551 1059 3HG1 VAL 146 HG13 VAL 146 13.887 25.082 13.017 1060 1HG2 VAL 146 HG22 VAL 146 17.409 24.877 11.604 1061 2HG2 VAL 146 HG21 VAL 146 17.092 26.163 10.441 1062 3HG2 VAL 146 HG23 VAL 146 17.107 26.520 12.168 1063 H GLN 147 HN GLN 147 13.873 22.077 11.321 1064 HA GLN 147 HA GLN 147 11.128 23.249 11.224 1065 1HB GLN 147 HB2 GLN 147 12.065 20.729 9.822 1066 2HB GLN 147 HB1 GLN 147 10.365 21.116 10.094 1067 1HG GLN 147 HG2 GLN 147 10.642 23.224 8.838 1068 2HG GLN 147 HG1 GLN 147 12.340 22.834 8.564 1069 1HE2 GLN 147 HE22 GLN 147 9.963 21.594 5.771 1070 2HE2 GLN 147 HE21 GLN 147 9.894 23.042 6.655 1071 H LEU 148 HN LEU 148 9.600 22.033 12.551 1072 HA LEU 148 HA LEU 148 10.862 20.869 14.903 1073 1HB LEU 148 HB2 LEU 148 7.924 20.892 14.136 1074 2HB LEU 148 HB1 LEU 148 8.581 20.562 15.737 1075 HG LEU 148 HG LEU 148 8.871 23.177 14.223 1076 1HD1 LEU 148 HD11 LEU 148 7.156 22.324 16.571 1077 2HD1 LEU 148 HD13 LEU 148 7.439 24.013 16.143 1078 3HD1 LEU 148 HD12 LEU 148 6.610 22.943 15.011 1079 1HD2 LEU 148 HD22 LEU 148 9.983 22.141 16.830 1080 2HD2 LEU 148 HD21 LEU 148 10.789 23.080 15.574 1081 3HD2 LEU 148 HD23 LEU 148 9.637 23.861 16.654 1082 H ALA 149 HN ALA 149 10.429 18.651 15.667 1083 HA ALA 149 HA ALA 149 10.372 16.729 13.386 1084 1HB ALA 149 HB1 ALA 149 11.234 16.445 16.279 1085 2HB ALA 149 HB3 ALA 149 11.220 15.115 15.122 1086 3HB ALA 149 HB2 ALA 149 12.284 16.498 14.863 1087 H GLN 150 HN GLN 150 8.950 14.918 13.434 1088 HA GLN 150 HA GLN 150 6.310 15.374 14.312 1089 1HB GLN 150 HB2 GLN 150 6.912 13.694 12.602 1090 2HB GLN 150 HB1 GLN 150 7.684 12.707 13.845 1091 1HG GLN 150 HG2 GLN 150 5.569 12.391 14.991 1092 2HG GLN 150 HG1 GLN 150 4.765 13.524 13.904 1093 1HE2 GLN 150 HE22 GLN 150 3.876 10.373 12.348 1094 2HE2 GLN 150 HE21 GLN 150 3.365 11.433 13.571 1095 H ASP 151 HN ASP 151 8.968 13.642 15.916 1096 HA ASP 151 HA ASP 151 7.515 12.572 18.092 1097 1HB ASP 151 HB2 ASP 151 9.909 12.078 17.666 1098 2HB ASP 151 HB1 ASP 151 10.325 13.732 18.116 1099 H ASP 152 HN ASP 152 8.809 15.831 17.550 1100 HA ASP 152 HA ASP 152 8.032 16.805 20.177 1101 1HB ASP 152 HB2 ASP 152 8.777 18.222 17.604 1102 2HB ASP 152 HB1 ASP 152 8.432 19.060 19.117 1103 H ILE 153 HN ILE 153 6.598 16.863 16.919 1104 HA ILE 153 HA ILE 153 4.378 18.552 17.502 1105 HB ILE 153 HB ILE 153 4.530 16.186 15.602 1106 1HG1 ILE 153 HG12 ILE 153 6.268 17.803 15.075 1107 2HG1 ILE 153 HG11 ILE 153 4.988 17.951 13.882 1108 1HG2 ILE 153 HG22 ILE 153 2.575 18.472 15.891 1109 2HG2 ILE 153 HG21 ILE 153 2.742 17.566 14.387 1110 3HG2 ILE 153 HG23 ILE 153 2.235 16.742 15.862 1111 1HD1 ILE 153 HD11 ILE 153 4.074 19.801 15.543 1112 2HD1 ILE 153 HD13 ILE 153 5.749 19.832 16.094 1113 3HD1 ILE 153 HD12 ILE 153 5.365 20.185 14.409 1114 H ASP 154 HN ASP 154 4.604 14.970 17.620 1115 HA ASP 154 HA ASP 154 1.956 14.614 18.665 1116 1HB ASP 154 HB2 ASP 154 4.429 12.870 18.814 1117 2HB ASP 154 HB1 ASP 154 2.849 12.365 19.415 1118 H GLY 155 HN GLY 155 5.108 15.016 20.230 1119 1HA GLY 155 HA2 GLY 155 4.216 14.524 22.905 1120 2HA GLY 155 HA1 GLY 155 5.678 15.399 22.468 1121 H ILE 156 HN ILE 156 4.721 17.633 21.176 1122 HA ILE 156 HA ILE 156 3.766 19.192 23.402 1123 HB ILE 156 HB ILE 156 5.229 20.033 21.501 1124 1HG1 ILE 156 HG12 ILE 156 4.026 22.268 21.418 1125 2HG1 ILE 156 HG11 ILE 156 2.683 21.499 22.259 1126 1HG2 ILE 156 HG22 ILE 156 3.701 19.010 19.731 1127 2HG2 ILE 156 HG21 ILE 156 2.600 20.351 20.041 1128 3HG2 ILE 156 HG23 ILE 156 4.224 20.665 19.432 1129 1HD1 ILE 156 HD13 ILE 156 5.397 21.184 23.484 1130 2HD1 ILE 156 HD12 ILE 156 4.643 22.772 23.578 1131 3HD1 ILE 156 HD11 ILE 156 3.821 21.369 24.255 1132 H GLN 157 HN GLN 157 2.184 17.907 20.485 1133 HA GLN 157 HA GLN 157 -0.312 19.258 20.905 1134 1HB GLN 157 HB2 GLN 157 0.380 16.691 19.456 1135 2HB GLN 157 HB1 GLN 157 -1.238 17.397 19.449 1136 1HG GLN 157 HG2 GLN 157 -0.440 19.405 18.389 1137 2HG GLN 157 HG1 GLN 157 1.241 18.915 18.595 1138 1HE2 GLN 157 HE22 GLN 157 0.097 18.057 15.101 1139 2HE2 GLN 157 HE21 GLN 157 0.119 19.497 16.000 1140 H ALA 158 HN ALA 158 0.918 16.104 22.004 1141 HA ALA 158 HA ALA 158 -1.531 15.213 23.187 1142 1HB ALA 158 HB3 ALA 158 0.656 13.887 22.765 1143 2HB ALA 158 HB2 ALA 158 1.190 14.546 24.312 1144 3HB ALA 158 HB1 ALA 158 -0.251 13.531 24.235 1145 H ILE 159 HN ILE 159 1.152 17.153 24.493 1146 HA ILE 159 HA ILE 159 0.185 17.255 27.188 1147 HB ILE 159 HB ILE 159 1.899 19.175 25.582 1148 1HG1 ILE 159 HG12 ILE 159 2.664 17.228 27.778 1149 2HG1 ILE 159 HG11 ILE 159 2.742 16.826 26.062 1150 1HG2 ILE 159 HG23 ILE 159 1.176 19.145 28.527 1151 2HG2 ILE 159 HG22 ILE 159 2.579 20.005 27.893 1152 3HG2 ILE 159 HG21 ILE 159 0.958 20.470 27.382 1153 1HD1 ILE 159 HD13 ILE 159 4.271 18.734 25.688 1154 2HD1 ILE 159 HD12 ILE 159 4.206 19.117 27.409 1155 3HD1 ILE 159 HD11 ILE 159 4.936 17.605 26.869 1156 H TYR 160 HN TYR 160 -0.201 19.551 24.474 1157 HA TYR 160 HA TYR 160 -2.332 20.955 26.009 1158 1HB TYR 160 HB2 TYR 160 -0.801 21.626 23.486 1159 2HB TYR 160 HB1 TYR 160 -2.195 22.560 24.030 1160 HD1 TYR 160 HD2 TYR 160 -2.149 23.665 26.283 1161 HD2 TYR 160 HD1 TYR 160 1.329 21.837 24.559 1162 HE1 TYR 160 HE2 TYR 160 -0.711 24.889 27.889 1163 HE2 TYR 160 HE1 TYR 160 2.768 23.059 26.169 1164 HH TYR 160 HH TYR 160 1.352 25.160 28.670 1165 H GLY 161 HN GLY 161 -1.980 20.176 22.546 1166 1HA GLY 161 HA2 GLY 161 -3.888 18.291 22.085 1167 2HA GLY 161 HA1 GLY 161 -4.878 19.727 22.359 1168 H ARG 162 HN ARG 162 -5.425 19.168 19.993 1169 HA ARG 162 HA ARG 162 -3.355 19.983 18.043 1170 1HB ARG 162 HB2 ARG 162 -6.229 19.054 17.733 1171 2HB ARG 162 HB1 ARG 162 -5.187 19.494 16.377 1172 1HG ARG 162 HG2 ARG 162 -3.565 17.785 17.073 1173 2HG ARG 162 HG1 ARG 162 -4.605 17.332 18.418 1174 1HD ARG 162 HD2 ARG 162 -6.422 16.843 16.752 1175 2HD ARG 162 HD1 ARG 162 -5.260 17.110 15.459 1176 HE ARG 162 HE ARG 162 -5.591 14.709 17.011 1177 1HH1 ARG 162 HH21 ARG 162 -3.121 16.741 15.714 1178 2HH1 ARG 162 HH22 ARG 162 -1.878 15.549 15.891 1179 1HH2 ARG 162 HH11 ARG 162 -3.991 13.154 17.228 1180 2HH2 ARG 162 HH12 ARG 162 -2.370 13.521 16.737 1181 H SER 163 HN SER 163 -3.552 21.858 16.734 1182 HA SER 163 HA SER 163 -4.909 24.084 18.028 1183 1HB SER 163 HB2 SER 163 -3.574 24.027 15.309 1184 2HB SER 163 HB1 SER 163 -3.911 25.447 16.294 1185 HG SER 163 HG SER 163 -1.842 23.685 16.411 1186 H GLN 164 HN GLN 164 -7.140 23.313 17.866 1187 HA GLN 164 HA GLN 164 -8.350 22.871 15.260 1188 1HB GLN 164 HB2 GLN 164 -9.494 23.338 18.020 1189 2HB GLN 164 HB1 GLN 164 -10.511 23.111 16.598 1190 1HG GLN 164 HG2 GLN 164 -9.574 20.915 16.194 1191 2HG GLN 164 HG1 GLN 164 -8.372 21.145 17.464 1192 1HE2 GLN 164 HE22 GLN 164 -11.356 19.214 18.787 1193 2HE2 GLN 164 HE21 GLN 164 -10.366 18.992 17.427 1194 H ASN 165 HN ASN 165 -9.057 24.411 13.866 1195 HA ASN 165 HA ASN 165 -10.011 27.000 14.848 1196 1HB ASN 165 HB2 ASN 165 -7.432 26.693 13.307 1197 2HB ASN 165 HB1 ASN 165 -8.362 28.188 13.232 1198 1HD2 ASN 165 HD22 ASN 165 -7.867 28.827 16.816 1199 2HD2 ASN 165 HD21 ASN 165 -9.133 28.839 15.685 1200 HA PRO 166 HA PRO 166 -12.550 26.514 11.242 1201 1HB PRO 166 HB2 PRO 166 -12.466 29.299 10.421 1202 2HB PRO 166 HB1 PRO 166 -13.776 28.448 11.251 1203 1HG PRO 166 HG2 PRO 166 -11.925 30.383 12.375 1204 2HG PRO 166 HG1 PRO 166 -13.275 29.572 13.182 1205 1HD PRO 166 HD2 PRO 166 -10.472 29.087 13.599 1206 2HD PRO 166 HD1 PRO 166 -11.837 28.198 14.306 1207 H VAL 167 HN VAL 167 -12.024 25.924 9.144 1208 HA VAL 167 HA VAL 167 -9.308 26.593 8.176 1209 HB VAL 167 HB VAL 167 -11.419 24.727 7.057 1210 1HG1 VAL 167 HG12 VAL 167 -8.548 25.311 6.304 1211 2HG1 VAL 167 HG11 VAL 167 -9.349 23.806 5.855 1212 3HG1 VAL 167 HG13 VAL 167 -9.973 25.346 5.265 1213 1HG2 VAL 167 HG22 VAL 167 -10.478 24.123 9.308 1214 2HG2 VAL 167 HG21 VAL 167 -10.073 22.959 8.043 1215 3HG2 VAL 167 HG23 VAL 167 -8.867 24.128 8.586 1216 H GLN 168 HN GLN 168 -8.996 28.271 6.817 1217 HA GLN 168 HA GLN 168 -11.257 29.565 5.499 1218 1HB GLN 168 HB2 GLN 168 -8.276 30.091 5.496 1219 2HB GLN 168 HB1 GLN 168 -9.418 31.071 4.578 1220 1HG GLN 168 HG2 GLN 168 -8.984 32.129 6.741 1221 2HG GLN 168 HG1 GLN 168 -10.652 31.556 6.686 1222 1HE2 GLN 168 HE22 GLN 168 -8.045 29.238 8.876 1223 2HE2 GLN 168 HE21 GLN 168 -7.519 29.903 7.406 1224 HA PRO 169 HA PRO 169 -10.985 27.340 1.658 1225 1HB PRO 169 HB2 PRO 169 -11.231 29.656 -0.065 1226 2HB PRO 169 HB1 PRO 169 -12.486 28.485 0.365 1227 1HG PRO 169 HG2 PRO 169 -12.190 31.220 1.317 1228 2HG PRO 169 HG1 PRO 169 -13.500 30.079 1.659 1229 1HD PRO 169 HD2 PRO 169 -11.457 30.944 3.480 1230 2HD PRO 169 HD1 PRO 169 -12.678 29.684 3.757 No H/Q in entry = 1230 Start of MODEL 11 1 1H VAL 1 HT3 VAL 1 2.768 17.829 45.063 2 2H VAL 1 HT2 VAL 1 1.764 18.155 43.730 3 3H VAL 1 HT1 VAL 1 2.206 16.556 44.095 4 HA VAL 1 HA VAL 1 4.183 16.706 43.092 5 HB VAL 1 HB VAL 1 2.951 19.246 41.975 6 1HG1 VAL 1 HG12 VAL 1 5.092 17.333 41.051 7 2HG1 VAL 1 HG11 VAL 1 4.138 18.220 39.866 8 3HG1 VAL 1 HG13 VAL 1 5.101 19.095 41.055 9 1HG2 VAL 1 HG23 VAL 1 1.320 17.389 41.961 10 2HG2 VAL 1 HG22 VAL 1 1.859 17.759 40.323 11 3HG2 VAL 1 HG21 VAL 1 2.503 16.349 41.167 12 H LEU 2 HN LEU 2 6.118 18.288 42.498 13 HA LEU 2 HA LEU 2 7.123 19.388 44.938 14 1HB LEU 2 HB2 LEU 2 7.949 20.032 42.093 15 2HB LEU 2 HB1 LEU 2 8.902 20.370 43.534 16 HG LEU 2 HG LEU 2 8.029 17.598 42.667 17 1HD1 LEU 2 HD11 LEU 2 9.646 18.753 41.115 18 2HD1 LEU 2 HD13 LEU 2 10.772 18.877 42.468 19 3HD1 LEU 2 HD12 LEU 2 10.290 17.291 41.862 20 1HD2 LEU 2 HD23 LEU 2 9.697 18.689 44.941 21 2HD2 LEU 2 HD22 LEU 2 8.430 17.463 44.985 22 3HD2 LEU 2 HD21 LEU 2 10.011 17.072 44.315 23 H THR 3 HN THR 3 5.753 20.941 42.056 24 HA THR 3 HA THR 3 5.611 23.552 43.493 25 HB THR 3 HB THR 3 5.170 24.526 41.317 26 HG1 THR 3 HG1 THR 3 4.329 22.036 40.801 27 1HG2 THR 3 HG23 THR 3 7.539 23.814 41.911 28 2HG2 THR 3 HG22 THR 3 7.281 22.412 40.872 29 3HG2 THR 3 HG21 THR 3 7.217 24.037 40.192 30 H GLU 4 HN GLU 4 3.549 24.780 43.171 31 HA GLU 4 HA GLU 4 1.276 23.185 43.967 32 1HB GLU 4 HB2 GLU 4 1.572 25.536 44.681 33 2HB GLU 4 HB1 GLU 4 1.405 26.060 43.005 34 1HG GLU 4 HG2 GLU 4 -0.863 25.223 42.902 35 2HG GLU 4 HG1 GLU 4 -0.711 24.490 44.502 36 H GLY 5 HN GLY 5 -0.483 22.513 42.696 37 1HA GLY 5 HA2 GLY 5 -1.619 21.921 40.725 38 2HA GLY 5 HA1 GLY 5 -1.045 23.453 40.061 39 H ASN 6 HN ASN 6 -0.858 22.018 38.049 40 HA ASN 6 HA ASN 6 1.325 20.084 38.059 41 1HB ASN 6 HB2 ASN 6 -0.378 21.240 35.845 42 2HB ASN 6 HB1 ASN 6 0.876 20.030 35.568 43 1HD2 ASN 6 HD22 ASN 6 -0.997 17.378 37.099 44 2HD2 ASN 6 HD21 ASN 6 0.571 17.876 36.681 45 HA PRO 7 HA PRO 7 4.543 23.062 37.162 46 1HB PRO 7 HB2 PRO 7 6.208 21.364 35.597 47 2HB PRO 7 HB1 PRO 7 6.285 21.570 37.350 48 1HG PRO 7 HG2 PRO 7 5.200 19.296 35.801 49 2HG PRO 7 HG1 PRO 7 5.682 19.357 37.503 50 1HD PRO 7 HD2 PRO 7 3.016 19.314 36.545 51 2HD PRO 7 HD1 PRO 7 3.533 19.727 38.195 52 H ARG 8 HN ARG 8 2.402 23.569 35.607 53 HA ARG 8 HA ARG 8 3.587 24.046 32.909 54 1HB ARG 8 HB2 ARG 8 0.838 22.850 33.386 55 2HB ARG 8 HB1 ARG 8 1.486 23.337 31.821 56 1HG ARG 8 HG2 ARG 8 3.330 21.709 32.097 57 2HG ARG 8 HG1 ARG 8 2.631 21.186 33.626 58 1HD ARG 8 HD2 ARG 8 0.497 20.684 32.359 59 2HD ARG 8 HD1 ARG 8 1.392 20.947 30.867 60 HE ARG 8 HE ARG 8 1.371 18.554 32.434 61 1HH1 ARG 8 HH21 ARG 8 3.606 20.607 30.771 62 2HH1 ARG 8 HH22 ARG 8 4.870 19.423 30.777 63 1HH2 ARG 8 HH11 ARG 8 2.970 17.031 32.422 64 2HH2 ARG 8 HH12 ARG 8 4.506 17.387 31.707 65 H TRP 9 HN TRP 9 2.525 25.806 31.764 66 HA TRP 9 HA TRP 9 1.657 27.931 33.535 67 1HB TRP 9 HB2 TRP 9 1.636 27.749 30.508 68 2HB TRP 9 HB1 TRP 9 1.380 29.224 31.438 69 HD1 TRP 9 HD1 TRP 9 4.075 26.856 30.256 70 HE1 TRP 9 HE1 TRP 9 6.386 27.803 30.895 71 HE3 TRP 9 HE3 TRP 9 2.643 30.706 33.287 72 HZ2 TRP 9 HZ2 TRP 9 7.486 29.923 32.479 73 HZ3 TRP 9 HZ3 TRP 9 4.337 32.172 34.343 74 HH2 TRP 9 HH2 TRP 9 6.752 31.786 33.945 75 H GLU 10 HN GLU 10 -0.435 28.419 34.141 76 HA GLU 10 HA GLU 10 -2.620 26.747 33.101 77 1HB GLU 10 HB2 GLU 10 -2.606 29.033 35.105 78 2HB GLU 10 HB1 GLU 10 -4.033 28.090 34.680 79 1HG GLU 10 HG2 GLU 10 -2.918 26.030 35.443 80 2HG GLU 10 HG1 GLU 10 -1.480 26.960 35.862 81 H GLN 11 HN GLN 11 -1.146 29.687 32.222 82 HA GLN 11 HA GLN 11 -3.594 30.876 31.077 83 1HB GLN 11 HB2 GLN 11 -0.684 31.713 31.057 84 2HB GLN 11 HB1 GLN 11 -1.944 32.593 30.190 85 1HG GLN 11 HG2 GLN 11 -3.179 32.933 32.284 86 2HG GLN 11 HG1 GLN 11 -1.966 32.009 33.167 87 1HE2 GLN 11 HE22 GLN 11 -1.317 35.833 33.086 88 2HE2 GLN 11 HE21 GLN 11 -2.798 35.014 33.215 89 H THR 12 HN THR 12 -4.031 31.045 28.859 90 HA THR 12 HA THR 12 -2.662 29.038 27.139 91 HB THR 12 HB THR 12 -4.550 29.582 25.544 92 HG1 THR 12 HG1 THR 12 -5.065 31.616 26.269 93 1HG2 THR 12 HG23 THR 12 -5.101 28.569 28.335 94 2HG2 THR 12 HG22 THR 12 -6.350 28.572 27.090 95 3HG2 THR 12 HG21 THR 12 -4.873 27.636 26.857 96 H HIS 13 HN HIS 13 -2.500 32.315 27.850 97 HA HIS 13 HA HIS 13 -1.170 32.939 25.229 98 1HB HIS 13 HB2 HIS 13 -2.818 34.751 27.027 99 2HB HIS 13 HB1 HIS 13 -1.813 35.335 25.702 100 HD1 HIS 13 HD1 HIS 13 -4.560 32.724 26.167 101 HD2 HIS 13 HD2 HIS 13 -3.211 35.487 23.358 102 HE1 HIS 13 HE1 HIS 13 -6.183 32.619 24.225 103 H LEU 14 HN LEU 14 0.988 33.390 25.535 104 HA LEU 14 HA LEU 14 1.882 34.207 28.291 105 1HB LEU 14 HB2 LEU 14 3.431 32.717 26.149 106 2HB LEU 14 HB1 LEU 14 4.016 33.130 27.761 107 HG LEU 14 HG LEU 14 1.605 31.382 27.189 108 1HD1 LEU 14 HD13 LEU 14 4.490 30.763 27.812 109 2HD1 LEU 14 HD12 LEU 14 3.213 29.636 28.268 110 3HD1 LEU 14 HD11 LEU 14 3.447 30.062 26.575 111 1HD2 LEU 14 HD21 LEU 14 2.879 32.461 29.697 112 2HD2 LEU 14 HD23 LEU 14 1.172 32.246 29.312 113 3HD2 LEU 14 HD22 LEU 14 2.159 30.852 29.745 114 H THR 15 HN THR 15 3.835 35.600 28.292 115 HA THR 15 HA THR 15 4.071 37.304 25.836 116 HB THR 15 HB THR 15 3.998 39.300 27.184 117 HG1 THR 15 HG1 THR 15 4.557 37.514 29.135 118 1HG2 THR 15 HG21 THR 15 1.820 38.326 26.549 119 2HG2 THR 15 HG23 THR 15 1.800 37.401 28.049 120 3HG2 THR 15 HG22 THR 15 1.714 39.162 28.097 121 H TYR 16 HN TYR 16 6.133 38.491 25.771 122 HA TYR 16 HA TYR 16 8.203 37.532 27.666 123 1HB TYR 16 HB2 TYR 16 9.680 36.745 25.897 124 2HB TYR 16 HB1 TYR 16 8.154 35.868 25.808 125 HD1 TYR 16 HD1 TYR 16 10.288 38.407 24.220 126 HD2 TYR 16 HD2 TYR 16 6.554 36.293 23.982 127 HE1 TYR 16 HE1 TYR 16 10.000 39.182 21.883 128 HE2 TYR 16 HE2 TYR 16 6.264 37.072 21.641 129 HH TYR 16 HH TYR 16 8.177 37.898 19.715 130 H ARG 17 HN ARG 17 10.214 38.760 27.475 131 HA ARG 17 HA ARG 17 10.057 41.254 25.862 132 1HB ARG 17 HB2 ARG 17 8.955 41.797 27.999 133 2HB ARG 17 HB1 ARG 17 10.364 41.216 28.879 134 1HG ARG 17 HG2 ARG 17 11.758 42.952 27.835 135 2HG ARG 17 HG1 ARG 17 10.371 43.521 26.906 136 1HD ARG 17 HD2 ARG 17 9.189 44.051 29.007 137 2HD ARG 17 HD1 ARG 17 10.571 43.472 29.933 138 HE ARG 17 HE ARG 17 11.627 45.406 28.230 139 1HH1 ARG 17 HH21 ARG 17 9.076 45.210 30.545 140 2HH1 ARG 17 HH22 ARG 17 9.220 46.864 31.038 141 1HH2 ARG 17 HH11 ARG 17 11.818 47.563 28.852 142 2HH2 ARG 17 HH12 ARG 17 10.769 48.196 30.076 143 H ILE 18 HN ILE 18 12.075 41.755 25.091 144 HA ILE 18 HA ILE 18 14.386 40.203 26.121 145 HB ILE 18 HB ILE 18 14.189 42.141 23.786 146 1HG1 ILE 18 HG12 ILE 18 14.307 39.109 23.777 147 2HG1 ILE 18 HG11 ILE 18 12.803 40.019 23.657 148 1HG2 ILE 18 HG21 ILE 18 16.359 40.246 24.739 149 2HG2 ILE 18 HG23 ILE 18 16.330 40.932 23.115 150 3HG2 ILE 18 HG22 ILE 18 16.482 41.992 24.516 151 1HD1 ILE 18 HD12 ILE 18 15.145 40.290 21.748 152 2HD1 ILE 18 HD11 ILE 18 13.672 39.375 21.422 153 3HD1 ILE 18 HD13 ILE 18 13.597 41.125 21.621 154 H GLU 19 HN GLU 19 15.627 41.101 27.719 155 HA GLU 19 HA GLU 19 15.276 43.810 28.614 156 1HB GLU 19 HB2 GLU 19 17.407 41.745 29.212 157 2HB GLU 19 HB1 GLU 19 17.346 43.323 29.997 158 1HG GLU 19 HG2 GLU 19 15.070 42.829 30.817 159 2HG GLU 19 HG1 GLU 19 15.137 41.247 30.037 160 H ASN 20 HN ASN 20 17.793 42.281 26.576 161 HA ASN 20 HA ASN 20 18.454 44.926 25.474 162 1HB ASN 20 HB2 ASN 20 20.526 43.351 27.030 163 2HB ASN 20 HB1 ASN 20 20.848 44.800 26.076 164 1HD2 ASN 20 HD22 ASN 20 19.641 45.258 29.843 165 2HD2 ASN 20 HD21 ASN 20 20.265 43.810 29.214 166 H TYR 21 HN TYR 21 19.746 44.788 23.564 167 HA TYR 21 HA TYR 21 19.807 42.063 22.341 168 1HB TYR 21 HB2 TYR 21 19.987 44.852 21.148 169 2HB TYR 21 HB1 TYR 21 20.183 43.373 20.208 170 HD1 TYR 21 HD1 TYR 21 18.303 41.870 19.804 171 HD2 TYR 21 HD2 TYR 21 17.803 45.478 22.084 172 HE1 TYR 21 HE1 TYR 21 15.843 41.657 19.600 173 HE2 TYR 21 HE2 TYR 21 15.338 45.262 21.880 174 HH TYR 21 HH TYR 21 13.819 43.598 19.718 175 H THR 22 HN THR 22 21.793 41.069 22.036 176 HA THR 22 HA THR 22 24.165 42.290 23.080 177 HB THR 22 HB THR 22 24.062 39.916 23.168 178 HG1 THR 22 HG1 THR 22 25.837 39.400 21.564 179 1HG2 THR 22 HG23 THR 22 23.466 40.118 20.209 180 2HG2 THR 22 HG22 THR 22 23.944 38.603 20.977 181 3HG2 THR 22 HG21 THR 22 22.459 39.413 21.476 182 HA PRO 23 HA PRO 23 25.442 44.580 19.465 183 1HB PRO 23 HB2 PRO 23 28.262 44.272 19.821 184 2HB PRO 23 HB1 PRO 23 27.265 45.613 20.402 185 1HG PRO 23 HG2 PRO 23 28.453 43.406 21.944 186 2HG PRO 23 HG1 PRO 23 27.726 44.906 22.538 187 1HD PRO 23 HD2 PRO 23 26.568 42.303 22.672 188 2HD PRO 23 HD1 PRO 23 25.759 43.848 23.019 189 H ASP 24 HN ASP 24 25.886 41.296 19.898 190 HA ASP 24 HA ASP 24 27.694 40.606 17.790 191 1HB ASP 24 HB2 ASP 24 25.342 39.123 18.989 192 2HB ASP 24 HB1 ASP 24 26.445 38.406 17.817 193 H LEU 25 HN LEU 25 24.188 41.155 17.837 194 HA LEU 25 HA LEU 25 24.247 41.490 14.885 195 1HB LEU 25 HB2 LEU 25 22.406 39.658 16.441 196 2HB LEU 25 HB1 LEU 25 22.074 40.163 14.790 197 HG LEU 25 HG LEU 25 24.611 38.732 15.649 198 1HD1 LEU 25 HD12 LEU 25 21.972 37.714 14.595 199 2HD1 LEU 25 HD11 LEU 25 23.465 36.812 14.337 200 3HD1 LEU 25 HD13 LEU 25 22.904 37.138 15.977 201 1HD2 LEU 25 HD21 LEU 25 23.484 39.682 13.013 202 2HD2 LEU 25 HD23 LEU 25 25.135 39.792 13.618 203 3HD2 LEU 25 HD22 LEU 25 24.510 38.251 13.048 204 HA PRO 26 HA PRO 26 21.698 44.958 15.975 205 1HB PRO 26 HB2 PRO 26 19.974 44.940 13.695 206 2HB PRO 26 HB1 PRO 26 21.468 45.869 13.885 207 1HG PRO 26 HG2 PRO 26 21.008 43.462 12.259 208 2HG PRO 26 HG1 PRO 26 22.380 44.579 12.222 209 1HD PRO 26 HD2 PRO 26 22.387 41.945 13.312 210 2HD PRO 26 HD1 PRO 26 23.656 43.174 13.506 211 H ARG 27 HN ARG 27 19.426 45.434 16.569 212 HA ARG 27 HA ARG 27 18.103 43.139 17.697 213 1HB ARG 27 HB2 ARG 27 16.376 44.769 18.378 214 2HB ARG 27 HB1 ARG 27 17.997 45.361 18.744 215 1HG ARG 27 HG2 ARG 27 17.965 46.610 16.570 216 2HG ARG 27 HG1 ARG 27 16.277 46.137 16.372 217 1HD ARG 27 HD2 ARG 27 15.725 47.243 18.518 218 2HD ARG 27 HD1 ARG 27 17.409 47.732 18.694 219 HE ARG 27 HE ARG 27 16.667 48.749 16.216 220 1HH1 ARG 27 HH21 ARG 27 15.486 48.868 19.446 221 2HH1 ARG 27 HH22 ARG 27 14.826 50.463 19.298 222 1HH2 ARG 27 HH11 ARG 27 15.793 50.835 15.980 223 2HH2 ARG 27 HH12 ARG 27 14.975 51.571 17.319 224 H ALA 28 HN ALA 28 17.708 44.995 14.762 225 HA ALA 28 HA ALA 28 15.092 44.192 14.032 226 1HB ALA 28 HB2 ALA 28 16.598 45.914 12.904 227 2HB ALA 28 HB1 ALA 28 17.381 44.557 12.097 228 3HB ALA 28 HB3 ALA 28 15.669 44.876 11.822 229 H ASP 29 HN ASP 29 18.220 42.589 13.468 230 HA ASP 29 HA ASP 29 16.934 40.365 12.049 231 1HB ASP 29 HB2 ASP 29 19.762 40.838 13.010 232 2HB ASP 29 HB1 ASP 29 19.258 39.373 12.169 233 H VAL 30 HN VAL 30 18.223 40.987 15.286 234 HA VAL 30 HA VAL 30 18.118 38.247 16.169 235 HB VAL 30 HB VAL 30 18.100 40.855 17.696 236 1HG1 VAL 30 HG11 VAL 30 18.168 37.997 18.653 237 2HG1 VAL 30 HG13 VAL 30 18.894 39.296 19.602 238 3HG1 VAL 30 HG12 VAL 30 17.171 39.331 19.235 239 1HG2 VAL 30 HG21 VAL 30 20.118 40.248 16.304 240 2HG2 VAL 30 HG23 VAL 30 20.449 40.420 18.028 241 3HG2 VAL 30 HG22 VAL 30 20.303 38.815 17.311 242 H ASP 31 HN ASP 31 15.843 40.988 16.700 243 HA ASP 31 HA ASP 31 13.961 39.524 18.227 244 1HB ASP 31 HB2 ASP 31 12.286 41.173 17.476 245 2HB ASP 31 HB1 ASP 31 13.797 41.971 17.918 246 H HIS 32 HN HIS 32 14.307 39.808 14.698 247 HA HIS 32 HA HIS 32 11.932 38.420 13.979 248 1HB HIS 32 HB2 HIS 32 13.317 39.643 12.347 249 2HB HIS 32 HB1 HIS 32 14.600 38.447 12.543 250 HD1 HIS 32 HD1 HIS 32 10.865 38.377 11.775 251 HD2 HIS 32 HD2 HIS 32 14.383 36.456 10.631 252 HE1 HIS 32 HE1 HIS 32 10.215 36.699 9.996 253 H ALA 33 HN ALA 33 15.219 37.171 14.606 254 HA ALA 33 HA ALA 33 14.687 34.454 13.995 255 1HB ALA 33 HB3 ALA 33 16.572 35.721 15.990 256 2HB ALA 33 HB2 ALA 33 16.543 33.987 15.674 257 3HB ALA 33 HB1 ALA 33 16.960 35.113 14.381 258 H ILE 34 HN ILE 34 14.248 36.284 17.008 259 HA ILE 34 HA ILE 34 13.374 34.025 18.588 260 HB ILE 34 HB ILE 34 12.800 36.991 18.950 261 1HG1 ILE 34 HG12 ILE 34 15.194 36.690 18.964 262 2HG1 ILE 34 HG11 ILE 34 14.678 36.849 20.639 263 1HG2 ILE 34 HG23 ILE 34 12.500 34.606 20.779 264 2HG2 ILE 34 HG22 ILE 34 12.607 36.255 21.396 265 3HG2 ILE 34 HG21 ILE 34 11.283 35.800 20.323 266 1HD1 ILE 34 HD11 ILE 34 14.561 34.248 20.611 267 2HD1 ILE 34 HD13 ILE 34 15.574 34.377 19.171 268 3HD1 ILE 34 HD12 ILE 34 16.145 35.017 20.710 269 H GLU 35 HN GLU 35 11.624 36.604 16.849 270 HA GLU 35 HA GLU 35 9.019 35.747 17.598 271 1HB GLU 35 HB2 GLU 35 9.465 37.918 16.523 272 2HB GLU 35 HB1 GLU 35 9.910 37.096 15.028 273 1HG GLU 35 HG2 GLU 35 7.637 36.154 14.860 274 2HG GLU 35 HG1 GLU 35 7.193 36.949 16.371 275 H LYS 36 HN LYS 36 11.111 34.761 14.908 276 HA LYS 36 HA LYS 36 9.213 33.109 13.577 277 1HB LYS 36 HB2 LYS 36 11.354 33.791 12.572 278 2HB LYS 36 HB1 LYS 36 12.225 32.821 13.754 279 1HG LYS 36 HG2 LYS 36 11.157 30.782 12.890 280 2HG LYS 36 HG1 LYS 36 10.244 31.745 11.726 281 1HD LYS 36 HD2 LYS 36 12.384 32.541 10.740 282 2HD LYS 36 HD1 LYS 36 13.266 31.507 11.863 283 1HE LYS 36 HE2 LYS 36 11.214 30.500 9.870 284 2HE LYS 36 HE1 LYS 36 12.959 30.461 9.611 285 1HZ LYS 36 HZ1 LYS 36 11.515 29.146 11.847 286 2HZ LYS 36 HZ3 LYS 36 12.147 28.360 10.482 287 3HZ LYS 36 HZ2 LYS 36 13.193 29.107 11.593 288 H ALA 37 HN ALA 37 11.456 32.382 16.255 289 HA ALA 37 HA ALA 37 10.954 29.570 16.351 290 1HB ALA 37 HB1 ALA 37 12.773 30.911 17.558 291 2HB ALA 37 HB3 ALA 37 11.541 31.304 18.757 292 3HB ALA 37 HB2 ALA 37 12.007 29.625 18.488 293 H PHE 38 HN PHE 38 9.406 32.239 18.189 294 HA PHE 38 HA PHE 38 7.600 30.575 19.629 295 1HB PHE 38 HB2 PHE 38 7.504 33.470 18.781 296 2HB PHE 38 HB1 PHE 38 6.150 32.737 19.638 297 HD1 PHE 38 HD2 PHE 38 6.726 31.430 21.838 298 HD2 PHE 38 HD1 PHE 38 9.323 34.315 19.998 299 HE1 PHE 38 HE2 PHE 38 7.936 31.715 23.986 300 HE2 PHE 38 HE1 PHE 38 10.530 34.593 22.147 301 HZ PHE 38 HZ PHE 38 9.838 33.297 24.136 302 H GLN 39 HN GLN 39 7.332 32.081 16.419 303 HA GLN 39 HA GLN 39 4.618 31.377 15.927 304 1HB GLN 39 HB2 GLN 39 6.936 31.731 14.008 305 2HB GLN 39 HB1 GLN 39 5.276 31.472 13.484 306 1HG GLN 39 HG2 GLN 39 4.551 33.502 14.634 307 2HG GLN 39 HG1 GLN 39 6.172 33.751 15.277 308 1HE2 GLN 39 HE22 GLN 39 5.763 35.790 12.127 309 2HE2 GLN 39 HE21 GLN 39 4.923 35.725 13.602 310 H LEU 40 HN LEU 40 7.630 29.494 15.419 311 HA LEU 40 HA LEU 40 6.418 27.321 14.028 312 1HB LEU 40 HB2 LEU 40 8.788 27.349 15.916 313 2HB LEU 40 HB1 LEU 40 8.308 25.932 14.988 314 HG LEU 40 HG LEU 40 9.039 28.623 13.793 315 1HD1 LEU 40 HD12 LEU 40 10.572 26.034 14.139 316 2HD1 LEU 40 HD11 LEU 40 11.053 27.282 12.989 317 3HD1 LEU 40 HD13 LEU 40 11.018 27.638 14.715 318 1HD2 LEU 40 HD23 LEU 40 8.051 26.011 12.665 319 2HD2 LEU 40 HD22 LEU 40 7.707 27.659 12.139 320 3HD2 LEU 40 HD21 LEU 40 9.248 26.913 11.733 321 H TRP 41 HN TRP 41 6.885 27.802 17.534 322 HA TRP 41 HA TRP 41 5.631 25.285 18.230 323 1HB TRP 41 HB2 TRP 41 6.177 27.792 19.839 324 2HB TRP 41 HB1 TRP 41 5.562 26.292 20.534 325 HD1 TRP 41 HD1 TRP 41 8.694 28.025 19.888 326 HE1 TRP 41 HE1 TRP 41 10.699 26.412 20.013 327 HE3 TRP 41 HE3 TRP 41 6.237 23.550 19.731 328 HZ2 TRP 41 HZ2 TRP 41 11.197 23.599 20.036 329 HZ3 TRP 41 HZ3 TRP 41 7.502 21.419 19.805 330 HH2 TRP 41 HH2 TRP 41 9.978 21.438 19.958 331 H SER 42 HN SER 42 4.466 28.655 18.111 332 HA SER 42 HA SER 42 1.834 28.089 19.130 333 1HB SER 42 HB2 SER 42 2.785 30.369 19.091 334 2HB SER 42 HB1 SER 42 2.758 30.353 17.330 335 HG SER 42 HG SER 42 0.408 29.751 18.730 336 H ASN 43 HN ASN 43 3.242 27.905 15.914 337 HA ASN 43 HA ASN 43 0.887 27.931 14.347 338 1HB ASN 43 HB2 ASN 43 3.489 26.427 13.995 339 2HB ASN 43 HB1 ASN 43 2.217 26.431 12.775 340 1HD2 ASN 43 HD22 ASN 43 4.720 29.261 12.248 341 2HD2 ASN 43 HD21 ASN 43 4.952 27.612 12.574 342 H VAL 44 HN VAL 44 2.399 25.214 16.104 343 HA VAL 44 HA VAL 44 0.132 23.454 15.281 344 HB VAL 44 HB VAL 44 1.514 21.606 15.930 345 1HG1 VAL 44 HG13 VAL 44 2.064 22.736 13.780 346 2HG1 VAL 44 HG12 VAL 44 3.274 23.702 14.623 347 3HG1 VAL 44 HG11 VAL 44 3.469 21.953 14.504 348 1HG2 VAL 44 HG21 VAL 44 3.133 23.745 17.323 349 2HG2 VAL 44 HG23 VAL 44 2.508 22.231 17.977 350 3HG2 VAL 44 HG22 VAL 44 3.882 22.212 16.874 351 H THR 45 HN THR 45 0.331 25.628 17.581 352 HA THR 45 HA THR 45 -1.103 23.910 19.531 353 HB THR 45 HB THR 45 0.098 24.823 21.438 354 HG1 THR 45 HG1 THR 45 1.917 26.078 19.713 355 1HG2 THR 45 HG22 THR 45 1.046 22.847 20.095 356 2HG2 THR 45 HG21 THR 45 2.226 23.993 19.469 357 3HG2 THR 45 HG23 THR 45 2.147 23.667 21.200 358 HA PRO 46 HA PRO 46 -3.705 27.538 19.514 359 1HB PRO 46 HB2 PRO 46 -4.907 27.196 22.040 360 2HB PRO 46 HB1 PRO 46 -5.477 26.465 20.532 361 1HG PRO 46 HG2 PRO 46 -4.037 25.189 22.789 362 2HG PRO 46 HG1 PRO 46 -5.043 24.436 21.542 363 1HD PRO 46 HD2 PRO 46 -2.214 24.358 21.639 364 2HD PRO 46 HD1 PRO 46 -3.225 23.954 20.232 365 H LEU 47 HN LEU 47 -1.020 27.061 21.359 366 HA LEU 47 HA LEU 47 -1.297 29.141 23.362 367 1HB LEU 47 HB2 LEU 47 1.213 27.893 22.185 368 2HB LEU 47 HB1 LEU 47 1.157 28.904 23.626 369 HG LEU 47 HG LEU 47 -0.283 26.256 23.299 370 1HD1 LEU 47 HD13 LEU 47 2.248 27.061 24.759 371 2HD1 LEU 47 HD12 LEU 47 1.397 25.549 25.067 372 3HD1 LEU 47 HD11 LEU 47 2.090 25.861 23.475 373 1HD2 LEU 47 HD23 LEU 47 -0.200 28.356 25.463 374 2HD2 LEU 47 HD22 LEU 47 -1.572 27.418 24.875 375 3HD2 LEU 47 HD21 LEU 47 -0.376 26.661 25.921 376 H THR 48 HN THR 48 -0.390 31.250 23.300 377 HA THR 48 HA THR 48 0.498 32.228 20.610 378 HB THR 48 HB THR 48 -0.984 34.184 20.865 379 HG1 THR 48 HG1 THR 48 -0.981 33.647 23.311 380 1HG2 THR 48 HG23 THR 48 -1.782 32.102 19.716 381 2HG2 THR 48 HG22 THR 48 -2.509 31.593 21.240 382 3HG2 THR 48 HG21 THR 48 -3.089 33.046 20.429 383 H PHE 49 HN PHE 49 1.979 33.958 20.729 384 HA PHE 49 HA PHE 49 2.890 34.727 23.487 385 1HB PHE 49 HB2 PHE 49 4.590 34.211 21.026 386 2HB PHE 49 HB1 PHE 49 5.186 34.731 22.604 387 HD1 PHE 49 HD1 PHE 49 3.646 31.948 20.718 388 HD2 PHE 49 HD2 PHE 49 5.283 33.199 24.487 389 HE1 PHE 49 HE1 PHE 49 3.700 29.585 21.481 390 HE2 PHE 49 HE2 PHE 49 5.336 30.841 25.247 391 HZ PHE 49 HZ PHE 49 4.548 29.035 23.743 392 H THR 50 HN THR 50 2.909 36.884 23.808 393 HA THR 50 HA THR 50 2.904 38.704 21.422 394 HB THR 50 HB THR 50 1.458 39.100 24.063 395 HG1 THR 50 HG1 THR 50 -0.182 39.153 22.049 396 1HG2 THR 50 HG23 THR 50 1.577 40.786 21.542 397 2HG2 THR 50 HG22 THR 50 0.495 41.084 22.901 398 3HG2 THR 50 HG21 THR 50 2.239 41.222 23.118 399 H LYS 51 HN LYS 51 4.447 40.209 21.414 400 HA LYS 51 HA LYS 51 6.466 40.240 23.503 401 1HB LYS 51 HB2 LYS 51 6.931 40.598 21.054 402 2HB LYS 51 HB1 LYS 51 6.108 42.154 21.179 403 1HG LYS 51 HG2 LYS 51 7.710 42.863 22.920 404 2HG LYS 51 HG1 LYS 51 8.535 41.311 22.792 405 1HD LYS 51 HD2 LYS 51 9.054 41.782 20.422 406 2HD LYS 51 HD1 LYS 51 8.243 43.343 20.559 407 1HE LYS 51 HE2 LYS 51 10.625 42.480 22.230 408 2HE LYS 51 HE1 LYS 51 10.720 43.532 20.821 409 1HZ LYS 51 HZ3 LYS 51 8.889 44.832 22.174 410 2HZ LYS 51 HZ2 LYS 51 9.659 44.079 23.489 411 3HZ LYS 51 HZ1 LYS 51 10.545 45.085 22.445 412 H VAL 52 HN VAL 52 6.913 41.997 24.940 413 HA VAL 52 HA VAL 52 4.799 44.127 25.112 414 HB VAL 52 HB VAL 52 4.887 43.953 27.568 415 1HG1 VAL 52 HG12 VAL 52 4.238 41.427 26.033 416 2HG1 VAL 52 HG11 VAL 52 3.843 41.632 27.739 417 3HG1 VAL 52 HG13 VAL 52 3.127 42.700 26.535 418 1HG2 VAL 52 HG22 VAL 52 6.841 41.741 26.923 419 2HG2 VAL 52 HG21 VAL 52 7.065 43.120 27.999 420 3HG2 VAL 52 HG23 VAL 52 5.988 41.803 28.465 421 H SER 53 HN SER 53 5.640 46.136 25.217 422 HA SER 53 HA SER 53 8.581 46.430 25.375 423 1HB SER 53 HB2 SER 53 7.028 47.605 23.673 424 2HB SER 53 HB1 SER 53 6.592 48.671 25.009 425 HG SER 53 HG SER 53 9.099 48.674 25.192 426 H GLU 54 HN GLU 54 6.072 46.436 27.590 427 HA GLU 54 HA GLU 54 7.774 47.745 29.604 428 1HB GLU 54 HB2 GLU 54 6.369 49.572 28.460 429 2HB GLU 54 HB1 GLU 54 4.965 48.791 29.183 430 1HG GLU 54 HG2 GLU 54 5.956 49.070 31.426 431 2HG GLU 54 HG1 GLU 54 7.361 49.855 30.703 432 H GLY 55 HN GLY 55 6.895 47.365 31.789 433 1HA GLY 55 HA2 GLY 55 5.540 46.228 33.375 434 2HA GLY 55 HA1 GLY 55 4.573 45.579 32.050 435 H GLN 56 HN GLN 56 5.304 43.845 34.051 436 HA GLN 56 HA GLN 56 7.805 42.484 33.384 437 1HB GLN 56 HB2 GLN 56 5.501 41.840 35.232 438 2HB GLN 56 HB1 GLN 56 6.854 40.733 34.992 439 1HG GLN 56 HG2 GLN 56 8.427 42.498 35.687 440 2HG GLN 56 HG1 GLN 56 7.077 43.608 35.930 441 1HE2 GLN 56 HE22 GLN 56 5.998 40.889 38.498 442 2HE2 GLN 56 HE21 GLN 56 5.525 41.031 36.875 443 H ALA 57 HN ALA 57 7.971 40.400 32.414 444 HA ALA 57 HA ALA 57 5.571 39.583 30.799 445 1HB ALA 57 HB1 ALA 57 7.714 40.561 29.636 446 2HB ALA 57 HB3 ALA 57 8.394 38.964 29.953 447 3HB ALA 57 HB2 ALA 57 6.941 39.126 28.965 448 H ASP 58 HN ASP 58 5.204 37.352 30.578 449 HA ASP 58 HA ASP 58 5.795 35.748 32.841 450 1HB ASP 58 HB2 ASP 58 4.893 35.058 30.038 451 2HB ASP 58 HB1 ASP 58 5.060 33.840 31.304 452 H ILE 59 HN ILE 59 7.364 35.928 29.650 453 HA ILE 59 HA ILE 59 9.564 34.172 30.708 454 HB ILE 59 HB ILE 59 8.722 34.714 27.839 455 1HG1 ILE 59 HG12 ILE 59 8.513 32.160 29.464 456 2HG1 ILE 59 HG11 ILE 59 7.173 33.288 29.261 457 1HG2 ILE 59 HG21 ILE 59 10.887 33.003 29.082 458 2HG2 ILE 59 HG23 ILE 59 10.312 32.763 27.432 459 3HG2 ILE 59 HG22 ILE 59 11.079 34.285 27.887 460 1HD1 ILE 59 HD11 ILE 59 8.659 31.932 26.991 461 2HD1 ILE 59 HD13 ILE 59 7.086 31.431 27.611 462 3HD1 ILE 59 HD12 ILE 59 7.266 33.001 26.830 463 H MET 60 HN MET 60 11.364 35.296 31.207 464 HA MET 60 HA MET 60 11.839 37.960 29.940 465 1HB MET 60 HB2 MET 60 13.153 36.707 32.379 466 2HB MET 60 HB1 MET 60 13.359 38.367 31.822 467 1HG MET 60 HG2 MET 60 10.740 37.126 32.720 468 2HG MET 60 HG1 MET 60 11.713 38.247 33.669 469 1HE MET 60 HE1 MET 60 12.425 40.366 33.046 470 2HE MET 60 HE3 MET 60 12.526 40.698 31.311 471 3HE MET 60 HE2 MET 60 11.375 41.574 32.314 472 H ILE 61 HN ILE 61 13.382 38.116 28.400 473 HA ILE 61 HA ILE 61 15.430 35.926 28.190 474 HB ILE 61 HB ILE 61 14.387 37.804 26.041 475 1HG1 ILE 61 HG12 ILE 61 13.977 34.811 26.311 476 2HG1 ILE 61 HG11 ILE 61 12.786 35.995 26.852 477 1HG2 ILE 61 HG23 ILE 61 16.374 35.521 26.031 478 2HG2 ILE 61 HG22 ILE 61 15.654 36.179 24.561 479 3HG2 ILE 61 HG21 ILE 61 16.668 37.201 25.580 480 1HD1 ILE 61 HD13 ILE 61 12.697 36.938 24.564 481 2HD1 ILE 61 HD12 ILE 61 13.866 35.730 24.029 482 3HD1 ILE 61 HD11 ILE 61 12.263 35.229 24.570 483 H SER 62 HN SER 62 17.541 36.556 28.529 484 HA SER 62 HA SER 62 18.298 39.387 28.033 485 1HB SER 62 HB2 SER 62 19.199 39.730 30.245 486 2HB SER 62 HB1 SER 62 17.526 39.211 30.431 487 HG SER 62 HG SER 62 19.413 37.191 30.301 488 H PHE 63 HN PHE 63 20.685 39.687 28.205 489 HA PHE 63 HA PHE 63 22.183 37.172 27.523 490 1HB PHE 63 HB2 PHE 63 22.462 40.024 26.545 491 2HB PHE 63 HB1 PHE 63 23.707 38.807 26.289 492 HD1 PHE 63 HD1 PHE 63 20.287 39.866 25.420 493 HD2 PHE 63 HD2 PHE 63 23.337 36.902 24.823 494 HE1 PHE 63 HE1 PHE 63 19.047 38.984 23.452 495 HE2 PHE 63 HE2 PHE 63 22.105 36.024 22.861 496 HZ PHE 63 HZ PHE 63 19.961 37.064 22.177 497 H VAL 64 HN VAL 64 24.013 36.760 28.749 498 HA VAL 64 HA VAL 64 24.936 38.913 30.630 499 HB VAL 64 HB VAL 64 25.237 37.129 32.329 500 1HG1 VAL 64 HG12 VAL 64 22.466 37.499 31.160 501 2HG1 VAL 64 HG11 VAL 64 22.777 36.828 32.761 502 3HG1 VAL 64 HG13 VAL 64 23.229 38.495 32.400 503 1HG2 VAL 64 HG23 VAL 64 23.745 35.461 30.280 504 2HG2 VAL 64 HG22 VAL 64 25.418 35.220 30.782 505 3HG2 VAL 64 HG21 VAL 64 24.104 34.956 31.930 506 H ARG 65 HN ARG 65 27.101 38.463 31.545 507 HA ARG 65 HA ARG 65 28.891 37.003 29.625 508 1HB ARG 65 HB2 ARG 65 29.211 39.709 30.938 509 2HB ARG 65 HB1 ARG 65 30.588 38.818 30.292 510 1HG ARG 65 HG2 ARG 65 29.530 38.750 28.083 511 2HG ARG 65 HG1 ARG 65 28.133 39.616 28.712 512 1HD ARG 65 HD2 ARG 65 30.967 40.659 28.750 513 2HD ARG 65 HD1 ARG 65 29.766 41.126 27.553 514 HE ARG 65 HE ARG 65 30.079 42.201 30.213 515 1HH1 ARG 65 HH21 ARG 65 27.599 41.203 28.004 516 2HH1 ARG 65 HH22 ARG 65 26.348 42.051 28.852 517 1HH2 ARG 65 HH11 ARG 65 28.449 43.292 31.296 518 2HH2 ARG 65 HH12 ARG 65 26.823 43.212 30.705 519 H GLY 66 HN GLY 66 30.370 35.679 30.569 520 1HA GLY 66 HA2 GLY 66 31.299 34.355 32.273 521 2HA GLY 66 HA1 GLY 66 31.713 35.919 32.971 522 H ASP 67 HN ASP 67 31.339 35.382 35.118 523 HA ASP 67 HA ASP 67 28.974 33.985 36.011 524 1HB ASP 67 HB2 ASP 67 31.077 34.025 37.326 525 2HB ASP 67 HB1 ASP 67 30.865 35.755 37.594 526 H HIS 68 HN HIS 68 26.987 34.798 36.460 527 HA HIS 68 HA HIS 68 26.673 37.763 36.757 528 1HB HIS 68 HB2 HIS 68 24.474 37.462 35.495 529 2HB HIS 68 HB1 HIS 68 25.944 37.353 34.528 530 HD1 HIS 68 HD1 HIS 68 26.898 34.664 34.551 531 HD2 HIS 68 HD2 HIS 68 22.803 35.360 34.892 532 HE1 HIS 68 HE1 HIS 68 25.751 32.492 33.942 533 H ARG 69 HN ARG 69 26.877 36.243 38.959 534 HA ARG 69 HA ARG 69 25.784 35.648 40.932 535 1HB ARG 69 HB2 ARG 69 23.604 37.370 39.713 536 2HB ARG 69 HB1 ARG 69 23.638 36.816 41.383 537 1HG ARG 69 HG2 ARG 69 25.761 37.977 41.758 538 2HG ARG 69 HG1 ARG 69 25.782 38.514 40.083 539 1HD ARG 69 HD2 ARG 69 23.634 39.188 42.105 540 2HD ARG 69 HD1 ARG 69 24.931 40.277 41.632 541 HE ARG 69 HE ARG 69 22.442 39.810 40.237 542 1HH1 ARG 69 HH21 ARG 69 25.813 40.257 39.641 543 2HH1 ARG 69 HH22 ARG 69 25.585 40.691 37.980 544 1HH2 ARG 69 HH11 ARG 69 22.137 40.381 38.092 545 2HH2 ARG 69 HH12 ARG 69 23.509 40.765 37.107 546 H ASP 70 HN ASP 70 25.679 33.675 38.988 547 HA ASP 70 HA ASP 70 22.980 32.473 39.521 548 1HB ASP 70 HB2 ASP 70 24.532 32.498 36.924 549 2HB ASP 70 HB1 ASP 70 23.312 31.270 37.269 550 H ASN 71 HN ASN 71 23.106 30.009 39.197 551 HA ASN 71 HA ASN 71 25.459 29.062 40.720 552 1HB ASN 71 HB2 ASN 71 23.002 28.411 41.193 553 2HB ASN 71 HB1 ASN 71 23.138 27.367 39.780 554 1HD2 ASN 71 HD22 ASN 71 25.542 26.471 43.015 555 2HD2 ASN 71 HD21 ASN 71 25.144 28.095 42.721 556 H SER 72 HN SER 72 25.066 29.678 37.603 557 HA SER 72 HA SER 72 26.767 27.368 36.753 558 1HB SER 72 HB2 SER 72 24.381 27.004 36.045 559 2HB SER 72 HB1 SER 72 24.485 28.498 35.117 560 HG SER 72 HG SER 72 26.268 27.548 34.005 561 HA PRO 73 HA PRO 73 28.349 31.514 35.393 562 1HB PRO 73 HB2 PRO 73 30.966 30.898 36.383 563 2HB PRO 73 HB1 PRO 73 29.803 32.032 37.089 564 1HG PRO 73 HG2 PRO 73 30.613 29.443 38.130 565 2HG PRO 73 HG1 PRO 73 29.496 30.606 38.857 566 1HD PRO 73 HD2 PRO 73 28.853 28.101 37.509 567 2HD PRO 73 HD1 PRO 73 27.745 29.213 38.339 568 H PHE 74 HN PHE 74 29.348 31.688 33.379 569 HA PHE 74 HA PHE 74 29.988 29.245 31.937 570 1HB PHE 74 HB2 PHE 74 30.387 32.149 31.163 571 2HB PHE 74 HB1 PHE 74 30.512 30.773 30.068 572 HD1 PHE 74 HD1 PHE 74 28.555 29.506 29.402 573 HD2 PHE 74 HD2 PHE 74 28.220 32.877 32.038 574 HE1 PHE 74 HE1 PHE 74 26.108 29.553 29.026 575 HE2 PHE 74 HE2 PHE 74 25.769 32.928 31.660 576 HZ PHE 74 HZ PHE 74 24.713 31.264 30.157 577 H ASP 75 HN ASP 75 32.063 28.639 31.113 578 HA ASP 75 HA ASP 75 34.417 29.999 32.396 579 1HB ASP 75 HB2 ASP 75 33.821 27.807 33.478 580 2HB ASP 75 HB1 ASP 75 34.104 27.021 31.923 581 H GLY 76 HN GLY 76 34.327 31.092 30.180 582 1HA GLY 76 HA2 GLY 76 35.688 31.369 28.252 583 2HA GLY 76 HA1 GLY 76 36.183 29.682 28.374 584 HA PRO 77 HA PRO 77 32.928 30.324 25.010 585 1HB PRO 77 HB2 PRO 77 34.667 29.228 23.015 586 2HB PRO 77 HB1 PRO 77 34.176 30.919 23.183 587 1HG PRO 77 HG2 PRO 77 36.780 29.726 23.780 588 2HG PRO 77 HG1 PRO 77 36.335 31.439 23.752 589 1HD PRO 77 HD2 PRO 77 36.824 29.816 26.079 590 2HD PRO 77 HD1 PRO 77 36.267 31.500 26.038 591 H GLY 78 HN GLY 78 34.551 27.970 26.656 592 1HA GLY 78 HA2 GLY 78 33.373 25.679 25.149 593 2HA GLY 78 HA1 GLY 78 34.574 25.560 26.434 594 H GLY 79 HN GLY 79 32.620 23.891 26.851 595 1HA GLY 79 HA2 GLY 79 31.171 23.281 28.605 596 2HA GLY 79 HA1 GLY 79 31.296 24.927 29.226 597 H ASN 80 HN ASN 80 28.990 24.929 29.566 598 HA ASN 80 HA ASN 80 27.151 24.519 27.375 599 1HB ASN 80 HB2 ASN 80 26.839 25.855 30.074 600 2HB ASN 80 HB1 ASN 80 25.509 25.654 28.931 601 1HD2 ASN 80 HD22 ASN 80 25.669 22.673 31.267 602 2HD2 ASN 80 HD21 ASN 80 25.593 24.345 31.547 603 H LEU 81 HN LEU 81 26.095 26.061 26.115 604 HA LEU 81 HA LEU 81 27.515 28.669 25.860 605 1HB LEU 81 HB2 LEU 81 25.386 27.513 24.043 606 2HB LEU 81 HB1 LEU 81 26.529 28.804 23.677 607 HG LEU 81 HG LEU 81 27.227 25.902 24.207 608 1HD1 LEU 81 HD11 LEU 81 27.116 27.609 21.709 609 2HD1 LEU 81 HD13 LEU 81 27.994 26.080 21.782 610 3HD1 LEU 81 HD12 LEU 81 26.248 26.108 22.034 611 1HD2 LEU 81 HD22 LEU 81 28.902 28.371 23.714 612 2HD2 LEU 81 HD21 LEU 81 29.072 27.170 24.993 613 3HD2 LEU 81 HD23 LEU 81 29.508 26.758 23.337 614 H ALA 82 HN ALA 82 24.623 27.329 27.091 615 HA ALA 82 HA ALA 82 23.645 29.865 28.011 616 1HB ALA 82 HB1 ALA 82 22.297 28.652 25.578 617 2HB ALA 82 HB3 ALA 82 21.511 29.833 26.625 618 3HB ALA 82 HB2 ALA 82 22.964 30.278 25.732 619 H HIS 83 HN HIS 83 21.346 29.531 28.937 620 HA HIS 83 HA HIS 83 20.500 26.784 29.378 621 1HB HIS 83 HB2 HIS 83 20.902 26.832 31.854 622 2HB HIS 83 HB1 HIS 83 22.389 26.793 30.909 623 HD1 HIS 83 HD1 HIS 83 24.071 28.512 31.523 624 HD2 HIS 83 HD2 HIS 83 20.222 29.697 32.598 625 HE1 HIS 83 HE1 HIS 83 24.315 30.724 32.731 626 H ALA 84 HN ALA 84 18.681 26.811 31.139 627 HA ALA 84 HA ALA 84 17.356 29.453 31.397 628 1HB ALA 84 HB3 ALA 84 16.640 28.383 29.197 629 2HB ALA 84 HB2 ALA 84 15.896 27.105 30.157 630 3HB ALA 84 HB1 ALA 84 15.329 28.768 30.311 631 H PHE 85 HN PHE 85 15.466 29.312 32.889 632 HA PHE 85 HA PHE 85 15.985 27.287 35.000 633 1HB PHE 85 HB2 PHE 85 14.306 29.810 34.951 634 2HB PHE 85 HB1 PHE 85 14.412 28.727 36.339 635 HD1 PHE 85 HD1 PHE 85 16.487 28.481 37.598 636 HD2 PHE 85 HD2 PHE 85 16.204 31.202 34.281 637 HE1 PHE 85 HE1 PHE 85 18.588 29.579 38.320 638 HE2 PHE 85 HE2 PHE 85 18.306 32.298 35.003 639 HZ PHE 85 HZ PHE 85 19.500 31.488 37.022 640 H GLN 86 HN GLN 86 14.136 26.144 35.988 641 HA GLN 86 HA GLN 86 12.448 24.959 34.024 642 1HB GLN 86 HB2 GLN 86 12.363 24.941 37.044 643 2HB GLN 86 HB1 GLN 86 11.253 23.991 36.059 644 1HG GLN 86 HG2 GLN 86 14.250 23.831 35.719 645 2HG GLN 86 HG1 GLN 86 13.371 22.792 36.842 646 1HE2 GLN 86 HE22 GLN 86 13.493 21.688 33.035 647 2HE2 GLN 86 HE21 GLN 86 14.586 22.763 33.763 648 HA PRO 87 HA PRO 87 9.092 27.849 33.727 649 1HB PRO 87 HB2 PRO 87 7.025 25.804 34.008 650 2HB PRO 87 HB1 PRO 87 7.524 26.665 32.545 651 1HG PRO 87 HG2 PRO 87 8.121 23.922 33.281 652 2HG PRO 87 HG1 PRO 87 8.581 24.773 31.798 653 1HD PRO 87 HD2 PRO 87 10.322 23.995 33.930 654 2HD PRO 87 HD1 PRO 87 10.732 25.011 32.532 655 H GLY 88 HN GLY 88 8.991 29.036 35.640 656 1HA GLY 88 HA2 GLY 88 7.130 28.128 37.685 657 2HA GLY 88 HA1 GLY 88 8.797 28.175 38.254 658 HA PRO 89 HA PRO 89 6.625 32.403 38.444 659 1HB PRO 89 HB2 PRO 89 6.909 32.499 41.293 660 2HB PRO 89 HB1 PRO 89 5.405 32.306 40.381 661 1HG PRO 89 HG2 PRO 89 6.877 30.281 41.914 662 2HG PRO 89 HG1 PRO 89 5.250 30.177 41.226 663 1HD PRO 89 HD2 PRO 89 7.597 28.874 40.245 664 2HD PRO 89 HD1 PRO 89 6.012 28.962 39.446 665 H GLY 90 HN GLY 90 7.725 34.365 39.596 666 1HA GLY 90 HA2 GLY 90 9.649 35.646 39.935 667 2HA GLY 90 HA1 GLY 90 10.367 34.196 40.635 668 H ILE 91 HN ILE 91 12.301 33.915 39.665 669 HA ILE 91 HA ILE 91 12.858 34.793 36.956 670 HB ILE 91 HB ILE 91 14.544 34.787 38.771 671 1HG1 ILE 91 HG12 ILE 91 15.440 32.821 36.652 672 2HG1 ILE 91 HG11 ILE 91 15.113 34.509 36.256 673 1HG2 ILE 91 HG22 ILE 91 13.625 32.533 39.671 674 2HG2 ILE 91 HG21 ILE 91 14.679 31.787 38.471 675 3HG2 ILE 91 HG23 ILE 91 15.367 32.799 39.740 676 1HD1 ILE 91 HD13 ILE 91 17.005 33.648 38.465 677 2HD1 ILE 91 HD12 ILE 91 17.531 34.028 36.826 678 3HD1 ILE 91 HD11 ILE 91 16.785 35.276 37.822 679 H GLY 92 HN GLY 92 11.303 32.039 38.119 680 1HA GLY 92 HA2 GLY 92 12.388 29.959 36.538 681 2HA GLY 92 HA1 GLY 92 10.697 30.043 37.029 682 H GLY 93 HN GLY 93 12.138 29.377 34.382 683 1HA GLY 93 HA2 GLY 93 11.234 29.473 32.176 684 2HA GLY 93 HA1 GLY 93 10.209 30.817 32.677 685 H ASP 94 HN ASP 94 12.693 32.119 33.911 686 HA ASP 94 HA ASP 94 13.319 33.852 31.740 687 1HB ASP 94 HB2 ASP 94 14.848 33.277 34.291 688 2HB ASP 94 HB1 ASP 94 15.227 34.599 33.187 689 H ALA 95 HN ALA 95 14.951 33.824 30.209 690 HA ALA 95 HA ALA 95 16.701 31.374 30.149 691 1HB ALA 95 HB3 ALA 95 15.037 31.490 28.310 692 2HB ALA 95 HB2 ALA 95 15.704 33.049 27.825 693 3HB ALA 95 HB1 ALA 95 16.690 31.592 27.710 694 H HIS 96 HN HIS 96 18.893 31.680 30.004 695 HA HIS 96 HA HIS 96 19.892 34.498 29.673 696 1HB HIS 96 HB2 HIS 96 21.033 32.194 31.276 697 2HB HIS 96 HB1 HIS 96 21.872 33.718 30.998 698 HD2 HIS 96 HD2 HIS 96 18.345 34.962 31.619 699 HE1 HIS 96 HE1 HIS 96 20.107 34.264 35.423 700 HE2 HIS 96 HE2 HIS 96 18.186 35.366 34.199 701 H PHE 97 HN PHE 97 21.117 34.823 27.909 702 HA PHE 97 HA PHE 97 22.198 32.455 26.427 703 1HB PHE 97 HB2 PHE 97 21.385 35.242 25.608 704 2HB PHE 97 HB1 PHE 97 22.411 34.256 24.569 705 HD1 PHE 97 HD1 PHE 97 19.090 34.501 26.184 706 HD2 PHE 97 HD2 PHE 97 21.538 32.361 23.382 707 HE1 PHE 97 HE1 PHE 97 17.080 33.309 25.339 708 HE2 PHE 97 HE2 PHE 97 19.536 31.170 22.534 709 HZ PHE 97 HZ PHE 97 17.305 31.645 23.513 710 H ASP 98 HN ASP 98 24.392 32.192 26.324 711 HA ASP 98 HA ASP 98 26.181 33.874 27.816 712 1HB ASP 98 HB2 ASP 98 26.633 31.472 27.286 713 2HB ASP 98 HB1 ASP 98 26.894 31.926 25.600 714 H GLU 99 HN GLU 99 26.689 35.898 27.236 715 HA GLU 99 HA GLU 99 26.519 36.770 24.456 716 1HB GLU 99 HB2 GLU 99 25.908 38.171 26.483 717 2HB GLU 99 HB1 GLU 99 27.631 38.324 26.801 718 1HG GLU 99 HG2 GLU 99 27.975 39.332 24.594 719 2HG GLU 99 HG1 GLU 99 26.265 39.124 24.217 720 H ASP 100 HN ASP 100 28.923 35.180 26.246 721 HA ASP 100 HA ASP 100 31.220 36.549 25.061 722 1HB ASP 100 HB2 ASP 100 30.960 33.905 26.521 723 2HB ASP 100 HB1 ASP 100 32.493 34.527 25.912 724 H GLU 101 HN GLU 101 29.037 34.078 24.079 725 HA GLU 101 HA GLU 101 30.839 32.921 22.065 726 1HB GLU 101 HB2 GLU 101 27.843 32.606 22.472 727 2HB GLU 101 HB1 GLU 101 28.852 31.605 21.429 728 1HG GLU 101 HG2 GLU 101 29.372 31.903 24.393 729 2HG GLU 101 HG1 GLU 101 28.338 30.637 23.736 730 H ARG 102 HN ARG 102 30.487 33.185 19.748 731 HA ARG 102 HA ARG 102 29.376 35.854 19.066 732 1HB ARG 102 HB2 ARG 102 31.609 35.235 18.194 733 2HB ARG 102 HB1 ARG 102 30.899 33.849 17.370 734 1HG ARG 102 HG2 ARG 102 31.187 35.725 15.803 735 2HG ARG 102 HG1 ARG 102 29.482 35.375 16.028 736 1HD ARG 102 HD2 ARG 102 29.108 37.306 17.275 737 2HD ARG 102 HD1 ARG 102 30.775 37.423 17.823 738 HE ARG 102 HE ARG 102 29.589 38.676 15.497 739 1HH1 ARG 102 HH21 ARG 102 32.452 37.050 16.519 740 2HH1 ARG 102 HH22 ARG 102 33.428 37.714 15.251 741 1HH2 ARG 102 HH11 ARG 102 30.832 39.531 13.843 742 2HH2 ARG 102 HH12 ARG 102 32.509 39.116 13.734 743 H TRP 103 HN TRP 103 27.242 35.847 18.645 744 HA TRP 103 HA TRP 103 25.903 33.447 17.595 745 1HB TRP 103 HB2 TRP 103 24.917 36.212 18.346 746 2HB TRP 103 HB1 TRP 103 23.866 34.905 17.797 747 HD1 TRP 103 HD1 TRP 103 25.248 36.337 20.848 748 HE1 TRP 103 HE1 TRP 103 25.077 34.684 22.822 749 HE3 TRP 103 HE3 TRP 103 24.118 32.074 18.302 750 HZ2 TRP 103 HZ2 TRP 103 24.531 31.889 23.249 751 HZ3 TRP 103 HZ3 TRP 103 23.778 29.935 19.498 752 HH2 TRP 103 HH2 TRP 103 23.979 29.834 21.966 753 H THR 104 HN THR 104 25.160 33.214 15.494 754 HA THR 104 HA THR 104 25.484 35.532 13.614 755 HB THR 104 HB THR 104 26.311 33.888 11.905 756 HG1 THR 104 HG1 THR 104 25.538 32.021 12.979 757 1HG2 THR 104 HG22 THR 104 27.870 34.368 14.454 758 2HG2 THR 104 HG21 THR 104 28.602 33.669 13.014 759 3HG2 THR 104 HG23 THR 104 27.931 35.296 12.956 760 H ASN 105 HN ASN 105 24.293 35.056 11.491 761 HA ASN 105 HA ASN 105 21.708 33.646 12.097 762 1HB ASN 105 HB2 ASN 105 22.323 36.054 10.356 763 2HB ASN 105 HB1 ASN 105 20.763 35.230 10.365 764 1HD2 ASN 105 HD22 ASN 105 20.788 38.086 12.863 765 2HD2 ASN 105 HD21 ASN 105 21.178 37.997 11.213 766 H ASN 106 HN ASN 106 24.279 32.575 10.801 767 HA ASN 106 HA ASN 106 22.898 31.346 8.487 768 1HB ASN 106 HB2 ASN 106 24.878 31.794 7.002 769 2HB ASN 106 HB1 ASN 106 23.947 33.230 7.421 770 1HD2 ASN 106 HD22 ASN 106 26.866 33.431 10.067 771 2HD2 ASN 106 HD21 ASN 106 25.457 32.506 10.249 772 H PHE 107 HN PHE 107 25.057 30.034 7.377 773 HA PHE 107 HA PHE 107 25.341 27.799 9.117 774 1HB PHE 107 HB2 PHE 107 25.473 27.683 6.647 775 2HB PHE 107 HB1 PHE 107 27.014 28.538 6.703 776 HD1 PHE 107 HD2 PHE 107 25.272 25.478 7.944 777 HD2 PHE 107 HD1 PHE 107 29.031 27.365 7.077 778 HE1 PHE 107 HE2 PHE 107 26.445 23.333 8.361 779 HE2 PHE 107 HE1 PHE 107 30.205 25.221 7.498 780 HZ PHE 107 HZ PHE 107 28.909 23.204 8.140 781 H ARG 108 HN ARG 108 26.782 30.702 9.616 782 HA ARG 108 HA ARG 108 29.518 30.085 9.968 783 1HB ARG 108 HB2 ARG 108 27.712 32.075 11.340 784 2HB ARG 108 HB1 ARG 108 29.419 31.931 11.758 785 1HG ARG 108 HG2 ARG 108 30.025 32.302 9.381 786 2HG ARG 108 HG1 ARG 108 28.319 32.496 8.986 787 1HD ARG 108 HD2 ARG 108 28.253 34.395 10.680 788 2HD ARG 108 HD1 ARG 108 30.007 34.270 10.771 789 HE ARG 108 HE ARG 108 29.527 34.522 8.059 790 1HH1 ARG 108 HH21 ARG 108 28.555 36.259 10.886 791 2HH1 ARG 108 HH22 ARG 108 28.545 37.798 10.092 792 1HH2 ARG 108 HH11 ARG 108 29.499 36.522 7.014 793 2HH2 ARG 108 HH12 ARG 108 29.077 37.947 7.902 794 H GLU 109 HN GLU 109 30.149 30.553 12.622 795 HA GLU 109 HA GLU 109 30.412 28.055 13.721 796 1HB GLU 109 HB2 GLU 109 30.143 30.724 15.120 797 2HB GLU 109 HB1 GLU 109 30.635 29.249 15.957 798 1HG GLU 109 HG2 GLU 109 32.510 28.975 14.380 799 2HG GLU 109 HG1 GLU 109 32.021 30.443 13.538 800 H TYR 110 HN TYR 110 27.834 30.300 14.918 801 HA TYR 110 HA TYR 110 26.156 27.867 15.459 802 1HB TYR 110 HB2 TYR 110 26.713 30.126 17.392 803 2HB TYR 110 HB1 TYR 110 25.500 28.873 17.642 804 HD1 TYR 110 HD2 TYR 110 26.211 26.471 17.861 805 HD2 TYR 110 HD1 TYR 110 29.031 29.707 17.754 806 HE1 TYR 110 HE2 TYR 110 27.962 24.972 18.771 807 HE2 TYR 110 HE1 TYR 110 30.785 28.216 18.664 808 HH TYR 110 HH TYR 110 30.840 25.174 18.526 809 H ASN 111 HN ASN 111 23.907 28.247 15.621 810 HA ASN 111 HA ASN 111 22.964 30.772 14.310 811 1HB ASN 111 HB2 ASN 111 21.820 27.971 14.419 812 2HB ASN 111 HB1 ASN 111 20.899 29.355 13.830 813 1HD2 ASN 111 HD22 ASN 111 22.878 27.659 11.016 814 2HD2 ASN 111 HD21 ASN 111 21.882 26.999 12.220 815 H LEU 112 HN LEU 112 22.028 32.166 15.730 816 HA LEU 112 HA LEU 112 21.442 31.534 18.435 817 1HB LEU 112 HB2 LEU 112 21.806 33.829 17.625 818 2HB LEU 112 HB1 LEU 112 20.314 33.750 16.696 819 HG LEU 112 HG LEU 112 19.043 33.431 18.813 820 1HD1 LEU 112 HD11 LEU 112 21.834 33.510 19.953 821 2HD1 LEU 112 HD13 LEU 112 20.482 34.101 20.922 822 3HD1 LEU 112 HD12 LEU 112 20.496 32.433 20.356 823 1HD2 LEU 112 HD22 LEU 112 19.536 35.709 17.812 824 2HD2 LEU 112 HD21 LEU 112 19.205 35.729 19.545 825 3HD2 LEU 112 HD23 LEU 112 20.865 35.851 18.964 826 H HIS 113 HN HIS 113 19.311 31.675 15.588 827 HA HIS 113 HA HIS 113 16.863 31.238 16.941 828 1HB HIS 113 HB2 HIS 113 17.088 31.913 14.552 829 2HB HIS 113 HB1 HIS 113 17.594 30.270 14.169 830 HD1 HIS 113 HD1 HIS 113 15.749 28.401 15.261 831 HD2 HIS 113 HD2 HIS 113 14.389 32.190 14.227 832 HE1 HIS 113 HE1 HIS 113 13.244 28.206 14.968 833 H ARG 114 HN ARG 114 19.095 28.774 15.528 834 HA ARG 114 HA ARG 114 17.464 26.525 16.163 835 1HB ARG 114 HB2 ARG 114 20.480 26.749 15.943 836 2HB ARG 114 HB1 ARG 114 19.618 25.228 16.161 837 1HG ARG 114 HG2 ARG 114 18.364 25.606 14.089 838 2HG ARG 114 HG1 ARG 114 19.159 27.162 13.876 839 1HD ARG 114 HD2 ARG 114 20.449 25.788 12.501 840 2HD ARG 114 HD1 ARG 114 21.382 25.743 13.985 841 HE ARG 114 HE ARG 114 19.754 23.595 12.679 842 1HH1 ARG 114 HH21 ARG 114 21.442 24.592 15.511 843 2HH1 ARG 114 HH22 ARG 114 21.326 23.039 16.270 844 1HH2 ARG 114 HH11 ARG 114 19.627 21.583 13.622 845 2HH2 ARG 114 HH12 ARG 114 20.321 21.328 15.189 846 H VAL 115 HN VAL 115 19.934 28.199 18.136 847 HA VAL 115 HA VAL 115 19.726 26.320 20.330 848 HB VAL 115 HB VAL 115 20.783 29.165 20.186 849 1HG1 VAL 115 HG12 VAL 115 20.765 27.201 22.494 850 2HG1 VAL 115 HG11 VAL 115 21.846 28.591 22.414 851 3HG1 VAL 115 HG13 VAL 115 20.099 28.834 22.477 852 1HG2 VAL 115 HG21 VAL 115 22.060 26.418 20.258 853 2HG2 VAL 115 HG23 VAL 115 22.184 27.628 18.981 854 3HG2 VAL 115 HG22 VAL 115 22.968 27.902 20.536 855 H ALA 116 HN ALA 116 18.178 29.429 19.574 856 HA ALA 116 HA ALA 116 16.764 29.780 22.019 857 1HB ALA 116 HB2 ALA 116 16.932 31.456 20.126 858 2HB ALA 116 HB1 ALA 116 15.729 30.500 19.263 859 3HB ALA 116 HB3 ALA 116 15.313 31.268 20.796 860 H ALA 117 HN ALA 117 15.887 27.994 19.074 861 HA ALA 117 HA ALA 117 13.263 27.258 19.857 862 1HB ALA 117 HB1 ALA 117 15.322 25.808 18.179 863 2HB ALA 117 HB3 ALA 117 13.643 25.295 18.319 864 3HB ALA 117 HB2 ALA 117 14.030 26.859 17.600 865 H HIS 118 HN HIS 118 16.374 25.582 20.377 866 HA HIS 118 HA HIS 118 15.325 23.339 21.777 867 1HB HIS 118 HB2 HIS 118 17.661 23.503 20.940 868 2HB HIS 118 HB1 HIS 118 18.004 24.718 22.170 869 HD1 HIS 118 HD1 HIS 118 16.613 21.163 22.055 870 HD2 HIS 118 HD2 HIS 118 18.991 23.576 24.486 871 HE1 HIS 118 HE1 HIS 118 17.453 19.683 23.929 872 H GLU 119 HN GLU 119 16.516 26.474 23.019 873 HA GLU 119 HA GLU 119 16.111 25.919 25.784 874 1HB GLU 119 HB2 GLU 119 16.036 28.516 24.233 875 2HB GLU 119 HB1 GLU 119 15.963 28.437 25.996 876 1HG GLU 119 HG2 GLU 119 18.104 27.197 26.019 877 2HG GLU 119 HG1 GLU 119 18.185 27.331 24.261 878 H LEU 120 HN LEU 120 13.904 27.330 23.362 879 HA LEU 120 HA LEU 120 11.761 27.886 25.172 880 1HB LEU 120 HB2 LEU 120 11.760 27.253 22.206 881 2HB LEU 120 HB1 LEU 120 10.317 27.748 23.088 882 HG LEU 120 HG LEU 120 12.880 29.369 22.958 883 1HD1 LEU 120 HD12 LEU 120 11.750 29.124 20.751 884 2HD1 LEU 120 HD11 LEU 120 10.271 29.770 21.464 885 3HD1 LEU 120 HD13 LEU 120 11.711 30.783 21.348 886 1HD2 LEU 120 HD22 LEU 120 10.182 29.768 24.243 887 2HD2 LEU 120 HD21 LEU 120 11.783 30.165 24.865 888 3HD2 LEU 120 HD23 LEU 120 11.042 31.177 23.629 889 H GLY 121 HN GLY 121 12.633 24.974 23.348 890 1HA GLY 121 HA2 GLY 121 10.296 23.455 23.872 891 2HA GLY 121 HA1 GLY 121 11.895 22.761 23.600 892 H HIS 122 HN HIS 122 13.238 23.908 25.848 893 HA HIS 122 HA HIS 122 12.436 22.053 27.911 894 1HB HIS 122 HB2 HIS 122 14.323 24.422 27.897 895 2HB HIS 122 HB1 HIS 122 14.063 23.429 29.331 896 HD1 HIS 122 HD1 HIS 122 14.122 20.636 28.426 897 HD2 HIS 122 HD2 HIS 122 16.588 23.493 26.656 898 HE1 HIS 122 HE1 HIS 122 15.991 19.364 27.292 899 H SER 123 HN SER 123 11.973 25.530 27.400 900 HA SER 123 HA SER 123 10.729 26.112 29.892 901 1HB SER 123 HB2 SER 123 9.897 28.100 28.856 902 2HB SER 123 HB1 SER 123 11.434 27.777 28.061 903 HG SER 123 HG SER 123 8.813 27.208 27.138 904 H LEU 124 HN LEU 124 9.584 24.526 26.998 905 HA LEU 124 HA LEU 124 6.775 24.575 27.887 906 1HB LEU 124 HB2 LEU 124 8.126 23.189 25.555 907 2HB LEU 124 HB1 LEU 124 6.383 23.239 25.833 908 HG LEU 124 HG LEU 124 8.123 25.707 25.566 909 1HD1 LEU 124 HD13 LEU 124 6.410 24.287 23.513 910 2HD1 LEU 124 HD12 LEU 124 7.054 25.916 23.308 911 3HD1 LEU 124 HD11 LEU 124 8.155 24.544 23.448 912 1HD2 LEU 124 HD23 LEU 124 5.185 25.216 25.968 913 2HD2 LEU 124 HD22 LEU 124 6.216 26.470 26.650 914 3HD2 LEU 124 HD21 LEU 124 5.674 26.595 24.982 915 H GLY 125 HN GLY 125 9.399 22.873 28.893 916 1HA GLY 125 HA2 GLY 125 9.337 21.053 30.440 917 2HA GLY 125 HA1 GLY 125 7.691 20.692 29.923 918 H LEU 126 HN LEU 126 9.562 21.092 27.171 919 HA LEU 126 HA LEU 126 9.501 18.226 26.629 920 1HB LEU 126 HB2 LEU 126 10.785 20.480 25.054 921 2HB LEU 126 HB1 LEU 126 10.451 18.854 24.454 922 HG LEU 126 HG LEU 126 8.371 20.834 25.428 923 1HD1 LEU 126 HD11 LEU 126 9.521 21.291 23.201 924 2HD1 LEU 126 HD13 LEU 126 8.817 19.779 22.629 925 3HD1 LEU 126 HD12 LEU 126 7.768 21.106 23.128 926 1HD2 LEU 126 HD23 LEU 126 8.266 17.945 24.573 927 2HD2 LEU 126 HD22 LEU 126 7.381 18.762 25.862 928 3HD2 LEU 126 HD21 LEU 126 6.903 18.995 24.184 929 H SER 127 HN SER 127 11.164 16.791 26.797 930 HA SER 127 HA SER 127 13.773 17.830 27.852 931 1HB SER 127 HB2 SER 127 12.333 15.198 28.198 932 2HB SER 127 HB1 SER 127 14.016 15.425 28.661 933 HG SER 127 HG SER 127 13.042 17.381 29.804 934 H HIS 128 HN HIS 128 15.694 16.556 27.228 935 HA HIS 128 HA HIS 128 16.113 16.390 24.471 936 1HB HIS 128 HB2 HIS 128 17.434 14.950 26.774 937 2HB HIS 128 HB1 HIS 128 17.986 14.745 25.114 938 HD1 HIS 128 HD1 HIS 128 19.479 16.533 24.170 939 HD2 HIS 128 HD2 HIS 128 17.627 17.753 27.701 940 HE1 HIS 128 HE1 HIS 128 20.536 18.748 24.807 941 H SER 129 HN SER 129 16.607 14.311 23.232 942 HA SER 129 HA SER 129 14.961 11.969 23.980 943 1HB SER 129 HB2 SER 129 13.390 13.473 22.777 944 2HB SER 129 HB1 SER 129 14.499 13.518 21.411 945 HG SER 129 HG SER 129 12.822 11.940 21.194 946 H THR 130 HN THR 130 15.351 10.158 22.420 947 HA THR 130 HA THR 130 18.172 10.210 21.516 948 HB THR 130 HB THR 130 17.912 7.772 21.323 949 HG1 THR 130 HG1 THR 130 15.338 8.436 21.164 950 1HG2 THR 130 HG21 THR 130 18.292 8.950 23.563 951 2HG2 THR 130 HG23 THR 130 16.583 8.654 23.885 952 3HG2 THR 130 HG22 THR 130 17.683 7.297 23.642 953 H ASP 131 HN ASP 131 15.392 11.153 20.101 954 HA ASP 131 HA ASP 131 15.634 9.707 17.557 955 1HB ASP 131 HB2 ASP 131 13.438 10.593 18.379 956 2HB ASP 131 HB1 ASP 131 14.064 12.227 18.179 957 H ILE 132 HN ILE 132 17.138 10.222 16.058 958 HA ILE 132 HA ILE 132 18.919 12.443 16.243 959 HB ILE 132 HB ILE 132 18.153 10.656 13.924 960 1HG1 ILE 132 HG12 ILE 132 20.637 10.677 15.659 961 2HG1 ILE 132 HG11 ILE 132 19.228 9.669 15.994 962 1HG2 ILE 132 HG23 ILE 132 20.261 12.808 14.172 963 2HG2 ILE 132 HG22 ILE 132 20.450 11.459 13.051 964 3HG2 ILE 132 HG21 ILE 132 19.090 12.566 12.876 965 1HD1 ILE 132 HD12 ILE 132 20.761 9.644 13.386 966 2HD1 ILE 132 HD11 ILE 132 20.987 8.473 14.686 967 3HD1 ILE 132 HD13 ILE 132 19.440 8.567 13.843 968 H GLY 133 HN GLY 133 15.948 11.983 14.328 969 1HA GLY 133 HA2 GLY 133 16.196 14.484 12.908 970 2HA GLY 133 HA1 GLY 133 14.741 13.499 13.000 971 H ALA 134 HN ALA 134 15.822 14.160 16.133 972 HA ALA 134 HA ALA 134 13.704 16.241 16.427 973 1HB ALA 134 HB2 ALA 134 15.160 14.476 18.409 974 2HB ALA 134 HB1 ALA 134 14.121 15.808 18.912 975 3HB ALA 134 HB3 ALA 134 13.446 14.462 17.994 976 H LEU 135 HN LEU 135 14.164 18.327 17.082 977 HA LEU 135 HA LEU 135 16.883 19.276 16.800 978 1HB LEU 135 HB2 LEU 135 14.469 20.675 17.993 979 2HB LEU 135 HB1 LEU 135 15.978 21.455 17.513 980 HG LEU 135 HG LEU 135 14.130 19.937 15.642 981 1HD1 LEU 135 HD12 LEU 135 13.267 22.145 16.521 982 2HD1 LEU 135 HD11 LEU 135 14.677 22.913 15.792 983 3HD1 LEU 135 HD13 LEU 135 13.492 22.095 14.774 984 1HD2 LEU 135 HD22 LEU 135 16.815 21.268 15.317 985 2HD2 LEU 135 HD21 LEU 135 16.223 19.759 14.620 986 3HD2 LEU 135 HD23 LEU 135 15.678 21.303 13.968 987 H MET 136 HN MET 136 14.904 18.209 19.449 988 HA MET 136 HA MET 136 16.469 19.411 21.564 989 1HB MET 136 HB2 MET 136 14.692 16.958 21.689 990 2HB MET 136 HB1 MET 136 15.187 17.968 23.040 991 1HG MET 136 HG2 MET 136 13.559 18.963 20.688 992 2HG MET 136 HG1 MET 136 12.863 18.458 22.226 993 1HE MET 136 HE2 MET 136 13.519 19.193 24.345 994 2HE MET 136 HE1 MET 136 15.161 19.825 24.436 995 3HE MET 136 HE3 MET 136 13.785 20.879 24.785 996 H TYR 137 HN TYR 137 17.508 17.258 19.360 997 HA TYR 137 HA TYR 137 18.574 15.129 20.911 998 1HB TYR 137 HB2 TYR 137 18.363 15.320 18.359 999 2HB TYR 137 HB1 TYR 137 19.880 16.216 18.415 1000 HD1 TYR 137 HD2 TYR 137 18.273 12.975 19.287 1001 HD2 TYR 137 HD1 TYR 137 21.957 15.081 18.695 1002 HE1 TYR 137 HE2 TYR 137 19.510 10.830 19.383 1003 HE2 TYR 137 HE1 TYR 137 23.203 12.939 18.785 1004 HH TYR 137 HH TYR 137 23.062 10.748 19.144 1005 HA PRO 138 HA PRO 138 21.672 17.509 23.129 1006 1HB PRO 138 HB2 PRO 138 23.377 15.291 23.723 1007 2HB PRO 138 HB1 PRO 138 22.091 15.942 24.744 1008 1HG PRO 138 HG2 PRO 138 22.098 13.470 23.142 1009 2HG PRO 138 HG1 PRO 138 20.985 13.958 24.430 1010 1HD PRO 138 HD2 PRO 138 20.409 13.919 21.649 1011 2HD PRO 138 HD1 PRO 138 19.427 14.678 22.924 1012 H SER 139 HN SER 139 21.991 17.460 20.222 1013 HA SER 139 HA SER 139 24.912 17.844 20.151 1014 1HB SER 139 HB2 SER 139 23.876 16.091 17.951 1015 2HB SER 139 HB1 SER 139 25.483 16.167 18.661 1016 HG SER 139 HG SER 139 23.253 15.299 20.156 1017 H TYR 140 HN TYR 140 25.080 19.808 19.252 1018 HA TYR 140 HA TYR 140 23.026 21.028 17.649 1019 1HB TYR 140 HB2 TYR 140 24.644 22.350 18.970 1020 2HB TYR 140 HB1 TYR 140 25.955 21.773 17.942 1021 HD1 TYR 140 HD1 TYR 140 26.161 22.513 15.616 1022 HD2 TYR 140 HD2 TYR 140 23.021 23.987 18.148 1023 HE1 TYR 140 HE1 TYR 140 25.714 24.334 13.993 1024 HE2 TYR 140 HE2 TYR 140 22.566 25.810 16.523 1025 HH TYR 140 HH TYR 140 24.689 26.663 14.070 1026 H THR 141 HN THR 141 22.758 20.993 15.424 1027 HA THR 141 HA THR 141 25.001 20.210 13.681 1028 HB THR 141 HB THR 141 23.586 18.359 12.638 1029 HG1 THR 141 HG1 THR 141 21.977 19.217 14.668 1030 1HG2 THR 141 HG23 THR 141 25.522 18.026 14.285 1031 2HG2 THR 141 HG22 THR 141 24.288 17.809 15.527 1032 3HG2 THR 141 HG21 THR 141 24.368 16.699 14.160 1033 H PHE 142 HN PHE 142 24.678 20.934 11.549 1034 HA PHE 142 HA PHE 142 22.568 22.916 11.190 1035 1HB PHE 142 HB2 PHE 142 24.930 23.057 10.235 1036 2HB PHE 142 HB1 PHE 142 24.453 21.812 9.083 1037 HD1 PHE 142 HD1 PHE 142 23.137 25.053 10.455 1038 HD2 PHE 142 HD2 PHE 142 23.655 22.538 7.008 1039 HE1 PHE 142 HE1 PHE 142 22.097 26.790 9.030 1040 HE2 PHE 142 HE2 PHE 142 22.613 24.278 5.586 1041 HZ PHE 142 HZ PHE 142 21.834 26.404 6.594 1042 H SER 143 HN SER 143 20.518 22.335 10.619 1043 HA SER 143 HA SER 143 20.096 19.737 9.204 1044 1HB SER 143 HB2 SER 143 18.106 21.584 10.555 1045 2HB SER 143 HB1 SER 143 17.738 20.012 9.852 1046 HG SER 143 HG SER 143 19.705 19.500 11.397 1047 H GLY 144 HN GLY 144 20.476 22.949 8.419 1048 1HA GLY 144 HA2 GLY 144 20.204 23.932 6.270 1049 2HA GLY 144 HA1 GLY 144 19.261 22.524 5.778 1050 H ASP 145 HN ASP 145 17.561 22.759 8.229 1051 HA ASP 145 HA ASP 145 16.186 25.328 7.967 1052 1HB ASP 145 HB2 ASP 145 14.106 24.410 7.097 1053 2HB ASP 145 HB1 ASP 145 15.411 24.020 5.977 1054 H VAL 146 HN VAL 146 14.645 25.623 9.657 1055 HA VAL 146 HA VAL 146 14.888 23.645 11.875 1056 HB VAL 146 HB VAL 146 13.708 26.439 11.915 1057 1HG1 VAL 146 HG13 VAL 146 14.551 24.465 14.051 1058 2HG1 VAL 146 HG12 VAL 146 14.226 26.165 14.385 1059 3HG1 VAL 146 HG11 VAL 146 12.938 25.122 13.780 1060 1HG2 VAL 146 HG22 VAL 146 16.506 25.438 12.527 1061 2HG2 VAL 146 HG21 VAL 146 16.045 26.588 11.272 1062 3HG2 VAL 146 HG23 VAL 146 15.916 27.039 12.972 1063 H GLN 147 HN GLN 147 13.283 22.123 11.846 1064 HA GLN 147 HA GLN 147 10.453 23.065 11.553 1065 1HB GLN 147 HB2 GLN 147 11.719 20.656 10.213 1066 2HB GLN 147 HB1 GLN 147 9.979 20.904 10.339 1067 1HG GLN 147 HG2 GLN 147 10.192 23.041 9.111 1068 2HG GLN 147 HG1 GLN 147 11.934 22.781 8.981 1069 1HE2 GLN 147 HE22 GLN 147 9.802 21.280 6.062 1070 2HE2 GLN 147 HE21 GLN 147 9.443 22.669 6.969 1071 H LEU 148 HN LEU 148 9.002 21.933 12.911 1072 HA LEU 148 HA LEU 148 10.217 20.600 15.197 1073 1HB LEU 148 HB2 LEU 148 7.292 20.826 14.423 1074 2HB LEU 148 HB1 LEU 148 7.914 20.365 16.008 1075 HG LEU 148 HG LEU 148 8.401 23.034 14.647 1076 1HD1 LEU 148 HD13 LEU 148 6.545 22.173 16.880 1077 2HD1 LEU 148 HD12 LEU 148 6.933 23.859 16.537 1078 3HD1 LEU 148 HD11 LEU 148 6.096 22.884 15.330 1079 1HD2 LEU 148 HD22 LEU 148 9.333 21.798 17.238 1080 2HD2 LEU 148 HD21 LEU 148 10.249 22.749 16.068 1081 3HD2 LEU 148 HD23 LEU 148 9.099 23.543 17.141 1082 H ALA 149 HN ALA 149 9.949 18.380 15.766 1083 HA ALA 149 HA ALA 149 9.541 16.587 13.420 1084 1HB ALA 149 HB1 ALA 149 11.657 16.404 14.706 1085 2HB ALA 149 HB3 ALA 149 10.726 16.006 16.150 1086 3HB ALA 149 HB2 ALA 149 10.720 14.911 14.767 1087 H GLN 150 HN GLN 150 8.418 14.485 13.871 1088 HA GLN 150 HA GLN 150 5.793 14.908 14.876 1089 1HB GLN 150 HB2 GLN 150 6.352 13.107 13.266 1090 2HB GLN 150 HB1 GLN 150 7.275 12.276 14.520 1091 1HG GLN 150 HG2 GLN 150 5.237 12.059 15.893 1092 2HG GLN 150 HG1 GLN 150 4.315 12.922 14.665 1093 1HE2 GLN 150 HE22 GLN 150 3.510 9.793 13.256 1094 2HE2 GLN 150 HE21 GLN 150 2.948 11.253 13.915 1095 H ASP 151 HN ASP 151 8.660 13.453 16.400 1096 HA ASP 151 HA ASP 151 7.403 12.577 18.792 1097 1HB ASP 151 HB2 ASP 151 9.693 11.935 18.197 1098 2HB ASP 151 HB1 ASP 151 10.226 13.605 18.414 1099 H ASP 152 HN ASP 152 8.771 15.771 17.951 1100 HA ASP 152 HA ASP 152 8.225 16.815 20.619 1101 1HB ASP 152 HB2 ASP 152 8.934 18.155 17.997 1102 2HB ASP 152 HB1 ASP 152 8.649 19.053 19.488 1103 H ILE 153 HN ILE 153 6.602 16.924 17.457 1104 HA ILE 153 HA ILE 153 4.506 18.712 18.214 1105 HB ILE 153 HB ILE 153 4.557 16.471 16.170 1106 1HG1 ILE 153 HG12 ILE 153 4.707 19.482 15.810 1107 2HG1 ILE 153 HG11 ILE 153 6.122 18.434 15.873 1108 1HG2 ILE 153 HG22 ILE 153 2.474 18.579 16.784 1109 2HG2 ILE 153 HG21 ILE 153 2.579 17.801 15.208 1110 3HG2 ILE 153 HG23 ILE 153 2.249 16.838 16.646 1111 1HD1 ILE 153 HD13 ILE 153 5.193 17.130 13.953 1112 2HD1 ILE 153 HD12 ILE 153 3.868 18.288 13.854 1113 3HD1 ILE 153 HD11 ILE 153 5.522 18.813 13.540 1114 H ASP 154 HN ASP 154 4.620 15.131 18.228 1115 HA ASP 154 HA ASP 154 2.022 14.752 19.347 1116 1HB ASP 154 HB2 ASP 154 4.515 13.038 19.473 1117 2HB ASP 154 HB1 ASP 154 2.953 12.517 20.103 1118 H GLY 155 HN GLY 155 5.188 15.201 20.871 1119 1HA GLY 155 HA2 GLY 155 4.329 14.699 23.556 1120 2HA GLY 155 HA1 GLY 155 5.784 15.580 23.104 1121 H ILE 156 HN ILE 156 4.747 17.831 21.820 1122 HA ILE 156 HA ILE 156 3.810 19.331 24.103 1123 HB ILE 156 HB ILE 156 5.214 20.281 22.223 1124 1HG1 ILE 156 HG12 ILE 156 3.932 22.462 22.161 1125 2HG1 ILE 156 HG11 ILE 156 2.598 21.635 22.960 1126 1HG2 ILE 156 HG22 ILE 156 3.788 19.202 20.435 1127 2HG2 ILE 156 HG21 ILE 156 2.569 20.433 20.760 1128 3HG2 ILE 156 HG23 ILE 156 4.159 20.902 20.162 1129 1HD1 ILE 156 HD13 ILE 156 5.319 21.440 24.217 1130 2HD1 ILE 156 HD12 ILE 156 4.440 22.960 24.361 1131 3HD1 ILE 156 HD11 ILE 156 3.726 21.473 24.977 1132 H GLN 157 HN GLN 157 2.249 18.018 21.204 1133 HA GLN 157 HA GLN 157 -0.313 19.231 21.693 1134 1HB GLN 157 HB2 GLN 157 0.495 16.764 20.127 1135 2HB GLN 157 HB1 GLN 157 -1.159 17.378 20.175 1136 1HG GLN 157 HG2 GLN 157 -0.429 19.521 19.254 1137 2HG GLN 157 HG1 GLN 157 1.253 18.992 19.289 1138 1HE2 GLN 157 HE22 GLN 157 -0.232 18.374 15.859 1139 2HE2 GLN 157 HE21 GLN 157 -0.179 19.754 16.847 1140 H ALA 158 HN ALA 158 1.149 16.146 22.682 1141 HA ALA 158 HA ALA 158 -1.176 15.018 23.892 1142 1HB ALA 158 HB3 ALA 158 1.751 14.716 24.637 1143 2HB ALA 158 HB2 ALA 158 0.449 13.704 25.264 1144 3HB ALA 158 HB1 ALA 158 0.834 13.678 23.543 1145 H ILE 159 HN ILE 159 1.244 17.322 25.129 1146 HA ILE 159 HA ILE 159 0.247 17.317 27.833 1147 HB ILE 159 HB ILE 159 1.814 19.414 26.304 1148 1HG1 ILE 159 HG12 ILE 159 2.695 17.425 28.415 1149 2HG1 ILE 159 HG11 ILE 159 2.843 17.135 26.683 1150 1HG2 ILE 159 HG23 ILE 159 0.935 19.229 29.193 1151 2HG2 ILE 159 HG22 ILE 159 2.394 20.110 28.745 1152 3HG2 ILE 159 HG21 ILE 159 0.833 20.608 28.099 1153 1HD1 ILE 159 HD13 ILE 159 4.167 19.258 26.498 1154 2HD1 ILE 159 HD12 ILE 159 4.126 19.381 28.257 1155 3HD1 ILE 159 HD11 ILE 159 4.951 18.025 27.488 1156 H TYR 160 HN TYR 160 -0.321 19.572 25.102 1157 HA TYR 160 HA TYR 160 -2.585 20.781 26.628 1158 1HB TYR 160 HB2 TYR 160 -1.113 21.606 24.115 1159 2HB TYR 160 HB1 TYR 160 -2.604 22.386 24.641 1160 HD1 TYR 160 HD2 TYR 160 -2.698 23.696 26.677 1161 HD2 TYR 160 HD1 TYR 160 0.966 21.875 25.379 1162 HE1 TYR 160 HE2 TYR 160 -1.435 25.137 28.247 1163 HE2 TYR 160 HE1 TYR 160 2.239 23.316 26.950 1164 HH TYR 160 HH TYR 160 1.625 25.814 28.067 1165 H GLY 161 HN GLY 161 -2.028 19.864 23.212 1166 1HA GLY 161 HA2 GLY 161 -3.802 17.895 22.697 1167 2HA GLY 161 HA1 GLY 161 -4.906 19.255 22.918 1168 H ARG 162 HN ARG 162 -5.374 18.702 20.545 1169 HA ARG 162 HA ARG 162 -3.295 19.624 18.638 1170 1HB ARG 162 HB2 ARG 162 -6.097 18.516 18.234 1171 2HB ARG 162 HB1 ARG 162 -5.046 19.037 16.918 1172 1HG ARG 162 HG2 ARG 162 -3.344 17.396 17.611 1173 2HG ARG 162 HG1 ARG 162 -4.384 16.872 18.935 1174 1HD ARG 162 HD2 ARG 162 -6.119 16.199 17.299 1175 2HD ARG 162 HD1 ARG 162 -5.057 16.696 15.978 1176 HE ARG 162 HE ARG 162 -3.520 14.892 17.417 1177 1HH1 ARG 162 HH21 ARG 162 -6.637 14.956 15.963 1178 2HH1 ARG 162 HH22 ARG 162 -6.681 13.254 15.645 1179 1HH2 ARG 162 HH11 ARG 162 -3.546 12.659 17.024 1180 2HH2 ARG 162 HH12 ARG 162 -4.925 11.948 16.253 1181 H SER 163 HN SER 163 -3.613 21.478 17.286 1182 HA SER 163 HA SER 163 -5.177 23.605 18.534 1183 1HB SER 163 HB2 SER 163 -3.722 23.629 15.866 1184 2HB SER 163 HB1 SER 163 -4.275 25.036 16.772 1185 HG SER 163 HG SER 163 -2.082 24.649 17.177 1186 H GLN 164 HN GLN 164 -7.279 22.561 18.331 1187 HA GLN 164 HA GLN 164 -8.442 22.000 15.733 1188 1HB GLN 164 HB2 GLN 164 -9.613 22.375 18.493 1189 2HB GLN 164 HB1 GLN 164 -10.587 21.953 17.085 1190 1HG GLN 164 HG2 GLN 164 -9.221 19.936 16.736 1191 2HG GLN 164 HG1 GLN 164 -8.229 20.358 18.135 1192 1HE2 GLN 164 HE22 GLN 164 -10.440 18.473 20.122 1193 2HE2 GLN 164 HE21 GLN 164 -8.847 18.696 19.581 1194 H ASN 165 HN ASN 165 -9.591 23.384 14.411 1195 HA ASN 165 HA ASN 165 -10.632 25.931 15.474 1196 1HB ASN 165 HB2 ASN 165 -8.531 25.892 13.281 1197 2HB ASN 165 HB1 ASN 165 -9.410 27.316 13.838 1198 1HD2 ASN 165 HD22 ASN 165 -7.725 27.258 17.086 1199 2HD2 ASN 165 HD21 ASN 165 -9.291 27.444 16.457 1200 HA PRO 166 HA PRO 166 -12.906 23.828 11.956 1201 1HB PRO 166 HB2 PRO 166 -15.365 24.043 13.466 1202 2HB PRO 166 HB1 PRO 166 -14.483 22.572 13.036 1203 1HG PRO 166 HG2 PRO 166 -14.692 23.798 15.648 1204 2HG PRO 166 HG1 PRO 166 -13.816 22.323 15.211 1205 1HD PRO 166 HD2 PRO 166 -12.705 24.937 15.849 1206 2HD PRO 166 HD1 PRO 166 -11.829 23.439 15.478 1207 H VAL 167 HN VAL 167 -12.340 25.993 11.052 1208 HA VAL 167 HA VAL 167 -14.111 28.253 11.627 1209 HB VAL 167 HB VAL 167 -12.015 27.808 9.483 1210 1HG1 VAL 167 HG11 VAL 167 -13.786 30.170 10.131 1211 2HG1 VAL 167 HG13 VAL 167 -12.233 30.379 9.320 1212 3HG1 VAL 167 HG12 VAL 167 -13.497 29.411 8.566 1213 1HG2 VAL 167 HG21 VAL 167 -11.301 27.989 11.926 1214 2HG2 VAL 167 HG23 VAL 167 -10.601 29.192 10.845 1215 3HG2 VAL 167 HG22 VAL 167 -11.943 29.630 11.903 1216 H GLN 168 HN GLN 168 -15.856 28.896 10.405 1217 HA GLN 168 HA GLN 168 -17.002 26.925 8.590 1218 1HB GLN 168 HB2 GLN 168 -17.969 29.675 9.431 1219 2HB GLN 168 HB1 GLN 168 -18.931 28.494 8.544 1220 1HG GLN 168 HG2 GLN 168 -18.482 26.872 10.465 1221 2HG GLN 168 HG1 GLN 168 -17.844 28.250 11.360 1222 1HE2 GLN 168 HE22 GLN 168 -21.838 28.495 10.364 1223 2HE2 GLN 168 HE21 GLN 168 -20.740 27.903 9.211 1224 HA PRO 169 HA PRO 169 -15.450 28.561 4.767 1225 1HB PRO 169 HB2 PRO 169 -18.041 28.552 3.421 1226 2HB PRO 169 HB1 PRO 169 -16.674 27.457 3.182 1227 1HG PRO 169 HG2 PRO 169 -19.157 26.897 4.557 1228 2HG PRO 169 HG1 PRO 169 -17.787 25.804 4.314 1229 1HD PRO 169 HD2 PRO 169 -18.603 27.019 6.786 1230 2HD PRO 169 HD1 PRO 169 -17.155 26.032 6.500 No H/Q in entry = 1230 Start of MODEL 12 1 1H VAL 1 HT1 VAL 1 -1.439 19.956 45.871 2 2H VAL 1 HT3 VAL 1 0.082 20.396 46.479 3 3H VAL 1 HT2 VAL 1 -0.098 20.027 44.830 4 HA VAL 1 HA VAL 1 0.944 18.187 45.968 5 HB VAL 1 HB VAL 1 -0.123 18.790 48.186 6 1HG1 VAL 1 HG12 VAL 1 -2.467 18.879 47.087 7 2HG1 VAL 1 HG11 VAL 1 -2.456 17.121 47.228 8 3HG1 VAL 1 HG13 VAL 1 -2.347 18.123 48.677 9 1HG2 VAL 1 HG22 VAL 1 -0.301 15.933 47.182 10 2HG2 VAL 1 HG21 VAL 1 1.089 16.697 47.953 11 3HG2 VAL 1 HG23 VAL 1 -0.376 16.386 48.882 12 H LEU 2 HN LEU 2 -2.283 18.840 44.837 13 HA LEU 2 HA LEU 2 -2.668 16.069 43.903 14 1HB LEU 2 HB2 LEU 2 -4.883 16.705 43.306 15 2HB LEU 2 HB1 LEU 2 -4.547 17.475 44.843 16 HG LEU 2 HG LEU 2 -5.636 19.133 43.558 17 1HD1 LEU 2 HD13 LEU 2 -3.611 19.946 44.714 18 2HD1 LEU 2 HD12 LEU 2 -2.690 19.708 43.230 19 3HD1 LEU 2 HD11 LEU 2 -3.989 20.890 43.277 20 1HD2 LEU 2 HD21 LEU 2 -4.909 17.800 41.305 21 2HD2 LEU 2 HD23 LEU 2 -5.514 19.448 41.303 22 3HD2 LEU 2 HD22 LEU 2 -3.786 19.152 41.219 23 H THR 3 HN THR 3 -0.867 18.567 42.774 24 HA THR 3 HA THR 3 -1.602 18.256 39.922 25 HB THR 3 HB THR 3 0.227 19.858 39.499 26 HG1 THR 3 HG1 THR 3 0.891 19.110 42.023 27 1HG2 THR 3 HG21 THR 3 -2.142 20.530 40.327 28 2HG2 THR 3 HG23 THR 3 -1.325 20.931 41.839 29 3HG2 THR 3 HG22 THR 3 -0.868 21.750 40.348 30 H GLU 4 HN GLU 4 0.153 17.703 38.365 31 HA GLU 4 HA GLU 4 1.383 15.189 39.093 32 1HB GLU 4 HB2 GLU 4 0.579 15.673 36.802 33 2HB GLU 4 HB1 GLU 4 1.800 16.934 36.641 34 1HG GLU 4 HG2 GLU 4 3.586 15.276 36.906 35 2HG GLU 4 HG1 GLU 4 2.390 14.004 37.156 36 H GLY 5 HN GLY 5 3.725 14.768 39.057 37 1HA GLY 5 HA2 GLY 5 5.232 16.634 40.613 38 2HA GLY 5 HA1 GLY 5 5.907 15.233 39.778 39 H ASN 6 HN ASN 6 4.232 17.135 37.590 40 HA ASN 6 HA ASN 6 6.399 19.028 37.003 41 1HB ASN 6 HB2 ASN 6 5.718 16.737 35.135 42 2HB ASN 6 HB1 ASN 6 6.693 18.132 34.683 43 1HD2 ASN 6 HD22 ASN 6 9.603 16.971 36.338 44 2HD2 ASN 6 HD21 ASN 6 8.875 18.255 35.498 45 HA PRO 7 HA PRO 7 2.033 20.195 35.894 46 1HB PRO 7 HB2 PRO 7 2.536 22.841 36.958 47 2HB PRO 7 HB1 PRO 7 1.461 21.597 37.608 48 1HG PRO 7 HG2 PRO 7 3.968 22.466 38.721 49 2HG PRO 7 HG1 PRO 7 2.936 21.153 39.307 50 1HD PRO 7 HD2 PRO 7 5.474 20.957 37.866 51 2HD PRO 7 HD1 PRO 7 4.536 19.654 38.623 52 H ARG 8 HN ARG 8 1.448 22.468 34.736 53 HA ARG 8 HA ARG 8 3.675 23.300 32.922 54 1HB ARG 8 HB2 ARG 8 0.885 22.569 31.965 55 2HB ARG 8 HB1 ARG 8 2.248 23.040 30.961 56 1HG ARG 8 HG2 ARG 8 2.291 20.575 32.719 57 2HG ARG 8 HG1 ARG 8 1.748 20.543 31.049 58 1HD ARG 8 HD2 ARG 8 3.946 21.437 30.324 59 2HD ARG 8 HD1 ARG 8 4.497 21.406 31.998 60 HE ARG 8 HE ARG 8 3.627 18.819 31.531 61 1HH1 ARG 8 HH21 ARG 8 5.831 21.050 30.099 62 2HH1 ARG 8 HH22 ARG 8 6.876 19.821 29.472 63 1HH2 ARG 8 HH11 ARG 8 4.976 17.201 30.722 64 2HH2 ARG 8 HH12 ARG 8 6.393 17.638 29.827 65 H TRP 9 HN TRP 9 2.771 25.253 31.518 66 HA TRP 9 HA TRP 9 2.014 27.321 33.331 67 1HB TRP 9 HB2 TRP 9 1.808 27.153 30.308 68 2HB TRP 9 HB1 TRP 9 1.442 28.616 31.218 69 HD1 TRP 9 HD1 TRP 9 4.303 26.489 29.986 70 HE1 TRP 9 HE1 TRP 9 6.536 27.666 30.516 71 HE3 TRP 9 HE3 TRP 9 2.622 30.258 32.990 72 HZ2 TRP 9 HZ2 TRP 9 7.482 29.910 32.020 73 HZ3 TRP 9 HZ3 TRP 9 4.204 31.900 33.958 74 HH2 TRP 9 HH2 TRP 9 6.632 31.731 33.479 75 H GLU 10 HN GLU 10 0.039 27.866 34.131 76 HA GLU 10 HA GLU 10 -2.294 26.261 33.488 77 1HB GLU 10 HB2 GLU 10 -1.963 28.780 35.142 78 2HB GLU 10 HB1 GLU 10 -3.473 27.877 35.012 79 1HG GLU 10 HG2 GLU 10 -2.360 25.876 35.928 80 2HG GLU 10 HG1 GLU 10 -0.848 26.780 36.063 81 H GLN 11 HN GLN 11 -1.043 29.377 32.500 82 HA GLN 11 HA GLN 11 -3.561 30.242 31.290 83 1HB GLN 11 HB2 GLN 11 -0.741 31.315 30.997 84 2HB GLN 11 HB1 GLN 11 -2.193 32.105 30.392 85 1HG GLN 11 HG2 GLN 11 -1.706 31.424 33.307 86 2HG GLN 11 HG1 GLN 11 -1.420 33.011 32.597 87 1HE2 GLN 11 HE22 GLN 11 -4.968 32.568 34.030 88 2HE2 GLN 11 HE21 GLN 11 -3.483 32.033 34.652 89 H THR 12 HN THR 12 -4.040 30.262 29.072 90 HA THR 12 HA THR 12 -2.518 28.310 27.434 91 HB THR 12 HB THR 12 -4.418 28.523 25.868 92 HG1 THR 12 HG1 THR 12 -4.817 30.753 27.353 93 1HG2 THR 12 HG21 THR 12 -5.062 28.085 28.788 94 2HG2 THR 12 HG23 THR 12 -6.232 27.773 27.508 95 3HG2 THR 12 HG22 THR 12 -4.720 26.869 27.558 96 H HIS 13 HN HIS 13 -2.475 31.561 28.085 97 HA HIS 13 HA HIS 13 -1.158 32.191 25.470 98 1HB HIS 13 HB2 HIS 13 -2.816 34.137 27.110 99 2HB HIS 13 HB1 HIS 13 -2.112 34.416 25.518 100 HD1 HIS 13 HD1 HIS 13 -5.298 34.142 26.591 101 HD2 HIS 13 HD2 HIS 13 -3.148 31.683 24.000 102 HE1 HIS 13 HE1 HIS 13 -7.009 32.884 25.207 103 H LEU 14 HN LEU 14 0.813 33.236 25.716 104 HA LEU 14 HA LEU 14 1.606 34.104 28.475 105 1HB LEU 14 HB2 LEU 14 3.218 32.383 26.562 106 2HB LEU 14 HB1 LEU 14 3.827 33.047 28.078 107 HG LEU 14 HG LEU 14 1.412 31.218 27.869 108 1HD1 LEU 14 HD11 LEU 14 4.306 30.613 28.543 109 2HD1 LEU 14 HD13 LEU 14 2.972 29.496 28.822 110 3HD1 LEU 14 HD12 LEU 14 3.382 29.984 27.180 111 1HD2 LEU 14 HD21 LEU 14 2.915 32.517 30.143 112 2HD2 LEU 14 HD23 LEU 14 1.177 32.322 29.921 113 3HD2 LEU 14 HD22 LEU 14 2.162 30.945 30.403 114 H THR 15 HN THR 15 3.453 35.607 28.449 115 HA THR 15 HA THR 15 3.806 37.043 25.834 116 HB THR 15 HB THR 15 3.709 39.157 27.009 117 HG1 THR 15 HG1 THR 15 3.014 38.856 29.356 118 1HG2 THR 15 HG21 THR 15 1.446 37.353 27.909 119 2HG2 THR 15 HG23 THR 15 1.386 39.114 27.846 120 3HG2 THR 15 HG22 THR 15 1.543 38.186 26.356 121 H TYR 16 HN TYR 16 5.900 38.110 25.615 122 HA TYR 16 HA TYR 16 7.952 37.347 27.649 123 1HB TYR 16 HB2 TYR 16 9.431 36.456 25.906 124 2HB TYR 16 HB1 TYR 16 7.915 35.560 25.938 125 HD1 TYR 16 HD2 TYR 16 6.243 35.832 24.170 126 HD2 TYR 16 HD1 TYR 16 9.975 37.954 24.052 127 HE1 TYR 16 HE2 TYR 16 5.857 36.372 21.782 128 HE2 TYR 16 HE1 TYR 16 9.585 38.500 21.661 129 HH TYR 16 HH TYR 16 7.733 37.004 19.720 130 H ARG 17 HN ARG 17 9.885 38.632 27.537 131 HA ARG 17 HA ARG 17 9.816 41.022 25.742 132 1HB ARG 17 HB2 ARG 17 8.735 41.643 27.909 133 2HB ARG 17 HB1 ARG 17 10.187 41.126 28.756 134 1HG ARG 17 HG2 ARG 17 11.502 42.827 27.534 135 2HG ARG 17 HG1 ARG 17 10.045 43.352 26.695 136 1HD ARG 17 HD2 ARG 17 9.004 43.828 28.924 137 2HD ARG 17 HD1 ARG 17 10.543 43.460 29.693 138 HE ARG 17 HE ARG 17 9.779 45.957 28.503 139 1HH1 ARG 17 HH21 ARG 17 12.482 43.792 28.612 140 2HH1 ARG 17 HH22 ARG 17 13.606 44.987 28.061 141 1HH2 ARG 17 HH11 ARG 17 11.243 47.502 27.821 142 2HH2 ARG 17 HH12 ARG 17 12.912 47.080 27.626 143 H ILE 18 HN ILE 18 11.868 41.566 25.043 144 HA ILE 18 HA ILE 18 14.143 39.946 26.065 145 HB ILE 18 HB ILE 18 14.002 41.945 23.780 146 1HG1 ILE 18 HG12 ILE 18 14.068 38.914 23.657 147 2HG1 ILE 18 HG11 ILE 18 12.572 39.841 23.590 148 1HG2 ILE 18 HG22 ILE 18 16.108 39.941 24.652 149 2HG2 ILE 18 HG21 ILE 18 16.131 40.771 23.097 150 3HG2 ILE 18 HG23 ILE 18 16.275 41.695 24.591 151 1HD1 ILE 18 HD12 ILE 18 13.645 41.133 21.641 152 2HD1 ILE 18 HD11 ILE 18 14.853 39.850 21.610 153 3HD1 ILE 18 HD13 ILE 18 13.157 39.470 21.318 154 H GLU 19 HN GLU 19 15.335 40.832 27.715 155 HA GLU 19 HA GLU 19 14.923 43.510 28.633 156 1HB GLU 19 HB2 GLU 19 15.762 41.581 30.019 157 2HB GLU 19 HB1 GLU 19 17.321 41.757 29.212 158 1HG GLU 19 HG2 GLU 19 17.506 44.066 30.009 159 2HG GLU 19 HG1 GLU 19 15.920 43.945 30.776 160 H ASN 20 HN ASN 20 17.512 42.084 26.612 161 HA ASN 20 HA ASN 20 18.069 44.709 25.476 162 1HB ASN 20 HB2 ASN 20 20.401 44.875 26.244 163 2HB ASN 20 HB1 ASN 20 19.293 44.890 27.616 164 1HD2 ASN 20 HD22 ASN 20 21.914 42.456 28.526 165 2HD2 ASN 20 HD21 ASN 20 21.789 44.138 28.323 166 H TYR 21 HN TYR 21 19.740 44.592 23.775 167 HA TYR 21 HA TYR 21 19.930 41.840 22.604 168 1HB TYR 21 HB2 TYR 21 20.173 44.568 21.298 169 2HB TYR 21 HB1 TYR 21 20.267 43.021 20.458 170 HD1 TYR 21 HD2 TYR 21 18.073 45.385 22.216 171 HD2 TYR 21 HD1 TYR 21 18.266 41.636 20.131 172 HE1 TYR 21 HE2 TYR 21 15.600 45.357 22.041 173 HE2 TYR 21 HE1 TYR 21 15.791 41.607 19.958 174 HH TYR 21 HH TYR 21 13.882 44.305 20.516 175 H THR 22 HN THR 22 21.952 40.993 22.166 176 HA THR 22 HA THR 22 24.242 42.302 23.366 177 HB THR 22 HB THR 22 24.275 39.940 23.528 178 HG1 THR 22 HG1 THR 22 26.305 40.358 23.049 179 1HG2 THR 22 HG21 THR 22 23.723 39.925 20.550 180 2HG2 THR 22 HG23 THR 22 24.100 38.486 21.495 181 3HG2 THR 22 HG22 THR 22 22.631 39.396 21.829 182 HA PRO 23 HA PRO 23 25.542 44.507 19.718 183 1HB PRO 23 HB2 PRO 23 28.354 44.333 20.126 184 2HB PRO 23 HB1 PRO 23 27.292 45.623 20.704 185 1HG PRO 23 HG2 PRO 23 28.536 43.432 22.243 186 2HG PRO 23 HG1 PRO 23 27.806 44.930 22.836 187 1HD PRO 23 HD2 PRO 23 26.657 42.340 23.004 188 2HD PRO 23 HD1 PRO 23 25.825 43.881 23.293 189 H ASP 24 HN ASP 24 25.982 41.246 20.211 190 HA ASP 24 HA ASP 24 27.889 40.570 18.174 191 1HB ASP 24 HB2 ASP 24 25.582 39.017 19.366 192 2HB ASP 24 HB1 ASP 24 26.720 38.324 18.210 193 H LEU 25 HN LEU 25 24.365 40.992 18.121 194 HA LEU 25 HA LEU 25 24.512 41.258 15.162 195 1HB LEU 25 HB2 LEU 25 22.624 39.502 16.742 196 2HB LEU 25 HB1 LEU 25 22.292 39.979 15.084 197 HG LEU 25 HG LEU 25 24.899 38.645 15.843 198 1HD1 LEU 25 HD12 LEU 25 22.282 37.340 15.041 199 2HD1 LEU 25 HD11 LEU 25 23.835 36.506 15.109 200 3HD1 LEU 25 HD13 LEU 25 23.113 37.151 16.583 201 1HD2 LEU 25 HD22 LEU 25 23.325 39.003 13.271 202 2HD2 LEU 25 HD21 LEU 25 24.936 39.615 13.632 203 3HD2 LEU 25 HD23 LEU 25 24.680 37.888 13.415 204 HA PRO 26 HA PRO 26 21.922 44.788 15.990 205 1HB PRO 26 HB2 PRO 26 20.241 44.530 13.669 206 2HB PRO 26 HB1 PRO 26 21.668 45.559 13.844 207 1HG PRO 26 HG2 PRO 26 21.401 43.067 12.327 208 2HG PRO 26 HG1 PRO 26 22.748 44.216 12.329 209 1HD PRO 26 HD2 PRO 26 22.725 41.630 13.535 210 2HD PRO 26 HD1 PRO 26 23.976 42.876 13.712 211 H ARG 27 HN ARG 27 19.764 45.193 16.815 212 HA ARG 27 HA ARG 27 18.411 42.921 17.900 213 1HB ARG 27 HB2 ARG 27 16.717 44.497 18.649 214 2HB ARG 27 HB1 ARG 27 18.307 45.234 18.851 215 1HG ARG 27 HG2 ARG 27 17.919 46.239 16.491 216 2HG ARG 27 HG1 ARG 27 16.227 45.806 16.738 217 1HD ARG 27 HD2 ARG 27 16.433 48.056 17.509 218 2HD ARG 27 HD1 ARG 27 16.377 47.055 18.962 219 HE ARG 27 HE ARG 27 19.086 47.268 18.411 220 1HH1 ARG 27 HH21 ARG 27 16.436 49.430 18.840 221 2HH1 ARG 27 HH22 ARG 27 17.413 50.714 19.473 222 1HH2 ARG 27 HH11 ARG 27 20.376 48.930 19.230 223 2HH2 ARG 27 HH12 ARG 27 19.644 50.428 19.695 224 H ALA 28 HN ALA 28 17.940 44.749 14.935 225 HA ALA 28 HA ALA 28 15.339 43.856 14.247 226 1HB ALA 28 HB2 ALA 28 17.725 44.622 12.558 227 2HB ALA 28 HB1 ALA 28 16.164 44.209 11.851 228 3HB ALA 28 HB3 ALA 28 16.304 45.594 12.934 229 H ASP 29 HN ASP 29 18.494 42.282 13.819 230 HA ASP 29 HA ASP 29 17.333 40.048 12.332 231 1HB ASP 29 HB2 ASP 29 20.059 40.535 13.559 232 2HB ASP 29 HB1 ASP 29 19.639 39.038 12.728 233 H VAL 30 HN VAL 30 18.119 40.764 15.688 234 HA VAL 30 HA VAL 30 17.928 38.042 16.637 235 HB VAL 30 HB VAL 30 17.666 40.713 18.034 236 1HG1 VAL 30 HG11 VAL 30 17.552 37.896 19.102 237 2HG1 VAL 30 HG13 VAL 30 18.148 39.221 20.103 238 3HG1 VAL 30 HG12 VAL 30 16.501 39.261 19.478 239 1HG2 VAL 30 HG23 VAL 30 19.873 40.015 16.993 240 2HG2 VAL 30 HG22 VAL 30 19.933 40.316 18.730 241 3HG2 VAL 30 HG21 VAL 30 19.891 38.659 18.122 242 H ASP 31 HN ASP 31 15.600 40.769 16.626 243 HA ASP 31 HA ASP 31 13.448 39.423 17.887 244 1HB ASP 31 HB2 ASP 31 13.478 41.572 15.750 245 2HB ASP 31 HB1 ASP 31 12.000 41.024 16.541 246 H HIS 32 HN HIS 32 14.426 39.506 14.482 247 HA HIS 32 HA HIS 32 12.216 38.105 13.366 248 1HB HIS 32 HB2 HIS 32 14.147 39.310 12.176 249 2HB HIS 32 HB1 HIS 32 15.070 37.822 12.417 250 HD1 HIS 32 HD1 HIS 32 14.962 36.494 10.307 251 HD2 HIS 32 HD2 HIS 32 11.326 38.287 11.219 252 HE1 HIS 32 HE1 HIS 32 13.303 35.673 8.596 253 H ALA 33 HN ALA 33 15.371 36.834 14.369 254 HA ALA 33 HA ALA 33 14.789 34.095 13.918 255 1HB ALA 33 HB1 ALA 33 16.739 35.530 15.711 256 2HB ALA 33 HB3 ALA 33 16.631 33.770 15.723 257 3HB ALA 33 HB2 ALA 33 17.059 34.618 14.238 258 H ILE 34 HN ILE 34 14.445 36.007 16.936 259 HA ILE 34 HA ILE 34 13.478 33.779 18.492 260 HB ILE 34 HB ILE 34 13.050 36.754 18.916 261 1HG1 ILE 34 HG12 ILE 34 15.436 36.217 18.856 262 2HG1 ILE 34 HG11 ILE 34 14.950 36.548 20.513 263 1HG2 ILE 34 HG21 ILE 34 12.696 34.358 20.728 264 2HG2 ILE 34 HG23 ILE 34 12.795 36.014 21.327 265 3HG2 ILE 34 HG22 ILE 34 11.476 35.540 20.255 266 1HD1 ILE 34 HD13 ILE 34 14.587 33.883 20.534 267 2HD1 ILE 34 HD12 ILE 34 15.800 33.974 19.260 268 3HD1 ILE 34 HD11 ILE 34 16.157 34.614 20.864 269 H GLU 35 HN GLU 35 11.841 36.336 16.648 270 HA GLU 35 HA GLU 35 9.169 35.788 17.457 271 1HB GLU 35 HB2 GLU 35 9.893 37.764 16.125 272 2HB GLU 35 HB1 GLU 35 10.165 36.705 14.744 273 1HG GLU 35 HG2 GLU 35 7.789 36.073 14.736 274 2HG GLU 35 HG1 GLU 35 7.501 37.103 16.140 275 H LYS 36 HN LYS 36 11.077 34.435 14.767 276 HA LYS 36 HA LYS 36 9.021 32.777 13.699 277 1HB LYS 36 HB2 LYS 36 12.037 32.553 13.644 278 2HB LYS 36 HB1 LYS 36 10.980 31.433 12.780 279 1HG LYS 36 HG2 LYS 36 10.042 33.205 11.463 280 2HG LYS 36 HG1 LYS 36 10.836 34.434 12.449 281 1HD LYS 36 HD2 LYS 36 12.112 34.150 10.384 282 2HD LYS 36 HD1 LYS 36 13.056 33.513 11.731 283 1HE LYS 36 HE2 LYS 36 12.649 31.280 11.127 284 2HE LYS 36 HE1 LYS 36 11.242 31.696 10.148 285 1HZ LYS 36 HZ2 LYS 36 13.930 32.692 9.442 286 2HZ LYS 36 HZ1 LYS 36 13.415 31.146 8.956 287 3HZ LYS 36 HZ3 LYS 36 12.561 32.522 8.451 288 H ALA 37 HN ALA 37 11.411 32.172 16.284 289 HA ALA 37 HA ALA 37 10.882 29.391 16.582 290 1HB ALA 37 HB3 ALA 37 12.708 30.724 17.751 291 2HB ALA 37 HB2 ALA 37 11.461 31.304 18.859 292 3HB ALA 37 HB1 ALA 37 11.840 29.582 18.781 293 H PHE 38 HN PHE 38 9.385 32.158 18.332 294 HA PHE 38 HA PHE 38 7.507 30.581 19.780 295 1HB PHE 38 HB2 PHE 38 7.503 33.458 18.860 296 2HB PHE 38 HB1 PHE 38 6.129 32.782 19.737 297 HD1 PHE 38 HD2 PHE 38 6.533 31.713 22.010 298 HD2 PHE 38 HD1 PHE 38 9.472 34.119 20.010 299 HE1 PHE 38 HE2 PHE 38 7.713 32.056 24.162 300 HE2 PHE 38 HE1 PHE 38 10.659 34.456 22.162 301 HZ PHE 38 HZ PHE 38 9.777 33.429 24.240 302 H GLN 39 HN GLN 39 7.238 32.100 16.549 303 HA GLN 39 HA GLN 39 4.506 31.433 16.110 304 1HB GLN 39 HB2 GLN 39 6.798 31.778 14.161 305 2HB GLN 39 HB1 GLN 39 5.125 31.548 13.659 306 1HG GLN 39 HG2 GLN 39 4.457 33.551 14.927 307 2HG GLN 39 HG1 GLN 39 6.125 33.786 15.446 308 1HE2 GLN 39 HE22 GLN 39 5.203 35.660 12.184 309 2HE2 GLN 39 HE21 GLN 39 4.258 35.418 13.573 310 H LEU 40 HN LEU 40 7.489 29.582 15.429 311 HA LEU 40 HA LEU 40 6.207 27.400 14.120 312 1HB LEU 40 HB2 LEU 40 8.721 27.481 15.807 313 2HB LEU 40 HB1 LEU 40 8.198 26.050 14.924 314 HG LEU 40 HG LEU 40 8.709 28.757 13.662 315 1HD1 LEU 40 HD13 LEU 40 10.413 26.254 13.792 316 2HD1 LEU 40 HD12 LEU 40 10.734 27.616 12.721 317 3HD1 LEU 40 HD11 LEU 40 10.801 27.837 14.467 318 1HD2 LEU 40 HD22 LEU 40 7.638 26.152 12.662 319 2HD2 LEU 40 HD21 LEU 40 7.359 27.790 12.073 320 3HD2 LEU 40 HD23 LEU 40 8.833 26.934 11.629 321 H TRP 41 HN TRP 41 6.771 27.973 17.586 322 HA TRP 41 HA TRP 41 5.718 25.392 18.372 323 1HB TRP 41 HB2 TRP 41 6.144 27.981 19.882 324 2HB TRP 41 HB1 TRP 41 5.572 26.501 20.649 325 HD1 TRP 41 HD1 TRP 41 8.646 28.294 19.927 326 HE1 TRP 41 HE1 TRP 41 10.707 26.759 20.109 327 HE3 TRP 41 HE3 TRP 41 6.348 23.719 19.959 328 HZ2 TRP 41 HZ2 TRP 41 11.306 23.972 20.246 329 HZ3 TRP 41 HZ3 TRP 41 7.696 21.646 20.114 330 HH2 TRP 41 HH2 TRP 41 10.166 21.766 20.258 331 H SER 42 HN SER 42 4.339 28.652 18.110 332 HA SER 42 HA SER 42 1.745 27.939 19.154 333 1HB SER 42 HB2 SER 42 2.606 30.282 18.999 334 2HB SER 42 HB1 SER 42 2.469 30.185 17.248 335 HG SER 42 HG SER 42 0.261 29.511 18.839 336 H ASN 43 HN ASN 43 3.166 27.903 15.922 337 HA ASN 43 HA ASN 43 0.846 27.675 14.359 338 1HB ASN 43 HB2 ASN 43 3.553 26.375 13.986 339 2HB ASN 43 HB1 ASN 43 2.281 26.360 12.761 340 1HD2 ASN 43 HD22 ASN 43 2.465 30.135 12.752 341 2HD2 ASN 43 HD21 ASN 43 1.272 29.043 13.260 342 H VAL 44 HN VAL 44 2.373 25.190 16.358 343 HA VAL 44 HA VAL 44 0.344 23.214 15.357 344 HB VAL 44 HB VAL 44 1.829 21.471 16.170 345 1HG1 VAL 44 HG13 VAL 44 3.188 23.624 14.529 346 2HG1 VAL 44 HG12 VAL 44 3.830 21.991 14.722 347 3HG1 VAL 44 HG11 VAL 44 2.274 22.240 13.930 348 1HG2 VAL 44 HG21 VAL 44 3.371 23.819 17.281 349 2HG2 VAL 44 HG23 VAL 44 2.827 22.363 18.113 350 3HG2 VAL 44 HG22 VAL 44 4.160 22.271 16.969 351 H THR 45 HN THR 45 0.398 25.388 17.715 352 HA THR 45 HA THR 45 -1.109 23.602 19.553 353 HB THR 45 HB THR 45 -0.006 24.450 21.527 354 HG1 THR 45 HG1 THR 45 0.339 26.560 20.562 355 1HG2 THR 45 HG22 THR 45 1.146 22.655 20.017 356 2HG2 THR 45 HG21 THR 45 2.293 23.951 19.669 357 3HG2 THR 45 HG23 THR 45 2.070 23.395 21.323 358 HA PRO 46 HA PRO 46 -3.823 27.150 19.411 359 1HB PRO 46 HB2 PRO 46 -5.121 26.755 21.894 360 2HB PRO 46 HB1 PRO 46 -5.615 26.051 20.348 361 1HG PRO 46 HG2 PRO 46 -4.262 24.741 22.636 362 2HG PRO 46 HG1 PRO 46 -5.177 24.006 21.310 363 1HD PRO 46 HD2 PRO 46 -2.357 23.990 21.568 364 2HD PRO 46 HD1 PRO 46 -3.277 23.600 20.097 365 H LEU 47 HN LEU 47 -1.190 26.838 21.349 366 HA LEU 47 HA LEU 47 -1.687 28.924 23.312 367 1HB LEU 47 HB2 LEU 47 0.953 27.812 22.303 368 2HB LEU 47 HB1 LEU 47 0.728 28.778 23.760 369 HG LEU 47 HG LEU 47 -0.497 26.048 23.245 370 1HD1 LEU 47 HD12 LEU 47 1.733 26.953 25.094 371 2HD1 LEU 47 HD11 LEU 47 1.031 25.333 25.074 372 3HD1 LEU 47 HD13 LEU 47 1.914 25.930 23.666 373 1HD2 LEU 47 HD21 LEU 47 -0.795 28.078 25.459 374 2HD2 LEU 47 HD23 LEU 47 -2.034 27.091 24.685 375 3HD2 LEU 47 HD22 LEU 47 -0.923 26.359 25.836 376 H THR 48 HN THR 48 -0.935 31.080 23.261 377 HA THR 48 HA THR 48 0.006 32.093 20.590 378 HB THR 48 HB THR 48 -1.384 34.083 20.924 379 HG1 THR 48 HG1 THR 48 -2.328 34.465 22.771 380 1HG2 THR 48 HG21 THR 48 -2.859 31.458 21.253 381 2HG2 THR 48 HG23 THR 48 -3.657 32.983 20.868 382 3HG2 THR 48 HG22 THR 48 -2.487 32.290 19.745 383 H PHE 49 HN PHE 49 1.657 33.619 20.702 384 HA PHE 49 HA PHE 49 2.582 34.428 23.446 385 1HB PHE 49 HB2 PHE 49 4.252 33.727 21.013 386 2HB PHE 49 HB1 PHE 49 4.884 34.363 22.534 387 HD1 PHE 49 HD1 PHE 49 3.292 31.461 20.903 388 HD2 PHE 49 HD2 PHE 49 4.927 33.018 24.557 389 HE1 PHE 49 HE1 PHE 49 3.297 29.177 21.874 390 HE2 PHE 49 HE2 PHE 49 4.928 30.740 25.530 391 HZ PHE 49 HZ PHE 49 4.115 28.818 24.189 392 H THR 50 HN THR 50 2.660 36.577 23.741 393 HA THR 50 HA THR 50 2.713 38.383 21.337 394 HB THR 50 HB THR 50 1.361 38.811 24.019 395 HG1 THR 50 HG1 THR 50 -0.253 37.909 23.071 396 1HG2 THR 50 HG22 THR 50 1.629 40.550 21.559 397 2HG2 THR 50 HG21 THR 50 0.420 40.833 22.811 398 3HG2 THR 50 HG23 THR 50 2.136 40.929 23.205 399 H LYS 51 HN LYS 51 4.378 39.815 21.274 400 HA LYS 51 HA LYS 51 6.326 39.875 23.459 401 1HB LYS 51 HB2 LYS 51 7.051 40.012 21.087 402 2HB LYS 51 HB1 LYS 51 6.184 41.540 20.921 403 1HG LYS 51 HG2 LYS 51 7.602 42.544 22.678 404 2HG LYS 51 HG1 LYS 51 8.467 41.016 22.847 405 1HD LYS 51 HD2 LYS 51 9.169 41.173 20.473 406 2HD LYS 51 HD1 LYS 51 8.334 42.722 20.344 407 1HE LYS 51 HE2 LYS 51 9.781 43.486 22.325 408 2HE LYS 51 HE1 LYS 51 10.754 42.046 22.028 409 1HZ LYS 51 HZ2 LYS 51 10.913 42.831 19.669 410 2HZ LYS 51 HZ1 LYS 51 10.246 44.307 20.184 411 3HZ LYS 51 HZ3 LYS 51 11.735 43.786 20.808 412 H VAL 52 HN VAL 52 6.675 41.626 24.887 413 HA VAL 52 HA VAL 52 4.708 43.898 24.741 414 HB VAL 52 HB VAL 52 4.612 43.871 27.203 415 1HG1 VAL 52 HG11 VAL 52 4.012 41.191 25.913 416 2HG1 VAL 52 HG13 VAL 52 3.348 41.740 27.449 417 3HG1 VAL 52 HG12 VAL 52 2.933 42.581 25.958 418 1HG2 VAL 52 HG22 VAL 52 6.531 41.564 26.838 419 2HG2 VAL 52 HG21 VAL 52 6.705 42.979 27.872 420 3HG2 VAL 52 HG23 VAL 52 5.550 41.716 28.295 421 H SER 53 HN SER 53 5.687 45.869 24.767 422 HA SER 53 HA SER 53 8.623 45.975 25.107 423 1HB SER 53 HB2 SER 53 7.623 47.181 23.222 424 2HB SER 53 HB1 SER 53 6.616 48.110 24.328 425 HG SER 53 HG SER 53 8.330 49.392 24.067 426 H GLU 54 HN GLU 54 5.942 46.329 27.105 427 HA GLU 54 HA GLU 54 7.593 47.585 29.188 428 1HB GLU 54 HB2 GLU 54 5.658 49.143 29.719 429 2HB GLU 54 HB1 GLU 54 6.586 49.559 28.289 430 1HG GLU 54 HG2 GLU 54 4.889 48.438 26.879 431 2HG GLU 54 HG1 GLU 54 3.959 48.037 28.324 432 H GLY 55 HN GLY 55 6.346 47.517 31.308 433 1HA GLY 55 HA2 GLY 55 4.869 46.423 32.819 434 2HA GLY 55 HA1 GLY 55 4.115 45.611 31.446 435 H GLN 56 HN GLN 56 4.492 43.948 33.460 436 HA GLN 56 HA GLN 56 7.156 42.729 33.436 437 1HB GLN 56 HB2 GLN 56 6.102 41.015 34.904 438 2HB GLN 56 HB1 GLN 56 5.850 42.656 35.498 439 1HG GLN 56 HG2 GLN 56 3.600 42.678 34.450 440 2HG GLN 56 HG1 GLN 56 3.850 41.017 33.907 441 1HE2 GLN 56 HE22 GLN 56 2.475 39.881 36.952 442 2HE2 GLN 56 HE21 GLN 56 2.464 39.802 35.256 443 H ALA 57 HN ALA 57 7.511 40.486 32.779 444 HA ALA 57 HA ALA 57 5.636 39.499 30.662 445 1HB ALA 57 HB2 ALA 57 8.625 39.927 30.523 446 2HB ALA 57 HB1 ALA 57 7.785 38.829 29.428 447 3HB ALA 57 HB3 ALA 57 7.384 40.545 29.434 448 H ASP 58 HN ASP 58 5.279 37.303 30.773 449 HA ASP 58 HA ASP 58 6.044 35.795 33.061 450 1HB ASP 58 HB2 ASP 58 4.994 34.972 30.345 451 2HB ASP 58 HB1 ASP 58 5.318 33.790 31.615 452 H ILE 59 HN ILE 59 7.466 35.893 29.799 453 HA ILE 59 HA ILE 59 9.772 34.255 30.837 454 HB ILE 59 HB ILE 59 8.675 34.483 28.018 455 1HG1 ILE 59 HG12 ILE 59 8.742 32.075 29.854 456 2HG1 ILE 59 HG11 ILE 59 7.345 33.143 29.732 457 1HG2 ILE 59 HG22 ILE 59 11.006 32.941 29.191 458 2HG2 ILE 59 HG21 ILE 59 10.324 32.615 27.598 459 3HG2 ILE 59 HG23 ILE 59 11.069 34.178 27.934 460 1HD1 ILE 59 HD13 ILE 59 7.331 32.719 27.250 461 2HD1 ILE 59 HD12 ILE 59 8.588 31.505 27.507 462 3HD1 ILE 59 HD11 ILE 59 6.991 31.288 28.225 463 H MET 60 HN MET 60 11.433 35.654 31.226 464 HA MET 60 HA MET 60 11.795 38.012 29.429 465 1HB MET 60 HB2 MET 60 12.898 37.337 32.159 466 2HB MET 60 HB1 MET 60 13.464 38.707 31.206 467 1HG MET 60 HG2 MET 60 11.120 39.551 31.098 468 2HG MET 60 HG1 MET 60 10.626 38.230 32.158 469 1HE MET 60 HE3 MET 60 10.866 41.660 32.191 470 2HE MET 60 HE2 MET 60 9.743 40.777 33.224 471 3HE MET 60 HE1 MET 60 10.888 41.907 33.943 472 H ILE 61 HN ILE 61 13.474 38.105 28.037 473 HA ILE 61 HA ILE 61 15.528 35.916 28.116 474 HB ILE 61 HB ILE 61 14.544 37.596 25.788 475 1HG1 ILE 61 HG12 ILE 61 14.270 34.617 26.264 476 2HG1 ILE 61 HG11 ILE 61 13.011 35.777 26.692 477 1HG2 ILE 61 HG21 ILE 61 16.705 35.496 26.060 478 2HG2 ILE 61 HG23 ILE 61 15.941 35.843 24.507 479 3HG2 ILE 61 HG22 ILE 61 16.829 37.110 25.354 480 1HD1 ILE 61 HD13 ILE 61 14.187 35.472 23.912 481 2HD1 ILE 61 HD12 ILE 61 12.660 34.756 24.431 482 3HD1 ILE 61 HD11 ILE 61 12.837 36.512 24.371 483 H SER 62 HN SER 62 17.653 36.521 28.371 484 HA SER 62 HA SER 62 18.439 39.323 27.770 485 1HB SER 62 HB2 SER 62 19.398 39.695 29.961 486 2HB SER 62 HB1 SER 62 17.714 39.227 30.182 487 HG SER 62 HG SER 62 18.346 37.247 30.839 488 H PHE 63 HN PHE 63 20.786 39.593 27.754 489 HA PHE 63 HA PHE 63 22.252 37.036 27.173 490 1HB PHE 63 HB2 PHE 63 22.559 39.838 26.045 491 2HB PHE 63 HB1 PHE 63 23.727 38.559 25.766 492 HD1 PHE 63 HD1 PHE 63 20.312 39.737 25.058 493 HD2 PHE 63 HD2 PHE 63 23.182 36.612 24.387 494 HE1 PHE 63 HE1 PHE 63 18.924 38.859 23.198 495 HE2 PHE 63 HE2 PHE 63 21.793 35.735 22.528 496 HZ PHE 63 HZ PHE 63 19.663 36.859 21.936 497 H VAL 64 HN VAL 64 24.027 36.623 28.468 498 HA VAL 64 HA VAL 64 25.114 38.876 30.142 499 HB VAL 64 HB VAL 64 25.320 37.293 32.015 500 1HG1 VAL 64 HG11 VAL 64 23.283 38.707 31.771 501 2HG1 VAL 64 HG13 VAL 64 22.508 37.393 30.884 502 3HG1 VAL 64 HG12 VAL 64 22.941 37.177 32.580 503 1HG2 VAL 64 HG23 VAL 64 23.927 35.422 30.080 504 2HG2 VAL 64 HG22 VAL 64 25.516 35.203 30.814 505 3HG2 VAL 64 HG21 VAL 64 24.063 35.109 31.812 506 H ARG 65 HN ARG 65 27.282 38.410 31.035 507 HA ARG 65 HA ARG 65 28.911 36.635 29.239 508 1HB ARG 65 HB2 ARG 65 29.534 39.368 30.390 509 2HB ARG 65 HB1 ARG 65 30.752 38.326 29.660 510 1HG ARG 65 HG2 ARG 65 29.489 38.295 27.556 511 2HG ARG 65 HG1 ARG 65 28.243 39.317 28.278 512 1HD ARG 65 HD2 ARG 65 29.896 41.107 28.628 513 2HD ARG 65 HD1 ARG 65 31.167 40.081 27.963 514 HE ARG 65 HE ARG 65 29.230 40.175 25.969 515 1HH1 ARG 65 HH21 ARG 65 31.059 42.439 27.824 516 2HH1 ARG 65 HH22 ARG 65 31.086 43.636 26.573 517 1HH2 ARG 65 HH11 ARG 65 29.257 41.712 24.336 518 2HH2 ARG 65 HH12 ARG 65 30.063 43.224 24.593 519 H GLY 66 HN GLY 66 30.307 35.252 30.268 520 1HA GLY 66 HA2 GLY 66 31.168 33.979 32.043 521 2HA GLY 66 HA1 GLY 66 31.692 35.547 32.646 522 H ASP 67 HN ASP 67 31.348 34.982 34.816 523 HA ASP 67 HA ASP 67 28.895 33.884 35.836 524 1HB ASP 67 HB2 ASP 67 31.117 33.940 37.056 525 2HB ASP 67 HB1 ASP 67 30.850 35.660 37.325 526 H HIS 68 HN HIS 68 26.991 34.880 36.217 527 HA HIS 68 HA HIS 68 26.926 37.868 36.400 528 1HB HIS 68 HB2 HIS 68 24.804 37.800 35.046 529 2HB HIS 68 HB1 HIS 68 26.252 37.377 34.136 530 HD1 HIS 68 HD1 HIS 68 26.710 34.664 33.991 531 HD2 HIS 68 HD2 HIS 68 22.820 35.881 34.871 532 HE1 HIS 68 HE1 HIS 68 25.213 32.673 33.527 533 H ARG 69 HN ARG 69 26.922 36.883 38.711 534 HA ARG 69 HA ARG 69 25.730 36.441 40.673 535 1HB ARG 69 HB2 ARG 69 23.596 37.823 39.020 536 2HB ARG 69 HB1 ARG 69 23.376 37.389 40.713 537 1HG ARG 69 HG2 ARG 69 25.314 38.753 41.340 538 2HG ARG 69 HG1 ARG 69 25.606 39.149 39.646 539 1HD ARG 69 HD2 ARG 69 23.447 40.284 39.504 540 2HD ARG 69 HD1 ARG 69 23.065 39.818 41.158 541 HE ARG 69 HE ARG 69 25.442 41.208 41.415 542 1HH1 ARG 69 HH21 ARG 69 22.388 41.770 39.916 543 2HH1 ARG 69 HH22 ARG 69 22.419 43.481 40.185 544 1HH2 ARG 69 HH11 ARG 69 25.502 43.448 41.771 545 2HH2 ARG 69 HH12 ARG 69 24.177 44.429 41.238 546 H ASP 70 HN ASP 70 26.060 34.234 39.168 547 HA ASP 70 HA ASP 70 23.511 32.750 39.610 548 1HB ASP 70 HB2 ASP 70 23.769 33.415 37.158 549 2HB ASP 70 HB1 ASP 70 25.203 32.383 37.122 550 H ASN 71 HN ASN 71 23.890 30.492 40.079 551 HA ASN 71 HA ASN 71 26.623 29.975 41.096 552 1HB ASN 71 HB2 ASN 71 24.516 29.418 42.420 553 2HB ASN 71 HB1 ASN 71 24.229 28.123 41.258 554 1HD2 ASN 71 HD22 ASN 71 26.165 26.241 43.634 555 2HD2 ASN 71 HD21 ASN 71 24.575 26.624 43.179 556 H SER 72 HN SER 72 25.403 29.824 38.144 557 HA SER 72 HA SER 72 26.928 27.341 37.433 558 1HB SER 72 HB2 SER 72 24.287 28.255 36.259 559 2HB SER 72 HB1 SER 72 25.266 26.929 35.636 560 HG SER 72 HG SER 72 25.105 26.255 38.024 561 HA PRO 73 HA PRO 73 28.216 31.194 35.065 562 1HB PRO 73 HB2 PRO 73 30.978 30.547 35.565 563 2HB PRO 73 HB1 PRO 73 30.060 31.905 36.227 564 1HG PRO 73 HG2 PRO 73 30.933 29.496 37.604 565 2HG PRO 73 HG1 PRO 73 30.123 30.915 38.287 566 1HD PRO 73 HD2 PRO 73 28.980 28.308 37.830 567 2HD PRO 73 HD1 PRO 73 28.155 29.762 38.429 568 H PHE 74 HN PHE 74 29.309 31.083 32.959 569 HA PHE 74 HA PHE 74 29.107 28.445 31.735 570 1HB PHE 74 HB2 PHE 74 29.997 31.145 30.691 571 2HB PHE 74 HB1 PHE 74 29.975 29.690 29.692 572 HD1 PHE 74 HD2 PHE 74 27.907 32.141 31.516 573 HD2 PHE 74 HD1 PHE 74 27.885 28.635 29.034 574 HE1 PHE 74 HE2 PHE 74 25.475 32.449 31.104 575 HE2 PHE 74 HE1 PHE 74 25.462 28.938 28.623 576 HZ PHE 74 HZ PHE 74 24.254 30.844 29.653 577 H ASP 75 HN ASP 75 30.804 27.135 31.033 578 HA ASP 75 HA ASP 75 33.463 27.729 32.215 579 1HB ASP 75 HB2 ASP 75 32.382 25.510 32.644 580 2HB ASP 75 HB1 ASP 75 32.450 25.186 30.913 581 H GLY 76 HN GLY 76 33.633 29.420 30.411 582 1HA GLY 76 HA2 GLY 76 34.714 30.063 28.420 583 2HA GLY 76 HA1 GLY 76 35.408 28.442 28.407 584 HA PRO 77 HA PRO 77 32.426 28.804 24.856 585 1HB PRO 77 HB2 PRO 77 34.336 27.401 23.198 586 2HB PRO 77 HB1 PRO 77 33.847 29.096 23.081 587 1HG PRO 77 HG2 PRO 77 36.385 28.074 24.002 588 2HG PRO 77 HG1 PRO 77 35.868 29.765 23.936 589 1HD PRO 77 HD2 PRO 77 36.139 28.055 26.281 590 2HD PRO 77 HD1 PRO 77 35.769 29.790 26.226 591 H GLY 78 HN GLY 78 33.707 26.515 26.856 592 1HA GLY 78 HA2 GLY 78 32.540 24.169 25.436 593 2HA GLY 78 HA1 GLY 78 33.573 24.100 26.867 594 H GLY 79 HN GLY 79 31.323 22.642 27.048 595 1HA GLY 79 HA2 GLY 79 29.632 22.341 28.688 596 2HA GLY 79 HA1 GLY 79 29.848 24.023 29.178 597 H ASN 80 HN ASN 80 27.389 23.896 29.136 598 HA ASN 80 HA ASN 80 26.030 23.675 26.600 599 1HB ASN 80 HB2 ASN 80 25.183 24.952 29.215 600 2HB ASN 80 HB1 ASN 80 24.109 24.680 27.837 601 1HD2 ASN 80 HD22 ASN 80 24.062 21.736 30.269 602 2HD2 ASN 80 HD21 ASN 80 23.940 23.406 30.538 603 H LEU 81 HN LEU 81 25.003 25.440 25.430 604 HA LEU 81 HA LEU 81 26.713 27.858 25.355 605 1HB LEU 81 HB2 LEU 81 24.361 27.170 23.576 606 2HB LEU 81 HB1 LEU 81 25.672 28.300 23.236 607 HG LEU 81 HG LEU 81 25.872 25.286 23.466 608 1HD1 LEU 81 HD11 LEU 81 24.999 26.194 21.324 609 2HD1 LEU 81 HD13 LEU 81 26.444 27.194 21.179 610 3HD1 LEU 81 HD12 LEU 81 26.579 25.438 21.123 611 1HD2 LEU 81 HD21 LEU 81 27.990 27.438 23.336 612 2HD2 LEU 81 HD23 LEU 81 27.886 26.068 24.442 613 3HD2 LEU 81 HD22 LEU 81 28.309 25.805 22.751 614 H ALA 82 HN ALA 82 23.879 26.873 26.870 615 HA ALA 82 HA ALA 82 23.302 29.482 27.906 616 1HB ALA 82 HB1 ALA 82 21.386 28.436 25.798 617 2HB ALA 82 HB3 ALA 82 21.067 29.801 26.867 618 3HB ALA 82 HB2 ALA 82 22.364 29.899 25.678 619 H HIS 83 HN HIS 83 20.929 29.354 28.935 620 HA HIS 83 HA HIS 83 19.984 26.703 29.617 621 1HB HIS 83 HB2 HIS 83 20.610 26.775 32.010 622 2HB HIS 83 HB1 HIS 83 22.041 26.731 30.976 623 HD1 HIS 83 HD1 HIS 83 23.470 28.885 30.803 624 HD2 HIS 83 HD2 HIS 83 20.219 29.248 33.390 625 HE1 HIS 83 HE1 HIS 83 23.839 31.017 32.121 626 H ALA 84 HN ALA 84 18.333 26.950 31.534 627 HA ALA 84 HA ALA 84 17.253 29.687 31.804 628 1HB ALA 84 HB2 ALA 84 16.335 28.584 29.654 629 2HB ALA 84 HB1 ALA 84 15.435 27.525 30.737 630 3HB ALA 84 HB3 ALA 84 15.163 29.266 30.780 631 H PHE 85 HN PHE 85 15.287 29.647 33.294 632 HA PHE 85 HA PHE 85 15.757 27.645 35.456 633 1HB PHE 85 HB2 PHE 85 14.266 30.287 35.418 634 2HB PHE 85 HB1 PHE 85 14.366 29.227 36.825 635 HD1 PHE 85 HD1 PHE 85 16.477 28.899 38.015 636 HD2 PHE 85 HD2 PHE 85 16.224 31.497 34.607 637 HE1 PHE 85 HE1 PHE 85 18.687 29.869 38.596 638 HE2 PHE 85 HE2 PHE 85 18.434 32.464 35.184 639 HZ PHE 85 HZ PHE 85 19.666 31.650 37.179 640 H GLN 86 HN GLN 86 13.714 26.839 36.587 641 HA GLN 86 HA GLN 86 11.994 25.622 34.649 642 1HB GLN 86 HB2 GLN 86 11.723 25.863 37.658 643 2HB GLN 86 HB1 GLN 86 10.708 24.831 36.660 644 1HG GLN 86 HG2 GLN 86 12.440 23.410 37.458 645 2HG GLN 86 HG1 GLN 86 12.880 23.784 35.791 646 1HE2 GLN 86 HE22 GLN 86 16.018 24.918 36.917 647 2HE2 GLN 86 HE21 GLN 86 15.149 23.945 35.834 648 HA PRO 87 HA PRO 87 8.896 28.760 34.117 649 1HB PRO 87 HB2 PRO 87 6.621 26.983 34.204 650 2HB PRO 87 HB1 PRO 87 7.419 27.645 32.775 651 1HG PRO 87 HG2 PRO 87 7.562 24.921 33.813 652 2HG PRO 87 HG1 PRO 87 8.205 25.550 32.290 653 1HD PRO 87 HD2 PRO 87 9.722 24.801 34.587 654 2HD PRO 87 HD1 PRO 87 10.324 25.637 33.141 655 H GLY 88 HN GLY 88 8.785 29.956 36.020 656 1HA GLY 88 HA2 GLY 88 6.645 29.388 37.889 657 2HA GLY 88 HA1 GLY 88 8.228 29.111 38.613 658 HA PRO 89 HA PRO 89 6.932 33.721 38.653 659 1HB PRO 89 HB2 PRO 89 7.044 33.701 41.541 660 2HB PRO 89 HB1 PRO 89 5.618 33.949 40.521 661 1HG PRO 89 HG2 PRO 89 6.329 31.582 42.080 662 2HG PRO 89 HG1 PRO 89 4.831 31.904 41.196 663 1HD PRO 89 HD2 PRO 89 6.895 30.061 40.448 664 2HD PRO 89 HD1 PRO 89 5.482 30.532 39.482 665 H GLY 90 HN GLY 90 8.323 35.310 40.325 666 1HA GLY 90 HA2 GLY 90 10.470 36.066 40.898 667 2HA GLY 90 HA1 GLY 90 10.871 34.381 41.214 668 H ILE 91 HN ILE 91 12.756 34.036 40.174 669 HA ILE 91 HA ILE 91 13.366 35.272 37.589 670 HB ILE 91 HB ILE 91 15.073 34.865 39.391 671 1HG1 ILE 91 HG12 ILE 91 15.780 33.284 36.909 672 2HG1 ILE 91 HG11 ILE 91 15.581 35.033 36.866 673 1HG2 ILE 91 HG21 ILE 91 14.060 32.578 39.947 674 2HG2 ILE 91 HG23 ILE 91 14.920 31.969 38.535 675 3HG2 ILE 91 HG22 ILE 91 15.818 32.654 39.887 676 1HD1 ILE 91 HD13 ILE 91 17.297 35.280 38.626 677 2HD1 ILE 91 HD12 ILE 91 17.508 33.528 38.660 678 3HD1 ILE 91 HD11 ILE 91 17.948 34.441 37.216 679 H GLY 92 HN GLY 92 11.506 32.673 38.470 680 1HA GLY 92 HA2 GLY 92 12.315 30.607 36.683 681 2HA GLY 92 HA1 GLY 92 10.677 30.823 37.285 682 H GLY 93 HN GLY 93 11.726 30.154 34.541 683 1HA GLY 93 HA2 GLY 93 10.685 30.542 32.432 684 2HA GLY 93 HA1 GLY 93 9.986 32.030 33.072 685 H ASP 94 HN ASP 94 12.718 32.827 34.129 686 HA ASP 94 HA ASP 94 13.524 34.424 31.901 687 1HB ASP 94 HB2 ASP 94 14.997 33.656 34.433 688 2HB ASP 94 HB1 ASP 94 15.625 34.814 33.255 689 H ALA 95 HN ALA 95 15.403 34.253 30.573 690 HA ALA 95 HA ALA 95 16.724 31.566 30.488 691 1HB ALA 95 HB3 ALA 95 14.791 31.821 28.806 692 2HB ALA 95 HB2 ALA 95 15.813 33.000 27.988 693 3HB ALA 95 HB1 ALA 95 16.353 31.330 28.154 694 H HIS 96 HN HIS 96 18.878 31.790 30.389 695 HA HIS 96 HA HIS 96 20.029 34.461 29.685 696 1HB HIS 96 HB2 HIS 96 21.109 32.141 31.311 697 2HB HIS 96 HB1 HIS 96 22.026 33.601 30.941 698 HD2 HIS 96 HD2 HIS 96 18.431 34.779 31.753 699 HE1 HIS 96 HE1 HIS 96 20.694 34.707 35.351 700 HE2 HIS 96 HE2 HIS 96 18.546 35.494 34.268 701 H PHE 97 HN PHE 97 21.424 34.640 27.975 702 HA PHE 97 HA PHE 97 22.157 32.137 26.475 703 1HB PHE 97 HB2 PHE 97 21.561 34.965 25.591 704 2HB PHE 97 HB1 PHE 97 22.448 33.850 24.551 705 HD1 PHE 97 HD1 PHE 97 19.281 34.210 26.506 706 HD2 PHE 97 HD2 PHE 97 21.297 32.235 23.263 707 HE1 PHE 97 HE1 PHE 97 17.140 33.170 25.803 708 HE2 PHE 97 HE2 PHE 97 19.154 31.201 22.562 709 HZ PHE 97 HZ PHE 97 17.080 31.667 23.836 710 H ASP 98 HN ASP 98 24.324 31.753 26.100 711 HA ASP 98 HA ASP 98 26.322 33.193 27.595 712 1HB ASP 98 HB2 ASP 98 26.424 30.762 26.795 713 2HB ASP 98 HB1 ASP 98 26.840 31.399 25.206 714 H GLU 99 HN GLU 99 26.517 35.323 27.060 715 HA GLU 99 HA GLU 99 26.511 36.252 24.303 716 1HB GLU 99 HB2 GLU 99 25.690 37.549 26.310 717 2HB GLU 99 HB1 GLU 99 27.371 37.751 26.782 718 1HG GLU 99 HG2 GLU 99 27.885 38.948 24.757 719 2HG GLU 99 HG1 GLU 99 26.305 38.571 24.071 720 H ASP 100 HN ASP 100 28.907 34.842 26.259 721 HA ASP 100 HA ASP 100 31.162 36.427 25.340 722 1HB ASP 100 HB2 ASP 100 30.989 33.658 26.571 723 2HB ASP 100 HB1 ASP 100 32.505 34.498 26.244 724 H GLU 101 HN GLU 101 29.335 33.774 24.066 725 HA GLU 101 HA GLU 101 31.372 33.051 22.057 726 1HB GLU 101 HB2 GLU 101 28.529 32.147 22.568 727 2HB GLU 101 HB1 GLU 101 29.499 31.556 21.218 728 1HG GLU 101 HG2 GLU 101 31.183 30.691 22.735 729 2HG GLU 101 HG1 GLU 101 30.361 31.410 24.120 730 H ARG 102 HN ARG 102 30.812 33.215 19.705 731 HA ARG 102 HA ARG 102 29.497 35.827 19.179 732 1HB ARG 102 HB2 ARG 102 31.736 35.287 18.194 733 2HB ARG 102 HB1 ARG 102 30.976 33.994 17.268 734 1HG ARG 102 HG2 ARG 102 29.483 35.631 16.192 735 2HG ARG 102 HG1 ARG 102 30.233 36.930 17.120 736 1HD ARG 102 HD2 ARG 102 32.433 36.330 16.087 737 2HD ARG 102 HD1 ARG 102 31.598 35.142 15.085 738 HE ARG 102 HE ARG 102 30.224 37.496 14.596 739 1HH1 ARG 102 HH21 ARG 102 33.522 36.473 14.520 740 2HH1 ARG 102 HH22 ARG 102 33.964 37.565 13.249 741 1HH2 ARG 102 HH11 ARG 102 30.789 38.920 12.943 742 2HH2 ARG 102 HH12 ARG 102 32.420 38.949 12.360 743 H TRP 103 HN TRP 103 27.399 35.841 18.666 744 HA TRP 103 HA TRP 103 26.062 33.368 17.769 745 1HB TRP 103 HB2 TRP 103 25.080 36.113 18.585 746 2HB TRP 103 HB1 TRP 103 24.002 34.875 17.940 747 HD1 TRP 103 HD1 TRP 103 25.326 36.074 21.125 748 HE1 TRP 103 HE1 TRP 103 25.045 34.293 22.975 749 HE3 TRP 103 HE3 TRP 103 24.215 32.012 18.259 750 HZ2 TRP 103 HZ2 TRP 103 24.428 31.499 23.197 751 HZ3 TRP 103 HZ3 TRP 103 23.788 29.806 19.301 752 HH2 TRP 103 HH2 TRP 103 23.893 29.544 21.764 753 H THR 104 HN THR 104 25.217 33.056 15.742 754 HA THR 104 HA THR 104 25.373 35.294 13.763 755 HB THR 104 HB THR 104 26.300 33.773 12.095 756 HG1 THR 104 HG1 THR 104 27.112 31.705 13.254 757 1HG2 THR 104 HG22 THR 104 27.783 34.994 13.831 758 2HG2 THR 104 HG21 THR 104 28.003 33.399 14.550 759 3HG2 THR 104 HG23 THR 104 28.515 33.697 12.891 760 H ASN 105 HN ASN 105 24.047 34.743 11.795 761 HA ASN 105 HA ASN 105 21.661 33.084 12.549 762 1HB ASN 105 HB2 ASN 105 21.850 35.566 10.822 763 2HB ASN 105 HB1 ASN 105 20.382 34.613 11.056 764 1HD2 ASN 105 HD22 ASN 105 20.521 35.453 14.717 765 2HD2 ASN 105 HD21 ASN 105 20.639 34.009 13.828 766 H ASN 106 HN ASN 106 24.070 32.116 11.252 767 HA ASN 106 HA ASN 106 22.795 31.007 8.823 768 1HB ASN 106 HB2 ASN 106 25.082 31.479 7.632 769 2HB ASN 106 HB1 ASN 106 23.888 32.769 7.744 770 1HD2 ASN 106 HD22 ASN 106 26.453 34.755 9.141 771 2HD2 ASN 106 HD21 ASN 106 25.411 34.518 7.821 772 H PHE 107 HN PHE 107 25.027 29.632 7.833 773 HA PHE 107 HA PHE 107 25.210 27.497 9.796 774 1HB PHE 107 HB2 PHE 107 26.493 26.314 8.097 775 2HB PHE 107 HB1 PHE 107 25.115 27.106 7.324 776 HD1 PHE 107 HD2 PHE 107 25.418 29.079 5.907 777 HD2 PHE 107 HD1 PHE 107 28.766 27.141 7.776 778 HE1 PHE 107 HE2 PHE 107 26.971 30.338 4.439 779 HE2 PHE 107 HE1 PHE 107 30.315 28.401 6.311 780 HZ PHE 107 HZ PHE 107 29.419 29.999 4.643 781 H ARG 108 HN ARG 108 26.707 30.345 9.941 782 HA ARG 108 HA ARG 108 29.491 29.771 10.071 783 1HB ARG 108 HB2 ARG 108 27.818 31.831 11.518 784 2HB ARG 108 HB1 ARG 108 29.571 31.768 11.642 785 1HG ARG 108 HG2 ARG 108 29.782 31.998 9.212 786 2HG ARG 108 HG1 ARG 108 28.029 32.037 9.051 787 1HD ARG 108 HD2 ARG 108 27.974 34.066 10.489 788 2HD ARG 108 HD1 ARG 108 29.734 34.035 10.566 789 HE ARG 108 HE ARG 108 29.183 34.043 7.850 790 1HH1 ARG 108 HH21 ARG 108 28.282 35.920 10.596 791 2HH1 ARG 108 HH22 ARG 108 28.140 37.400 9.706 792 1HH2 ARG 108 HH11 ARG 108 29.007 35.958 6.668 793 2HH2 ARG 108 HH12 ARG 108 28.549 37.421 7.477 794 H GLU 109 HN GLU 109 30.126 30.591 12.772 795 HA GLU 109 HA GLU 109 30.627 28.171 13.999 796 1HB GLU 109 HB2 GLU 109 30.081 30.848 15.306 797 2HB GLU 109 HB1 GLU 109 30.760 29.459 16.154 798 1HG GLU 109 HG2 GLU 109 32.641 29.395 14.566 799 2HG GLU 109 HG1 GLU 109 31.970 30.783 13.711 800 H TYR 110 HN TYR 110 27.903 30.291 15.066 801 HA TYR 110 HA TYR 110 26.362 27.793 15.644 802 1HB TYR 110 HB2 TYR 110 26.846 30.052 17.605 803 2HB TYR 110 HB1 TYR 110 25.682 28.750 17.845 804 HD1 TYR 110 HD2 TYR 110 26.470 26.386 18.059 805 HD2 TYR 110 HD1 TYR 110 29.202 29.695 17.888 806 HE1 TYR 110 HE2 TYR 110 28.282 24.937 18.938 807 HE2 TYR 110 HE1 TYR 110 31.014 28.247 18.761 808 HH TYR 110 HH TYR 110 30.425 25.202 20.144 809 H ASN 111 HN ASN 111 24.141 28.011 15.483 810 HA ASN 111 HA ASN 111 23.188 30.556 14.253 811 1HB ASN 111 HB2 ASN 111 21.914 27.802 14.365 812 2HB ASN 111 HB1 ASN 111 21.235 29.217 13.553 813 1HD2 ASN 111 HD22 ASN 111 24.740 27.770 11.956 814 2HD2 ASN 111 HD21 ASN 111 24.565 27.822 13.642 815 H LEU 112 HN LEU 112 22.312 31.922 15.687 816 HA LEU 112 HA LEU 112 21.605 31.289 18.349 817 1HB LEU 112 HB2 LEU 112 22.110 33.560 17.606 818 2HB LEU 112 HB1 LEU 112 20.668 33.571 16.590 819 HG LEU 112 HG LEU 112 19.246 33.345 18.597 820 1HD1 LEU 112 HD11 LEU 112 21.934 33.159 19.957 821 2HD1 LEU 112 HD13 LEU 112 20.543 33.802 20.833 822 3HD1 LEU 112 HD12 LEU 112 20.496 32.161 20.193 823 1HD2 LEU 112 HD21 LEU 112 21.304 35.569 18.681 824 2HD2 LEU 112 HD23 LEU 112 19.758 35.589 17.832 825 3HD2 LEU 112 HD22 LEU 112 19.796 35.584 19.595 826 H HIS 113 HN HIS 113 19.552 31.459 15.444 827 HA HIS 113 HA HIS 113 17.051 31.251 16.745 828 1HB HIS 113 HB2 HIS 113 17.297 31.760 14.351 829 2HB HIS 113 HB1 HIS 113 17.847 30.113 14.054 830 HD1 HIS 113 HD1 HIS 113 15.727 29.732 12.515 831 HD2 HIS 113 HD2 HIS 113 14.849 30.500 16.517 832 HE1 HIS 113 HE1 HIS 113 13.281 29.159 12.833 833 H ARG 114 HN ARG 114 19.119 28.561 15.531 834 HA ARG 114 HA ARG 114 17.318 26.494 16.310 835 1HB ARG 114 HB2 ARG 114 20.307 26.586 15.904 836 2HB ARG 114 HB1 ARG 114 19.528 25.111 16.481 837 1HG ARG 114 HG2 ARG 114 19.711 25.051 14.037 838 2HG ARG 114 HG1 ARG 114 18.015 25.161 14.507 839 1HD ARG 114 HD2 ARG 114 17.856 27.420 13.869 840 2HD ARG 114 HD1 ARG 114 19.598 27.654 13.935 841 HE ARG 114 HE ARG 114 19.291 25.775 11.938 842 1HH1 ARG 114 HH21 ARG 114 17.848 28.835 12.639 843 2HH1 ARG 114 HH22 ARG 114 17.714 29.295 10.975 844 1HH2 ARG 114 HH11 ARG 114 19.137 26.372 9.774 845 2HH2 ARG 114 HH12 ARG 114 18.449 27.903 9.354 846 H VAL 115 HN VAL 115 19.931 28.072 18.163 847 HA VAL 115 HA VAL 115 19.539 26.406 20.498 848 HB VAL 115 HB VAL 115 20.879 29.099 20.137 849 1HG1 VAL 115 HG13 VAL 115 20.609 27.316 22.568 850 2HG1 VAL 115 HG12 VAL 115 21.914 28.488 22.404 851 3HG1 VAL 115 HG11 VAL 115 20.238 29.035 22.438 852 1HG2 VAL 115 HG21 VAL 115 21.951 27.176 19.013 853 2HG2 VAL 115 HG23 VAL 115 22.936 27.744 20.362 854 3HG2 VAL 115 HG22 VAL 115 21.954 26.286 20.534 855 H ALA 116 HN ALA 116 18.314 29.596 19.507 856 HA ALA 116 HA ALA 116 17.061 30.320 21.931 857 1HB ALA 116 HB3 ALA 116 16.082 30.803 19.099 858 2HB ALA 116 HB2 ALA 116 15.506 31.651 20.534 859 3HB ALA 116 HB1 ALA 116 17.177 31.847 20.007 860 H ALA 117 HN ALA 117 15.694 28.437 19.208 861 HA ALA 117 HA ALA 117 13.177 27.910 20.427 862 1HB ALA 117 HB3 ALA 117 13.760 27.462 18.022 863 2HB ALA 117 HB2 ALA 117 14.687 26.061 18.561 864 3HB ALA 117 HB1 ALA 117 12.944 26.119 18.820 865 H HIS 118 HN HIS 118 16.274 26.188 20.625 866 HA HIS 118 HA HIS 118 15.350 23.928 22.091 867 1HB HIS 118 HB2 HIS 118 17.631 24.151 21.097 868 2HB HIS 118 HB1 HIS 118 18.026 25.338 22.342 869 HD1 HIS 118 HD1 HIS 118 17.596 21.696 21.762 870 HD2 HIS 118 HD2 HIS 118 18.203 24.234 25.011 871 HE1 HIS 118 HE1 HIS 118 18.272 20.222 23.704 872 H GLU 119 HN GLU 119 16.673 27.046 23.256 873 HA GLU 119 HA GLU 119 16.348 26.501 26.039 874 1HB GLU 119 HB2 GLU 119 16.318 29.094 24.476 875 2HB GLU 119 HB1 GLU 119 16.225 29.044 26.234 876 1HG GLU 119 HG2 GLU 119 18.449 27.736 24.647 877 2HG GLU 119 HG1 GLU 119 18.559 29.363 25.315 878 H LEU 120 HN LEU 120 14.133 27.877 23.625 879 HA LEU 120 HA LEU 120 12.032 28.484 25.485 880 1HB LEU 120 HB2 LEU 120 11.979 27.929 22.508 881 2HB LEU 120 HB1 LEU 120 10.576 28.477 23.420 882 HG LEU 120 HG LEU 120 13.227 29.954 23.343 883 1HD1 LEU 120 HD13 LEU 120 12.021 29.811 21.113 884 2HD1 LEU 120 HD12 LEU 120 10.687 30.685 21.863 885 3HD1 LEU 120 HD11 LEU 120 12.272 31.444 21.723 886 1HD2 LEU 120 HD23 LEU 120 10.542 30.462 24.613 887 2HD2 LEU 120 HD22 LEU 120 12.158 30.753 25.255 888 3HD2 LEU 120 HD21 LEU 120 11.486 31.842 24.049 889 H GLY 121 HN GLY 121 12.762 25.569 23.578 890 1HA GLY 121 HA2 GLY 121 10.386 24.141 24.122 891 2HA GLY 121 HA1 GLY 121 11.955 23.377 23.858 892 H HIS 122 HN HIS 122 13.344 24.461 26.067 893 HA HIS 122 HA HIS 122 12.526 22.687 28.176 894 1HB HIS 122 HB2 HIS 122 14.441 25.030 28.092 895 2HB HIS 122 HB1 HIS 122 14.177 24.079 29.555 896 HD1 HIS 122 HD1 HIS 122 14.333 21.295 28.920 897 HD2 HIS 122 HD2 HIS 122 16.567 24.013 26.682 898 HE1 HIS 122 HE1 HIS 122 16.192 19.963 27.822 899 H SER 123 HN SER 123 12.079 26.154 27.595 900 HA SER 123 HA SER 123 10.933 26.874 30.074 901 1HB SER 123 HB2 SER 123 10.071 27.916 27.361 902 2HB SER 123 HB1 SER 123 9.943 28.749 28.908 903 HG SER 123 HG SER 123 11.906 28.924 27.253 904 H LEU 124 HN LEU 124 9.599 25.131 27.337 905 HA LEU 124 HA LEU 124 6.849 25.236 28.378 906 1HB LEU 124 HB2 LEU 124 8.093 23.631 26.122 907 2HB LEU 124 HB1 LEU 124 6.370 23.683 26.480 908 HG LEU 124 HG LEU 124 8.008 26.167 25.873 909 1HD1 LEU 124 HD11 LEU 124 7.996 24.530 23.960 910 2HD1 LEU 124 HD13 LEU 124 6.235 24.616 23.966 911 3HD1 LEU 124 HD12 LEU 124 7.186 26.053 23.597 912 1HD2 LEU 124 HD23 LEU 124 5.052 25.548 26.128 913 2HD2 LEU 124 HD22 LEU 124 5.982 26.804 26.945 914 3HD2 LEU 124 HD21 LEU 124 5.617 26.957 25.232 915 H GLY 125 HN GLY 125 9.572 23.655 29.314 916 1HA GLY 125 HA2 GLY 125 9.732 21.974 30.981 917 2HA GLY 125 HA1 GLY 125 8.018 21.630 30.769 918 H LEU 126 HN LEU 126 9.748 21.725 27.806 919 HA LEU 126 HA LEU 126 9.288 18.874 27.409 920 1HB LEU 126 HB2 LEU 126 10.816 20.874 25.716 921 2HB LEU 126 HB1 LEU 126 10.410 19.233 25.218 922 HG LEU 126 HG LEU 126 8.354 21.305 26.032 923 1HD1 LEU 126 HD13 LEU 126 9.597 21.982 24.004 924 2HD1 LEU 126 HD12 LEU 126 9.219 20.433 23.259 925 3HD1 LEU 126 HD11 LEU 126 7.926 21.573 23.630 926 1HD2 LEU 126 HD21 LEU 126 8.238 18.493 24.935 927 2HD2 LEU 126 HD23 LEU 126 7.314 19.209 26.255 928 3HD2 LEU 126 HD22 LEU 126 6.931 19.626 24.589 929 H SER 127 HN SER 127 10.854 17.249 27.195 930 HA SER 127 HA SER 127 13.497 17.866 28.468 931 1HB SER 127 HB2 SER 127 11.892 15.302 28.286 932 2HB SER 127 HB1 SER 127 13.532 15.391 28.928 933 HG SER 127 HG SER 127 11.325 15.794 30.236 934 H HIS 128 HN HIS 128 15.362 16.756 27.584 935 HA HIS 128 HA HIS 128 15.688 16.938 24.787 936 1HB HIS 128 HB2 HIS 128 17.174 15.212 26.792 937 2HB HIS 128 HB1 HIS 128 17.741 15.565 25.162 938 HD1 HIS 128 HD1 HIS 128 18.951 16.506 28.075 939 HD2 HIS 128 HD2 HIS 128 16.986 18.851 25.241 940 HE1 HIS 128 HE1 HIS 128 19.668 18.897 28.505 941 H SER 129 HN SER 129 16.339 14.939 23.376 942 HA SER 129 HA SER 129 14.848 12.471 24.018 943 1HB SER 129 HB2 SER 129 13.171 13.955 22.908 944 2HB SER 129 HB1 SER 129 14.229 14.048 21.503 945 HG SER 129 HG SER 129 13.208 12.293 20.936 946 H THR 130 HN THR 130 15.232 10.808 22.216 947 HA THR 130 HA THR 130 18.075 11.015 21.369 948 HB THR 130 HB THR 130 17.934 8.599 21.018 949 HG1 THR 130 HG1 THR 130 15.599 8.873 20.381 950 1HG2 THR 130 HG23 THR 130 16.660 9.558 23.594 951 2HG2 THR 130 HG22 THR 130 17.253 7.915 23.344 952 3HG2 THR 130 HG21 THR 130 18.376 9.274 23.297 953 H ASP 131 HN ASP 131 15.345 12.029 20.000 954 HA ASP 131 HA ASP 131 15.575 10.744 17.369 955 1HB ASP 131 HB2 ASP 131 13.381 11.527 18.199 956 2HB ASP 131 HB1 ASP 131 13.992 13.178 18.258 957 H ILE 132 HN ILE 132 17.159 11.317 15.984 958 HA ILE 132 HA ILE 132 18.923 13.513 16.378 959 HB ILE 132 HB ILE 132 18.314 11.950 13.851 960 1HG1 ILE 132 HG12 ILE 132 20.638 11.639 15.770 961 2HG1 ILE 132 HG11 ILE 132 19.143 10.725 15.959 962 1HG2 ILE 132 HG22 ILE 132 20.572 13.831 14.596 963 2HG2 ILE 132 HG21 ILE 132 20.649 12.714 13.234 964 3HG2 ILE 132 HG23 ILE 132 19.446 14.003 13.252 965 1HD1 ILE 132 HD13 ILE 132 19.412 9.853 13.641 966 2HD1 ILE 132 HD12 ILE 132 20.951 10.709 13.522 967 3HD1 ILE 132 HD11 ILE 132 20.759 9.397 14.687 968 H GLY 133 HN GLY 133 16.043 13.195 14.319 969 1HA GLY 133 HA2 GLY 133 16.374 15.780 13.068 970 2HA GLY 133 HA1 GLY 133 14.912 14.799 13.036 971 H ALA 134 HN ALA 134 15.767 15.165 16.249 972 HA ALA 134 HA ALA 134 13.688 17.267 16.579 973 1HB ALA 134 HB1 ALA 134 15.039 15.365 18.502 974 2HB ALA 134 HB3 ALA 134 13.985 16.668 19.047 975 3HB ALA 134 HB2 ALA 134 13.346 15.394 18.013 976 H LEU 135 HN LEU 135 14.127 19.291 17.327 977 HA LEU 135 HA LEU 135 16.851 20.267 17.290 978 1HB LEU 135 HB2 LEU 135 14.320 21.565 18.360 979 2HB LEU 135 HB1 LEU 135 15.842 22.399 18.042 980 HG LEU 135 HG LEU 135 14.200 20.926 15.955 981 1HD1 LEU 135 HD11 LEU 135 13.159 23.031 16.849 982 2HD1 LEU 135 HD13 LEU 135 14.599 23.907 16.332 983 3HD1 LEU 135 HD12 LEU 135 13.570 23.119 15.136 984 1HD2 LEU 135 HD22 LEU 135 16.838 22.386 15.916 985 2HD2 LEU 135 HD21 LEU 135 16.387 20.880 15.121 986 3HD2 LEU 135 HD23 LEU 135 15.816 22.416 14.478 987 H MET 136 HN MET 136 14.662 19.123 19.763 988 HA MET 136 HA MET 136 16.148 20.187 22.004 989 1HB MET 136 HB2 MET 136 14.271 17.802 21.918 990 2HB MET 136 HB1 MET 136 14.773 18.680 23.363 991 1HG MET 136 HG2 MET 136 13.214 19.866 21.045 992 2HG MET 136 HG1 MET 136 12.531 19.408 22.604 993 1HE MET 136 HE3 MET 136 13.242 20.118 24.710 994 2HE MET 136 HE2 MET 136 14.951 20.546 24.752 995 3HE MET 136 HE1 MET 136 13.736 21.761 25.139 996 H TYR 137 HN TYR 137 17.449 18.355 19.794 997 HA TYR 137 HA TYR 137 18.309 15.980 21.108 998 1HB TYR 137 HB2 TYR 137 18.611 16.678 18.613 999 2HB TYR 137 HB1 TYR 137 20.070 17.496 19.168 1000 HD1 TYR 137 HD2 TYR 137 18.321 14.193 19.377 1001 HD2 TYR 137 HD1 TYR 137 22.088 16.267 19.343 1002 HE1 TYR 137 HE2 TYR 137 19.520 12.023 19.374 1003 HE2 TYR 137 HE1 TYR 137 23.283 14.092 19.341 1004 HH TYR 137 HH TYR 137 21.486 11.011 19.244 1005 HA PRO 138 HA PRO 138 20.854 17.807 24.301 1006 1HB PRO 138 HB2 PRO 138 22.840 15.670 24.168 1007 2HB PRO 138 HB1 PRO 138 21.633 15.975 25.424 1008 1HG PRO 138 HG2 PRO 138 21.586 13.907 23.407 1009 2HG PRO 138 HG1 PRO 138 20.374 14.224 24.656 1010 1HD PRO 138 HD2 PRO 138 20.111 14.689 21.836 1011 2HD PRO 138 HD1 PRO 138 18.945 15.100 23.107 1012 H SER 139 HN SER 139 22.683 16.350 21.567 1013 HA SER 139 HA SER 139 24.795 18.389 21.852 1014 1HB SER 139 HB2 SER 139 24.416 16.156 19.842 1015 2HB SER 139 HB1 SER 139 25.828 17.202 19.923 1016 HG SER 139 HG SER 139 26.454 15.645 21.236 1017 H TYR 140 HN TYR 140 25.353 19.894 20.200 1018 HA TYR 140 HA TYR 140 23.089 21.090 18.825 1019 1HB TYR 140 HB2 TYR 140 24.993 22.435 19.684 1020 2HB TYR 140 HB1 TYR 140 26.060 21.644 18.528 1021 HD1 TYR 140 HD1 TYR 140 25.862 22.082 16.115 1022 HD2 TYR 140 HD2 TYR 140 23.343 24.080 18.965 1023 HE1 TYR 140 HE1 TYR 140 25.218 23.740 14.383 1024 HE2 TYR 140 HE2 TYR 140 22.693 25.736 17.231 1025 HH TYR 140 HH TYR 140 22.679 25.531 14.410 1026 H THR 141 HN THR 141 22.568 20.929 16.640 1027 HA THR 141 HA THR 141 24.383 19.391 14.848 1028 HB THR 141 HB THR 141 22.501 17.967 14.108 1029 HG1 THR 141 HG1 THR 141 21.003 18.624 16.332 1030 1HG2 THR 141 HG23 THR 141 24.063 17.323 16.011 1031 2HG2 THR 141 HG22 THR 141 22.783 17.821 17.116 1032 3HG2 THR 141 HG21 THR 141 22.510 16.487 15.995 1033 H PHE 142 HN PHE 142 24.208 20.033 12.720 1034 HA PHE 142 HA PHE 142 22.820 22.556 12.242 1035 1HB PHE 142 HB2 PHE 142 25.051 22.159 11.310 1036 2HB PHE 142 HB1 PHE 142 24.446 20.770 10.409 1037 HD1 PHE 142 HD2 PHE 142 24.412 24.443 10.691 1038 HD2 PHE 142 HD1 PHE 142 23.047 21.046 8.447 1039 HE1 PHE 142 HE2 PHE 142 23.721 25.947 8.839 1040 HE2 PHE 142 HE1 PHE 142 22.354 22.544 6.599 1041 HZ PHE 142 HZ PHE 142 22.688 24.992 6.792 1042 H SER 143 HN SER 143 20.784 22.726 11.460 1043 HA SER 143 HA SER 143 19.606 20.394 9.965 1044 1HB SER 143 HB2 SER 143 18.508 20.780 12.164 1045 2HB SER 143 HB1 SER 143 18.181 22.444 11.697 1046 HG SER 143 HG SER 143 16.734 20.302 11.175 1047 H GLY 144 HN GLY 144 19.276 20.899 7.861 1048 1HA GLY 144 HA2 GLY 144 19.747 23.378 6.663 1049 2HA GLY 144 HA1 GLY 144 18.670 22.162 5.968 1050 H ASP 145 HN ASP 145 16.415 22.329 6.357 1051 HA ASP 145 HA ASP 145 15.481 25.047 6.889 1052 1HB ASP 145 HB2 ASP 145 14.038 22.442 6.309 1053 2HB ASP 145 HB1 ASP 145 13.206 23.979 6.555 1054 H VAL 146 HN VAL 146 14.227 25.685 8.705 1055 HA VAL 146 HA VAL 146 14.650 23.993 11.116 1056 HB VAL 146 HB VAL 146 13.630 26.837 10.839 1057 1HG1 VAL 146 HG11 VAL 146 14.511 25.224 13.253 1058 2HG1 VAL 146 HG13 VAL 146 14.130 26.944 13.273 1059 3HG1 VAL 146 HG12 VAL 146 12.870 25.768 12.915 1060 1HG2 VAL 146 HG21 VAL 146 16.358 25.658 11.408 1061 2HG2 VAL 146 HG23 VAL 146 15.913 26.781 10.124 1062 3HG2 VAL 146 HG22 VAL 146 15.945 27.328 11.800 1063 H GLN 147 HN GLN 147 13.035 22.504 11.309 1064 HA GLN 147 HA GLN 147 10.233 23.518 11.429 1065 1HB GLN 147 HB2 GLN 147 11.204 21.151 9.804 1066 2HB GLN 147 HB1 GLN 147 9.510 21.420 10.214 1067 1HG GLN 147 HG2 GLN 147 9.569 23.609 9.101 1068 2HG GLN 147 HG1 GLN 147 11.274 23.381 8.723 1069 1HE2 GLN 147 HE22 GLN 147 10.069 22.147 5.617 1070 2HE2 GLN 147 HE21 GLN 147 10.804 23.460 6.403 1071 H LEU 148 HN LEU 148 8.856 22.143 12.744 1072 HA LEU 148 HA LEU 148 10.318 20.892 14.934 1073 1HB LEU 148 HB2 LEU 148 7.341 20.986 14.360 1074 2HB LEU 148 HB1 LEU 148 8.073 20.457 15.877 1075 HG LEU 148 HG LEU 148 8.412 23.217 14.653 1076 1HD1 LEU 148 HD12 LEU 148 6.099 22.612 15.554 1077 2HD1 LEU 148 HD11 LEU 148 6.855 22.478 17.139 1078 3HD1 LEU 148 HD13 LEU 148 6.866 24.020 16.286 1079 1HD2 LEU 148 HD22 LEU 148 9.527 21.840 17.087 1080 2HD2 LEU 148 HD21 LEU 148 10.316 22.960 15.977 1081 3HD2 LEU 148 HD23 LEU 148 9.184 23.567 17.182 1082 H ALA 149 HN ALA 149 10.107 18.653 15.557 1083 HA ALA 149 HA ALA 149 9.766 16.845 13.202 1084 1HB ALA 149 HB2 ALA 149 11.925 16.745 14.419 1085 2HB ALA 149 HB1 ALA 149 11.062 16.336 15.900 1086 3HB ALA 149 HB3 ALA 149 11.047 15.221 14.535 1087 H GLN 150 HN GLN 150 8.679 14.746 13.626 1088 HA GLN 150 HA GLN 150 6.097 15.075 14.770 1089 1HB GLN 150 HB2 GLN 150 6.614 13.366 13.066 1090 2HB GLN 150 HB1 GLN 150 7.621 12.504 14.230 1091 1HG GLN 150 HG2 GLN 150 5.670 12.138 15.681 1092 2HG GLN 150 HG1 GLN 150 4.655 13.050 14.565 1093 1HE2 GLN 150 HE22 GLN 150 4.388 9.361 13.826 1094 2HE2 GLN 150 HE21 GLN 150 4.165 10.282 15.235 1095 H ASP 151 HN ASP 151 9.054 13.637 16.094 1096 HA ASP 151 HA ASP 151 7.943 12.593 18.488 1097 1HB ASP 151 HB2 ASP 151 10.227 12.087 17.708 1098 2HB ASP 151 HB1 ASP 151 10.704 13.753 18.013 1099 H ASP 152 HN ASP 152 9.190 15.854 17.747 1100 HA ASP 152 HA ASP 152 8.741 16.810 20.465 1101 1HB ASP 152 HB2 ASP 152 9.296 18.238 17.847 1102 2HB ASP 152 HB1 ASP 152 9.171 19.059 19.403 1103 H ILE 153 HN ILE 153 7.033 17.074 17.352 1104 HA ILE 153 HA ILE 153 4.968 18.827 18.222 1105 HB ILE 153 HB ILE 153 5.003 16.662 16.105 1106 1HG1 ILE 153 HG12 ILE 153 5.032 19.678 15.829 1107 2HG1 ILE 153 HG11 ILE 153 6.505 18.708 15.912 1108 1HG2 ILE 153 HG21 ILE 153 2.873 18.668 16.858 1109 2HG2 ILE 153 HG23 ILE 153 2.987 18.012 15.226 1110 3HG2 ILE 153 HG22 ILE 153 2.695 16.936 16.590 1111 1HD1 ILE 153 HD12 ILE 153 5.693 17.377 13.966 1112 2HD1 ILE 153 HD11 ILE 153 4.298 18.448 13.849 1113 3HD1 ILE 153 HD13 ILE 153 5.921 19.081 13.570 1114 H ASP 154 HN ASP 154 5.070 15.248 18.138 1115 HA ASP 154 HA ASP 154 2.492 14.852 19.293 1116 1HB ASP 154 HB2 ASP 154 4.994 13.143 19.342 1117 2HB ASP 154 HB1 ASP 154 3.455 12.610 20.019 1118 H GLY 155 HN GLY 155 5.690 15.274 20.782 1119 1HA GLY 155 HA2 GLY 155 4.932 14.711 23.462 1120 2HA GLY 155 HA1 GLY 155 6.289 15.728 23.001 1121 H ILE 156 HN ILE 156 5.143 17.943 21.864 1122 HA ILE 156 HA ILE 156 4.059 19.301 24.171 1123 HB ILE 156 HB ILE 156 5.421 20.438 22.398 1124 1HG1 ILE 156 HG12 ILE 156 3.988 22.491 22.291 1125 2HG1 ILE 156 HG11 ILE 156 2.642 21.549 22.922 1126 1HG2 ILE 156 HG22 ILE 156 4.256 19.283 20.485 1127 2HG2 ILE 156 HG21 ILE 156 2.867 20.329 20.773 1128 3HG2 ILE 156 HG23 ILE 156 4.412 21.026 20.288 1129 1HD1 ILE 156 HD11 ILE 156 5.220 21.521 24.455 1130 2HD1 ILE 156 HD13 ILE 156 4.210 22.963 24.539 1131 3HD1 ILE 156 HD12 ILE 156 3.559 21.407 25.042 1132 H GLN 157 HN GLN 157 2.622 18.048 21.189 1133 HA GLN 157 HA GLN 157 -0.009 19.092 21.672 1134 1HB GLN 157 HB2 GLN 157 0.982 16.734 20.057 1135 2HB GLN 157 HB1 GLN 157 -0.710 17.234 20.081 1136 1HG GLN 157 HG2 GLN 157 -0.094 19.449 19.231 1137 2HG GLN 157 HG1 GLN 157 1.616 19.017 19.283 1138 1HE2 GLN 157 HE22 GLN 157 0.240 18.390 15.812 1139 2HE2 GLN 157 HE21 GLN 157 0.251 19.755 16.821 1140 H ALA 158 HN ALA 158 1.564 16.022 22.572 1141 HA ALA 158 HA ALA 158 -0.762 14.765 23.633 1142 1HB ALA 158 HB3 ALA 158 1.392 13.585 23.240 1143 2HB ALA 158 HB2 ALA 158 2.099 14.467 24.592 1144 3HB ALA 158 HB1 ALA 158 0.782 13.328 24.875 1145 H ILE 159 HN ILE 159 1.586 16.988 25.131 1146 HA ILE 159 HA ILE 159 0.477 16.837 27.782 1147 HB ILE 159 HB ILE 159 1.986 19.088 26.412 1148 1HG1 ILE 159 HG12 ILE 159 2.983 16.994 28.360 1149 2HG1 ILE 159 HG11 ILE 159 3.089 16.799 26.611 1150 1HG2 ILE 159 HG22 ILE 159 1.281 18.572 29.313 1151 2HG2 ILE 159 HG21 ILE 159 2.543 19.695 28.811 1152 3HG2 ILE 159 HG23 ILE 159 0.869 19.988 28.344 1153 1HD1 ILE 159 HD11 ILE 159 4.191 19.228 28.028 1154 2HD1 ILE 159 HD13 ILE 159 5.153 17.776 27.761 1155 3HD1 ILE 159 HD12 ILE 159 4.527 18.683 26.386 1156 H TYR 160 HN TYR 160 -0.046 19.185 25.130 1157 HA TYR 160 HA TYR 160 -2.412 20.265 26.587 1158 1HB TYR 160 HB2 TYR 160 -0.921 21.172 24.109 1159 2HB TYR 160 HB1 TYR 160 -2.393 21.946 24.698 1160 HD1 TYR 160 HD2 TYR 160 -2.434 22.844 27.072 1161 HD2 TYR 160 HD1 TYR 160 1.185 21.667 25.084 1162 HE1 TYR 160 HE2 TYR 160 -1.111 24.151 28.708 1163 HE2 TYR 160 HE1 TYR 160 2.511 22.970 26.721 1164 HH TYR 160 HH TYR 160 2.343 24.639 28.305 1165 H GLY 161 HN GLY 161 -1.725 19.508 23.168 1166 1HA GLY 161 HA2 GLY 161 -3.480 17.458 22.641 1167 2HA GLY 161 HA1 GLY 161 -4.537 18.872 22.681 1168 H ARG 162 HN ARG 162 -4.602 17.834 20.276 1169 HA ARG 162 HA ARG 162 -2.397 18.838 18.577 1170 1HB ARG 162 HB2 ARG 162 -4.990 17.393 17.943 1171 2HB ARG 162 HB1 ARG 162 -3.839 17.913 16.717 1172 1HG ARG 162 HG2 ARG 162 -2.096 16.516 17.700 1173 2HG ARG 162 HG1 ARG 162 -3.181 16.043 19.013 1174 1HD ARG 162 HD2 ARG 162 -3.166 14.281 17.327 1175 2HD ARG 162 HD1 ARG 162 -4.741 15.081 17.303 1176 HE ARG 162 HE ARG 162 -3.314 16.472 15.404 1177 1HH1 ARG 162 HH21 ARG 162 -3.956 13.131 16.032 1178 2HH1 ARG 162 HH22 ARG 162 -3.890 12.678 14.360 1179 1HH2 ARG 162 HH11 ARG 162 -3.242 15.891 13.237 1180 2HH2 ARG 162 HH12 ARG 162 -3.490 14.240 12.781 1181 H SER 163 HN SER 163 -2.698 20.514 17.001 1182 HA SER 163 HA SER 163 -4.607 22.572 17.798 1183 1HB SER 163 HB2 SER 163 -2.601 22.396 15.538 1184 2HB SER 163 HB1 SER 163 -3.630 23.798 15.807 1185 HG SER 163 HG SER 163 -1.846 22.652 17.698 1186 H GLN 164 HN GLN 164 -6.228 20.531 17.180 1187 HA GLN 164 HA GLN 164 -6.955 20.411 14.376 1188 1HB GLN 164 HB2 GLN 164 -8.368 19.543 16.906 1189 2HB GLN 164 HB1 GLN 164 -9.044 19.293 15.295 1190 1HG GLN 164 HG2 GLN 164 -7.174 17.930 14.636 1191 2HG GLN 164 HG1 GLN 164 -6.284 18.342 16.103 1192 1HE2 GLN 164 HE22 GLN 164 -7.887 15.006 16.629 1193 2HE2 GLN 164 HE21 GLN 164 -6.754 15.628 15.529 1194 H ASN 165 HN ASN 165 -7.787 22.137 13.360 1195 HA ASN 165 HA ASN 165 -10.219 23.406 14.365 1196 1HB ASN 165 HB2 ASN 165 -7.690 25.050 14.026 1197 2HB ASN 165 HB1 ASN 165 -9.301 25.712 14.278 1198 1HD2 ASN 165 HD22 ASN 165 -7.155 24.625 17.468 1199 2HD2 ASN 165 HD21 ASN 165 -6.497 24.792 15.914 1200 HA PRO 166 HA PRO 166 -9.509 23.036 9.752 1201 1HB PRO 166 HB2 PRO 166 -12.141 21.913 9.435 1202 2HB PRO 166 HB1 PRO 166 -10.595 21.073 9.276 1203 1HG PRO 166 HG2 PRO 166 -12.538 20.842 11.430 1204 2HG PRO 166 HG1 PRO 166 -11.034 19.935 11.216 1205 1HD PRO 166 HD2 PRO 166 -11.564 22.051 13.114 1206 2HD PRO 166 HD1 PRO 166 -10.052 21.146 12.899 1207 H VAL 167 HN VAL 167 -10.339 25.304 11.322 1208 HA VAL 167 HA VAL 167 -12.799 26.314 10.012 1209 HB VAL 167 HB VAL 167 -10.993 27.580 12.097 1210 1HG1 VAL 167 HG11 VAL 167 -13.782 28.294 11.140 1211 2HG1 VAL 167 HG13 VAL 167 -12.927 29.072 12.472 1212 3HG1 VAL 167 HG12 VAL 167 -12.316 29.225 10.824 1213 1HG2 VAL 167 HG23 VAL 167 -13.604 26.049 12.316 1214 2HG2 VAL 167 HG22 VAL 167 -12.036 25.532 12.931 1215 3HG2 VAL 167 HG21 VAL 167 -12.849 26.926 13.647 1216 H GLN 168 HN GLN 168 -12.778 27.934 8.466 1217 HA GLN 168 HA GLN 168 -10.241 28.451 7.134 1218 1HB GLN 168 HB2 GLN 168 -12.986 29.629 6.611 1219 2HB GLN 168 HB1 GLN 168 -11.606 29.719 5.520 1220 1HG GLN 168 HG2 GLN 168 -11.578 27.284 5.298 1221 2HG GLN 168 HG1 GLN 168 -12.897 27.146 6.459 1222 1HE2 GLN 168 HE22 GLN 168 -14.403 27.059 3.045 1223 2HE2 GLN 168 HE21 GLN 168 -13.305 26.088 3.901 1224 HA PRO 169 HA PRO 169 -9.184 32.172 9.336 1225 1HB PRO 169 HB2 PRO 169 -8.361 33.655 6.982 1226 2HB PRO 169 HB1 PRO 169 -7.331 32.855 8.178 1227 1HG PRO 169 HG2 PRO 169 -7.936 31.982 5.464 1228 2HG PRO 169 HG1 PRO 169 -6.809 31.257 6.621 1229 1HD PRO 169 HD2 PRO 169 -9.325 30.178 5.798 1230 2HD PRO 169 HD1 PRO 169 -8.281 29.579 7.107 No H/Q in entry = 1230 Start of MODEL 13 1 1H VAL 1 HT2 VAL 1 -16.247 18.142 11.159 2 2H VAL 1 HT1 VAL 1 -15.567 19.583 11.749 3 3H VAL 1 HT3 VAL 1 -16.542 19.613 10.362 4 HA VAL 1 HA VAL 1 -14.923 18.353 9.125 5 HB VAL 1 HB VAL 1 -13.621 20.637 10.637 6 1HG1 VAL 1 HG12 VAL 1 -13.140 19.327 7.953 7 2HG1 VAL 1 HG11 VAL 1 -12.532 20.939 8.338 8 3HG1 VAL 1 HG13 VAL 1 -11.992 19.545 9.275 9 1HG2 VAL 1 HG22 VAL 1 -15.854 21.252 9.770 10 2HG2 VAL 1 HG21 VAL 1 -14.577 22.066 8.866 11 3HG2 VAL 1 HG23 VAL 1 -15.392 20.665 8.172 12 H LEU 2 HN LEU 2 -14.400 18.482 12.557 13 HA LEU 2 HA LEU 2 -11.822 17.063 12.419 14 1HB LEU 2 HB2 LEU 2 -12.541 18.772 14.223 15 2HB LEU 2 HB1 LEU 2 -13.542 17.481 14.876 16 HG LEU 2 HG LEU 2 -11.400 17.574 16.051 17 1HD1 LEU 2 HD11 LEU 2 -12.567 15.341 15.421 18 2HD1 LEU 2 HD13 LEU 2 -11.216 15.127 14.303 19 3HD1 LEU 2 HD12 LEU 2 -10.916 15.284 16.033 20 1HD2 LEU 2 HD23 LEU 2 -10.228 18.441 13.825 21 2HD2 LEU 2 HD22 LEU 2 -9.315 17.559 15.046 22 3HD2 LEU 2 HD21 LEU 2 -9.879 16.723 13.604 23 H THR 3 HN THR 3 -11.847 14.916 11.965 24 HA THR 3 HA THR 3 -14.273 13.315 12.615 25 HB THR 3 HB THR 3 -13.351 11.641 11.127 26 HG1 THR 3 HG1 THR 3 -11.264 12.271 10.116 27 1HG2 THR 3 HG22 THR 3 -14.453 13.597 10.074 28 2HG2 THR 3 HG21 THR 3 -12.888 14.400 9.964 29 3HG2 THR 3 HG23 THR 3 -13.186 12.926 9.047 30 H GLU 4 HN GLU 4 -14.183 11.519 13.973 31 HA GLU 4 HA GLU 4 -12.154 11.543 16.035 32 1HB GLU 4 HB2 GLU 4 -14.476 10.824 16.484 33 2HB GLU 4 HB1 GLU 4 -14.261 9.453 15.397 34 1HG GLU 4 HG2 GLU 4 -12.492 8.555 16.828 35 2HG GLU 4 HG1 GLU 4 -12.602 9.965 17.883 36 H GLY 5 HN GLY 5 -10.423 10.090 16.315 37 1HA GLY 5 HA2 GLY 5 -9.031 8.219 15.750 38 2HA GLY 5 HA1 GLY 5 -10.022 7.942 14.315 39 H ASN 6 HN ASN 6 -9.589 9.187 12.413 40 HA ASN 6 HA ASN 6 -7.418 11.155 12.445 41 1HB ASN 6 HB2 ASN 6 -7.108 8.431 11.173 42 2HB ASN 6 HB1 ASN 6 -6.129 9.812 10.682 43 1HD2 ASN 6 HD22 ASN 6 -4.614 10.009 14.054 44 2HD2 ASN 6 HD21 ASN 6 -5.397 11.066 12.979 45 HA PRO 7 HA PRO 7 -9.853 12.608 9.022 46 1HB PRO 7 HB2 PRO 7 -7.688 13.624 7.432 47 2HB PRO 7 HB1 PRO 7 -8.708 14.535 8.555 48 1HG PRO 7 HG2 PRO 7 -5.926 13.670 8.914 49 2HG PRO 7 HG1 PRO 7 -6.870 14.796 9.902 50 1HD PRO 7 HD2 PRO 7 -6.129 12.140 10.622 51 2HD PRO 7 HD1 PRO 7 -7.289 13.185 11.471 52 H ARG 8 HN ARG 8 -10.672 11.169 7.562 53 HA ARG 8 HA ARG 8 -8.860 9.255 6.187 54 1HB ARG 8 HB2 ARG 8 -11.872 9.456 6.441 55 2HB ARG 8 HB1 ARG 8 -11.060 8.234 5.462 56 1HG ARG 8 HG2 ARG 8 -9.901 7.364 7.412 57 2HG ARG 8 HG1 ARG 8 -10.559 8.655 8.421 58 1HD ARG 8 HD2 ARG 8 -12.852 7.836 7.949 59 2HD ARG 8 HD1 ARG 8 -12.172 6.522 6.993 60 HE ARG 8 HE ARG 8 -10.922 6.238 9.437 61 1HH1 ARG 8 HH21 ARG 8 -14.166 6.571 8.329 62 2HH1 ARG 8 HH22 ARG 8 -14.844 5.611 9.603 63 1HH2 ARG 8 HH11 ARG 8 -11.782 4.967 11.101 64 2HH2 ARG 8 HH12 ARG 8 -13.491 4.696 11.170 65 H TRP 9 HN TRP 9 -9.372 8.860 3.793 66 HA TRP 9 HA TRP 9 -9.183 11.349 2.336 67 1HB TRP 9 HB2 TRP 9 -9.762 8.528 1.370 68 2HB TRP 9 HB1 TRP 9 -9.397 9.894 0.315 69 HD1 TRP 9 HD1 TRP 9 -7.791 7.267 2.415 70 HE1 TRP 9 HE1 TRP 9 -5.229 7.568 2.406 71 HE3 TRP 9 HE3 TRP 9 -7.455 11.877 0.249 72 HZ2 TRP 9 HZ2 TRP 9 -3.290 9.515 1.589 73 HZ3 TRP 9 HZ3 TRP 9 -5.245 12.930 -0.135 74 HH2 TRP 9 HH2 TRP 9 -3.165 11.755 0.529 75 H GLU 10 HN GLU 10 -10.894 12.670 1.879 76 HA GLU 10 HA GLU 10 -13.636 11.693 2.247 77 1HB GLU 10 HB2 GLU 10 -12.487 14.381 1.460 78 2HB GLU 10 HB1 GLU 10 -14.218 14.072 1.611 79 1HG GLU 10 HG2 GLU 10 -13.943 13.429 3.950 80 2HG GLU 10 HG1 GLU 10 -12.191 13.606 3.820 81 H GLN 11 HN GLN 11 -11.434 11.952 -0.368 82 HA GLN 11 HA GLN 11 -13.542 12.154 -2.428 83 1HB GLN 11 HB2 GLN 11 -10.563 11.646 -2.686 84 2HB GLN 11 HB1 GLN 11 -11.667 11.973 -4.019 85 1HG GLN 11 HG2 GLN 11 -11.242 13.872 -1.699 86 2HG GLN 11 HG1 GLN 11 -10.367 13.986 -3.225 87 1HE2 GLN 11 HE22 GLN 11 -13.705 15.945 -3.164 88 2HE2 GLN 11 HE21 GLN 11 -12.571 15.748 -1.917 89 H THR 12 HN THR 12 -14.269 10.422 -3.675 90 HA THR 12 HA THR 12 -13.644 7.715 -2.636 91 HB THR 12 HB THR 12 -15.498 6.983 -4.070 92 HG1 THR 12 HG1 THR 12 -15.704 8.116 -5.818 93 1HG2 THR 12 HG21 THR 12 -15.929 8.137 -1.840 94 2HG2 THR 12 HG23 THR 12 -16.303 9.591 -2.767 95 3HG2 THR 12 HG22 THR 12 -17.282 8.141 -2.973 96 H HIS 13 HN HIS 13 -12.445 9.821 -4.898 97 HA HIS 13 HA HIS 13 -11.285 7.618 -6.571 98 1HB HIS 13 HB2 HIS 13 -11.968 10.470 -7.377 99 2HB HIS 13 HB1 HIS 13 -11.134 9.298 -8.398 100 HD1 HIS 13 HD1 HIS 13 -12.530 7.201 -9.189 101 HD2 HIS 13 HD2 HIS 13 -14.750 10.116 -7.205 102 HE1 HIS 13 HE1 HIS 13 -14.969 6.677 -9.643 103 H LEU 14 HN LEU 14 -9.074 7.543 -6.448 104 HA LEU 14 HA LEU 14 -7.612 9.980 -5.474 105 1HB LEU 14 HB2 LEU 14 -7.079 7.104 -4.680 106 2HB LEU 14 HB1 LEU 14 -6.129 8.501 -4.182 107 HG LEU 14 HG LEU 14 -9.078 8.126 -3.591 108 1HD1 LEU 14 HD13 LEU 14 -7.675 6.486 -2.396 109 2HD1 LEU 14 HD12 LEU 14 -6.647 7.791 -1.802 110 3HD1 LEU 14 HD11 LEU 14 -8.328 7.684 -1.277 111 1HD2 LEU 14 HD22 LEU 14 -7.054 10.286 -2.995 112 2HD2 LEU 14 HD21 LEU 14 -8.734 10.442 -3.495 113 3HD2 LEU 14 HD23 LEU 14 -8.351 9.983 -1.842 114 H THR 15 HN THR 15 -5.322 9.984 -6.078 115 HA THR 15 HA THR 15 -4.735 8.394 -8.552 116 HB THR 15 HB THR 15 -3.698 10.402 -9.499 117 HG1 THR 15 HG1 THR 15 -3.052 11.438 -7.641 118 1HG2 THR 15 HG21 THR 15 -6.521 10.778 -8.470 119 2HG2 THR 15 HG23 THR 15 -5.780 11.823 -9.681 120 3HG2 THR 15 HG22 THR 15 -6.032 10.112 -10.028 121 H TYR 16 HN TYR 16 -2.410 8.108 -8.939 122 HA TYR 16 HA TYR 16 -0.631 8.699 -6.622 123 1HB TYR 16 HB2 TYR 16 0.136 6.378 -6.494 124 2HB TYR 16 HB1 TYR 16 -1.601 6.450 -6.199 125 HD1 TYR 16 HD2 TYR 16 -3.203 5.652 -7.870 126 HD2 TYR 16 HD1 TYR 16 1.032 5.429 -8.556 127 HE1 TYR 16 HE2 TYR 16 -3.591 4.096 -9.761 128 HE2 TYR 16 HE1 TYR 16 0.644 3.867 -10.445 129 HH TYR 16 HH TYR 16 -0.981 3.090 -11.884 130 H ARG 17 HN ARG 17 1.633 8.555 -7.186 131 HA ARG 17 HA ARG 17 2.264 8.172 -10.076 132 1HB ARG 17 HB2 ARG 17 1.771 10.589 -9.748 133 2HB ARG 17 HB1 ARG 17 3.007 10.656 -8.493 134 1HG ARG 17 HG2 ARG 17 4.749 10.122 -10.066 135 2HG ARG 17 HG1 ARG 17 3.572 9.759 -11.328 136 1HD ARG 17 HD2 ARG 17 4.593 12.010 -11.621 137 2HD ARG 17 HD1 ARG 17 2.851 12.101 -11.371 138 HE ARG 17 HE ARG 17 3.888 12.363 -8.820 139 1HH1 ARG 17 HH21 ARG 17 4.345 13.883 -11.884 140 2HH1 ARG 17 HH22 ARG 17 4.774 15.418 -11.208 141 1HH2 ARG 17 HH11 ARG 17 4.445 14.358 -7.921 142 2HH2 ARG 17 HH12 ARG 17 4.840 15.685 -8.960 143 H ILE 18 HN ILE 18 4.197 7.135 -10.314 144 HA ILE 18 HA ILE 18 5.770 6.545 -7.881 145 HB ILE 18 HB ILE 18 6.102 5.597 -10.747 146 1HG1 ILE 18 HG12 ILE 18 4.992 4.111 -8.349 147 2HG1 ILE 18 HG11 ILE 18 3.972 4.930 -9.532 148 1HG2 ILE 18 HG22 ILE 18 7.380 4.703 -8.144 149 2HG2 ILE 18 HG21 ILE 18 7.513 3.829 -9.668 150 3HG2 ILE 18 HG23 ILE 18 8.202 5.447 -9.516 151 1HD1 ILE 18 HD12 ILE 18 6.026 2.836 -10.293 152 2HD1 ILE 18 HD11 ILE 18 4.335 2.452 -9.961 153 3HD1 ILE 18 HD13 ILE 18 4.750 3.511 -11.308 154 H GLU 19 HN GLU 19 7.381 7.923 -7.326 155 HA GLU 19 HA GLU 19 8.322 10.005 -9.046 156 1HB GLU 19 HB2 GLU 19 9.413 8.884 -6.456 157 2HB GLU 19 HB1 GLU 19 10.107 10.289 -7.271 158 1HG GLU 19 HG2 GLU 19 7.927 11.435 -7.167 159 2HG GLU 19 HG1 GLU 19 7.224 10.035 -6.357 160 H ASN 20 HN ASN 20 9.694 6.814 -8.224 161 HA ASN 20 HA ASN 20 11.209 6.854 -10.721 162 1HB ASN 20 HB2 ASN 20 12.646 8.191 -9.107 163 2HB ASN 20 HB1 ASN 20 12.797 6.720 -8.144 164 1HD2 ASN 20 HD22 ASN 20 15.606 5.893 -10.122 165 2HD2 ASN 20 HD21 ASN 20 15.008 6.216 -8.567 166 H TYR 21 HN TYR 21 12.164 4.769 -11.186 167 HA TYR 21 HA TYR 21 10.854 2.559 -9.691 168 1HB TYR 21 HB2 TYR 21 12.275 2.709 -12.361 169 2HB TYR 21 HB1 TYR 21 11.793 1.181 -11.632 170 HD1 TYR 21 HD1 TYR 21 9.397 0.671 -11.239 171 HD2 TYR 21 HD2 TYR 21 10.652 4.211 -13.324 172 HE1 TYR 21 HE1 TYR 21 7.101 0.963 -12.125 173 HE2 TYR 21 HE2 TYR 21 8.352 4.506 -14.206 174 HH TYR 21 HH TYR 21 6.365 3.131 -14.649 175 H THR 22 HN THR 22 12.062 0.931 -8.665 176 HA THR 22 HA THR 22 14.678 1.658 -7.733 177 HB THR 22 HB THR 22 13.200 0.257 -6.376 178 HG1 THR 22 HG1 THR 22 15.723 -0.401 -7.067 179 1HG2 THR 22 HG23 THR 22 12.248 -0.909 -8.476 180 2HG2 THR 22 HG22 THR 22 13.629 -1.996 -8.336 181 3HG2 THR 22 HG21 THR 22 12.456 -1.886 -7.025 182 HA PRO 23 HA PRO 23 16.711 0.045 -11.421 183 1HB PRO 23 HB2 PRO 23 19.323 -0.045 -10.286 184 2HB PRO 23 HB1 PRO 23 18.632 1.282 -11.232 185 1HG PRO 23 HG2 PRO 23 19.123 1.168 -8.333 186 2HG PRO 23 HG1 PRO 23 18.728 2.573 -9.338 187 1HD PRO 23 HD2 PRO 23 16.967 1.231 -7.525 188 2HD PRO 23 HD1 PRO 23 16.535 2.503 -8.691 189 H ASP 24 HN ASP 24 16.239 -1.428 -8.476 190 HA ASP 24 HA ASP 24 17.897 -3.771 -8.712 191 1HB ASP 24 HB2 ASP 24 15.277 -3.271 -7.276 192 2HB ASP 24 HB1 ASP 24 16.181 -4.776 -7.147 193 H LEU 25 HN LEU 25 14.349 -3.683 -8.996 194 HA LEU 25 HA LEU 25 14.488 -5.846 -11.007 195 1HB LEU 25 HB2 LEU 25 12.115 -4.550 -9.631 196 2HB LEU 25 HB1 LEU 25 12.030 -5.969 -10.672 197 HG LEU 25 HG LEU 25 13.831 -5.935 -8.243 198 1HD1 LEU 25 HD13 LEU 25 10.903 -6.716 -8.338 199 2HD1 LEU 25 HD12 LEU 25 11.992 -7.019 -6.985 200 3HD1 LEU 25 HD11 LEU 25 11.587 -5.364 -7.436 201 1HD2 LEU 25 HD21 LEU 25 12.468 -8.103 -9.875 202 2HD2 LEU 25 HD23 LEU 25 14.198 -7.777 -9.781 203 3HD2 LEU 25 HD22 LEU 25 13.343 -8.409 -8.377 204 HA PRO 26 HA PRO 26 13.898 -3.007 -14.388 205 1HB PRO 26 HB2 PRO 26 11.950 -4.638 -15.792 206 2HB PRO 26 HB1 PRO 26 13.674 -4.454 -16.149 207 1HG PRO 26 HG2 PRO 26 12.335 -6.738 -14.935 208 2HG PRO 26 HG1 PRO 26 14.038 -6.588 -15.393 209 1HD PRO 26 HD2 PRO 26 12.976 -6.603 -12.728 210 2HD PRO 26 HD1 PRO 26 14.657 -6.287 -13.216 211 H ARG 27 HN ARG 27 12.161 -1.577 -15.268 212 HA ARG 27 HA ARG 27 10.154 -0.979 -13.274 213 1HB ARG 27 HB2 ARG 27 9.400 0.753 -14.822 214 2HB ARG 27 HB1 ARG 27 11.164 0.751 -14.761 215 1HG ARG 27 HG2 ARG 27 11.152 -0.712 -16.823 216 2HG ARG 27 HG1 ARG 27 9.406 -0.456 -16.922 217 1HD ARG 27 HD2 ARG 27 9.743 1.965 -17.079 218 2HD ARG 27 HD1 ARG 27 11.482 1.755 -16.895 219 HE ARG 27 HE ARG 27 10.850 0.212 -19.113 220 1HH1 ARG 27 HH21 ARG 27 10.287 3.450 -18.078 221 2HH1 ARG 27 HH22 ARG 27 10.348 4.118 -19.677 222 1HH2 ARG 27 HH11 ARG 27 10.940 1.065 -21.213 223 2HH2 ARG 27 HH12 ARG 27 10.710 2.764 -21.453 224 H ALA 28 HN ALA 28 10.205 -2.854 -16.215 225 HA ALA 28 HA ALA 28 7.423 -3.007 -16.761 226 1HB ALA 28 HB1 ALA 28 9.337 -3.868 -18.195 227 2HB ALA 28 HB3 ALA 28 9.404 -5.267 -17.122 228 3HB ALA 28 HB2 ALA 28 7.948 -4.947 -18.065 229 H ASP 29 HN ASP 29 9.448 -4.914 -14.545 230 HA ASP 29 HA ASP 29 7.176 -6.608 -13.780 231 1HB ASP 29 HB2 ASP 29 10.018 -6.371 -12.760 232 2HB ASP 29 HB1 ASP 29 8.842 -7.523 -12.123 233 H VAL 30 HN VAL 30 8.806 -3.737 -12.526 234 HA VAL 30 HA VAL 30 7.694 -3.929 -9.866 235 HB VAL 30 HB VAL 30 8.814 -1.595 -11.437 236 1HG1 VAL 30 HG13 VAL 30 7.813 -1.787 -8.592 237 2HG1 VAL 30 HG12 VAL 30 8.994 -0.574 -9.081 238 3HG1 VAL 30 HG11 VAL 30 7.392 -0.591 -9.816 239 1HG2 VAL 30 HG21 VAL 30 10.268 -3.601 -10.708 240 2HG2 VAL 30 HG23 VAL 30 10.818 -1.991 -10.237 241 3HG2 VAL 30 HG22 VAL 30 10.011 -3.026 -9.061 242 H ASP 31 HN ASP 31 6.749 -1.940 -12.704 243 HA ASP 31 HA ASP 31 4.498 -0.730 -11.493 244 1HB ASP 31 HB2 ASP 31 3.635 -0.430 -13.805 245 2HB ASP 31 HB1 ASP 31 5.339 -0.001 -13.677 246 H HIS 32 HN HIS 32 4.813 -3.895 -13.074 247 HA HIS 32 HA HIS 32 2.047 -4.588 -13.084 248 1HB HIS 32 HB2 HIS 32 3.773 -5.924 -14.254 249 2HB HIS 32 HB1 HIS 32 4.445 -6.409 -12.697 250 HD1 HIS 32 HD1 HIS 32 1.093 -6.563 -14.521 251 HD2 HIS 32 HD2 HIS 32 3.283 -8.714 -11.698 252 HE1 HIS 32 HE1 HIS 32 -0.237 -8.659 -14.025 253 H ALA 33 HN ALA 33 4.561 -5.199 -10.611 254 HA ALA 33 HA ALA 33 2.884 -6.533 -8.735 255 1HB ALA 33 HB3 ALA 33 5.429 -6.282 -8.673 256 2HB ALA 33 HB2 ALA 33 5.157 -4.680 -7.989 257 3HB ALA 33 HB1 ALA 33 4.599 -6.114 -7.128 258 H ILE 34 HN ILE 34 3.662 -3.060 -9.059 259 HA ILE 34 HA ILE 34 2.009 -2.257 -6.832 260 HB ILE 34 HB ILE 34 2.944 -0.675 -9.246 261 1HG1 ILE 34 HG12 ILE 34 4.838 -1.610 -8.022 262 2HG1 ILE 34 HG11 ILE 34 4.737 0.119 -7.708 263 1HG2 ILE 34 HG23 ILE 34 1.706 0.126 -6.613 264 2HG2 ILE 34 HG22 ILE 34 2.676 1.250 -7.565 265 3HG2 ILE 34 HG21 ILE 34 1.198 0.567 -8.242 266 1HD1 ILE 34 HD11 ILE 34 3.310 -0.632 -5.616 267 2HD1 ILE 34 HD13 ILE 34 4.125 -2.179 -5.869 268 3HD1 ILE 34 HD12 ILE 34 5.069 -0.723 -5.559 269 H GLU 35 HN GLU 35 1.466 -2.362 -10.357 270 HA GLU 35 HA GLU 35 -1.125 -1.188 -10.333 271 1HB GLU 35 HB2 GLU 35 0.170 -1.565 -12.403 272 2HB GLU 35 HB1 GLU 35 -0.021 -3.305 -12.208 273 1HG GLU 35 HG2 GLU 35 -2.475 -3.060 -12.375 274 2HG GLU 35 HG1 GLU 35 -2.285 -1.317 -12.564 275 H LYS 36 HN LYS 36 -0.097 -4.562 -9.908 276 HA LYS 36 HA LYS 36 -2.715 -5.706 -9.883 277 1HB LYS 36 HB2 LYS 36 -0.573 -6.992 -10.095 278 2HB LYS 36 HB1 LYS 36 -0.278 -6.697 -8.380 279 1HG LYS 36 HG2 LYS 36 -2.395 -7.827 -7.814 280 2HG LYS 36 HG1 LYS 36 -2.695 -8.127 -9.526 281 1HD LYS 36 HD2 LYS 36 -0.576 -9.423 -9.649 282 2HD LYS 36 HD1 LYS 36 -0.344 -9.173 -7.919 283 1HE LYS 36 HE2 LYS 36 -1.359 -11.368 -8.315 284 2HE LYS 36 HE1 LYS 36 -2.504 -10.318 -7.481 285 1HZ LYS 36 HZ3 LYS 36 -2.464 -10.548 -10.429 286 2HZ LYS 36 HZ2 LYS 36 -3.359 -11.620 -9.462 287 3HZ LYS 36 HZ1 LYS 36 -3.704 -9.957 -9.434 288 H ALA 37 HN ALA 37 -0.732 -4.355 -7.239 289 HA ALA 37 HA ALA 37 -2.473 -5.166 -5.118 290 1HB ALA 37 HB3 ALA 37 -0.616 -2.780 -5.333 291 2HB ALA 37 HB2 ALA 37 -1.412 -3.289 -3.841 292 3HB ALA 37 HB1 ALA 37 -0.245 -4.353 -4.625 293 H PHE 38 HN PHE 38 -2.373 -2.093 -6.973 294 HA PHE 38 HA PHE 38 -4.519 -0.847 -5.585 295 1HB PHE 38 HB2 PHE 38 -3.393 -0.527 -8.368 296 2HB PHE 38 HB1 PHE 38 -4.817 0.388 -7.874 297 HD1 PHE 38 HD2 PHE 38 -4.566 1.461 -5.394 298 HD2 PHE 38 HD1 PHE 38 -1.325 0.536 -8.064 299 HE1 PHE 38 HE2 PHE 38 -3.129 3.097 -4.218 300 HE2 PHE 38 HE1 PHE 38 0.111 2.179 -6.885 301 HZ PHE 38 HZ PHE 38 -0.792 3.461 -4.964 302 H GLN 39 HN GLN 39 -4.560 -3.015 -8.406 303 HA GLN 39 HA GLN 39 -7.336 -2.783 -8.984 304 1HB GLN 39 HB2 GLN 39 -5.399 -5.080 -9.347 305 2HB GLN 39 HB1 GLN 39 -7.049 -5.098 -9.973 306 1HG GLN 39 HG2 GLN 39 -6.597 -3.065 -11.272 307 2HG GLN 39 HG1 GLN 39 -4.958 -3.001 -10.625 308 1HE2 GLN 39 HE22 GLN 39 -4.227 -4.737 -13.684 309 2HE2 GLN 39 HE21 GLN 39 -4.280 -3.193 -12.979 310 H LEU 40 HN LEU 40 -5.614 -4.938 -6.745 311 HA LEU 40 HA LEU 40 -7.847 -6.514 -5.971 312 1HB LEU 40 HB2 LEU 40 -5.344 -5.717 -4.474 313 2HB LEU 40 HB1 LEU 40 -6.502 -6.891 -3.855 314 HG LEU 40 HG LEU 40 -5.132 -7.130 -6.551 315 1HD1 LEU 40 HD11 LEU 40 -3.537 -7.214 -4.630 316 2HD1 LEU 40 HD13 LEU 40 -4.468 -8.553 -3.959 317 3HD1 LEU 40 HD12 LEU 40 -3.641 -8.742 -5.505 318 1HD2 LEU 40 HD23 LEU 40 -7.054 -8.835 -4.976 319 2HD2 LEU 40 HD22 LEU 40 -6.996 -8.523 -6.709 320 3HD2 LEU 40 HD21 LEU 40 -5.847 -9.638 -5.980 321 H TRP 41 HN TRP 41 -6.644 -3.430 -4.614 322 HA TRP 41 HA TRP 41 -8.574 -3.411 -2.463 323 1HB TRP 41 HB2 TRP 41 -6.957 -1.200 -3.757 324 2HB TRP 41 HB1 TRP 41 -7.998 -0.942 -2.361 325 HD1 TRP 41 HD1 TRP 41 -4.551 -1.672 -3.167 326 HE1 TRP 41 HE1 TRP 41 -3.292 -2.670 -1.150 327 HE3 TRP 41 HE3 TRP 41 -8.504 -2.906 -0.175 328 HZ2 TRP 41 HZ2 TRP 41 -3.879 -3.838 1.389 329 HZ3 TRP 41 HZ3 TRP 41 -8.122 -3.964 2.036 330 HH2 TRP 41 HH2 TRP 41 -5.818 -4.431 2.820 331 H SER 42 HN SER 42 -8.550 -1.930 -5.705 332 HA SER 42 HA SER 42 -11.070 -0.560 -5.351 333 1HB SER 42 HB2 SER 42 -9.562 0.220 -7.059 334 2HB SER 42 HB1 SER 42 -9.531 -1.363 -7.831 335 HG SER 42 HG SER 42 -12.006 -0.866 -7.788 336 H ASN 43 HN ASN 43 -10.220 -3.804 -6.340 337 HA ASN 43 HA ASN 43 -12.591 -4.514 -7.719 338 1HB ASN 43 HB2 ASN 43 -10.703 -6.168 -6.041 339 2HB ASN 43 HB1 ASN 43 -12.023 -6.865 -6.977 340 1HD2 ASN 43 HD22 ASN 43 -8.811 -6.693 -9.009 341 2HD2 ASN 43 HD21 ASN 43 -9.122 -7.263 -7.440 342 H VAL 44 HN VAL 44 -11.905 -4.566 -4.222 343 HA VAL 44 HA VAL 44 -14.718 -5.452 -3.736 344 HB VAL 44 HB VAL 44 -13.954 -5.958 -1.458 345 1HG1 VAL 44 HG11 VAL 44 -12.201 -7.016 -3.691 346 2HG1 VAL 44 HG13 VAL 44 -12.298 -7.739 -2.087 347 3HG1 VAL 44 HG12 VAL 44 -13.724 -7.704 -3.127 348 1HG2 VAL 44 HG23 VAL 44 -11.452 -4.593 -2.445 349 2HG2 VAL 44 HG22 VAL 44 -12.279 -4.418 -0.898 350 3HG2 VAL 44 HG21 VAL 44 -11.321 -5.857 -1.222 351 H THR 45 HN THR 45 -13.590 -2.595 -4.368 352 HA THR 45 HA THR 45 -15.306 -1.288 -2.355 353 HB THR 45 HB THR 45 -13.630 0.471 -1.886 354 HG1 THR 45 HG1 THR 45 -11.419 -0.723 -2.591 355 1HG2 THR 45 HG22 THR 45 -13.841 -1.753 -0.549 356 2HG2 THR 45 HG21 THR 45 -12.303 -2.160 -1.315 357 3HG2 THR 45 HG23 THR 45 -12.425 -0.738 -0.283 358 HA PRO 46 HA PRO 46 -16.361 1.027 -6.046 359 1HB PRO 46 HB2 PRO 46 -17.298 3.383 -4.794 360 2HB PRO 46 HB1 PRO 46 -18.269 1.943 -5.135 361 1HG PRO 46 HG2 PRO 46 -17.200 2.884 -2.539 362 2HG PRO 46 HG1 PRO 46 -18.519 1.746 -2.855 363 1HD PRO 46 HD2 PRO 46 -15.912 1.055 -1.969 364 2HD PRO 46 HD1 PRO 46 -17.140 -0.061 -2.608 365 H LEU 47 HN LEU 47 -13.820 1.661 -4.059 366 HA LEU 47 HA LEU 47 -13.115 4.356 -4.858 367 1HB LEU 47 HB2 LEU 47 -11.385 2.122 -3.758 368 2HB LEU 47 HB1 LEU 47 -10.920 3.821 -3.860 369 HG LEU 47 HG LEU 47 -13.274 2.741 -2.281 370 1HD1 LEU 47 HD12 LEU 47 -10.579 3.793 -1.371 371 2HD1 LEU 47 HD11 LEU 47 -11.911 3.341 -0.307 372 3HD1 LEU 47 HD13 LEU 47 -11.113 2.114 -1.291 373 1HD2 LEU 47 HD21 LEU 47 -12.249 5.506 -2.870 374 2HD2 LEU 47 HD23 LEU 47 -13.910 4.931 -2.746 375 3HD2 LEU 47 HD22 LEU 47 -12.959 5.190 -1.287 376 H THR 48 HN THR 48 -11.576 5.001 -6.405 377 HA THR 48 HA THR 48 -10.688 2.899 -8.364 378 HB THR 48 HB THR 48 -11.240 4.352 -10.200 379 HG1 THR 48 HG1 THR 48 -11.575 6.428 -9.940 380 1HG2 THR 48 HG21 THR 48 -13.500 4.412 -8.178 381 2HG2 THR 48 HG23 THR 48 -13.677 4.622 -9.922 382 3HG2 THR 48 HG22 THR 48 -13.134 3.075 -9.270 383 H PHE 49 HN PHE 49 -8.606 3.245 -9.214 384 HA PHE 49 HA PHE 49 -7.090 5.602 -8.124 385 1HB PHE 49 HB2 PHE 49 -6.146 2.739 -8.451 386 2HB PHE 49 HB1 PHE 49 -5.131 4.094 -7.951 387 HD1 PHE 49 HD1 PHE 49 -7.890 1.856 -6.975 388 HD2 PHE 49 HD2 PHE 49 -5.397 5.132 -5.747 389 HE1 PHE 49 HE1 PHE 49 -8.646 1.551 -4.634 390 HE2 PHE 49 HE2 PHE 49 -6.155 4.827 -3.408 391 HZ PHE 49 HZ PHE 49 -7.777 3.039 -2.850 392 H THR 50 HN THR 50 -6.157 6.805 -9.685 393 HA THR 50 HA THR 50 -5.684 5.571 -12.383 394 HB THR 50 HB THR 50 -6.452 8.432 -11.727 395 HG1 THR 50 HG1 THR 50 -8.327 7.702 -13.004 396 1HG2 THR 50 HG21 THR 50 -5.898 6.985 -14.330 397 2HG2 THR 50 HG23 THR 50 -6.699 8.558 -14.239 398 3HG2 THR 50 HG22 THR 50 -5.034 8.382 -13.681 399 H LYS 51 HN LYS 51 -3.622 5.669 -13.104 400 HA LYS 51 HA LYS 51 -1.540 6.870 -11.450 401 1HB LYS 51 HB2 LYS 51 -1.209 4.758 -12.756 402 2HB LYS 51 HB1 LYS 51 -1.325 5.699 -14.242 403 1HG LYS 51 HG2 LYS 51 0.616 7.055 -13.537 404 2HG LYS 51 HG1 LYS 51 0.733 6.113 -12.050 405 1HD LYS 51 HD2 LYS 51 1.112 4.065 -13.378 406 2HD LYS 51 HD1 LYS 51 1.000 5.010 -14.864 407 1HE LYS 51 HE2 LYS 51 3.352 4.680 -14.272 408 2HE LYS 51 HE1 LYS 51 2.929 6.384 -14.108 409 1HZ LYS 51 HZ1 LYS 51 2.608 6.031 -11.733 410 2HZ LYS 51 HZ3 LYS 51 3.042 4.400 -11.901 411 3HZ LYS 51 HZ2 LYS 51 4.188 5.618 -12.205 412 H VAL 52 HN VAL 52 -0.424 8.785 -11.841 413 HA VAL 52 HA VAL 52 -1.223 10.384 -14.256 414 HB VAL 52 HB VAL 52 -1.121 12.408 -12.884 415 1HG1 VAL 52 HG12 VAL 52 -2.852 10.237 -11.665 416 2HG1 VAL 52 HG11 VAL 52 -3.093 11.969 -11.435 417 3HG1 VAL 52 HG13 VAL 52 -3.279 11.255 -13.037 418 1HG2 VAL 52 HG23 VAL 52 -0.400 10.447 -10.694 419 2HG2 VAL 52 HG22 VAL 52 0.527 11.844 -11.249 420 3HG2 VAL 52 HG21 VAL 52 -0.979 12.079 -10.360 421 H SER 53 HN SER 53 0.484 11.200 -15.397 422 HA SER 53 HA SER 53 3.213 10.566 -14.426 423 1HB SER 53 HB2 SER 53 2.922 9.887 -16.658 424 2HB SER 53 HB1 SER 53 2.027 11.343 -17.082 425 HG SER 53 HG SER 53 3.934 12.516 -16.899 426 H GLU 54 HN GLU 54 1.114 13.218 -14.384 427 HA GLU 54 HA GLU 54 3.386 15.033 -13.749 428 1HB GLU 54 HB2 GLU 54 1.256 15.576 -15.834 429 2HB GLU 54 HB1 GLU 54 2.253 16.843 -15.125 430 1HG GLU 54 HG2 GLU 54 4.289 15.688 -15.901 431 2HG GLU 54 HG1 GLU 54 3.297 14.419 -16.618 432 H GLY 55 HN GLY 55 2.697 16.920 -12.537 433 1HA GLY 55 HA2 GLY 55 1.183 18.166 -11.179 434 2HA GLY 55 HA1 GLY 55 -0.084 16.997 -11.554 435 H GLN 56 HN GLN 56 0.222 17.785 -8.933 436 HA GLN 56 HA GLN 56 1.923 15.848 -7.518 437 1HB GLN 56 HB2 GLN 56 1.574 18.110 -6.575 438 2HB GLN 56 HB1 GLN 56 -0.159 17.785 -6.453 439 1HG GLN 56 HG2 GLN 56 0.209 16.009 -4.870 440 2HG GLN 56 HG1 GLN 56 1.953 16.071 -5.117 441 1HE2 GLN 56 HE22 GLN 56 1.237 17.991 -2.013 442 2HE2 GLN 56 HE21 GLN 56 1.079 16.373 -2.507 443 H ALA 57 HN ALA 57 1.223 13.912 -6.684 444 HA ALA 57 HA ALA 57 -1.642 13.178 -7.159 445 1HB ALA 57 HB3 ALA 57 0.262 11.826 -8.199 446 2HB ALA 57 HB2 ALA 57 0.654 11.307 -6.562 447 3HB ALA 57 HB1 ALA 57 -0.914 10.911 -7.262 448 H ASP 58 HN ASP 58 -2.837 12.225 -5.463 449 HA ASP 58 HA ASP 58 -2.338 13.181 -2.832 450 1HB ASP 58 HB2 ASP 58 -4.079 10.921 -3.851 451 2HB ASP 58 HB1 ASP 58 -4.094 11.473 -2.175 452 H ILE 59 HN ILE 59 -1.654 10.038 -4.350 453 HA ILE 59 HA ILE 59 -0.119 9.230 -1.899 454 HB ILE 59 HB ILE 59 -1.228 7.523 -4.150 455 1HG1 ILE 59 HG12 ILE 59 -2.103 7.670 -1.252 456 2HG1 ILE 59 HG11 ILE 59 -2.907 8.561 -2.548 457 1HG2 ILE 59 HG21 ILE 59 0.227 6.843 -1.580 458 2HG2 ILE 59 HG23 ILE 59 -0.619 5.659 -2.576 459 3HG2 ILE 59 HG22 ILE 59 0.773 6.521 -3.226 460 1HD1 ILE 59 HD11 ILE 59 -2.478 5.571 -2.703 461 2HD1 ILE 59 HD13 ILE 59 -3.898 6.267 -1.924 462 3HD1 ILE 59 HD12 ILE 59 -3.597 6.566 -3.635 463 H MET 60 HN MET 60 2.030 9.667 -2.180 464 HA MET 60 HA MET 60 3.208 9.388 -4.922 465 1HB MET 60 HB2 MET 60 4.291 10.748 -2.441 466 2HB MET 60 HB1 MET 60 5.125 10.651 -3.988 467 1HG MET 60 HG2 MET 60 3.090 11.759 -5.033 468 2HG MET 60 HG1 MET 60 2.514 12.059 -3.395 469 1HE MET 60 HE1 MET 60 5.335 12.141 -5.762 470 2HE MET 60 HE3 MET 60 4.710 13.717 -6.262 471 3HE MET 60 HE2 MET 60 6.268 13.603 -5.450 472 H ILE 61 HN ILE 61 4.669 7.783 -5.310 473 HA ILE 61 HA ILE 61 5.603 6.127 -2.982 474 HB ILE 61 HB ILE 61 4.959 5.250 -5.814 475 1HG1 ILE 61 HG12 ILE 61 3.598 4.541 -3.197 476 2HG1 ILE 61 HG11 ILE 61 3.013 5.793 -4.294 477 1HG2 ILE 61 HG23 ILE 61 6.057 3.803 -3.399 478 2HG2 ILE 61 HG22 ILE 61 5.297 2.952 -4.741 479 3HG2 ILE 61 HG21 ILE 61 6.757 3.902 -5.013 480 1HD1 ILE 61 HD11 ILE 61 2.868 4.096 -6.108 481 2HD1 ILE 61 HD13 ILE 61 3.366 2.855 -4.959 482 3HD1 ILE 61 HD12 ILE 61 1.834 3.699 -4.736 483 H SER 62 HN SER 62 7.796 5.978 -2.769 484 HA SER 62 HA SER 62 9.517 6.308 -5.158 485 1HB SER 62 HB2 SER 62 10.774 8.134 -4.266 486 2HB SER 62 HB1 SER 62 9.083 8.600 -4.140 487 HG SER 62 HG SER 62 9.255 7.633 -1.945 488 H PHE 63 HN PHE 63 11.855 5.980 -4.525 489 HA PHE 63 HA PHE 63 12.079 3.942 -2.334 490 1HB PHE 63 HB2 PHE 63 13.459 4.165 -5.020 491 2HB PHE 63 HB1 PHE 63 13.968 3.046 -3.760 492 HD1 PHE 63 HD1 PHE 63 11.317 3.870 -6.181 493 HD2 PHE 63 HD2 PHE 63 12.579 1.152 -3.101 494 HE1 PHE 63 HE1 PHE 63 9.556 2.265 -6.873 495 HE2 PHE 63 HE2 PHE 63 10.823 -0.450 -3.793 496 HZ PHE 63 HZ PHE 63 9.310 0.105 -5.677 497 H VAL 64 HN VAL 64 13.747 4.230 -0.861 498 HA VAL 64 HA VAL 64 15.654 6.499 -1.333 499 HB VAL 64 HB VAL 64 15.357 7.035 1.124 500 1HG1 VAL 64 HG12 VAL 64 14.315 8.345 -0.726 501 2HG1 VAL 64 HG11 VAL 64 12.896 7.304 -0.633 502 3HG1 VAL 64 HG13 VAL 64 13.320 8.341 0.728 503 1HG2 VAL 64 HG21 VAL 64 14.209 4.739 1.514 504 2HG2 VAL 64 HG23 VAL 64 13.510 6.144 2.321 505 3HG2 VAL 64 HG22 VAL 64 12.762 5.505 0.859 506 H ARG 65 HN ARG 65 17.574 6.390 0.076 507 HA ARG 65 HA ARG 65 18.206 3.612 1.026 508 1HB ARG 65 HB2 ARG 65 19.910 5.483 -0.649 509 2HB ARG 65 HB1 ARG 65 20.544 4.053 0.165 510 1HG ARG 65 HG2 ARG 65 19.120 2.597 -1.107 511 2HG ARG 65 HG1 ARG 65 18.234 3.967 -1.788 512 1HD ARG 65 HD2 ARG 65 21.204 3.529 -2.197 513 2HD ARG 65 HD1 ARG 65 19.976 2.970 -3.334 514 HE ARG 65 HE ARG 65 19.381 5.649 -3.034 515 1HH1 ARG 65 HH21 ARG 65 22.227 3.824 -3.718 516 2HH1 ARG 65 HH22 ARG 65 22.914 5.032 -4.753 517 1HH2 ARG 65 HH11 ARG 65 20.265 7.239 -4.376 518 2HH2 ARG 65 HH12 ARG 65 21.805 6.967 -5.122 519 H GLY 66 HN GLY 66 19.455 3.535 2.900 520 1HA GLY 66 HA2 GLY 66 20.179 4.324 4.991 521 2HA GLY 66 HA1 GLY 66 21.128 5.436 4.012 522 H ASP 67 HN ASP 67 20.925 7.184 5.392 523 HA ASP 67 HA ASP 67 18.442 8.105 6.517 524 1HB ASP 67 HB2 ASP 67 20.764 8.659 7.361 525 2HB ASP 67 HB1 ASP 67 20.936 9.743 5.979 526 H HIS 68 HN HIS 68 16.871 9.321 5.587 527 HA HIS 68 HA HIS 68 17.491 10.832 3.078 528 1HB HIS 68 HB2 HIS 68 15.119 10.121 2.356 529 2HB HIS 68 HB1 HIS 68 16.385 8.896 2.265 530 HD1 HIS 68 HD1 HIS 68 16.616 7.591 4.812 531 HD2 HIS 68 HD2 HIS 68 12.911 9.054 3.589 532 HE1 HIS 68 HE1 HIS 68 14.872 6.366 6.182 533 H ARG 69 HN ARG 69 17.565 12.245 5.299 534 HA ARG 69 HA ARG 69 16.607 14.015 6.487 535 1HB ARG 69 HB2 ARG 69 14.817 14.015 4.036 536 2HB ARG 69 HB1 ARG 69 14.823 15.285 5.260 537 1HG ARG 69 HG2 ARG 69 17.230 15.670 4.845 538 2HG ARG 69 HG1 ARG 69 17.210 14.419 3.602 539 1HD ARG 69 HD2 ARG 69 15.518 16.936 3.555 540 2HD ARG 69 HD1 ARG 69 17.002 16.699 2.632 541 HE ARG 69 HE ARG 69 15.425 14.549 1.892 542 1HH1 ARG 69 HH21 ARG 69 15.051 17.973 2.050 543 2HH1 ARG 69 HH22 ARG 69 13.955 18.050 0.712 544 1HH2 ARG 69 HH11 ARG 69 14.003 14.632 0.137 545 2HH2 ARG 69 HH12 ARG 69 13.361 16.159 -0.371 546 H ASP 70 HN ASP 70 15.864 11.624 7.515 547 HA ASP 70 HA ASP 70 13.065 12.150 8.405 548 1HB ASP 70 HB2 ASP 70 14.150 9.543 7.321 549 2HB ASP 70 HB1 ASP 70 12.749 9.593 8.393 550 H ASN 71 HN ASN 71 12.593 11.080 10.490 551 HA ASN 71 HA ASN 71 14.995 11.069 12.221 552 1HB ASN 71 HB2 ASN 71 12.020 10.991 12.796 553 2HB ASN 71 HB1 ASN 71 13.254 10.910 14.052 554 1HD2 ASN 71 HD22 ASN 71 12.195 14.511 13.281 555 2HD2 ASN 71 HD21 ASN 71 11.256 13.115 13.492 556 H SER 72 HN SER 72 13.676 8.769 10.355 557 HA SER 72 HA SER 72 14.319 6.596 12.317 558 1HB SER 72 HB2 SER 72 12.051 6.467 10.315 559 2HB SER 72 HB1 SER 72 12.446 5.287 11.562 560 HG SER 72 HG SER 72 12.116 7.127 13.057 561 HA PRO 73 HA PRO 73 16.556 6.278 8.216 562 1HB PRO 73 HB2 PRO 73 18.970 5.613 9.664 563 2HB PRO 73 HB1 PRO 73 18.642 7.071 8.715 564 1HG PRO 73 HG2 PRO 73 18.801 6.848 11.596 565 2HG PRO 73 HG1 PRO 73 18.474 8.301 10.642 566 1HD PRO 73 HD2 PRO 73 16.604 6.766 12.243 567 2HD PRO 73 HD1 PRO 73 16.287 8.250 11.320 568 H PHE 74 HN PHE 74 17.455 4.274 7.328 569 HA PHE 74 HA PHE 74 16.241 1.905 8.494 570 1HB PHE 74 HB2 PHE 74 18.152 2.199 6.159 571 2HB PHE 74 HB1 PHE 74 17.256 0.735 6.563 572 HD1 PHE 74 HD1 PHE 74 14.726 0.785 6.538 573 HD2 PHE 74 HD2 PHE 74 17.123 3.987 4.976 574 HE1 PHE 74 HE1 PHE 74 12.772 1.635 5.275 575 HE2 PHE 74 HE2 PHE 74 15.165 4.838 3.716 576 HZ PHE 74 HZ PHE 74 12.991 3.663 3.867 577 H ASP 75 HN ASP 75 17.365 0.063 9.301 578 HA ASP 75 HA ASP 75 20.263 0.443 9.942 579 1HB ASP 75 HB2 ASP 75 18.771 1.069 11.909 580 2HB ASP 75 HB1 ASP 75 18.227 -0.608 11.928 581 H GLY 76 HN GLY 76 20.322 -1.057 8.058 582 1HA GLY 76 HA2 GLY 76 20.776 -3.208 7.263 583 2HA GLY 76 HA1 GLY 76 20.650 -3.783 8.927 584 HA PRO 77 HA PRO 77 16.993 -5.245 6.337 585 1HB PRO 77 HB2 PRO 77 17.497 -7.925 7.321 586 2HB PRO 77 HB1 PRO 77 17.618 -7.342 5.657 587 1HG PRO 77 HG2 PRO 77 19.791 -8.049 7.414 588 2HG PRO 77 HG1 PRO 77 19.907 -7.393 5.773 589 1HD PRO 77 HD2 PRO 77 20.450 -6.035 8.293 590 2HD PRO 77 HD1 PRO 77 20.674 -5.421 6.643 591 H GLY 78 HN GLY 78 17.899 -4.799 9.479 592 1HA GLY 78 HA2 GLY 78 15.600 -6.193 10.723 593 2HA GLY 78 HA1 GLY 78 16.852 -5.287 11.578 594 H GLY 79 HN GLY 79 14.270 -4.809 12.296 595 1HA GLY 79 HA2 GLY 79 12.965 -2.889 12.757 596 2HA GLY 79 HA1 GLY 79 13.984 -1.975 11.640 597 H ASN 80 HN ASN 80 11.788 -1.131 10.964 598 HA ASN 80 HA ASN 80 9.968 -2.885 9.559 599 1HB ASN 80 HB2 ASN 80 10.364 0.123 9.476 600 2HB ASN 80 HB1 ASN 80 9.051 -0.719 8.656 601 1HD2 ASN 80 HD22 ASN 80 8.007 0.368 12.148 602 2HD2 ASN 80 HD21 ASN 80 8.756 1.216 10.883 603 H LEU 81 HN LEU 81 9.757 -3.099 7.260 604 HA LEU 81 HA LEU 81 12.327 -2.818 5.819 605 1HB LEU 81 HB2 LEU 81 9.706 -3.894 4.751 606 2HB LEU 81 HB1 LEU 81 11.322 -4.197 4.126 607 HG LEU 81 HG LEU 81 10.262 -5.122 6.815 608 1HD1 LEU 81 HD12 LEU 81 10.885 -6.586 4.236 609 2HD1 LEU 81 HD11 LEU 81 10.486 -7.373 5.762 610 3HD1 LEU 81 HD13 LEU 81 9.290 -6.360 4.951 611 1HD2 LEU 81 HD21 LEU 81 12.934 -5.497 5.432 612 2HD2 LEU 81 HD23 LEU 81 12.647 -4.759 7.007 613 3HD2 LEU 81 HD22 LEU 81 12.402 -6.489 6.784 614 H ALA 82 HN ALA 82 9.614 -0.975 6.390 615 HA ALA 82 HA ALA 82 10.349 1.048 4.491 616 1HB ALA 82 HB3 ALA 82 7.921 -0.650 3.839 617 2HB ALA 82 HB2 ALA 82 8.255 0.919 3.105 618 3HB ALA 82 HB1 ALA 82 9.356 -0.432 2.838 619 H HIS 83 HN HIS 83 8.386 2.705 4.382 620 HA HIS 83 HA HIS 83 6.525 2.605 6.604 621 1HB HIS 83 HB2 HIS 83 7.481 4.506 7.862 622 2HB HIS 83 HB1 HIS 83 8.586 3.132 7.847 623 HD1 HIS 83 HD1 HIS 83 10.855 3.474 6.784 624 HD2 HIS 83 HD2 HIS 83 8.240 6.618 5.969 625 HE1 HIS 83 HE1 HIS 83 12.227 5.265 5.638 626 H ALA 84 HN ALA 84 5.260 4.653 6.722 627 HA ALA 84 HA ALA 84 5.524 6.441 4.373 628 1HB ALA 84 HB2 ALA 84 4.038 4.565 3.664 629 2HB ALA 84 HB1 ALA 84 2.969 4.933 5.019 630 3HB ALA 84 HB3 ALA 84 3.187 6.109 3.721 631 H PHE 85 HN PHE 85 4.048 8.337 4.617 632 HA PHE 85 HA PHE 85 3.874 9.096 7.480 633 1HB PHE 85 HB2 PHE 85 3.650 10.648 4.889 634 2HB PHE 85 HB1 PHE 85 3.360 11.373 6.471 635 HD1 PHE 85 HD2 PHE 85 5.894 9.834 4.263 636 HD2 PHE 85 HD1 PHE 85 5.175 11.722 8.056 637 HE1 PHE 85 HE2 PHE 85 8.337 10.108 4.594 638 HE2 PHE 85 HE1 PHE 85 7.616 11.995 8.384 639 HZ PHE 85 HZ PHE 85 9.198 11.187 6.656 640 H GLN 86 HN GLN 86 1.864 10.214 8.224 641 HA GLN 86 HA GLN 86 -0.428 8.625 7.717 642 1HB GLN 86 HB2 GLN 86 -0.080 11.321 9.036 643 2HB GLN 86 HB1 GLN 86 -1.642 10.507 8.962 644 1HG GLN 86 HG2 GLN 86 -0.599 8.506 10.050 645 2HG GLN 86 HG1 GLN 86 0.890 9.433 10.233 646 1HE2 GLN 86 HE22 GLN 86 -1.031 9.841 13.394 647 2HE2 GLN 86 HE21 GLN 86 -0.296 8.549 12.576 648 HA PRO 87 HA PRO 87 -2.061 10.379 3.986 649 1HB PRO 87 HB2 PRO 87 -4.833 10.384 4.780 650 2HB PRO 87 HB1 PRO 87 -3.996 9.172 3.801 651 1HG PRO 87 HG2 PRO 87 -4.854 8.968 6.591 652 2HG PRO 87 HG1 PRO 87 -4.209 7.696 5.541 653 1HD PRO 87 HD2 PRO 87 -2.846 8.945 7.717 654 2HD PRO 87 HD1 PRO 87 -2.143 7.847 6.510 655 H GLY 88 HN GLY 88 -1.474 12.543 3.890 656 1HA GLY 88 HA2 GLY 88 -3.447 14.529 4.589 657 2HA GLY 88 HA1 GLY 88 -2.051 14.614 5.663 658 HA PRO 89 HA PRO 89 -1.351 16.838 1.496 659 1HB PRO 89 HB2 PRO 89 -1.027 19.358 2.857 660 2HB PRO 89 HB1 PRO 89 -2.323 18.898 1.741 661 1HG PRO 89 HG2 PRO 89 -2.466 19.189 4.644 662 2HG PRO 89 HG1 PRO 89 -3.787 18.891 3.504 663 1HD PRO 89 HD2 PRO 89 -2.650 17.004 5.351 664 2HD PRO 89 HD1 PRO 89 -3.871 16.686 4.101 665 H GLY 90 HN GLY 90 0.674 18.508 1.312 666 1HA GLY 90 HA2 GLY 90 2.982 18.787 1.591 667 2HA GLY 90 HA1 GLY 90 2.733 18.390 3.290 668 H ILE 91 HN ILE 91 4.113 16.773 3.810 669 HA ILE 91 HA ILE 91 4.983 14.814 1.824 670 HB ILE 91 HB ILE 91 6.471 15.735 3.628 671 1HG1 ILE 91 HG12 ILE 91 6.156 12.742 3.959 672 2HG1 ILE 91 HG11 ILE 91 6.751 13.437 2.454 673 1HG2 ILE 91 HG23 ILE 91 4.552 15.571 5.358 674 2HG2 ILE 91 HG22 ILE 91 4.993 13.868 5.492 675 3HG2 ILE 91 HG21 ILE 91 6.168 15.116 5.902 676 1HD1 ILE 91 HD11 ILE 91 7.964 14.033 5.160 677 2HD1 ILE 91 HD13 ILE 91 8.565 12.782 4.073 678 3HD1 ILE 91 HD12 ILE 91 8.611 14.474 3.580 679 H GLY 92 HN GLY 92 2.311 15.042 3.885 680 1HA GLY 92 HA2 GLY 92 1.986 12.390 4.830 681 2HA GLY 92 HA1 GLY 92 0.655 13.488 4.476 682 H GLY 93 HN GLY 93 1.116 10.528 3.911 683 1HA GLY 93 HA2 GLY 93 0.086 9.180 2.247 684 2HA GLY 93 HA1 GLY 93 0.034 10.577 1.172 685 H ASP 94 HN ASP 94 3.052 10.929 1.961 686 HA ASP 94 HA ASP 94 4.094 9.623 -0.382 687 1HB ASP 94 HB2 ASP 94 5.474 10.912 1.985 688 2HB ASP 94 HB1 ASP 94 6.329 10.325 0.559 689 H ALA 95 HN ALA 95 4.891 7.592 -0.623 690 HA ALA 95 HA ALA 95 5.217 5.881 1.816 691 1HB ALA 95 HB2 ALA 95 3.551 5.132 0.106 692 2HB ALA 95 HB1 ALA 95 4.855 5.036 -1.076 693 3HB ALA 95 HB3 ALA 95 4.864 3.975 0.331 694 H HIS 96 HN HIS 96 7.276 5.389 2.381 695 HA HIS 96 HA HIS 96 9.456 5.693 0.343 696 1HB HIS 96 HB2 HIS 96 9.459 5.809 3.373 697 2HB HIS 96 HB1 HIS 96 10.932 5.767 2.408 698 HD2 HIS 96 HD2 HIS 96 8.621 8.081 0.409 699 HE1 HIS 96 HE1 HIS 96 10.655 10.433 3.307 700 HE2 HIS 96 HE2 HIS 96 9.245 10.492 1.206 701 H PHE 97 HN PHE 97 10.517 3.853 -0.301 702 HA PHE 97 HA PHE 97 10.007 1.319 1.249 703 1HB PHE 97 HB2 PHE 97 10.544 1.852 -1.677 704 2HB PHE 97 HB1 PHE 97 10.750 0.243 -0.979 705 HD1 PHE 97 HD1 PHE 97 8.287 3.044 -1.259 706 HD2 PHE 97 HD2 PHE 97 8.888 -1.171 -0.707 707 HE1 PHE 97 HE1 PHE 97 5.834 2.676 -1.380 708 HE2 PHE 97 HE2 PHE 97 6.443 -1.539 -0.837 709 HZ PHE 97 HZ PHE 97 4.914 0.382 -1.171 710 H ASP 98 HN ASP 98 11.722 0.124 1.986 711 HA ASP 98 HA ASP 98 14.324 1.374 2.161 712 1HB ASP 98 HB2 ASP 98 13.375 -0.163 3.893 713 2HB ASP 98 HB1 ASP 98 13.556 -1.505 2.761 714 H GLU 99 HN GLU 99 15.382 1.600 0.194 715 HA GLU 99 HA GLU 99 15.354 -0.535 -1.802 716 1HB GLU 99 HB2 GLU 99 15.408 1.818 -2.473 717 2HB GLU 99 HB1 GLU 99 16.950 2.032 -1.666 718 1HG GLU 99 HG2 GLU 99 18.044 0.513 -3.198 719 2HG GLU 99 HG1 GLU 99 16.496 0.047 -3.909 720 H ASP 100 HN ASP 100 17.151 -0.015 1.023 721 HA ASP 100 HA ASP 100 19.693 -1.084 0.065 722 1HB ASP 100 HB2 ASP 100 18.551 -0.670 2.841 723 2HB ASP 100 HB1 ASP 100 20.161 -1.322 2.552 724 H GLU 101 HN GLU 101 16.671 -2.413 0.903 725 HA GLU 101 HA GLU 101 17.752 -5.046 1.684 726 1HB GLU 101 HB2 GLU 101 14.945 -3.993 1.271 727 2HB GLU 101 HB1 GLU 101 15.307 -5.658 1.733 728 1HG GLU 101 HG2 GLU 101 16.369 -4.946 3.771 729 2HG GLU 101 HG1 GLU 101 16.293 -3.253 3.280 730 H ARG 102 HN ARG 102 16.910 -6.994 0.489 731 HA ARG 102 HA ARG 102 17.297 -6.592 -2.417 732 1HB ARG 102 HB2 ARG 102 18.426 -8.448 -1.127 733 2HB ARG 102 HB1 ARG 102 16.833 -9.167 -0.881 734 1HG ARG 102 HG2 ARG 102 16.521 -9.210 -3.360 735 2HG ARG 102 HG1 ARG 102 18.172 -8.625 -3.543 736 1HD ARG 102 HD2 ARG 102 17.331 -11.189 -2.179 737 2HD ARG 102 HD1 ARG 102 18.090 -11.079 -3.760 738 HE ARG 102 HE ARG 102 19.411 -11.082 -1.193 739 1HH1 ARG 102 HH21 ARG 102 19.534 -9.533 -4.280 740 2HH1 ARG 102 HH22 ARG 102 21.147 -8.945 -4.051 741 1HH2 ARG 102 HH11 ARG 102 21.501 -10.341 -0.905 742 2HH2 ARG 102 HH12 ARG 102 22.251 -9.388 -2.142 743 H TRP 103 HN TRP 103 15.439 -6.000 -3.489 744 HA TRP 103 HA TRP 103 12.827 -7.032 -2.550 745 1HB TRP 103 HB2 TRP 103 13.586 -5.026 -4.685 746 2HB TRP 103 HB1 TRP 103 11.927 -5.522 -4.355 747 HD1 TRP 103 HD1 TRP 103 14.245 -2.908 -3.495 748 HE1 TRP 103 HE1 TRP 103 13.593 -1.722 -1.301 749 HE3 TRP 103 HE3 TRP 103 10.876 -6.278 -1.609 750 HZ2 TRP 103 HZ2 TRP 103 11.889 -2.140 0.947 751 HZ3 TRP 103 HZ3 TRP 103 9.770 -5.852 0.559 752 HH2 TRP 103 HH2 TRP 103 10.268 -3.793 1.840 753 H THR 104 HN THR 104 11.746 -8.638 -3.591 754 HA THR 104 HA THR 104 12.632 -9.440 -6.330 755 HB THR 104 HB THR 104 12.427 -11.833 -5.603 756 HG1 THR 104 HG1 THR 104 12.871 -11.352 -2.999 757 1HG2 THR 104 HG21 THR 104 14.615 -10.490 -5.697 758 2HG2 THR 104 HG23 THR 104 14.491 -10.385 -3.940 759 3HG2 THR 104 HG22 THR 104 14.629 -11.960 -4.723 760 H ASN 105 HN ASN 105 10.997 -10.857 -7.367 761 HA ASN 105 HA ASN 105 8.225 -10.201 -6.426 762 1HB ASN 105 HB2 ASN 105 9.411 -10.450 -9.197 763 2HB ASN 105 HB1 ASN 105 7.671 -10.435 -8.903 764 1HD2 ASN 105 HD22 ASN 105 9.094 -6.914 -9.424 765 2HD2 ASN 105 HD21 ASN 105 9.381 -8.352 -10.281 766 H ASN 106 HN ASN 106 9.837 -12.579 -5.692 767 HA ASN 106 HA ASN 106 7.883 -14.622 -6.597 768 1HB ASN 106 HB2 ASN 106 9.951 -16.149 -7.063 769 2HB ASN 106 HB1 ASN 106 9.481 -14.965 -8.285 770 1HD2 ASN 106 HD22 ASN 106 12.843 -13.856 -8.162 771 2HD2 ASN 106 HD21 ASN 106 11.654 -14.634 -9.090 772 H PHE 107 HN PHE 107 9.148 -16.865 -5.603 773 HA PHE 107 HA PHE 107 8.617 -16.690 -2.794 774 1HB PHE 107 HB2 PHE 107 10.014 -18.790 -4.470 775 2HB PHE 107 HB1 PHE 107 9.635 -19.007 -2.763 776 HD1 PHE 107 HD1 PHE 107 8.250 -18.694 -6.158 777 HD2 PHE 107 HD2 PHE 107 7.324 -19.245 -2.001 778 HE1 PHE 107 HE1 PHE 107 5.949 -19.398 -6.765 779 HE2 PHE 107 HE2 PHE 107 5.026 -19.946 -2.604 780 HZ PHE 107 HZ PHE 107 4.335 -20.025 -4.983 781 H ARG 108 HN ARG 108 11.166 -15.336 -4.314 782 HA ARG 108 HA ARG 108 13.470 -16.253 -2.956 783 1HB ARG 108 HB2 ARG 108 12.730 -13.533 -4.023 784 2HB ARG 108 HB1 ARG 108 14.327 -13.890 -3.376 785 1HG ARG 108 HG2 ARG 108 13.100 -15.624 -5.514 786 2HG ARG 108 HG1 ARG 108 13.934 -14.140 -5.951 787 1HD ARG 108 HD2 ARG 108 15.918 -15.019 -4.597 788 2HD ARG 108 HD1 ARG 108 15.085 -16.567 -4.539 789 HE ARG 108 HE ARG 108 16.633 -15.557 -6.722 790 1HH1 ARG 108 HH21 ARG 108 13.617 -17.151 -6.130 791 2HH1 ARG 108 HH22 ARG 108 13.424 -17.645 -7.777 792 1HH2 ARG 108 HH11 ARG 108 16.396 -16.226 -8.841 793 2HH2 ARG 108 HH12 ARG 108 14.997 -17.137 -9.304 794 H GLU 109 HN GLU 109 14.495 -13.980 -1.602 795 HA GLU 109 HA GLU 109 13.808 -14.516 1.042 796 1HB GLU 109 HB2 GLU 109 14.818 -11.921 -0.145 797 2HB GLU 109 HB1 GLU 109 14.721 -12.230 1.590 798 1HG GLU 109 HG2 GLU 109 16.186 -14.201 1.324 799 2HG GLU 109 HG1 GLU 109 16.286 -13.887 -0.410 800 H TYR 110 HN TYR 110 12.623 -11.599 -0.712 801 HA TYR 110 HA TYR 110 10.082 -11.821 0.865 802 1HB TYR 110 HB2 TYR 110 11.668 -9.262 0.464 803 2HB TYR 110 HB1 TYR 110 10.132 -9.414 1.314 804 HD1 TYR 110 HD2 TYR 110 10.003 -10.659 3.474 805 HD2 TYR 110 HD1 TYR 110 13.737 -9.931 1.474 806 HE1 TYR 110 HE2 TYR 110 11.228 -11.225 5.555 807 HE2 TYR 110 HE1 TYR 110 14.962 -10.492 3.554 808 HH TYR 110 HH TYR 110 14.434 -10.472 6.059 809 H ASN 111 HN ASN 111 8.249 -11.080 -0.261 810 HA ASN 111 HA ASN 111 8.684 -10.551 -3.163 811 1HB ASN 111 HB2 ASN 111 6.212 -10.921 -3.328 812 2HB ASN 111 HB1 ASN 111 7.084 -12.314 -2.684 813 1HD2 ASN 111 HD22 ASN 111 5.818 -10.611 0.645 814 2HD2 ASN 111 HD21 ASN 111 7.243 -10.207 -0.181 815 H LEU 112 HN LEU 112 8.633 -8.506 -3.840 816 HA LEU 112 HA LEU 112 8.184 -6.268 -2.181 817 1HB LEU 112 HB2 LEU 112 9.474 -6.171 -4.272 818 2HB LEU 112 HB1 LEU 112 8.009 -6.479 -5.201 819 HG LEU 112 HG LEU 112 7.038 -4.355 -4.344 820 1HD1 LEU 112 HD11 LEU 112 9.686 -4.245 -2.901 821 2HD1 LEU 112 HD13 LEU 112 8.809 -2.766 -3.290 822 3HD1 LEU 112 HD12 LEU 112 8.067 -3.978 -2.248 823 1HD2 LEU 112 HD23 LEU 112 9.775 -4.158 -5.637 824 2HD2 LEU 112 HD22 LEU 112 8.230 -4.325 -6.471 825 3HD2 LEU 112 HD21 LEU 112 8.600 -2.842 -5.588 826 H HIS 113 HN HIS 113 5.938 -7.987 -4.325 827 HA HIS 113 HA HIS 113 3.847 -6.090 -4.318 828 1HB HIS 113 HB2 HIS 113 3.847 -8.033 -5.797 829 2HB HIS 113 HB1 HIS 113 3.646 -9.109 -4.418 830 HD1 HIS 113 HD1 HIS 113 1.340 -9.872 -5.497 831 HD2 HIS 113 HD2 HIS 113 1.487 -5.879 -4.312 832 HE1 HIS 113 HE1 HIS 113 -1.054 -9.050 -5.450 833 H ARG 114 HN ARG 114 4.263 -8.841 -1.983 834 HA ARG 114 HA ARG 114 1.904 -8.233 -0.506 835 1HB ARG 114 HB2 ARG 114 3.218 -10.334 -0.200 836 2HB ARG 114 HB1 ARG 114 4.471 -9.392 0.610 837 1HG ARG 114 HG2 ARG 114 2.843 -8.681 2.324 838 2HG ARG 114 HG1 ARG 114 1.580 -9.602 1.509 839 1HD ARG 114 HD2 ARG 114 2.748 -11.683 1.940 840 2HD ARG 114 HD1 ARG 114 4.135 -10.815 2.601 841 HE ARG 114 HE ARG 114 2.018 -9.973 4.179 842 1HH1 ARG 114 HH21 ARG 114 3.333 -12.993 3.169 843 2HH1 ARG 114 HH22 ARG 114 2.885 -13.821 4.620 844 1HH2 ARG 114 HH11 ARG 114 1.430 -11.044 6.085 845 2HH2 ARG 114 HH12 ARG 114 1.815 -12.723 6.269 846 H VAL 115 HN VAL 115 5.226 -6.976 -0.130 847 HA VAL 115 HA VAL 115 4.599 -5.471 2.254 848 HB VAL 115 HB VAL 115 6.812 -5.183 0.198 849 1HG1 VAL 115 HG13 VAL 115 6.256 -3.648 2.743 850 2HG1 VAL 115 HG12 VAL 115 7.888 -3.796 2.088 851 3HG1 VAL 115 HG11 VAL 115 6.625 -3.011 1.139 852 1HG2 VAL 115 HG22 VAL 115 6.584 -6.440 2.944 853 2HG2 VAL 115 HG21 VAL 115 7.099 -7.194 1.438 854 3HG2 VAL 115 HG23 VAL 115 8.144 -6.023 2.239 855 H ALA 116 HN ALA 116 4.595 -4.664 -1.217 856 HA ALA 116 HA ALA 116 4.089 -1.888 -0.995 857 1HB ALA 116 HB2 ALA 116 4.504 -3.090 -3.145 858 2HB ALA 116 HB1 ALA 116 2.894 -3.799 -3.027 859 3HB ALA 116 HB3 ALA 116 3.079 -2.054 -3.216 860 H ALA 117 HN ALA 117 1.844 -4.645 -0.919 861 HA ALA 117 HA ALA 117 -0.569 -3.153 -0.700 862 1HB ALA 117 HB1 ALA 117 -0.438 -5.626 -1.091 863 2HB ALA 117 HB3 ALA 117 0.051 -5.826 0.593 864 3HB ALA 117 HB2 ALA 117 -1.548 -5.190 0.208 865 H HIS 118 HN HIS 118 1.761 -4.248 1.747 866 HA HIS 118 HA HIS 118 0.276 -3.535 4.049 867 1HB HIS 118 HB2 HIS 118 2.482 -4.812 3.942 868 2HB HIS 118 HB1 HIS 118 3.276 -3.243 3.807 869 HD1 HIS 118 HD1 HIS 118 1.061 -5.226 6.153 870 HD2 HIS 118 HD2 HIS 118 3.472 -1.826 6.226 871 HE1 HIS 118 HE1 HIS 118 1.191 -4.495 8.573 872 H GLU 119 HN GLU 119 2.652 -1.515 2.220 873 HA GLU 119 HA GLU 119 2.249 0.802 3.866 874 1HB GLU 119 HB2 GLU 119 3.124 0.552 0.969 875 2HB GLU 119 HB1 GLU 119 3.081 2.084 1.836 876 1HG GLU 119 HG2 GLU 119 5.306 1.400 2.133 877 2HG GLU 119 HG1 GLU 119 4.543 0.852 3.623 878 H LEU 120 HN LEU 120 0.635 -0.373 0.944 879 HA LEU 120 HA LEU 120 -1.078 1.903 0.609 880 1HB LEU 120 HB2 LEU 120 -1.379 -0.988 -0.245 881 2HB LEU 120 HB1 LEU 120 -2.486 0.290 -0.736 882 HG LEU 120 HG LEU 120 0.509 0.367 -1.222 883 1HD1 LEU 120 HD13 LEU 120 -1.754 -0.445 -3.072 884 2HD1 LEU 120 HD12 LEU 120 -0.089 -0.164 -3.584 885 3HD1 LEU 120 HD11 LEU 120 -0.460 -1.485 -2.475 886 1HD2 LEU 120 HD21 LEU 120 -1.815 2.153 -1.946 887 2HD2 LEU 120 HD23 LEU 120 -0.203 2.595 -1.385 888 3HD2 LEU 120 HD22 LEU 120 -0.437 2.052 -3.041 889 H GLY 121 HN GLY 121 -1.379 -1.100 2.476 890 1HA GLY 121 HA2 GLY 121 -4.107 -0.813 3.235 891 2HA GLY 121 HA1 GLY 121 -2.885 -1.649 4.194 892 H HIS 122 HN HIS 122 -1.127 0.519 4.650 893 HA HIS 122 HA HIS 122 -2.455 1.816 6.867 894 1HB HIS 122 HB2 HIS 122 0.245 2.202 5.550 895 2HB HIS 122 HB1 HIS 122 -0.293 3.210 6.894 896 HD1 HIS 122 HD1 HIS 122 -1.135 1.748 9.076 897 HD2 HIS 122 HD2 HIS 122 1.414 -0.166 6.391 898 HE1 HIS 122 HE1 HIS 122 -0.145 -0.229 10.311 899 H SER 123 HN SER 123 -1.539 2.853 3.594 900 HA SER 123 HA SER 123 -2.161 5.613 3.872 901 1HB SER 123 HB2 SER 123 -2.291 5.673 1.464 902 2HB SER 123 HB1 SER 123 -1.039 4.507 1.881 903 HG SER 123 HG SER 123 -3.672 3.602 1.636 904 H LEU 124 HN LEU 124 -4.205 2.799 3.578 905 HA LEU 124 HA LEU 124 -6.618 4.395 3.011 906 1HB LEU 124 HB2 LEU 124 -6.264 1.466 3.699 907 2HB LEU 124 HB1 LEU 124 -7.781 2.207 3.200 908 HG LEU 124 HG LEU 124 -5.244 2.209 1.536 909 1HD1 LEU 124 HD12 LEU 124 -7.594 0.320 1.650 910 2HD1 LEU 124 HD11 LEU 124 -6.736 0.569 0.132 911 3HD1 LEU 124 HD13 LEU 124 -5.875 -0.051 1.539 912 1HD2 LEU 124 HD23 LEU 124 -8.060 3.215 1.119 913 2HD2 LEU 124 HD22 LEU 124 -6.529 4.001 0.732 914 3HD2 LEU 124 HD21 LEU 124 -7.115 2.676 -0.268 915 H GLY 125 HN GLY 125 -4.761 3.817 5.710 916 1HA GLY 125 HA2 GLY 125 -5.227 4.522 7.928 917 2HA GLY 125 HA1 GLY 125 -6.925 4.705 7.490 918 H LEU 126 HN LEU 126 -5.628 1.677 6.547 919 HA LEU 126 HA LEU 126 -7.328 0.309 8.493 920 1HB LEU 126 HB2 LEU 126 -5.299 -0.797 6.522 921 2HB LEU 126 HB1 LEU 126 -6.436 -1.767 7.455 922 HG LEU 126 HG LEU 126 -7.227 0.410 5.504 923 1HD1 LEU 126 HD13 LEU 126 -7.241 -2.612 5.216 924 2HD1 LEU 126 HD12 LEU 126 -7.942 -1.484 4.056 925 3HD1 LEU 126 HD11 LEU 126 -6.203 -1.488 4.336 926 1HD2 LEU 126 HD23 LEU 126 -8.745 -1.459 7.314 927 2HD2 LEU 126 HD22 LEU 126 -9.049 0.241 6.951 928 3HD2 LEU 126 HD21 LEU 126 -9.462 -0.997 5.769 929 H SER 127 HN SER 127 -6.589 -1.069 10.193 930 HA SER 127 HA SER 127 -3.815 -0.442 11.154 931 1HB SER 127 HB2 SER 127 -6.306 -1.260 12.672 932 2HB SER 127 HB1 SER 127 -4.716 -1.065 13.401 933 HG SER 127 HG SER 127 -6.500 0.791 13.003 934 H HIS 128 HN HIS 128 -2.653 -2.188 12.213 935 HA HIS 128 HA HIS 128 -2.497 -4.577 10.757 936 1HB HIS 128 HB2 HIS 128 -1.756 -4.109 13.658 937 2HB HIS 128 HB1 HIS 128 -1.200 -5.461 12.672 938 HD1 HIS 128 HD1 HIS 128 0.544 -2.997 13.906 939 HD2 HIS 128 HD2 HIS 128 -0.576 -3.547 9.930 940 HE1 HIS 128 HE1 HIS 128 2.201 -1.693 12.507 941 H SER 129 HN SER 129 -2.843 -6.837 11.814 942 HA SER 129 HA SER 129 -5.299 -6.995 13.467 943 1HB SER 129 HB2 SER 129 -6.064 -6.900 11.087 944 2HB SER 129 HB1 SER 129 -5.089 -8.326 10.746 945 HG SER 129 HG SER 129 -6.674 -9.459 11.507 946 H THR 130 HN THR 130 -5.665 -9.238 14.221 947 HA THR 130 HA THR 130 -3.077 -10.641 14.606 948 HB THR 130 HB THR 130 -4.139 -11.740 16.447 949 HG1 THR 130 HG1 THR 130 -6.246 -11.609 14.933 950 1HG2 THR 130 HG23 THR 130 -3.606 -9.349 16.807 951 2HG2 THR 130 HG22 THR 130 -5.234 -8.919 16.280 952 3HG2 THR 130 HG21 THR 130 -5.004 -9.856 17.756 953 H ASP 131 HN ASP 131 -5.434 -10.804 12.328 954 HA ASP 131 HA ASP 131 -5.820 -13.709 12.292 955 1HB ASP 131 HB2 ASP 131 -7.566 -12.182 11.430 956 2HB ASP 131 HB1 ASP 131 -6.453 -11.627 10.182 957 H ILE 132 HN ILE 132 -4.348 -15.073 11.505 958 HA ILE 132 HA ILE 132 -1.884 -14.288 10.331 959 HB ILE 132 HB ILE 132 -3.345 -16.942 10.281 960 1HG1 ILE 132 HG12 ILE 132 -0.978 -15.998 11.934 961 2HG1 ILE 132 HG11 ILE 132 -2.647 -15.967 12.503 962 1HG2 ILE 132 HG22 ILE 132 -0.549 -16.190 9.395 963 2HG2 ILE 132 HG21 ILE 132 -1.007 -17.843 9.802 964 3HG2 ILE 132 HG23 ILE 132 -1.796 -17.016 8.461 965 1HD1 ILE 132 HD13 ILE 132 -2.698 -18.483 11.899 966 2HD1 ILE 132 HD12 ILE 132 -0.942 -18.366 11.838 967 3HD1 ILE 132 HD11 ILE 132 -1.795 -18.010 13.337 968 H GLY 133 HN GLY 133 -4.942 -15.313 8.845 969 1HA GLY 133 HA2 GLY 133 -3.897 -15.427 6.161 970 2HA GLY 133 HA1 GLY 133 -5.603 -15.339 6.594 971 H ALA 134 HN ALA 134 -4.027 -12.783 8.092 972 HA ALA 134 HA ALA 134 -5.033 -10.910 6.002 973 1HB ALA 134 HB1 ALA 134 -4.068 -10.415 8.837 974 2HB ALA 134 HB3 ALA 134 -4.682 -9.171 7.752 975 3HB ALA 134 HB2 ALA 134 -5.745 -10.464 8.300 976 H LEU 135 HN LEU 135 -3.667 -9.583 4.839 977 HA LEU 135 HA LEU 135 -0.859 -10.269 4.691 978 1HB LEU 135 HB2 LEU 135 -2.261 -7.815 3.584 979 2HB LEU 135 HB1 LEU 135 -0.721 -8.481 3.041 980 HG LEU 135 HG LEU 135 -3.384 -9.929 2.904 981 1HD1 LEU 135 HD12 LEU 135 -1.743 -8.477 0.815 982 2HD1 LEU 135 HD11 LEU 135 -3.049 -9.593 0.420 983 3HD1 LEU 135 HD13 LEU 135 -3.394 -8.117 1.320 984 1HD2 LEU 135 HD22 LEU 135 -0.560 -10.641 2.093 985 2HD2 LEU 135 HD21 LEU 135 -1.711 -11.601 3.025 986 3HD2 LEU 135 HD23 LEU 135 -1.947 -11.384 1.295 987 H MET 136 HN MET 136 -2.720 -7.778 6.309 988 HA MET 136 HA MET 136 -0.461 -6.111 6.989 989 1HB MET 136 HB2 MET 136 -3.165 -6.319 8.351 990 2HB MET 136 HB1 MET 136 -2.032 -4.973 8.471 991 1HG MET 136 HG2 MET 136 -3.337 -5.919 5.903 992 2HG MET 136 HG1 MET 136 -3.850 -4.514 6.830 993 1HE MET 136 HE1 MET 136 -2.462 -2.830 7.620 994 2HE MET 136 HE3 MET 136 -0.709 -2.767 7.392 995 3HE MET 136 HE2 MET 136 -1.771 -1.814 6.361 996 H TYR 137 HN TYR 137 -0.782 -9.184 7.791 997 HA TYR 137 HA TYR 137 -0.712 -9.246 10.634 998 1HB TYR 137 HB2 TYR 137 -0.959 -11.212 8.986 999 2HB TYR 137 HB1 TYR 137 0.800 -11.197 8.891 1000 HD1 TYR 137 HD2 TYR 137 -2.037 -11.315 11.321 1001 HD2 TYR 137 HD1 TYR 137 2.074 -12.301 10.555 1002 HE1 TYR 137 HE2 TYR 137 -1.938 -12.573 13.457 1003 HE2 TYR 137 HE1 TYR 137 2.165 -13.554 12.697 1004 HH TYR 137 HH TYR 137 0.564 -14.699 14.225 1005 HA PRO 138 HA PRO 138 3.257 -7.271 11.247 1006 1HB PRO 138 HB2 PRO 138 3.882 -8.684 13.682 1007 2HB PRO 138 HB1 PRO 138 3.218 -7.052 13.518 1008 1HG PRO 138 HG2 PRO 138 1.837 -9.491 14.346 1009 2HG PRO 138 HG1 PRO 138 1.235 -7.829 14.366 1010 1HD PRO 138 HD2 PRO 138 0.442 -9.895 12.566 1011 2HD PRO 138 HD1 PRO 138 0.014 -8.173 12.468 1012 H SER 139 HN SER 139 3.122 -10.825 11.755 1013 HA SER 139 HA SER 139 5.998 -11.065 11.171 1014 1HB SER 139 HB2 SER 139 4.025 -13.335 11.354 1015 2HB SER 139 HB1 SER 139 5.756 -13.370 11.657 1016 HG SER 139 HG SER 139 3.811 -12.923 13.384 1017 H TYR 140 HN TYR 140 6.877 -11.553 9.222 1018 HA TYR 140 HA TYR 140 5.220 -11.503 6.843 1019 1HB TYR 140 HB2 TYR 140 7.521 -10.593 6.875 1020 2HB TYR 140 HB1 TYR 140 8.154 -12.211 7.177 1021 HD1 TYR 140 HD1 TYR 140 8.123 -13.928 5.426 1022 HD2 TYR 140 HD2 TYR 140 6.604 -9.976 4.693 1023 HE1 TYR 140 HE1 TYR 140 8.134 -14.377 2.989 1024 HE2 TYR 140 HE2 TYR 140 6.609 -10.426 2.250 1025 HH TYR 140 HH TYR 140 8.263 -12.946 0.856 1026 H THR 141 HN THR 141 4.390 -13.236 5.736 1027 HA THR 141 HA THR 141 5.542 -15.929 6.040 1028 HB THR 141 HB THR 141 3.294 -16.887 6.703 1029 HG1 THR 141 HG1 THR 141 2.062 -15.058 6.168 1030 1HG2 THR 141 HG21 THR 141 5.220 -16.419 8.312 1031 2HG2 THR 141 HG23 THR 141 4.346 -14.959 8.777 1032 3HG2 THR 141 HG22 THR 141 3.616 -16.543 9.034 1033 H PHE 142 HN PHE 142 5.768 -15.088 3.698 1034 HA PHE 142 HA PHE 142 3.338 -14.964 2.101 1035 1HB PHE 142 HB2 PHE 142 5.230 -13.671 1.354 1036 2HB PHE 142 HB1 PHE 142 6.269 -15.097 1.352 1037 HD1 PHE 142 HD1 PHE 142 3.319 -13.520 -0.289 1038 HD2 PHE 142 HD2 PHE 142 6.304 -16.608 -0.500 1039 HE1 PHE 142 HE1 PHE 142 2.658 -14.006 -2.632 1040 HE2 PHE 142 HE2 PHE 142 5.638 -17.089 -2.838 1041 HZ PHE 142 HZ PHE 142 3.816 -15.791 -3.904 1042 H SER 143 HN SER 143 2.422 -16.546 0.881 1043 HA SER 143 HA SER 143 3.726 -18.993 0.121 1044 1HB SER 143 HB2 SER 143 2.492 -20.557 1.552 1045 2HB SER 143 HB1 SER 143 3.450 -19.466 2.546 1046 HG SER 143 HG SER 143 1.121 -18.303 2.129 1047 H GLY 144 HN GLY 144 2.482 -20.025 -1.461 1048 1HA GLY 144 HA2 GLY 144 0.662 -20.379 -2.919 1049 2HA GLY 144 HA1 GLY 144 -0.387 -19.680 -1.684 1050 H ASP 145 HN ASP 145 -1.436 -17.933 -2.474 1051 HA ASP 145 HA ASP 145 0.057 -16.031 -4.264 1052 1HB ASP 145 HB2 ASP 145 -2.023 -15.605 -5.437 1053 2HB ASP 145 HB1 ASP 145 -1.741 -17.347 -5.431 1054 H VAL 146 HN VAL 146 -0.969 -13.781 -4.172 1055 HA VAL 146 HA VAL 146 -1.474 -13.104 -1.316 1056 HB VAL 146 HB VAL 146 -1.011 -11.231 -3.653 1057 1HG1 VAL 146 HG11 VAL 146 -2.018 -10.241 -1.619 1058 2HG1 VAL 146 HG13 VAL 146 -0.690 -10.888 -0.654 1059 3HG1 VAL 146 HG12 VAL 146 -0.374 -9.655 -1.875 1060 1HG2 VAL 146 HG23 VAL 146 0.958 -12.497 -1.724 1061 2HG2 VAL 146 HG22 VAL 146 0.897 -12.731 -3.471 1062 3HG2 VAL 146 HG21 VAL 146 1.346 -11.160 -2.809 1063 H GLN 147 HN GLN 147 -3.579 -13.092 -0.759 1064 HA GLN 147 HA GLN 147 -5.555 -11.792 -2.602 1065 1HB GLN 147 HB2 GLN 147 -5.843 -14.398 -1.077 1066 2HB GLN 147 HB1 GLN 147 -7.206 -13.534 -1.793 1067 1HG GLN 147 HG2 GLN 147 -6.145 -13.676 -4.011 1068 2HG GLN 147 HG1 GLN 147 -4.769 -14.520 -3.305 1069 1HE2 GLN 147 HE22 GLN 147 -6.435 -17.641 -3.104 1070 2HE2 GLN 147 HE21 GLN 147 -5.059 -16.753 -2.661 1071 H LEU 148 HN LEU 148 -7.271 -10.701 -1.487 1072 HA LEU 148 HA LEU 148 -6.509 -9.655 1.111 1073 1HB LEU 148 HB2 LEU 148 -9.131 -9.346 -0.387 1074 2HB LEU 148 HB1 LEU 148 -8.585 -8.357 0.969 1075 HG LEU 148 HG LEU 148 -7.181 -8.583 -1.713 1076 1HD1 LEU 148 HD12 LEU 148 -9.398 -7.362 -1.687 1077 2HD1 LEU 148 HD11 LEU 148 -8.690 -6.234 -0.531 1078 3HD1 LEU 148 HD13 LEU 148 -8.023 -6.365 -2.157 1079 1HD2 LEU 148 HD23 LEU 148 -6.557 -7.150 0.870 1080 2HD2 LEU 148 HD22 LEU 148 -5.472 -8.043 -0.196 1081 3HD2 LEU 148 HD21 LEU 148 -6.043 -6.445 -0.663 1082 H ALA 149 HN ALA 149 -7.690 -9.928 3.091 1083 HA ALA 149 HA ALA 149 -9.096 -12.563 3.275 1084 1HB ALA 149 HB3 ALA 149 -7.088 -12.123 4.723 1085 2HB ALA 149 HB2 ALA 149 -7.996 -10.828 5.505 1086 3HB ALA 149 HB1 ALA 149 -8.551 -12.496 5.635 1087 H GLN 150 HN GLN 150 -10.984 -12.629 4.774 1088 HA GLN 150 HA GLN 150 -12.950 -10.688 4.098 1089 1HB GLN 150 HB2 GLN 150 -13.506 -12.964 4.896 1090 2HB GLN 150 HB1 GLN 150 -12.876 -12.558 6.491 1091 1HG GLN 150 HG2 GLN 150 -14.568 -10.795 6.733 1092 2HG GLN 150 HG1 GLN 150 -15.186 -11.147 5.120 1093 1HE2 GLN 150 HE22 GLN 150 -17.484 -13.308 6.741 1094 2HE2 GLN 150 HE21 GLN 150 -17.282 -11.882 5.841 1095 H ASP 151 HN ASP 151 -10.838 -10.990 6.936 1096 HA ASP 151 HA ASP 151 -11.964 -8.891 8.482 1097 1HB ASP 151 HB2 ASP 151 -10.303 -10.479 9.370 1098 2HB ASP 151 HB1 ASP 151 -9.069 -9.787 8.320 1099 H ASP 152 HN ASP 152 -9.449 -8.770 5.922 1100 HA ASP 152 HA ASP 152 -9.037 -5.907 6.278 1101 1HB ASP 152 HB2 ASP 152 -8.253 -7.830 4.068 1102 2HB ASP 152 HB1 ASP 152 -7.817 -6.122 4.071 1103 H ILE 153 HN ILE 153 -10.874 -7.920 3.983 1104 HA ILE 153 HA ILE 153 -11.754 -5.789 2.294 1105 HB ILE 153 HB ILE 153 -13.016 -8.463 2.971 1106 1HG1 ILE 153 HG12 ILE 153 -11.560 -7.542 0.474 1107 2HG1 ILE 153 HG11 ILE 153 -10.768 -8.391 1.802 1108 1HG2 ILE 153 HG21 ILE 153 -13.780 -6.368 0.919 1109 2HG2 ILE 153 HG23 ILE 153 -14.284 -8.053 0.798 1110 3HG2 ILE 153 HG22 ILE 153 -14.805 -7.075 2.167 1111 1HD1 ILE 153 HD13 ILE 153 -12.369 -10.269 1.537 1112 2HD1 ILE 153 HD12 ILE 153 -13.098 -9.432 0.164 1113 3HD1 ILE 153 HD11 ILE 153 -11.429 -9.997 0.070 1114 H ASP 154 HN ASP 154 -13.370 -7.332 5.091 1115 HA ASP 154 HA ASP 154 -15.679 -5.667 5.072 1116 1HB ASP 154 HB2 ASP 154 -14.258 -7.082 7.343 1117 2HB ASP 154 HB1 ASP 154 -15.813 -6.271 7.526 1118 H GLY 155 HN GLY 155 -12.522 -5.258 6.643 1119 1HA GLY 155 HA2 GLY 155 -13.135 -2.959 8.184 1120 2HA GLY 155 HA1 GLY 155 -11.523 -3.383 7.617 1121 H ILE 156 HN ILE 156 -11.683 -3.094 4.897 1122 HA ILE 156 HA ILE 156 -11.706 -0.220 4.633 1123 HB ILE 156 HB ILE 156 -10.217 -1.757 3.309 1124 1HG1 ILE 156 HG12 ILE 156 -10.565 -0.511 1.117 1125 2HG1 ILE 156 HG11 ILE 156 -12.016 0.188 1.828 1126 1HG2 ILE 156 HG21 ILE 156 -11.921 -3.462 2.772 1127 2HG2 ILE 156 HG23 ILE 156 -12.746 -2.304 1.731 1128 3HG2 ILE 156 HG22 ILE 156 -11.127 -2.858 1.325 1129 1HD1 ILE 156 HD13 ILE 156 -9.434 0.399 3.353 1130 2HD1 ILE 156 HD12 ILE 156 -9.701 1.463 1.975 1131 3HD1 ILE 156 HD11 ILE 156 -10.820 1.489 3.333 1132 H GLN 157 HN GLN 157 -13.990 -2.774 3.711 1133 HA GLN 157 HA GLN 157 -15.747 -1.038 2.213 1134 1HB GLN 157 HB2 GLN 157 -16.209 -3.685 3.618 1135 2HB GLN 157 HB1 GLN 157 -17.436 -2.876 2.641 1136 1HG GLN 157 HG2 GLN 157 -16.052 -3.003 0.669 1137 2HG GLN 157 HG1 GLN 157 -14.681 -3.585 1.612 1138 1HE2 GLN 157 HE22 GLN 157 -16.455 -6.514 0.041 1139 2HE2 GLN 157 HE21 GLN 157 -15.786 -5.087 -0.588 1140 H ALA 158 HN ALA 158 -15.636 -2.058 5.616 1141 HA ALA 158 HA ALA 158 -18.097 -0.869 6.425 1142 1HB ALA 158 HB3 ALA 158 -15.520 -1.340 7.952 1143 2HB ALA 158 HB2 ALA 158 -17.024 -0.809 8.707 1144 3HB ALA 158 HB1 ALA 158 -16.942 -2.384 7.916 1145 H ILE 159 HN ILE 159 -14.820 0.472 6.155 1146 HA ILE 159 HA ILE 159 -15.427 3.015 7.320 1147 HB ILE 159 HB ILE 159 -13.315 2.190 5.308 1148 1HG1 ILE 159 HG12 ILE 159 -13.098 2.811 8.271 1149 2HG1 ILE 159 HG11 ILE 159 -13.295 1.180 7.632 1150 1HG2 ILE 159 HG22 ILE 159 -13.776 4.791 6.783 1151 2HG2 ILE 159 HG21 ILE 159 -12.199 4.339 6.136 1152 3HG2 ILE 159 HG23 ILE 159 -13.570 4.554 5.047 1153 1HD1 ILE 159 HD13 ILE 159 -11.233 1.552 6.236 1154 2HD1 ILE 159 HD12 ILE 159 -11.002 3.082 7.086 1155 3HD1 ILE 159 HD11 ILE 159 -10.932 1.559 7.975 1156 H TYR 160 HN TYR 160 -15.370 1.989 3.875 1157 HA TYR 160 HA TYR 160 -16.710 4.562 3.157 1158 1HB TYR 160 HB2 TYR 160 -15.352 2.436 1.486 1159 2HB TYR 160 HB1 TYR 160 -16.235 3.795 0.795 1160 HD1 TYR 160 HD2 TYR 160 -15.403 6.090 1.008 1161 HD2 TYR 160 HD1 TYR 160 -13.245 2.775 2.677 1162 HE1 TYR 160 HE2 TYR 160 -13.405 7.535 1.289 1163 HE2 TYR 160 HE1 TYR 160 -11.250 4.217 2.962 1164 HH TYR 160 HH TYR 160 -10.426 6.495 1.665 1165 H GLY 161 HN GLY 161 -17.046 1.077 2.319 1166 1HA GLY 161 HA2 GLY 161 -19.712 0.713 2.969 1167 2HA GLY 161 HA1 GLY 161 -19.772 1.489 1.388 1168 H ARG 162 HN ARG 162 -20.811 -0.982 1.421 1169 HA ARG 162 HA ARG 162 -18.714 -2.944 0.680 1170 1HB ARG 162 HB2 ARG 162 -21.722 -3.157 0.977 1171 2HB ARG 162 HB1 ARG 162 -20.694 -4.493 0.465 1172 1HG ARG 162 HG2 ARG 162 -19.422 -4.329 2.574 1173 2HG ARG 162 HG1 ARG 162 -20.454 -2.993 3.090 1174 1HD ARG 162 HD2 ARG 162 -21.425 -5.789 2.434 1175 2HD ARG 162 HD1 ARG 162 -21.190 -5.157 4.064 1176 HE ARG 162 HE ARG 162 -22.890 -3.319 2.891 1177 1HH1 ARG 162 HH21 ARG 162 -22.818 -6.742 3.314 1178 2HH1 ARG 162 HH22 ARG 162 -24.541 -6.904 3.350 1179 1HH2 ARG 162 HH11 ARG 162 -25.134 -3.515 2.944 1180 2HH2 ARG 162 HH12 ARG 162 -25.853 -5.078 3.144 1181 H SER 163 HN SER 163 -18.540 -3.798 -1.429 1182 HA SER 163 HA SER 163 -19.436 -2.017 -3.548 1183 1HB SER 163 HB2 SER 163 -18.121 -4.750 -3.645 1184 2HB SER 163 HB1 SER 163 -18.424 -3.746 -5.059 1185 HG SER 163 HG SER 163 -17.166 -2.109 -3.962 1186 H GLN 164 HN GLN 164 -21.673 -2.030 -3.507 1187 HA GLN 164 HA GLN 164 -23.281 -4.390 -3.294 1188 1HB GLN 164 HB2 GLN 164 -23.892 -1.654 -4.444 1189 2HB GLN 164 HB1 GLN 164 -25.106 -2.918 -4.237 1190 1HG GLN 164 HG2 GLN 164 -24.604 -3.005 -1.820 1191 2HG GLN 164 HG1 GLN 164 -23.400 -1.733 -2.030 1192 1HE2 GLN 164 HE22 GLN 164 -25.791 0.884 -2.252 1193 2HE2 GLN 164 HE21 GLN 164 -24.165 0.453 -2.481 1194 H ASN 165 HN ASN 165 -23.974 -5.802 -4.792 1195 HA ASN 165 HA ASN 165 -23.813 -5.222 -7.669 1196 1HB ASN 165 HB2 ASN 165 -22.094 -7.281 -6.266 1197 2HB ASN 165 HB1 ASN 165 -22.513 -7.450 -7.966 1198 1HD2 ASN 165 HD22 ASN 165 -20.740 -4.280 -8.743 1199 2HD2 ASN 165 HD21 ASN 165 -22.310 -4.884 -8.965 1200 HA PRO 166 HA PRO 166 -27.493 -7.660 -7.621 1201 1HB PRO 166 HB2 PRO 166 -26.696 -9.394 -9.846 1202 2HB PRO 166 HB1 PRO 166 -27.924 -8.120 -9.822 1203 1HG PRO 166 HG2 PRO 166 -25.291 -7.999 -11.015 1204 2HG PRO 166 HG1 PRO 166 -26.517 -6.724 -10.978 1205 1HD PRO 166 HD2 PRO 166 -24.047 -6.757 -9.527 1206 2HD PRO 166 HD1 PRO 166 -25.362 -5.577 -9.363 1207 H VAL 167 HN VAL 167 -27.279 -8.846 -5.708 1208 HA VAL 167 HA VAL 167 -25.536 -11.238 -5.627 1209 HB VAL 167 HB VAL 167 -27.443 -10.225 -3.497 1210 1HG1 VAL 167 HG11 VAL 167 -25.011 -12.030 -3.468 1211 2HG1 VAL 167 HG13 VAL 167 -25.735 -11.359 -2.008 1212 3HG1 VAL 167 HG12 VAL 167 -26.668 -12.449 -3.028 1213 1HG2 VAL 167 HG23 VAL 167 -24.627 -9.374 -4.190 1214 2HG2 VAL 167 HG22 VAL 167 -26.037 -8.363 -3.879 1215 3HG2 VAL 167 HG21 VAL 167 -25.256 -9.211 -2.550 1216 H GLN 168 HN GLN 168 -26.349 -13.171 -6.320 1217 HA GLN 168 HA GLN 168 -29.314 -13.538 -6.359 1218 1HB GLN 168 HB2 GLN 168 -27.066 -14.805 -7.926 1219 2HB GLN 168 HB1 GLN 168 -28.686 -15.501 -7.893 1220 1HG GLN 168 HG2 GLN 168 -28.248 -12.583 -8.552 1221 2HG GLN 168 HG1 GLN 168 -28.139 -13.826 -9.798 1222 1HE2 GLN 168 HE22 GLN 168 -31.748 -12.502 -8.835 1223 2HE2 GLN 168 HE21 GLN 168 -30.300 -11.663 -8.559 1224 HA PRO 169 HA PRO 169 -27.566 -17.463 -4.135 1225 1HB PRO 169 HB2 PRO 169 -25.455 -16.541 -2.360 1226 2HB PRO 169 HB1 PRO 169 -25.353 -17.775 -3.623 1227 1HG PRO 169 HG2 PRO 169 -24.175 -15.177 -3.693 1228 2HG PRO 169 HG1 PRO 169 -24.263 -16.332 -5.033 1229 1HD PRO 169 HD2 PRO 169 -25.807 -13.872 -4.626 1230 2HD PRO 169 HD1 PRO 169 -25.674 -14.857 -6.090 No H/Q in entry = 1230 Start of MODEL 14 1 1H VAL 1 HT3 VAL 1 -17.037 16.817 10.188 2 2H VAL 1 HT2 VAL 1 -18.719 16.585 10.281 3 3H VAL 1 HT1 VAL 1 -18.033 18.057 10.778 4 HA VAL 1 HA VAL 1 -17.813 17.310 12.829 5 HB VAL 1 HB VAL 1 -19.818 15.949 12.311 6 1HG1 VAL 1 HG11 VAL 1 -18.647 14.698 10.424 7 2HG1 VAL 1 HG13 VAL 1 -17.907 13.692 11.671 8 3HG1 VAL 1 HG12 VAL 1 -19.661 13.716 11.480 9 1HG2 VAL 1 HG23 VAL 1 -18.681 15.746 14.541 10 2HG2 VAL 1 HG22 VAL 1 -19.547 14.284 14.067 11 3HG2 VAL 1 HG21 VAL 1 -17.791 14.359 13.915 12 H LEU 2 HN LEU 2 -16.215 16.358 14.154 13 HA LEU 2 HA LEU 2 -13.779 15.601 12.813 14 1HB LEU 2 HB2 LEU 2 -13.802 16.777 14.989 15 2HB LEU 2 HB1 LEU 2 -14.565 15.379 15.740 16 HG LEU 2 HG LEU 2 -12.577 14.003 15.154 17 1HD1 LEU 2 HD13 LEU 2 -11.688 16.619 13.942 18 2HD1 LEU 2 HD12 LEU 2 -10.492 15.475 14.549 19 3HD1 LEU 2 HD11 LEU 2 -11.592 14.992 13.263 20 1HD2 LEU 2 HD23 LEU 2 -12.780 15.188 17.338 21 2HD2 LEU 2 HD22 LEU 2 -11.101 14.992 16.834 22 3HD2 LEU 2 HD21 LEU 2 -11.900 16.553 16.649 23 H THR 3 HN THR 3 -12.995 13.552 12.385 24 HA THR 3 HA THR 3 -14.820 11.269 12.948 25 HB THR 3 HB THR 3 -13.441 10.070 11.287 26 HG1 THR 3 HG1 THR 3 -12.026 12.041 10.287 27 1HG2 THR 3 HG23 THR 3 -15.334 11.648 10.639 28 2HG2 THR 3 HG22 THR 3 -14.088 12.831 10.240 29 3HG2 THR 3 HG21 THR 3 -14.160 11.300 9.369 30 H GLU 4 HN GLU 4 -13.971 9.322 13.940 31 HA GLU 4 HA GLU 4 -12.143 9.841 16.106 32 1HB GLU 4 HB2 GLU 4 -13.964 8.104 16.149 33 2HB GLU 4 HB1 GLU 4 -13.013 7.144 15.016 34 1HG GLU 4 HG2 GLU 4 -11.174 7.006 16.616 35 2HG GLU 4 HG1 GLU 4 -12.034 8.061 17.738 36 H GLY 5 HN GLY 5 -9.949 9.383 16.248 37 1HA GLY 5 HA2 GLY 5 -7.809 8.695 15.539 38 2HA GLY 5 HA1 GLY 5 -8.584 7.760 14.259 39 H ASN 6 HN ASN 6 -6.945 8.590 12.763 40 HA ASN 6 HA ASN 6 -6.738 11.438 12.300 41 1HB ASN 6 HB2 ASN 6 -5.763 8.991 10.824 42 2HB ASN 6 HB1 ASN 6 -5.532 10.611 10.164 43 1HD2 ASN 6 HD22 ASN 6 -3.478 9.533 13.560 44 2HD2 ASN 6 HD21 ASN 6 -4.890 8.689 13.141 45 HA PRO 7 HA PRO 7 -10.240 12.029 9.654 46 1HB PRO 7 HB2 PRO 7 -8.822 13.530 7.613 47 2HB PRO 7 HB1 PRO 7 -9.893 14.153 8.876 48 1HG PRO 7 HG2 PRO 7 -6.987 14.301 8.757 49 2HG PRO 7 HG1 PRO 7 -8.071 15.030 9.953 50 1HD PRO 7 HD2 PRO 7 -6.323 12.808 10.380 51 2HD PRO 7 HD1 PRO 7 -7.575 13.407 11.490 52 H ARG 8 HN ARG 8 -11.090 10.744 8.035 53 HA ARG 8 HA ARG 8 -9.243 8.946 6.588 54 1HB ARG 8 HB2 ARG 8 -12.281 9.072 6.597 55 2HB ARG 8 HB1 ARG 8 -11.298 7.763 5.944 56 1HG ARG 8 HG2 ARG 8 -11.006 8.589 8.832 57 2HG ARG 8 HG1 ARG 8 -12.299 7.499 8.344 58 1HD ARG 8 HD2 ARG 8 -10.587 5.994 7.320 59 2HD ARG 8 HD1 ARG 8 -9.326 7.057 7.948 60 HE ARG 8 HE ARG 8 -10.818 6.453 10.188 61 1HH1 ARG 8 HH21 ARG 8 -9.337 4.646 7.656 62 2HH1 ARG 8 HH22 ARG 8 -8.983 3.279 8.658 63 1HH2 ARG 8 HH11 ARG 8 -10.353 4.673 11.514 64 2HH2 ARG 8 HH12 ARG 8 -9.543 3.300 10.836 65 H TRP 9 HN TRP 9 -9.764 8.607 4.156 66 HA TRP 9 HA TRP 9 -9.531 11.147 2.802 67 1HB TRP 9 HB2 TRP 9 -9.963 8.327 1.789 68 2HB TRP 9 HB1 TRP 9 -9.772 9.710 0.714 69 HD1 TRP 9 HD1 TRP 9 -7.861 7.416 3.015 70 HE1 TRP 9 HE1 TRP 9 -5.343 7.932 2.859 71 HE3 TRP 9 HE3 TRP 9 -8.010 11.705 0.241 72 HZ2 TRP 9 HZ2 TRP 9 -3.617 9.906 1.709 73 HZ3 TRP 9 HZ3 TRP 9 -5.917 12.879 -0.372 74 HH2 TRP 9 HH2 TRP 9 -3.720 11.985 0.358 75 H GLU 10 HN GLU 10 -11.153 12.495 2.217 76 HA GLU 10 HA GLU 10 -13.942 11.679 2.517 77 1HB GLU 10 HB2 GLU 10 -12.642 14.242 1.546 78 2HB GLU 10 HB1 GLU 10 -14.387 14.024 1.677 79 1HG GLU 10 HG2 GLU 10 -14.178 13.563 4.077 80 2HG GLU 10 HG1 GLU 10 -12.423 13.708 3.967 81 H GLN 11 HN GLN 11 -11.650 11.703 -0.064 82 HA GLN 11 HA GLN 11 -13.710 11.788 -2.174 83 1HB GLN 11 HB2 GLN 11 -10.714 11.318 -2.259 84 2HB GLN 11 HB1 GLN 11 -11.751 11.370 -3.686 85 1HG GLN 11 HG2 GLN 11 -12.438 13.655 -3.137 86 2HG GLN 11 HG1 GLN 11 -11.469 13.608 -1.665 87 1HE2 GLN 11 HE22 GLN 11 -9.385 13.617 -5.222 88 2HE2 GLN 11 HE21 GLN 11 -10.846 12.759 -5.136 89 H THR 12 HN THR 12 -14.391 9.998 -3.349 90 HA THR 12 HA THR 12 -13.920 7.361 -2.089 91 HB THR 12 HB THR 12 -15.699 6.604 -3.626 92 HG1 THR 12 HG1 THR 12 -15.850 7.693 -5.401 93 1HG2 THR 12 HG22 THR 12 -16.353 7.671 -1.500 94 2HG2 THR 12 HG21 THR 12 -16.359 9.245 -2.295 95 3HG2 THR 12 HG23 THR 12 -17.526 8.011 -2.772 96 H HIS 13 HN HIS 13 -12.515 9.269 -4.406 97 HA HIS 13 HA HIS 13 -11.345 6.903 -5.831 98 1HB HIS 13 HB2 HIS 13 -11.877 9.633 -7.038 99 2HB HIS 13 HB1 HIS 13 -11.269 8.202 -7.871 100 HD1 HIS 13 HD1 HIS 13 -13.109 6.023 -7.030 101 HD2 HIS 13 HD2 HIS 13 -14.511 9.868 -7.820 102 HE1 HIS 13 HE1 HIS 13 -15.580 5.792 -7.535 103 H LEU 14 HN LEU 14 -9.132 6.961 -6.056 104 HA LEU 14 HA LEU 14 -7.679 9.410 -5.116 105 1HB LEU 14 HB2 LEU 14 -7.081 6.538 -4.355 106 2HB LEU 14 HB1 LEU 14 -6.110 7.936 -3.902 107 HG LEU 14 HG LEU 14 -9.042 7.631 -3.190 108 1HD1 LEU 14 HD12 LEU 14 -6.553 6.959 -1.597 109 2HD1 LEU 14 HD11 LEU 14 -8.171 7.073 -0.902 110 3HD1 LEU 14 HD13 LEU 14 -7.815 5.841 -2.112 111 1HD2 LEU 14 HD22 LEU 14 -6.849 9.587 -2.472 112 2HD2 LEU 14 HD21 LEU 14 -8.496 9.921 -3.007 113 3HD2 LEU 14 HD23 LEU 14 -8.203 9.326 -1.376 114 H THR 15 HN THR 15 -5.477 9.514 -5.896 115 HA THR 15 HA THR 15 -4.915 7.823 -8.312 116 HB THR 15 HB THR 15 -4.126 9.773 -9.474 117 HG1 THR 15 HG1 THR 15 -4.502 11.836 -8.169 118 1HG2 THR 15 HG23 THR 15 -6.656 9.385 -9.236 119 2HG2 THR 15 HG22 THR 15 -6.631 10.721 -8.085 120 3HG2 THR 15 HG21 THR 15 -6.144 10.991 -9.758 121 H TYR 16 HN TYR 16 -2.595 7.571 -8.743 122 HA TYR 16 HA TYR 16 -0.764 8.512 -6.599 123 1HB TYR 16 HB2 TYR 16 0.094 6.306 -6.098 124 2HB TYR 16 HB1 TYR 16 -1.650 6.295 -5.847 125 HD1 TYR 16 HD2 TYR 16 -3.135 5.466 -7.735 126 HD2 TYR 16 HD1 TYR 16 1.102 4.782 -7.629 127 HE1 TYR 16 HE2 TYR 16 -3.396 3.611 -9.354 128 HE2 TYR 16 HE1 TYR 16 0.841 2.922 -9.250 129 HH TYR 16 HH TYR 16 -2.168 1.555 -9.998 130 H ARG 17 HN ARG 17 1.501 8.243 -7.167 131 HA ARG 17 HA ARG 17 2.044 7.677 -10.051 132 1HB ARG 17 HB2 ARG 17 1.571 10.134 -9.728 133 2HB ARG 17 HB1 ARG 17 2.958 10.199 -8.642 134 1HG ARG 17 HG2 ARG 17 4.420 9.393 -10.451 135 2HG ARG 17 HG1 ARG 17 3.041 9.329 -11.543 136 1HD ARG 17 HD2 ARG 17 2.703 11.741 -11.293 137 2HD ARG 17 HD1 ARG 17 4.033 11.842 -10.145 138 HE ARG 17 HE ARG 17 4.196 11.823 -13.046 139 1HH1 ARG 17 HH21 ARG 17 5.795 10.677 -10.216 140 2HH1 ARG 17 HH22 ARG 17 7.269 10.301 -11.045 141 1HH2 ARG 17 HH11 ARG 17 6.093 11.312 -14.143 142 2HH2 ARG 17 HH12 ARG 17 7.437 10.662 -13.265 143 H ILE 18 HN ILE 18 4.009 6.681 -10.345 144 HA ILE 18 HA ILE 18 5.715 6.233 -7.946 145 HB ILE 18 HB ILE 18 5.734 4.966 -10.708 146 1HG1 ILE 18 HG12 ILE 18 5.053 3.737 -8.021 147 2HG1 ILE 18 HG11 ILE 18 3.831 4.405 -9.100 148 1HG2 ILE 18 HG23 ILE 18 7.486 4.607 -8.271 149 2HG2 ILE 18 HG22 ILE 18 7.295 3.323 -9.465 150 3HG2 ILE 18 HG21 ILE 18 7.977 4.877 -9.943 151 1HD1 ILE 18 HD11 ILE 18 5.806 2.258 -9.921 152 2HD1 ILE 18 HD13 ILE 18 4.172 1.918 -9.354 153 3HD1 ILE 18 HD12 ILE 18 4.417 2.829 -10.845 154 H GLU 19 HN GLU 19 7.476 7.548 -7.684 155 HA GLU 19 HA GLU 19 8.280 9.446 -9.680 156 1HB GLU 19 HB2 GLU 19 9.581 8.509 -7.117 157 2HB GLU 19 HB1 GLU 19 10.255 9.797 -8.121 158 1HG GLU 19 HG2 GLU 19 8.145 11.052 -7.939 159 2HG GLU 19 HG1 GLU 19 7.462 9.771 -6.940 160 H ASN 20 HN ASN 20 9.645 6.291 -8.727 161 HA ASN 20 HA ASN 20 10.866 6.050 -11.359 162 1HB ASN 20 HB2 ASN 20 13.199 5.933 -10.557 163 2HB ASN 20 HB1 ASN 20 12.497 7.525 -10.263 164 1HD2 ASN 20 HD22 ASN 20 12.956 7.325 -6.790 165 2HD2 ASN 20 HD21 ASN 20 12.643 8.289 -8.152 166 H TYR 21 HN TYR 21 12.106 3.954 -11.535 167 HA TYR 21 HA TYR 21 10.896 1.882 -9.732 168 1HB TYR 21 HB2 TYR 21 12.002 1.674 -12.555 169 2HB TYR 21 HB1 TYR 21 11.406 0.310 -11.609 170 HD1 TYR 21 HD2 TYR 21 10.490 3.423 -13.345 171 HD2 TYR 21 HD1 TYR 21 9.013 0.012 -11.185 172 HE1 TYR 21 HE2 TYR 21 8.184 3.966 -14.070 173 HE2 TYR 21 HE1 TYR 21 6.702 0.558 -11.916 174 HH TYR 21 HH TYR 21 5.528 1.779 -13.556 175 H THR 22 HN THR 22 12.279 0.458 -8.651 176 HA THR 22 HA THR 22 15.058 1.276 -8.461 177 HB THR 22 HB THR 22 14.218 0.554 -6.399 178 HG1 THR 22 HG1 THR 22 15.175 -1.679 -6.208 179 1HG2 THR 22 HG23 THR 22 12.954 -1.691 -7.975 180 2HG2 THR 22 HG22 THR 22 13.059 -1.722 -6.214 181 3HG2 THR 22 HG21 THR 22 12.153 -0.443 -7.022 182 HA PRO 23 HA PRO 23 16.584 -1.474 -11.609 183 1HB PRO 23 HB2 PRO 23 19.097 -2.068 -10.373 184 2HB PRO 23 HB1 PRO 23 18.777 -0.795 -11.560 185 1HG PRO 23 HG2 PRO 23 19.231 -0.530 -8.665 186 2HG PRO 23 HG1 PRO 23 19.227 0.732 -9.907 187 1HD PRO 23 HD2 PRO 23 17.190 0.278 -7.969 188 2HD PRO 23 HD1 PRO 23 17.087 1.344 -9.388 189 H ASP 24 HN ASP 24 15.797 -2.331 -8.484 190 HA ASP 24 HA ASP 24 16.816 -5.003 -8.274 191 1HB ASP 24 HB2 ASP 24 14.330 -3.696 -7.123 192 2HB ASP 24 HB1 ASP 24 14.854 -5.327 -6.706 193 H LEU 25 HN LEU 25 13.839 -3.671 -9.710 194 HA LEU 25 HA LEU 25 13.527 -6.207 -11.230 195 1HB LEU 25 HB2 LEU 25 11.387 -4.865 -9.561 196 2HB LEU 25 HB1 LEU 25 11.025 -6.077 -10.781 197 HG LEU 25 HG LEU 25 12.903 -6.545 -8.445 198 1HD1 LEU 25 HD13 LEU 25 9.954 -7.115 -8.790 199 2HD1 LEU 25 HD12 LEU 25 10.951 -7.924 -7.580 200 3HD1 LEU 25 HD11 LEU 25 10.730 -6.176 -7.515 201 1HD2 LEU 25 HD23 LEU 25 11.777 -8.263 -10.663 202 2HD2 LEU 25 HD22 LEU 25 13.431 -8.178 -10.057 203 3HD2 LEU 25 HD21 LEU 25 12.191 -8.992 -9.113 204 HA PRO 26 HA PRO 26 12.692 -3.327 -14.529 205 1HB PRO 26 HB2 PRO 26 10.719 -4.912 -15.881 206 2HB PRO 26 HB1 PRO 26 12.449 -4.837 -16.239 207 1HG PRO 26 HG2 PRO 26 10.953 -6.992 -14.927 208 2HG PRO 26 HG1 PRO 26 12.619 -7.009 -15.523 209 1HD PRO 26 HD2 PRO 26 11.811 -6.919 -12.790 210 2HD PRO 26 HD1 PRO 26 13.454 -6.681 -13.421 211 H ARG 27 HN ARG 27 10.819 -2.010 -15.383 212 HA ARG 27 HA ARG 27 8.958 -1.348 -13.278 213 1HB ARG 27 HB2 ARG 27 7.959 0.186 -14.963 214 2HB ARG 27 HB1 ARG 27 9.712 0.359 -14.868 215 1HG ARG 27 HG2 ARG 27 9.963 -1.123 -16.837 216 2HG ARG 27 HG1 ARG 27 8.211 -1.287 -16.935 217 1HD ARG 27 HD2 ARG 27 9.745 1.315 -17.186 218 2HD ARG 27 HD1 ARG 27 9.019 0.417 -18.521 219 HE ARG 27 HE ARG 27 6.913 0.824 -16.768 220 1HH1 ARG 27 HH21 ARG 27 9.261 2.747 -18.395 221 2HH1 ARG 27 HH22 ARG 27 8.265 4.164 -18.443 222 1HH2 ARG 27 HH11 ARG 27 5.603 2.652 -16.806 223 2HH2 ARG 27 HH12 ARG 27 6.192 4.114 -17.523 224 H ALA 28 HN ALA 28 8.791 -3.376 -16.134 225 HA ALA 28 HA ALA 28 5.974 -3.615 -16.402 226 1HB ALA 28 HB1 ALA 28 8.186 -5.606 -16.939 227 2HB ALA 28 HB3 ALA 28 6.505 -5.869 -17.400 228 3HB ALA 28 HB2 ALA 28 7.413 -4.531 -18.104 229 H ASP 29 HN ASP 29 8.235 -5.405 -14.324 230 HA ASP 29 HA ASP 29 6.104 -7.128 -13.306 231 1HB ASP 29 HB2 ASP 29 8.979 -6.687 -12.462 232 2HB ASP 29 HB1 ASP 29 7.900 -7.836 -11.670 233 H VAL 30 HN VAL 30 7.723 -4.165 -12.319 234 HA VAL 30 HA VAL 30 6.680 -4.159 -9.627 235 HB VAL 30 HB VAL 30 7.685 -1.920 -11.403 236 1HG1 VAL 30 HG12 VAL 30 6.671 -1.928 -8.561 237 2HG1 VAL 30 HG11 VAL 30 7.895 -0.763 -9.069 238 3HG1 VAL 30 HG13 VAL 30 6.320 -0.788 -9.860 239 1HG2 VAL 30 HG23 VAL 30 9.278 -3.756 -10.611 240 2HG2 VAL 30 HG22 VAL 30 9.726 -2.111 -10.164 241 3HG2 VAL 30 HG21 VAL 30 8.984 -3.178 -8.970 242 H ASP 31 HN ASP 31 5.587 -2.702 -12.693 243 HA ASP 31 HA ASP 31 3.377 -1.280 -11.616 244 1HB ASP 31 HB2 ASP 31 3.818 -2.546 -14.327 245 2HB ASP 31 HB1 ASP 31 2.420 -1.536 -13.952 246 H HIS 32 HN HIS 32 3.631 -4.624 -12.784 247 HA HIS 32 HA HIS 32 0.875 -5.282 -12.438 248 1HB HIS 32 HB2 HIS 32 2.424 -6.708 -13.711 249 2HB HIS 32 HB1 HIS 32 3.307 -7.082 -12.231 250 HD1 HIS 32 HD1 HIS 32 -0.386 -7.194 -13.269 251 HD2 HIS 32 HD2 HIS 32 2.438 -9.473 -11.222 252 HE1 HIS 32 HE1 HIS 32 -1.563 -9.323 -12.547 253 H ALA 33 HN ALA 33 3.664 -5.686 -10.238 254 HA ALA 33 HA ALA 33 2.203 -6.851 -8.104 255 1HB ALA 33 HB2 ALA 33 4.698 -6.730 -8.221 256 2HB ALA 33 HB1 ALA 33 4.594 -5.011 -7.839 257 3HB ALA 33 HB3 ALA 33 4.050 -6.208 -6.666 258 H ILE 34 HN ILE 34 2.963 -3.385 -8.695 259 HA ILE 34 HA ILE 34 1.504 -2.514 -6.358 260 HB ILE 34 HB ILE 34 2.227 -0.978 -8.872 261 1HG1 ILE 34 HG12 ILE 34 4.218 -1.877 -7.763 262 2HG1 ILE 34 HG11 ILE 34 4.133 -0.138 -7.507 263 1HG2 ILE 34 HG22 ILE 34 1.279 -0.081 -6.141 264 2HG2 ILE 34 HG21 ILE 34 2.012 1.005 -7.322 265 3HG2 ILE 34 HG23 ILE 34 0.490 0.192 -7.693 266 1HD1 ILE 34 HD11 ILE 34 2.847 -0.888 -5.284 267 2HD1 ILE 34 HD13 ILE 34 3.764 -2.370 -5.546 268 3HD1 ILE 34 HD12 ILE 34 4.606 -0.834 -5.353 269 H GLU 35 HN GLU 35 0.677 -2.703 -9.816 270 HA GLU 35 HA GLU 35 -1.938 -1.597 -9.619 271 1HB GLU 35 HB2 GLU 35 -0.779 -1.995 -11.762 272 2HB GLU 35 HB1 GLU 35 -0.920 -3.735 -11.514 273 1HG GLU 35 HG2 GLU 35 -3.354 -3.591 -11.559 274 2HG GLU 35 HG1 GLU 35 -3.276 -1.831 -11.680 275 H LYS 36 HN LYS 36 -0.809 -4.950 -9.246 276 HA LYS 36 HA LYS 36 -3.384 -6.140 -9.030 277 1HB LYS 36 HB2 LYS 36 -1.291 -7.407 -9.383 278 2HB LYS 36 HB1 LYS 36 -0.790 -7.028 -7.736 279 1HG LYS 36 HG2 LYS 36 -2.788 -8.183 -6.864 280 2HG LYS 36 HG1 LYS 36 -3.283 -8.566 -8.514 281 1HD LYS 36 HD2 LYS 36 -1.145 -9.790 -8.840 282 2HD LYS 36 HD1 LYS 36 -0.729 -9.467 -7.156 283 1HE LYS 36 HE2 LYS 36 -3.282 -10.862 -7.973 284 2HE LYS 36 HE1 LYS 36 -1.796 -11.731 -7.588 285 1HZ LYS 36 HZ1 LYS 36 -2.487 -9.738 -5.644 286 2HZ LYS 36 HZ3 LYS 36 -3.668 -10.945 -5.794 287 3HZ LYS 36 HZ2 LYS 36 -2.065 -11.368 -5.422 288 H ALA 37 HN ALA 37 -1.266 -4.734 -6.537 289 HA ALA 37 HA ALA 37 -2.844 -5.518 -4.293 290 1HB ALA 37 HB1 ALA 37 -0.488 -4.604 -4.254 291 2HB ALA 37 HB3 ALA 37 -1.177 -3.003 -4.523 292 3HB ALA 37 HB2 ALA 37 -1.570 -3.898 -3.055 293 H PHE 38 HN PHE 38 -2.851 -2.400 -6.106 294 HA PHE 38 HA PHE 38 -4.935 -1.192 -4.587 295 1HB PHE 38 HB2 PHE 38 -3.983 -0.830 -7.432 296 2HB PHE 38 HB1 PHE 38 -5.365 0.078 -6.825 297 HD1 PHE 38 HD2 PHE 38 -4.995 1.308 -4.498 298 HD2 PHE 38 HD1 PHE 38 -1.828 0.036 -7.116 299 HE1 PHE 38 HE2 PHE 38 -3.451 2.928 -3.425 300 HE2 PHE 38 HE1 PHE 38 -0.293 1.659 -6.037 301 HZ PHE 38 HZ PHE 38 -1.101 3.102 -4.196 302 H GLN 39 HN GLN 39 -5.101 -3.328 -7.447 303 HA GLN 39 HA GLN 39 -7.914 -3.120 -7.845 304 1HB GLN 39 HB2 GLN 39 -6.000 -5.393 -8.411 305 2HB GLN 39 HB1 GLN 39 -7.694 -5.405 -8.906 306 1HG GLN 39 HG2 GLN 39 -7.366 -3.374 -10.215 307 2HG GLN 39 HG1 GLN 39 -5.692 -3.259 -9.667 308 1HE2 GLN 39 HE22 GLN 39 -6.015 -5.092 -13.009 309 2HE2 GLN 39 HE21 GLN 39 -6.736 -3.657 -12.461 310 H LEU 40 HN LEU 40 -6.037 -5.321 -5.741 311 HA LEU 40 HA LEU 40 -8.235 -6.937 -4.933 312 1HB LEU 40 HB2 LEU 40 -5.707 -6.146 -3.476 313 2HB LEU 40 HB1 LEU 40 -6.852 -7.314 -2.828 314 HG LEU 40 HG LEU 40 -5.537 -7.578 -5.552 315 1HD1 LEU 40 HD11 LEU 40 -4.748 -8.638 -2.827 316 2HD1 LEU 40 HD13 LEU 40 -4.191 -9.380 -4.327 317 3HD1 LEU 40 HD12 LEU 40 -3.764 -7.709 -3.960 318 1HD2 LEU 40 HD21 LEU 40 -7.334 -9.323 -3.857 319 2HD2 LEU 40 HD23 LEU 40 -7.441 -8.977 -5.583 320 3HD2 LEU 40 HD22 LEU 40 -6.202 -10.069 -4.981 321 H TRP 41 HN TRP 41 -7.041 -3.850 -3.584 322 HA TRP 41 HA TRP 41 -8.983 -3.840 -1.435 323 1HB TRP 41 HB2 TRP 41 -7.360 -1.621 -2.716 324 2HB TRP 41 HB1 TRP 41 -8.409 -1.377 -1.318 325 HD1 TRP 41 HD1 TRP 41 -4.989 -2.475 -2.246 326 HE1 TRP 41 HE1 TRP 41 -3.757 -3.395 -0.175 327 HE3 TRP 41 HE3 TRP 41 -8.909 -2.868 0.984 328 HZ2 TRP 41 HZ2 TRP 41 -4.372 -4.195 2.519 329 HZ3 TRP 41 HZ3 TRP 41 -8.572 -3.706 3.287 330 HH2 TRP 41 HH2 TRP 41 -6.313 -4.371 4.063 331 H SER 42 HN SER 42 -8.915 -2.457 -4.717 332 HA SER 42 HA SER 42 -11.442 -1.081 -4.446 333 1HB SER 42 HB2 SER 42 -9.748 -0.504 -6.183 334 2HB SER 42 HB1 SER 42 -10.080 -2.036 -6.987 335 HG SER 42 HG SER 42 -11.903 -1.245 -7.715 336 H ASN 43 HN ASN 43 -10.537 -4.350 -5.319 337 HA ASN 43 HA ASN 43 -12.924 -5.203 -6.600 338 1HB ASN 43 HB2 ASN 43 -10.981 -6.723 -4.840 339 2HB ASN 43 HB1 ASN 43 -12.249 -7.483 -5.801 340 1HD2 ASN 43 HD22 ASN 43 -9.003 -7.285 -7.767 341 2HD2 ASN 43 HD21 ASN 43 -9.354 -7.860 -6.208 342 H VAL 44 HN VAL 44 -12.156 -4.864 -3.158 343 HA VAL 44 HA VAL 44 -14.871 -5.916 -2.458 344 HB VAL 44 HB VAL 44 -13.892 -5.968 -0.117 345 1HG1 VAL 44 HG11 VAL 44 -12.693 -7.584 -2.381 346 2HG1 VAL 44 HG13 VAL 44 -12.428 -7.974 -0.682 347 3HG1 VAL 44 HG12 VAL 44 -14.059 -8.020 -1.353 348 1HG2 VAL 44 HG23 VAL 44 -12.034 -4.316 -0.786 349 2HG2 VAL 44 HG22 VAL 44 -11.540 -5.710 0.174 350 3HG2 VAL 44 HG21 VAL 44 -11.248 -5.689 -1.565 351 H THR 45 HN THR 45 -13.733 -2.993 -3.238 352 HA THR 45 HA THR 45 -15.620 -1.688 -1.379 353 HB THR 45 HB THR 45 -13.932 0.181 -0.981 354 HG1 THR 45 HG1 THR 45 -11.967 -0.090 -1.655 355 1HG2 THR 45 HG21 THR 45 -13.327 -2.562 0.155 356 2HG2 THR 45 HG23 THR 45 -12.832 -1.028 0.862 357 3HG2 THR 45 HG22 THR 45 -14.543 -1.439 0.763 358 HA PRO 46 HA PRO 46 -16.537 0.474 -5.152 359 1HB PRO 46 HB2 PRO 46 -17.541 2.871 -4.034 360 2HB PRO 46 HB1 PRO 46 -18.483 1.409 -4.362 361 1HG PRO 46 HG2 PRO 46 -17.535 2.459 -1.760 362 2HG PRO 46 HG1 PRO 46 -18.824 1.289 -2.088 363 1HD PRO 46 HD2 PRO 46 -16.245 0.676 -1.072 364 2HD PRO 46 HD1 PRO 46 -17.429 -0.482 -1.718 365 H LEU 47 HN LEU 47 -14.001 1.169 -3.224 366 HA LEU 47 HA LEU 47 -13.341 3.861 -4.088 367 1HB LEU 47 HB2 LEU 47 -11.579 1.670 -2.955 368 2HB LEU 47 HB1 LEU 47 -11.086 3.347 -3.178 369 HG LEU 47 HG LEU 47 -13.405 2.442 -1.439 370 1HD1 LEU 47 HD13 LEU 47 -10.615 3.385 -0.714 371 2HD1 LEU 47 HD12 LEU 47 -11.909 3.043 0.436 372 3HD1 LEU 47 HD11 LEU 47 -11.227 1.741 -0.539 373 1HD2 LEU 47 HD23 LEU 47 -12.219 5.127 -2.153 374 2HD2 LEU 47 HD22 LEU 47 -13.916 4.663 -2.018 375 3HD2 LEU 47 HD21 LEU 47 -12.953 4.895 -0.565 376 H THR 48 HN THR 48 -11.874 4.476 -5.704 377 HA THR 48 HA THR 48 -11.055 2.335 -7.642 378 HB THR 48 HB THR 48 -11.683 3.752 -9.482 379 HG1 THR 48 HG1 THR 48 -12.510 5.830 -9.086 380 1HG2 THR 48 HG21 THR 48 -13.514 2.472 -8.367 381 2HG2 THR 48 HG23 THR 48 -13.888 3.904 -7.407 382 3HG2 THR 48 HG22 THR 48 -14.089 3.939 -9.159 383 H PHE 49 HN PHE 49 -9.009 2.581 -8.495 384 HA PHE 49 HA PHE 49 -7.411 4.943 -7.541 385 1HB PHE 49 HB2 PHE 49 -6.558 2.059 -7.945 386 2HB PHE 49 HB1 PHE 49 -5.460 3.382 -7.548 387 HD1 PHE 49 HD2 PHE 49 -5.624 4.543 -5.350 388 HD2 PHE 49 HD1 PHE 49 -8.071 1.137 -6.291 389 HE1 PHE 49 HE2 PHE 49 -6.184 4.283 -2.949 390 HE2 PHE 49 HE1 PHE 49 -8.627 0.876 -3.888 391 HZ PHE 49 HZ PHE 49 -7.685 2.445 -2.217 392 H THR 50 HN THR 50 -6.383 6.082 -9.094 393 HA THR 50 HA THR 50 -6.292 4.954 -11.877 394 HB THR 50 HB THR 50 -6.780 7.820 -11.019 395 HG1 THR 50 HG1 THR 50 -8.828 7.382 -11.330 396 1HG2 THR 50 HG22 THR 50 -6.570 6.464 -13.715 397 2HG2 THR 50 HG21 THR 50 -7.267 8.067 -13.490 398 3HG2 THR 50 HG23 THR 50 -5.570 7.781 -13.098 399 H LYS 51 HN LYS 51 -4.352 4.928 -12.795 400 HA LYS 51 HA LYS 51 -2.026 5.998 -11.392 401 1HB LYS 51 HB2 LYS 51 -1.905 3.822 -12.508 402 2HB LYS 51 HB1 LYS 51 -2.317 4.566 -14.050 403 1HG LYS 51 HG2 LYS 51 0.103 4.164 -13.880 404 2HG LYS 51 HG1 LYS 51 -0.235 5.889 -13.977 405 1HD LYS 51 HD2 LYS 51 0.260 6.246 -11.707 406 2HD LYS 51 HD1 LYS 51 0.025 4.550 -11.287 407 1HE LYS 51 HE2 LYS 51 2.061 3.934 -12.485 408 2HE LYS 51 HE1 LYS 51 2.272 5.595 -13.036 409 1HZ LYS 51 HZ1 LYS 51 2.016 5.161 -10.161 410 2HZ LYS 51 HZ3 LYS 51 3.464 4.662 -10.891 411 3HZ LYS 51 HZ2 LYS 51 2.966 6.282 -11.012 412 H VAL 52 HN VAL 52 -0.960 7.890 -11.874 413 HA VAL 52 HA VAL 52 -1.835 9.416 -14.320 414 HB VAL 52 HB VAL 52 -1.502 11.478 -13.072 415 1HG1 VAL 52 HG13 VAL 52 -3.155 9.437 -11.563 416 2HG1 VAL 52 HG12 VAL 52 -3.262 11.181 -11.320 417 3HG1 VAL 52 HG11 VAL 52 -3.708 10.476 -12.874 418 1HG2 VAL 52 HG22 VAL 52 -0.504 9.584 -10.937 419 2HG2 VAL 52 HG21 VAL 52 0.307 10.995 -11.618 420 3HG2 VAL 52 HG23 VAL 52 -1.067 11.205 -10.533 421 H SER 53 HN SER 53 -0.205 10.066 -15.643 422 HA SER 53 HA SER 53 2.546 9.212 -14.968 423 1HB SER 53 HB2 SER 53 1.446 8.709 -17.181 424 2HB SER 53 HB1 SER 53 1.486 10.439 -17.524 425 HG SER 53 HG SER 53 3.505 8.570 -17.533 426 H GLU 54 HN GLU 54 0.783 12.013 -14.539 427 HA GLU 54 HA GLU 54 3.215 13.577 -14.125 428 1HB GLU 54 HB2 GLU 54 2.596 13.696 -16.645 429 2HB GLU 54 HB1 GLU 54 1.245 14.698 -16.119 430 1HG GLU 54 HG2 GLU 54 2.839 16.233 -14.999 431 2HG GLU 54 HG1 GLU 54 4.178 15.240 -15.581 432 H GLY 55 HN GLY 55 2.624 15.783 -13.237 433 1HA GLY 55 HA2 GLY 55 1.160 17.238 -12.051 434 2HA GLY 55 HA1 GLY 55 -0.165 16.109 -12.347 435 H GLN 56 HN GLN 56 0.151 17.147 -9.786 436 HA GLN 56 HA GLN 56 1.722 15.255 -8.179 437 1HB GLN 56 HB2 GLN 56 -0.217 17.459 -7.413 438 2HB GLN 56 HB1 GLN 56 0.650 16.459 -6.247 439 1HG GLN 56 HG2 GLN 56 2.785 17.241 -7.044 440 2HG GLN 56 HG1 GLN 56 2.030 18.081 -8.400 441 1HE2 GLN 56 HE22 GLN 56 2.607 20.604 -5.704 442 2HE2 GLN 56 HE21 GLN 56 3.600 19.605 -6.651 443 H ALA 57 HN ALA 57 0.916 13.522 -7.046 444 HA ALA 57 HA ALA 57 -1.962 12.815 -7.528 445 1HB ALA 57 HB2 ALA 57 0.017 11.329 -8.368 446 2HB ALA 57 HB1 ALA 57 0.159 10.846 -6.679 447 3HB ALA 57 HB3 ALA 57 -1.344 10.555 -7.559 448 H ASP 58 HN ASP 58 -3.130 11.864 -5.749 449 HA ASP 58 HA ASP 58 -2.742 13.150 -3.237 450 1HB ASP 58 HB2 ASP 58 -4.267 10.625 -3.941 451 2HB ASP 58 HB1 ASP 58 -4.331 11.398 -2.359 452 H ILE 59 HN ILE 59 -1.800 9.914 -4.387 453 HA ILE 59 HA ILE 59 -0.178 9.542 -1.876 454 HB ILE 59 HB ILE 59 -1.274 7.456 -3.800 455 1HG1 ILE 59 HG12 ILE 59 -2.094 8.014 -0.934 456 2HG1 ILE 59 HG11 ILE 59 -2.972 8.630 -2.334 457 1HG2 ILE 59 HG23 ILE 59 0.275 7.233 -1.202 458 2HG2 ILE 59 HG22 ILE 59 -0.544 5.877 -1.974 459 3HG2 ILE 59 HG21 ILE 59 0.790 6.683 -2.797 460 1HD1 ILE 59 HD13 ILE 59 -2.402 5.695 -1.832 461 2HD1 ILE 59 HD12 ILE 59 -3.929 6.491 -1.458 462 3HD1 ILE 59 HD11 ILE 59 -3.387 6.364 -3.132 463 H MET 60 HN MET 60 1.958 9.934 -2.297 464 HA MET 60 HA MET 60 3.004 9.423 -5.053 465 1HB MET 60 HB2 MET 60 4.240 10.964 -2.751 466 2HB MET 60 HB1 MET 60 4.930 10.799 -4.364 467 1HG MET 60 HG2 MET 60 2.189 11.972 -3.844 468 2HG MET 60 HG1 MET 60 3.647 12.953 -3.974 469 1HE MET 60 HE3 MET 60 5.157 13.060 -5.731 470 2HE MET 60 HE2 MET 60 5.333 11.539 -6.600 471 3HE MET 60 HE1 MET 60 4.754 12.967 -7.451 472 H ILE 61 HN ILE 61 4.488 7.830 -5.397 473 HA ILE 61 HA ILE 61 5.535 6.340 -3.006 474 HB ILE 61 HB ILE 61 4.821 5.243 -5.747 475 1HG1 ILE 61 HG12 ILE 61 3.558 4.714 -3.046 476 2HG1 ILE 61 HG11 ILE 61 2.919 5.885 -4.199 477 1HG2 ILE 61 HG21 ILE 61 5.818 3.871 -3.228 478 2HG2 ILE 61 HG23 ILE 61 5.322 3.052 -4.708 479 3HG2 ILE 61 HG22 ILE 61 6.749 4.085 -4.709 480 1HD1 ILE 61 HD11 ILE 61 2.726 4.057 -5.888 481 2HD1 ILE 61 HD13 ILE 61 3.265 2.908 -4.662 482 3HD1 ILE 61 HD12 ILE 61 1.738 3.766 -4.456 483 H SER 62 HN SER 62 7.702 6.238 -2.877 484 HA SER 62 HA SER 62 9.328 6.527 -5.347 485 1HB SER 62 HB2 SER 62 10.597 8.386 -4.482 486 2HB SER 62 HB1 SER 62 8.893 8.819 -4.388 487 HG SER 62 HG SER 62 9.188 9.042 -2.330 488 H PHE 63 HN PHE 63 11.574 5.939 -4.994 489 HA PHE 63 HA PHE 63 11.938 4.072 -2.676 490 1HB PHE 63 HB2 PHE 63 13.112 4.104 -5.474 491 2HB PHE 63 HB1 PHE 63 13.707 3.051 -4.193 492 HD1 PHE 63 HD1 PHE 63 10.862 3.785 -6.426 493 HD2 PHE 63 HD2 PHE 63 12.362 1.216 -3.326 494 HE1 PHE 63 HE1 PHE 63 9.025 2.171 -6.870 495 HE2 PHE 63 HE2 PHE 63 10.527 -0.394 -3.771 496 HZ PHE 63 HZ PHE 63 8.860 0.085 -5.541 497 H VAL 64 HN VAL 64 13.611 4.500 -1.259 498 HA VAL 64 HA VAL 64 15.626 6.582 -2.045 499 HB VAL 64 HB VAL 64 15.398 7.574 0.221 500 1HG1 VAL 64 HG12 VAL 64 14.138 8.421 -1.782 501 2HG1 VAL 64 HG11 VAL 64 12.764 7.438 -1.278 502 3HG1 VAL 64 HG13 VAL 64 13.329 8.756 -0.252 503 1HG2 VAL 64 HG21 VAL 64 13.229 5.473 0.431 504 2HG2 VAL 64 HG23 VAL 64 14.528 5.826 1.568 505 3HG2 VAL 64 HG22 VAL 64 13.174 6.943 1.403 506 H ARG 65 HN ARG 65 17.505 6.632 -0.506 507 HA ARG 65 HA ARG 65 18.137 3.896 0.568 508 1HB ARG 65 HB2 ARG 65 19.892 5.819 -0.983 509 2HB ARG 65 HB1 ARG 65 20.529 4.442 -0.089 510 1HG ARG 65 HG2 ARG 65 19.145 2.923 -1.438 511 2HG ARG 65 HG1 ARG 65 18.503 4.300 -2.340 512 1HD ARG 65 HD2 ARG 65 20.815 4.879 -3.043 513 2HD ARG 65 HD1 ARG 65 21.406 3.445 -2.200 514 HE ARG 65 HE ARG 65 19.523 2.398 -3.902 515 1HH1 ARG 65 HH21 ARG 65 22.220 4.521 -4.178 516 2HH1 ARG 65 HH22 ARG 65 22.579 4.079 -5.814 517 1HH2 ARG 65 HH11 ARG 65 19.964 1.806 -6.041 518 2HH2 ARG 65 HH12 ARG 65 21.291 2.543 -6.875 519 H GLY 66 HN GLY 66 19.286 3.836 2.508 520 1HA GLY 66 HA2 GLY 66 19.730 4.630 4.688 521 2HA GLY 66 HA1 GLY 66 20.833 5.681 3.807 522 H ASP 67 HN ASP 67 20.587 7.543 5.020 523 HA ASP 67 HA ASP 67 17.994 8.535 5.873 524 1HB ASP 67 HB2 ASP 67 20.189 8.997 7.051 525 2HB ASP 67 HB1 ASP 67 20.599 10.078 5.721 526 H HIS 68 HN HIS 68 16.639 9.892 4.792 527 HA HIS 68 HA HIS 68 17.663 11.356 2.395 528 1HB HIS 68 HB2 HIS 68 15.511 10.770 1.227 529 2HB HIS 68 HB1 HIS 68 16.580 9.395 1.492 530 HD1 HIS 68 HD1 HIS 68 16.021 8.071 3.878 531 HD2 HIS 68 HD2 HIS 68 12.954 10.275 2.110 532 HE1 HIS 68 HE1 HIS 68 13.855 7.203 4.863 533 H ARG 69 HN ARG 69 17.531 12.812 4.533 534 HA ARG 69 HA ARG 69 16.528 14.650 5.576 535 1HB ARG 69 HB2 ARG 69 15.096 14.657 2.906 536 2HB ARG 69 HB1 ARG 69 14.971 15.960 4.089 537 1HG ARG 69 HG2 ARG 69 17.432 16.202 4.045 538 2HG ARG 69 HG1 ARG 69 17.526 14.963 2.800 539 1HD ARG 69 HD2 ARG 69 16.013 16.363 1.371 540 2HD ARG 69 HD1 ARG 69 16.114 17.646 2.572 541 HE ARG 69 HE ARG 69 18.022 17.108 0.506 542 1HH1 ARG 69 HH21 ARG 69 17.896 17.863 3.871 543 2HH1 ARG 69 HH22 ARG 69 19.569 18.296 3.961 544 1HH2 ARG 69 HH11 ARG 69 20.176 17.722 0.607 545 2HH2 ARG 69 HH12 ARG 69 20.854 18.230 2.117 546 H ASP 70 HN ASP 70 15.492 12.352 6.577 547 HA ASP 70 HA ASP 70 12.657 13.119 7.080 548 1HB ASP 70 HB2 ASP 70 13.642 10.401 6.193 549 2HB ASP 70 HB1 ASP 70 12.141 10.593 7.099 550 H ASN 71 HN ASN 71 11.840 11.966 9.079 551 HA ASN 71 HA ASN 71 13.977 12.041 11.119 552 1HB ASN 71 HB2 ASN 71 10.958 11.825 11.346 553 2HB ASN 71 HB1 ASN 71 12.065 11.931 12.717 554 1HD2 ASN 71 HD22 ASN 71 10.832 15.366 11.400 555 2HD2 ASN 71 HD21 ASN 71 9.966 13.912 11.511 556 H SER 72 HN SER 72 13.111 9.685 9.111 557 HA SER 72 HA SER 72 13.487 7.559 11.190 558 1HB SER 72 HB2 SER 72 11.066 7.814 10.374 559 2HB SER 72 HB1 SER 72 11.644 7.224 8.820 560 HG SER 72 HG SER 72 12.588 5.700 10.830 561 HA PRO 73 HA PRO 73 16.387 7.303 7.483 562 1HB PRO 73 HB2 PRO 73 18.590 6.953 9.325 563 2HB PRO 73 HB1 PRO 73 18.292 8.319 8.242 564 1HG PRO 73 HG2 PRO 73 17.996 8.252 11.128 565 2HG PRO 73 HG1 PRO 73 17.749 9.626 10.041 566 1HD PRO 73 HD2 PRO 73 15.724 8.092 11.413 567 2HD PRO 73 HD1 PRO 73 15.487 9.450 10.297 568 H PHE 74 HN PHE 74 17.012 5.283 6.700 569 HA PHE 74 HA PHE 74 16.190 2.945 8.236 570 1HB PHE 74 HB2 PHE 74 17.532 3.237 5.534 571 2HB PHE 74 HB1 PHE 74 17.027 1.693 6.220 572 HD1 PHE 74 HD1 PHE 74 14.563 1.442 6.926 573 HD2 PHE 74 HD2 PHE 74 15.967 4.592 4.364 574 HE1 PHE 74 HE1 PHE 74 12.251 1.814 6.116 575 HE2 PHE 74 HE2 PHE 74 13.646 4.964 3.555 576 HZ PHE 74 HZ PHE 74 11.792 3.573 4.432 577 H ASP 75 HN ASP 75 17.579 1.225 8.927 578 HA ASP 75 HA ASP 75 20.501 1.872 9.055 579 1HB ASP 75 HB2 ASP 75 19.289 2.484 11.207 580 2HB ASP 75 HB1 ASP 75 18.933 0.767 11.400 581 H GLY 76 HN GLY 76 20.464 0.267 7.284 582 1HA GLY 76 HA2 GLY 76 21.110 -1.884 6.599 583 2HA GLY 76 HA1 GLY 76 21.096 -2.383 8.290 584 HA PRO 77 HA PRO 77 17.401 -4.127 5.922 585 1HB PRO 77 HB2 PRO 77 18.158 -6.784 6.790 586 2HB PRO 77 HB1 PRO 77 18.129 -6.152 5.137 587 1HG PRO 77 HG2 PRO 77 20.454 -6.734 6.756 588 2HG PRO 77 HG1 PRO 77 20.415 -6.103 5.104 589 1HD PRO 77 HD2 PRO 77 21.086 -4.663 7.536 590 2HD PRO 77 HD1 PRO 77 21.080 -4.052 5.869 591 H GLY 78 HN GLY 78 18.507 -3.578 8.963 592 1HA GLY 78 HA2 GLY 78 16.514 -5.205 10.416 593 2HA GLY 78 HA1 GLY 78 17.684 -4.103 11.146 594 H GLY 79 HN GLY 79 15.137 -3.920 12.071 595 1HA GLY 79 HA2 GLY 79 13.591 -2.207 12.543 596 2HA GLY 79 HA1 GLY 79 14.443 -1.182 11.387 597 H ASN 80 HN ASN 80 12.181 -0.574 10.764 598 HA ASN 80 HA ASN 80 10.456 -2.509 9.473 599 1HB ASN 80 HB2 ASN 80 10.569 0.516 9.397 600 2HB ASN 80 HB1 ASN 80 9.317 -0.426 8.586 601 1HD2 ASN 80 HD22 ASN 80 8.887 -1.681 12.305 602 2HD2 ASN 80 HD21 ASN 80 9.973 -2.319 11.169 603 H LEU 81 HN LEU 81 10.034 -2.680 7.170 604 HA LEU 81 HA LEU 81 12.491 -2.302 5.557 605 1HB LEU 81 HB2 LEU 81 9.852 -3.497 4.667 606 2HB LEU 81 HB1 LEU 81 11.435 -3.719 3.926 607 HG LEU 81 HG LEU 81 10.558 -4.728 6.648 608 1HD1 LEU 81 HD12 LEU 81 11.200 -6.061 4.008 609 2HD1 LEU 81 HD11 LEU 81 11.056 -6.946 5.525 610 3HD1 LEU 81 HD13 LEU 81 9.663 -6.082 4.873 611 1HD2 LEU 81 HD22 LEU 81 13.244 -4.759 5.254 612 2HD2 LEU 81 HD21 LEU 81 12.874 -4.185 6.878 613 3HD2 LEU 81 HD23 LEU 81 12.837 -5.912 6.522 614 H ALA 82 HN ALA 82 9.647 -0.604 6.229 615 HA ALA 82 HA ALA 82 10.217 1.497 4.358 616 1HB ALA 82 HB2 ALA 82 9.292 -0.172 2.740 617 2HB ALA 82 HB1 ALA 82 7.801 -0.214 3.678 618 3HB ALA 82 HB3 ALA 82 8.287 1.269 2.862 619 H HIS 83 HN HIS 83 8.169 3.061 4.305 620 HA HIS 83 HA HIS 83 6.319 2.755 6.548 621 1HB HIS 83 HB2 HIS 83 7.159 4.713 7.818 622 2HB HIS 83 HB1 HIS 83 8.342 3.404 7.772 623 HD1 HIS 83 HD1 HIS 83 10.616 4.051 7.015 624 HD2 HIS 83 HD2 HIS 83 7.727 6.699 5.596 625 HE1 HIS 83 HE1 HIS 83 11.866 5.889 5.810 626 H ALA 84 HN ALA 84 5.002 4.852 6.811 627 HA ALA 84 HA ALA 84 5.028 6.572 4.386 628 1HB ALA 84 HB2 ALA 84 3.552 4.670 3.832 629 2HB ALA 84 HB1 ALA 84 2.607 4.982 5.288 630 3HB ALA 84 HB3 ALA 84 2.631 6.166 3.980 631 H PHE 85 HN PHE 85 3.569 8.457 4.649 632 HA PHE 85 HA PHE 85 3.528 9.335 7.486 633 1HB PHE 85 HB2 PHE 85 3.187 10.801 4.862 634 2HB PHE 85 HB1 PHE 85 2.970 11.573 6.434 635 HD1 PHE 85 HD1 PHE 85 4.872 11.883 7.960 636 HD2 PHE 85 HD2 PHE 85 5.381 10.103 4.083 637 HE1 PHE 85 HE1 PHE 85 7.323 12.217 8.126 638 HE2 PHE 85 HE2 PHE 85 7.831 10.439 4.250 639 HZ PHE 85 HZ PHE 85 8.804 11.494 6.274 640 H GLN 86 HN GLN 86 1.580 10.696 8.113 641 HA GLN 86 HA GLN 86 -0.799 9.117 7.845 642 1HB GLN 86 HB2 GLN 86 -0.246 11.849 9.015 643 2HB GLN 86 HB1 GLN 86 -1.841 11.101 9.083 644 1HG GLN 86 HG2 GLN 86 0.660 9.721 10.088 645 2HG GLN 86 HG1 GLN 86 -0.360 10.718 11.126 646 1HE2 GLN 86 HE22 GLN 86 -1.467 6.941 10.344 647 2HE2 GLN 86 HE21 GLN 86 0.059 7.558 9.933 648 HA PRO 87 HA PRO 87 -2.525 10.846 4.127 649 1HB PRO 87 HB2 PRO 87 -5.247 11.065 5.054 650 2HB PRO 87 HB1 PRO 87 -4.540 9.770 4.079 651 1HG PRO 87 HG2 PRO 87 -5.269 9.707 6.909 652 2HG PRO 87 HG1 PRO 87 -4.748 8.367 5.879 653 1HD PRO 87 HD2 PRO 87 -3.219 9.614 7.945 654 2HD PRO 87 HD1 PRO 87 -2.641 8.421 6.764 655 H GLY 88 HN GLY 88 -1.766 12.937 3.948 656 1HA GLY 88 HA2 GLY 88 -3.560 15.108 4.626 657 2HA GLY 88 HA1 GLY 88 -2.097 15.135 5.613 658 HA PRO 89 HA PRO 89 -1.484 17.044 1.255 659 1HB PRO 89 HB2 PRO 89 -0.942 19.622 2.393 660 2HB PRO 89 HB1 PRO 89 -2.344 19.161 1.416 661 1HG PRO 89 HG2 PRO 89 -2.218 19.634 4.309 662 2HG PRO 89 HG1 PRO 89 -3.646 19.432 3.285 663 1HD PRO 89 HD2 PRO 89 -2.621 17.525 5.146 664 2HD PRO 89 HD1 PRO 89 -3.890 17.247 3.934 665 H GLY 90 HN GLY 90 0.632 18.669 0.960 666 1HA GLY 90 HA2 GLY 90 2.966 18.785 1.151 667 2HA GLY 90 HA1 GLY 90 2.743 18.431 2.865 668 H ILE 91 HN ILE 91 4.043 16.748 3.350 669 HA ILE 91 HA ILE 91 4.629 14.645 1.392 670 HB ILE 91 HB ILE 91 6.328 15.606 2.959 671 1HG1 ILE 91 HG12 ILE 91 5.887 12.646 3.432 672 2HG1 ILE 91 HG11 ILE 91 6.521 13.303 1.927 673 1HG2 ILE 91 HG21 ILE 91 4.588 15.624 4.890 674 2HG2 ILE 91 HG23 ILE 91 5.061 13.943 5.132 675 3HG2 ILE 91 HG22 ILE 91 6.261 15.227 5.277 676 1HD1 ILE 91 HD13 ILE 91 8.313 14.453 3.326 677 2HD1 ILE 91 HD12 ILE 91 7.765 13.463 4.678 678 3HD1 ILE 91 HD11 ILE 91 8.429 12.698 3.235 679 H GLY 92 HN GLY 92 2.097 15.162 3.524 680 1HA GLY 92 HA2 GLY 92 1.727 12.597 4.718 681 2HA GLY 92 HA1 GLY 92 0.436 13.744 4.391 682 H GLY 93 HN GLY 93 0.750 10.727 3.981 683 1HA GLY 93 HA2 GLY 93 -0.495 9.340 2.482 684 2HA GLY 93 HA1 GLY 93 -0.536 10.665 1.319 685 H ASP 94 HN ASP 94 2.513 10.917 1.944 686 HA ASP 94 HA ASP 94 3.401 9.439 -0.357 687 1HB ASP 94 HB2 ASP 94 4.916 10.842 1.851 688 2HB ASP 94 HB1 ASP 94 5.694 10.126 0.437 689 H ALA 95 HN ALA 95 5.030 7.726 -0.387 690 HA ALA 95 HA ALA 95 5.274 6.104 2.104 691 1HB ALA 95 HB1 ALA 95 3.306 5.218 0.887 692 2HB ALA 95 HB3 ALA 95 4.305 4.990 -0.547 693 3HB ALA 95 HB2 ALA 95 4.632 4.055 0.913 694 H HIS 96 HN HIS 96 7.403 5.744 2.324 695 HA HIS 96 HA HIS 96 9.149 5.698 -0.101 696 1HB HIS 96 HB2 HIS 96 9.835 6.023 2.835 697 2HB HIS 96 HB1 HIS 96 10.970 6.140 1.493 698 HD2 HIS 96 HD2 HIS 96 7.908 8.076 0.224 699 HE1 HIS 96 HE1 HIS 96 10.336 10.759 2.450 700 HE2 HIS 96 HE2 HIS 96 8.398 10.568 0.832 701 H PHE 97 HN PHE 97 10.308 3.883 -0.637 702 HA PHE 97 HA PHE 97 10.004 1.453 1.105 703 1HB PHE 97 HB2 PHE 97 10.329 1.814 -1.878 704 2HB PHE 97 HB1 PHE 97 10.718 0.278 -1.110 705 HD1 PHE 97 HD1 PHE 97 8.000 2.786 -1.550 706 HD2 PHE 97 HD2 PHE 97 9.017 -1.252 -0.507 707 HE1 PHE 97 HE1 PHE 97 5.602 2.177 -1.577 708 HE2 PHE 97 HE2 PHE 97 6.617 -1.866 -0.528 709 HZ PHE 97 HZ PHE 97 4.906 -0.152 -1.064 710 H ASP 98 HN ASP 98 11.835 0.301 1.694 711 HA ASP 98 HA ASP 98 14.376 1.669 1.737 712 1HB ASP 98 HB2 ASP 98 13.543 -0.030 3.428 713 2HB ASP 98 HB1 ASP 98 13.865 -1.281 2.225 714 H GLU 99 HN GLU 99 15.298 2.019 -0.284 715 HA GLU 99 HA GLU 99 15.184 0.037 -2.405 716 1HB GLU 99 HB2 GLU 99 15.404 2.560 -2.702 717 2HB GLU 99 HB1 GLU 99 17.083 2.378 -2.221 718 1HG GLU 99 HG2 GLU 99 17.535 0.890 -4.072 719 2HG GLU 99 HG1 GLU 99 15.826 0.841 -4.504 720 H ASP 100 HN ASP 100 17.173 0.353 0.362 721 HA ASP 100 HA ASP 100 19.598 -0.779 -0.797 722 1HB ASP 100 HB2 ASP 100 18.651 -0.438 2.057 723 2HB ASP 100 HB1 ASP 100 20.201 -1.164 1.644 724 H GLU 101 HN GLU 101 16.617 -2.038 0.352 725 HA GLU 101 HA GLU 101 17.655 -4.744 0.859 726 1HB GLU 101 HB2 GLU 101 14.847 -3.616 0.721 727 2HB GLU 101 HB1 GLU 101 15.256 -5.251 1.248 728 1HG GLU 101 HG2 GLU 101 16.559 -4.392 3.098 729 2HG GLU 101 HG1 GLU 101 16.359 -2.738 2.520 730 H ARG 102 HN ARG 102 17.060 -6.592 -0.489 731 HA ARG 102 HA ARG 102 16.746 -5.829 -3.344 732 1HB ARG 102 HB2 ARG 102 18.495 -7.497 -2.557 733 2HB ARG 102 HB1 ARG 102 17.169 -8.603 -2.201 734 1HG ARG 102 HG2 ARG 102 16.429 -8.488 -4.547 735 2HG ARG 102 HG1 ARG 102 17.742 -7.375 -4.919 736 1HD ARG 102 HD2 ARG 102 19.356 -9.143 -4.119 737 2HD ARG 102 HD1 ARG 102 18.005 -10.260 -3.993 738 HE ARG 102 HE ARG 102 19.471 -9.606 -6.380 739 1HH1 ARG 102 HH21 ARG 102 16.232 -10.042 -5.295 740 2HH1 ARG 102 HH22 ARG 102 15.596 -10.273 -6.887 741 1HH2 ARG 102 HH11 ARG 102 18.658 -9.957 -8.452 742 2HH2 ARG 102 HH12 ARG 102 16.962 -10.236 -8.665 743 H TRP 103 HN TRP 103 14.734 -5.714 -4.137 744 HA TRP 103 HA TRP 103 12.499 -7.131 -2.822 745 1HB TRP 103 HB2 TRP 103 12.599 -5.180 -5.142 746 2HB TRP 103 HB1 TRP 103 11.118 -5.827 -4.435 747 HD1 TRP 103 HD1 TRP 103 13.425 -3.003 -4.116 748 HE1 TRP 103 HE1 TRP 103 13.037 -1.748 -1.892 749 HE3 TRP 103 HE3 TRP 103 10.537 -6.425 -1.678 750 HZ2 TRP 103 HZ2 TRP 103 11.675 -2.154 0.595 751 HZ3 TRP 103 HZ3 TRP 103 9.712 -5.973 0.613 752 HH2 TRP 103 HH2 TRP 103 10.278 -3.847 1.753 753 H THR 104 HN THR 104 11.403 -8.866 -3.724 754 HA THR 104 HA THR 104 12.208 -9.781 -6.467 755 HB THR 104 HB THR 104 12.436 -12.041 -5.702 756 HG1 THR 104 HG1 THR 104 10.749 -12.006 -4.203 757 1HG2 THR 104 HG21 THR 104 14.284 -10.287 -5.139 758 2HG2 THR 104 HG23 THR 104 13.749 -10.505 -3.474 759 3HG2 THR 104 HG22 THR 104 14.371 -11.879 -4.386 760 H ASN 105 HN ASN 105 10.640 -11.323 -7.401 761 HA ASN 105 HA ASN 105 7.854 -10.955 -6.332 762 1HB ASN 105 HB2 ASN 105 8.842 -11.028 -9.198 763 2HB ASN 105 HB1 ASN 105 7.140 -11.108 -8.741 764 1HD2 ASN 105 HD22 ASN 105 8.099 -7.677 -7.083 765 2HD2 ASN 105 HD21 ASN 105 8.198 -9.206 -6.355 766 H ASN 106 HN ASN 106 9.761 -13.172 -5.794 767 HA ASN 106 HA ASN 106 7.981 -15.380 -6.718 768 1HB ASN 106 HB2 ASN 106 10.000 -16.759 -7.311 769 2HB ASN 106 HB1 ASN 106 9.745 -15.386 -8.391 770 1HD2 ASN 106 HD22 ASN 106 12.375 -13.957 -5.786 771 2HD2 ASN 106 HD21 ASN 106 10.707 -14.068 -5.504 772 H PHE 107 HN PHE 107 9.458 -17.490 -5.736 773 HA PHE 107 HA PHE 107 8.906 -17.405 -2.940 774 1HB PHE 107 HB2 PHE 107 10.579 -19.302 -4.599 775 2HB PHE 107 HB1 PHE 107 10.186 -19.579 -2.904 776 HD1 PHE 107 HD1 PHE 107 7.866 -20.057 -2.203 777 HD2 PHE 107 HD2 PHE 107 8.889 -19.434 -6.329 778 HE1 PHE 107 HE1 PHE 107 5.678 -21.006 -2.889 779 HE2 PHE 107 HE2 PHE 107 6.702 -20.380 -7.013 780 HZ PHE 107 HZ PHE 107 5.098 -21.168 -5.295 781 H ARG 108 HN ARG 108 11.307 -15.685 -4.334 782 HA ARG 108 HA ARG 108 13.635 -16.400 -2.870 783 1HB ARG 108 HB2 ARG 108 12.718 -13.755 -3.984 784 2HB ARG 108 HB1 ARG 108 14.294 -13.967 -3.235 785 1HG ARG 108 HG2 ARG 108 13.384 -15.785 -5.464 786 2HG ARG 108 HG1 ARG 108 14.112 -14.222 -5.817 787 1HD ARG 108 HD2 ARG 108 16.082 -14.912 -4.380 788 2HD ARG 108 HD1 ARG 108 15.382 -16.529 -4.314 789 HE ARG 108 HE ARG 108 15.462 -15.982 -7.016 790 1HH1 ARG 108 HH21 ARG 108 17.724 -15.869 -4.406 791 2HH1 ARG 108 HH22 ARG 108 19.082 -16.281 -5.400 792 1HH2 ARG 108 HH11 ARG 108 17.224 -16.524 -8.312 793 2HH2 ARG 108 HH12 ARG 108 18.801 -16.648 -7.606 794 H GLU 109 HN GLU 109 14.464 -14.189 -1.482 795 HA GLU 109 HA GLU 109 13.612 -14.678 1.136 796 1HB GLU 109 HB2 GLU 109 14.954 -12.264 -0.082 797 2HB GLU 109 HB1 GLU 109 14.727 -12.461 1.656 798 1HG GLU 109 HG2 GLU 109 15.957 -14.607 1.562 799 2HG GLU 109 HG1 GLU 109 16.206 -14.378 -0.168 800 H TYR 110 HN TYR 110 12.733 -11.687 -0.718 801 HA TYR 110 HA TYR 110 10.329 -11.468 1.098 802 1HB TYR 110 HB2 TYR 110 12.067 -9.276 -0.055 803 2HB TYR 110 HB1 TYR 110 10.568 -9.002 0.832 804 HD1 TYR 110 HD2 TYR 110 10.409 -10.206 3.190 805 HD2 TYR 110 HD1 TYR 110 14.084 -9.350 1.135 806 HE1 TYR 110 HE2 TYR 110 11.648 -10.375 5.336 807 HE2 TYR 110 HE1 TYR 110 15.320 -9.516 3.273 808 HH TYR 110 HH TYR 110 15.189 -9.955 5.455 809 H ASN 111 HN ASN 111 8.373 -10.982 0.201 810 HA ASN 111 HA ASN 111 8.205 -10.929 -2.779 811 1HB ASN 111 HB2 ASN 111 6.823 -12.582 -1.452 812 2HB ASN 111 HB1 ASN 111 5.968 -11.209 -0.751 813 1HD2 ASN 111 HD22 ASN 111 5.546 -11.347 -4.825 814 2HD2 ASN 111 HD21 ASN 111 7.099 -11.354 -4.141 815 H LEU 112 HN LEU 112 8.165 -8.897 -3.601 816 HA LEU 112 HA LEU 112 7.762 -6.535 -2.102 817 1HB LEU 112 HB2 LEU 112 8.916 -6.583 -4.271 818 2HB LEU 112 HB1 LEU 112 7.400 -6.977 -5.076 819 HG LEU 112 HG LEU 112 6.444 -4.814 -4.280 820 1HD1 LEU 112 HD11 LEU 112 9.196 -4.585 -3.056 821 2HD1 LEU 112 HD13 LEU 112 8.299 -3.137 -3.507 822 3HD1 LEU 112 HD12 LEU 112 7.627 -4.249 -2.319 823 1HD2 LEU 112 HD21 LEU 112 7.527 -5.016 -6.495 824 2HD2 LEU 112 HD23 LEU 112 7.761 -3.406 -5.812 825 3HD2 LEU 112 HD22 LEU 112 9.074 -4.582 -5.771 826 H HIS 113 HN HIS 113 5.420 -8.398 -4.052 827 HA HIS 113 HA HIS 113 3.299 -6.520 -3.951 828 1HB HIS 113 HB2 HIS 113 3.277 -8.557 -5.361 829 2HB HIS 113 HB1 HIS 113 3.072 -9.544 -3.914 830 HD1 HIS 113 HD1 HIS 113 0.766 -9.345 -2.650 831 HD2 HIS 113 HD2 HIS 113 0.977 -7.166 -6.184 832 HE1 HIS 113 HE1 HIS 113 -1.605 -8.646 -3.217 833 H ARG 114 HN ARG 114 4.036 -9.174 -1.657 834 HA ARG 114 HA ARG 114 1.803 -8.664 0.045 835 1HB ARG 114 HB2 ARG 114 3.120 -10.739 0.151 836 2HB ARG 114 HB1 ARG 114 4.493 -9.833 0.787 837 1HG ARG 114 HG2 ARG 114 3.400 -9.351 2.819 838 2HG ARG 114 HG1 ARG 114 1.804 -9.701 2.153 839 1HD ARG 114 HD2 ARG 114 2.408 -12.086 1.967 840 2HD ARG 114 HD1 ARG 114 3.997 -11.731 2.648 841 HE ARG 114 HE ARG 114 2.252 -10.733 4.536 842 1HH1 ARG 114 HH21 ARG 114 2.638 -13.716 2.851 843 2HH1 ARG 114 HH22 ARG 114 2.048 -14.681 4.162 844 1HH2 ARG 114 HH11 ARG 114 1.475 -11.969 6.244 845 2HH2 ARG 114 HH12 ARG 114 1.391 -13.692 6.086 846 H VAL 115 HN VAL 115 5.117 -7.334 0.123 847 HA VAL 115 HA VAL 115 4.654 -5.905 2.599 848 HB VAL 115 HB VAL 115 6.742 -5.489 0.438 849 1HG1 VAL 115 HG11 VAL 115 6.369 -4.268 3.179 850 2HG1 VAL 115 HG13 VAL 115 7.931 -4.298 2.361 851 3HG1 VAL 115 HG12 VAL 115 6.573 -3.433 1.640 852 1HG2 VAL 115 HG22 VAL 115 6.669 -7.003 3.060 853 2HG2 VAL 115 HG21 VAL 115 7.051 -7.632 1.457 854 3HG2 VAL 115 HG23 VAL 115 8.180 -6.553 2.274 855 H ALA 116 HN ALA 116 4.496 -5.008 -0.839 856 HA ALA 116 HA ALA 116 3.977 -2.234 -0.439 857 1HB ALA 116 HB3 ALA 116 3.155 -4.144 -2.640 858 2HB ALA 116 HB2 ALA 116 2.813 -2.415 -2.698 859 3HB ALA 116 HB1 ALA 116 4.482 -2.982 -2.665 860 H ALA 117 HN ALA 117 1.842 -5.062 -0.545 861 HA ALA 117 HA ALA 117 -0.643 -3.678 -0.397 862 1HB ALA 117 HB3 ALA 117 -0.409 -6.134 -0.829 863 2HB ALA 117 HB2 ALA 117 0.057 -6.353 0.858 864 3HB ALA 117 HB1 ALA 117 -1.561 -5.779 0.459 865 H HIS 118 HN HIS 118 1.570 -4.819 2.126 866 HA HIS 118 HA HIS 118 0.017 -4.092 4.390 867 1HB HIS 118 HB2 HIS 118 2.057 -5.484 4.508 868 2HB HIS 118 HB1 HIS 118 3.036 -4.086 4.058 869 HD1 HIS 118 HD1 HIS 118 1.276 -5.657 6.911 870 HD2 HIS 118 HD2 HIS 118 3.136 -2.018 6.104 871 HE1 HIS 118 HE1 HIS 118 1.576 -4.499 9.143 872 H GLU 119 HN GLU 119 2.416 -2.221 2.521 873 HA GLU 119 HA GLU 119 2.342 0.122 4.134 874 1HB GLU 119 HB2 GLU 119 2.861 -0.268 1.173 875 2HB GLU 119 HB1 GLU 119 3.069 1.279 1.994 876 1HG GLU 119 HG2 GLU 119 4.443 -1.276 2.865 877 2HG GLU 119 HG1 GLU 119 5.188 -0.082 1.802 878 H LEU 120 HN LEU 120 0.318 -0.921 1.407 879 HA LEU 120 HA LEU 120 -1.209 1.504 1.223 880 1HB LEU 120 HB2 LEU 120 -1.957 -1.345 0.501 881 2HB LEU 120 HB1 LEU 120 -2.873 0.086 0.028 882 HG LEU 120 HG LEU 120 0.030 -0.421 -0.675 883 1HD1 LEU 120 HD11 LEU 120 -1.611 -1.959 -1.777 884 2HD1 LEU 120 HD13 LEU 120 -2.406 -0.546 -2.465 885 3HD1 LEU 120 HD12 LEU 120 -0.740 -0.924 -2.907 886 1HD2 LEU 120 HD21 LEU 120 -1.869 1.860 -1.136 887 2HD2 LEU 120 HD23 LEU 120 -0.137 1.892 -0.802 888 3HD2 LEU 120 HD22 LEU 120 -0.713 1.474 -2.411 889 H GLY 121 HN GLY 121 -1.631 -1.461 3.132 890 1HA GLY 121 HA2 GLY 121 -4.215 -0.958 4.125 891 2HA GLY 121 HA1 GLY 121 -2.969 -1.823 5.027 892 H HIS 122 HN HIS 122 -1.076 0.275 5.260 893 HA HIS 122 HA HIS 122 -2.169 1.695 7.516 894 1HB HIS 122 HB2 HIS 122 0.396 2.046 5.944 895 2HB HIS 122 HB1 HIS 122 0.000 3.003 7.374 896 HD1 HIS 122 HD1 HIS 122 -1.250 0.914 9.189 897 HD2 HIS 122 HD2 HIS 122 2.183 0.163 6.946 898 HE1 HIS 122 HE1 HIS 122 -0.045 -0.993 10.341 899 H SER 123 HN SER 123 -1.558 2.585 4.151 900 HA SER 123 HA SER 123 -2.131 5.364 4.353 901 1HB SER 123 HB2 SER 123 -2.566 3.411 2.079 902 2HB SER 123 HB1 SER 123 -2.726 5.158 1.915 903 HG SER 123 HG SER 123 -0.635 5.269 1.816 904 H LEU 124 HN LEU 124 -4.248 2.545 4.110 905 HA LEU 124 HA LEU 124 -6.650 4.164 3.728 906 1HB LEU 124 HB2 LEU 124 -6.251 1.245 4.452 907 2HB LEU 124 HB1 LEU 124 -7.828 1.975 4.174 908 HG LEU 124 HG LEU 124 -5.575 1.980 2.139 909 1HD1 LEU 124 HD12 LEU 124 -7.948 0.127 2.479 910 2HD1 LEU 124 HD11 LEU 124 -7.019 0.249 0.986 911 3HD1 LEU 124 HD13 LEU 124 -6.240 -0.312 2.464 912 1HD2 LEU 124 HD23 LEU 124 -8.429 2.956 2.163 913 2HD2 LEU 124 HD22 LEU 124 -6.996 3.713 1.473 914 3HD2 LEU 124 HD21 LEU 124 -7.749 2.353 0.649 915 H GLY 125 HN GLY 125 -4.642 3.632 6.350 916 1HA GLY 125 HA2 GLY 125 -4.987 4.547 8.533 917 2HA GLY 125 HA1 GLY 125 -6.719 4.605 8.219 918 H LEU 126 HN LEU 126 -5.353 1.600 7.365 919 HA LEU 126 HA LEU 126 -6.775 0.288 9.559 920 1HB LEU 126 HB2 LEU 126 -4.948 -0.856 7.422 921 2HB LEU 126 HB1 LEU 126 -5.995 -1.798 8.484 922 HG LEU 126 HG LEU 126 -6.974 0.334 6.561 923 1HD1 LEU 126 HD13 LEU 126 -6.003 -1.657 5.424 924 2HD1 LEU 126 HD12 LEU 126 -7.119 -2.683 6.318 925 3HD1 LEU 126 HD11 LEU 126 -7.737 -1.505 5.158 926 1HD2 LEU 126 HD22 LEU 126 -8.326 -1.562 8.485 927 2HD2 LEU 126 HD21 LEU 126 -8.633 0.156 8.223 928 3HD2 LEU 126 HD23 LEU 126 -9.173 -1.023 7.035 929 H SER 127 HN SER 127 -5.831 -0.829 11.293 930 HA SER 127 HA SER 127 -2.976 -0.118 11.858 931 1HB SER 127 HB2 SER 127 -5.310 -0.816 13.648 932 2HB SER 127 HB1 SER 127 -3.653 -0.742 14.237 933 HG SER 127 HG SER 127 -4.153 1.430 12.780 934 H HIS 128 HN HIS 128 -1.715 -1.797 13.033 935 HA HIS 128 HA HIS 128 -1.615 -4.281 11.682 936 1HB HIS 128 HB2 HIS 128 -0.663 -3.617 14.485 937 2HB HIS 128 HB1 HIS 128 -0.174 -5.038 13.562 938 HD1 HIS 128 HD1 HIS 128 0.199 -1.295 13.665 939 HD2 HIS 128 HD2 HIS 128 1.720 -4.532 11.520 940 HE1 HIS 128 HE1 HIS 128 2.092 -0.390 12.251 941 H SER 129 HN SER 129 -1.909 -6.465 12.852 942 HA SER 129 HA SER 129 -4.166 -6.468 14.782 943 1HB SER 129 HB2 SER 129 -5.236 -6.533 12.561 944 2HB SER 129 HB1 SER 129 -4.242 -7.916 12.114 945 HG SER 129 HG SER 129 -5.639 -8.131 14.495 946 H THR 130 HN THR 130 -4.436 -8.611 15.777 947 HA THR 130 HA THR 130 -1.823 -10.002 15.992 948 HB THR 130 HB THR 130 -2.746 -10.954 18.037 949 HG1 THR 130 HG1 THR 130 -5.121 -9.816 17.025 950 1HG2 THR 130 HG21 THR 130 -1.877 -8.598 18.030 951 2HG2 THR 130 HG23 THR 130 -3.539 -8.041 17.835 952 3HG2 THR 130 HG22 THR 130 -3.065 -8.909 19.295 953 H ASP 131 HN ASP 131 -4.452 -10.396 14.055 954 HA ASP 131 HA ASP 131 -4.763 -13.302 14.398 955 1HB ASP 131 HB2 ASP 131 -6.661 -11.848 13.692 956 2HB ASP 131 HB1 ASP 131 -5.802 -11.508 12.190 957 H ILE 132 HN ILE 132 -3.546 -14.797 13.375 958 HA ILE 132 HA ILE 132 -1.267 -14.110 11.814 959 HB ILE 132 HB ILE 132 -2.777 -16.721 12.106 960 1HG1 ILE 132 HG12 ILE 132 -0.090 -15.855 13.212 961 2HG1 ILE 132 HG11 ILE 132 -1.604 -15.668 14.102 962 1HG2 ILE 132 HG21 ILE 132 -0.231 -16.041 10.621 963 2HG2 ILE 132 HG23 ILE 132 -0.528 -17.665 11.240 964 3HG2 ILE 132 HG22 ILE 132 -1.620 -16.965 10.047 965 1HD1 ILE 132 HD12 ILE 132 -0.510 -18.285 13.031 966 2HD1 ILE 132 HD11 ILE 132 -0.467 -17.775 14.719 967 3HD1 ILE 132 HD13 ILE 132 -2.013 -18.092 13.932 968 H GLY 133 HN GLY 133 -4.525 -15.148 10.850 969 1HA GLY 133 HA2 GLY 133 -3.927 -15.358 8.046 970 2HA GLY 133 HA1 GLY 133 -5.540 -15.220 8.740 971 H ALA 134 HN ALA 134 -3.664 -12.645 9.835 972 HA ALA 134 HA ALA 134 -5.004 -10.835 7.883 973 1HB ALA 134 HB1 ALA 134 -3.621 -10.289 10.519 974 2HB ALA 134 HB3 ALA 134 -4.367 -9.055 9.505 975 3HB ALA 134 HB2 ALA 134 -5.359 -10.321 10.227 976 H LEU 135 HN LEU 135 -3.876 -9.522 6.497 977 HA LEU 135 HA LEU 135 -1.172 -10.224 5.809 978 1HB LEU 135 HB2 LEU 135 -2.803 -7.785 5.023 979 2HB LEU 135 HB1 LEU 135 -1.313 -8.313 4.239 980 HG LEU 135 HG LEU 135 -3.852 -9.974 4.414 981 1HD1 LEU 135 HD13 LEU 135 -2.651 -8.361 2.143 982 2HD1 LEU 135 HD12 LEU 135 -3.986 -9.498 1.958 983 3HD1 LEU 135 HD11 LEU 135 -4.189 -8.053 2.949 984 1HD2 LEU 135 HD21 LEU 135 -1.114 -10.413 3.214 985 2HD2 LEU 135 HD23 LEU 135 -2.098 -11.527 4.164 986 3HD2 LEU 135 HD22 LEU 135 -2.525 -11.188 2.492 987 H MET 136 HN MET 136 -2.592 -7.562 7.643 988 HA MET 136 HA MET 136 -0.126 -6.092 7.892 989 1HB MET 136 HB2 MET 136 -2.514 -5.954 9.738 990 2HB MET 136 HB1 MET 136 -1.322 -4.693 9.415 991 1HG MET 136 HG2 MET 136 -2.060 -4.788 6.978 992 2HG MET 136 HG1 MET 136 -3.401 -5.793 7.518 993 1HE MET 136 HE1 MET 136 -1.510 -2.655 7.604 994 2HE MET 136 HE3 MET 136 -2.603 -1.382 8.162 995 3HE MET 136 HE2 MET 136 -1.776 -2.410 9.326 996 H TYR 137 HN TYR 137 -0.172 -9.028 8.774 997 HA TYR 137 HA TYR 137 0.097 -9.114 11.611 998 1HB TYR 137 HB2 TYR 137 -0.075 -11.050 9.872 999 2HB TYR 137 HB1 TYR 137 1.675 -10.893 9.747 1000 HD1 TYR 137 HD2 TYR 137 -1.017 -11.150 12.339 1001 HD2 TYR 137 HD1 TYR 137 3.017 -12.132 11.235 1002 HE1 TYR 137 HE2 TYR 137 -0.774 -12.486 14.412 1003 HE2 TYR 137 HE1 TYR 137 3.258 -13.469 13.308 1004 HH TYR 137 HH TYR 137 1.922 -14.579 14.946 1005 HA PRO 138 HA PRO 138 3.929 -6.804 12.016 1006 1HB PRO 138 HB2 PRO 138 4.891 -8.267 14.311 1007 2HB PRO 138 HB1 PRO 138 4.081 -6.695 14.294 1008 1HG PRO 138 HG2 PRO 138 2.991 -9.268 15.127 1009 2HG PRO 138 HG1 PRO 138 2.237 -7.672 15.240 1010 1HD PRO 138 HD2 PRO 138 1.535 -9.775 13.428 1011 2HD PRO 138 HD1 PRO 138 0.897 -8.120 13.451 1012 H SER 139 HN SER 139 4.203 -10.344 12.510 1013 HA SER 139 HA SER 139 6.980 -10.312 11.539 1014 1HB SER 139 HB2 SER 139 6.302 -11.875 13.329 1015 2HB SER 139 HB1 SER 139 5.170 -12.647 12.222 1016 HG SER 139 HG SER 139 7.853 -12.338 11.468 1017 H TYR 140 HN TYR 140 7.626 -10.772 9.509 1018 HA TYR 140 HA TYR 140 5.696 -10.920 7.357 1019 1HB TYR 140 HB2 TYR 140 7.880 -9.859 7.023 1020 2HB TYR 140 HB1 TYR 140 8.694 -11.384 7.378 1021 HD1 TYR 140 HD1 TYR 140 8.555 -13.284 5.823 1022 HD2 TYR 140 HD2 TYR 140 6.735 -9.502 4.926 1023 HE1 TYR 140 HE1 TYR 140 8.310 -13.968 3.452 1024 HE2 TYR 140 HE2 TYR 140 6.491 -10.183 2.558 1025 HH TYR 140 HH TYR 140 7.113 -11.697 1.010 1026 H THR 141 HN THR 141 5.117 -12.726 6.112 1027 HA THR 141 HA THR 141 6.370 -15.349 6.697 1028 HB THR 141 HB THR 141 4.255 -16.447 7.179 1029 HG1 THR 141 HG1 THR 141 2.783 -14.161 7.419 1030 1HG2 THR 141 HG22 THR 141 5.477 -15.240 9.052 1031 2HG2 THR 141 HG21 THR 141 4.309 -13.931 8.860 1032 3HG2 THR 141 HG23 THR 141 3.763 -15.537 9.339 1033 H PHE 142 HN PHE 142 6.087 -16.812 4.929 1034 HA PHE 142 HA PHE 142 5.414 -15.487 2.402 1035 1HB PHE 142 HB2 PHE 142 7.360 -16.992 2.538 1036 2HB PHE 142 HB1 PHE 142 6.291 -18.335 2.949 1037 HD1 PHE 142 HD2 PHE 142 7.357 -16.021 0.283 1038 HD2 PHE 142 HD1 PHE 142 4.784 -19.302 1.309 1039 HE1 PHE 142 HE2 PHE 142 6.884 -16.403 -2.121 1040 HE2 PHE 142 HE1 PHE 142 4.310 -19.685 -1.092 1041 HZ PHE 142 HZ PHE 142 5.357 -18.231 -2.809 1042 H SER 143 HN SER 143 3.525 -15.713 1.292 1043 HA SER 143 HA SER 143 1.535 -17.754 2.249 1044 1HB SER 143 HB2 SER 143 0.720 -15.533 2.762 1045 2HB SER 143 HB1 SER 143 1.127 -14.957 1.148 1046 HG SER 143 HG SER 143 -0.635 -15.846 0.398 1047 H GLY 144 HN GLY 144 0.894 -19.206 0.683 1048 1HA GLY 144 HA2 GLY 144 2.135 -19.256 -1.883 1049 2HA GLY 144 HA1 GLY 144 0.710 -20.199 -1.442 1050 H ASP 145 HN ASP 145 -1.061 -18.103 -0.845 1051 HA ASP 145 HA ASP 145 -1.312 -16.638 -3.455 1052 1HB ASP 145 HB2 ASP 145 -3.456 -18.067 -1.855 1053 2HB ASP 145 HB1 ASP 145 -3.801 -16.937 -3.166 1054 H VAL 146 HN VAL 146 -1.802 -14.486 -3.238 1055 HA VAL 146 HA VAL 146 -1.973 -13.408 -0.467 1056 HB VAL 146 HB VAL 146 -1.561 -12.008 -3.130 1057 1HG1 VAL 146 HG12 VAL 146 -1.566 -11.047 -0.266 1058 2HG1 VAL 146 HG11 VAL 146 -0.735 -10.160 -1.545 1059 3HG1 VAL 146 HG13 VAL 146 -2.480 -10.410 -1.632 1060 1HG2 VAL 146 HG22 VAL 146 0.275 -13.579 -2.336 1061 2HG2 VAL 146 HG21 VAL 146 0.767 -11.898 -2.538 1062 3HG2 VAL 146 HG23 VAL 146 0.449 -12.536 -0.925 1063 H GLN 147 HN GLN 147 -4.048 -13.223 0.266 1064 HA GLN 147 HA GLN 147 -6.064 -11.926 -1.519 1065 1HB GLN 147 HB2 GLN 147 -6.446 -14.482 0.070 1066 2HB GLN 147 HB1 GLN 147 -7.777 -13.530 -0.590 1067 1HG GLN 147 HG2 GLN 147 -6.852 -13.785 -2.856 1068 2HG GLN 147 HG1 GLN 147 -5.514 -14.733 -2.206 1069 1HE2 GLN 147 HE22 GLN 147 -7.482 -17.605 -2.813 1070 2HE2 GLN 147 HE21 GLN 147 -6.044 -16.768 -3.152 1071 H LEU 148 HN LEU 148 -7.741 -10.824 -0.323 1072 HA LEU 148 HA LEU 148 -6.797 -9.705 2.189 1073 1HB LEU 148 HB2 LEU 148 -9.468 -9.441 0.774 1074 2HB LEU 148 HB1 LEU 148 -8.943 -8.451 2.134 1075 HG LEU 148 HG LEU 148 -7.488 -8.635 -0.526 1076 1HD1 LEU 148 HD11 LEU 148 -9.702 -7.567 -0.731 1077 2HD1 LEU 148 HD13 LEU 148 -9.296 -6.474 0.594 1078 3HD1 LEU 148 HD12 LEU 148 -8.407 -6.385 -0.927 1079 1HD2 LEU 148 HD21 LEU 148 -7.037 -7.100 2.038 1080 2HD2 LEU 148 HD23 LEU 148 -5.861 -7.945 1.030 1081 3HD2 LEU 148 HD22 LEU 148 -6.523 -6.401 0.503 1082 H ALA 149 HN ALA 149 -7.732 -10.029 4.273 1083 HA ALA 149 HA ALA 149 -9.146 -12.640 4.570 1084 1HB ALA 149 HB2 ALA 149 -7.558 -10.867 6.422 1085 2HB ALA 149 HB1 ALA 149 -8.660 -12.074 7.086 1086 3HB ALA 149 HB3 ALA 149 -7.320 -12.576 6.056 1087 H GLN 150 HN GLN 150 -10.954 -12.692 6.170 1088 HA GLN 150 HA GLN 150 -12.976 -10.808 5.531 1089 1HB GLN 150 HB2 GLN 150 -13.465 -13.056 6.412 1090 2HB GLN 150 HB1 GLN 150 -12.760 -12.604 7.966 1091 1HG GLN 150 HG2 GLN 150 -14.449 -10.927 8.330 1092 2HG GLN 150 HG1 GLN 150 -15.073 -11.120 6.692 1093 1HE2 GLN 150 HE22 GLN 150 -17.355 -13.107 8.783 1094 2HE2 GLN 150 HE21 GLN 150 -17.018 -11.470 8.488 1095 H ASP 151 HN ASP 151 -10.724 -10.954 8.294 1096 HA ASP 151 HA ASP 151 -11.877 -8.831 9.791 1097 1HB ASP 151 HB2 ASP 151 -10.047 -10.322 10.624 1098 2HB ASP 151 HB1 ASP 151 -8.930 -9.500 9.534 1099 H ASP 152 HN ASP 152 -9.509 -8.780 7.120 1100 HA ASP 152 HA ASP 152 -9.137 -5.909 7.257 1101 1HB ASP 152 HB2 ASP 152 -8.529 -7.951 5.099 1102 2HB ASP 152 HB1 ASP 152 -8.111 -6.242 4.964 1103 H ILE 153 HN ILE 153 -11.172 -8.060 5.289 1104 HA ILE 153 HA ILE 153 -12.221 -6.010 3.579 1105 HB ILE 153 HB ILE 153 -13.371 -8.668 4.464 1106 1HG1 ILE 153 HG12 ILE 153 -12.100 -7.894 1.827 1107 2HG1 ILE 153 HG11 ILE 153 -11.174 -8.576 3.165 1108 1HG2 ILE 153 HG23 ILE 153 -14.289 -6.663 2.392 1109 2HG2 ILE 153 HG22 ILE 153 -14.738 -8.368 2.314 1110 3HG2 ILE 153 HG21 ILE 153 -15.226 -7.388 3.696 1111 1HD1 ILE 153 HD13 ILE 153 -13.584 -9.888 1.875 1112 2HD1 ILE 153 HD12 ILE 153 -11.903 -10.329 1.570 1113 3HD1 ILE 153 HD11 ILE 153 -12.601 -10.568 3.172 1114 H ASP 154 HN ASP 154 -13.559 -7.489 6.555 1115 HA ASP 154 HA ASP 154 -15.891 -5.864 6.666 1116 1HB ASP 154 HB2 ASP 154 -14.306 -7.233 8.858 1117 2HB ASP 154 HB1 ASP 154 -15.851 -6.425 9.134 1118 H GLY 155 HN GLY 155 -12.625 -5.344 7.946 1119 1HA GLY 155 HA2 GLY 155 -13.200 -2.977 9.423 1120 2HA GLY 155 HA1 GLY 155 -11.613 -3.412 8.798 1121 H ILE 156 HN ILE 156 -11.840 -3.235 6.081 1122 HA ILE 156 HA ILE 156 -11.992 -0.380 5.686 1123 HB ILE 156 HB ILE 156 -10.523 -1.996 4.370 1124 1HG1 ILE 156 HG12 ILE 156 -10.900 -0.753 2.191 1125 2HG1 ILE 156 HG11 ILE 156 -12.334 -0.038 2.920 1126 1HG2 ILE 156 HG23 ILE 156 -12.449 -3.593 3.933 1127 2HG2 ILE 156 HG22 ILE 156 -13.041 -2.428 2.750 1128 3HG2 ILE 156 HG21 ILE 156 -11.470 -3.192 2.524 1129 1HD1 ILE 156 HD12 ILE 156 -9.758 0.176 4.444 1130 2HD1 ILE 156 HD11 ILE 156 -9.965 1.186 3.017 1131 3HD1 ILE 156 HD13 ILE 156 -11.111 1.305 4.347 1132 H GLN 157 HN GLN 157 -14.160 -3.067 4.850 1133 HA GLN 157 HA GLN 157 -16.042 -1.457 3.381 1134 1HB GLN 157 HB2 GLN 157 -16.362 -4.083 4.863 1135 2HB GLN 157 HB1 GLN 157 -17.654 -3.339 3.927 1136 1HG GLN 157 HG2 GLN 157 -16.272 -3.421 1.906 1137 2HG GLN 157 HG1 GLN 157 -14.936 -4.112 2.829 1138 1HE2 GLN 157 HE22 GLN 157 -16.895 -6.909 1.243 1139 2HE2 GLN 157 HE21 GLN 157 -16.101 -5.541 0.628 1140 H ALA 158 HN ALA 158 -15.720 -2.343 6.787 1141 HA ALA 158 HA ALA 158 -18.197 -1.271 7.677 1142 1HB ALA 158 HB2 ALA 158 -15.526 -1.522 9.086 1143 2HB ALA 158 HB1 ALA 158 -17.033 -1.102 9.900 1144 3HB ALA 158 HB3 ALA 158 -16.858 -2.676 9.124 1145 H ILE 159 HN ILE 159 -15.023 0.285 7.201 1146 HA ILE 159 HA ILE 159 -15.843 2.846 8.254 1147 HB ILE 159 HB ILE 159 -13.640 2.108 6.307 1148 1HG1 ILE 159 HG12 ILE 159 -13.502 2.720 9.273 1149 2HG1 ILE 159 HG11 ILE 159 -13.598 1.083 8.621 1150 1HG2 ILE 159 HG21 ILE 159 -14.273 4.668 7.787 1151 2HG2 ILE 159 HG23 ILE 159 -12.665 4.313 7.159 1152 3HG2 ILE 159 HG22 ILE 159 -14.031 4.451 6.054 1153 1HD1 ILE 159 HD12 ILE 159 -11.555 1.559 7.259 1154 2HD1 ILE 159 HD11 ILE 159 -11.433 3.120 8.067 1155 3HD1 ILE 159 HD13 ILE 159 -11.259 1.634 8.997 1156 H TYR 160 HN TYR 160 -15.594 1.587 4.909 1157 HA TYR 160 HA TYR 160 -17.068 3.992 3.933 1158 1HB TYR 160 HB2 TYR 160 -15.607 1.764 2.493 1159 2HB TYR 160 HB1 TYR 160 -16.512 3.030 1.667 1160 HD1 TYR 160 HD2 TYR 160 -15.735 5.376 1.718 1161 HD2 TYR 160 HD1 TYR 160 -13.517 2.230 3.630 1162 HE1 TYR 160 HE2 TYR 160 -13.760 6.868 1.886 1163 HE2 TYR 160 HE1 TYR 160 -11.546 3.723 3.802 1164 HH TYR 160 HH TYR 160 -10.841 5.862 3.621 1165 H GLY 161 HN GLY 161 -17.183 0.464 3.260 1166 1HA GLY 161 HA2 GLY 161 -19.693 -0.245 4.023 1167 2HA GLY 161 HA1 GLY 161 -20.042 0.710 2.579 1168 H ARG 162 HN ARG 162 -20.859 -1.715 2.180 1169 HA ARG 162 HA ARG 162 -18.674 -3.422 1.134 1170 1HB ARG 162 HB2 ARG 162 -21.672 -3.817 1.383 1171 2HB ARG 162 HB1 ARG 162 -20.592 -4.994 0.629 1172 1HG ARG 162 HG2 ARG 162 -19.270 -5.127 2.702 1173 2HG ARG 162 HG1 ARG 162 -20.342 -3.953 3.467 1174 1HD ARG 162 HD2 ARG 162 -21.040 -6.161 4.157 1175 2HD ARG 162 HD1 ARG 162 -22.253 -5.538 3.034 1176 HE ARG 162 HE ARG 162 -20.549 -6.926 1.384 1177 1HH1 ARG 162 HH21 ARG 162 -22.219 -7.589 4.327 1178 2HH1 ARG 162 HH22 ARG 162 -22.394 -9.281 4.002 1179 1HH2 ARG 162 HH11 ARG 162 -20.756 -9.128 0.948 1180 2HH2 ARG 162 HH12 ARG 162 -21.558 -10.155 2.088 1181 H SER 163 HN SER 163 -18.481 -3.932 -1.101 1182 HA SER 163 HA SER 163 -19.332 -1.808 -2.897 1183 1HB SER 163 HB2 SER 163 -17.944 -4.455 -3.405 1184 2HB SER 163 HB1 SER 163 -18.259 -3.261 -4.659 1185 HG SER 163 HG SER 163 -17.174 -1.941 -2.698 1186 H GLN 164 HN GLN 164 -21.662 -2.671 -1.937 1187 HA GLN 164 HA GLN 164 -22.833 -4.842 -3.496 1188 1HB GLN 164 HB2 GLN 164 -24.015 -2.723 -1.688 1189 2HB GLN 164 HB1 GLN 164 -24.985 -3.961 -2.481 1190 1HG GLN 164 HG2 GLN 164 -23.802 -5.720 -1.331 1191 2HG GLN 164 HG1 GLN 164 -22.628 -4.574 -0.678 1192 1HE2 GLN 164 HE22 GLN 164 -25.296 -5.192 1.904 1193 2HE2 GLN 164 HE21 GLN 164 -24.212 -6.199 1.074 1194 H ASN 165 HN ASN 165 -21.832 -3.379 -5.463 1195 HA ASN 165 HA ASN 165 -24.215 -2.289 -6.804 1196 1HB ASN 165 HB2 ASN 165 -21.783 -0.599 -6.186 1197 2HB ASN 165 HB1 ASN 165 -22.942 -0.190 -7.453 1198 1HD2 ASN 165 HD22 ASN 165 -23.840 0.664 -3.630 1199 2HD2 ASN 165 HD21 ASN 165 -22.302 0.134 -4.113 1200 HA PRO 166 HA PRO 166 -21.033 -4.540 -9.390 1201 1HB PRO 166 HB2 PRO 166 -22.937 -6.396 -10.376 1202 2HB PRO 166 HB1 PRO 166 -21.761 -6.701 -9.093 1203 1HG PRO 166 HG2 PRO 166 -24.669 -6.306 -8.860 1204 2HG PRO 166 HG1 PRO 166 -23.538 -6.945 -7.659 1205 1HD PRO 166 HD2 PRO 166 -24.731 -4.340 -7.677 1206 2HD PRO 166 HD1 PRO 166 -23.469 -4.924 -6.573 1207 H VAL 167 HN VAL 167 -21.618 -2.225 -10.278 1208 HA VAL 167 HA VAL 167 -23.635 -2.181 -12.411 1209 HB VAL 167 HB VAL 167 -21.485 -0.153 -11.738 1210 1HG1 VAL 167 HG13 VAL 167 -23.981 -0.074 -13.444 1211 2HG1 VAL 167 HG12 VAL 167 -23.161 1.384 -12.888 1212 3HG1 VAL 167 HG11 VAL 167 -22.320 0.248 -13.944 1213 1HG2 VAL 167 HG21 VAL 167 -24.335 -0.485 -10.768 1214 2HG2 VAL 167 HG23 VAL 167 -22.866 -0.403 -9.793 1215 3HG2 VAL 167 HG22 VAL 167 -23.451 1.034 -10.630 1216 H GLN 168 HN GLN 168 -23.226 -2.391 -14.580 1217 HA GLN 168 HA GLN 168 -20.680 -3.555 -15.371 1218 1HB GLN 168 HB2 GLN 168 -22.863 -2.670 -17.261 1219 2HB GLN 168 HB1 GLN 168 -21.772 -4.043 -17.418 1220 1HG GLN 168 HG2 GLN 168 -22.879 -5.042 -15.377 1221 2HG GLN 168 HG1 GLN 168 -24.078 -3.751 -15.486 1222 1HE2 GLN 168 HE22 GLN 168 -24.906 -6.901 -17.602 1223 2HE2 GLN 168 HE21 GLN 168 -24.166 -6.831 -16.076 1224 HA PRO 169 HA PRO 169 -18.659 0.206 -16.642 1225 1HB PRO 169 HB2 PRO 169 -17.638 -0.769 -19.157 1226 2HB PRO 169 HB1 PRO 169 -16.774 -0.658 -17.618 1227 1HG PRO 169 HG2 PRO 169 -17.826 -3.051 -18.939 1228 2HG PRO 169 HG1 PRO 169 -16.775 -2.949 -17.518 1229 1HD PRO 169 HD2 PRO 169 -19.527 -3.673 -17.526 1230 2HD PRO 169 HD1 PRO 169 -18.536 -3.320 -16.099 No H/Q in entry = 1230 Start of MODEL 15 1 1H VAL 1 HT2 VAL 1 -1.889 4.022 12.980 2 2H VAL 1 HT1 VAL 1 -0.360 4.715 13.231 3 3H VAL 1 HT3 VAL 1 -0.828 3.355 14.127 4 HA VAL 1 HA VAL 1 -2.190 4.526 15.510 5 HB VAL 1 HB VAL 1 -0.209 6.630 14.587 6 1HG1 VAL 1 HG11 VAL 1 -1.645 6.188 17.227 7 2HG1 VAL 1 HG13 VAL 1 -0.404 7.409 16.941 8 3HG1 VAL 1 HG12 VAL 1 -1.946 7.505 16.091 9 1HG2 VAL 1 HG21 VAL 1 0.048 4.413 16.646 10 2HG2 VAL 1 HG23 VAL 1 0.890 4.485 15.098 11 3HG2 VAL 1 HG22 VAL 1 1.247 5.672 16.351 12 H LEU 2 HN LEU 2 -4.125 5.566 15.510 13 HA LEU 2 HA LEU 2 -5.159 6.739 13.085 14 1HB LEU 2 HB2 LEU 2 -6.238 6.849 15.921 15 2HB LEU 2 HB1 LEU 2 -7.146 7.248 14.461 16 HG LEU 2 HG LEU 2 -5.882 4.544 15.018 17 1HD1 LEU 2 HD13 LEU 2 -8.686 5.595 15.408 18 2HD1 LEU 2 HD12 LEU 2 -8.376 3.877 15.163 19 3HD1 LEU 2 HD11 LEU 2 -7.675 4.710 16.549 20 1HD2 LEU 2 HD21 LEU 2 -7.460 5.710 12.728 21 2HD2 LEU 2 HD23 LEU 2 -6.047 4.653 12.687 22 3HD2 LEU 2 HD22 LEU 2 -7.625 3.995 13.098 23 H THR 3 HN THR 3 -5.386 8.905 12.534 24 HA THR 3 HA THR 3 -3.795 10.832 14.135 25 HB THR 3 HB THR 3 -3.913 12.265 12.185 26 HG1 THR 3 HG1 THR 3 -5.382 12.017 10.676 27 1HG2 THR 3 HG21 THR 3 -2.354 10.303 12.117 28 2HG2 THR 3 HG23 THR 3 -3.591 9.409 11.233 29 3HG2 THR 3 HG22 THR 3 -2.864 10.849 10.519 30 H GLU 4 HN GLU 4 -4.702 12.743 14.994 31 HA GLU 4 HA GLU 4 -7.463 12.565 15.817 32 1HB GLU 4 HB2 GLU 4 -5.710 13.678 17.178 33 2HB GLU 4 HB1 GLU 4 -5.559 14.923 15.938 34 1HG GLU 4 HG2 GLU 4 -7.915 15.561 16.271 35 2HG GLU 4 HG1 GLU 4 -8.089 14.304 17.496 36 H GLY 5 HN GLY 5 -9.262 13.466 14.889 37 1HA GLY 5 HA2 GLY 5 -10.230 15.402 13.616 38 2HA GLY 5 HA1 GLY 5 -8.873 15.257 12.504 39 H ASN 6 HN ASN 6 -8.974 13.719 10.861 40 HA ASN 6 HA ASN 6 -11.050 11.636 10.896 41 1HB ASN 6 HB2 ASN 6 -11.147 13.960 8.963 42 2HB ASN 6 HB1 ASN 6 -12.053 12.462 8.746 43 1HD2 ASN 6 HD22 ASN 6 -14.508 13.288 11.147 44 2HD2 ASN 6 HD21 ASN 6 -13.934 12.139 10.038 45 HA PRO 7 HA PRO 7 -7.120 10.731 8.567 46 1HB PRO 7 HB2 PRO 7 -7.193 8.024 9.581 47 2HB PRO 7 HB1 PRO 7 -6.063 9.310 10.017 48 1HG PRO 7 HG2 PRO 7 -8.215 8.229 11.622 49 2HG PRO 7 HG1 PRO 7 -7.058 9.491 12.065 50 1HD PRO 7 HD2 PRO 7 -9.861 9.801 11.409 51 2HD PRO 7 HD1 PRO 7 -8.716 11.068 11.888 52 H ARG 8 HN ARG 8 -9.283 10.975 7.101 53 HA ARG 8 HA ARG 8 -9.487 8.416 5.593 54 1HB ARG 8 HB2 ARG 8 -11.846 10.030 6.619 55 2HB ARG 8 HB1 ARG 8 -11.972 8.783 5.376 56 1HG ARG 8 HG2 ARG 8 -11.065 7.114 6.951 57 2HG ARG 8 HG1 ARG 8 -10.937 8.353 8.198 58 1HD ARG 8 HD2 ARG 8 -13.378 8.716 8.084 59 2HD ARG 8 HD1 ARG 8 -13.501 7.463 6.849 60 HE ARG 8 HE ARG 8 -12.241 6.190 8.964 61 1HH1 ARG 8 HH21 ARG 8 -15.107 8.055 8.514 62 2HH1 ARG 8 HH22 ARG 8 -15.996 7.231 9.753 63 1HH2 ARG 8 HH11 ARG 8 -13.385 5.112 10.585 64 2HH2 ARG 8 HH12 ARG 8 -15.022 5.567 10.923 65 H TRP 9 HN TRP 9 -9.546 8.796 3.379 66 HA TRP 9 HA TRP 9 -8.967 11.459 2.427 67 1HB TRP 9 HB2 TRP 9 -9.742 8.916 0.978 68 2HB TRP 9 HB1 TRP 9 -9.309 10.410 0.147 69 HD1 TRP 9 HD1 TRP 9 -7.835 7.647 2.326 70 HE1 TRP 9 HE1 TRP 9 -5.264 7.736 2.157 71 HE3 TRP 9 HE3 TRP 9 -7.272 11.956 -0.356 72 HZ2 TRP 9 HZ2 TRP 9 -3.238 9.406 1.032 73 HZ3 TRP 9 HZ3 TRP 9 -5.013 12.769 -0.966 74 HH2 TRP 9 HH2 TRP 9 -2.997 11.503 -0.278 75 H GLU 10 HN GLU 10 -10.339 12.986 1.582 76 HA GLU 10 HA GLU 10 -13.180 12.754 2.119 77 1HB GLU 10 HB2 GLU 10 -11.525 14.825 0.659 78 2HB GLU 10 HB1 GLU 10 -13.260 14.988 0.925 79 1HG GLU 10 HG2 GLU 10 -12.974 14.960 3.315 80 2HG GLU 10 HG1 GLU 10 -11.270 14.531 3.162 81 H GLN 11 HN GLN 11 -11.151 12.503 -0.753 82 HA GLN 11 HA GLN 11 -13.478 12.278 -2.546 83 1HB GLN 11 HB2 GLN 11 -10.536 11.876 -3.142 84 2HB GLN 11 HB1 GLN 11 -11.824 12.151 -4.314 85 1HG GLN 11 HG2 GLN 11 -10.857 14.292 -4.043 86 2HG GLN 11 HG1 GLN 11 -12.278 14.344 -3.000 87 1HE2 GLN 11 HE22 GLN 11 -9.853 15.568 -0.641 88 2HE2 GLN 11 HE21 GLN 11 -10.995 16.073 -1.793 89 H THR 12 HN THR 12 -14.062 10.377 -3.664 90 HA THR 12 HA THR 12 -13.250 7.846 -2.339 91 HB THR 12 HB THR 12 -15.101 6.854 -3.624 92 HG1 THR 12 HG1 THR 12 -14.744 9.139 -5.049 93 1HG2 THR 12 HG22 THR 12 -15.708 9.464 -2.219 94 2HG2 THR 12 HG21 THR 12 -16.956 8.316 -2.705 95 3HG2 THR 12 HG23 THR 12 -15.731 7.840 -1.527 96 H HIS 13 HN HIS 13 -12.263 9.742 -4.871 97 HA HIS 13 HA HIS 13 -11.150 7.416 -6.409 98 1HB HIS 13 HB2 HIS 13 -11.813 10.236 -7.338 99 2HB HIS 13 HB1 HIS 13 -11.024 9.005 -8.327 100 HD1 HIS 13 HD1 HIS 13 -14.205 9.206 -6.202 101 HD2 HIS 13 HD2 HIS 13 -12.871 7.615 -9.819 102 HE1 HIS 13 HE1 HIS 13 -16.205 8.072 -7.267 103 H LEU 14 HN LEU 14 -8.949 7.296 -6.350 104 HA LEU 14 HA LEU 14 -7.396 9.719 -5.483 105 1HB LEU 14 HB2 LEU 14 -6.902 6.825 -4.713 106 2HB LEU 14 HB1 LEU 14 -5.911 8.202 -4.235 107 HG LEU 14 HG LEU 14 -8.850 7.879 -3.559 108 1HD1 LEU 14 HD11 LEU 14 -6.341 7.353 -1.944 109 2HD1 LEU 14 HD13 LEU 14 -7.946 7.503 -1.228 110 3HD1 LEU 14 HD12 LEU 14 -7.605 6.197 -2.365 111 1HD2 LEU 14 HD21 LEU 14 -6.756 9.975 -2.967 112 2HD2 LEU 14 HD23 LEU 14 -8.435 10.190 -3.467 113 3HD2 LEU 14 HD22 LEU 14 -8.066 9.699 -1.816 114 H THR 15 HN THR 15 -5.136 9.650 -6.210 115 HA THR 15 HA THR 15 -4.715 7.975 -8.663 116 HB THR 15 HB THR 15 -3.712 9.913 -9.758 117 HG1 THR 15 HG1 THR 15 -4.398 11.243 -7.348 118 1HG2 THR 15 HG21 THR 15 -6.157 9.596 -9.973 119 2HG2 THR 15 HG23 THR 15 -6.407 10.602 -8.546 120 3HG2 THR 15 HG22 THR 15 -5.728 11.305 -10.013 121 H TYR 16 HN TYR 16 -2.405 7.657 -9.157 122 HA TYR 16 HA TYR 16 -0.538 8.302 -6.934 123 1HB TYR 16 HB2 TYR 16 0.204 5.963 -6.752 124 2HB TYR 16 HB1 TYR 16 -1.503 6.113 -6.342 125 HD1 TYR 16 HD1 TYR 16 0.917 4.899 -8.837 126 HD2 TYR 16 HD2 TYR 16 -3.246 5.252 -7.833 127 HE1 TYR 16 HE1 TYR 16 0.352 3.248 -10.599 128 HE2 TYR 16 HE2 TYR 16 -3.808 3.601 -9.602 129 HH TYR 16 HH TYR 16 -2.026 1.524 -10.819 130 H ARG 17 HN ARG 17 1.686 8.083 -7.528 131 HA ARG 17 HA ARG 17 2.280 7.567 -10.397 132 1HB ARG 17 HB2 ARG 17 1.795 10.039 -10.050 133 2HB ARG 17 HB1 ARG 17 3.194 10.079 -8.977 134 1HG ARG 17 HG2 ARG 17 4.628 9.254 -10.818 135 2HG ARG 17 HG1 ARG 17 3.226 9.244 -11.894 136 1HD ARG 17 HD2 ARG 17 4.357 11.674 -10.472 137 2HD ARG 17 HD1 ARG 17 4.509 11.318 -12.197 138 HE ARG 17 HE ARG 17 1.793 11.283 -11.807 139 1HH1 ARG 17 HH21 ARG 17 4.372 13.447 -11.069 140 2HH1 ARG 17 HH22 ARG 17 3.380 14.866 -11.156 141 1HH2 ARG 17 HH11 ARG 17 0.486 13.109 -11.909 142 2HH2 ARG 17 HH12 ARG 17 1.178 14.673 -11.633 143 H ILE 18 HN ILE 18 4.288 6.613 -10.632 144 HA ILE 18 HA ILE 18 5.842 6.122 -8.156 145 HB ILE 18 HB ILE 18 6.194 5.041 -10.972 146 1HG1 ILE 18 HG12 ILE 18 5.120 3.665 -8.491 147 2HG1 ILE 18 HG11 ILE 18 4.080 4.390 -9.719 148 1HG2 ILE 18 HG21 ILE 18 7.504 4.355 -8.323 149 2HG2 ILE 18 HG23 ILE 18 7.637 3.358 -9.772 150 3HG2 ILE 18 HG22 ILE 18 8.299 4.994 -9.763 151 1HD1 ILE 18 HD11 ILE 18 6.188 2.322 -10.383 152 2HD1 ILE 18 HD13 ILE 18 4.526 1.890 -9.977 153 3HD1 ILE 18 HD12 ILE 18 4.858 2.879 -11.401 154 H GLU 19 HN GLU 19 7.454 7.520 -7.662 155 HA GLU 19 HA GLU 19 8.334 9.567 -9.463 156 1HB GLU 19 HB2 GLU 19 8.432 9.692 -6.951 157 2HB GLU 19 HB1 GLU 19 9.782 8.559 -6.997 158 1HG GLU 19 HG2 GLU 19 11.054 10.122 -8.417 159 2HG GLU 19 HG1 GLU 19 9.704 11.258 -8.378 160 H ASN 20 HN ASN 20 9.759 6.431 -8.536 161 HA ASN 20 HA ASN 20 11.290 6.396 -11.034 162 1HB ASN 20 HB2 ASN 20 12.693 6.570 -8.352 163 2HB ASN 20 HB1 ASN 20 13.488 6.091 -9.851 164 1HD2 ASN 20 HD22 ASN 20 13.326 9.944 -9.071 165 2HD2 ASN 20 HD21 ASN 20 13.280 8.694 -7.922 166 H TYR 21 HN TYR 21 12.232 4.300 -11.436 167 HA TYR 21 HA TYR 21 10.975 2.123 -9.819 168 1HB TYR 21 HB2 TYR 21 12.181 2.164 -12.606 169 2HB TYR 21 HB1 TYR 21 11.600 0.702 -11.805 170 HD1 TYR 21 HD1 TYR 21 9.218 0.346 -11.387 171 HD2 TYR 21 HD2 TYR 21 10.632 3.903 -13.339 172 HE1 TYR 21 HE1 TYR 21 6.902 0.867 -12.112 173 HE2 TYR 21 HE2 TYR 21 8.317 4.427 -14.061 174 HH TYR 21 HH TYR 21 6.106 2.789 -14.478 175 H THR 22 HN THR 22 12.276 0.823 -8.572 176 HA THR 22 HA THR 22 15.062 1.457 -8.285 177 HB THR 22 HB THR 22 13.922 0.628 -6.353 178 HG1 THR 22 HG1 THR 22 15.142 -1.501 -6.150 179 1HG2 THR 22 HG21 THR 22 12.150 -0.618 -7.546 180 2HG2 THR 22 HG23 THR 22 13.324 -1.857 -7.987 181 3HG2 THR 22 HG22 THR 22 12.896 -1.609 -6.294 182 HA PRO 23 HA PRO 23 16.539 -1.171 -11.604 183 1HB PRO 23 HB2 PRO 23 19.144 -1.623 -10.538 184 2HB PRO 23 HB1 PRO 23 18.677 -0.330 -11.653 185 1HG PRO 23 HG2 PRO 23 19.273 -0.145 -8.771 186 2HG PRO 23 HG1 PRO 23 19.160 1.154 -9.967 187 1HD PRO 23 HD2 PRO 23 17.232 0.557 -7.961 188 2HD PRO 23 HD1 PRO 23 17.019 1.655 -9.344 189 H ASP 24 HN ASP 24 15.907 -2.124 -8.476 190 HA ASP 24 HA ASP 24 17.139 -4.709 -8.331 191 1HB ASP 24 HB2 ASP 24 14.608 -3.612 -7.083 192 2HB ASP 24 HB1 ASP 24 15.248 -5.214 -6.720 193 H LEU 25 HN LEU 25 14.042 -3.614 -9.685 194 HA LEU 25 HA LEU 25 13.881 -6.177 -11.198 195 1HB LEU 25 HB2 LEU 25 11.619 -4.897 -9.631 196 2HB LEU 25 HB1 LEU 25 11.420 -6.252 -10.730 197 HG LEU 25 HG LEU 25 13.272 -6.314 -8.329 198 1HD1 LEU 25 HD13 LEU 25 10.374 -7.112 -8.622 199 2HD1 LEU 25 HD12 LEU 25 11.411 -7.762 -7.353 200 3HD1 LEU 25 HD11 LEU 25 11.088 -6.031 -7.426 201 1HD2 LEU 25 HD21 LEU 25 12.257 -8.366 -10.312 202 2HD2 LEU 25 HD23 LEU 25 13.921 -8.038 -9.824 203 3HD2 LEU 25 HD22 LEU 25 12.825 -8.851 -8.714 204 HA PRO 26 HA PRO 26 13.006 -3.389 -14.552 205 1HB PRO 26 HB2 PRO 26 10.922 -5.012 -15.751 206 2HB PRO 26 HB1 PRO 26 12.606 -4.858 -16.267 207 1HG PRO 26 HG2 PRO 26 11.353 -7.103 -14.898 208 2HG PRO 26 HG1 PRO 26 13.006 -6.987 -15.520 209 1HD PRO 26 HD2 PRO 26 12.212 -6.959 -12.772 210 2HD PRO 26 HD1 PRO 26 13.837 -6.658 -13.416 211 H ARG 27 HN ARG 27 11.299 -1.876 -15.193 212 HA ARG 27 HA ARG 27 9.428 -1.279 -13.078 213 1HB ARG 27 HB2 ARG 27 8.617 0.489 -14.592 214 2HB ARG 27 HB1 ARG 27 10.380 0.472 -14.545 215 1HG ARG 27 HG2 ARG 27 10.302 -1.000 -16.608 216 2HG ARG 27 HG1 ARG 27 8.578 -0.652 -16.703 217 1HD ARG 27 HD2 ARG 27 9.138 1.793 -16.687 218 2HD ARG 27 HD1 ARG 27 10.841 1.371 -16.799 219 HE ARG 27 HE ARG 27 8.967 1.512 -18.969 220 1HH1 ARG 27 HH21 ARG 27 11.495 -0.535 -17.781 221 2HH1 ARG 27 HH22 ARG 27 11.717 -1.331 -19.301 222 1HH2 ARG 27 HH11 ARG 27 9.273 0.498 -20.930 223 2HH2 ARG 27 HH12 ARG 27 10.472 -0.743 -21.080 224 H ALA 28 HN ALA 28 9.208 -3.041 -16.105 225 HA ALA 28 HA ALA 28 6.384 -3.078 -16.408 226 1HB ALA 28 HB2 ALA 28 8.009 -3.891 -18.112 227 2HB ALA 28 HB1 ALA 28 8.335 -5.294 -17.093 228 3HB ALA 28 HB3 ALA 28 6.728 -5.060 -17.785 229 H ASP 29 HN ASP 29 8.533 -5.167 -14.496 230 HA ASP 29 HA ASP 29 6.347 -6.886 -13.616 231 1HB ASP 29 HB2 ASP 29 9.210 -6.553 -12.681 232 2HB ASP 29 HB1 ASP 29 8.093 -7.727 -11.980 233 H VAL 30 HN VAL 30 8.068 -4.083 -12.304 234 HA VAL 30 HA VAL 30 6.908 -4.255 -9.672 235 HB VAL 30 HB VAL 30 8.151 -1.976 -11.223 236 1HG1 VAL 30 HG11 VAL 30 7.041 -2.084 -8.417 237 2HG1 VAL 30 HG13 VAL 30 8.347 -0.974 -8.835 238 3HG1 VAL 30 HG12 VAL 30 6.789 -0.851 -9.651 239 1HG2 VAL 30 HG22 VAL 30 9.524 -4.008 -10.488 240 2HG2 VAL 30 HG21 VAL 30 10.108 -2.441 -9.927 241 3HG2 VAL 30 HG23 VAL 30 9.215 -3.494 -8.829 242 H ASP 31 HN ASP 31 5.993 -2.457 -12.618 243 HA ASP 31 HA ASP 31 3.872 -0.963 -11.473 244 1HB ASP 31 HB2 ASP 31 4.736 -0.597 -13.773 245 2HB ASP 31 HB1 ASP 31 4.014 -2.128 -14.271 246 H HIS 32 HN HIS 32 3.878 -4.227 -12.898 247 HA HIS 32 HA HIS 32 1.079 -4.717 -12.641 248 1HB HIS 32 HB2 HIS 32 2.611 -6.189 -13.926 249 2HB HIS 32 HB1 HIS 32 3.356 -6.715 -12.414 250 HD1 HIS 32 HD1 HIS 32 -0.121 -6.607 -13.988 251 HD2 HIS 32 HD2 HIS 32 2.086 -8.907 -11.302 252 HE1 HIS 32 HE1 HIS 32 -1.584 -8.577 -13.363 253 H ALA 33 HN ALA 33 3.766 -5.333 -10.381 254 HA ALA 33 HA ALA 33 2.256 -6.580 -8.325 255 1HB ALA 33 HB2 ALA 33 4.734 -6.480 -8.373 256 2HB ALA 33 HB1 ALA 33 4.657 -4.755 -8.019 257 3HB ALA 33 HB3 ALA 33 4.084 -5.926 -6.831 258 H ILE 34 HN ILE 34 3.015 -3.118 -8.823 259 HA ILE 34 HA ILE 34 1.532 -2.254 -6.495 260 HB ILE 34 HB ILE 34 2.241 -0.700 -9.009 261 1HG1 ILE 34 HG12 ILE 34 4.288 -1.550 -8.038 262 2HG1 ILE 34 HG11 ILE 34 4.154 0.147 -7.600 263 1HG2 ILE 34 HG22 ILE 34 1.363 0.128 -6.236 264 2HG2 ILE 34 HG21 ILE 34 2.130 1.242 -7.365 265 3HG2 ILE 34 HG23 ILE 34 0.583 0.500 -7.773 266 1HD1 ILE 34 HD12 ILE 34 2.994 -0.764 -5.436 267 2HD1 ILE 34 HD11 ILE 34 3.778 -2.284 -5.871 268 3HD1 ILE 34 HD13 ILE 34 4.751 -0.846 -5.567 269 H GLU 35 HN GLU 35 0.756 -2.407 -9.971 270 HA GLU 35 HA GLU 35 -1.841 -1.271 -9.807 271 1HB GLU 35 HB2 GLU 35 -0.643 -1.675 -11.935 272 2HB GLU 35 HB1 GLU 35 -0.835 -3.411 -11.706 273 1HG GLU 35 HG2 GLU 35 -3.269 -3.190 -11.783 274 2HG GLU 35 HG1 GLU 35 -3.124 -1.437 -11.920 275 H LYS 36 HN LYS 36 -0.807 -4.676 -9.465 276 HA LYS 36 HA LYS 36 -3.442 -5.767 -9.242 277 1HB LYS 36 HB2 LYS 36 -1.437 -7.148 -9.656 278 2HB LYS 36 HB1 LYS 36 -0.857 -6.790 -8.029 279 1HG LYS 36 HG2 LYS 36 -2.842 -7.879 -7.066 280 2HG LYS 36 HG1 LYS 36 -3.462 -8.204 -8.685 281 1HD LYS 36 HD2 LYS 36 -1.503 -9.594 -9.182 282 2HD LYS 36 HD1 LYS 36 -0.828 -9.239 -7.593 283 1HE LYS 36 HE2 LYS 36 -1.923 -11.418 -7.524 284 2HE LYS 36 HE1 LYS 36 -2.850 -10.279 -6.551 285 1HZ LYS 36 HZ3 LYS 36 -3.609 -10.396 -9.338 286 2HZ LYS 36 HZ2 LYS 36 -3.895 -11.826 -8.466 287 3HZ LYS 36 HZ1 LYS 36 -4.579 -10.360 -7.947 288 H ALA 37 HN ALA 37 -1.220 -4.484 -6.770 289 HA ALA 37 HA ALA 37 -2.728 -5.273 -4.492 290 1HB ALA 37 HB1 ALA 37 -0.375 -4.227 -4.610 291 2HB ALA 37 HB3 ALA 37 -1.203 -2.673 -4.651 292 3HB ALA 37 HB2 ALA 37 -1.403 -3.742 -3.265 293 H PHE 38 HN PHE 38 -2.867 -2.181 -6.319 294 HA PHE 38 HA PHE 38 -4.939 -1.018 -4.745 295 1HB PHE 38 HB2 PHE 38 -4.055 -0.612 -7.603 296 2HB PHE 38 HB1 PHE 38 -5.461 0.243 -6.974 297 HD1 PHE 38 HD2 PHE 38 -5.187 1.623 -4.841 298 HD2 PHE 38 HD1 PHE 38 -1.858 0.158 -7.124 299 HE1 PHE 38 HE2 PHE 38 -3.709 3.292 -3.756 300 HE2 PHE 38 HE1 PHE 38 -0.381 1.825 -6.039 301 HZ PHE 38 HZ PHE 38 -1.305 3.393 -4.355 302 H GLN 39 HN GLN 39 -5.086 -3.170 -7.568 303 HA GLN 39 HA GLN 39 -7.897 -3.061 -7.964 304 1HB GLN 39 HB2 GLN 39 -5.901 -5.287 -8.441 305 2HB GLN 39 HB1 GLN 39 -7.586 -5.369 -8.961 306 1HG GLN 39 HG2 GLN 39 -7.317 -3.420 -10.367 307 2HG GLN 39 HG1 GLN 39 -5.695 -3.135 -9.736 308 1HE2 GLN 39 HE22 GLN 39 -5.238 -4.946 -12.940 309 2HE2 GLN 39 HE21 GLN 39 -5.814 -3.422 -12.463 310 H LEU 40 HN LEU 40 -5.940 -5.095 -5.782 311 HA LEU 40 HA LEU 40 -8.053 -6.777 -4.885 312 1HB LEU 40 HB2 LEU 40 -5.562 -5.797 -3.462 313 2HB LEU 40 HB1 LEU 40 -6.645 -7.009 -2.784 314 HG LEU 40 HG LEU 40 -5.260 -7.260 -5.472 315 1HD1 LEU 40 HD12 LEU 40 -4.576 -8.379 -2.740 316 2HD1 LEU 40 HD11 LEU 40 -3.885 -8.991 -4.242 317 3HD1 LEU 40 HD13 LEU 40 -3.579 -7.328 -3.744 318 1HD2 LEU 40 HD21 LEU 40 -7.163 -8.986 -3.897 319 2HD2 LEU 40 HD23 LEU 40 -7.076 -8.718 -5.638 320 3HD2 LEU 40 HD22 LEU 40 -5.912 -9.779 -4.854 321 H TRP 41 HN TRP 41 -6.940 -3.621 -3.654 322 HA TRP 41 HA TRP 41 -8.889 -3.566 -1.502 323 1HB TRP 41 HB2 TRP 41 -7.230 -1.396 -2.815 324 2HB TRP 41 HB1 TRP 41 -8.275 -1.114 -1.423 325 HD1 TRP 41 HD1 TRP 41 -4.851 -2.082 -2.270 326 HE1 TRP 41 HE1 TRP 41 -3.636 -3.075 -0.224 327 HE3 TRP 41 HE3 TRP 41 -8.833 -2.833 0.843 328 HZ2 TRP 41 HZ2 TRP 41 -4.270 -4.062 2.384 329 HZ3 TRP 41 HZ3 TRP 41 -8.499 -3.805 3.099 330 HH2 TRP 41 HH2 TRP 41 -6.222 -4.422 3.872 331 H SER 42 HN SER 42 -8.796 -2.213 -4.783 332 HA SER 42 HA SER 42 -11.263 -0.745 -4.544 333 1HB SER 42 HB2 SER 42 -9.601 -0.203 -6.259 334 2HB SER 42 HB1 SER 42 -9.824 -1.785 -7.000 335 HG SER 42 HG SER 42 -12.216 -0.798 -6.785 336 H ASN 43 HN ASN 43 -10.494 -4.007 -5.709 337 HA ASN 43 HA ASN 43 -12.916 -4.701 -6.911 338 1HB ASN 43 HB2 ASN 43 -11.056 -6.381 -5.216 339 2HB ASN 43 HB1 ASN 43 -12.413 -7.054 -6.124 340 1HD2 ASN 43 HD22 ASN 43 -9.234 -7.034 -8.219 341 2HD2 ASN 43 HD21 ASN 43 -9.541 -7.578 -6.641 342 H VAL 44 HN VAL 44 -12.277 -4.307 -3.468 343 HA VAL 44 HA VAL 44 -15.030 -5.341 -2.856 344 HB VAL 44 HB VAL 44 -14.141 -5.348 -0.471 345 1HG1 VAL 44 HG12 VAL 44 -14.305 -7.375 -1.909 346 2HG1 VAL 44 HG11 VAL 44 -12.680 -7.055 -2.512 347 3HG1 VAL 44 HG13 VAL 44 -12.926 -7.451 -0.811 348 1HG2 VAL 44 HG23 VAL 44 -12.212 -3.757 -1.159 349 2HG2 VAL 44 HG22 VAL 44 -11.814 -5.098 -0.087 350 3HG2 VAL 44 HG21 VAL 44 -11.430 -5.201 -1.805 351 H THR 45 HN THR 45 -13.855 -2.447 -3.655 352 HA THR 45 HA THR 45 -15.767 -1.075 -1.868 353 HB THR 45 HB THR 45 -13.966 0.774 -1.554 354 HG1 THR 45 HG1 THR 45 -12.526 -0.267 -3.055 355 1HG2 THR 45 HG21 THR 45 -14.814 -0.640 0.278 356 2HG2 THR 45 HG23 THR 45 -13.658 -1.899 -0.161 357 3HG2 THR 45 HG22 THR 45 -13.084 -0.348 0.445 358 HA PRO 46 HA PRO 46 -16.545 1.107 -5.669 359 1HB PRO 46 HB2 PRO 46 -17.429 3.567 -4.609 360 2HB PRO 46 HB1 PRO 46 -18.444 2.144 -4.870 361 1HG PRO 46 HG2 PRO 46 -17.377 3.222 -2.324 362 2HG PRO 46 HG1 PRO 46 -18.760 2.148 -2.589 363 1HD PRO 46 HD2 PRO 46 -16.233 1.358 -1.585 364 2HD PRO 46 HD1 PRO 46 -17.496 0.275 -2.211 365 H LEU 47 HN LEU 47 -14.000 1.670 -3.724 366 HA LEU 47 HA LEU 47 -13.145 4.309 -4.566 367 1HB LEU 47 HB2 LEU 47 -11.582 1.974 -3.423 368 2HB LEU 47 HB1 LEU 47 -10.918 3.587 -3.671 369 HG LEU 47 HG LEU 47 -13.332 2.983 -1.929 370 1HD1 LEU 47 HD12 LEU 47 -11.202 1.973 -1.095 371 2HD1 LEU 47 HD11 LEU 47 -10.473 3.579 -1.111 372 3HD1 LEU 47 HD13 LEU 47 -11.827 3.237 -0.033 373 1HD2 LEU 47 HD21 LEU 47 -11.757 5.474 -2.594 374 2HD2 LEU 47 HD23 LEU 47 -13.505 5.258 -2.497 375 3HD2 LEU 47 HD22 LEU 47 -12.546 5.329 -1.022 376 H THR 48 HN THR 48 -11.679 4.852 -6.197 377 HA THR 48 HA THR 48 -10.861 2.661 -8.083 378 HB THR 48 HB THR 48 -11.247 4.315 -9.940 379 HG1 THR 48 HG1 THR 48 -12.933 5.743 -8.257 380 1HG2 THR 48 HG22 THR 48 -12.911 2.549 -9.362 381 2HG2 THR 48 HG21 THR 48 -13.715 3.699 -8.293 382 3HG2 THR 48 HG23 THR 48 -13.660 3.998 -10.030 383 H PHE 49 HN PHE 49 -8.786 2.903 -8.911 384 HA PHE 49 HA PHE 49 -7.213 5.287 -7.966 385 1HB PHE 49 HB2 PHE 49 -6.265 2.424 -8.298 386 2HB PHE 49 HB1 PHE 49 -5.271 3.791 -7.795 387 HD1 PHE 49 HD2 PHE 49 -5.545 4.819 -5.593 388 HD2 PHE 49 HD1 PHE 49 -7.934 1.456 -6.795 389 HE1 PHE 49 HE2 PHE 49 -6.238 4.468 -3.238 390 HE2 PHE 49 HE1 PHE 49 -8.628 1.107 -4.437 391 HZ PHE 49 HZ PHE 49 -7.780 2.614 -2.661 392 H THR 50 HN THR 50 -6.299 6.412 -9.596 393 HA THR 50 HA THR 50 -5.955 5.077 -12.268 394 HB THR 50 HB THR 50 -6.644 7.975 -11.685 395 HG1 THR 50 HG1 THR 50 -8.249 6.121 -11.519 396 1HG2 THR 50 HG22 THR 50 -5.945 6.454 -14.185 397 2HG2 THR 50 HG21 THR 50 -7.088 7.791 -14.276 398 3HG2 THR 50 HG23 THR 50 -5.449 8.073 -13.691 399 H LYS 51 HN LYS 51 -3.889 5.110 -13.036 400 HA LYS 51 HA LYS 51 -1.800 6.398 -11.450 401 1HB LYS 51 HB2 LYS 51 -1.548 4.182 -12.681 402 2HB LYS 51 HB1 LYS 51 -1.508 5.115 -14.177 403 1HG LYS 51 HG2 LYS 51 0.425 6.397 -13.334 404 2HG LYS 51 HG1 LYS 51 0.388 5.462 -11.837 405 1HD LYS 51 HD2 LYS 51 0.784 3.390 -13.115 406 2HD LYS 51 HD1 LYS 51 0.824 4.321 -14.613 407 1HE LYS 51 HE2 LYS 51 2.698 4.757 -12.270 408 2HE LYS 51 HE1 LYS 51 3.107 3.848 -13.725 409 1HZ LYS 51 HZ3 LYS 51 2.320 5.986 -14.916 410 2HZ LYS 51 HZ2 LYS 51 2.607 6.731 -13.414 411 3HZ LYS 51 HZ1 LYS 51 3.872 5.941 -14.232 412 H VAL 52 HN VAL 52 -0.807 8.357 -11.920 413 HA VAL 52 HA VAL 52 -1.648 9.759 -14.451 414 HB VAL 52 HB VAL 52 -1.513 11.871 -13.170 415 1HG1 VAL 52 HG12 VAL 52 -3.335 9.718 -12.064 416 2HG1 VAL 52 HG11 VAL 52 -3.522 11.435 -11.701 417 3HG1 VAL 52 HG13 VAL 52 -3.692 10.861 -13.359 418 1HG2 VAL 52 HG23 VAL 52 -0.862 9.959 -10.917 419 2HG2 VAL 52 HG22 VAL 52 0.047 11.377 -11.441 420 3HG2 VAL 52 HG21 VAL 52 -1.498 11.577 -10.614 421 H SER 53 HN SER 53 -0.007 10.518 -15.686 422 HA SER 53 HA SER 53 2.769 10.089 -14.727 423 1HB SER 53 HB2 SER 53 1.982 9.311 -17.005 424 2HB SER 53 HB1 SER 53 1.834 11.009 -17.459 425 HG SER 53 HG SER 53 4.087 11.192 -16.825 426 H GLU 54 HN GLU 54 0.519 12.648 -14.931 427 HA GLU 54 HA GLU 54 2.658 14.584 -14.317 428 1HB GLU 54 HB2 GLU 54 1.642 16.198 -15.950 429 2HB GLU 54 HB1 GLU 54 2.497 14.857 -16.691 430 1HG GLU 54 HG2 GLU 54 0.314 13.674 -16.962 431 2HG GLU 54 HG1 GLU 54 -0.500 15.095 -16.305 432 H GLY 55 HN GLY 55 1.747 16.642 -13.547 433 1HA GLY 55 HA2 GLY 55 0.019 17.956 -12.527 434 2HA GLY 55 HA1 GLY 55 -1.088 16.594 -12.684 435 H GLN 56 HN GLN 56 -1.458 17.325 -10.321 436 HA GLN 56 HA GLN 56 0.632 16.477 -8.418 437 1HB GLN 56 HB2 GLN 56 -0.864 18.474 -8.027 438 2HB GLN 56 HB1 GLN 56 -2.219 17.360 -7.857 439 1HG GLN 56 HG2 GLN 56 -1.475 17.769 -5.635 440 2HG GLN 56 HG1 GLN 56 -0.825 16.184 -6.047 441 1HE2 GLN 56 HE22 GLN 56 1.707 19.253 -5.275 442 2HE2 GLN 56 HE21 GLN 56 0.024 19.452 -5.194 443 H ALA 57 HN ALA 57 0.755 14.403 -7.646 444 HA ALA 57 HA ALA 57 -1.558 12.570 -8.127 445 1HB ALA 57 HB2 ALA 57 0.780 11.972 -8.938 446 2HB ALA 57 HB1 ALA 57 1.245 11.834 -7.241 447 3HB ALA 57 HB3 ALA 57 0.008 10.765 -7.908 448 H ASP 58 HN ASP 58 -2.742 11.856 -6.400 449 HA ASP 58 HA ASP 58 -2.459 13.019 -3.826 450 1HB ASP 58 HB2 ASP 58 -3.940 10.567 -4.787 451 2HB ASP 58 HB1 ASP 58 -4.023 11.120 -3.114 452 H ILE 59 HN ILE 59 -1.365 9.826 -5.022 453 HA ILE 59 HA ILE 59 0.227 9.548 -2.477 454 HB ILE 59 HB ILE 59 -0.916 7.367 -4.254 455 1HG1 ILE 59 HG12 ILE 59 -1.662 8.129 -1.416 456 2HG1 ILE 59 HG11 ILE 59 -2.557 8.676 -2.834 457 1HG2 ILE 59 HG23 ILE 59 1.228 6.749 -3.152 458 2HG2 ILE 59 HG22 ILE 59 0.539 7.206 -1.597 459 3HG2 ILE 59 HG21 ILE 59 -0.133 5.847 -2.491 460 1HD1 ILE 59 HD13 ILE 59 -2.065 5.776 -2.095 461 2HD1 ILE 59 HD12 ILE 59 -3.577 6.646 -1.836 462 3HD1 ILE 59 HD11 ILE 59 -3.002 6.347 -3.476 463 H MET 60 HN MET 60 2.357 9.860 -2.882 464 HA MET 60 HA MET 60 3.422 9.209 -5.602 465 1HB MET 60 HB2 MET 60 4.450 10.975 -3.374 466 2HB MET 60 HB1 MET 60 5.436 10.521 -4.764 467 1HG MET 60 HG2 MET 60 3.696 11.456 -6.275 468 2HG MET 60 HG1 MET 60 2.773 11.969 -4.861 469 1HE MET 60 HE2 MET 60 3.287 13.769 -6.991 470 2HE MET 60 HE1 MET 60 4.527 15.008 -6.810 471 3HE MET 60 HE3 MET 60 4.931 13.447 -7.537 472 H ILE 61 HN ILE 61 4.886 7.590 -5.856 473 HA ILE 61 HA ILE 61 5.843 6.158 -3.395 474 HB ILE 61 HB ILE 61 5.296 5.041 -6.161 475 1HG1 ILE 61 HG12 ILE 61 3.836 4.531 -3.551 476 2HG1 ILE 61 HG11 ILE 61 3.282 5.684 -4.765 477 1HG2 ILE 61 HG22 ILE 61 6.361 3.850 -3.600 478 2HG2 ILE 61 HG21 ILE 61 5.598 2.852 -4.836 479 3HG2 ILE 61 HG23 ILE 61 7.057 3.765 -5.216 480 1HD1 ILE 61 HD12 ILE 61 3.793 2.748 -5.324 481 2HD1 ILE 61 HD11 ILE 61 2.203 3.424 -4.969 482 3HD1 ILE 61 HD13 ILE 61 3.071 3.925 -6.422 483 H SER 62 HN SER 62 8.047 6.062 -3.158 484 HA SER 62 HA SER 62 9.765 6.322 -5.577 485 1HB SER 62 HB2 SER 62 11.081 8.116 -4.601 486 2HB SER 62 HB1 SER 62 9.395 8.621 -4.669 487 HG SER 62 HG SER 62 10.830 8.737 -2.593 488 H PHE 63 HN PHE 63 11.996 5.759 -5.154 489 HA PHE 63 HA PHE 63 12.306 3.851 -2.863 490 1HB PHE 63 HB2 PHE 63 13.442 3.944 -5.666 491 2HB PHE 63 HB1 PHE 63 14.152 2.929 -4.414 492 HD1 PHE 63 HD2 PHE 63 12.876 1.076 -3.407 493 HD2 PHE 63 HD1 PHE 63 11.257 3.438 -6.608 494 HE1 PHE 63 HE2 PHE 63 11.122 -0.637 -3.780 495 HE2 PHE 63 HE1 PHE 63 9.496 1.724 -6.978 496 HZ PHE 63 HZ PHE 63 9.434 -0.313 -5.566 497 H VAL 64 HN VAL 64 13.875 4.316 -1.369 498 HA VAL 64 HA VAL 64 15.974 6.349 -2.071 499 HB VAL 64 HB VAL 64 15.707 7.301 0.188 500 1HG1 VAL 64 HG13 VAL 64 13.213 7.148 -1.523 501 2HG1 VAL 64 HG12 VAL 64 13.407 8.282 -0.187 502 3HG1 VAL 64 HG11 VAL 64 14.475 8.378 -1.588 503 1HG2 VAL 64 HG23 VAL 64 13.416 5.316 0.348 504 2HG2 VAL 64 HG22 VAL 64 14.859 5.342 1.363 505 3HG2 VAL 64 HG21 VAL 64 13.667 6.636 1.492 506 H ARG 65 HN ARG 65 17.876 6.276 -0.609 507 HA ARG 65 HA ARG 65 18.377 3.516 0.477 508 1HB ARG 65 HB2 ARG 65 20.242 5.429 -0.955 509 2HB ARG 65 HB1 ARG 65 20.791 3.988 -0.101 510 1HG ARG 65 HG2 ARG 65 19.370 2.584 -1.536 511 2HG ARG 65 HG1 ARG 65 18.812 4.022 -2.394 512 1HD ARG 65 HD2 ARG 65 21.188 4.507 -3.019 513 2HD ARG 65 HD1 ARG 65 21.654 2.979 -2.269 514 HE ARG 65 HE ARG 65 19.690 2.237 -4.063 515 1HH1 ARG 65 HH21 ARG 65 22.607 4.073 -4.178 516 2HH1 ARG 65 HH22 ARG 65 22.960 3.657 -5.823 517 1HH2 ARG 65 HH11 ARG 65 20.134 1.685 -6.209 518 2HH2 ARG 65 HH12 ARG 65 21.560 2.306 -6.972 519 H GLY 66 HN GLY 66 19.357 3.369 2.467 520 1HA GLY 66 HA2 GLY 66 19.836 4.059 4.661 521 2HA GLY 66 HA1 GLY 66 20.947 5.155 3.848 522 H ASP 67 HN ASP 67 20.646 6.859 5.287 523 HA ASP 67 HA ASP 67 18.065 7.827 6.116 524 1HB ASP 67 HB2 ASP 67 20.209 8.267 7.337 525 2HB ASP 67 HB1 ASP 67 20.693 9.336 6.021 526 H HIS 68 HN HIS 68 16.674 9.120 5.041 527 HA HIS 68 HA HIS 68 17.658 10.711 2.698 528 1HB HIS 68 HB2 HIS 68 15.377 10.152 1.663 529 2HB HIS 68 HB1 HIS 68 16.565 8.849 1.701 530 HD1 HIS 68 HD1 HIS 68 16.360 7.396 4.128 531 HD2 HIS 68 HD2 HIS 68 12.954 9.275 2.635 532 HE1 HIS 68 HE1 HIS 68 14.379 6.266 5.230 533 H ARG 69 HN ARG 69 17.472 11.961 5.076 534 HA ARG 69 HA ARG 69 16.409 13.708 6.224 535 1HB ARG 69 HB2 ARG 69 15.165 14.009 3.475 536 2HB ARG 69 HB1 ARG 69 14.921 15.162 4.784 537 1HG ARG 69 HG2 ARG 69 17.357 15.520 4.929 538 2HG ARG 69 HG1 ARG 69 17.599 14.376 3.610 539 1HD ARG 69 HD2 ARG 69 15.990 16.940 3.422 540 2HD ARG 69 HD1 ARG 69 17.617 16.716 2.792 541 HE ARG 69 HE ARG 69 16.128 14.674 1.618 542 1HH1 ARG 69 HH21 ARG 69 15.946 18.110 1.887 543 2HH1 ARG 69 HH22 ARG 69 15.164 18.320 0.355 544 1HH2 ARG 69 HH11 ARG 69 15.110 14.932 -0.385 545 2HH2 ARG 69 HH12 ARG 69 14.692 16.523 -0.930 546 H ASP 70 HN ASP 70 15.323 11.404 7.023 547 HA ASP 70 HA ASP 70 12.424 12.066 7.261 548 1HB ASP 70 HB2 ASP 70 11.802 9.716 6.892 549 2HB ASP 70 HB1 ASP 70 12.616 10.369 5.469 550 H ASN 71 HN ASN 71 11.439 10.631 9.060 551 HA ASN 71 HA ASN 71 13.316 10.684 11.348 552 1HB ASN 71 HB2 ASN 71 10.329 10.220 11.138 553 2HB ASN 71 HB1 ASN 71 11.219 10.134 12.657 554 1HD2 ASN 71 HD22 ASN 71 9.926 13.645 12.155 555 2HD2 ASN 71 HD21 ASN 71 9.174 12.122 12.179 556 H SER 72 HN SER 72 12.872 8.514 9.024 557 HA SER 72 HA SER 72 13.306 6.196 10.869 558 1HB SER 72 HB2 SER 72 10.969 6.130 10.022 559 2HB SER 72 HB1 SER 72 11.585 6.163 8.371 560 HG SER 72 HG SER 72 12.159 4.135 8.550 561 HA PRO 73 HA PRO 73 16.462 6.644 7.446 562 1HB PRO 73 HB2 PRO 73 18.603 6.346 9.327 563 2HB PRO 73 HB1 PRO 73 18.122 7.829 8.494 564 1HG PRO 73 HG2 PRO 73 17.748 7.154 11.303 565 2HG PRO 73 HG1 PRO 73 17.393 8.685 10.489 566 1HD PRO 73 HD2 PRO 73 15.500 6.691 11.393 567 2HD PRO 73 HD1 PRO 73 15.153 8.221 10.556 568 H PHE 74 HN PHE 74 16.919 4.717 6.443 569 HA PHE 74 HA PHE 74 16.534 2.206 7.847 570 1HB PHE 74 HB2 PHE 74 17.697 2.747 5.094 571 2HB PHE 74 HB1 PHE 74 17.163 1.179 5.697 572 HD1 PHE 74 HD1 PHE 74 14.715 0.943 6.455 573 HD2 PHE 74 HD2 PHE 74 16.150 4.236 4.099 574 HE1 PHE 74 HE1 PHE 74 12.392 1.448 5.748 575 HE2 PHE 74 HE2 PHE 74 13.826 4.741 3.393 576 HZ PHE 74 HZ PHE 74 11.948 3.347 4.217 577 H ASP 75 HN ASP 75 18.102 0.770 8.568 578 HA ASP 75 HA ASP 75 20.972 1.492 8.163 579 1HB ASP 75 HB2 ASP 75 20.209 2.455 10.347 580 2HB ASP 75 HB1 ASP 75 19.755 0.831 10.864 581 H GLY 76 HN GLY 76 20.771 -0.372 6.704 582 1HA GLY 76 HA2 GLY 76 21.429 -2.607 6.331 583 2HA GLY 76 HA1 GLY 76 21.487 -2.846 8.078 584 HA PRO 77 HA PRO 77 17.694 -4.905 6.166 585 1HB PRO 77 HB2 PRO 77 18.417 -7.372 7.474 586 2HB PRO 77 HB1 PRO 77 18.417 -7.036 5.738 587 1HG PRO 77 HG2 PRO 77 20.714 -7.324 7.503 588 2HG PRO 77 HG1 PRO 77 20.709 -7.087 5.748 589 1HD PRO 77 HD2 PRO 77 21.424 -5.156 7.766 590 2HD PRO 77 HD1 PRO 77 21.349 -4.905 6.011 591 H GLY 78 HN GLY 78 18.942 -3.932 9.068 592 1HA GLY 78 HA2 GLY 78 16.869 -5.150 10.795 593 2HA GLY 78 HA1 GLY 78 18.150 -4.053 11.324 594 H GLY 79 HN GLY 79 15.624 -3.523 12.234 595 1HA GLY 79 HA2 GLY 79 14.264 -1.601 12.455 596 2HA GLY 79 HA1 GLY 79 15.152 -0.873 11.114 597 H ASN 80 HN ASN 80 12.750 -0.260 10.669 598 HA ASN 80 HA ASN 80 11.005 -2.313 9.612 599 1HB ASN 80 HB2 ASN 80 11.030 0.704 9.296 600 2HB ASN 80 HB1 ASN 80 9.746 -0.339 8.673 601 1HD2 ASN 80 HD22 ASN 80 9.032 0.869 12.240 602 2HD2 ASN 80 HD21 ASN 80 9.581 1.716 10.875 603 H LEU 81 HN LEU 81 10.451 -2.579 7.320 604 HA LEU 81 HA LEU 81 12.842 -2.312 5.593 605 1HB LEU 81 HB2 LEU 81 10.171 -3.569 4.914 606 2HB LEU 81 HB1 LEU 81 11.720 -3.838 4.114 607 HG LEU 81 HG LEU 81 11.021 -4.613 6.964 608 1HD1 LEU 81 HD13 LEU 81 10.032 -6.020 5.147 609 2HD1 LEU 81 HD12 LEU 81 11.661 -6.323 4.542 610 3HD1 LEU 81 HD11 LEU 81 11.194 -6.900 6.142 611 1HD2 LEU 81 HD23 LEU 81 13.590 -4.718 5.378 612 2HD2 LEU 81 HD22 LEU 81 13.335 -4.085 7.004 613 3HD2 LEU 81 HD21 LEU 81 13.302 -5.824 6.718 614 H ALA 82 HN ALA 82 10.011 -0.575 6.247 615 HA ALA 82 HA ALA 82 10.539 1.411 4.250 616 1HB ALA 82 HB3 ALA 82 9.567 -0.393 2.772 617 2HB ALA 82 HB2 ALA 82 8.077 -0.274 3.703 618 3HB ALA 82 HB1 ALA 82 8.645 1.107 2.766 619 H HIS 83 HN HIS 83 8.376 2.871 4.084 620 HA HIS 83 HA HIS 83 6.593 2.706 6.366 621 1HB HIS 83 HB2 HIS 83 7.389 4.766 7.504 622 2HB HIS 83 HB1 HIS 83 8.589 3.473 7.564 623 HD1 HIS 83 HD1 HIS 83 10.834 3.920 6.480 624 HD2 HIS 83 HD2 HIS 83 8.013 6.827 5.511 625 HE1 HIS 83 HE1 HIS 83 12.085 5.751 5.262 626 H ALA 84 HN ALA 84 5.255 4.803 6.501 627 HA ALA 84 HA ALA 84 5.221 6.329 3.952 628 1HB ALA 84 HB1 ALA 84 2.890 4.711 5.020 629 2HB ALA 84 HB3 ALA 84 2.747 5.933 3.758 630 3HB ALA 84 HB2 ALA 84 3.717 4.487 3.479 631 H PHE 85 HN PHE 85 3.826 8.243 4.108 632 HA PHE 85 HA PHE 85 3.843 9.335 6.867 633 1HB PHE 85 HB2 PHE 85 3.467 10.600 4.140 634 2HB PHE 85 HB1 PHE 85 3.345 11.495 5.654 635 HD1 PHE 85 HD2 PHE 85 5.619 9.678 3.393 636 HD2 PHE 85 HD1 PHE 85 5.293 11.904 7.051 637 HE1 PHE 85 HE2 PHE 85 8.087 9.891 3.483 638 HE2 PHE 85 HE1 PHE 85 7.762 12.114 7.143 639 HZ PHE 85 HZ PHE 85 9.159 11.109 5.359 640 H GLN 86 HN GLN 86 1.913 10.743 7.455 641 HA GLN 86 HA GLN 86 -0.457 9.184 7.433 642 1HB GLN 86 HB2 GLN 86 -0.104 12.148 7.965 643 2HB GLN 86 HB1 GLN 86 -1.543 11.214 8.379 644 1HG GLN 86 HG2 GLN 86 -0.303 9.840 9.921 645 2HG GLN 86 HG1 GLN 86 1.233 10.515 9.372 646 1HE2 GLN 86 HE22 GLN 86 0.976 12.746 12.110 647 2HE2 GLN 86 HE21 GLN 86 1.836 11.460 11.411 648 HA PRO 87 HA PRO 87 -2.125 10.203 3.423 649 1HB PRO 87 HB2 PRO 87 -4.885 10.252 4.213 650 2HB PRO 87 HB1 PRO 87 -4.005 8.890 3.508 651 1HG PRO 87 HG2 PRO 87 -4.846 9.273 6.300 652 2HG PRO 87 HG1 PRO 87 -4.244 7.803 5.515 653 1HD PRO 87 HD2 PRO 87 -2.811 9.414 7.369 654 2HD PRO 87 HD1 PRO 87 -2.134 8.126 6.345 655 H GLY 88 HN GLY 88 -1.561 12.388 3.052 656 1HA GLY 88 HA2 GLY 88 -3.627 14.360 3.436 657 2HA GLY 88 HA1 GLY 88 -2.310 14.617 4.578 658 HA PRO 89 HA PRO 89 -1.518 16.570 0.284 659 1HB PRO 89 HB2 PRO 89 -1.269 19.149 1.549 660 2HB PRO 89 HB1 PRO 89 -2.530 18.618 0.427 661 1HG PRO 89 HG2 PRO 89 -2.715 18.984 3.333 662 2HG PRO 89 HG1 PRO 89 -4.018 18.698 2.170 663 1HD PRO 89 HD2 PRO 89 -3.018 16.821 4.063 664 2HD PRO 89 HD1 PRO 89 -4.118 16.474 2.715 665 H GLY 90 HN GLY 90 0.493 18.223 0.037 666 1HA GLY 90 HA2 GLY 90 2.797 18.525 0.336 667 2HA GLY 90 HA1 GLY 90 2.509 18.268 2.058 668 H ILE 91 HN ILE 91 3.780 16.651 2.787 669 HA ILE 91 HA ILE 91 4.665 14.512 0.970 670 HB ILE 91 HB ILE 91 6.217 15.602 2.597 671 1HG1 ILE 91 HG12 ILE 91 5.809 12.666 3.227 672 2HG1 ILE 91 HG11 ILE 91 6.502 13.236 1.708 673 1HG2 ILE 91 HG23 ILE 91 4.334 15.680 4.393 674 2HG2 ILE 91 HG22 ILE 91 4.823 14.027 4.761 675 3HG2 ILE 91 HG21 ILE 91 5.981 15.346 4.924 676 1HD1 ILE 91 HD12 ILE 91 8.270 14.423 2.973 677 2HD1 ILE 91 HD11 ILE 91 7.586 13.811 4.481 678 3HD1 ILE 91 HD13 ILE 91 8.285 12.691 3.311 679 H GLY 92 HN GLY 92 2.046 15.000 3.068 680 1HA GLY 92 HA2 GLY 92 1.720 12.456 4.276 681 2HA GLY 92 HA1 GLY 92 0.390 13.528 3.842 682 H GLY 93 HN GLY 93 0.929 10.505 3.535 683 1HA GLY 93 HA2 GLY 93 -0.153 9.006 2.027 684 2HA GLY 93 HA1 GLY 93 -0.279 10.308 0.847 685 H ASP 94 HN ASP 94 2.725 10.846 1.391 686 HA ASP 94 HA ASP 94 3.717 9.369 -0.843 687 1HB ASP 94 HB2 ASP 94 5.159 10.812 1.397 688 2HB ASP 94 HB1 ASP 94 5.988 10.100 0.011 689 H ALA 95 HN ALA 95 5.318 7.644 -0.853 690 HA ALA 95 HA ALA 95 5.498 6.037 1.659 691 1HB ALA 95 HB3 ALA 95 4.459 5.127 -1.027 692 2HB ALA 95 HB2 ALA 95 5.108 3.986 0.150 693 3HB ALA 95 HB1 ALA 95 3.690 4.958 0.551 694 H HIS 96 HN HIS 96 7.599 5.549 2.009 695 HA HIS 96 HA HIS 96 9.498 5.571 -0.312 696 1HB HIS 96 HB2 HIS 96 10.003 5.931 2.657 697 2HB HIS 96 HB1 HIS 96 11.244 5.959 1.403 698 HD2 HIS 96 HD2 HIS 96 8.463 7.965 -0.237 699 HE1 HIS 96 HE1 HIS 96 10.614 10.623 2.297 700 HE2 HIS 96 HE2 HIS 96 8.931 10.459 0.408 701 H PHE 97 HN PHE 97 10.669 3.761 -0.777 702 HA PHE 97 HA PHE 97 10.258 1.336 0.952 703 1HB PHE 97 HB2 PHE 97 10.699 1.693 -2.017 704 2HB PHE 97 HB1 PHE 97 10.982 0.140 -1.231 705 HD1 PHE 97 HD1 PHE 97 8.414 2.761 -1.864 706 HD2 PHE 97 HD2 PHE 97 9.177 -1.265 -0.581 707 HE1 PHE 97 HE1 PHE 97 5.982 2.275 -1.932 708 HE2 PHE 97 HE2 PHE 97 6.748 -1.750 -0.651 709 HZ PHE 97 HZ PHE 97 5.149 0.021 -1.327 710 H ASP 98 HN ASP 98 12.059 0.190 1.654 711 HA ASP 98 HA ASP 98 14.608 1.537 1.770 712 1HB ASP 98 HB2 ASP 98 13.819 -0.091 3.489 713 2HB ASP 98 HB1 ASP 98 13.960 -1.388 2.300 714 H GLU 99 HN GLU 99 15.506 1.896 -0.254 715 HA GLU 99 HA GLU 99 15.524 -0.152 -2.322 716 1HB GLU 99 HB2 GLU 99 15.505 2.368 -2.666 717 2HB GLU 99 HB1 GLU 99 17.200 2.353 -2.224 718 1HG GLU 99 HG2 GLU 99 17.727 0.840 -4.063 719 2HG GLU 99 HG1 GLU 99 16.018 0.708 -4.475 720 H ASP 100 HN ASP 100 17.442 0.321 0.446 721 HA ASP 100 HA ASP 100 19.983 -0.552 -0.697 722 1HB ASP 100 HB2 ASP 100 18.971 -0.406 2.156 723 2HB ASP 100 HB1 ASP 100 20.597 -0.933 1.734 724 H GLU 101 HN GLU 101 17.127 -2.100 0.525 725 HA GLU 101 HA GLU 101 18.442 -4.724 0.815 726 1HB GLU 101 HB2 GLU 101 15.573 -3.797 1.087 727 2HB GLU 101 HB1 GLU 101 16.080 -5.476 1.302 728 1HG GLU 101 HG2 GLU 101 17.635 -4.786 3.085 729 2HG GLU 101 HG1 GLU 101 17.142 -3.107 2.870 730 H ARG 102 HN ARG 102 17.501 -6.613 -0.406 731 HA ARG 102 HA ARG 102 17.201 -5.870 -3.266 732 1HB ARG 102 HB2 ARG 102 18.845 -7.625 -2.542 733 2HB ARG 102 HB1 ARG 102 17.488 -8.617 -2.009 734 1HG ARG 102 HG2 ARG 102 16.600 -8.738 -4.251 735 2HG ARG 102 HG1 ARG 102 17.776 -7.555 -4.828 736 1HD ARG 102 HD2 ARG 102 18.537 -9.773 -5.460 737 2HD ARG 102 HD1 ARG 102 19.604 -9.149 -4.203 738 HE ARG 102 HE ARG 102 17.714 -10.564 -2.777 739 1HH1 ARG 102 HH21 ARG 102 19.753 -11.191 -5.487 740 2HH1 ARG 102 HH22 ARG 102 19.934 -12.875 -5.129 741 1HH2 ARG 102 HH11 ARG 102 17.942 -12.763 -2.298 742 2HH2 ARG 102 HH12 ARG 102 18.911 -13.763 -3.326 743 H TRP 103 HN TRP 103 15.172 -5.690 -4.082 744 HA TRP 103 HA TRP 103 12.899 -6.983 -2.674 745 1HB TRP 103 HB2 TRP 103 13.065 -4.963 -4.924 746 2HB TRP 103 HB1 TRP 103 11.544 -5.673 -4.377 747 HD1 TRP 103 HD1 TRP 103 13.671 -2.792 -3.776 748 HE1 TRP 103 HE1 TRP 103 13.135 -1.681 -1.511 749 HE3 TRP 103 HE3 TRP 103 10.861 -6.476 -1.625 750 HZ2 TRP 103 HZ2 TRP 103 11.698 -2.274 0.890 751 HZ3 TRP 103 HZ3 TRP 103 9.918 -6.174 0.647 752 HH2 TRP 103 HH2 TRP 103 10.336 -4.079 1.908 753 H THR 104 HN THR 104 11.792 -8.712 -3.524 754 HA THR 104 HA THR 104 12.474 -9.608 -6.306 755 HB THR 104 HB THR 104 12.445 -11.941 -5.477 756 HG1 THR 104 HG1 THR 104 11.202 -11.680 -3.640 757 1HG2 THR 104 HG22 THR 104 14.389 -10.099 -4.068 758 2HG2 THR 104 HG21 THR 104 14.609 -11.839 -4.265 759 3HG2 THR 104 HG23 THR 104 14.586 -10.787 -5.680 760 H ASN 105 HN ASN 105 10.822 -11.124 -7.174 761 HA ASN 105 HA ASN 105 8.077 -10.488 -6.125 762 1HB ASN 105 HB2 ASN 105 9.068 -10.984 -8.950 763 2HB ASN 105 HB1 ASN 105 7.361 -10.896 -8.512 764 1HD2 ASN 105 HD22 ASN 105 8.592 -7.476 -9.542 765 2HD2 ASN 105 HD21 ASN 105 8.616 -8.994 -10.300 766 H ASN 106 HN ASN 106 9.812 -12.745 -5.305 767 HA ASN 106 HA ASN 106 7.925 -14.936 -6.004 768 1HB ASN 106 HB2 ASN 106 10.067 -16.400 -6.337 769 2HB ASN 106 HB1 ASN 106 9.528 -15.364 -7.657 770 1HD2 ASN 106 HD22 ASN 106 12.791 -14.017 -7.704 771 2HD2 ASN 106 HD21 ASN 106 11.599 -14.875 -8.555 772 H PHE 107 HN PHE 107 9.423 -17.015 -4.793 773 HA PHE 107 HA PHE 107 8.842 -16.490 -2.002 774 1HB PHE 107 HB2 PHE 107 9.607 -18.797 -1.636 775 2HB PHE 107 HB1 PHE 107 8.531 -18.725 -3.032 776 HD1 PHE 107 HD2 PHE 107 12.030 -19.118 -1.922 777 HD2 PHE 107 HD1 PHE 107 9.372 -19.039 -5.296 778 HE1 PHE 107 HE2 PHE 107 13.819 -20.067 -3.353 779 HE2 PHE 107 HE1 PHE 107 11.161 -19.987 -6.727 780 HZ PHE 107 HZ PHE 107 13.385 -20.500 -5.757 781 H ARG 108 HN ARG 108 11.388 -15.399 -3.729 782 HA ARG 108 HA ARG 108 13.687 -16.191 -2.283 783 1HB ARG 108 HB2 ARG 108 13.016 -13.621 -3.719 784 2HB ARG 108 HB1 ARG 108 14.590 -13.896 -2.979 785 1HG ARG 108 HG2 ARG 108 14.872 -15.940 -4.312 786 2HG ARG 108 HG1 ARG 108 13.311 -15.673 -5.072 787 1HD ARG 108 HD2 ARG 108 14.125 -13.492 -5.929 788 2HD ARG 108 HD1 ARG 108 15.702 -13.800 -5.215 789 HE ARG 108 HE ARG 108 14.727 -14.762 -7.751 790 1HH1 ARG 108 HH21 ARG 108 16.501 -15.838 -4.984 791 2HH1 ARG 108 HH22 ARG 108 17.186 -17.200 -5.805 792 1HH2 ARG 108 HH11 ARG 108 15.625 -16.512 -8.818 793 2HH2 ARG 108 HH12 ARG 108 16.696 -17.578 -7.969 794 H GLU 109 HN GLU 109 14.775 -13.814 -1.242 795 HA GLU 109 HA GLU 109 14.170 -13.984 1.451 796 1HB GLU 109 HB2 GLU 109 15.226 -11.655 -0.153 797 2HB GLU 109 HB1 GLU 109 15.180 -11.666 1.613 798 1HG GLU 109 HG2 GLU 109 16.527 -13.732 1.636 799 2HG GLU 109 HG1 GLU 109 16.583 -13.717 -0.126 800 H TYR 110 HN TYR 110 12.958 -11.246 -0.597 801 HA TYR 110 HA TYR 110 10.568 -11.151 1.233 802 1HB TYR 110 HB2 TYR 110 12.163 -8.765 0.257 803 2HB TYR 110 HB1 TYR 110 10.693 -8.701 1.230 804 HD1 TYR 110 HD2 TYR 110 10.693 -9.734 3.545 805 HD2 TYR 110 HD1 TYR 110 14.279 -9.164 1.249 806 HE1 TYR 110 HE2 TYR 110 12.050 -9.987 5.603 807 HE2 TYR 110 HE1 TYR 110 15.639 -9.418 3.310 808 HH TYR 110 HH TYR 110 14.808 -10.802 5.898 809 H ASN 111 HN ASN 111 8.657 -10.417 0.319 810 HA ASN 111 HA ASN 111 8.592 -10.340 -2.674 811 1HB ASN 111 HB2 ASN 111 6.344 -10.763 -0.682 812 2HB ASN 111 HB1 ASN 111 6.213 -10.889 -2.435 813 1HD2 ASN 111 HD22 ASN 111 8.863 -13.715 -1.399 814 2HD2 ASN 111 HD21 ASN 111 9.241 -12.062 -1.441 815 H LEU 112 HN LEU 112 8.509 -8.279 -3.456 816 HA LEU 112 HA LEU 112 8.035 -5.968 -1.885 817 1HB LEU 112 HB2 LEU 112 9.220 -5.902 -4.037 818 2HB LEU 112 HB1 LEU 112 7.724 -6.309 -4.878 819 HG LEU 112 HG LEU 112 6.683 -4.215 -4.071 820 1HD1 LEU 112 HD13 LEU 112 9.313 -3.978 -2.614 821 2HD1 LEU 112 HD12 LEU 112 8.443 -2.518 -3.093 822 3HD1 LEU 112 HD11 LEU 112 7.680 -3.684 -2.016 823 1HD2 LEU 112 HD21 LEU 112 9.371 -3.934 -5.446 824 2HD2 LEU 112 HD23 LEU 112 7.794 -4.124 -6.211 825 3HD2 LEU 112 HD22 LEU 112 8.180 -2.637 -5.347 826 H HIS 113 HN HIS 113 5.751 -7.781 -3.960 827 HA HIS 113 HA HIS 113 3.628 -5.913 -3.757 828 1HB HIS 113 HB2 HIS 113 3.586 -7.816 -5.330 829 2HB HIS 113 HB1 HIS 113 3.399 -8.926 -3.972 830 HD1 HIS 113 HD1 HIS 113 1.264 -8.013 -2.287 831 HD2 HIS 113 HD2 HIS 113 1.115 -7.179 -6.368 832 HE1 HIS 113 HE1 HIS 113 -1.156 -7.490 -2.822 833 H ARG 114 HN ARG 114 4.390 -8.694 -1.627 834 HA ARG 114 HA ARG 114 2.138 -8.351 0.077 835 1HB ARG 114 HB2 ARG 114 4.893 -9.461 0.653 836 2HB ARG 114 HB1 ARG 114 3.571 -9.502 1.819 837 1HG ARG 114 HG2 ARG 114 2.187 -10.746 0.201 838 2HG ARG 114 HG1 ARG 114 3.516 -10.729 -0.954 839 1HD ARG 114 HD2 ARG 114 4.927 -11.911 0.736 840 2HD ARG 114 HD1 ARG 114 3.528 -12.028 1.790 841 HE ARG 114 HE ARG 114 4.176 -13.737 -0.453 842 1HH1 ARG 114 HH21 ARG 114 1.514 -12.161 1.071 843 2HH1 ARG 114 HH22 ARG 114 0.323 -13.160 0.306 844 1HH2 ARG 114 HH11 ARG 114 2.645 -15.047 -1.447 845 2HH2 ARG 114 HH12 ARG 114 0.963 -14.794 -1.118 846 H VAL 115 HN VAL 115 5.395 -6.893 0.242 847 HA VAL 115 HA VAL 115 4.808 -5.429 2.675 848 HB VAL 115 HB VAL 115 6.913 -5.007 0.532 849 1HG1 VAL 115 HG13 VAL 115 6.504 -3.670 3.220 850 2HG1 VAL 115 HG12 VAL 115 8.030 -3.627 2.339 851 3HG1 VAL 115 HG11 VAL 115 6.590 -2.891 1.639 852 1HG2 VAL 115 HG22 VAL 115 6.869 -6.383 3.223 853 2HG2 VAL 115 HG21 VAL 115 7.320 -7.066 1.661 854 3HG2 VAL 115 HG23 VAL 115 8.374 -5.893 2.449 855 H ALA 116 HN ALA 116 4.666 -4.687 -0.795 856 HA ALA 116 HA ALA 116 4.057 -1.922 -0.582 857 1HB ALA 116 HB2 ALA 116 4.549 -3.238 -2.709 858 2HB ALA 116 HB1 ALA 116 2.880 -3.803 -2.640 859 3HB ALA 116 HB3 ALA 116 3.222 -2.083 -2.826 860 H ALA 117 HN ALA 117 1.859 -4.735 -0.760 861 HA ALA 117 HA ALA 117 -0.569 -3.305 -0.506 862 1HB ALA 117 HB3 ALA 117 0.163 -6.071 0.496 863 2HB ALA 117 HB2 ALA 117 -1.483 -5.439 0.435 864 3HB ALA 117 HB1 ALA 117 -0.571 -5.674 -1.059 865 H HIS 118 HN HIS 118 1.677 -4.479 1.987 866 HA HIS 118 HA HIS 118 0.076 -3.863 4.256 867 1HB HIS 118 HB2 HIS 118 2.186 -5.168 4.350 868 2HB HIS 118 HB1 HIS 118 3.097 -3.705 3.975 869 HD1 HIS 118 HD1 HIS 118 1.202 -5.400 6.722 870 HD2 HIS 118 HD2 HIS 118 3.245 -1.816 6.128 871 HE1 HIS 118 HE1 HIS 118 1.507 -4.365 9.011 872 H GLU 119 HN GLU 119 2.429 -1.846 2.465 873 HA GLU 119 HA GLU 119 2.167 0.480 4.109 874 1HB GLU 119 HB2 GLU 119 2.898 0.168 1.184 875 2HB GLU 119 HB1 GLU 119 2.968 1.706 2.041 876 1HG GLU 119 HG2 GLU 119 4.539 0.732 3.674 877 2HG GLU 119 HG1 GLU 119 4.472 -0.811 2.818 878 H LEU 120 HN LEU 120 0.353 -0.633 1.257 879 HA LEU 120 HA LEU 120 -1.253 1.712 0.955 880 1HB LEU 120 HB2 LEU 120 -1.949 -1.176 0.328 881 2HB LEU 120 HB1 LEU 120 -2.835 0.233 -0.255 882 HG LEU 120 HG LEU 120 0.085 -0.352 -0.832 883 1HD1 LEU 120 HD13 LEU 120 -1.719 -1.840 -1.917 884 2HD1 LEU 120 HD12 LEU 120 -2.212 -0.392 -2.793 885 3HD1 LEU 120 HD11 LEU 120 -0.585 -1.037 -3.004 886 1HD2 LEU 120 HD21 LEU 120 -1.760 1.938 -1.479 887 2HD2 LEU 120 HD23 LEU 120 -0.060 1.974 -1.010 888 3HD2 LEU 120 HD22 LEU 120 -0.510 1.494 -2.642 889 H GLY 121 HN GLY 121 -1.626 -1.201 2.944 890 1HA GLY 121 HA2 GLY 121 -4.237 -0.741 3.904 891 2HA GLY 121 HA1 GLY 121 -2.978 -1.562 4.829 892 H HIS 122 HN HIS 122 -1.128 0.513 5.121 893 HA HIS 122 HA HIS 122 -2.285 2.008 7.293 894 1HB HIS 122 HB2 HIS 122 0.327 2.254 5.783 895 2HB HIS 122 HB1 HIS 122 -0.097 3.340 7.105 896 HD1 HIS 122 HD1 HIS 122 -0.787 2.029 9.425 897 HD2 HIS 122 HD2 HIS 122 1.479 -0.111 6.656 898 HE1 HIS 122 HE1 HIS 122 0.206 0.068 10.677 899 H SER 123 HN SER 123 -1.604 2.776 3.908 900 HA SER 123 HA SER 123 -2.144 5.568 4.010 901 1HB SER 123 HB2 SER 123 -2.569 3.563 1.776 902 2HB SER 123 HB1 SER 123 -2.703 5.306 1.571 903 HG SER 123 HG SER 123 -0.447 3.734 2.203 904 H LEU 124 HN LEU 124 -4.304 2.768 3.708 905 HA LEU 124 HA LEU 124 -6.669 4.447 3.318 906 1HB LEU 124 HB2 LEU 124 -6.426 1.507 4.028 907 2HB LEU 124 HB1 LEU 124 -7.912 2.320 3.543 908 HG LEU 124 HG LEU 124 -5.407 2.176 1.837 909 1HD1 LEU 124 HD11 LEU 124 -7.984 0.580 1.680 910 2HD1 LEU 124 HD13 LEU 124 -6.677 0.527 0.497 911 3HD1 LEU 124 HD12 LEU 124 -6.400 -0.051 2.140 912 1HD2 LEU 124 HD21 LEU 124 -8.161 3.357 1.472 913 2HD2 LEU 124 HD23 LEU 124 -6.593 4.040 1.048 914 3HD2 LEU 124 HD22 LEU 124 -7.285 2.756 0.067 915 H GLY 125 HN GLY 125 -4.737 3.906 5.948 916 1HA GLY 125 HA2 GLY 125 -5.129 4.725 8.148 917 2HA GLY 125 HA1 GLY 125 -6.848 4.855 7.769 918 H LEU 126 HN LEU 126 -5.522 1.798 6.941 919 HA LEU 126 HA LEU 126 -7.116 0.530 9.038 920 1HB LEU 126 HB2 LEU 126 -5.187 -0.650 7.015 921 2HB LEU 126 HB1 LEU 126 -6.234 -1.594 8.072 922 HG LEU 126 HG LEU 126 -7.248 0.481 6.104 923 1HD1 LEU 126 HD13 LEU 126 -6.840 -2.501 5.849 924 2HD1 LEU 126 HD12 LEU 126 -8.040 -1.651 4.877 925 3HD1 LEU 126 HD11 LEU 126 -6.338 -1.224 4.743 926 1HD2 LEU 126 HD22 LEU 126 -8.553 -1.493 7.980 927 2HD2 LEU 126 HD21 LEU 126 -8.955 0.201 7.698 928 3HD2 LEU 126 HD23 LEU 126 -9.380 -1.016 6.499 929 H SER 127 HN SER 127 -6.329 -0.569 10.854 930 HA SER 127 HA SER 127 -3.536 0.142 11.652 931 1HB SER 127 HB2 SER 127 -5.977 -0.693 13.243 932 2HB SER 127 HB1 SER 127 -4.377 -0.512 13.953 933 HG SER 127 HG SER 127 -4.903 1.630 12.469 934 H HIS 128 HN HIS 128 -2.456 -1.583 13.062 935 HA HIS 128 HA HIS 128 -2.196 -4.023 11.592 936 1HB HIS 128 HB2 HIS 128 -1.397 -3.331 14.439 937 2HB HIS 128 HB1 HIS 128 -0.918 -4.813 13.609 938 HD1 HIS 128 HD1 HIS 128 0.889 -2.215 14.542 939 HD2 HIS 128 HD2 HIS 128 -0.156 -3.360 10.672 940 HE1 HIS 128 HE1 HIS 128 2.622 -1.196 12.997 941 H SER 129 HN SER 129 -2.580 -6.238 12.741 942 HA SER 129 HA SER 129 -4.956 -6.247 14.507 943 1HB SER 129 HB2 SER 129 -5.864 -6.154 12.190 944 2HB SER 129 HB1 SER 129 -4.970 -7.621 11.800 945 HG SER 129 HG SER 129 -7.333 -7.335 13.061 946 H THR 130 HN THR 130 -5.408 -8.468 15.309 947 HA THR 130 HA THR 130 -2.870 -10.000 15.558 948 HB THR 130 HB THR 130 -3.995 -11.113 17.446 949 HG1 THR 130 HG1 THR 130 -6.078 -10.603 17.949 950 1HG2 THR 130 HG22 THR 130 -2.855 -8.870 17.707 951 2HG2 THR 130 HG21 THR 130 -4.452 -8.125 17.593 952 3HG2 THR 130 HG23 THR 130 -4.082 -9.220 18.927 953 H ASP 131 HN ASP 131 -5.255 -10.061 13.386 954 HA ASP 131 HA ASP 131 -5.914 -12.928 13.481 955 1HB ASP 131 HB2 ASP 131 -7.534 -11.218 12.636 956 2HB ASP 131 HB1 ASP 131 -6.448 -10.913 11.284 957 H ILE 132 HN ILE 132 -4.567 -14.433 12.703 958 HA ILE 132 HA ILE 132 -2.118 -13.895 11.369 959 HB ILE 132 HB ILE 132 -3.770 -16.438 11.423 960 1HG1 ILE 132 HG12 ILE 132 -1.349 -15.683 13.078 961 2HG1 ILE 132 HG11 ILE 132 -3.003 -15.403 13.626 962 1HG2 ILE 132 HG22 ILE 132 -0.935 -15.844 10.550 963 2HG2 ILE 132 HG21 ILE 132 -1.444 -17.462 11.039 964 3HG2 ILE 132 HG23 ILE 132 -2.199 -16.682 9.647 965 1HD1 ILE 132 HD11 ILE 132 -1.882 -18.098 12.800 966 2HD1 ILE 132 HD13 ILE 132 -2.103 -17.563 14.466 967 3HD1 ILE 132 HD12 ILE 132 -3.503 -17.794 13.422 968 H GLY 133 HN GLY 133 -5.297 -14.811 10.056 969 1HA GLY 133 HA2 GLY 133 -4.379 -15.118 7.347 970 2HA GLY 133 HA1 GLY 133 -6.057 -14.896 7.835 971 H ALA 134 HN ALA 134 -4.261 -12.361 9.116 972 HA ALA 134 HA ALA 134 -5.223 -10.563 6.939 973 1HB ALA 134 HB3 ALA 134 -4.146 -9.910 9.699 974 2HB ALA 134 HB2 ALA 134 -4.801 -8.745 8.549 975 3HB ALA 134 HB1 ALA 134 -5.849 -9.979 9.245 976 H LEU 135 HN LEU 135 -3.845 -9.379 5.689 977 HA LEU 135 HA LEU 135 -1.095 -10.217 5.462 978 1HB LEU 135 HB2 LEU 135 -2.498 -7.809 4.262 979 2HB LEU 135 HB1 LEU 135 -0.954 -8.471 3.727 980 HG LEU 135 HG LEU 135 -3.569 -10.013 3.742 981 1HD1 LEU 135 HD13 LEU 135 -3.511 -8.098 2.120 982 2HD1 LEU 135 HD12 LEU 135 -2.081 -8.820 1.386 983 3HD1 LEU 135 HD11 LEU 135 -3.621 -9.674 1.340 984 1HD2 LEU 135 HD21 LEU 135 -0.745 -10.644 2.879 985 2HD2 LEU 135 HD23 LEU 135 -1.863 -11.634 3.818 986 3HD2 LEU 135 HD22 LEU 135 -2.107 -11.436 2.084 987 H MET 136 HN MET 136 -2.696 -7.601 7.145 988 HA MET 136 HA MET 136 -0.348 -5.950 7.499 989 1HB MET 136 HB2 MET 136 -2.827 -6.068 9.241 990 2HB MET 136 HB1 MET 136 -1.687 -4.729 9.114 991 1HG MET 136 HG2 MET 136 -3.388 -5.791 6.841 992 2HG MET 136 HG1 MET 136 -3.731 -4.330 7.763 993 1HE MET 136 HE1 MET 136 -2.620 -2.296 7.766 994 2HE MET 136 HE3 MET 136 -0.948 -2.753 8.118 995 3HE MET 136 HE2 MET 136 -1.315 -1.738 6.727 996 H TYR 137 HN TYR 137 -0.386 -8.968 8.408 997 HA TYR 137 HA TYR 137 -0.087 -8.955 11.241 998 1HB TYR 137 HB2 TYR 137 -0.333 -10.959 9.621 999 2HB TYR 137 HB1 TYR 137 1.414 -10.841 9.424 1000 HD1 TYR 137 HD2 TYR 137 -1.180 -10.919 12.146 1001 HD2 TYR 137 HD1 TYR 137 2.782 -12.037 10.911 1002 HE1 TYR 137 HE2 TYR 137 -0.867 -12.160 14.271 1003 HE2 TYR 137 HE1 TYR 137 3.089 -13.277 13.037 1004 HH TYR 137 HH TYR 137 1.070 -14.406 14.817 1005 HA PRO 138 HA PRO 138 3.787 -6.711 11.526 1006 1HB PRO 138 HB2 PRO 138 4.659 -8.139 13.900 1007 2HB PRO 138 HB1 PRO 138 4.002 -6.500 13.789 1008 1HG PRO 138 HG2 PRO 138 2.675 -8.882 14.790 1009 2HG PRO 138 HG1 PRO 138 2.052 -7.227 14.740 1010 1HD PRO 138 HD2 PRO 138 1.223 -9.431 13.100 1011 2HD PRO 138 HD1 PRO 138 0.701 -7.737 12.973 1012 H SER 139 HN SER 139 3.915 -10.248 12.129 1013 HA SER 139 HA SER 139 6.704 -10.362 11.199 1014 1HB SER 139 HB2 SER 139 5.662 -11.849 13.015 1015 2HB SER 139 HB1 SER 139 4.897 -12.725 11.694 1016 HG SER 139 HG SER 139 7.636 -12.176 11.552 1017 H TYR 140 HN TYR 140 7.405 -11.128 9.241 1018 HA TYR 140 HA TYR 140 5.611 -11.025 6.982 1019 1HB TYR 140 HB2 TYR 140 8.007 -10.427 6.823 1020 2HB TYR 140 HB1 TYR 140 8.444 -12.097 7.190 1021 HD1 TYR 140 HD1 TYR 140 8.000 -13.906 5.572 1022 HD2 TYR 140 HD2 TYR 140 7.122 -9.801 4.661 1023 HE1 TYR 140 HE1 TYR 140 7.801 -14.479 3.166 1024 HE2 TYR 140 HE2 TYR 140 6.920 -10.375 2.260 1025 HH TYR 140 HH TYR 140 8.123 -12.842 0.857 1026 H THR 141 HN THR 141 4.771 -12.761 5.752 1027 HA THR 141 HA THR 141 5.449 -15.536 6.529 1028 HB THR 141 HB THR 141 3.057 -16.133 6.864 1029 HG1 THR 141 HG1 THR 141 1.572 -14.459 7.086 1030 1HG2 THR 141 HG23 THR 141 4.613 -15.477 8.765 1031 2HG2 THR 141 HG22 THR 141 3.855 -13.885 8.723 1032 3HG2 THR 141 HG21 THR 141 2.891 -15.311 9.108 1033 H PHE 142 HN PHE 142 5.322 -16.877 4.774 1034 HA PHE 142 HA PHE 142 4.692 -15.682 2.183 1035 1HB PHE 142 HB2 PHE 142 6.596 -17.231 2.440 1036 2HB PHE 142 HB1 PHE 142 5.485 -18.521 2.898 1037 HD1 PHE 142 HD1 PHE 142 3.982 -19.541 1.257 1038 HD2 PHE 142 HD2 PHE 142 6.705 -16.412 0.144 1039 HE1 PHE 142 HE1 PHE 142 3.617 -20.075 -1.136 1040 HE2 PHE 142 HE2 PHE 142 6.339 -16.943 -2.250 1041 HZ PHE 142 HZ PHE 142 4.794 -18.775 -2.891 1042 H SER 143 HN SER 143 2.792 -15.876 1.098 1043 HA SER 143 HA SER 143 0.793 -17.916 2.043 1044 1HB SER 143 HB2 SER 143 0.007 -15.697 2.645 1045 2HB SER 143 HB1 SER 143 0.346 -15.092 1.026 1046 HG SER 143 HG SER 143 -1.231 -17.328 1.051 1047 H GLY 144 HN GLY 144 -0.180 -19.140 0.416 1048 1HA GLY 144 HA2 GLY 144 1.144 -19.386 -2.090 1049 2HA GLY 144 HA1 GLY 144 -0.453 -20.048 -1.734 1050 H ASP 145 HN ASP 145 -1.845 -17.650 -1.199 1051 HA ASP 145 HA ASP 145 -1.599 -16.096 -3.754 1052 1HB ASP 145 HB2 ASP 145 -4.050 -16.095 -3.954 1053 2HB ASP 145 HB1 ASP 145 -3.438 -17.750 -3.972 1054 H VAL 146 HN VAL 146 -2.237 -13.906 -3.575 1055 HA VAL 146 HA VAL 146 -2.273 -12.874 -0.779 1056 HB VAL 146 HB VAL 146 -2.065 -11.330 -3.382 1057 1HG1 VAL 146 HG12 VAL 146 -1.497 -10.662 -0.481 1058 2HG1 VAL 146 HG11 VAL 146 -1.004 -9.642 -1.832 1059 3HG1 VAL 146 HG13 VAL 146 -2.716 -9.932 -1.524 1060 1HG2 VAL 146 HG21 VAL 146 0.089 -12.484 -1.589 1061 2HG2 VAL 146 HG23 VAL 146 -0.190 -12.861 -3.288 1062 3HG2 VAL 146 HG22 VAL 146 0.394 -11.263 -2.823 1063 H GLN 147 HN GLN 147 -4.327 -12.738 0.028 1064 HA GLN 147 HA GLN 147 -6.379 -11.338 -1.630 1065 1HB GLN 147 HB2 GLN 147 -6.743 -13.965 -0.166 1066 2HB GLN 147 HB1 GLN 147 -8.089 -12.969 -0.724 1067 1HG GLN 147 HG2 GLN 147 -7.232 -13.116 -3.042 1068 2HG GLN 147 HG1 GLN 147 -5.894 -14.122 -2.478 1069 1HE2 GLN 147 HE22 GLN 147 -9.206 -15.999 -3.486 1070 2HE2 GLN 147 HE21 GLN 147 -8.672 -14.508 -4.097 1071 H LEU 148 HN LEU 148 -7.950 -10.210 -0.366 1072 HA LEU 148 HA LEU 148 -6.940 -9.294 2.205 1073 1HB LEU 148 HB2 LEU 148 -9.556 -8.731 0.777 1074 2HB LEU 148 HB1 LEU 148 -8.974 -7.871 2.202 1075 HG LEU 148 HG LEU 148 -7.481 -8.032 -0.438 1076 1HD1 LEU 148 HD11 LEU 148 -9.597 -6.744 -0.604 1077 2HD1 LEU 148 HD13 LEU 148 -9.081 -5.746 0.756 1078 3HD1 LEU 148 HD12 LEU 148 -8.180 -5.703 -0.762 1079 1HD2 LEU 148 HD22 LEU 148 -6.935 -6.741 2.234 1080 2HD2 LEU 148 HD21 LEU 148 -5.824 -7.578 1.150 1081 3HD2 LEU 148 HD23 LEU 148 -6.360 -5.945 0.770 1082 H ALA 149 HN ALA 149 -8.025 -9.556 4.253 1083 HA ALA 149 HA ALA 149 -9.533 -12.121 4.437 1084 1HB ALA 149 HB2 ALA 149 -7.478 -11.609 5.870 1085 2HB ALA 149 HB1 ALA 149 -8.485 -10.439 6.723 1086 3HB ALA 149 HB3 ALA 149 -8.912 -12.148 6.740 1087 H GLN 150 HN GLN 150 -11.367 -12.158 6.043 1088 HA GLN 150 HA GLN 150 -13.381 -10.281 5.337 1089 1HB GLN 150 HB2 GLN 150 -13.866 -12.531 6.236 1090 2HB GLN 150 HB1 GLN 150 -13.211 -12.045 7.797 1091 1HG GLN 150 HG2 GLN 150 -14.950 -10.292 7.986 1092 2HG GLN 150 HG1 GLN 150 -15.600 -10.781 6.422 1093 1HE2 GLN 150 HE22 GLN 150 -17.573 -12.562 9.025 1094 2HE2 GLN 150 HE21 GLN 150 -17.332 -10.943 8.578 1095 H ASP 151 HN ASP 151 -11.223 -10.427 8.160 1096 HA ASP 151 HA ASP 151 -12.389 -8.318 9.661 1097 1HB ASP 151 HB2 ASP 151 -10.627 -9.811 10.543 1098 2HB ASP 151 HB1 ASP 151 -9.459 -9.083 9.439 1099 H ASP 152 HN ASP 152 -9.974 -8.227 7.042 1100 HA ASP 152 HA ASP 152 -9.633 -5.341 7.254 1101 1HB ASP 152 HB2 ASP 152 -8.849 -7.364 5.136 1102 2HB ASP 152 HB1 ASP 152 -8.446 -5.648 5.036 1103 H ILE 153 HN ILE 153 -11.448 -7.531 5.105 1104 HA ILE 153 HA ILE 153 -12.444 -5.532 3.332 1105 HB ILE 153 HB ILE 153 -13.654 -8.173 4.212 1106 1HG1 ILE 153 HG12 ILE 153 -12.228 -7.435 1.642 1107 2HG1 ILE 153 HG11 ILE 153 -11.396 -8.137 3.030 1108 1HG2 ILE 153 HG21 ILE 153 -14.416 -6.244 2.006 1109 2HG2 ILE 153 HG23 ILE 153 -14.925 -7.932 2.021 1110 3HG2 ILE 153 HG22 ILE 153 -15.442 -6.842 3.308 1111 1HD1 ILE 153 HD13 ILE 153 -12.971 -10.071 2.947 1112 2HD1 ILE 153 HD12 ILE 153 -13.694 -9.384 1.493 1113 3HD1 ILE 153 HD11 ILE 153 -12.013 -9.916 1.475 1114 H ASP 154 HN ASP 154 -13.922 -6.925 6.283 1115 HA ASP 154 HA ASP 154 -16.242 -5.266 6.277 1116 1HB ASP 154 HB2 ASP 154 -14.721 -6.614 8.524 1117 2HB ASP 154 HB1 ASP 154 -16.215 -5.715 8.796 1118 H GLY 155 HN GLY 155 -13.002 -4.770 7.637 1119 1HA GLY 155 HA2 GLY 155 -13.561 -2.359 9.040 1120 2HA GLY 155 HA1 GLY 155 -11.969 -2.840 8.459 1121 H ILE 156 HN ILE 156 -12.137 -2.732 5.747 1122 HA ILE 156 HA ILE 156 -12.210 0.113 5.268 1123 HB ILE 156 HB ILE 156 -10.730 -1.584 4.067 1124 1HG1 ILE 156 HG12 ILE 156 -10.977 -0.357 1.854 1125 2HG1 ILE 156 HG11 ILE 156 -12.403 0.422 2.530 1126 1HG2 ILE 156 HG23 ILE 156 -12.729 -3.099 3.565 1127 2HG2 ILE 156 HG22 ILE 156 -13.149 -1.954 2.293 1128 3HG2 ILE 156 HG21 ILE 156 -11.611 -2.816 2.234 1129 1HD1 ILE 156 HD13 ILE 156 -9.922 0.559 4.188 1130 2HD1 ILE 156 HD12 ILE 156 -9.941 1.505 2.704 1131 3HD1 ILE 156 HD11 ILE 156 -11.180 1.766 3.927 1132 H GLN 157 HN GLN 157 -14.422 -2.546 4.464 1133 HA GLN 157 HA GLN 157 -16.218 -0.934 2.885 1134 1HB GLN 157 HB2 GLN 157 -16.617 -3.521 4.412 1135 2HB GLN 157 HB1 GLN 157 -17.860 -2.795 3.394 1136 1HG GLN 157 HG2 GLN 157 -16.342 -2.892 1.455 1137 2HG GLN 157 HG1 GLN 157 -15.094 -3.621 2.468 1138 1HE2 GLN 157 HE22 GLN 157 -17.885 -6.344 2.861 1139 2HE2 GLN 157 HE21 GLN 157 -17.645 -4.985 3.849 1140 H ALA 158 HN ALA 158 -16.034 -1.759 6.328 1141 HA ALA 158 HA ALA 158 -18.523 -0.646 7.134 1142 1HB ALA 158 HB1 ALA 158 -15.882 -1.029 8.554 1143 2HB ALA 158 HB3 ALA 158 -17.274 -0.324 9.372 1144 3HB ALA 158 HB2 ALA 158 -17.366 -1.966 8.738 1145 H ILE 159 HN ILE 159 -15.323 0.869 6.715 1146 HA ILE 159 HA ILE 159 -16.113 3.450 7.724 1147 HB ILE 159 HB ILE 159 -13.911 2.623 5.810 1148 1HG1 ILE 159 HG12 ILE 159 -13.782 3.454 8.723 1149 2HG1 ILE 159 HG11 ILE 159 -13.883 1.773 8.200 1150 1HG2 ILE 159 HG21 ILE 159 -14.449 5.282 7.167 1151 2HG2 ILE 159 HG23 ILE 159 -12.915 4.857 6.410 1152 3HG2 ILE 159 HG22 ILE 159 -14.374 4.979 5.430 1153 1HD1 ILE 159 HD13 ILE 159 -11.811 2.071 6.876 1154 2HD1 ILE 159 HD12 ILE 159 -11.703 3.738 7.437 1155 3HD1 ILE 159 HD11 ILE 159 -11.539 2.410 8.584 1156 H TYR 160 HN TYR 160 -15.859 2.182 4.380 1157 HA TYR 160 HA TYR 160 -17.329 4.582 3.398 1158 1HB TYR 160 HB2 TYR 160 -15.901 2.317 1.978 1159 2HB TYR 160 HB1 TYR 160 -16.830 3.557 1.134 1160 HD1 TYR 160 HD2 TYR 160 -16.078 5.880 1.070 1161 HD2 TYR 160 HD1 TYR 160 -13.807 2.865 3.118 1162 HE1 TYR 160 HE2 TYR 160 -14.140 7.418 1.182 1163 HE2 TYR 160 HE1 TYR 160 -11.868 4.406 3.234 1164 HH TYR 160 HH TYR 160 -11.434 6.820 3.161 1165 H GLY 161 HN GLY 161 -17.503 1.098 2.607 1166 1HA GLY 161 HA2 GLY 161 -20.015 0.413 3.462 1167 2HA GLY 161 HA1 GLY 161 -20.358 1.355 2.010 1168 H ARG 162 HN ARG 162 -21.199 -1.096 1.716 1169 HA ARG 162 HA ARG 162 -19.064 -2.846 0.645 1170 1HB ARG 162 HB2 ARG 162 -22.061 -3.181 0.975 1171 2HB ARG 162 HB1 ARG 162 -21.021 -4.401 0.233 1172 1HG ARG 162 HG2 ARG 162 -19.671 -4.514 2.298 1173 2HG ARG 162 HG1 ARG 162 -20.709 -3.298 3.045 1174 1HD ARG 162 HD2 ARG 162 -22.657 -4.810 2.761 1175 2HD ARG 162 HD1 ARG 162 -21.590 -6.035 2.073 1176 HE ARG 162 HE ARG 162 -20.430 -5.454 4.518 1177 1HH1 ARG 162 HH21 ARG 162 -23.558 -6.365 3.387 1178 2HH1 ARG 162 HH22 ARG 162 -23.984 -7.205 4.838 1179 1HH2 ARG 162 HH11 ARG 162 -20.972 -6.545 6.424 1180 2HH2 ARG 162 HH12 ARG 162 -22.522 -7.307 6.558 1181 H SER 163 HN SER 163 -18.912 -3.379 -1.579 1182 HA SER 163 HA SER 163 -19.827 -1.321 -3.414 1183 1HB SER 163 HB2 SER 163 -18.598 -4.015 -4.066 1184 2HB SER 163 HB1 SER 163 -18.663 -2.609 -5.116 1185 HG SER 163 HG SER 163 -16.648 -2.810 -4.035 1186 H GLN 164 HN GLN 164 -22.178 -1.863 -2.622 1187 HA GLN 164 HA GLN 164 -23.449 -4.231 -3.693 1188 1HB GLN 164 HB2 GLN 164 -24.556 -1.581 -2.722 1189 2HB GLN 164 HB1 GLN 164 -25.570 -2.934 -3.219 1190 1HG GLN 164 HG2 GLN 164 -24.593 -4.357 -1.491 1191 2HG GLN 164 HG1 GLN 164 -23.472 -3.073 -1.036 1192 1HE2 GLN 164 HE22 GLN 164 -26.641 -3.061 1.117 1193 2HE2 GLN 164 HE21 GLN 164 -25.641 -4.344 0.630 1194 H ASN 165 HN ASN 165 -24.375 -4.530 -5.697 1195 HA ASN 165 HA ASN 165 -24.927 -2.219 -7.448 1196 1HB ASN 165 HB2 ASN 165 -22.833 -4.310 -8.100 1197 2HB ASN 165 HB1 ASN 165 -23.554 -3.248 -9.308 1198 1HD2 ASN 165 HD22 ASN 165 -21.626 -0.441 -8.368 1199 2HD2 ASN 165 HD21 ASN 165 -22.835 -1.055 -9.388 1200 HA PRO 166 HA PRO 166 -27.678 -5.996 -7.781 1201 1HB PRO 166 HB2 PRO 166 -29.984 -4.265 -7.580 1202 2HB PRO 166 HB1 PRO 166 -29.426 -5.461 -6.403 1203 1HG PRO 166 HG2 PRO 166 -29.294 -2.584 -6.171 1204 2HG PRO 166 HG1 PRO 166 -28.725 -3.786 -5.006 1205 1HD PRO 166 HD2 PRO 166 -27.126 -2.110 -6.766 1206 2HD PRO 166 HD1 PRO 166 -26.559 -3.256 -5.536 1207 H VAL 167 HN VAL 167 -28.211 -6.604 -9.843 1208 HA VAL 167 HA VAL 167 -28.239 -4.563 -11.975 1209 HB VAL 167 HB VAL 167 -28.540 -7.576 -12.168 1210 1HG1 VAL 167 HG13 VAL 167 -27.859 -5.426 -14.197 1211 2HG1 VAL 167 HG12 VAL 167 -27.725 -7.158 -14.503 1212 3HG1 VAL 167 HG11 VAL 167 -29.302 -6.441 -14.177 1213 1HG2 VAL 167 HG23 VAL 167 -26.419 -6.897 -11.072 1214 2HG2 VAL 167 HG22 VAL 167 -26.130 -7.579 -12.674 1215 3HG2 VAL 167 HG21 VAL 167 -26.068 -5.831 -12.434 1216 H GLN 168 HN GLN 168 -30.070 -3.950 -13.113 1217 HA GLN 168 HA GLN 168 -32.659 -4.647 -11.966 1218 1HB GLN 168 HB2 GLN 168 -31.924 -2.964 -14.382 1219 2HB GLN 168 HB1 GLN 168 -33.540 -3.068 -13.691 1220 1HG GLN 168 HG2 GLN 168 -32.548 -2.280 -11.496 1221 2HG GLN 168 HG1 GLN 168 -31.048 -1.964 -12.372 1222 1HE2 GLN 168 HE22 GLN 168 -34.330 0.402 -13.140 1223 2HE2 GLN 168 HE21 GLN 168 -34.558 -1.139 -12.463 1224 HA PRO 169 HA PRO 169 -33.665 -8.047 -14.657 1225 1HB PRO 169 HB2 PRO 169 -36.325 -7.047 -15.328 1226 2HB PRO 169 HB1 PRO 169 -35.894 -8.392 -14.258 1227 1HG PRO 169 HG2 PRO 169 -36.830 -5.759 -13.496 1228 2HG PRO 169 HG1 PRO 169 -36.396 -7.102 -12.428 1229 1HD PRO 169 HD2 PRO 169 -34.929 -4.664 -12.821 1230 2HD PRO 169 HD1 PRO 169 -34.442 -6.064 -11.847 No H/Q in entry = 1230 Start of MODEL 16 1 1H VAL 1 HT1 VAL 1 -2.245 15.142 14.625 2 2H VAL 1 HT3 VAL 1 -2.101 13.739 15.565 3 3H VAL 1 HT2 VAL 1 -0.716 14.640 15.168 4 HA VAL 1 HA VAL 1 -0.866 14.058 12.889 5 HB VAL 1 HB VAL 1 -1.037 11.426 13.210 6 1HG1 VAL 1 HG12 VAL 1 0.983 13.235 14.563 7 2HG1 VAL 1 HG11 VAL 1 1.202 11.492 14.401 8 3HG1 VAL 1 HG13 VAL 1 1.098 12.505 12.961 9 1HG2 VAL 1 HG21 VAL 1 -2.326 11.681 15.357 10 2HG2 VAL 1 HG23 VAL 1 -0.853 10.728 15.530 11 3HG2 VAL 1 HG22 VAL 1 -0.889 12.402 16.080 12 H LEU 2 HN LEU 2 -3.636 12.721 14.714 13 HA LEU 2 HA LEU 2 -5.082 11.962 12.317 14 1HB LEU 2 HB2 LEU 2 -5.978 12.382 15.181 15 2HB LEU 2 HB1 LEU 2 -7.023 11.749 13.913 16 HG LEU 2 HG LEU 2 -4.371 10.498 14.690 17 1HD1 LEU 2 HD11 LEU 2 -7.186 9.989 15.663 18 2HD1 LEU 2 HD13 LEU 2 -5.951 8.731 15.719 19 3HD1 LEU 2 HD12 LEU 2 -5.720 10.232 16.615 20 1HD2 LEU 2 HD21 LEU 2 -6.590 9.788 12.774 21 2HD2 LEU 2 HD23 LEU 2 -4.845 9.670 12.556 22 3HD2 LEU 2 HD22 LEU 2 -5.688 8.489 13.552 23 H THR 3 HN THR 3 -6.822 13.082 11.324 24 HA THR 3 HA THR 3 -6.826 16.024 11.823 25 HB THR 3 HB THR 3 -7.640 16.280 9.633 26 HG1 THR 3 HG1 THR 3 -9.264 14.538 10.089 27 1HG2 THR 3 HG22 THR 3 -5.319 15.207 9.829 28 2HG2 THR 3 HG21 THR 3 -6.100 13.696 9.361 29 3HG2 THR 3 HG23 THR 3 -6.117 15.075 8.261 30 H GLU 4 HN GLU 4 -8.524 16.957 12.847 31 HA GLU 4 HA GLU 4 -10.700 15.358 13.879 32 1HB GLU 4 HB2 GLU 4 -9.810 17.354 15.055 33 2HB GLU 4 HB1 GLU 4 -10.415 18.377 13.753 34 1HG GLU 4 HG2 GLU 4 -12.721 17.613 14.221 35 2HG GLU 4 HG1 GLU 4 -12.113 16.594 15.526 36 H GLY 5 HN GLY 5 -12.882 15.355 13.233 37 1HA GLY 5 HA2 GLY 5 -14.750 16.101 11.901 38 2HA GLY 5 HA1 GLY 5 -13.628 16.888 10.794 39 H ASN 6 HN ASN 6 -11.900 14.908 10.062 40 HA ASN 6 HA ASN 6 -13.398 12.468 9.380 41 1HB ASN 6 HB2 ASN 6 -12.628 14.513 7.286 42 2HB ASN 6 HB1 ASN 6 -13.082 12.850 6.914 43 1HD2 ASN 6 HD22 ASN 6 -15.984 15.538 7.473 44 2HD2 ASN 6 HD21 ASN 6 -14.358 15.950 7.214 45 HA PRO 7 HA PRO 7 -8.784 12.030 9.615 46 1HB PRO 7 HB2 PRO 7 -9.090 9.576 11.087 47 2HB PRO 7 HB1 PRO 7 -8.530 11.133 11.711 48 1HG PRO 7 HG2 PRO 7 -11.065 9.835 12.237 49 2HG PRO 7 HG1 PRO 7 -10.491 11.385 12.869 50 1HD PRO 7 HD2 PRO 7 -12.489 10.914 10.800 51 2HD PRO 7 HD1 PRO 7 -12.001 12.464 11.518 52 H ARG 8 HN ARG 8 -10.602 11.349 7.502 53 HA ARG 8 HA ARG 8 -9.215 8.989 6.393 54 1HB ARG 8 HB2 ARG 8 -12.234 9.189 6.693 55 2HB ARG 8 HB1 ARG 8 -11.446 8.084 5.575 56 1HG ARG 8 HG2 ARG 8 -11.631 6.658 7.371 57 2HG ARG 8 HG1 ARG 8 -10.089 7.388 7.800 58 1HD ARG 8 HD2 ARG 8 -11.833 9.167 8.961 59 2HD ARG 8 HD1 ARG 8 -12.746 7.669 9.112 60 HE ARG 8 HE ARG 8 -10.650 8.391 10.808 61 1HH1 ARG 8 HH21 ARG 8 -11.357 5.750 8.688 62 2HH1 ARG 8 HH22 ARG 8 -10.291 4.659 9.496 63 1HH2 ARG 8 HH11 ARG 8 -9.291 6.964 11.872 64 2HH2 ARG 8 HH12 ARG 8 -9.131 5.338 11.296 65 H TRP 9 HN TRP 9 -9.584 8.887 3.991 66 HA TRP 9 HA TRP 9 -9.458 11.507 2.821 67 1HB TRP 9 HB2 TRP 9 -9.945 8.784 1.571 68 2HB TRP 9 HB1 TRP 9 -9.675 10.257 0.641 69 HD1 TRP 9 HD1 TRP 9 -7.879 7.510 2.364 70 HE1 TRP 9 HE1 TRP 9 -5.344 7.972 2.394 71 HE3 TRP 9 HE3 TRP 9 -7.857 12.399 0.887 72 HZ2 TRP 9 HZ2 TRP 9 -3.539 10.134 1.864 73 HZ3 TRP 9 HZ3 TRP 9 -5.721 13.633 0.658 74 HH2 TRP 9 HH2 TRP 9 -3.565 12.508 1.144 75 H GLU 10 HN GLU 10 -11.115 12.832 2.196 76 HA GLU 10 HA GLU 10 -13.866 12.015 2.692 77 1HB GLU 10 HB2 GLU 10 -12.696 14.529 1.468 78 2HB GLU 10 HB1 GLU 10 -14.404 14.311 1.849 79 1HG GLU 10 HG2 GLU 10 -13.825 13.933 4.222 80 2HG GLU 10 HG1 GLU 10 -12.119 14.162 3.838 81 H GLN 11 HN GLN 11 -11.761 12.153 -0.071 82 HA GLN 11 HA GLN 11 -13.944 12.049 -2.027 83 1HB GLN 11 HB2 GLN 11 -10.943 11.697 -2.262 84 2HB GLN 11 HB1 GLN 11 -12.045 11.638 -3.638 85 1HG GLN 11 HG2 GLN 11 -11.910 13.981 -1.725 86 2HG GLN 11 HG1 GLN 11 -10.985 13.905 -3.224 87 1HE2 GLN 11 HE22 GLN 11 -14.146 13.836 -5.183 88 2HE2 GLN 11 HE21 GLN 11 -12.779 12.840 -5.042 89 H THR 12 HN THR 12 -14.499 10.198 -3.274 90 HA THR 12 HA THR 12 -13.962 7.615 -1.912 91 HB THR 12 HB THR 12 -15.733 6.742 -3.405 92 HG1 THR 12 HG1 THR 12 -15.048 8.626 -4.950 93 1HG2 THR 12 HG22 THR 12 -16.339 9.320 -1.939 94 2HG2 THR 12 HG21 THR 12 -17.590 8.253 -2.578 95 3HG2 THR 12 HG23 THR 12 -16.492 7.674 -1.325 96 H HIS 13 HN HIS 13 -12.607 9.441 -4.330 97 HA HIS 13 HA HIS 13 -11.472 7.024 -5.709 98 1HB HIS 13 HB2 HIS 13 -12.005 9.779 -6.875 99 2HB HIS 13 HB1 HIS 13 -11.279 8.418 -7.732 100 HD1 HIS 13 HD1 HIS 13 -14.109 9.840 -8.385 101 HD2 HIS 13 HD2 HIS 13 -13.545 6.181 -6.468 102 HE1 HIS 13 HE1 HIS 13 -16.259 8.536 -8.680 103 H LEU 14 HN LEU 14 -9.239 6.991 -5.824 104 HA LEU 14 HA LEU 14 -7.742 9.417 -4.888 105 1HB LEU 14 HB2 LEU 14 -7.223 6.537 -4.086 106 2HB LEU 14 HB1 LEU 14 -6.245 7.926 -3.615 107 HG LEU 14 HG LEU 14 -9.201 7.647 -2.983 108 1HD1 LEU 14 HD12 LEU 14 -6.731 6.905 -1.406 109 2HD1 LEU 14 HD11 LEU 14 -8.258 7.282 -0.607 110 3HD1 LEU 14 HD13 LEU 14 -8.162 5.926 -1.729 111 1HD2 LEU 14 HD21 LEU 14 -7.050 9.655 -2.298 112 2HD2 LEU 14 HD23 LEU 14 -8.702 9.939 -2.845 113 3HD2 LEU 14 HD22 LEU 14 -8.403 9.406 -1.195 114 H THR 15 HN THR 15 -5.487 9.427 -5.608 115 HA THR 15 HA THR 15 -5.000 7.758 -8.057 116 HB THR 15 HB THR 15 -3.959 9.748 -9.085 117 HG1 THR 15 HG1 THR 15 -4.909 11.679 -7.620 118 1HG2 THR 15 HG22 THR 15 -6.800 10.047 -8.094 119 2HG2 THR 15 HG21 THR 15 -6.086 11.118 -9.299 120 3HG2 THR 15 HG23 THR 15 -6.262 9.398 -9.643 121 H TYR 16 HN TYR 16 -2.694 7.483 -8.550 122 HA TYR 16 HA TYR 16 -0.806 8.127 -6.339 123 1HB TYR 16 HB2 TYR 16 -0.056 5.778 -6.199 124 2HB TYR 16 HB1 TYR 16 -1.757 5.926 -5.755 125 HD1 TYR 16 HD2 TYR 16 -3.537 5.219 -7.318 126 HD2 TYR 16 HD1 TYR 16 0.621 4.636 -8.226 127 HE1 TYR 16 HE2 TYR 16 -4.152 3.621 -9.109 128 HE2 TYR 16 HE1 TYR 16 0.004 3.036 -10.021 129 HH TYR 16 HH TYR 16 -1.659 1.888 -10.964 130 H ARG 17 HN ARG 17 1.433 7.946 -7.002 131 HA ARG 17 HA ARG 17 1.941 7.378 -9.878 132 1HB ARG 17 HB2 ARG 17 1.350 9.806 -9.681 133 2HB ARG 17 HB1 ARG 17 2.718 10.009 -8.587 134 1HG ARG 17 HG2 ARG 17 4.253 9.213 -10.354 135 2HG ARG 17 HG1 ARG 17 2.883 9.018 -11.452 136 1HD ARG 17 HD2 ARG 17 3.746 11.622 -10.157 137 2HD ARG 17 HD1 ARG 17 4.002 11.179 -11.849 138 HE ARG 17 HE ARG 17 1.280 10.894 -11.518 139 1HH1 ARG 17 HH21 ARG 17 3.618 13.370 -10.965 140 2HH1 ARG 17 HH22 ARG 17 2.485 14.662 -11.182 141 1HH2 ARG 17 HH11 ARG 17 -0.200 12.549 -11.791 142 2HH2 ARG 17 HH12 ARG 17 0.316 14.194 -11.633 143 H ILE 18 HN ILE 18 3.958 6.483 -10.166 144 HA ILE 18 HA ILE 18 5.660 6.141 -7.762 145 HB ILE 18 HB ILE 18 5.796 4.939 -10.546 146 1HG1 ILE 18 HG12 ILE 18 5.157 3.651 -7.875 147 2HG1 ILE 18 HG11 ILE 18 3.921 4.241 -8.985 148 1HG2 ILE 18 HG23 ILE 18 7.564 4.644 -8.111 149 2HG2 ILE 18 HG22 ILE 18 7.451 3.368 -9.323 150 3HG2 ILE 18 HG21 ILE 18 8.041 4.966 -9.778 151 1HD1 ILE 18 HD13 ILE 18 6.033 2.188 -9.704 152 2HD1 ILE 18 HD12 ILE 18 4.371 1.801 -9.258 153 3HD1 ILE 18 HD11 ILE 18 4.698 2.722 -10.726 154 H GLU 19 HN GLU 19 7.408 7.456 -7.442 155 HA GLU 19 HA GLU 19 8.078 9.542 -9.290 156 1HB GLU 19 HB2 GLU 19 9.521 8.458 -6.867 157 2HB GLU 19 HB1 GLU 19 10.089 9.855 -7.781 158 1HG GLU 19 HG2 GLU 19 7.935 10.996 -7.381 159 2HG GLU 19 HG1 GLU 19 7.368 9.601 -6.463 160 H ASN 20 HN ASN 20 9.622 6.389 -8.628 161 HA ASN 20 HA ASN 20 10.800 6.446 -11.296 162 1HB ASN 20 HB2 ASN 20 13.131 6.429 -10.638 163 2HB ASN 20 HB1 ASN 20 12.381 7.877 -9.967 164 1HD2 ASN 20 HD22 ASN 20 14.361 6.008 -7.315 165 2HD2 ASN 20 HD21 ASN 20 14.765 6.514 -8.884 166 H TYR 21 HN TYR 21 11.854 4.425 -11.829 167 HA TYR 21 HA TYR 21 10.922 2.158 -10.106 168 1HB TYR 21 HB2 TYR 21 11.641 2.283 -13.052 169 2HB TYR 21 HB1 TYR 21 11.131 0.826 -12.200 170 HD1 TYR 21 HD2 TYR 21 10.065 4.108 -13.489 171 HD2 TYR 21 HD1 TYR 21 8.831 0.542 -11.435 172 HE1 TYR 21 HE2 TYR 21 7.690 4.738 -13.823 173 HE2 TYR 21 HE1 TYR 21 6.459 1.173 -11.769 174 HH TYR 21 HH TYR 21 5.578 4.160 -13.514 175 H THR 22 HN THR 22 12.464 0.889 -9.148 176 HA THR 22 HA THR 22 15.260 1.558 -9.480 177 HB THR 22 HB THR 22 14.629 0.854 -7.298 178 HG1 THR 22 HG1 THR 22 16.009 -0.823 -6.991 179 1HG2 THR 22 HG21 THR 22 13.330 -1.473 -8.725 180 2HG2 THR 22 HG23 THR 22 13.593 -1.455 -6.983 181 3HG2 THR 22 HG22 THR 22 12.552 -0.244 -7.730 182 HA PRO 23 HA PRO 23 16.000 -1.315 -12.822 183 1HB PRO 23 HB2 PRO 23 18.711 -1.924 -12.225 184 2HB PRO 23 HB1 PRO 23 18.141 -0.618 -13.274 185 1HG PRO 23 HG2 PRO 23 19.252 -0.437 -10.546 186 2HG PRO 23 HG1 PRO 23 19.033 0.847 -11.745 187 1HD PRO 23 HD2 PRO 23 17.441 0.438 -9.419 188 2HD PRO 23 HD1 PRO 23 17.077 1.530 -10.774 189 H ASP 24 HN ASP 24 15.911 -2.085 -9.583 190 HA ASP 24 HA ASP 24 16.960 -4.741 -9.511 191 1HB ASP 24 HB2 ASP 24 14.772 -3.405 -7.901 192 2HB ASP 24 HB1 ASP 24 15.360 -5.035 -7.568 193 H LEU 25 HN LEU 25 13.754 -3.477 -10.377 194 HA LEU 25 HA LEU 25 13.156 -6.102 -11.658 195 1HB LEU 25 HB2 LEU 25 11.284 -4.499 -9.887 196 2HB LEU 25 HB1 LEU 25 10.779 -5.867 -10.870 197 HG LEU 25 HG LEU 25 13.012 -6.142 -8.850 198 1HD1 LEU 25 HD11 LEU 25 10.027 -6.333 -8.401 199 2HD1 LEU 25 HD13 LEU 25 11.206 -7.087 -7.328 200 3HD1 LEU 25 HD12 LEU 25 11.186 -5.334 -7.525 201 1HD2 LEU 25 HD21 LEU 25 11.086 -8.055 -10.208 202 2HD2 LEU 25 HD23 LEU 25 12.840 -8.000 -10.380 203 3HD2 LEU 25 HD22 LEU 25 12.120 -8.522 -8.860 204 HA PRO 26 HA PRO 26 12.079 -3.456 -15.073 205 1HB PRO 26 HB2 PRO 26 9.779 -5.012 -15.907 206 2HB PRO 26 HB1 PRO 26 11.397 -5.003 -16.621 207 1HG PRO 26 HG2 PRO 26 10.187 -7.066 -14.962 208 2HG PRO 26 HG1 PRO 26 11.759 -7.100 -15.772 209 1HD PRO 26 HD2 PRO 26 11.293 -6.837 -12.956 210 2HD PRO 26 HD1 PRO 26 12.847 -6.695 -13.806 211 H ARG 27 HN ARG 27 10.618 -1.720 -15.387 212 HA ARG 27 HA ARG 27 8.923 -0.992 -13.205 213 1HB ARG 27 HB2 ARG 27 8.196 0.864 -14.619 214 2HB ARG 27 HB1 ARG 27 9.934 0.637 -14.808 215 1HG ARG 27 HG2 ARG 27 9.443 -0.776 -16.844 216 2HG ARG 27 HG1 ARG 27 7.755 -0.286 -16.701 217 1HD ARG 27 HD2 ARG 27 8.408 2.077 -16.897 218 2HD ARG 27 HD1 ARG 27 10.103 1.605 -17.021 219 HE ARG 27 HE ARG 27 8.890 0.196 -19.068 220 1HH1 ARG 27 HH21 ARG 27 8.955 3.479 -18.016 221 2HH1 ARG 27 HH22 ARG 27 8.796 4.133 -19.612 222 1HH2 ARG 27 HH11 ARG 27 8.689 1.032 -21.159 223 2HH2 ARG 27 HH12 ARG 27 8.648 2.748 -21.391 224 H ALA 28 HN ALA 28 8.289 -2.652 -16.243 225 HA ALA 28 HA ALA 28 5.456 -2.468 -16.262 226 1HB ALA 28 HB2 ALA 28 7.285 -4.666 -17.262 227 2HB ALA 28 HB1 ALA 28 5.561 -4.573 -17.624 228 3HB ALA 28 HB3 ALA 28 6.652 -3.310 -18.194 229 H ASP 29 HN ASP 29 7.601 -4.795 -14.626 230 HA ASP 29 HA ASP 29 5.347 -6.349 -13.611 231 1HB ASP 29 HB2 ASP 29 8.304 -6.348 -12.951 232 2HB ASP 29 HB1 ASP 29 7.141 -7.439 -12.196 233 H VAL 30 HN VAL 30 7.258 -3.629 -12.492 234 HA VAL 30 HA VAL 30 6.493 -3.841 -9.714 235 HB VAL 30 HB VAL 30 7.494 -1.523 -11.390 236 1HG1 VAL 30 HG13 VAL 30 6.759 -1.678 -8.460 237 2HG1 VAL 30 HG12 VAL 30 7.962 -0.526 -9.045 238 3HG1 VAL 30 HG11 VAL 30 6.304 -0.450 -9.641 239 1HG2 VAL 30 HG22 VAL 30 8.972 -3.547 -10.835 240 2HG2 VAL 30 HG21 VAL 30 9.600 -1.971 -10.352 241 3HG2 VAL 30 HG23 VAL 30 8.863 -3.032 -9.152 242 H ASP 31 HN ASP 31 5.171 -1.991 -12.478 243 HA ASP 31 HA ASP 31 3.146 -0.632 -11.006 244 1HB ASP 31 HB2 ASP 31 3.228 -1.561 -13.889 245 2HB ASP 31 HB1 ASP 31 1.939 -0.549 -13.234 246 H HIS 32 HN HIS 32 3.183 -3.831 -12.551 247 HA HIS 32 HA HIS 32 0.450 -4.494 -12.085 248 1HB HIS 32 HB2 HIS 32 1.928 -5.841 -13.534 249 2HB HIS 32 HB1 HIS 32 2.867 -6.331 -12.123 250 HD1 HIS 32 HD1 HIS 32 -0.878 -6.257 -12.902 251 HD2 HIS 32 HD2 HIS 32 2.007 -8.823 -11.332 252 HE1 HIS 32 HE1 HIS 32 -2.088 -8.385 -12.253 253 H ALA 33 HN ALA 33 3.346 -4.934 -10.067 254 HA ALA 33 HA ALA 33 2.113 -6.336 -7.927 255 1HB ALA 33 HB2 ALA 33 4.600 -5.900 -8.262 256 2HB ALA 33 HB1 ALA 33 4.315 -4.281 -7.625 257 3HB ALA 33 HB3 ALA 33 4.016 -5.692 -6.611 258 H ILE 34 HN ILE 34 2.634 -2.823 -8.345 259 HA ILE 34 HA ILE 34 1.186 -2.111 -5.947 260 HB ILE 34 HB ILE 34 1.756 -0.452 -8.422 261 1HG1 ILE 34 HG12 ILE 34 3.844 -1.319 -7.524 262 2HG1 ILE 34 HG11 ILE 34 3.709 0.382 -7.092 263 1HG2 ILE 34 HG22 ILE 34 0.944 0.252 -5.597 264 2HG2 ILE 34 HG21 ILE 34 1.636 1.427 -6.714 265 3HG2 ILE 34 HG23 ILE 34 0.101 0.648 -7.094 266 1HD1 ILE 34 HD13 ILE 34 2.631 -0.543 -4.877 267 2HD1 ILE 34 HD12 ILE 34 3.436 -2.042 -5.336 268 3HD1 ILE 34 HD11 ILE 34 4.382 -0.580 -5.072 269 H GLU 35 HN GLU 35 0.306 -2.158 -9.407 270 HA GLU 35 HA GLU 35 -2.338 -1.156 -9.105 271 1HB GLU 35 HB2 GLU 35 -1.220 -1.393 -11.294 272 2HB GLU 35 HB1 GLU 35 -1.284 -3.148 -11.138 273 1HG GLU 35 HG2 GLU 35 -3.757 -3.055 -11.079 274 2HG GLU 35 HG1 GLU 35 -3.690 -1.300 -11.232 275 H LYS 36 HN LYS 36 -1.118 -4.507 -8.997 276 HA LYS 36 HA LYS 36 -3.657 -5.766 -8.751 277 1HB LYS 36 HB2 LYS 36 -1.567 -6.988 -9.249 278 2HB LYS 36 HB1 LYS 36 -0.998 -6.671 -7.610 279 1HG LYS 36 HG2 LYS 36 -2.671 -8.036 -6.636 280 2HG LYS 36 HG1 LYS 36 -3.639 -8.049 -8.110 281 1HD LYS 36 HD2 LYS 36 -2.533 -10.193 -7.922 282 2HD LYS 36 HD1 LYS 36 -1.773 -9.306 -9.242 283 1HE LYS 36 HE2 LYS 36 0.109 -8.718 -7.873 284 2HE LYS 36 HE1 LYS 36 -0.697 -9.297 -6.415 285 1HZ LYS 36 HZ2 LYS 36 -0.517 -11.273 -8.493 286 2HZ LYS 36 HZ1 LYS 36 1.000 -10.744 -7.941 287 3HZ LYS 36 HZ3 LYS 36 -0.120 -11.391 -6.845 288 H ALA 37 HN ALA 37 -1.483 -4.445 -6.253 289 HA ALA 37 HA ALA 37 -2.945 -5.419 -4.007 290 1HB ALA 37 HB3 ALA 37 -0.624 -4.268 -4.100 291 2HB ALA 37 HB2 ALA 37 -1.527 -2.756 -4.011 292 3HB ALA 37 HB1 ALA 37 -1.653 -3.938 -2.707 293 H PHE 38 HN PHE 38 -3.179 -2.220 -5.641 294 HA PHE 38 HA PHE 38 -5.283 -1.226 -3.998 295 1HB PHE 38 HB2 PHE 38 -4.407 -0.610 -6.821 296 2HB PHE 38 HB1 PHE 38 -5.829 0.172 -6.133 297 HD1 PHE 38 HD2 PHE 38 -5.565 1.368 -3.863 298 HD2 PHE 38 HD1 PHE 38 -2.243 0.201 -6.324 299 HE1 PHE 38 HE2 PHE 38 -4.109 2.981 -2.666 300 HE2 PHE 38 HE1 PHE 38 -0.788 1.814 -5.128 301 HZ PHE 38 HZ PHE 38 -1.723 3.206 -3.301 302 H GLN 39 HN GLN 39 -5.394 -3.174 -6.976 303 HA GLN 39 HA GLN 39 -8.212 -3.079 -7.347 304 1HB GLN 39 HB2 GLN 39 -6.187 -5.225 -8.027 305 2HB GLN 39 HB1 GLN 39 -7.877 -5.293 -8.530 306 1HG GLN 39 HG2 GLN 39 -7.656 -3.216 -9.760 307 2HG GLN 39 HG1 GLN 39 -6.020 -2.979 -9.147 308 1HE2 GLN 39 HE22 GLN 39 -6.257 -4.824 -12.571 309 2HE2 GLN 39 HE21 GLN 39 -7.273 -3.599 -11.982 310 H LEU 40 HN LEU 40 -6.206 -5.244 -5.348 311 HA LEU 40 HA LEU 40 -8.312 -6.991 -4.550 312 1HB LEU 40 HB2 LEU 40 -5.813 -6.101 -3.083 313 2HB LEU 40 HB1 LEU 40 -6.887 -7.362 -2.488 314 HG LEU 40 HG LEU 40 -5.536 -7.429 -5.202 315 1HD1 LEU 40 HD11 LEU 40 -3.884 -7.514 -3.375 316 2HD1 LEU 40 HD13 LEU 40 -4.785 -8.826 -2.617 317 3HD1 LEU 40 HD12 LEU 40 -4.008 -9.079 -4.180 318 1HD2 LEU 40 HD22 LEU 40 -7.333 -9.307 -3.671 319 2HD2 LEU 40 HD21 LEU 40 -7.345 -8.904 -5.388 320 3HD2 LEU 40 HD23 LEU 40 -6.110 -9.983 -4.746 321 H TRP 41 HN TRP 41 -7.176 -3.903 -3.183 322 HA TRP 41 HA TRP 41 -9.092 -3.930 -1.004 323 1HB TRP 41 HB2 TRP 41 -7.448 -1.709 -2.246 324 2HB TRP 41 HB1 TRP 41 -8.487 -1.476 -0.844 325 HD1 TRP 41 HD1 TRP 41 -5.044 -2.191 -1.660 326 HE1 TRP 41 HE1 TRP 41 -3.786 -3.255 0.323 327 HE3 TRP 41 HE3 TRP 41 -9.001 -3.513 1.293 328 HZ2 TRP 41 HZ2 TRP 41 -4.378 -4.506 2.822 329 HZ3 TRP 41 HZ3 TRP 41 -8.622 -4.640 3.467 330 HH2 TRP 41 HH2 TRP 41 -6.317 -5.139 4.235 331 H SER 42 HN SER 42 -9.026 -2.439 -4.236 332 HA SER 42 HA SER 42 -11.466 -0.949 -3.914 333 1HB SER 42 HB2 SER 42 -9.811 -0.449 -5.679 334 2HB SER 42 HB1 SER 42 -10.169 -1.992 -6.449 335 HG SER 42 HG SER 42 -12.426 -0.597 -5.925 336 H ASN 43 HN ASN 43 -10.783 -4.193 -5.194 337 HA ASN 43 HA ASN 43 -13.291 -4.818 -6.275 338 1HB ASN 43 HB2 ASN 43 -11.327 -6.570 -4.782 339 2HB ASN 43 HB1 ASN 43 -12.744 -7.202 -5.622 340 1HD2 ASN 43 HD22 ASN 43 -9.772 -7.183 -7.956 341 2HD2 ASN 43 HD21 ASN 43 -10.024 -7.839 -6.411 342 H VAL 44 HN VAL 44 -12.352 -4.619 -2.887 343 HA VAL 44 HA VAL 44 -15.062 -5.616 -2.084 344 HB VAL 44 HB VAL 44 -13.996 -5.686 0.224 345 1HG1 VAL 44 HG12 VAL 44 -12.798 -7.351 -2.012 346 2HG1 VAL 44 HG11 VAL 44 -12.738 -7.768 -0.299 347 3HG1 VAL 44 HG13 VAL 44 -14.288 -7.702 -1.137 348 1HG2 VAL 44 HG21 VAL 44 -12.126 -4.113 -0.386 349 2HG2 VAL 44 HG23 VAL 44 -11.570 -5.619 0.342 350 3HG2 VAL 44 HG22 VAL 44 -11.456 -5.386 -1.401 351 H THR 45 HN THR 45 -13.891 -2.732 -2.923 352 HA THR 45 HA THR 45 -15.627 -1.348 -0.962 353 HB THR 45 HB THR 45 -13.845 0.477 -0.765 354 HG1 THR 45 HG1 THR 45 -11.817 -0.051 -1.343 355 1HG2 THR 45 HG23 THR 45 -13.276 -2.255 0.411 356 2HG2 THR 45 HG22 THR 45 -12.641 -0.729 1.018 357 3HG2 THR 45 HG21 THR 45 -14.373 -1.049 1.081 358 HA PRO 46 HA PRO 46 -16.734 0.827 -4.700 359 1HB PRO 46 HB2 PRO 46 -17.547 3.274 -3.547 360 2HB PRO 46 HB1 PRO 46 -18.574 1.849 -3.763 361 1HG PRO 46 HG2 PRO 46 -17.355 2.898 -1.272 362 2HG PRO 46 HG1 PRO 46 -18.731 1.800 -1.467 363 1HD PRO 46 HD2 PRO 46 -16.123 1.047 -0.649 364 2HD PRO 46 HD1 PRO 46 -17.414 -0.050 -1.191 365 H LEU 47 HN LEU 47 -14.111 1.490 -2.822 366 HA LEU 47 HA LEU 47 -13.335 4.095 -3.837 367 1HB LEU 47 HB2 LEU 47 -11.661 1.894 -2.590 368 2HB LEU 47 HB1 LEU 47 -11.126 3.552 -2.858 369 HG LEU 47 HG LEU 47 -13.501 2.758 -1.147 370 1HD1 LEU 47 HD11 LEU 47 -10.677 3.578 -0.406 371 2HD1 LEU 47 HD13 LEU 47 -12.009 3.455 0.743 372 3HD1 LEU 47 HD12 LEU 47 -11.437 2.016 -0.099 373 1HD2 LEU 47 HD23 LEU 47 -12.251 5.384 -1.942 374 2HD2 LEU 47 HD22 LEU 47 -13.955 4.963 -1.780 375 3HD2 LEU 47 HD21 LEU 47 -12.979 5.238 -0.342 376 H THR 48 HN THR 48 -11.864 4.561 -5.488 377 HA THR 48 HA THR 48 -11.033 2.281 -7.255 378 HB THR 48 HB THR 48 -11.553 3.665 -9.210 379 HG1 THR 48 HG1 THR 48 -13.037 5.558 -8.236 380 1HG2 THR 48 HG22 THR 48 -13.811 3.387 -7.211 381 2HG2 THR 48 HG21 THR 48 -14.058 3.791 -8.910 382 3HG2 THR 48 HG23 THR 48 -13.351 2.237 -8.466 383 H PHE 49 HN PHE 49 -8.964 2.517 -8.144 384 HA PHE 49 HA PHE 49 -7.418 4.957 -7.303 385 1HB PHE 49 HB2 PHE 49 -6.496 2.072 -7.474 386 2HB PHE 49 HB1 PHE 49 -5.452 3.450 -7.118 387 HD1 PHE 49 HD2 PHE 49 -5.627 4.653 -4.996 388 HD2 PHE 49 HD1 PHE 49 -8.158 1.292 -5.861 389 HE1 PHE 49 HE2 PHE 49 -6.281 4.531 -2.606 390 HE2 PHE 49 HE1 PHE 49 -8.811 1.169 -3.472 391 HZ PHE 49 HZ PHE 49 -7.872 2.788 -1.844 392 H THR 50 HN THR 50 -6.449 6.021 -8.938 393 HA THR 50 HA THR 50 -5.992 4.600 -11.539 394 HB THR 50 HB THR 50 -6.972 7.453 -11.227 395 HG1 THR 50 HG1 THR 50 -8.787 6.440 -10.902 396 1HG2 THR 50 HG22 THR 50 -5.618 6.999 -13.246 397 2HG2 THR 50 HG21 THR 50 -6.684 5.654 -13.650 398 3HG2 THR 50 HG23 THR 50 -7.304 7.305 -13.658 399 H LYS 51 HN LYS 51 -3.966 4.896 -12.345 400 HA LYS 51 HA LYS 51 -2.034 6.450 -10.811 401 1HB LYS 51 HB2 LYS 51 -1.386 4.338 -11.935 402 2HB LYS 51 HB1 LYS 51 -1.744 5.072 -13.500 403 1HG LYS 51 HG2 LYS 51 -0.001 6.716 -13.211 404 2HG LYS 51 HG1 LYS 51 0.263 6.216 -11.541 405 1HD LYS 51 HD2 LYS 51 1.991 5.263 -13.016 406 2HD LYS 51 HD1 LYS 51 0.991 3.989 -12.318 407 1HE LYS 51 HE2 LYS 51 -0.138 3.589 -14.336 408 2HE LYS 51 HE1 LYS 51 0.277 5.172 -14.998 409 1HZ LYS 51 HZ1 LYS 51 2.670 4.338 -14.843 410 2HZ LYS 51 HZ3 LYS 51 1.994 2.789 -14.696 411 3HZ LYS 51 HZ2 LYS 51 1.693 3.718 -16.087 412 H VAL 52 HN VAL 52 -1.098 8.431 -11.425 413 HA VAL 52 HA VAL 52 -2.311 9.778 -13.833 414 HB VAL 52 HB VAL 52 -1.943 11.917 -12.498 415 1HG1 VAL 52 HG12 VAL 52 -3.894 9.854 -11.431 416 2HG1 VAL 52 HG11 VAL 52 -4.025 11.597 -11.196 417 3HG1 VAL 52 HG13 VAL 52 -4.167 10.912 -12.815 418 1HG2 VAL 52 HG22 VAL 52 -0.400 10.954 -10.818 419 2HG2 VAL 52 HG21 VAL 52 -1.824 11.651 -10.044 420 3HG2 VAL 52 HG23 VAL 52 -1.692 9.904 -10.238 421 H SER 53 HN SER 53 -0.861 10.575 -15.277 422 HA SER 53 HA SER 53 2.023 10.266 -14.662 423 1HB SER 53 HB2 SER 53 1.057 9.373 -16.792 424 2HB SER 53 HB1 SER 53 0.684 11.026 -17.272 425 HG SER 53 HG SER 53 3.278 10.233 -16.472 426 H GLU 54 HN GLU 54 -0.286 12.722 -14.504 427 HA GLU 54 HA GLU 54 1.870 14.763 -14.362 428 1HB GLU 54 HB2 GLU 54 -0.561 14.984 -16.161 429 2HB GLU 54 HB1 GLU 54 0.430 16.364 -15.692 430 1HG GLU 54 HG2 GLU 54 2.415 15.275 -16.676 431 2HG GLU 54 HG1 GLU 54 1.420 13.899 -17.154 432 H GLY 55 HN GLY 55 1.263 16.591 -13.080 433 1HA GLY 55 HA2 GLY 55 -0.160 17.819 -11.599 434 2HA GLY 55 HA1 GLY 55 -1.401 16.578 -11.792 435 H GLN 56 HN GLN 56 -1.089 17.209 -9.248 436 HA GLN 56 HA GLN 56 1.044 15.611 -7.980 437 1HB GLN 56 HB2 GLN 56 -1.265 17.233 -6.866 438 2HB GLN 56 HB1 GLN 56 -0.109 16.357 -5.861 439 1HG GLN 56 HG2 GLN 56 1.738 17.657 -6.782 440 2HG GLN 56 HG1 GLN 56 0.640 18.480 -7.890 441 1HE2 GLN 56 HE22 GLN 56 1.129 20.599 -4.812 442 2HE2 GLN 56 HE21 GLN 56 2.202 19.914 -5.935 443 H ALA 57 HN ALA 57 0.669 13.686 -6.820 444 HA ALA 57 HA ALA 57 -1.934 12.327 -7.418 445 1HB ALA 57 HB3 ALA 57 0.336 11.331 -8.143 446 2HB ALA 57 HB2 ALA 57 0.592 10.990 -6.431 447 3HB ALA 57 HB1 ALA 57 -0.774 10.267 -7.281 448 H ASP 58 HN ASP 58 -3.138 11.457 -5.710 449 HA ASP 58 HA ASP 58 -2.955 12.710 -3.165 450 1HB ASP 58 HB2 ASP 58 -4.313 10.138 -4.022 451 2HB ASP 58 HB1 ASP 58 -4.504 10.848 -2.419 452 H ILE 59 HN ILE 59 -1.745 9.586 -4.325 453 HA ILE 59 HA ILE 59 -0.194 9.299 -1.763 454 HB ILE 59 HB ILE 59 -1.190 7.149 -3.658 455 1HG1 ILE 59 HG12 ILE 59 -2.033 7.762 -0.809 456 2HG1 ILE 59 HG11 ILE 59 -2.918 8.330 -2.225 457 1HG2 ILE 59 HG23 ILE 59 0.364 7.054 -1.057 458 2HG2 ILE 59 HG22 ILE 59 -0.416 5.648 -1.780 459 3HG2 ILE 59 HG21 ILE 59 0.892 6.467 -2.634 460 1HD1 ILE 59 HD11 ILE 59 -2.321 5.423 -1.605 461 2HD1 ILE 59 HD13 ILE 59 -3.869 6.220 -1.326 462 3HD1 ILE 59 HD12 ILE 59 -3.263 6.022 -2.970 463 H MET 60 HN MET 60 1.928 9.656 -2.070 464 HA MET 60 HA MET 60 3.097 9.355 -4.799 465 1HB MET 60 HB2 MET 60 4.254 10.629 -2.297 466 2HB MET 60 HB1 MET 60 4.959 10.686 -3.913 467 1HG MET 60 HG2 MET 60 2.226 11.786 -3.189 468 2HG MET 60 HG1 MET 60 3.686 12.761 -3.344 469 1HE MET 60 HE3 MET 60 5.285 12.365 -5.514 470 2HE MET 60 HE2 MET 60 4.499 13.009 -6.953 471 3HE MET 60 HE1 MET 60 4.375 13.879 -5.426 472 H ILE 61 HN ILE 61 4.395 7.632 -5.225 473 HA ILE 61 HA ILE 61 5.421 5.991 -2.924 474 HB ILE 61 HB ILE 61 4.845 5.150 -5.783 475 1HG1 ILE 61 HG12 ILE 61 3.400 4.377 -3.230 476 2HG1 ILE 61 HG11 ILE 61 2.839 5.654 -4.310 477 1HG2 ILE 61 HG21 ILE 61 5.834 3.672 -3.335 478 2HG2 ILE 61 HG23 ILE 61 5.175 2.853 -4.750 479 3HG2 ILE 61 HG22 ILE 61 6.638 3.826 -4.897 480 1HD1 ILE 61 HD13 ILE 61 2.768 4.014 -6.177 481 2HD1 ILE 61 HD12 ILE 61 3.257 2.745 -5.054 482 3HD1 ILE 61 HD11 ILE 61 1.702 3.551 -4.851 483 H SER 62 HN SER 62 7.629 5.868 -2.731 484 HA SER 62 HA SER 62 9.316 6.279 -5.137 485 1HB SER 62 HB2 SER 62 10.565 8.100 -4.200 486 2HB SER 62 HB1 SER 62 8.862 8.535 -4.070 487 HG SER 62 HG SER 62 10.524 8.557 -2.142 488 H PHE 63 HN PHE 63 11.553 5.675 -4.765 489 HA PHE 63 HA PHE 63 11.910 3.780 -2.460 490 1HB PHE 63 HB2 PHE 63 13.080 3.782 -5.265 491 2HB PHE 63 HB1 PHE 63 13.574 2.668 -3.990 492 HD1 PHE 63 HD1 PHE 63 10.850 3.633 -6.281 493 HD2 PHE 63 HD2 PHE 63 12.084 0.900 -3.203 494 HE1 PHE 63 HE1 PHE 63 8.937 2.146 -6.830 495 HE2 PHE 63 HE2 PHE 63 10.175 -0.583 -3.756 496 HZ PHE 63 HZ PHE 63 8.603 0.040 -5.568 497 H VAL 64 HN VAL 64 13.724 4.137 -1.139 498 HA VAL 64 HA VAL 64 15.779 6.102 -2.089 499 HB VAL 64 HB VAL 64 15.693 7.290 0.063 500 1HG1 VAL 64 HG13 VAL 64 14.265 7.984 -1.899 501 2HG1 VAL 64 HG12 VAL 64 12.924 7.111 -1.157 502 3HG1 VAL 64 HG11 VAL 64 13.639 8.496 -0.332 503 1HG2 VAL 64 HG22 VAL 64 13.493 5.287 0.611 504 2HG2 VAL 64 HG21 VAL 64 14.918 5.635 1.589 505 3HG2 VAL 64 HG23 VAL 64 13.606 6.809 1.494 506 H ARG 65 HN ARG 65 17.673 6.163 -0.517 507 HA ARG 65 HA ARG 65 18.112 3.524 0.836 508 1HB ARG 65 HB2 ARG 65 19.940 4.922 -1.143 509 2HB ARG 65 HB1 ARG 65 20.467 3.607 -0.091 510 1HG ARG 65 HG2 ARG 65 18.742 2.141 -1.044 511 2HG ARG 65 HG1 ARG 65 18.205 3.453 -2.097 512 1HD ARG 65 HD2 ARG 65 19.681 2.013 -3.374 513 2HD ARG 65 HD1 ARG 65 20.519 3.534 -3.069 514 HE ARG 65 HE ARG 65 21.299 1.911 -0.961 515 1HH1 ARG 65 HH21 ARG 65 21.234 1.702 -4.399 516 2HH1 ARG 65 HH22 ARG 65 22.635 0.688 -4.500 517 1HH2 ARG 65 HH11 ARG 65 23.136 0.592 -1.069 518 2HH2 ARG 65 HH12 ARG 65 23.711 0.060 -2.613 519 H GLY 66 HN GLY 66 19.863 3.631 2.450 520 1HA GLY 66 HA2 GLY 66 20.759 4.665 4.365 521 2HA GLY 66 HA1 GLY 66 21.378 5.837 3.203 522 H ASP 67 HN ASP 67 21.052 7.436 4.943 523 HA ASP 67 HA ASP 67 18.410 8.030 5.951 524 1HB ASP 67 HB2 ASP 67 20.474 8.754 7.116 525 2HB ASP 67 HB1 ASP 67 20.860 9.816 5.761 526 H HIS 68 HN HIS 68 16.804 9.169 4.972 527 HA HIS 68 HA HIS 68 17.471 10.838 2.566 528 1HB HIS 68 HB2 HIS 68 15.336 10.029 1.561 529 2HB HIS 68 HB1 HIS 68 16.509 8.732 1.791 530 HD1 HIS 68 HD1 HIS 68 16.185 7.376 4.173 531 HD2 HIS 68 HD2 HIS 68 12.893 9.498 2.745 532 HE1 HIS 68 HE1 HIS 68 14.160 6.456 5.384 533 H ARG 69 HN ARG 69 17.358 12.332 4.667 534 HA ARG 69 HA ARG 69 16.183 13.999 5.826 535 1HB ARG 69 HB2 ARG 69 14.409 13.755 3.375 536 2HB ARG 69 HB1 ARG 69 14.362 15.087 4.530 537 1HG ARG 69 HG2 ARG 69 16.735 15.593 4.031 538 2HG ARG 69 HG1 ARG 69 16.755 14.283 2.850 539 1HD ARG 69 HD2 ARG 69 16.365 16.351 1.654 540 2HD ARG 69 HD1 ARG 69 14.861 15.430 1.653 541 HE ARG 69 HE ARG 69 14.659 17.044 3.901 542 1HH1 ARG 69 HH21 ARG 69 15.288 17.490 0.540 543 2HH1 ARG 69 HH22 ARG 69 14.574 19.068 0.482 544 1HH2 ARG 69 HH11 ARG 69 13.734 19.101 3.846 545 2HH2 ARG 69 HH12 ARG 69 13.703 19.983 2.355 546 H ASP 70 HN ASP 70 15.665 11.571 6.904 547 HA ASP 70 HA ASP 70 12.802 11.811 7.691 548 1HB ASP 70 HB2 ASP 70 13.057 10.031 5.900 549 2HB ASP 70 HB1 ASP 70 14.084 9.146 7.029 550 H ASN 71 HN ASN 71 12.387 10.726 9.779 551 HA ASN 71 HA ASN 71 14.765 10.900 11.532 552 1HB ASN 71 HB2 ASN 71 11.799 10.642 12.073 553 2HB ASN 71 HB1 ASN 71 13.015 10.591 13.351 554 1HD2 ASN 71 HD22 ASN 71 11.838 14.158 12.012 555 2HD2 ASN 71 HD21 ASN 71 10.985 12.716 11.740 556 H SER 72 HN SER 72 13.698 8.516 9.647 557 HA SER 72 HA SER 72 14.437 6.394 11.636 558 1HB SER 72 HB2 SER 72 12.259 6.182 9.540 559 2HB SER 72 HB1 SER 72 12.759 4.910 10.650 560 HG SER 72 HG SER 72 10.899 6.574 11.105 561 HA PRO 73 HA PRO 73 16.889 6.305 7.617 562 1HB PRO 73 HB2 PRO 73 19.299 5.980 9.187 563 2HB PRO 73 HB1 PRO 73 18.846 7.356 8.172 564 1HG PRO 73 HG2 PRO 73 18.886 7.233 11.067 565 2HG PRO 73 HG1 PRO 73 18.471 8.616 10.044 566 1HD PRO 73 HD2 PRO 73 16.668 6.989 11.614 567 2HD PRO 73 HD1 PRO 73 16.262 8.360 10.564 568 H PHE 74 HN PHE 74 17.631 4.327 6.737 569 HA PHE 74 HA PHE 74 16.925 1.926 8.226 570 1HB PHE 74 HB2 PHE 74 18.261 2.322 5.529 571 2HB PHE 74 HB1 PHE 74 17.759 0.756 6.170 572 HD1 PHE 74 HD1 PHE 74 15.263 0.681 7.084 573 HD2 PHE 74 HD2 PHE 74 16.731 3.500 4.194 574 HE1 PHE 74 HE1 PHE 74 12.946 1.082 6.298 575 HE2 PHE 74 HE2 PHE 74 14.409 3.902 3.410 576 HZ PHE 74 HZ PHE 74 12.519 2.694 4.464 577 H ASP 75 HN ASP 75 18.390 0.286 8.934 578 HA ASP 75 HA ASP 75 21.289 1.058 9.018 579 1HB ASP 75 HB2 ASP 75 20.159 1.622 11.176 580 2HB ASP 75 HB1 ASP 75 19.699 -0.073 11.340 581 H GLY 76 HN GLY 76 21.153 -0.588 7.173 582 1HA GLY 76 HA2 GLY 76 22.086 -2.700 6.606 583 2HA GLY 76 HA1 GLY 76 21.885 -3.217 8.278 584 HA PRO 77 HA PRO 77 18.588 -5.099 5.490 585 1HB PRO 77 HB2 PRO 77 19.281 -7.729 6.391 586 2HB PRO 77 HB1 PRO 77 19.601 -7.036 4.795 587 1HG PRO 77 HG2 PRO 77 21.503 -7.560 6.958 588 2HG PRO 77 HG1 PRO 77 21.839 -7.071 5.290 589 1HD PRO 77 HD2 PRO 77 22.035 -5.434 7.641 590 2HD PRO 77 HD1 PRO 77 22.237 -4.915 5.956 591 H GLY 78 HN GLY 78 19.438 -4.811 8.732 592 1HA GLY 78 HA2 GLY 78 17.074 -6.297 9.762 593 2HA GLY 78 HA1 GLY 78 18.351 -5.578 10.743 594 H GLY 79 HN GLY 79 16.007 -4.936 11.697 595 1HA GLY 79 HA2 GLY 79 14.873 -2.970 12.374 596 2HA GLY 79 HA1 GLY 79 15.765 -2.072 11.145 597 H ASN 80 HN ASN 80 13.515 -1.128 10.813 598 HA ASN 80 HA ASN 80 11.461 -2.784 9.637 599 1HB ASN 80 HB2 ASN 80 11.922 0.209 9.644 600 2HB ASN 80 HB1 ASN 80 10.508 -0.546 8.907 601 1HD2 ASN 80 HD22 ASN 80 9.800 0.327 12.528 602 2HD2 ASN 80 HD21 ASN 80 10.401 1.239 11.228 603 H LEU 81 HN LEU 81 10.953 -3.067 7.445 604 HA LEU 81 HA LEU 81 13.214 -2.656 5.573 605 1HB LEU 81 HB2 LEU 81 10.570 -4.108 5.214 606 2HB LEU 81 HB1 LEU 81 11.901 -4.107 4.058 607 HG LEU 81 HG LEU 81 12.037 -5.171 6.899 608 1HD1 LEU 81 HD11 LEU 81 10.676 -6.516 5.256 609 2HD1 LEU 81 HD13 LEU 81 12.127 -6.675 4.266 610 3HD1 LEU 81 HD12 LEU 81 12.084 -7.370 5.887 611 1HD2 LEU 81 HD21 LEU 81 14.079 -4.786 4.715 612 2HD2 LEU 81 HD23 LEU 81 14.245 -4.543 6.455 613 3HD2 LEU 81 HD22 LEU 81 14.236 -6.175 5.792 614 H ALA 82 HN ALA 82 10.480 -0.975 6.531 615 HA ALA 82 HA ALA 82 10.741 1.012 4.490 616 1HB ALA 82 HB1 ALA 82 8.506 -1.001 4.149 617 2HB ALA 82 HB3 ALA 82 8.428 0.620 3.458 618 3HB ALA 82 HB2 ALA 82 9.698 -0.494 2.953 619 H HIS 83 HN HIS 83 8.587 2.464 4.565 620 HA HIS 83 HA HIS 83 7.037 2.294 7.009 621 1HB HIS 83 HB2 HIS 83 7.951 4.369 8.052 622 2HB HIS 83 HB1 HIS 83 9.127 3.056 8.021 623 HD1 HIS 83 HD1 HIS 83 10.869 3.155 5.926 624 HD2 HIS 83 HD2 HIS 83 8.831 6.684 6.804 625 HE1 HIS 83 HE1 HIS 83 12.152 5.024 4.796 626 H ALA 84 HN ALA 84 5.700 4.390 7.263 627 HA ALA 84 HA ALA 84 5.448 5.944 4.746 628 1HB ALA 84 HB3 ALA 84 4.018 3.818 4.618 629 2HB ALA 84 HB2 ALA 84 3.044 4.524 5.908 630 3HB ALA 84 HB1 ALA 84 3.175 5.344 4.352 631 H PHE 85 HN PHE 85 3.926 7.779 5.012 632 HA PHE 85 HA PHE 85 3.997 8.802 7.809 633 1HB PHE 85 HB2 PHE 85 3.489 10.143 5.138 634 2HB PHE 85 HB1 PHE 85 3.327 10.974 6.684 635 HD1 PHE 85 HD1 PHE 85 5.272 11.447 8.079 636 HD2 PHE 85 HD2 PHE 85 5.681 9.439 4.302 637 HE1 PHE 85 HE1 PHE 85 7.717 11.866 8.122 638 HE2 PHE 85 HE2 PHE 85 8.126 9.854 4.349 639 HZ PHE 85 HZ PHE 85 9.143 11.068 6.257 640 H GLN 86 HN GLN 86 2.009 9.999 8.567 641 HA GLN 86 HA GLN 86 -0.283 8.325 8.433 642 1HB GLN 86 HB2 GLN 86 -0.028 11.222 9.284 643 2HB GLN 86 HB1 GLN 86 -1.456 10.228 9.569 644 1HG GLN 86 HG2 GLN 86 1.305 9.425 10.511 645 2HG GLN 86 HG1 GLN 86 0.192 10.363 11.507 646 1HE2 GLN 86 HE22 GLN 86 -0.397 6.375 11.051 647 2HE2 GLN 86 HE21 GLN 86 0.903 7.167 10.300 648 HA PRO 87 HA PRO 87 -2.156 9.680 4.620 649 1HB PRO 87 HB2 PRO 87 -4.881 9.639 5.573 650 2HB PRO 87 HB1 PRO 87 -4.052 8.390 4.633 651 1HG PRO 87 HG2 PRO 87 -4.759 8.342 7.467 652 2HG PRO 87 HG1 PRO 87 -4.079 7.037 6.483 653 1HD PRO 87 HD2 PRO 87 -2.711 8.555 8.496 654 2HD PRO 87 HD1 PRO 87 -2.005 7.364 7.381 655 H GLY 88 HN GLY 88 -1.796 11.872 4.238 656 1HA GLY 88 HA2 GLY 88 -3.781 13.788 5.039 657 2HA GLY 88 HA1 GLY 88 -2.331 13.985 6.019 658 HA PRO 89 HA PRO 89 -2.120 16.214 1.781 659 1HB PRO 89 HB2 PRO 89 -1.711 18.702 3.204 660 2HB PRO 89 HB1 PRO 89 -3.077 18.258 2.172 661 1HG PRO 89 HG2 PRO 89 -2.994 18.420 5.091 662 2HG PRO 89 HG1 PRO 89 -4.399 18.164 4.045 663 1HD PRO 89 HD2 PRO 89 -3.161 16.213 5.717 664 2HD PRO 89 HD1 PRO 89 -4.401 15.917 4.480 665 H GLY 90 HN GLY 90 -0.170 17.910 1.393 666 1HA GLY 90 HA2 GLY 90 2.151 18.219 1.396 667 2HA GLY 90 HA1 GLY 90 2.085 17.888 3.125 668 H ILE 91 HN ILE 91 3.553 16.339 3.571 669 HA ILE 91 HA ILE 91 4.276 14.307 1.594 670 HB ILE 91 HB ILE 91 5.922 15.385 3.142 671 1HG1 ILE 91 HG12 ILE 91 5.779 12.416 3.697 672 2HG1 ILE 91 HG11 ILE 91 6.168 13.037 2.094 673 1HG2 ILE 91 HG22 ILE 91 4.363 15.400 5.118 674 2HG2 ILE 91 HG21 ILE 91 4.615 13.661 5.268 675 3HG2 ILE 91 HG23 ILE 91 5.969 14.770 5.481 676 1HD1 ILE 91 HD13 ILE 91 7.664 13.729 4.638 677 2HD1 ILE 91 HD12 ILE 91 8.216 12.590 3.410 678 3HD1 ILE 91 HD11 ILE 91 8.059 14.302 3.017 679 H GLY 92 HN GLY 92 1.878 14.566 3.991 680 1HA GLY 92 HA2 GLY 92 1.741 11.976 5.092 681 2HA GLY 92 HA1 GLY 92 0.328 12.984 4.780 682 H GLY 93 HN GLY 93 0.849 10.022 4.367 683 1HA GLY 93 HA2 GLY 93 -0.221 8.538 2.845 684 2HA GLY 93 HA1 GLY 93 -0.402 9.870 1.704 685 H ASP 94 HN ASP 94 2.563 10.510 2.131 686 HA ASP 94 HA ASP 94 3.558 9.086 -0.133 687 1HB ASP 94 HB2 ASP 94 5.040 10.542 2.076 688 2HB ASP 94 HB1 ASP 94 5.799 9.949 0.598 689 H ALA 95 HN ALA 95 4.731 7.193 -0.303 690 HA ALA 95 HA ALA 95 5.232 5.647 2.230 691 1HB ALA 95 HB1 ALA 95 4.242 4.752 -0.485 692 2HB ALA 95 HB3 ALA 95 4.946 3.621 0.672 693 3HB ALA 95 HB2 ALA 95 3.481 4.511 1.088 694 H HIS 96 HN HIS 96 7.340 5.127 2.545 695 HA HIS 96 HA HIS 96 9.235 5.379 0.231 696 1HB HIS 96 HB2 HIS 96 9.671 5.646 3.219 697 2HB HIS 96 HB1 HIS 96 10.971 5.649 2.028 698 HD2 HIS 96 HD2 HIS 96 8.235 7.735 0.349 699 HE1 HIS 96 HE1 HIS 96 10.508 10.323 2.844 700 HE2 HIS 96 HE2 HIS 96 8.799 10.213 0.976 701 H PHE 97 HN PHE 97 10.270 3.566 -0.431 702 HA PHE 97 HA PHE 97 10.043 1.096 1.260 703 1HB PHE 97 HB2 PHE 97 10.233 1.532 -1.722 704 2HB PHE 97 HB1 PHE 97 10.527 -0.044 -0.991 705 HD1 PHE 97 HD1 PHE 97 8.011 2.593 -1.598 706 HD2 PHE 97 HD2 PHE 97 8.723 -1.332 -0.007 707 HE1 PHE 97 HE1 PHE 97 5.565 2.192 -1.493 708 HE2 PHE 97 HE2 PHE 97 6.278 -1.733 0.096 709 HZ PHE 97 HZ PHE 97 4.699 0.027 -0.646 710 H ASP 98 HN ASP 98 11.902 0.175 1.984 711 HA ASP 98 HA ASP 98 14.431 1.525 1.661 712 1HB ASP 98 HB2 ASP 98 13.737 0.159 3.666 713 2HB ASP 98 HB1 ASP 98 13.964 -1.289 2.682 714 H GLU 99 HN GLU 99 15.381 1.502 -0.350 715 HA GLU 99 HA GLU 99 15.171 -0.830 -2.104 716 1HB GLU 99 HB2 GLU 99 15.341 1.660 -2.797 717 2HB GLU 99 HB1 GLU 99 17.060 1.484 -2.483 718 1HG GLU 99 HG2 GLU 99 16.669 1.080 -4.843 719 2HG GLU 99 HG1 GLU 99 17.106 -0.446 -4.088 720 H ASP 100 HN ASP 100 16.920 -0.410 0.619 721 HA ASP 100 HA ASP 100 19.563 -1.212 -0.257 722 1HB ASP 100 HB2 ASP 100 18.203 -1.338 2.450 723 2HB ASP 100 HB1 ASP 100 19.882 -1.797 2.185 724 H GLU 101 HN GLU 101 16.698 -2.944 0.926 725 HA GLU 101 HA GLU 101 18.061 -5.545 0.729 726 1HB GLU 101 HB2 GLU 101 15.181 -4.766 1.288 727 2HB GLU 101 HB1 GLU 101 15.739 -6.437 1.215 728 1HG GLU 101 HG2 GLU 101 15.821 -5.866 3.521 729 2HG GLU 101 HG1 GLU 101 17.492 -5.766 2.970 730 H ARG 102 HN ARG 102 17.187 -7.241 -0.753 731 HA ARG 102 HA ARG 102 16.739 -6.085 -3.425 732 1HB ARG 102 HB2 ARG 102 18.356 -7.953 -3.058 733 2HB ARG 102 HB1 ARG 102 17.018 -8.981 -2.561 734 1HG ARG 102 HG2 ARG 102 17.342 -9.534 -4.833 735 2HG ARG 102 HG1 ARG 102 15.980 -8.423 -4.873 736 1HD ARG 102 HD2 ARG 102 17.416 -6.588 -5.543 737 2HD ARG 102 HD1 ARG 102 18.859 -7.570 -5.299 738 HE ARG 102 HE ARG 102 17.368 -8.990 -7.164 739 1HH1 ARG 102 HH21 ARG 102 18.607 -5.793 -6.815 740 2HH1 ARG 102 HH22 ARG 102 18.773 -5.527 -8.518 741 1HH2 ARG 102 HH11 ARG 102 17.576 -8.663 -9.393 742 2HH2 ARG 102 HH12 ARG 102 18.191 -7.153 -9.978 743 H TRP 103 HN TRP 103 14.746 -5.856 -4.282 744 HA TRP 103 HA TRP 103 12.422 -7.083 -2.910 745 1HB TRP 103 HB2 TRP 103 12.626 -5.056 -5.159 746 2HB TRP 103 HB1 TRP 103 11.109 -5.622 -4.464 747 HD1 TRP 103 HD1 TRP 103 13.629 -2.995 -4.082 748 HE1 TRP 103 HE1 TRP 103 13.347 -1.760 -1.839 749 HE3 TRP 103 HE3 TRP 103 10.449 -6.207 -1.699 750 HZ2 TRP 103 HZ2 TRP 103 11.959 -2.090 0.639 751 HZ3 TRP 103 HZ3 TRP 103 9.664 -5.720 0.602 752 HH2 TRP 103 HH2 TRP 103 10.415 -3.667 1.773 753 H THR 104 HN THR 104 11.231 -8.731 -3.796 754 HA THR 104 HA THR 104 11.766 -9.522 -6.639 755 HB THR 104 HB THR 104 11.618 -11.901 -5.928 756 HG1 THR 104 HG1 THR 104 12.210 -11.690 -3.390 757 1HG2 THR 104 HG23 THR 104 13.812 -10.763 -6.192 758 2HG2 THR 104 HG22 THR 104 13.779 -10.358 -4.476 759 3HG2 THR 104 HG21 THR 104 13.857 -12.045 -4.982 760 H ASN 105 HN ASN 105 9.985 -10.853 -7.529 761 HA ASN 105 HA ASN 105 7.339 -10.099 -6.322 762 1HB ASN 105 HB2 ASN 105 8.182 -10.581 -9.195 763 2HB ASN 105 HB1 ASN 105 6.502 -10.399 -8.688 764 1HD2 ASN 105 HD22 ASN 105 8.217 -7.065 -9.613 765 2HD2 ASN 105 HD21 ASN 105 8.347 -8.582 -10.364 766 H ASN 106 HN ASN 106 9.004 -12.483 -5.692 767 HA ASN 106 HA ASN 106 6.938 -14.539 -6.280 768 1HB ASN 106 HB2 ASN 106 8.953 -16.132 -6.760 769 2HB ASN 106 HB1 ASN 106 8.412 -15.047 -8.041 770 1HD2 ASN 106 HD22 ASN 106 11.716 -13.838 -8.271 771 2HD2 ASN 106 HD21 ASN 106 10.398 -14.548 -9.071 772 H PHE 107 HN PHE 107 8.334 -16.713 -5.170 773 HA PHE 107 HA PHE 107 8.079 -16.073 -2.344 774 1HB PHE 107 HB2 PHE 107 8.519 -18.475 -1.997 775 2HB PHE 107 HB1 PHE 107 7.280 -18.218 -3.225 776 HD1 PHE 107 HD2 PHE 107 7.756 -18.592 -5.602 777 HD2 PHE 107 HD1 PHE 107 10.729 -19.301 -2.585 778 HE1 PHE 107 HE2 PHE 107 9.118 -19.861 -7.242 779 HE2 PHE 107 HE1 PHE 107 12.091 -20.573 -4.226 780 HZ PHE 107 HZ PHE 107 11.283 -20.852 -6.554 781 H ARG 108 HN ARG 108 10.526 -15.247 -4.224 782 HA ARG 108 HA ARG 108 12.863 -16.402 -3.074 783 1HB ARG 108 HB2 ARG 108 12.332 -13.726 -4.373 784 2HB ARG 108 HB1 ARG 108 13.929 -14.161 -3.781 785 1HG ARG 108 HG2 ARG 108 13.934 -16.166 -5.191 786 2HG ARG 108 HG1 ARG 108 12.333 -15.765 -5.795 787 1HD ARG 108 HD2 ARG 108 13.193 -13.659 -6.719 788 2HD ARG 108 HD1 ARG 108 14.797 -14.006 -6.087 789 HE ARG 108 HE ARG 108 13.650 -14.952 -8.566 790 1HH1 ARG 108 HH21 ARG 108 15.582 -16.036 -5.914 791 2HH1 ARG 108 HH22 ARG 108 16.219 -17.395 -6.780 792 1HH2 ARG 108 HH11 ARG 108 14.476 -16.694 -9.691 793 2HH2 ARG 108 HH12 ARG 108 15.594 -17.766 -8.916 794 H GLU 109 HN GLU 109 14.233 -14.047 -2.093 795 HA GLU 109 HA GLU 109 13.952 -14.304 0.642 796 1HB GLU 109 HB2 GLU 109 14.747 -11.838 -0.924 797 2HB GLU 109 HB1 GLU 109 14.974 -12.018 0.816 798 1HG GLU 109 HG2 GLU 109 16.361 -14.022 0.433 799 2HG GLU 109 HG1 GLU 109 16.139 -13.843 -1.308 800 H TYR 110 HN TYR 110 12.498 -11.515 -1.159 801 HA TYR 110 HA TYR 110 10.273 -11.550 0.856 802 1HB TYR 110 HB2 TYR 110 11.801 -9.091 -0.032 803 2HB TYR 110 HB1 TYR 110 10.395 -9.101 1.031 804 HD1 TYR 110 HD2 TYR 110 10.544 -9.963 3.319 805 HD2 TYR 110 HD1 TYR 110 13.966 -9.910 0.727 806 HE1 TYR 110 HE2 TYR 110 12.025 -10.371 5.265 807 HE2 TYR 110 HE1 TYR 110 15.448 -10.316 2.673 808 HH TYR 110 HH TYR 110 15.378 -9.966 5.137 809 H ASN 111 HN ASN 111 8.275 -10.904 0.084 810 HA ASN 111 HA ASN 111 8.048 -10.628 -2.873 811 1HB ASN 111 HB2 ASN 111 6.660 -12.317 -1.577 812 2HB ASN 111 HB1 ASN 111 5.827 -10.952 -0.833 813 1HD2 ASN 111 HD22 ASN 111 3.663 -11.630 -3.670 814 2HD2 ASN 111 HD21 ASN 111 3.948 -12.154 -2.081 815 H LEU 112 HN LEU 112 8.007 -8.553 -3.611 816 HA LEU 112 HA LEU 112 7.680 -6.246 -1.988 817 1HB LEU 112 HB2 LEU 112 8.747 -6.197 -4.217 818 2HB LEU 112 HB1 LEU 112 7.194 -6.555 -4.968 819 HG LEU 112 HG LEU 112 6.282 -4.425 -3.997 820 1HD1 LEU 112 HD11 LEU 112 9.108 -4.246 -2.964 821 2HD1 LEU 112 HD13 LEU 112 8.188 -2.778 -3.295 822 3HD1 LEU 112 HD12 LEU 112 7.595 -3.939 -2.111 823 1HD2 LEU 112 HD23 LEU 112 7.404 -4.656 -6.305 824 2HD2 LEU 112 HD22 LEU 112 7.240 -3.026 -5.654 825 3HD2 LEU 112 HD21 LEU 112 8.794 -3.854 -5.573 826 H HIS 113 HN HIS 113 5.312 -8.023 -3.960 827 HA HIS 113 HA HIS 113 3.178 -6.182 -3.693 828 1HB HIS 113 HB2 HIS 113 3.166 -8.124 -5.238 829 2HB HIS 113 HB1 HIS 113 2.987 -9.201 -3.853 830 HD1 HIS 113 HD1 HIS 113 0.739 -8.928 -2.431 831 HD2 HIS 113 HD2 HIS 113 0.805 -6.890 -6.066 832 HE1 HIS 113 HE1 HIS 113 -1.655 -8.264 -2.929 833 H ARG 114 HN ARG 114 3.958 -9.009 -1.631 834 HA ARG 114 HA ARG 114 1.791 -8.676 0.175 835 1HB ARG 114 HB2 ARG 114 3.271 -10.683 0.079 836 2HB ARG 114 HB1 ARG 114 4.560 -9.731 0.818 837 1HG ARG 114 HG2 ARG 114 3.162 -9.325 2.791 838 2HG ARG 114 HG1 ARG 114 1.840 -10.220 2.057 839 1HD ARG 114 HD2 ARG 114 4.569 -11.379 2.652 840 2HD ARG 114 HD1 ARG 114 3.174 -11.576 3.706 841 HE ARG 114 HE ARG 114 3.799 -13.106 1.340 842 1HH1 ARG 114 HH21 ARG 114 1.117 -11.619 2.939 843 2HH1 ARG 114 HH22 ARG 114 -0.062 -12.549 2.078 844 1HH2 ARG 114 HH11 ARG 114 2.272 -14.316 0.235 845 2HH2 ARG 114 HH12 ARG 114 0.588 -14.072 0.558 846 H VAL 115 HN VAL 115 5.084 -7.309 0.270 847 HA VAL 115 HA VAL 115 4.680 -5.971 2.793 848 HB VAL 115 HB VAL 115 6.652 -5.501 0.539 849 1HG1 VAL 115 HG13 VAL 115 6.380 -4.211 3.258 850 2HG1 VAL 115 HG12 VAL 115 7.924 -4.271 2.409 851 3HG1 VAL 115 HG11 VAL 115 6.556 -3.424 1.690 852 1HG2 VAL 115 HG23 VAL 115 6.772 -6.941 3.201 853 2HG2 VAL 115 HG22 VAL 115 7.005 -7.629 1.594 854 3HG2 VAL 115 HG21 VAL 115 8.210 -6.531 2.266 855 H ALA 116 HN ALA 116 4.327 -4.979 -0.605 856 HA ALA 116 HA ALA 116 3.778 -2.228 -0.121 857 1HB ALA 116 HB1 ALA 116 4.165 -3.236 -2.382 858 2HB ALA 116 HB3 ALA 116 2.568 -3.978 -2.284 859 3HB ALA 116 HB2 ALA 116 2.724 -2.221 -2.319 860 H ALA 117 HN ALA 117 1.660 -5.081 -0.129 861 HA ALA 117 HA ALA 117 -0.817 -3.730 0.172 862 1HB ALA 117 HB3 ALA 117 -0.420 -6.230 -0.216 863 2HB ALA 117 HB2 ALA 117 -0.133 -6.349 1.519 864 3HB ALA 117 HB1 ALA 117 -1.704 -5.816 0.920 865 H HIS 118 HN HIS 118 1.569 -4.759 2.613 866 HA HIS 118 HA HIS 118 0.039 -4.075 4.914 867 1HB HIS 118 HB2 HIS 118 2.168 -5.348 4.979 868 2HB HIS 118 HB1 HIS 118 3.043 -3.878 4.553 869 HD1 HIS 118 HD1 HIS 118 1.530 -5.664 7.403 870 HD2 HIS 118 HD2 HIS 118 2.878 -1.798 6.619 871 HE1 HIS 118 HE1 HIS 118 1.742 -4.510 9.647 872 H GLU 119 HN GLU 119 2.426 -2.067 3.122 873 HA GLU 119 HA GLU 119 2.036 0.266 4.736 874 1HB GLU 119 HB2 GLU 119 2.981 -0.044 1.873 875 2HB GLU 119 HB1 GLU 119 2.978 1.495 2.728 876 1HG GLU 119 HG2 GLU 119 5.165 0.696 3.080 877 2HG GLU 119 HG1 GLU 119 4.334 0.234 4.563 878 H LEU 120 HN LEU 120 0.418 -0.831 1.762 879 HA LEU 120 HA LEU 120 -1.139 1.542 1.381 880 1HB LEU 120 HB2 LEU 120 -1.702 -1.336 0.619 881 2HB LEU 120 HB1 LEU 120 -2.680 0.029 0.086 882 HG LEU 120 HG LEU 120 0.298 -0.247 -0.420 883 1HD1 LEU 120 HD13 LEU 120 -0.997 -1.966 -1.619 884 2HD1 LEU 120 HD12 LEU 120 -2.055 -0.717 -2.274 885 3HD1 LEU 120 HD11 LEU 120 -0.356 -0.768 -2.743 886 1HD2 LEU 120 HD22 LEU 120 -1.776 1.828 -1.095 887 2HD2 LEU 120 HD21 LEU 120 -0.097 2.045 -0.601 888 3HD2 LEU 120 HD23 LEU 120 -0.472 1.535 -2.243 889 H GLY 121 HN GLY 121 -1.689 -1.390 3.295 890 1HA GLY 121 HA2 GLY 121 -4.371 -0.878 4.046 891 2HA GLY 121 HA1 GLY 121 -3.217 -1.773 5.038 892 H HIS 122 HN HIS 122 -1.314 0.321 5.422 893 HA HIS 122 HA HIS 122 -2.509 1.696 7.643 894 1HB HIS 122 HB2 HIS 122 0.074 2.140 6.128 895 2HB HIS 122 HB1 HIS 122 -0.375 3.088 7.547 896 HD1 HIS 122 HD1 HIS 122 -1.736 0.724 9.119 897 HD2 HIS 122 HD2 HIS 122 2.055 0.572 7.393 898 HE1 HIS 122 HE1 HIS 122 -0.470 -1.097 10.335 899 H SER 123 HN SER 123 -1.809 2.674 4.306 900 HA SER 123 HA SER 123 -2.511 5.421 4.566 901 1HB SER 123 HB2 SER 123 -1.413 4.402 2.557 902 2HB SER 123 HB1 SER 123 -2.949 3.641 2.150 903 HG SER 123 HG SER 123 -2.912 5.548 1.057 904 H LEU 124 HN LEU 124 -4.470 2.518 4.185 905 HA LEU 124 HA LEU 124 -6.935 4.026 3.730 906 1HB LEU 124 HB2 LEU 124 -6.508 1.110 4.440 907 2HB LEU 124 HB1 LEU 124 -8.028 1.821 3.906 908 HG LEU 124 HG LEU 124 -5.462 1.798 2.287 909 1HD1 LEU 124 HD11 LEU 124 -6.481 -0.454 2.590 910 2HD1 LEU 124 HD13 LEU 124 -7.999 0.169 1.942 911 3HD1 LEU 124 HD12 LEU 124 -6.565 0.098 0.917 912 1HD2 LEU 124 HD22 LEU 124 -8.235 2.898 1.825 913 2HD2 LEU 124 HD21 LEU 124 -6.674 3.642 1.479 914 3HD2 LEU 124 HD23 LEU 124 -7.277 2.346 0.452 915 H GLY 125 HN GLY 125 -5.023 3.590 6.394 916 1HA GLY 125 HA2 GLY 125 -5.483 4.333 8.599 917 2HA GLY 125 HA1 GLY 125 -7.191 4.434 8.184 918 H LEU 126 HN LEU 126 -5.504 1.455 7.501 919 HA LEU 126 HA LEU 126 -7.272 0.042 9.361 920 1HB LEU 126 HB2 LEU 126 -5.003 -0.952 7.612 921 2HB LEU 126 HB1 LEU 126 -6.093 -1.991 8.528 922 HG LEU 126 HG LEU 126 -6.997 -0.001 6.425 923 1HD1 LEU 126 HD13 LEU 126 -5.604 -2.036 5.644 924 2HD1 LEU 126 HD12 LEU 126 -6.991 -3.004 6.137 925 3HD1 LEU 126 HD11 LEU 126 -7.172 -1.781 4.880 926 1HD2 LEU 126 HD22 LEU 126 -8.401 -1.958 8.231 927 2HD2 LEU 126 HD21 LEU 126 -8.884 -0.330 7.756 928 3HD2 LEU 126 HD23 LEU 126 -9.065 -1.667 6.624 929 H SER 127 HN SER 127 -6.569 -1.176 11.188 930 HA SER 127 HA SER 127 -4.034 -0.154 12.411 931 1HB SER 127 HB2 SER 127 -6.538 -1.356 13.618 932 2HB SER 127 HB1 SER 127 -5.083 -1.006 14.546 933 HG SER 127 HG SER 127 -7.002 0.642 14.044 934 H HIS 128 HN HIS 128 -2.757 -1.722 13.674 935 HA HIS 128 HA HIS 128 -2.260 -4.154 12.209 936 1HB HIS 128 HB2 HIS 128 -1.301 -3.263 14.947 937 2HB HIS 128 HB1 HIS 128 -0.669 -4.653 14.066 938 HD1 HIS 128 HD1 HIS 128 -0.699 -0.898 14.052 939 HD2 HIS 128 HD2 HIS 128 0.982 -4.002 11.834 940 HE1 HIS 128 HE1 HIS 128 1.039 0.159 12.545 941 H SER 129 HN SER 129 -2.272 -6.352 13.313 942 HA SER 129 HA SER 129 -4.326 -6.685 15.421 943 1HB SER 129 HB2 SER 129 -5.663 -6.730 13.374 944 2HB SER 129 HB1 SER 129 -4.573 -7.914 12.657 945 HG SER 129 HG SER 129 -5.174 -9.033 14.839 946 H THR 130 HN THR 130 -4.334 -8.923 16.263 947 HA THR 130 HA THR 130 -1.632 -10.157 16.021 948 HB THR 130 HB THR 130 -2.238 -11.335 18.103 949 HG1 THR 130 HG1 THR 130 -4.602 -11.101 17.390 950 1HG2 THR 130 HG23 THR 130 -1.297 -8.976 18.093 951 2HG2 THR 130 HG22 THR 130 -2.946 -8.407 18.353 952 3HG2 THR 130 HG21 THR 130 -2.169 -9.435 19.556 953 H ASP 131 HN ASP 131 -4.346 -10.527 14.342 954 HA ASP 131 HA ASP 131 -4.733 -13.422 14.626 955 1HB ASP 131 HB2 ASP 131 -6.600 -11.898 13.988 956 2HB ASP 131 HB1 ASP 131 -5.758 -11.535 12.482 957 H ILE 132 HN ILE 132 -3.526 -14.916 13.608 958 HA ILE 132 HA ILE 132 -1.285 -14.275 11.985 959 HB ILE 132 HB ILE 132 -2.828 -16.875 12.240 960 1HG1 ILE 132 HG12 ILE 132 -0.208 -16.023 13.508 961 2HG1 ILE 132 HG11 ILE 132 -1.768 -15.872 14.316 962 1HG2 ILE 132 HG21 ILE 132 -0.135 -16.251 11.000 963 2HG2 ILE 132 HG23 ILE 132 -0.651 -17.878 11.437 964 3HG2 ILE 132 HG22 ILE 132 -1.533 -16.977 10.206 965 1HD1 ILE 132 HD11 ILE 132 -2.130 -18.315 14.027 966 2HD1 ILE 132 HD13 ILE 132 -0.533 -18.447 13.292 967 3HD1 ILE 132 HD12 ILE 132 -0.689 -17.971 14.983 968 H GLY 133 HN GLY 133 -4.586 -15.255 11.091 969 1HA GLY 133 HA2 GLY 133 -4.056 -15.490 8.280 970 2HA GLY 133 HA1 GLY 133 -5.649 -15.287 9.003 971 H ALA 134 HN ALA 134 -3.731 -12.777 10.095 972 HA ALA 134 HA ALA 134 -4.933 -10.930 8.079 973 1HB ALA 134 HB2 ALA 134 -3.611 -10.350 10.748 974 2HB ALA 134 HB1 ALA 134 -4.379 -9.155 9.702 975 3HB ALA 134 HB3 ALA 134 -5.349 -10.422 10.454 976 H LEU 135 HN LEU 135 -3.656 -9.776 6.667 977 HA LEU 135 HA LEU 135 -0.896 -10.553 6.294 978 1HB LEU 135 HB2 LEU 135 -2.414 -8.172 5.171 979 2HB LEU 135 HB1 LEU 135 -0.855 -8.751 4.586 980 HG LEU 135 HG LEU 135 -3.410 -10.392 4.610 981 1HD1 LEU 135 HD11 LEU 135 -2.002 -8.856 2.410 982 2HD1 LEU 135 HD13 LEU 135 -3.253 -10.062 2.108 983 3HD1 LEU 135 HD12 LEU 135 -3.640 -8.596 3.010 984 1HD2 LEU 135 HD22 LEU 135 -0.573 -10.905 3.711 985 2HD2 LEU 135 HD21 LEU 135 -1.652 -11.956 4.629 986 3HD2 LEU 135 HD23 LEU 135 -1.910 -11.720 2.903 987 H MET 136 HN MET 136 -2.517 -8.083 8.100 988 HA MET 136 HA MET 136 -0.255 -6.310 8.414 989 1HB MET 136 HB2 MET 136 -2.628 -6.665 10.270 990 2HB MET 136 HB1 MET 136 -1.591 -5.246 10.137 991 1HG MET 136 HG2 MET 136 -3.331 -6.334 7.903 992 2HG MET 136 HG1 MET 136 -3.740 -4.951 8.916 993 1HE MET 136 HE2 MET 136 -1.990 -3.073 9.367 994 2HE MET 136 HE1 MET 136 -1.525 -2.144 7.944 995 3HE MET 136 HE3 MET 136 -3.221 -2.570 8.212 996 H TYR 137 HN TYR 137 -0.797 -9.430 9.502 997 HA TYR 137 HA TYR 137 0.148 -9.332 12.173 998 1HB TYR 137 HB2 TYR 137 -0.925 -11.295 10.919 999 2HB TYR 137 HB1 TYR 137 0.680 -11.604 10.256 1000 HD1 TYR 137 HD2 TYR 137 -0.867 -10.822 13.609 1001 HD2 TYR 137 HD1 TYR 137 1.970 -13.172 11.400 1002 HE1 TYR 137 HE2 TYR 137 -0.237 -12.016 15.685 1003 HE2 TYR 137 HE1 TYR 137 2.599 -14.366 13.477 1004 HH TYR 137 HH TYR 137 1.026 -13.594 16.585 1005 HA PRO 138 HA PRO 138 4.348 -8.076 11.063 1006 1HB PRO 138 HB2 PRO 138 5.454 -8.608 13.646 1007 2HB PRO 138 HB1 PRO 138 4.864 -7.057 13.043 1008 1HG PRO 138 HG2 PRO 138 3.603 -8.862 14.987 1009 2HG PRO 138 HG1 PRO 138 3.189 -7.185 14.600 1010 1HD PRO 138 HD2 PRO 138 1.730 -9.518 13.834 1011 2HD PRO 138 HD1 PRO 138 1.447 -7.853 13.276 1012 H SER 139 HN SER 139 4.070 -10.327 9.856 1013 HA SER 139 HA SER 139 6.436 -11.901 10.563 1014 1HB SER 139 HB2 SER 139 5.441 -13.901 11.167 1015 2HB SER 139 HB1 SER 139 4.228 -12.791 11.798 1016 HG SER 139 HG SER 139 4.154 -14.496 9.616 1017 H TYR 140 HN TYR 140 7.409 -12.091 8.614 1018 HA TYR 140 HA TYR 140 5.875 -11.874 6.147 1019 1HB TYR 140 HB2 TYR 140 8.155 -10.951 6.308 1020 2HB TYR 140 HB1 TYR 140 8.797 -12.570 6.587 1021 HD1 TYR 140 HD2 TYR 140 7.265 -10.306 4.116 1022 HD2 TYR 140 HD1 TYR 140 8.891 -14.222 4.798 1023 HE1 TYR 140 HE2 TYR 140 7.341 -10.698 1.669 1024 HE2 TYR 140 HE1 TYR 140 8.964 -14.617 2.350 1025 HH TYR 140 HH TYR 140 7.541 -12.343 0.079 1026 H THR 141 HN THR 141 4.992 -13.538 5.035 1027 HA THR 141 HA THR 141 6.155 -16.251 5.219 1028 HB THR 141 HB THR 141 3.984 -17.265 5.837 1029 HG1 THR 141 HG1 THR 141 3.206 -14.660 5.498 1030 1HG2 THR 141 HG23 THR 141 5.693 -16.549 7.581 1031 2HG2 THR 141 HG22 THR 141 4.690 -15.124 7.854 1032 3HG2 THR 141 HG21 THR 141 4.041 -16.732 8.168 1033 H PHE 142 HN PHE 142 5.990 -17.219 3.230 1034 HA PHE 142 HA PHE 142 4.601 -15.782 1.093 1035 1HB PHE 142 HB2 PHE 142 6.748 -16.825 0.605 1036 2HB PHE 142 HB1 PHE 142 6.129 -18.401 1.101 1037 HD1 PHE 142 HD2 PHE 142 5.954 -15.757 -1.474 1038 HD2 PHE 142 HD1 PHE 142 4.623 -19.672 -0.316 1039 HE1 PHE 142 HE2 PHE 142 5.103 -16.146 -3.771 1040 HE2 PHE 142 HE1 PHE 142 3.767 -20.060 -2.612 1041 HZ PHE 142 HZ PHE 142 4.012 -18.296 -4.339 1042 H SER 143 HN SER 143 2.560 -16.165 0.456 1043 HA SER 143 HA SER 143 1.186 -18.662 1.396 1044 1HB SER 143 HB2 SER 143 0.051 -15.971 0.575 1045 2HB SER 143 HB1 SER 143 -0.907 -17.367 1.061 1046 HG SER 143 HG SER 143 1.145 -16.256 2.670 1047 H GLY 144 HN GLY 144 0.106 -19.930 -0.156 1048 1HA GLY 144 HA2 GLY 144 1.105 -19.895 -2.824 1049 2HA GLY 144 HA1 GLY 144 -0.328 -20.784 -2.303 1050 H ASP 145 HN ASP 145 -1.885 -18.596 -1.416 1051 HA ASP 145 HA ASP 145 -2.287 -16.989 -3.922 1052 1HB ASP 145 HB2 ASP 145 -4.360 -18.379 -2.203 1053 2HB ASP 145 HB1 ASP 145 -4.758 -17.155 -3.410 1054 H VAL 146 HN VAL 146 -2.519 -14.827 -3.562 1055 HA VAL 146 HA VAL 146 -2.459 -13.888 -0.737 1056 HB VAL 146 HB VAL 146 -2.134 -12.317 -3.313 1057 1HG1 VAL 146 HG12 VAL 146 -1.524 -11.674 -0.411 1058 2HG1 VAL 146 HG11 VAL 146 -1.088 -10.653 -1.782 1059 3HG1 VAL 146 HG13 VAL 146 -2.786 -10.939 -1.401 1060 1HG2 VAL 146 HG21 VAL 146 -0.125 -13.656 -1.484 1061 2HG2 VAL 146 HG23 VAL 146 -0.332 -13.895 -3.219 1062 3HG2 VAL 146 HG22 VAL 146 0.319 -12.373 -2.611 1063 H GLN 147 HN GLN 147 -4.454 -13.576 0.124 1064 HA GLN 147 HA GLN 147 -6.464 -12.039 -1.469 1065 1HB GLN 147 HB2 GLN 147 -6.940 -14.631 0.032 1066 2HB GLN 147 HB1 GLN 147 -8.238 -13.559 -0.495 1067 1HG GLN 147 HG2 GLN 147 -7.596 -13.816 -2.815 1068 2HG GLN 147 HG1 GLN 147 -6.155 -14.725 -2.360 1069 1HE2 GLN 147 HE22 GLN 147 -8.071 -17.652 -2.846 1070 2HE2 GLN 147 HE21 GLN 147 -6.733 -16.735 -3.343 1071 H LEU 148 HN LEU 148 -8.020 -10.918 -0.097 1072 HA LEU 148 HA LEU 148 -6.815 -9.929 2.357 1073 1HB LEU 148 HB2 LEU 148 -9.561 -9.500 1.138 1074 2HB LEU 148 HB1 LEU 148 -8.977 -8.657 2.570 1075 HG LEU 148 HG LEU 148 -7.584 -8.607 -0.124 1076 1HD1 LEU 148 HD11 LEU 148 -9.428 -6.581 1.178 1077 2HD1 LEU 148 HD13 LEU 148 -8.484 -6.290 -0.283 1078 3HD1 LEU 148 HD12 LEU 148 -9.760 -7.508 -0.285 1079 1HD2 LEU 148 HD23 LEU 148 -7.057 -7.352 2.563 1080 2HD2 LEU 148 HD22 LEU 148 -5.917 -8.026 1.400 1081 3HD2 LEU 148 HD21 LEU 148 -6.632 -6.444 1.112 1082 H ALA 149 HN ALA 149 -7.820 -10.111 4.493 1083 HA ALA 149 HA ALA 149 -9.068 -12.793 4.879 1084 1HB ALA 149 HB2 ALA 149 -7.007 -12.222 6.160 1085 2HB ALA 149 HB1 ALA 149 -7.879 -10.890 6.920 1086 3HB ALA 149 HB3 ALA 149 -8.385 -12.554 7.210 1087 H GLN 150 HN GLN 150 -10.821 -12.943 6.499 1088 HA GLN 150 HA GLN 150 -12.981 -11.194 5.926 1089 1HB GLN 150 HB2 GLN 150 -13.269 -13.495 6.787 1090 2HB GLN 150 HB1 GLN 150 -12.591 -12.997 8.336 1091 1HG GLN 150 HG2 GLN 150 -14.433 -11.388 8.640 1092 2HG GLN 150 HG1 GLN 150 -15.105 -11.856 7.077 1093 1HE2 GLN 150 HE22 GLN 150 -16.892 -13.865 9.647 1094 2HE2 GLN 150 HE21 GLN 150 -16.771 -12.219 9.252 1095 H ASP 151 HN ASP 151 -10.676 -11.243 8.641 1096 HA ASP 151 HA ASP 151 -11.913 -9.225 10.215 1097 1HB ASP 151 HB2 ASP 151 -10.047 -10.633 11.023 1098 2HB ASP 151 HB1 ASP 151 -8.956 -9.825 9.898 1099 H ASP 152 HN ASP 152 -9.609 -8.980 7.510 1100 HA ASP 152 HA ASP 152 -9.362 -6.093 7.738 1101 1HB ASP 152 HB2 ASP 152 -8.680 -8.040 5.519 1102 2HB ASP 152 HB1 ASP 152 -8.326 -6.314 5.443 1103 H ILE 153 HN ILE 153 -11.271 -8.287 5.679 1104 HA ILE 153 HA ILE 153 -12.410 -6.281 4.004 1105 HB ILE 153 HB ILE 153 -13.500 -8.962 4.910 1106 1HG1 ILE 153 HG12 ILE 153 -12.240 -8.135 2.279 1107 2HG1 ILE 153 HG11 ILE 153 -11.334 -8.876 3.596 1108 1HG2 ILE 153 HG22 ILE 153 -14.466 -7.011 2.806 1109 2HG2 ILE 153 HG21 ILE 153 -14.912 -8.717 2.802 1110 3HG2 ILE 153 HG23 ILE 153 -15.384 -7.686 4.152 1111 1HD1 ILE 153 HD11 ILE 153 -13.094 -10.760 3.512 1112 2HD1 ILE 153 HD13 ILE 153 -13.566 -10.076 1.956 1113 3HD1 ILE 153 HD12 ILE 153 -11.930 -10.690 2.190 1114 H ASP 154 HN ASP 154 -13.687 -7.767 6.994 1115 HA ASP 154 HA ASP 154 -16.055 -6.198 7.131 1116 1HB ASP 154 HB2 ASP 154 -14.393 -7.519 9.288 1117 2HB ASP 154 HB1 ASP 154 -15.950 -6.751 9.603 1118 H GLY 155 HN GLY 155 -12.787 -5.584 8.392 1119 1HA GLY 155 HA2 GLY 155 -13.460 -3.212 9.851 1120 2HA GLY 155 HA1 GLY 155 -11.842 -3.649 9.313 1121 H ILE 156 HN ILE 156 -11.966 -3.540 6.590 1122 HA ILE 156 HA ILE 156 -12.024 -0.705 6.101 1123 HB ILE 156 HB ILE 156 -10.593 -2.379 4.860 1124 1HG1 ILE 156 HG12 ILE 156 -10.963 -1.251 2.610 1125 2HG1 ILE 156 HG11 ILE 156 -12.378 -0.476 3.314 1126 1HG2 ILE 156 HG22 ILE 156 -12.527 -3.979 4.508 1127 2HG2 ILE 156 HG21 ILE 156 -13.105 -2.883 3.254 1128 3HG2 ILE 156 HG23 ILE 156 -11.537 -3.672 3.085 1129 1HD1 ILE 156 HD12 ILE 156 -9.787 -0.228 4.802 1130 2HD1 ILE 156 HD11 ILE 156 -9.993 0.712 3.327 1131 3HD1 ILE 156 HD13 ILE 156 -11.123 0.914 4.661 1132 H GLN 157 HN GLN 157 -14.290 -3.326 5.321 1133 HA GLN 157 HA GLN 157 -16.072 -1.671 3.785 1134 1HB GLN 157 HB2 GLN 157 -16.494 -4.275 5.273 1135 2HB GLN 157 HB1 GLN 157 -17.743 -3.511 4.285 1136 1HG GLN 157 HG2 GLN 157 -16.240 -3.577 2.327 1137 2HG GLN 157 HG1 GLN 157 -14.993 -4.343 3.309 1138 1HE2 GLN 157 HE22 GLN 157 -17.826 -7.042 3.631 1139 2HE2 GLN 157 HE21 GLN 157 -17.587 -5.707 4.652 1140 H ALA 158 HN ALA 158 -15.858 -2.464 7.241 1141 HA ALA 158 HA ALA 158 -18.339 -1.321 8.044 1142 1HB ALA 158 HB2 ALA 158 -15.712 -1.394 9.563 1143 2HB ALA 158 HB1 ALA 158 -17.299 -1.103 10.274 1144 3HB ALA 158 HB3 ALA 158 -16.928 -2.671 9.558 1145 H ILE 159 HN ILE 159 -15.136 0.170 7.566 1146 HA ILE 159 HA ILE 159 -15.877 2.775 8.526 1147 HB ILE 159 HB ILE 159 -13.762 1.930 6.523 1148 1HG1 ILE 159 HG12 ILE 159 -13.470 2.709 9.436 1149 2HG1 ILE 159 HG11 ILE 159 -13.664 1.037 8.909 1150 1HG2 ILE 159 HG21 ILE 159 -14.317 4.566 7.903 1151 2HG2 ILE 159 HG23 ILE 159 -12.736 4.163 7.233 1152 3HG2 ILE 159 HG22 ILE 159 -14.143 4.264 6.174 1153 1HD1 ILE 159 HD11 ILE 159 -11.501 2.871 7.849 1154 2HD1 ILE 159 HD13 ILE 159 -11.260 1.775 9.210 1155 3HD1 ILE 159 HD12 ILE 159 -11.638 1.129 7.613 1156 H TYR 160 HN TYR 160 -15.709 1.463 5.197 1157 HA TYR 160 HA TYR 160 -17.221 3.841 4.224 1158 1HB TYR 160 HB2 TYR 160 -15.697 1.619 2.846 1159 2HB TYR 160 HB1 TYR 160 -16.762 2.705 1.954 1160 HD1 TYR 160 HD2 TYR 160 -16.265 5.104 1.779 1161 HD2 TYR 160 HD1 TYR 160 -13.609 2.414 3.818 1162 HE1 TYR 160 HE2 TYR 160 -14.483 6.826 1.723 1163 HE2 TYR 160 HE1 TYR 160 -11.825 4.138 3.762 1164 HH TYR 160 HH TYR 160 -12.441 7.395 2.939 1165 H GLY 161 HN GLY 161 -17.345 0.331 3.532 1166 1HA GLY 161 HA2 GLY 161 -19.756 -0.486 4.412 1167 2HA GLY 161 HA1 GLY 161 -20.256 0.546 3.069 1168 H ARG 162 HN ARG 162 -21.093 -1.661 2.318 1169 HA ARG 162 HA ARG 162 -18.996 -3.434 1.199 1170 1HB ARG 162 HB2 ARG 162 -22.018 -3.603 1.291 1171 2HB ARG 162 HB1 ARG 162 -21.000 -4.790 0.475 1172 1HG ARG 162 HG2 ARG 162 -19.821 -5.243 2.592 1173 2HG ARG 162 HG1 ARG 162 -20.838 -4.059 3.415 1174 1HD ARG 162 HD2 ARG 162 -21.794 -6.241 3.816 1175 2HD ARG 162 HD1 ARG 162 -22.846 -5.396 2.684 1176 HE ARG 162 HE ARG 162 -21.061 -6.817 1.075 1177 1HH1 ARG 162 HH21 ARG 162 -23.284 -7.486 3.626 1178 2HH1 ARG 162 HH22 ARG 162 -23.633 -9.092 3.080 1179 1HH2 ARG 162 HH11 ARG 162 -21.498 -8.913 0.353 1180 2HH2 ARG 162 HH12 ARG 162 -22.622 -9.900 1.227 1181 H SER 163 HN SER 163 -18.652 -3.667 -1.023 1182 HA SER 163 HA SER 163 -19.472 -1.407 -2.676 1183 1HB SER 163 HB2 SER 163 -18.118 -3.963 -3.580 1184 2HB SER 163 HB1 SER 163 -18.100 -2.399 -4.389 1185 HG SER 163 HG SER 163 -16.378 -3.286 -2.651 1186 H GLN 164 HN GLN 164 -21.781 -1.650 -2.680 1187 HA GLN 164 HA GLN 164 -23.055 -4.102 -3.537 1188 1HB GLN 164 HB2 GLN 164 -24.041 -1.241 -3.380 1189 2HB GLN 164 HB1 GLN 164 -25.073 -2.602 -3.823 1190 1HG GLN 164 HG2 GLN 164 -24.555 -3.703 -1.680 1191 2HG GLN 164 HG1 GLN 164 -23.523 -2.346 -1.228 1192 1HE2 GLN 164 HE22 GLN 164 -27.209 -2.011 -0.075 1193 2HE2 GLN 164 HE21 GLN 164 -26.249 -3.409 -0.148 1194 H ASN 165 HN ASN 165 -23.069 -4.878 -5.569 1195 HA ASN 165 HA ASN 165 -23.453 -3.092 -7.866 1196 1HB ASN 165 HB2 ASN 165 -20.903 -4.685 -7.496 1197 2HB ASN 165 HB1 ASN 165 -21.414 -3.996 -9.038 1198 1HD2 ASN 165 HD22 ASN 165 -20.599 -0.653 -8.124 1199 2HD2 ASN 165 HD21 ASN 165 -21.422 -1.632 -9.240 1200 HA PRO 166 HA PRO 166 -25.196 -7.421 -8.021 1201 1HB PRO 166 HB2 PRO 166 -27.739 -6.363 -8.848 1202 2HB PRO 166 HB1 PRO 166 -27.335 -7.084 -7.284 1203 1HG PRO 166 HG2 PRO 166 -27.830 -4.284 -7.874 1204 2HG PRO 166 HG1 PRO 166 -27.495 -5.023 -6.301 1205 1HD PRO 166 HD2 PRO 166 -25.716 -3.399 -7.912 1206 2HD PRO 166 HD1 PRO 166 -25.386 -4.120 -6.322 1207 H VAL 167 HN VAL 167 -24.348 -8.215 -9.921 1208 HA VAL 167 HA VAL 167 -24.641 -6.712 -12.436 1209 HB VAL 167 HB VAL 167 -23.401 -9.422 -11.853 1210 1HG1 VAL 167 HG13 VAL 167 -23.612 -7.746 -14.361 1211 2HG1 VAL 167 HG12 VAL 167 -22.315 -8.922 -14.146 1212 3HG1 VAL 167 HG11 VAL 167 -23.996 -9.454 -14.151 1213 1HG2 VAL 167 HG23 VAL 167 -22.204 -6.673 -12.327 1214 2HG2 VAL 167 HG22 VAL 167 -22.197 -7.560 -10.803 1215 3HG2 VAL 167 HG21 VAL 167 -21.273 -8.164 -12.179 1216 H GLN 168 HN GLN 168 -26.035 -7.272 -14.106 1217 HA GLN 168 HA GLN 168 -28.273 -8.994 -13.400 1218 1HB GLN 168 HB2 GLN 168 -27.603 -7.561 -15.993 1219 2HB GLN 168 HB1 GLN 168 -29.156 -8.306 -15.620 1220 1HG GLN 168 HG2 GLN 168 -29.458 -6.796 -13.716 1221 2HG GLN 168 HG1 GLN 168 -27.874 -6.079 -14.013 1222 1HE2 GLN 168 HE22 GLN 168 -31.061 -4.976 -16.302 1223 2HE2 GLN 168 HE21 GLN 168 -31.204 -6.230 -15.167 1224 HA PRO 169 HA PRO 169 -26.718 -12.784 -15.102 1225 1HB PRO 169 HB2 PRO 169 -29.151 -13.499 -16.513 1226 2HB PRO 169 HB1 PRO 169 -28.560 -14.138 -14.972 1227 1HG PRO 169 HG2 PRO 169 -30.739 -12.250 -15.416 1228 2HG PRO 169 HG1 PRO 169 -30.233 -12.999 -13.894 1229 1HD PRO 169 HD2 PRO 169 -29.872 -10.268 -14.635 1230 2HD PRO 169 HD1 PRO 169 -29.167 -11.086 -13.226 No H/Q in entry = 1230 Start of MODEL 17 1 1H VAL 1 HT1 VAL 1 -1.293 14.846 41.629 2 2H VAL 1 HT3 VAL 1 -2.602 15.109 42.673 3 3H VAL 1 HT2 VAL 1 -2.882 14.638 41.065 4 HA VAL 1 HA VAL 1 -3.111 16.773 40.568 5 HB VAL 1 HB VAL 1 -3.462 17.191 43.001 6 1HG1 VAL 1 HG11 VAL 1 -1.152 16.342 43.633 7 2HG1 VAL 1 HG13 VAL 1 -0.514 17.881 43.053 8 3HG1 VAL 1 HG12 VAL 1 -1.635 17.848 44.415 9 1HG2 VAL 1 HG21 VAL 1 -3.463 19.040 41.303 10 2HG2 VAL 1 HG23 VAL 1 -2.979 19.574 42.913 11 3HG2 VAL 1 HG22 VAL 1 -1.760 19.318 41.665 12 H LEU 2 HN LEU 2 0.043 15.746 41.770 13 HA LEU 2 HA LEU 2 1.554 17.819 40.440 14 1HB LEU 2 HB2 LEU 2 2.405 15.019 41.248 15 2HB LEU 2 HB1 LEU 2 3.494 16.332 40.806 16 HG LEU 2 HG LEU 2 1.536 16.426 43.124 17 1HD1 LEU 2 HD13 LEU 2 3.384 14.771 43.427 18 2HD1 LEU 2 HD12 LEU 2 4.549 16.067 43.156 19 3HD1 LEU 2 HD11 LEU 2 3.483 16.118 44.561 20 1HD2 LEU 2 HD22 LEU 2 3.568 18.345 41.987 21 2HD2 LEU 2 HD21 LEU 2 1.932 18.669 42.559 22 3HD2 LEU 2 HD23 LEU 2 3.227 18.370 43.715 23 H THR 3 HN THR 3 2.387 17.846 38.349 24 HA THR 3 HA THR 3 1.231 15.853 36.475 25 HB THR 3 HB THR 3 1.714 17.411 34.747 26 HG1 THR 3 HG1 THR 3 3.774 17.988 35.116 27 1HG2 THR 3 HG21 THR 3 -0.096 18.150 36.256 28 2HG2 THR 3 HG23 THR 3 1.083 19.022 37.238 29 3HG2 THR 3 HG22 THR 3 0.772 19.528 35.578 30 H GLU 4 HN GLU 4 2.508 14.491 35.212 31 HA GLU 4 HA GLU 4 5.090 13.769 36.269 32 1HB GLU 4 HB2 GLU 4 3.511 12.179 35.140 33 2HB GLU 4 HB1 GLU 4 3.856 12.984 33.611 34 1HG GLU 4 HG2 GLU 4 5.257 10.996 33.808 35 2HG GLU 4 HG1 GLU 4 6.272 12.435 33.906 36 H GLY 5 HN GLY 5 7.133 14.290 35.522 37 1HA GLY 5 HA2 GLY 5 8.714 15.095 33.884 38 2HA GLY 5 HA1 GLY 5 7.392 15.868 33.010 39 H ASN 6 HN ASN 6 6.512 17.866 33.896 40 HA ASN 6 HA ASN 6 7.884 19.114 36.165 41 1HB ASN 6 HB2 ASN 6 8.326 19.994 33.309 42 2HB ASN 6 HB1 ASN 6 8.554 21.104 34.657 43 1HD2 ASN 6 HD22 ASN 6 11.337 19.112 35.984 44 2HD2 ASN 6 HD21 ASN 6 9.927 19.865 36.557 45 HA PRO 7 HA PRO 7 3.940 21.137 36.472 46 1HB PRO 7 HB2 PRO 7 5.021 23.762 37.124 47 2HB PRO 7 HB1 PRO 7 4.258 22.593 38.211 48 1HG PRO 7 HG2 PRO 7 7.079 23.238 37.999 49 2HG PRO 7 HG1 PRO 7 6.305 22.104 39.117 50 1HD PRO 7 HD2 PRO 7 7.966 21.440 36.873 51 2HD PRO 7 HD1 PRO 7 7.062 20.317 37.909 52 H ARG 8 HN ARG 8 2.741 21.840 34.766 53 HA ARG 8 HA ARG 8 4.070 23.200 32.506 54 1HB ARG 8 HB2 ARG 8 1.264 22.127 32.912 55 2HB ARG 8 HB1 ARG 8 1.822 22.886 31.421 56 1HG ARG 8 HG2 ARG 8 3.592 21.184 31.206 57 2HG ARG 8 HG1 ARG 8 3.038 20.421 32.699 58 1HD ARG 8 HD2 ARG 8 1.377 20.780 30.187 59 2HD ARG 8 HD1 ARG 8 2.109 19.267 30.726 60 HE ARG 8 HE ARG 8 0.594 20.026 32.896 61 1HH1 ARG 8 HH21 ARG 8 0.029 19.690 29.512 62 2HH1 ARG 8 HH22 ARG 8 -1.624 19.207 29.703 63 1HH2 ARG 8 HH11 ARG 8 -1.558 19.395 33.164 64 2HH2 ARG 8 HH12 ARG 8 -2.521 19.039 31.768 65 H TRP 9 HN TRP 9 3.066 25.156 31.545 66 HA TRP 9 HA TRP 9 2.543 27.194 33.519 67 1HB TRP 9 HB2 TRP 9 2.270 27.109 30.503 68 2HB TRP 9 HB1 TRP 9 1.887 28.550 31.442 69 HD1 TRP 9 HD1 TRP 9 4.763 26.574 30.057 70 HE1 TRP 9 HE1 TRP 9 6.983 27.744 30.650 71 HE3 TRP 9 HE3 TRP 9 3.064 30.045 33.391 72 HZ2 TRP 9 HZ2 TRP 9 7.913 29.875 32.319 73 HZ3 TRP 9 HZ3 TRP 9 4.634 31.632 34.467 74 HH2 TRP 9 HH2 TRP 9 7.054 31.552 33.935 75 H GLU 10 HN GLU 10 0.575 27.857 34.351 76 HA GLU 10 HA GLU 10 -1.778 26.239 33.816 77 1HB GLU 10 HB2 GLU 10 -1.360 28.754 35.451 78 2HB GLU 10 HB1 GLU 10 -2.905 27.910 35.350 79 1HG GLU 10 HG2 GLU 10 -1.844 25.857 36.218 80 2HG GLU 10 HG1 GLU 10 -0.299 26.701 36.322 81 H GLN 11 HN GLN 11 -0.636 29.389 32.737 82 HA GLN 11 HA GLN 11 -3.240 30.097 31.564 83 1HB GLN 11 HB2 GLN 11 -0.527 31.424 31.278 84 2HB GLN 11 HB1 GLN 11 -2.080 32.120 30.810 85 1HG GLN 11 HG2 GLN 11 -1.381 31.255 33.629 86 2HG GLN 11 HG1 GLN 11 -1.283 32.917 33.048 87 1HE2 GLN 11 HE22 GLN 11 -4.722 31.886 34.541 88 2HE2 GLN 11 HE21 GLN 11 -3.178 31.369 35.023 89 H THR 12 HN THR 12 -3.737 30.065 29.354 90 HA THR 12 HA THR 12 -1.985 28.366 27.660 91 HB THR 12 HB THR 12 -3.893 28.361 26.096 92 HG1 THR 12 HG1 THR 12 -4.471 30.591 27.312 93 1HG2 THR 12 HG21 THR 12 -4.694 27.890 28.981 94 2HG2 THR 12 HG23 THR 12 -5.559 27.267 27.576 95 3HG2 THR 12 HG22 THR 12 -3.917 26.720 27.913 96 H HIS 13 HN HIS 13 -2.385 31.573 28.400 97 HA HIS 13 HA HIS 13 -1.275 32.501 25.770 98 1HB HIS 13 HB2 HIS 13 -3.052 33.957 27.763 99 2HB HIS 13 HB1 HIS 13 -2.242 34.744 26.409 100 HD1 HIS 13 HD1 HIS 13 -4.603 31.795 26.959 101 HD2 HIS 13 HD2 HIS 13 -3.772 34.726 24.116 102 HE1 HIS 13 HE1 HIS 13 -6.341 31.536 25.135 103 H LEU 14 HN LEU 14 0.766 33.370 25.972 104 HA LEU 14 HA LEU 14 1.675 34.273 28.691 105 1HB LEU 14 HB2 LEU 14 3.262 32.609 26.708 106 2HB LEU 14 HB1 LEU 14 3.856 33.213 28.252 107 HG LEU 14 HG LEU 14 1.471 31.361 27.961 108 1HD1 LEU 14 HD12 LEU 14 4.396 30.813 28.486 109 2HD1 LEU 14 HD11 LEU 14 3.133 29.680 28.964 110 3HD1 LEU 14 HD13 LEU 14 3.353 30.088 27.263 111 1HD2 LEU 14 HD23 LEU 14 2.974 32.545 30.299 112 2HD2 LEU 14 HD22 LEU 14 1.235 32.428 30.046 113 3HD2 LEU 14 HD21 LEU 14 2.158 30.992 30.472 114 H THR 15 HN THR 15 3.542 35.759 28.567 115 HA THR 15 HA THR 15 3.762 37.191 25.936 116 HB THR 15 HB THR 15 3.754 39.307 27.076 117 HG1 THR 15 HG1 THR 15 3.790 37.705 29.406 118 1HG2 THR 15 HG21 THR 15 1.529 38.215 26.680 119 2HG2 THR 15 HG23 THR 15 1.576 37.625 28.341 120 3HG2 THR 15 HG22 THR 15 1.525 39.359 28.022 121 H TYR 16 HN TYR 16 5.843 38.376 25.717 122 HA TYR 16 HA TYR 16 7.983 37.486 27.588 123 1HB TYR 16 HB2 TYR 16 9.372 36.605 25.805 124 2HB TYR 16 HB1 TYR 16 7.814 35.780 25.759 125 HD1 TYR 16 HD1 TYR 16 9.988 38.237 24.092 126 HD2 TYR 16 HD2 TYR 16 6.202 36.211 23.976 127 HE1 TYR 16 HE1 TYR 16 9.668 38.970 21.746 128 HE2 TYR 16 HE2 TYR 16 5.882 36.945 21.627 129 HH TYR 16 HH TYR 16 6.655 38.282 19.999 130 H ARG 17 HN ARG 17 9.989 38.722 27.299 131 HA ARG 17 HA ARG 17 9.736 41.198 25.651 132 1HB ARG 17 HB2 ARG 17 8.824 41.693 27.922 133 2HB ARG 17 HB1 ARG 17 10.368 41.206 28.618 134 1HG ARG 17 HG2 ARG 17 11.514 42.975 27.328 135 2HG ARG 17 HG1 ARG 17 9.969 43.466 26.631 136 1HD ARG 17 HD2 ARG 17 9.122 43.913 28.936 137 2HD ARG 17 HD1 ARG 17 10.723 43.531 29.566 138 HE ARG 17 HE ARG 17 11.196 45.490 27.658 139 1HH1 ARG 17 HH21 ARG 17 9.196 45.101 30.436 140 2HH1 ARG 17 HH22 ARG 17 9.188 46.787 30.831 141 1HH2 ARG 17 HH11 ARG 17 11.197 47.696 28.156 142 2HH2 ARG 17 HH12 ARG 17 10.320 48.257 29.540 143 H ILE 18 HN ILE 18 11.698 41.937 24.905 144 HA ILE 18 HA ILE 18 14.084 40.275 25.497 145 HB ILE 18 HB ILE 18 13.609 42.503 23.488 146 1HG1 ILE 18 HG12 ILE 18 13.974 39.526 23.038 147 2HG1 ILE 18 HG11 ILE 18 12.393 40.301 23.150 148 1HG2 ILE 18 HG23 ILE 18 16.007 40.766 24.097 149 2HG2 ILE 18 HG22 ILE 18 15.783 41.512 22.516 150 3HG2 ILE 18 HG21 ILE 18 15.937 42.522 23.952 151 1HD1 ILE 18 HD11 ILE 18 14.540 41.136 21.182 152 2HD1 ILE 18 HD13 ILE 18 13.226 40.027 20.789 153 3HD1 ILE 18 HD12 ILE 18 12.869 41.696 21.232 154 H GLU 19 HN GLU 19 15.341 40.949 27.194 155 HA GLU 19 HA GLU 19 15.064 43.562 28.363 156 1HB GLU 19 HB2 GLU 19 15.844 41.484 29.571 157 2HB GLU 19 HB1 GLU 19 17.391 41.661 28.739 158 1HG GLU 19 HG2 GLU 19 17.699 43.884 29.709 159 2HG GLU 19 HG1 GLU 19 16.115 43.791 30.480 160 H ASN 20 HN ASN 20 17.476 42.164 26.142 161 HA ASN 20 HA ASN 20 18.140 44.833 25.177 162 1HB ASN 20 HB2 ASN 20 19.461 44.667 27.306 163 2HB ASN 20 HB1 ASN 20 20.308 43.282 26.619 164 1HD2 ASN 20 HD22 ASN 20 22.638 45.447 25.138 165 2HD2 ASN 20 HD21 ASN 20 22.347 44.032 26.030 166 H TYR 21 HN TYR 21 19.660 44.730 23.351 167 HA TYR 21 HA TYR 21 19.556 42.069 21.995 168 1HB TYR 21 HB2 TYR 21 19.948 44.892 20.965 169 2HB TYR 21 HB1 TYR 21 20.085 43.455 19.949 170 HD1 TYR 21 HD1 TYR 21 18.133 42.088 19.425 171 HD2 TYR 21 HD2 TYR 21 17.791 45.587 21.888 172 HE1 TYR 21 HE1 TYR 21 15.667 42.034 19.156 173 HE2 TYR 21 HE2 TYR 21 15.325 45.533 21.622 174 HH TYR 21 HH TYR 21 13.570 43.976 21.070 175 H THR 22 HN THR 22 21.426 40.931 21.750 176 HA THR 22 HA THR 22 23.893 41.856 22.841 177 HB THR 22 HB THR 22 23.555 39.502 22.777 178 HG1 THR 22 HG1 THR 22 25.492 40.521 21.050 179 1HG2 THR 22 HG22 THR 22 23.113 39.860 19.802 180 2HG2 THR 22 HG21 THR 22 23.250 38.297 20.602 181 3HG2 THR 22 HG23 THR 22 21.913 39.374 20.998 182 HA PRO 23 HA PRO 23 25.274 44.256 19.319 183 1HB PRO 23 HB2 PRO 23 28.070 44.000 19.813 184 2HB PRO 23 HB1 PRO 23 27.017 45.302 20.386 185 1HG PRO 23 HG2 PRO 23 28.168 43.061 21.916 186 2HG PRO 23 HG1 PRO 23 27.413 44.545 22.518 187 1HD PRO 23 HD2 PRO 23 26.253 41.943 22.543 188 2HD PRO 23 HD1 PRO 23 25.424 43.479 22.882 189 H ASP 24 HN ASP 24 25.686 40.969 19.734 190 HA ASP 24 HA ASP 24 27.598 40.325 17.694 191 1HB ASP 24 HB2 ASP 24 25.246 38.779 18.814 192 2HB ASP 24 HB1 ASP 24 26.386 38.099 17.653 193 H LEU 25 HN LEU 25 24.079 40.828 17.604 194 HA LEU 25 HA LEU 25 24.269 41.156 14.649 195 1HB LEU 25 HB2 LEU 25 22.270 39.428 16.138 196 2HB LEU 25 HB1 LEU 25 22.109 39.860 14.443 197 HG LEU 25 HG LEU 25 24.508 38.407 15.595 198 1HD1 LEU 25 HD11 LEU 25 21.989 37.381 14.274 199 2HD1 LEU 25 HD13 LEU 25 23.465 36.422 14.398 200 3HD1 LEU 25 HD12 LEU 25 22.630 36.950 15.859 201 1HD2 LEU 25 HD21 LEU 25 23.632 39.219 12.820 202 2HD2 LEU 25 HD23 LEU 25 25.226 39.349 13.563 203 3HD2 LEU 25 HD22 LEU 25 24.626 37.780 13.035 204 HA PRO 26 HA PRO 26 21.758 44.725 15.537 205 1HB PRO 26 HB2 PRO 26 20.070 44.568 13.216 206 2HB PRO 26 HB1 PRO 26 21.534 45.545 13.406 207 1HG PRO 26 HG2 PRO 26 21.179 43.068 11.866 208 2HG PRO 26 HG1 PRO 26 22.541 44.197 11.843 209 1HD PRO 26 HD2 PRO 26 22.537 41.610 13.016 210 2HD PRO 26 HD1 PRO 26 23.775 42.861 13.233 211 H ARG 27 HN ARG 27 19.437 45.271 16.034 212 HA ARG 27 HA ARG 27 18.082 43.036 17.261 213 1HB ARG 27 HB2 ARG 27 16.312 44.694 17.799 214 2HB ARG 27 HB1 ARG 27 17.916 45.265 18.229 215 1HG ARG 27 HG2 ARG 27 17.085 47.145 17.139 216 2HG ARG 27 HG1 ARG 27 17.901 46.329 15.813 217 1HD ARG 27 HD2 ARG 27 15.940 46.203 14.664 218 2HD ARG 27 HD1 ARG 27 15.160 45.354 15.997 219 HE ARG 27 HE ARG 27 15.176 47.981 16.844 220 1HH1 ARG 27 HH21 ARG 27 14.188 46.286 14.009 221 2HH1 ARG 27 HH22 ARG 27 12.900 47.385 13.640 222 1HH2 ARG 27 HH11 ARG 27 13.501 49.427 16.375 223 2HH2 ARG 27 HH12 ARG 27 12.512 49.160 14.977 224 H ALA 28 HN ALA 28 17.808 44.633 14.168 225 HA ALA 28 HA ALA 28 15.187 43.811 13.435 226 1HB ALA 28 HB2 ALA 28 17.646 44.201 11.706 227 2HB ALA 28 HB1 ALA 28 16.001 44.039 11.089 228 3HB ALA 28 HB3 ALA 28 16.433 45.421 12.095 229 H ASP 29 HN ASP 29 18.286 42.075 13.232 230 HA ASP 29 HA ASP 29 16.995 39.767 11.927 231 1HB ASP 29 HB2 ASP 29 19.814 40.286 12.896 232 2HB ASP 29 HB1 ASP 29 19.304 38.757 12.178 233 H VAL 30 HN VAL 30 18.123 40.658 15.159 234 HA VAL 30 HA VAL 30 17.966 37.994 16.257 235 HB VAL 30 HB VAL 30 17.881 40.729 17.551 236 1HG1 VAL 30 HG11 VAL 30 17.899 37.960 18.758 237 2HG1 VAL 30 HG13 VAL 30 18.500 39.364 19.640 238 3HG1 VAL 30 HG12 VAL 30 16.814 39.301 19.125 239 1HG2 VAL 30 HG23 VAL 30 19.991 40.065 16.398 240 2HG2 VAL 30 HG22 VAL 30 20.200 40.222 18.143 241 3HG2 VAL 30 HG21 VAL 30 20.060 38.623 17.411 242 H ASP 31 HN ASP 31 15.670 40.752 16.301 243 HA ASP 31 HA ASP 31 13.662 39.486 17.855 244 1HB ASP 31 HB2 ASP 31 12.083 41.065 16.808 245 2HB ASP 31 HB1 ASP 31 13.581 41.882 17.255 246 H HIS 32 HN HIS 32 14.305 39.328 14.356 247 HA HIS 32 HA HIS 32 11.984 37.838 13.635 248 1HB HIS 32 HB2 HIS 32 13.513 38.831 11.962 249 2HB HIS 32 HB1 HIS 32 14.770 37.686 12.437 250 HD1 HIS 32 HD1 HIS 32 11.120 37.488 11.306 251 HD2 HIS 32 HD2 HIS 32 14.716 35.427 10.863 252 HE1 HIS 32 HE1 HIS 32 10.646 35.547 9.750 253 H ALA 33 HN ALA 33 15.214 36.764 14.708 254 HA ALA 33 HA ALA 33 14.727 33.968 14.504 255 1HB ALA 33 HB1 ALA 33 16.960 35.011 14.949 256 2HB ALA 33 HB3 ALA 33 16.422 35.383 16.587 257 3HB ALA 33 HB2 ALA 33 16.579 33.704 16.070 258 H ILE 34 HN ILE 34 14.123 36.249 17.180 259 HA ILE 34 HA ILE 34 13.060 34.210 18.951 260 HB ILE 34 HB ILE 34 12.648 37.218 18.988 261 1HG1 ILE 34 HG12 ILE 34 15.022 36.721 19.113 262 2HG1 ILE 34 HG11 ILE 34 14.463 37.168 20.720 263 1HG2 ILE 34 HG21 ILE 34 12.246 35.080 21.096 264 2HG2 ILE 34 HG23 ILE 34 12.222 36.812 21.428 265 3HG2 ILE 34 HG22 ILE 34 11.003 36.100 20.372 266 1HD1 ILE 34 HD12 ILE 34 14.119 34.567 21.014 267 2HD1 ILE 34 HD11 ILE 34 15.270 34.468 19.681 268 3HD1 ILE 34 HD13 ILE 34 15.727 35.266 21.184 269 H GLU 35 HN GLU 35 11.490 36.804 17.036 270 HA GLU 35 HA GLU 35 8.825 36.050 17.662 271 1HB GLU 35 HB2 GLU 35 9.471 38.193 16.556 272 2HB GLU 35 HB1 GLU 35 9.816 37.292 15.079 273 1HG GLU 35 HG2 GLU 35 7.476 36.502 15.009 274 2HG GLU 35 HG1 GLU 35 7.130 37.403 16.485 275 H LYS 36 HN LYS 36 10.973 34.958 15.045 276 HA LYS 36 HA LYS 36 9.026 33.403 13.658 277 1HB LYS 36 HB2 LYS 36 11.313 34.033 12.803 278 2HB LYS 36 HB1 LYS 36 11.984 32.794 13.865 279 1HG LYS 36 HG2 LYS 36 10.597 31.085 12.753 280 2HG LYS 36 HG1 LYS 36 9.928 32.322 11.688 281 1HD LYS 36 HD2 LYS 36 12.197 32.803 10.828 282 2HD LYS 36 HD1 LYS 36 12.853 31.542 11.873 283 1HE LYS 36 HE2 LYS 36 10.749 31.087 9.739 284 2HE LYS 36 HE1 LYS 36 12.467 30.738 9.545 285 1HZ LYS 36 HZ3 LYS 36 12.095 29.413 11.737 286 2HZ LYS 36 HZ2 LYS 36 10.473 29.397 11.229 287 3HZ LYS 36 HZ1 LYS 36 11.682 28.723 10.242 288 H ALA 37 HN ALA 37 11.197 32.550 16.360 289 HA ALA 37 HA ALA 37 10.571 29.759 16.378 290 1HB ALA 37 HB3 ALA 37 12.443 31.000 17.641 291 2HB ALA 37 HB2 ALA 37 11.217 31.354 18.859 292 3HB ALA 37 HB1 ALA 37 11.638 29.682 18.490 293 H PHE 38 HN PHE 38 9.127 32.466 18.233 294 HA PHE 38 HA PHE 38 7.265 30.874 19.684 295 1HB PHE 38 HB2 PHE 38 7.278 33.767 18.806 296 2HB PHE 38 HB1 PHE 38 5.889 33.094 19.660 297 HD1 PHE 38 HD2 PHE 38 6.494 31.672 21.824 298 HD2 PHE 38 HD1 PHE 38 9.023 34.677 20.084 299 HE1 PHE 38 HE2 PHE 38 7.682 31.924 23.987 300 HE2 PHE 38 HE1 PHE 38 10.211 34.928 22.247 301 HZ PHE 38 HZ PHE 38 9.541 33.552 24.197 302 H GLN 39 HN GLN 39 7.041 32.368 16.467 303 HA GLN 39 HA GLN 39 4.308 31.766 15.974 304 1HB GLN 39 HB2 GLN 39 6.672 32.004 14.100 305 2HB GLN 39 HB1 GLN 39 5.008 31.822 13.539 306 1HG GLN 39 HG2 GLN 39 4.345 33.870 14.638 307 2HG GLN 39 HG1 GLN 39 5.917 34.015 15.420 308 1HE2 GLN 39 HE22 GLN 39 5.660 36.017 12.145 309 2HE2 GLN 39 HE21 GLN 39 4.532 35.839 13.400 310 H LEU 40 HN LEU 40 7.238 29.810 15.359 311 HA LEU 40 HA LEU 40 5.930 27.643 14.059 312 1HB LEU 40 HB2 LEU 40 8.388 27.637 15.830 313 2HB LEU 40 HB1 LEU 40 7.882 26.276 14.834 314 HG LEU 40 HG LEU 40 8.451 29.044 13.734 315 1HD1 LEU 40 HD11 LEU 40 10.225 26.586 13.872 316 2HD1 LEU 40 HD13 LEU 40 10.590 28.037 12.938 317 3HD1 LEU 40 HD12 LEU 40 10.496 28.122 14.697 318 1HD2 LEU 40 HD22 LEU 40 7.783 26.355 12.528 319 2HD2 LEU 40 HD21 LEU 40 7.135 27.945 12.125 320 3HD2 LEU 40 HD23 LEU 40 8.761 27.502 11.616 321 H TRP 41 HN TRP 41 6.526 28.212 17.531 322 HA TRP 41 HA TRP 41 5.405 25.676 18.340 323 1HB TRP 41 HB2 TRP 41 5.868 28.266 19.840 324 2HB TRP 41 HB1 TRP 41 5.262 26.802 20.609 325 HD1 TRP 41 HD1 TRP 41 8.387 28.523 19.746 326 HE1 TRP 41 HE1 TRP 41 10.419 26.968 20.043 327 HE3 TRP 41 HE3 TRP 41 6.000 24.029 20.217 328 HZ2 TRP 41 HZ2 TRP 41 10.964 24.192 20.430 329 HZ3 TRP 41 HZ3 TRP 41 7.306 21.947 20.552 330 HH2 TRP 41 HH2 TRP 41 9.781 22.024 20.659 331 H SER 42 HN SER 42 4.066 28.980 18.119 332 HA SER 42 HA SER 42 1.474 28.256 19.157 333 1HB SER 42 HB2 SER 42 2.394 30.600 19.027 334 2HB SER 42 HB1 SER 42 2.137 30.548 17.286 335 HG SER 42 HG SER 42 0.406 31.387 18.847 336 H ASN 43 HN ASN 43 2.784 28.477 15.850 337 HA ASN 43 HA ASN 43 0.389 28.146 14.406 338 1HB ASN 43 HB2 ASN 43 3.190 27.168 13.818 339 2HB ASN 43 HB1 ASN 43 1.862 27.008 12.670 340 1HD2 ASN 43 HD22 ASN 43 3.437 30.200 11.771 341 2HD2 ASN 43 HD21 ASN 43 3.773 28.541 11.637 342 H VAL 44 HN VAL 44 2.268 25.740 16.169 343 HA VAL 44 HA VAL 44 0.412 23.602 15.189 344 HB VAL 44 HB VAL 44 2.139 22.019 15.968 345 1HG1 VAL 44 HG12 VAL 44 2.120 23.099 13.655 346 2HG1 VAL 44 HG11 VAL 44 3.395 24.167 14.243 347 3HG1 VAL 44 HG13 VAL 44 3.666 22.426 14.173 348 1HG2 VAL 44 HG21 VAL 44 3.409 24.573 16.943 349 2HG2 VAL 44 HG23 VAL 44 3.310 23.003 17.734 350 3HG2 VAL 44 HG22 VAL 44 4.451 23.250 16.420 351 H THR 45 HN THR 45 0.276 25.683 17.615 352 HA THR 45 HA THR 45 -1.006 23.698 19.390 353 HB THR 45 HB THR 45 0.078 24.717 21.420 354 HG1 THR 45 HG1 THR 45 1.582 25.965 19.386 355 1HG2 THR 45 HG21 THR 45 0.930 22.613 20.069 356 2HG2 THR 45 HG23 THR 45 2.278 23.677 19.674 357 3HG2 THR 45 HG22 THR 45 1.924 23.297 21.353 358 HA PRO 46 HA PRO 46 -3.881 27.094 19.655 359 1HB PRO 46 HB2 PRO 46 -5.006 26.525 22.186 360 2HB PRO 46 HB1 PRO 46 -5.551 25.857 20.641 361 1HG PRO 46 HG2 PRO 46 -4.023 24.525 22.795 362 2HG PRO 46 HG1 PRO 46 -4.942 23.798 21.467 363 1HD PRO 46 HD2 PRO 46 -2.110 23.975 21.635 364 2HD PRO 46 HD1 PRO 46 -3.059 23.531 20.200 365 H LEU 47 HN LEU 47 -1.137 26.821 21.475 366 HA LEU 47 HA LEU 47 -1.631 28.839 23.513 367 1HB LEU 47 HB2 LEU 47 0.997 27.838 22.372 368 2HB LEU 47 HB1 LEU 47 0.810 28.781 23.847 369 HG LEU 47 HG LEU 47 -0.338 26.013 23.359 370 1HD1 LEU 47 HD13 LEU 47 2.190 26.277 23.710 371 2HD1 LEU 47 HD12 LEU 47 1.799 26.838 25.335 372 3HD1 LEU 47 HD11 LEU 47 1.352 25.207 24.836 373 1HD2 LEU 47 HD23 LEU 47 -0.591 28.002 25.619 374 2HD2 LEU 47 HD22 LEU 47 -1.839 26.995 24.885 375 3HD2 LEU 47 HD21 LEU 47 -0.652 26.274 25.966 376 H THR 48 HN THR 48 -0.897 31.026 23.491 377 HA THR 48 HA THR 48 -0.065 32.103 20.809 378 HB THR 48 HB THR 48 -1.509 34.107 21.345 379 HG1 THR 48 HG1 THR 48 -3.108 32.643 22.997 380 1HG2 THR 48 HG22 THR 48 -2.185 32.191 19.821 381 2HG2 THR 48 HG21 THR 48 -3.080 31.526 21.188 382 3HG2 THR 48 HG23 THR 48 -3.523 33.098 20.523 383 H PHE 49 HN PHE 49 1.392 33.840 20.914 384 HA PHE 49 HA PHE 49 2.387 34.584 23.648 385 1HB PHE 49 HB2 PHE 49 3.994 34.061 21.133 386 2HB PHE 49 HB1 PHE 49 4.659 34.687 22.642 387 HD1 PHE 49 HD1 PHE 49 3.191 31.758 20.967 388 HD2 PHE 49 HD2 PHE 49 4.866 33.263 24.625 389 HE1 PHE 49 HE1 PHE 49 3.403 29.441 21.821 390 HE2 PHE 49 HE2 PHE 49 5.075 30.938 25.482 391 HZ PHE 49 HZ PHE 49 4.342 29.032 24.079 392 H THR 50 HN THR 50 2.463 36.741 24.000 393 HA THR 50 HA THR 50 2.289 38.598 21.647 394 HB THR 50 HB THR 50 1.114 38.943 24.421 395 HG1 THR 50 HG1 THR 50 -0.711 38.337 23.546 396 1HG2 THR 50 HG23 THR 50 1.228 40.726 21.985 397 2HG2 THR 50 HG22 THR 50 0.022 40.942 23.254 398 3HG2 THR 50 HG21 THR 50 1.737 41.098 23.632 399 H LYS 51 HN LYS 51 3.884 40.044 21.494 400 HA LYS 51 HA LYS 51 6.040 40.088 23.461 401 1HB LYS 51 HB2 LYS 51 6.333 40.264 20.952 402 2HB LYS 51 HB1 LYS 51 5.649 41.884 21.055 403 1HG LYS 51 HG2 LYS 51 7.439 42.545 22.618 404 2HG LYS 51 HG1 LYS 51 8.128 40.924 22.512 405 1HD LYS 51 HD2 LYS 51 8.394 41.235 20.051 406 2HD LYS 51 HD1 LYS 51 7.810 42.891 20.225 407 1HE LYS 51 HE2 LYS 51 10.331 41.693 21.393 408 2HE LYS 51 HE1 LYS 51 10.202 43.018 20.236 409 1HZ LYS 51 HZ1 LYS 51 8.895 44.195 22.035 410 2HZ LYS 51 HZ3 LYS 51 9.474 43.010 23.101 411 3HZ LYS 51 HZ2 LYS 51 10.566 44.030 22.293 412 H VAL 52 HN VAL 52 6.507 41.765 24.905 413 HA VAL 52 HA VAL 52 4.579 44.073 24.997 414 HB VAL 52 HB VAL 52 4.817 44.052 27.450 415 1HG1 VAL 52 HG11 VAL 52 3.937 41.471 26.139 416 2HG1 VAL 52 HG13 VAL 52 3.683 41.801 27.853 417 3HG1 VAL 52 HG12 VAL 52 2.931 42.832 26.637 418 1HG2 VAL 52 HG21 VAL 52 6.612 41.693 26.846 419 2HG2 VAL 52 HG23 VAL 52 6.982 43.132 27.797 420 3HG2 VAL 52 HG22 VAL 52 5.872 41.919 28.431 421 H SER 53 HN SER 53 5.568 46.034 24.912 422 HA SER 53 HA SER 53 8.528 46.124 24.899 423 1HB SER 53 HB2 SER 53 7.087 47.323 23.176 424 2HB SER 53 HB1 SER 53 6.585 48.407 24.474 425 HG SER 53 HG SER 53 8.990 48.607 24.799 426 H GLU 54 HN GLU 54 6.158 46.328 27.200 427 HA GLU 54 HA GLU 54 7.973 47.687 29.077 428 1HB GLU 54 HB2 GLU 54 6.557 49.469 27.895 429 2HB GLU 54 HB1 GLU 54 5.168 48.757 28.717 430 1HG GLU 54 HG2 GLU 54 6.255 49.132 30.892 431 2HG GLU 54 HG1 GLU 54 7.647 49.842 30.075 432 H GLY 55 HN GLY 55 7.181 47.432 31.320 433 1HA GLY 55 HA2 GLY 55 5.891 46.370 33.012 434 2HA GLY 55 HA1 GLY 55 4.861 45.679 31.758 435 H GLN 56 HN GLN 56 5.581 43.992 33.731 436 HA GLN 56 HA GLN 56 8.049 42.556 33.087 437 1HB GLN 56 HB2 GLN 56 5.736 41.947 34.950 438 2HB GLN 56 HB1 GLN 56 7.153 40.909 34.783 439 1HG GLN 56 HG2 GLN 56 8.619 42.709 35.504 440 2HG GLN 56 HG1 GLN 56 7.267 43.841 35.542 441 1HE2 GLN 56 HE22 GLN 56 7.855 42.462 39.005 442 2HE2 GLN 56 HE21 GLN 56 8.855 43.253 37.885 443 H ALA 57 HN ALA 57 7.964 40.197 32.526 444 HA ALA 57 HA ALA 57 5.539 39.399 30.974 445 1HB ALA 57 HB3 ALA 57 7.375 40.472 29.510 446 2HB ALA 57 HB2 ALA 57 8.326 39.030 29.862 447 3HB ALA 57 HB1 ALA 57 6.782 38.886 29.021 448 H ASP 58 HN ASP 58 5.283 37.119 30.830 449 HA ASP 58 HA ASP 58 6.237 35.601 33.036 450 1HB ASP 58 HB2 ASP 58 5.056 34.751 30.382 451 2HB ASP 58 HB1 ASP 58 5.386 33.622 31.696 452 H ILE 59 HN ILE 59 7.379 35.745 29.666 453 HA ILE 59 HA ILE 59 9.758 34.085 30.457 454 HB ILE 59 HB ILE 59 8.527 34.596 27.732 455 1HG1 ILE 59 HG12 ILE 59 8.751 32.007 29.291 456 2HG1 ILE 59 HG11 ILE 59 7.318 33.035 29.341 457 1HG2 ILE 59 HG22 ILE 59 10.954 33.009 28.612 458 2HG2 ILE 59 HG21 ILE 59 10.186 32.813 27.035 459 3HG2 ILE 59 HG23 ILE 59 10.912 34.358 27.477 460 1HD1 ILE 59 HD11 ILE 59 8.511 31.982 26.765 461 2HD1 ILE 59 HD13 ILE 59 7.217 31.160 27.637 462 3HD1 ILE 59 HD12 ILE 59 6.950 32.774 26.978 463 H MET 60 HN MET 60 11.455 35.406 30.897 464 HA MET 60 HA MET 60 11.757 37.952 29.357 465 1HB MET 60 HB2 MET 60 13.003 36.984 31.945 466 2HB MET 60 HB1 MET 60 13.446 38.492 31.142 467 1HG MET 60 HG2 MET 60 11.083 39.237 31.273 468 2HG MET 60 HG1 MET 60 10.675 37.750 32.128 469 1HE MET 60 HE2 MET 60 13.042 40.678 31.922 470 2HE MET 60 HE1 MET 60 11.595 41.424 32.595 471 3HE MET 60 HE3 MET 60 13.084 41.353 33.549 472 H ILE 61 HN ILE 61 13.356 38.127 27.867 473 HA ILE 61 HA ILE 61 15.393 35.929 27.688 474 HB ILE 61 HB ILE 61 14.373 37.873 25.587 475 1HG1 ILE 61 HG12 ILE 61 14.109 34.857 25.734 476 2HG1 ILE 61 HG11 ILE 61 12.855 35.971 26.283 477 1HG2 ILE 61 HG21 ILE 61 16.453 35.671 25.445 478 2HG2 ILE 61 HG23 ILE 61 15.744 36.449 24.032 479 3HG2 ILE 61 HG22 ILE 61 16.713 37.392 25.162 480 1HD1 ILE 61 HD12 ILE 61 14.017 35.945 23.481 481 2HD1 ILE 61 HD11 ILE 61 12.488 35.192 23.934 482 3HD1 ILE 61 HD13 ILE 61 12.678 36.942 24.050 483 H SER 62 HN SER 62 17.497 36.502 28.119 484 HA SER 62 HA SER 62 18.342 39.314 27.707 485 1HB SER 62 HB2 SER 62 19.187 39.536 29.997 486 2HB SER 62 HB1 SER 62 17.450 39.238 30.019 487 HG SER 62 HG SER 62 17.911 37.044 30.428 488 H PHE 63 HN PHE 63 20.711 39.549 28.077 489 HA PHE 63 HA PHE 63 22.188 37.010 27.437 490 1HB PHE 63 HB2 PHE 63 22.590 39.871 26.507 491 2HB PHE 63 HB1 PHE 63 23.765 38.589 26.233 492 HD1 PHE 63 HD1 PHE 63 20.384 39.814 25.417 493 HD2 PHE 63 HD2 PHE 63 23.320 36.765 24.681 494 HE1 PHE 63 HE1 PHE 63 19.089 39.043 23.445 495 HE2 PHE 63 HE2 PHE 63 22.025 35.994 22.712 496 HZ PHE 63 HZ PHE 63 19.911 37.132 22.094 497 H VAL 64 HN VAL 64 23.968 36.566 28.748 498 HA VAL 64 HA VAL 64 24.812 38.673 30.720 499 HB VAL 64 HB VAL 64 25.011 36.912 32.420 500 1HG1 VAL 64 HG12 VAL 64 22.841 38.206 31.978 501 2HG1 VAL 64 HG11 VAL 64 22.259 36.744 31.183 502 3HG1 VAL 64 HG13 VAL 64 22.686 36.706 32.893 503 1HG2 VAL 64 HG22 VAL 64 23.983 35.178 30.161 504 2HG2 VAL 64 HG21 VAL 64 25.459 34.966 31.103 505 3HG2 VAL 64 HG23 VAL 64 23.888 34.684 31.852 506 H ARG 65 HN ARG 65 26.962 38.302 31.639 507 HA ARG 65 HA ARG 65 28.791 36.729 29.850 508 1HB ARG 65 HB2 ARG 65 29.139 39.509 31.005 509 2HB ARG 65 HB1 ARG 65 30.486 38.564 30.372 510 1HG ARG 65 HG2 ARG 65 29.422 38.435 28.187 511 2HG ARG 65 HG1 ARG 65 28.000 39.288 28.796 512 1HD ARG 65 HD2 ARG 65 29.505 40.831 27.593 513 2HD ARG 65 HD1 ARG 65 29.409 41.253 29.305 514 HE ARG 65 HE ARG 65 31.594 39.578 29.199 515 1HH1 ARG 65 HH21 ARG 65 30.546 42.375 27.479 516 2HH1 ARG 65 HH22 ARG 65 32.151 42.962 27.193 517 1HH2 ARG 65 HH11 ARG 65 33.691 40.327 28.840 518 2HH2 ARG 65 HH12 ARG 65 33.932 41.802 27.964 519 H GLY 66 HN GLY 66 30.494 35.680 30.911 520 1HA GLY 66 HA2 GLY 66 31.360 34.437 32.719 521 2HA GLY 66 HA1 GLY 66 31.633 36.049 33.373 522 H ASP 67 HN ASP 67 31.250 35.378 35.511 523 HA ASP 67 HA ASP 67 28.975 33.909 36.408 524 1HB ASP 67 HB2 ASP 67 31.079 34.371 37.726 525 2HB ASP 67 HB1 ASP 67 30.496 36.018 37.963 526 H HIS 68 HN HIS 68 26.890 34.542 36.802 527 HA HIS 68 HA HIS 68 26.258 37.458 36.897 528 1HB HIS 68 HB2 HIS 68 24.234 36.913 35.440 529 2HB HIS 68 HB1 HIS 68 25.798 36.914 34.627 530 HD1 HIS 68 HD1 HIS 68 26.957 34.248 35.053 531 HD2 HIS 68 HD2 HIS 68 22.851 34.721 34.520 532 HE1 HIS 68 HE1 HIS 68 26.069 31.999 34.299 533 H ARG 69 HN ARG 69 26.356 36.091 39.202 534 HA ARG 69 HA ARG 69 25.100 35.414 41.061 535 1HB ARG 69 HB2 ARG 69 23.038 37.002 39.511 536 2HB ARG 69 HB1 ARG 69 22.759 36.380 41.138 537 1HG ARG 69 HG2 ARG 69 24.627 37.649 42.010 538 2HG ARG 69 HG1 ARG 69 25.094 38.158 40.387 539 1HD ARG 69 HD2 ARG 69 22.963 39.367 40.140 540 2HD ARG 69 HD1 ARG 69 22.482 38.855 41.760 541 HE ARG 69 HE ARG 69 24.882 40.112 42.214 542 1HH1 ARG 69 HH21 ARG 69 21.997 40.892 40.498 543 2HH1 ARG 69 HH22 ARG 69 22.112 42.592 40.811 544 1HH2 ARG 69 HH11 ARG 69 25.049 42.323 42.637 545 2HH2 ARG 69 HH12 ARG 69 23.841 43.401 42.024 546 H ASP 70 HN ASP 70 25.414 33.359 39.321 547 HA ASP 70 HA ASP 70 22.839 31.897 39.619 548 1HB ASP 70 HB2 ASP 70 24.396 32.247 37.049 549 2HB ASP 70 HB1 ASP 70 23.338 30.860 37.303 550 H ASN 71 HN ASN 71 23.201 29.508 39.410 551 HA ASN 71 HA ASN 71 25.729 28.801 40.766 552 1HB ASN 71 HB2 ASN 71 24.653 26.653 41.181 553 2HB ASN 71 HB1 ASN 71 23.526 27.952 41.580 554 1HD2 ASN 71 HD22 ASN 71 21.614 25.555 39.491 555 2HD2 ASN 71 HD21 ASN 71 22.321 25.549 41.034 556 H SER 72 HN SER 72 25.089 29.256 37.638 557 HA SER 72 HA SER 72 26.858 26.989 36.778 558 1HB SER 72 HB2 SER 72 24.448 28.045 35.273 559 2HB SER 72 HB1 SER 72 25.560 26.803 34.701 560 HG SER 72 HG SER 72 24.375 26.487 37.213 561 HA PRO 73 HA PRO 73 28.357 31.200 35.391 562 1HB PRO 73 HB2 PRO 73 31.011 30.549 36.292 563 2HB PRO 73 HB1 PRO 73 29.897 31.724 37.008 564 1HG PRO 73 HG2 PRO 73 30.674 29.133 38.073 565 2HG PRO 73 HG1 PRO 73 29.626 30.348 38.818 566 1HD PRO 73 HD2 PRO 73 28.838 27.834 37.615 567 2HD PRO 73 HD1 PRO 73 27.797 29.054 38.371 568 H PHE 74 HN PHE 74 29.294 31.381 33.333 569 HA PHE 74 HA PHE 74 29.896 28.905 31.913 570 1HB PHE 74 HB2 PHE 74 30.203 31.795 31.040 571 2HB PHE 74 HB1 PHE 74 30.266 30.385 29.981 572 HD1 PHE 74 HD1 PHE 74 28.233 29.040 29.540 573 HD2 PHE 74 HD2 PHE 74 28.108 32.578 31.972 574 HE1 PHE 74 HE1 PHE 74 25.762 29.082 29.349 575 HE2 PHE 74 HE2 PHE 74 25.634 32.619 31.783 576 HZ PHE 74 HZ PHE 74 24.462 30.872 30.470 577 H ASP 75 HN ASP 75 31.960 28.329 31.027 578 HA ASP 75 HA ASP 75 34.314 29.867 32.045 579 1HB ASP 75 HB2 ASP 75 33.815 27.993 33.627 580 2HB ASP 75 HB1 ASP 75 34.005 26.858 32.289 581 H GLY 76 HN GLY 76 34.263 30.475 29.722 582 1HA GLY 76 HA2 GLY 76 35.562 30.321 27.745 583 2HA GLY 76 HA1 GLY 76 36.005 28.671 28.182 584 HA PRO 77 HA PRO 77 32.717 28.735 24.801 585 1HB PRO 77 HB2 PRO 77 34.407 27.092 23.141 586 2HB PRO 77 HB1 PRO 77 33.947 28.778 22.866 587 1HG PRO 77 HG2 PRO 77 36.541 27.755 23.687 588 2HG PRO 77 HG1 PRO 77 36.091 29.430 23.340 589 1HD PRO 77 HD2 PRO 77 36.590 28.239 25.932 590 2HD PRO 77 HD1 PRO 77 36.135 29.917 25.573 591 H GLY 78 HN GLY 78 34.294 26.672 26.892 592 1HA GLY 78 HA2 GLY 78 33.061 24.167 25.918 593 2HA GLY 78 HA1 GLY 78 34.100 24.332 27.334 594 H GLY 79 HN GLY 79 31.982 22.855 27.852 595 1HA GLY 79 HA2 GLY 79 30.246 22.705 29.435 596 2HA GLY 79 HA1 GLY 79 30.493 24.414 29.791 597 H ASN 80 HN ASN 80 28.034 24.310 29.831 598 HA ASN 80 HA ASN 80 26.611 23.961 27.335 599 1HB ASN 80 HB2 ASN 80 25.788 25.399 29.879 600 2HB ASN 80 HB1 ASN 80 24.703 24.957 28.560 601 1HD2 ASN 80 HD22 ASN 80 24.847 21.427 29.328 602 2HD2 ASN 80 HD21 ASN 80 24.705 22.501 28.020 603 H LEU 81 HN LEU 81 25.752 25.620 25.978 604 HA LEU 81 HA LEU 81 27.373 28.105 25.971 605 1HB LEU 81 HB2 LEU 81 25.324 27.142 23.951 606 2HB LEU 81 HB1 LEU 81 26.517 28.420 23.720 607 HG LEU 81 HG LEU 81 27.128 25.487 24.203 608 1HD1 LEU 81 HD13 LEU 81 27.417 27.237 21.742 609 2HD1 LEU 81 HD12 LEU 81 27.996 25.575 21.877 610 3HD1 LEU 81 HD11 LEU 81 26.267 25.915 21.951 611 1HD2 LEU 81 HD22 LEU 81 28.854 27.955 24.002 612 2HD2 LEU 81 HD21 LEU 81 28.958 26.619 25.149 613 3HD2 LEU 81 HD23 LEU 81 29.487 26.393 23.483 614 H ALA 82 HN ALA 82 24.510 27.084 27.300 615 HA ALA 82 HA ALA 82 23.672 29.710 28.058 616 1HB ALA 82 HB1 ALA 82 22.221 28.423 25.740 617 2HB ALA 82 HB3 ALA 82 21.430 29.599 26.789 618 3HB ALA 82 HB2 ALA 82 22.850 30.066 25.854 619 H HIS 83 HN HIS 83 21.354 29.538 29.089 620 HA HIS 83 HA HIS 83 20.409 26.878 29.739 621 1HB HIS 83 HB2 HIS 83 21.033 26.810 32.081 622 2HB HIS 83 HB1 HIS 83 22.499 27.017 31.126 623 HD1 HIS 83 HD1 HIS 83 21.885 28.013 34.173 624 HD2 HIS 83 HD2 HIS 83 22.112 30.368 30.742 625 HE1 HIS 83 HE1 HIS 83 22.446 30.357 34.949 626 H ALA 84 HN ALA 84 18.625 27.027 31.415 627 HA ALA 84 HA ALA 84 17.521 29.766 31.770 628 1HB ALA 84 HB1 ALA 84 16.183 27.506 30.265 629 2HB ALA 84 HB3 ALA 84 15.272 28.847 30.960 630 3HB ALA 84 HB2 ALA 84 16.476 29.153 29.708 631 H PHE 85 HN PHE 85 15.587 29.686 33.258 632 HA PHE 85 HA PHE 85 16.090 27.660 35.380 633 1HB PHE 85 HB2 PHE 85 14.440 30.206 35.363 634 2HB PHE 85 HB1 PHE 85 14.654 29.153 36.764 635 HD1 PHE 85 HD1 PHE 85 16.843 28.931 37.860 636 HD2 PHE 85 HD2 PHE 85 16.262 31.582 34.529 637 HE1 PHE 85 HE1 PHE 85 19.000 30.043 38.368 638 HE2 PHE 85 HE2 PHE 85 18.418 32.695 35.038 639 HZ PHE 85 HZ PHE 85 19.789 31.924 36.957 640 H GLN 86 HN GLN 86 14.194 26.623 36.421 641 HA GLN 86 HA GLN 86 12.468 25.431 34.474 642 1HB GLN 86 HB2 GLN 86 12.370 25.457 37.505 643 2HB GLN 86 HB1 GLN 86 11.317 24.456 36.512 644 1HG GLN 86 HG2 GLN 86 14.346 24.370 36.426 645 2HG GLN 86 HG1 GLN 86 13.338 23.230 37.316 646 1HE2 GLN 86 HE22 GLN 86 14.111 22.293 33.595 647 2HE2 GLN 86 HE21 GLN 86 15.101 23.179 34.650 648 HA PRO 87 HA PRO 87 9.184 28.392 34.213 649 1HB PRO 87 HB2 PRO 87 7.025 26.465 34.474 650 2HB PRO 87 HB1 PRO 87 7.612 27.250 33.002 651 1HG PRO 87 HG2 PRO 87 8.045 24.500 33.857 652 2HG PRO 87 HG1 PRO 87 8.530 25.259 32.333 653 1HD PRO 87 HD2 PRO 87 10.261 24.486 34.469 654 2HD PRO 87 HD1 PRO 87 10.699 25.439 33.037 655 H GLY 88 HN GLY 88 9.218 29.546 36.148 656 1HA GLY 88 HA2 GLY 88 7.290 28.756 38.196 657 2HA GLY 88 HA1 GLY 88 8.961 28.740 38.758 658 HA PRO 89 HA PRO 89 6.999 33.103 38.785 659 1HB PRO 89 HB2 PRO 89 7.142 33.250 41.646 660 2HB PRO 89 HB1 PRO 89 5.677 33.143 40.658 661 1HG PRO 89 HG2 PRO 89 6.925 31.055 42.307 662 2HG PRO 89 HG1 PRO 89 5.329 31.053 41.541 663 1HD PRO 89 HD2 PRO 89 7.604 29.549 40.702 664 2HD PRO 89 HD1 PRO 89 6.079 29.752 39.815 665 H GLY 90 HN GLY 90 8.186 35.017 39.950 666 1HA GLY 90 HA2 GLY 90 10.182 36.131 40.471 667 2HA GLY 90 HA1 GLY 90 10.803 34.590 41.059 668 H ILE 91 HN ILE 91 12.704 34.217 40.055 669 HA ILE 91 HA ILE 91 13.262 35.218 37.371 670 HB ILE 91 HB ILE 91 15.011 35.138 39.106 671 1HG1 ILE 91 HG12 ILE 91 15.719 33.115 36.970 672 2HG1 ILE 91 HG11 ILE 91 15.508 34.826 36.598 673 1HG2 ILE 91 HG23 ILE 91 14.050 32.973 40.104 674 2HG2 ILE 91 HG22 ILE 91 14.949 32.128 38.843 675 3HG2 ILE 91 HG21 ILE 91 15.807 33.104 40.036 676 1HD1 ILE 91 HD11 ILE 91 17.392 33.792 38.733 677 2HD1 ILE 91 HD13 ILE 91 17.892 34.168 37.084 678 3HD1 ILE 91 HD12 ILE 91 17.272 35.445 38.129 679 H GLY 92 HN GLY 92 11.714 32.458 38.553 680 1HA GLY 92 HA2 GLY 92 12.653 30.393 36.867 681 2HA GLY 92 HA1 GLY 92 11.004 30.497 37.477 682 H GLY 93 HN GLY 93 12.300 29.874 34.733 683 1HA GLY 93 HA2 GLY 93 11.218 29.947 32.605 684 2HA GLY 93 HA1 GLY 93 10.249 31.308 33.162 685 H ASP 94 HN ASP 94 12.966 32.488 34.163 686 HA ASP 94 HA ASP 94 13.387 34.181 31.881 687 1HB ASP 94 HB2 ASP 94 15.029 33.714 34.379 688 2HB ASP 94 HB1 ASP 94 15.439 34.927 33.165 689 H ALA 95 HN ALA 95 14.671 33.897 30.124 690 HA ALA 95 HA ALA 95 16.414 31.473 30.028 691 1HB ALA 95 HB3 ALA 95 15.277 33.263 27.862 692 2HB ALA 95 HB2 ALA 95 16.410 31.947 27.551 693 3HB ALA 95 HB1 ALA 95 14.814 31.599 28.219 694 H HIS 96 HN HIS 96 18.614 31.690 29.950 695 HA HIS 96 HA HIS 96 19.752 34.454 29.597 696 1HB HIS 96 HB2 HIS 96 20.629 32.123 31.315 697 2HB HIS 96 HB1 HIS 96 21.703 33.468 30.935 698 HD2 HIS 96 HD2 HIS 96 18.049 34.774 31.627 699 HE1 HIS 96 HE1 HIS 96 20.427 35.091 35.140 700 HE2 HIS 96 HE2 HIS 96 18.229 35.735 34.055 701 H PHE 97 HN PHE 97 21.340 34.694 28.058 702 HA PHE 97 HA PHE 97 22.187 32.230 26.545 703 1HB PHE 97 HB2 PHE 97 21.722 35.080 25.642 704 2HB PHE 97 HB1 PHE 97 22.534 33.876 24.643 705 HD1 PHE 97 HD1 PHE 97 19.401 34.362 26.654 706 HD2 PHE 97 HD2 PHE 97 21.241 32.504 23.242 707 HE1 PHE 97 HE1 PHE 97 17.196 33.490 25.938 708 HE2 PHE 97 HE2 PHE 97 19.032 31.634 22.528 709 HZ PHE 97 HZ PHE 97 17.010 32.127 23.875 710 H ASP 98 HN ASP 98 24.382 31.878 26.342 711 HA ASP 98 HA ASP 98 26.214 33.435 27.946 712 1HB ASP 98 HB2 ASP 98 26.482 30.985 27.385 713 2HB ASP 98 HB1 ASP 98 26.919 31.470 25.745 714 H GLU 99 HN GLU 99 26.614 35.511 27.328 715 HA GLU 99 HA GLU 99 26.625 36.347 24.548 716 1HB GLU 99 HB2 GLU 99 25.906 37.818 26.396 717 2HB GLU 99 HB1 GLU 99 27.523 37.782 27.063 718 1HG GLU 99 HG2 GLU 99 27.058 39.851 25.754 719 2HG GLU 99 HG1 GLU 99 28.406 38.937 25.099 720 H ASP 100 HN ASP 100 28.877 34.632 26.284 721 HA ASP 100 HA ASP 100 31.299 35.999 25.444 722 1HB ASP 100 HB2 ASP 100 30.800 33.182 26.438 723 2HB ASP 100 HB1 ASP 100 32.402 33.818 26.077 724 H GLU 101 HN GLU 101 29.366 33.320 24.118 725 HA GLU 101 HA GLU 101 31.306 32.834 21.975 726 1HB GLU 101 HB2 GLU 101 28.487 31.827 22.463 727 2HB GLU 101 HB1 GLU 101 29.463 31.347 21.076 728 1HG GLU 101 HG2 GLU 101 29.827 29.647 22.698 729 2HG GLU 101 HG1 GLU 101 31.264 30.663 22.777 730 H ARG 102 HN ARG 102 30.867 33.211 19.720 731 HA ARG 102 HA ARG 102 29.352 35.718 19.269 732 1HB ARG 102 HB2 ARG 102 31.693 35.397 18.388 733 2HB ARG 102 HB1 ARG 102 31.081 34.113 17.354 734 1HG ARG 102 HG2 ARG 102 31.004 35.935 15.904 735 2HG ARG 102 HG1 ARG 102 29.368 35.957 16.549 736 1HD ARG 102 HD2 ARG 102 30.444 37.537 18.383 737 2HD ARG 102 HD1 ARG 102 31.672 37.798 17.151 738 HE ARG 102 HE ARG 102 29.074 38.981 17.210 739 1HH1 ARG 102 HH21 ARG 102 31.216 37.385 15.025 740 2HH1 ARG 102 HH22 ARG 102 30.384 37.934 13.612 741 1HH2 ARG 102 HH11 ARG 102 27.996 39.711 15.382 742 2HH2 ARG 102 HH12 ARG 102 28.569 39.254 13.812 743 H TRP 103 HN TRP 103 27.279 35.572 18.614 744 HA TRP 103 HA TRP 103 26.228 33.017 17.589 745 1HB TRP 103 HB2 TRP 103 24.881 35.659 18.220 746 2HB TRP 103 HB1 TRP 103 24.041 34.182 17.751 747 HD1 TRP 103 HD1 TRP 103 25.173 35.976 20.725 748 HE1 TRP 103 HE1 TRP 103 25.177 34.438 22.796 749 HE3 TRP 103 HE3 TRP 103 24.685 31.432 18.449 750 HZ2 TRP 103 HZ2 TRP 103 24.997 31.646 23.404 751 HZ3 TRP 103 HZ3 TRP 103 24.607 29.353 19.794 752 HH2 TRP 103 HH2 TRP 103 24.763 29.454 22.266 753 H THR 104 HN THR 104 25.258 32.753 15.544 754 HA THR 104 HA THR 104 25.656 34.968 13.563 755 HB THR 104 HB THR 104 26.414 33.309 11.914 756 HG1 THR 104 HG1 THR 104 26.644 31.207 12.467 757 1HG2 THR 104 HG23 THR 104 27.941 33.285 14.528 758 2HG2 THR 104 HG22 THR 104 28.603 32.739 12.987 759 3HG2 THR 104 HG21 THR 104 28.139 34.427 13.199 760 H ASN 105 HN ASN 105 24.352 34.489 11.518 761 HA ASN 105 HA ASN 105 21.703 33.307 12.291 762 1HB ASN 105 HB2 ASN 105 22.441 35.470 10.304 763 2HB ASN 105 HB1 ASN 105 20.831 34.756 10.417 764 1HD2 ASN 105 HD21 ASN 105 21.664 37.573 11.053 765 2HD2 ASN 105 HD22 ASN 105 21.211 37.822 12.670 766 H ASN 106 HN ASN 106 24.110 31.891 11.123 767 HA ASN 106 HA ASN 106 22.625 30.586 8.904 768 1HB ASN 106 HB2 ASN 106 24.775 30.544 7.548 769 2HB ASN 106 HB1 ASN 106 23.989 32.120 7.662 770 1HD2 ASN 106 HD22 ASN 106 26.770 32.188 10.527 771 2HD2 ASN 106 HD21 ASN 106 25.314 31.330 10.665 772 H PHE 107 HN PHE 107 24.633 28.820 8.121 773 HA PHE 107 HA PHE 107 24.597 26.976 10.364 774 1HB PHE 107 HB2 PHE 107 25.664 25.411 8.845 775 2HB PHE 107 HB1 PHE 107 24.404 26.275 7.962 776 HD1 PHE 107 HD1 PHE 107 28.038 25.919 8.476 777 HD2 PHE 107 HD2 PHE 107 24.956 27.902 6.235 778 HE1 PHE 107 HE1 PHE 107 29.733 26.722 6.854 779 HE2 PHE 107 HE2 PHE 107 26.652 28.703 4.612 780 HZ PHE 107 HZ PHE 107 29.041 28.114 4.924 781 H ARG 108 HN ARG 108 26.709 29.495 9.536 782 HA ARG 108 HA ARG 108 29.259 28.406 10.115 783 1HB ARG 108 HB2 ARG 108 28.206 31.175 10.768 784 2HB ARG 108 HB1 ARG 108 29.905 30.712 10.774 785 1HG ARG 108 HG2 ARG 108 29.742 30.098 8.382 786 2HG ARG 108 HG1 ARG 108 28.050 30.595 8.378 787 1HD ARG 108 HD2 ARG 108 28.792 32.888 9.095 788 2HD ARG 108 HD1 ARG 108 30.460 32.361 8.894 789 HE ARG 108 HE ARG 108 29.192 31.763 6.467 790 1HH1 ARG 108 HH21 ARG 108 29.776 34.509 8.466 791 2HH1 ARG 108 HH22 ARG 108 29.733 35.639 7.155 792 1HH2 ARG 108 HH11 ARG 108 29.128 33.223 4.743 793 2HH2 ARG 108 HH12 ARG 108 29.365 34.912 5.047 794 H GLU 109 HN GLU 109 30.293 29.694 12.295 795 HA GLU 109 HA GLU 109 30.595 28.438 14.468 796 1HB GLU 109 HB2 GLU 109 29.154 31.090 14.566 797 2HB GLU 109 HB1 GLU 109 29.848 30.320 15.992 798 1HG GLU 109 HG2 GLU 109 32.064 30.369 15.021 799 2HG GLU 109 HG1 GLU 109 31.423 30.937 13.477 800 H TYR 110 HN TYR 110 27.652 30.113 15.337 801 HA TYR 110 HA TYR 110 26.227 27.508 15.718 802 1HB TYR 110 HB2 TYR 110 26.521 29.675 17.824 803 2HB TYR 110 HB1 TYR 110 25.531 28.224 17.973 804 HD1 TYR 110 HD2 TYR 110 26.604 25.971 18.034 805 HD2 TYR 110 HD1 TYR 110 28.908 29.596 18.108 806 HE1 TYR 110 HE2 TYR 110 28.575 24.700 18.841 807 HE2 TYR 110 HE1 TYR 110 30.880 28.326 18.914 808 HH TYR 110 HH TYR 110 31.354 26.226 20.095 809 H ASN 111 HN ASN 111 23.941 27.701 15.671 810 HA ASN 111 HA ASN 111 22.970 30.181 14.354 811 1HB ASN 111 HB2 ASN 111 22.458 27.914 13.401 812 2HB ASN 111 HB1 ASN 111 21.500 27.576 14.843 813 1HD2 ASN 111 HD22 ASN 111 18.819 28.892 12.893 814 2HD2 ASN 111 HD21 ASN 111 19.540 27.466 13.465 815 H LEU 112 HN LEU 112 22.045 31.714 15.586 816 HA LEU 112 HA LEU 112 21.519 31.461 18.359 817 1HB LEU 112 HB2 LEU 112 21.867 33.619 17.222 818 2HB LEU 112 HB1 LEU 112 20.343 33.423 16.369 819 HG LEU 112 HG LEU 112 19.134 33.425 18.533 820 1HD1 LEU 112 HD13 LEU 112 21.953 33.570 19.594 821 2HD1 LEU 112 HD12 LEU 112 20.646 34.321 20.507 822 3HD1 LEU 112 HD11 LEU 112 20.598 32.595 20.163 823 1HD2 LEU 112 HD23 LEU 112 21.023 35.747 18.044 824 2HD2 LEU 112 HD22 LEU 112 19.398 35.549 17.389 825 3HD2 LEU 112 HD21 LEU 112 19.625 35.824 19.116 826 H HIS 113 HN HIS 113 19.241 31.257 15.597 827 HA HIS 113 HA HIS 113 16.881 31.042 17.156 828 1HB HIS 113 HB2 HIS 113 16.845 31.389 14.704 829 2HB HIS 113 HB1 HIS 113 17.425 29.739 14.472 830 HD1 HIS 113 HD1 HIS 113 15.191 29.040 13.279 831 HD2 HIS 113 HD2 HIS 113 14.677 30.345 17.208 832 HE1 HIS 113 HE1 HIS 113 12.826 28.418 13.945 833 H ARG 114 HN ARG 114 19.146 28.514 16.083 834 HA ARG 114 HA ARG 114 17.610 26.279 16.925 835 1HB ARG 114 HB2 ARG 114 19.737 26.192 15.567 836 2HB ARG 114 HB1 ARG 114 20.629 26.519 17.050 837 1HG ARG 114 HG2 ARG 114 20.704 24.188 17.001 838 2HG ARG 114 HG1 ARG 114 19.271 24.447 17.988 839 1HD ARG 114 HD2 ARG 114 18.443 22.911 16.456 840 2HD ARG 114 HD1 ARG 114 18.051 24.410 15.611 841 HE ARG 114 HE ARG 114 20.571 23.828 14.676 842 1HH1 ARG 114 HH21 ARG 114 17.617 22.082 15.033 843 2HH1 ARG 114 HH22 ARG 114 17.885 21.083 13.644 844 1HH2 ARG 114 HH11 ARG 114 20.936 22.528 12.860 845 2HH2 ARG 114 HH12 ARG 114 19.763 21.335 12.415 846 H VAL 115 HN VAL 115 19.927 28.294 18.763 847 HA VAL 115 HA VAL 115 19.664 26.705 21.169 848 HB VAL 115 HB VAL 115 20.632 29.543 20.719 849 1HG1 VAL 115 HG12 VAL 115 20.536 27.835 23.214 850 2HG1 VAL 115 HG11 VAL 115 21.652 29.190 23.040 851 3HG1 VAL 115 HG13 VAL 115 19.912 29.470 22.996 852 1HG2 VAL 115 HG21 VAL 115 22.069 26.926 21.264 853 2HG2 VAL 115 HG23 VAL 115 22.025 27.775 19.718 854 3HG2 VAL 115 HG22 VAL 115 22.849 28.499 21.099 855 H ALA 116 HN ALA 116 18.082 29.655 19.963 856 HA ALA 116 HA ALA 116 16.582 30.250 22.306 857 1HB ALA 116 HB3 ALA 116 16.818 31.687 20.211 858 2HB ALA 116 HB2 ALA 116 15.592 30.655 19.476 859 3HB ALA 116 HB1 ALA 116 15.199 31.610 20.905 860 H ALA 117 HN ALA 117 15.722 28.257 19.474 861 HA ALA 117 HA ALA 117 13.130 27.505 20.353 862 1HB ALA 117 HB3 ALA 117 15.120 25.964 18.664 863 2HB ALA 117 HB2 ALA 117 13.414 25.554 18.829 864 3HB ALA 117 HB1 ALA 117 13.886 27.075 18.072 865 H HIS 118 HN HIS 118 16.283 25.921 20.912 866 HA HIS 118 HA HIS 118 15.283 23.668 22.330 867 1HB HIS 118 HB2 HIS 118 17.622 23.847 21.550 868 2HB HIS 118 HB1 HIS 118 17.914 25.130 22.724 869 HD1 HIS 118 HD1 HIS 118 16.643 21.529 22.749 870 HD2 HIS 118 HD2 HIS 118 18.849 24.144 25.131 871 HE1 HIS 118 HE1 HIS 118 17.418 20.190 24.753 872 H GLU 119 HN GLU 119 16.334 26.861 23.533 873 HA GLU 119 HA GLU 119 15.902 26.329 26.302 874 1HB GLU 119 HB2 GLU 119 15.787 28.900 24.706 875 2HB GLU 119 HB1 GLU 119 15.678 28.845 26.466 876 1HG GLU 119 HG2 GLU 119 17.869 27.728 26.578 877 2HG GLU 119 HG1 GLU 119 17.981 27.760 24.818 878 H LEU 120 HN LEU 120 13.723 27.554 23.776 879 HA LEU 120 HA LEU 120 11.514 28.118 25.504 880 1HB LEU 120 HB2 LEU 120 11.630 27.374 22.570 881 2HB LEU 120 HB1 LEU 120 10.144 27.855 23.383 882 HG LEU 120 HG LEU 120 12.660 29.553 23.328 883 1HD1 LEU 120 HD13 LEU 120 10.193 29.660 21.567 884 2HD1 LEU 120 HD12 LEU 120 11.421 30.923 21.638 885 3HD1 LEU 120 HD11 LEU 120 11.842 29.317 21.050 886 1HD2 LEU 120 HD22 LEU 120 9.860 29.917 24.388 887 2HD2 LEU 120 HD21 LEU 120 11.399 30.379 25.114 888 3HD2 LEU 120 HD23 LEU 120 10.732 31.327 23.789 889 H GLY 121 HN GLY 121 12.516 25.170 23.804 890 1HA GLY 121 HA2 GLY 121 10.205 23.616 24.363 891 2HA GLY 121 HA1 GLY 121 11.816 22.951 24.095 892 H HIS 122 HN HIS 122 13.135 24.191 26.321 893 HA HIS 122 HA HIS 122 12.434 22.337 28.400 894 1HB HIS 122 HB2 HIS 122 14.176 24.814 28.381 895 2HB HIS 122 HB1 HIS 122 13.982 23.797 29.810 896 HD1 HIS 122 HD1 HIS 122 14.086 21.023 28.768 897 HD2 HIS 122 HD2 HIS 122 16.559 24.001 27.222 898 HE1 HIS 122 HE1 HIS 122 16.028 19.835 27.665 899 H SER 123 HN SER 123 11.712 25.773 27.891 900 HA SER 123 HA SER 123 10.398 26.187 30.410 901 1HB SER 123 HB2 SER 123 9.541 28.208 29.436 902 2HB SER 123 HB1 SER 123 11.156 27.980 28.771 903 HG SER 123 HG SER 123 9.862 28.378 27.047 904 H LEU 124 HN LEU 124 9.416 24.672 27.419 905 HA LEU 124 HA LEU 124 6.559 24.708 28.128 906 1HB LEU 124 HB2 LEU 124 8.082 23.364 25.881 907 2HB LEU 124 HB1 LEU 124 6.331 23.290 26.065 908 HG LEU 124 HG LEU 124 7.919 25.865 25.821 909 1HD1 LEU 124 HD11 LEU 124 8.003 24.458 23.764 910 2HD1 LEU 124 HD13 LEU 124 6.240 24.443 23.733 911 3HD1 LEU 124 HD12 LEU 124 7.113 25.960 23.519 912 1HD2 LEU 124 HD23 LEU 124 4.995 25.196 26.107 913 2HD2 LEU 124 HD22 LEU 124 5.915 26.512 26.838 914 3HD2 LEU 124 HD21 LEU 124 5.450 26.601 25.144 915 H GLY 125 HN GLY 125 9.172 22.986 29.201 916 1HA GLY 125 HA2 GLY 125 9.087 21.185 30.759 917 2HA GLY 125 HA1 GLY 125 7.423 20.868 30.276 918 H LEU 126 HN LEU 126 9.518 21.198 27.597 919 HA LEU 126 HA LEU 126 9.197 18.368 26.952 920 1HB LEU 126 HB2 LEU 126 10.827 20.522 25.564 921 2HB LEU 126 HB1 LEU 126 10.429 18.940 24.892 922 HG LEU 126 HG LEU 126 8.418 21.065 25.696 923 1HD1 LEU 126 HD13 LEU 126 9.867 21.436 23.599 924 2HD1 LEU 126 HD12 LEU 126 9.008 20.060 22.910 925 3HD1 LEU 126 HD11 LEU 126 8.119 21.508 23.385 926 1HD2 LEU 126 HD21 LEU 126 8.166 18.230 24.703 927 2HD2 LEU 126 HD23 LEU 126 7.239 19.058 25.955 928 3HD2 LEU 126 HD22 LEU 126 6.935 19.413 24.257 929 H SER 127 HN SER 127 10.886 16.825 26.792 930 HA SER 127 HA SER 127 13.277 17.440 28.488 931 1HB SER 127 HB2 SER 127 11.900 14.836 27.791 932 2HB SER 127 HB1 SER 127 13.414 14.935 28.685 933 HG SER 127 HG SER 127 10.820 15.683 29.423 934 H HIS 128 HN HIS 128 15.322 16.392 27.829 935 HA HIS 128 HA HIS 128 16.037 16.944 25.130 936 1HB HIS 128 HB2 HIS 128 17.388 15.165 27.180 937 2HB HIS 128 HB1 HIS 128 18.122 15.661 25.656 938 HD1 HIS 128 HD1 HIS 128 17.175 16.938 29.044 939 HD2 HIS 128 HD2 HIS 128 18.862 18.426 25.534 940 HE1 HIS 128 HE1 HIS 128 18.130 19.213 29.616 941 H SER 129 HN SER 129 17.023 15.188 23.651 942 HA SER 129 HA SER 129 15.686 12.555 23.815 943 1HB SER 129 HB2 SER 129 14.036 14.003 22.663 944 2HB SER 129 HB1 SER 129 15.258 14.438 21.473 945 HG SER 129 HG SER 129 15.297 11.846 21.558 946 H THR 130 HN THR 130 16.641 11.012 22.327 947 HA THR 130 HA THR 130 19.407 11.777 21.502 948 HB THR 130 HB THR 130 19.827 9.363 21.424 949 HG1 THR 130 HG1 THR 130 17.405 8.685 22.512 950 1HG2 THR 130 HG21 THR 130 19.924 10.601 23.608 951 2HG2 THR 130 HG23 THR 130 18.279 10.054 23.932 952 3HG2 THR 130 HG22 THR 130 19.585 8.879 23.781 953 H ASP 131 HN ASP 131 16.543 11.944 20.046 954 HA ASP 131 HA ASP 131 17.109 10.401 17.615 955 1HB ASP 131 HB2 ASP 131 14.782 10.793 18.413 956 2HB ASP 131 HB1 ASP 131 14.996 12.517 18.109 957 H ILE 132 HN ILE 132 18.274 11.129 15.927 958 HA ILE 132 HA ILE 132 19.683 13.595 15.950 959 HB ILE 132 HB ILE 132 20.356 11.604 14.622 960 1HG1 ILE 132 HG12 ILE 132 19.863 14.008 12.840 961 2HG1 ILE 132 HG11 ILE 132 21.120 13.963 14.076 962 1HG2 ILE 132 HG22 ILE 132 17.977 11.118 13.874 963 2HG2 ILE 132 HG21 ILE 132 18.157 12.433 12.710 964 3HG2 ILE 132 HG23 ILE 132 19.197 11.012 12.605 965 1HD1 ILE 132 HD11 ILE 132 20.902 11.846 11.928 966 2HD1 ILE 132 HD13 ILE 132 21.842 13.320 11.703 967 3HD1 ILE 132 HD12 ILE 132 22.273 12.187 12.984 968 H GLY 133 HN GLY 133 16.613 12.704 14.396 969 1HA GLY 133 HA2 GLY 133 16.375 15.240 12.998 970 2HA GLY 133 HA1 GLY 133 15.109 14.030 13.156 971 H ALA 134 HN ALA 134 16.272 14.706 16.231 972 HA ALA 134 HA ALA 134 13.920 16.460 16.759 973 1HB ALA 134 HB3 ALA 134 15.724 14.825 18.549 974 2HB ALA 134 HB2 ALA 134 14.574 15.996 19.190 975 3HB ALA 134 HB1 ALA 134 13.998 14.617 18.257 976 H LEU 135 HN LEU 135 14.130 18.529 17.565 977 HA LEU 135 HA LEU 135 16.591 19.945 17.058 978 1HB LEU 135 HB2 LEU 135 14.121 20.803 18.599 979 2HB LEU 135 HB1 LEU 135 15.407 21.883 18.063 980 HG LEU 135 HG LEU 135 13.708 20.174 16.216 981 1HD1 LEU 135 HD11 LEU 135 13.595 23.138 16.858 982 2HD1 LEU 135 HD13 LEU 135 12.678 22.349 15.575 983 3HD1 LEU 135 HD12 LEU 135 12.369 21.936 17.262 984 1HD2 LEU 135 HD21 LEU 135 15.987 22.108 15.809 985 2HD2 LEU 135 HD23 LEU 135 15.684 20.560 15.019 986 3HD2 LEU 135 HD22 LEU 135 14.740 21.975 14.569 987 H MET 136 HN MET 136 15.063 18.700 20.006 988 HA MET 136 HA MET 136 16.912 20.027 21.788 989 1HB MET 136 HB2 MET 136 15.264 17.548 22.352 990 2HB MET 136 HB1 MET 136 15.923 18.681 23.535 991 1HG MET 136 HG2 MET 136 14.551 20.494 22.413 992 2HG MET 136 HG1 MET 136 13.763 19.220 21.483 993 1HE MET 136 HE3 MET 136 14.904 20.290 24.953 994 2HE MET 136 HE2 MET 136 13.562 21.362 24.565 995 3HE MET 136 HE1 MET 136 13.417 20.233 25.910 996 H TYR 137 HN TYR 137 18.253 18.532 19.647 997 HA TYR 137 HA TYR 137 19.336 16.083 20.659 998 1HB TYR 137 HB2 TYR 137 19.471 17.112 18.261 999 2HB TYR 137 HB1 TYR 137 20.886 17.965 18.872 1000 HD1 TYR 137 HD2 TYR 137 19.407 14.528 18.628 1001 HD2 TYR 137 HD1 TYR 137 22.987 16.886 18.861 1002 HE1 TYR 137 HE2 TYR 137 20.775 12.496 18.240 1003 HE2 TYR 137 HE1 TYR 137 24.353 14.857 18.473 1004 HH TYR 137 HH TYR 137 22.870 11.774 17.652 1005 HA PRO 138 HA PRO 138 21.728 17.839 24.009 1006 1HB PRO 138 HB2 PRO 138 23.893 15.904 23.682 1007 2HB PRO 138 HB1 PRO 138 22.683 15.998 24.970 1008 1HG PRO 138 HG2 PRO 138 22.780 14.096 22.805 1009 2HG PRO 138 HG1 PRO 138 21.546 14.229 24.065 1010 1HD PRO 138 HD2 PRO 138 21.267 14.900 21.271 1011 2HD PRO 138 HD1 PRO 138 20.056 15.084 22.559 1012 H SER 139 HN SER 139 23.862 16.662 21.361 1013 HA SER 139 HA SER 139 25.625 18.980 21.733 1014 1HB SER 139 HB2 SER 139 26.999 17.956 20.020 1015 2HB SER 139 HB1 SER 139 26.474 16.703 21.141 1016 HG SER 139 HG SER 139 26.128 16.776 18.544 1017 H TYR 140 HN TYR 140 26.227 20.352 19.861 1018 HA TYR 140 HA TYR 140 23.819 21.329 18.477 1019 1HB TYR 140 HB2 TYR 140 25.404 22.927 19.488 1020 2HB TYR 140 HB1 TYR 140 26.691 22.314 18.449 1021 HD1 TYR 140 HD1 TYR 140 26.713 22.782 16.051 1022 HD2 TYR 140 HD2 TYR 140 23.588 24.295 18.580 1023 HE1 TYR 140 HE1 TYR 140 26.018 24.344 14.256 1024 HE2 TYR 140 HE2 TYR 140 22.891 25.857 16.783 1025 HH TYR 140 HH TYR 140 23.926 25.566 13.592 1026 H THR 141 HN THR 141 23.392 20.969 16.312 1027 HA THR 141 HA THR 141 25.554 20.107 14.495 1028 HB THR 141 HB THR 141 24.181 18.087 13.783 1029 HG1 THR 141 HG1 THR 141 22.764 17.353 15.513 1030 1HG2 THR 141 HG23 THR 141 26.211 18.083 15.396 1031 2HG2 THR 141 HG22 THR 141 25.016 17.857 16.673 1032 3HG2 THR 141 HG21 THR 141 25.168 16.661 15.388 1033 H PHE 142 HN PHE 142 25.183 21.115 12.574 1034 HA PHE 142 HA PHE 142 22.623 22.460 12.127 1035 1HB PHE 142 HB2 PHE 142 24.755 23.532 11.468 1036 2HB PHE 142 HB1 PHE 142 25.042 22.233 10.310 1037 HD1 PHE 142 HD1 PHE 142 23.003 25.186 11.101 1038 HD2 PHE 142 HD2 PHE 142 23.692 22.031 8.270 1039 HE1 PHE 142 HE1 PHE 142 21.610 26.381 9.434 1040 HE2 PHE 142 HE2 PHE 142 22.298 23.225 6.601 1041 HZ PHE 142 HZ PHE 142 21.256 25.400 7.183 1042 H SER 143 HN SER 143 20.957 21.689 10.930 1043 HA SER 143 HA SER 143 21.453 19.502 8.962 1044 1HB SER 143 HB2 SER 143 20.779 18.338 10.993 1045 2HB SER 143 HB1 SER 143 19.414 19.430 11.209 1046 HG SER 143 HG SER 143 18.372 18.464 9.607 1047 H GLY 144 HN GLY 144 20.910 20.795 7.205 1048 1HA GLY 144 HA2 GLY 144 19.567 22.107 5.786 1049 2HA GLY 144 HA1 GLY 144 18.253 21.108 6.411 1050 H ASP 145 HN ASP 145 16.748 22.840 6.488 1051 HA ASP 145 HA ASP 145 17.395 25.285 7.957 1052 1HB ASP 145 HB2 ASP 145 14.820 24.215 6.777 1053 2HB ASP 145 HB1 ASP 145 14.921 25.752 7.636 1054 H VAL 146 HN VAL 146 15.837 25.946 9.784 1055 HA VAL 146 HA VAL 146 15.774 23.722 11.749 1056 HB VAL 146 HB VAL 146 15.326 26.707 12.063 1057 1HG1 VAL 146 HG11 VAL 146 15.536 24.454 14.081 1058 2HG1 VAL 146 HG13 VAL 146 15.656 26.163 14.503 1059 3HG1 VAL 146 HG12 VAL 146 14.159 25.526 13.821 1060 1HG2 VAL 146 HG21 VAL 146 17.639 25.965 11.402 1061 2HG2 VAL 146 HG23 VAL 146 17.573 26.732 12.989 1062 3HG2 VAL 146 HG22 VAL 146 17.687 24.977 12.861 1063 H GLN 147 HN GLN 147 13.919 22.559 11.743 1064 HA GLN 147 HA GLN 147 11.307 24.021 11.755 1065 1HB GLN 147 HB2 GLN 147 12.053 21.617 10.060 1066 2HB GLN 147 HB1 GLN 147 10.391 22.149 10.323 1067 1HG GLN 147 HG2 GLN 147 10.909 24.339 9.356 1068 2HG GLN 147 HG1 GLN 147 12.594 23.864 9.141 1069 1HE2 GLN 147 HE22 GLN 147 11.739 22.769 5.900 1070 2HE2 GLN 147 HE21 GLN 147 12.709 23.784 6.855 1071 H LEU 148 HN LEU 148 9.572 22.692 12.763 1072 HA LEU 148 HA LEU 148 10.592 21.193 15.041 1073 1HB LEU 148 HB2 LEU 148 7.738 21.517 14.059 1074 2HB LEU 148 HB1 LEU 148 8.216 20.877 15.628 1075 HG LEU 148 HG LEU 148 8.887 23.666 14.636 1076 1HD1 LEU 148 HD13 LEU 148 6.735 22.665 16.523 1077 2HD1 LEU 148 HD12 LEU 148 7.196 24.360 16.370 1078 3HD1 LEU 148 HD11 LEU 148 6.498 23.509 14.992 1079 1HD2 LEU 148 HD23 LEU 148 9.410 22.141 17.191 1080 2HD2 LEU 148 HD22 LEU 148 10.517 23.144 16.254 1081 3HD2 LEU 148 HD21 LEU 148 9.261 23.898 17.228 1082 H ALA 149 HN ALA 149 10.213 18.948 15.459 1083 HA ALA 149 HA ALA 149 9.986 17.307 12.966 1084 1HB ALA 149 HB3 ALA 149 12.038 17.123 14.444 1085 2HB ALA 149 HB2 ALA 149 10.988 16.450 15.692 1086 3HB ALA 149 HB1 ALA 149 11.192 15.602 14.158 1087 H GLN 150 HN GLN 150 8.862 15.185 13.248 1088 HA GLN 150 HA GLN 150 6.196 15.501 14.204 1089 1HB GLN 150 HB2 GLN 150 6.960 13.811 12.493 1090 2HB GLN 150 HB1 GLN 150 7.699 12.891 13.803 1091 1HG GLN 150 HG2 GLN 150 5.529 11.929 13.405 1092 2HG GLN 150 HG1 GLN 150 5.420 12.830 14.915 1093 1HE2 GLN 150 HE22 GLN 150 2.898 14.955 13.699 1094 2HE2 GLN 150 HE21 GLN 150 3.755 14.349 15.034 1095 H ASP 151 HN ASP 151 9.081 14.035 15.645 1096 HA ASP 151 HA ASP 151 7.879 12.914 17.954 1097 1HB ASP 151 HB2 ASP 151 10.223 12.496 17.283 1098 2HB ASP 151 HB1 ASP 151 10.628 14.169 17.660 1099 H ASP 152 HN ASP 152 9.057 16.224 17.329 1100 HA ASP 152 HA ASP 152 8.463 17.098 20.044 1101 1HB ASP 152 HB2 ASP 152 9.109 18.606 17.497 1102 2HB ASP 152 HB1 ASP 152 8.830 19.399 19.048 1103 H ILE 153 HN ILE 153 6.825 17.398 16.876 1104 HA ILE 153 HA ILE 153 4.689 19.056 17.792 1105 HB ILE 153 HB ILE 153 4.793 16.981 15.580 1106 1HG1 ILE 153 HG12 ILE 153 4.811 20.009 15.448 1107 2HG1 ILE 153 HG11 ILE 153 6.281 19.034 15.462 1108 1HG2 ILE 153 HG23 ILE 153 2.650 18.984 16.336 1109 2HG2 ILE 153 HG22 ILE 153 2.767 18.283 14.723 1110 3HG2 ILE 153 HG21 ILE 153 2.470 17.243 16.114 1111 1HD1 ILE 153 HD11 ILE 153 4.048 18.735 13.433 1112 2HD1 ILE 153 HD13 ILE 153 5.538 19.633 13.150 1113 3HD1 ILE 153 HD12 ILE 153 5.597 17.892 13.422 1114 H ASP 154 HN ASP 154 4.859 15.484 17.512 1115 HA ASP 154 HA ASP 154 2.278 14.984 18.609 1116 1HB ASP 154 HB2 ASP 154 4.804 13.321 18.592 1117 2HB ASP 154 HB1 ASP 154 3.259 12.717 19.193 1118 H GLY 155 HN GLY 155 5.448 15.305 20.201 1119 1HA GLY 155 HA2 GLY 155 4.567 14.589 22.820 1120 2HA GLY 155 HA1 GLY 155 5.995 15.558 22.466 1121 H ILE 156 HN ILE 156 4.983 17.859 21.385 1122 HA ILE 156 HA ILE 156 3.917 19.164 23.722 1123 HB ILE 156 HB ILE 156 5.394 20.256 21.996 1124 1HG1 ILE 156 HG12 ILE 156 4.071 22.428 22.003 1125 2HG1 ILE 156 HG11 ILE 156 2.738 21.528 22.717 1126 1HG2 ILE 156 HG23 ILE 156 4.102 19.322 20.046 1127 2HG2 ILE 156 HG22 ILE 156 2.834 20.494 20.402 1128 3HG2 ILE 156 HG21 ILE 156 4.444 21.046 19.939 1129 1HD1 ILE 156 HD12 ILE 156 5.440 21.340 24.021 1130 2HD1 ILE 156 HD11 ILE 156 4.486 22.802 24.253 1131 3HD1 ILE 156 HD13 ILE 156 3.835 21.242 24.746 1132 H GLN 157 HN GLN 157 2.451 18.046 20.687 1133 HA GLN 157 HA GLN 157 -0.122 19.257 21.163 1134 1HB GLN 157 HB2 GLN 157 0.756 16.889 19.496 1135 2HB GLN 157 HB1 GLN 157 -0.914 17.448 19.543 1136 1HG GLN 157 HG2 GLN 157 -0.218 19.665 18.757 1137 2HG GLN 157 HG1 GLN 157 1.468 19.150 18.746 1138 1HE2 GLN 157 HE22 GLN 157 0.022 16.568 16.179 1139 2HE2 GLN 157 HE21 GLN 157 0.166 16.366 17.858 1140 H ALA 158 HN ALA 158 1.260 16.078 21.970 1141 HA ALA 158 HA ALA 158 -1.150 14.934 23.000 1142 1HB ALA 158 HB1 ALA 158 1.769 14.377 23.564 1143 2HB ALA 158 HB3 ALA 158 0.462 13.430 24.279 1144 3HB ALA 158 HB2 ALA 158 0.673 13.463 22.528 1145 H ILE 159 HN ILE 159 1.421 16.833 24.579 1146 HA ILE 159 HA ILE 159 0.377 16.544 27.240 1147 HB ILE 159 HB ILE 159 2.116 18.681 25.978 1148 1HG1 ILE 159 HG12 ILE 159 2.818 16.443 27.902 1149 2HG1 ILE 159 HG11 ILE 159 2.963 16.292 26.150 1150 1HG2 ILE 159 HG22 ILE 159 1.195 18.266 28.827 1151 2HG2 ILE 159 HG21 ILE 159 2.699 19.109 28.461 1152 3HG2 ILE 159 HG23 ILE 159 1.165 19.749 27.872 1153 1HD1 ILE 159 HD13 ILE 159 4.341 18.410 27.830 1154 2HD1 ILE 159 HD12 ILE 159 5.113 16.954 27.202 1155 3HD1 ILE 159 HD11 ILE 159 4.519 18.187 26.090 1156 H TYR 160 HN TYR 160 0.023 19.186 24.848 1157 HA TYR 160 HA TYR 160 -2.134 20.380 26.508 1158 1HB TYR 160 HB2 TYR 160 -0.715 21.279 23.985 1159 2HB TYR 160 HB1 TYR 160 -2.108 22.131 24.651 1160 HD1 TYR 160 HD2 TYR 160 -1.982 23.042 27.018 1161 HD2 TYR 160 HD1 TYR 160 1.453 21.546 24.919 1162 HE1 TYR 160 HE2 TYR 160 -0.492 24.216 28.619 1163 HE2 TYR 160 HE1 TYR 160 2.942 22.717 26.520 1164 HH TYR 160 HH TYR 160 2.959 24.421 28.097 1165 H GLY 161 HN GLY 161 -1.787 19.754 23.010 1166 1HA GLY 161 HA2 GLY 161 -3.757 17.882 22.569 1167 2HA GLY 161 HA1 GLY 161 -4.666 19.388 22.721 1168 H ARG 162 HN ARG 162 -4.975 18.412 20.310 1169 HA ARG 162 HA ARG 162 -2.810 19.370 18.518 1170 1HB ARG 162 HB2 ARG 162 -5.415 17.905 17.992 1171 2HB ARG 162 HB1 ARG 162 -4.306 18.440 16.725 1172 1HG ARG 162 HG2 ARG 162 -2.524 17.078 17.596 1173 2HG ARG 162 HG1 ARG 162 -3.454 16.690 19.039 1174 1HD ARG 162 HD2 ARG 162 -3.543 14.803 17.538 1175 2HD ARG 162 HD1 ARG 162 -5.139 15.524 17.608 1176 HE ARG 162 HE ARG 162 -3.185 15.404 15.339 1177 1HH1 ARG 162 HH21 ARG 162 -6.022 16.907 16.590 1178 2HH1 ARG 162 HH22 ARG 162 -6.491 17.565 15.059 1179 1HH2 ARG 162 HH11 ARG 162 -3.775 16.240 13.360 1180 2HH2 ARG 162 HH12 ARG 162 -5.219 17.187 13.229 1181 H SER 163 HN SER 163 -3.155 21.059 16.996 1182 HA SER 163 HA SER 163 -4.939 23.158 17.908 1183 1HB SER 163 HB2 SER 163 -3.256 22.883 15.400 1184 2HB SER 163 HB1 SER 163 -4.146 24.340 15.832 1185 HG SER 163 HG SER 163 -1.923 23.143 17.066 1186 H GLN 164 HN GLN 164 -6.984 21.987 17.767 1187 HA GLN 164 HA GLN 164 -7.989 21.007 15.239 1188 1HB GLN 164 HB2 GLN 164 -9.392 21.753 17.821 1189 2HB GLN 164 HB1 GLN 164 -10.191 20.985 16.449 1190 1HG GLN 164 HG2 GLN 164 -8.696 19.059 16.609 1191 2HG GLN 164 HG1 GLN 164 -7.796 19.835 17.912 1192 1HE2 GLN 164 HE22 GLN 164 -10.540 17.514 19.234 1193 2HE2 GLN 164 HE21 GLN 164 -9.388 17.278 18.010 1194 H ASN 165 HN ASN 165 -9.140 22.088 13.684 1195 HA ASN 165 HA ASN 165 -10.316 24.719 14.244 1196 1HB ASN 165 HB2 ASN 165 -7.961 24.314 12.388 1197 2HB ASN 165 HB1 ASN 165 -9.054 25.684 12.208 1198 1HD2 ASN 165 HD22 ASN 165 -8.091 26.987 15.528 1199 2HD2 ASN 165 HD21 ASN 165 -9.526 26.632 14.695 1200 HA PRO 166 HA PRO 166 -13.159 23.098 11.241 1201 1HB PRO 166 HB2 PRO 166 -13.888 25.551 9.962 1202 2HB PRO 166 HB1 PRO 166 -14.704 24.791 11.332 1203 1HG PRO 166 HG2 PRO 166 -12.952 27.158 11.320 1204 2HG PRO 166 HG1 PRO 166 -14.038 26.587 12.597 1205 1HD PRO 166 HD2 PRO 166 -11.201 26.411 12.610 1206 2HD PRO 166 HD1 PRO 166 -12.314 25.599 13.729 1207 H VAL 167 HN VAL 167 -10.525 22.813 10.457 1208 HA VAL 167 HA VAL 167 -10.214 23.937 7.738 1209 HB VAL 167 HB VAL 167 -8.455 22.141 9.433 1210 1HG1 VAL 167 HG11 VAL 167 -8.171 23.148 6.602 1211 2HG1 VAL 167 HG13 VAL 167 -6.747 22.806 7.582 1212 3HG1 VAL 167 HG12 VAL 167 -7.900 21.521 7.225 1213 1HG2 VAL 167 HG23 VAL 167 -8.686 24.544 10.112 1214 2HG2 VAL 167 HG22 VAL 167 -7.047 24.122 9.615 1215 3HG2 VAL 167 HG21 VAL 167 -8.101 25.013 8.516 1216 H GLN 168 HN GLN 168 -11.083 22.880 6.033 1217 HA GLN 168 HA GLN 168 -12.068 20.153 6.311 1218 1HB GLN 168 HB2 GLN 168 -11.906 21.912 3.845 1219 2HB GLN 168 HB1 GLN 168 -12.908 20.473 4.031 1220 1HG GLN 168 HG2 GLN 168 -13.960 21.664 6.052 1221 2HG GLN 168 HG1 GLN 168 -13.175 23.125 5.450 1222 1HE2 GLN 168 HE22 GLN 168 -16.110 23.608 3.524 1223 2HE2 GLN 168 HE21 GLN 168 -15.164 24.175 4.814 1224 HA PRO 169 HA PRO 169 -8.408 18.089 4.851 1225 1HB PRO 169 HB2 PRO 169 -9.742 16.198 3.129 1226 2HB PRO 169 HB1 PRO 169 -9.159 15.928 4.776 1227 1HG PRO 169 HG2 PRO 169 -11.917 16.271 3.869 1228 2HG PRO 169 HG1 PRO 169 -11.339 15.806 5.476 1229 1HD PRO 169 HD2 PRO 169 -12.472 18.323 4.749 1230 2HD PRO 169 HD1 PRO 169 -11.678 17.921 6.285 No H/Q in entry = 1230 Start of MODEL 18 1 1H VAL 1 HT2 VAL 1 -0.291 19.454 13.410 2 2H VAL 1 HT1 VAL 1 -0.601 21.104 13.154 3 3H VAL 1 HT3 VAL 1 -1.574 20.217 14.223 4 HA VAL 1 HA VAL 1 -2.746 20.559 12.153 5 HB VAL 1 HB VAL 1 -1.725 19.330 10.135 6 1HG1 VAL 1 HG11 VAL 1 -0.500 21.833 11.315 7 2HG1 VAL 1 HG13 VAL 1 -0.188 21.292 9.666 8 3HG1 VAL 1 HG12 VAL 1 -1.824 21.730 10.156 9 1HG2 VAL 1 HG21 VAL 1 -0.007 18.156 11.585 10 2HG2 VAL 1 HG23 VAL 1 0.664 18.969 10.172 11 3HG2 VAL 1 HG22 VAL 1 0.805 19.712 11.764 12 H LEU 2 HN LEU 2 -2.132 18.495 14.377 13 HA LEU 2 HA LEU 2 -2.913 15.961 13.101 14 1HB LEU 2 HB2 LEU 2 -1.358 16.353 15.203 15 2HB LEU 2 HB1 LEU 2 -2.878 16.426 16.083 16 HG LEU 2 HG LEU 2 -1.990 14.151 16.141 17 1HD1 LEU 2 HD13 LEU 2 -4.502 14.674 15.854 18 2HD1 LEU 2 HD12 LEU 2 -4.296 14.082 14.206 19 3HD1 LEU 2 HD11 LEU 2 -3.971 13.017 15.569 20 1HD2 LEU 2 HD21 LEU 2 -0.929 14.597 13.683 21 2HD2 LEU 2 HD23 LEU 2 -1.215 12.977 14.318 22 3HD2 LEU 2 HD22 LEU 2 -2.374 13.701 13.204 23 H THR 3 HN THR 3 -5.012 15.432 12.746 24 HA THR 3 HA THR 3 -7.162 17.089 13.915 25 HB THR 3 HB THR 3 -8.605 15.977 12.303 26 HG1 THR 3 HG1 THR 3 -7.960 14.187 11.218 27 1HG2 THR 3 HG21 THR 3 -6.917 17.731 11.539 28 2HG2 THR 3 HG23 THR 3 -5.940 16.394 10.933 29 3HG2 THR 3 HG22 THR 3 -7.552 16.680 10.274 30 H GLU 4 HN GLU 4 -8.915 16.140 15.164 31 HA GLU 4 HA GLU 4 -8.069 14.081 17.003 32 1HB GLU 4 HB2 GLU 4 -9.721 15.868 17.582 33 2HB GLU 4 HB1 GLU 4 -10.879 15.105 16.494 34 1HG GLU 4 HG2 GLU 4 -10.777 13.029 17.809 35 2HG GLU 4 HG1 GLU 4 -9.598 13.763 18.892 36 H GLY 5 HN GLY 5 -8.451 11.876 16.931 37 1HA GLY 5 HA2 GLY 5 -9.479 9.844 16.229 38 2HA GLY 5 HA1 GLY 5 -10.476 10.767 15.104 39 H ASN 6 HN ASN 6 -9.453 8.550 13.995 40 HA ASN 6 HA ASN 6 -6.807 8.980 12.884 41 1HB ASN 6 HB2 ASN 6 -8.987 7.035 12.074 42 2HB ASN 6 HB1 ASN 6 -7.310 6.976 11.525 43 1HD2 ASN 6 HD22 ASN 6 -8.201 5.851 15.375 44 2HD2 ASN 6 HD21 ASN 6 -9.342 6.723 14.471 45 HA PRO 7 HA PRO 7 -8.544 11.730 9.735 46 1HB PRO 7 HB2 PRO 7 -6.212 11.788 8.111 47 2HB PRO 7 HB1 PRO 7 -6.624 12.936 9.393 48 1HG PRO 7 HG2 PRO 7 -4.599 10.795 9.426 49 2HG PRO 7 HG1 PRO 7 -4.787 12.163 10.532 50 1HD PRO 7 HD2 PRO 7 -5.440 9.441 11.082 51 2HD PRO 7 HD1 PRO 7 -5.850 10.858 12.081 52 H ARG 8 HN ARG 8 -10.041 10.361 8.711 53 HA ARG 8 HA ARG 8 -9.097 8.246 6.871 54 1HB ARG 8 HB2 ARG 8 -11.897 9.214 7.555 55 2HB ARG 8 HB1 ARG 8 -11.520 7.777 6.605 56 1HG ARG 8 HG2 ARG 8 -10.484 8.152 9.419 57 2HG ARG 8 HG1 ARG 8 -12.047 7.415 9.097 58 1HD ARG 8 HD2 ARG 8 -10.846 5.771 7.585 59 2HD ARG 8 HD1 ARG 8 -9.329 6.421 8.211 60 HE ARG 8 HE ARG 8 -10.743 5.799 10.493 61 1HH1 ARG 8 HH21 ARG 8 -9.874 4.197 7.579 62 2HH1 ARG 8 HH22 ARG 8 -9.763 2.633 8.312 63 1HH2 ARG 8 HH11 ARG 8 -10.647 3.783 11.473 64 2HH2 ARG 8 HH12 ARG 8 -10.220 2.393 10.533 65 H TRP 9 HN TRP 9 -9.463 8.328 4.583 66 HA TRP 9 HA TRP 9 -9.312 10.977 3.427 67 1HB TRP 9 HB2 TRP 9 -9.735 8.246 2.156 68 2HB TRP 9 HB1 TRP 9 -9.518 9.735 1.234 69 HD1 TRP 9 HD1 TRP 9 -7.624 7.083 3.076 70 HE1 TRP 9 HE1 TRP 9 -5.100 7.618 3.039 71 HE3 TRP 9 HE3 TRP 9 -7.757 11.852 1.248 72 HZ2 TRP 9 HZ2 TRP 9 -3.365 9.790 2.331 73 HZ3 TRP 9 HZ3 TRP 9 -5.661 13.128 0.902 74 HH2 TRP 9 HH2 TRP 9 -3.467 12.106 1.441 75 H GLU 10 HN GLU 10 -11.035 12.304 3.101 76 HA GLU 10 HA GLU 10 -13.765 11.258 3.324 77 1HB GLU 10 HB2 GLU 10 -12.726 14.040 2.673 78 2HB GLU 10 HB1 GLU 10 -14.412 13.637 2.994 79 1HG GLU 10 HG2 GLU 10 -13.598 14.414 5.073 80 2HG GLU 10 HG1 GLU 10 -13.568 12.660 5.229 81 H GLN 11 HN GLN 11 -11.509 11.635 0.812 82 HA GLN 11 HA GLN 11 -13.494 12.160 -1.299 83 1HB GLN 11 HB2 GLN 11 -10.533 11.510 -1.353 84 2HB GLN 11 HB1 GLN 11 -11.496 11.788 -2.802 85 1HG GLN 11 HG2 GLN 11 -11.996 14.041 -2.157 86 2HG GLN 11 HG1 GLN 11 -11.346 13.788 -0.535 87 1HE2 GLN 11 HE22 GLN 11 -8.803 15.418 -2.878 88 2HE2 GLN 11 HE21 GLN 11 -10.445 15.760 -2.609 89 H THR 12 HN THR 12 -14.285 10.622 -2.751 90 HA THR 12 HA THR 12 -14.021 7.794 -1.906 91 HB THR 12 HB THR 12 -15.816 7.373 -3.529 92 HG1 THR 12 HG1 THR 12 -16.582 9.047 -4.794 93 1HG2 THR 12 HG23 THR 12 -16.381 8.264 -1.260 94 2HG2 THR 12 HG22 THR 12 -16.405 9.888 -1.945 95 3HG2 THR 12 HG21 THR 12 -17.574 8.687 -2.486 96 H HIS 13 HN HIS 13 -12.399 9.886 -3.914 97 HA HIS 13 HA HIS 13 -11.407 7.641 -5.637 98 1HB HIS 13 HB2 HIS 13 -11.769 10.536 -6.478 99 2HB HIS 13 HB1 HIS 13 -11.215 9.206 -7.497 100 HD1 HIS 13 HD1 HIS 13 -13.055 7.076 -7.470 101 HD2 HIS 13 HD2 HIS 13 -14.500 10.910 -6.723 102 HE1 HIS 13 HE1 HIS 13 -15.540 7.007 -7.938 103 H LEU 14 HN LEU 14 -9.192 7.461 -5.663 104 HA LEU 14 HA LEU 14 -7.572 9.709 -4.500 105 1HB LEU 14 HB2 LEU 14 -7.089 6.735 -4.104 106 2HB LEU 14 HB1 LEU 14 -6.135 8.048 -3.419 107 HG LEU 14 HG LEU 14 -9.094 7.696 -2.872 108 1HD1 LEU 14 HD13 LEU 14 -6.681 6.704 -1.333 109 2HD1 LEU 14 HD12 LEU 14 -8.284 6.864 -0.614 110 3HD1 LEU 14 HD11 LEU 14 -8.028 5.746 -1.956 111 1HD2 LEU 14 HD22 LEU 14 -6.898 9.429 -1.713 112 2HD2 LEU 14 HD21 LEU 14 -8.443 9.940 -2.397 113 3HD2 LEU 14 HD23 LEU 14 -8.396 9.117 -0.840 114 H THR 15 HN THR 15 -5.358 9.754 -5.282 115 HA THR 15 HA THR 15 -4.927 8.318 -7.880 116 HB THR 15 HB THR 15 -3.996 10.379 -8.816 117 HG1 THR 15 HG1 THR 15 -3.501 11.982 -7.568 118 1HG2 THR 15 HG22 THR 15 -6.439 9.982 -9.011 119 2HG2 THR 15 HG21 THR 15 -6.690 10.907 -7.530 120 3HG2 THR 15 HG23 THR 15 -6.048 11.701 -8.968 121 H TYR 16 HN TYR 16 -2.656 7.928 -8.350 122 HA TYR 16 HA TYR 16 -0.741 8.614 -6.172 123 1HB TYR 16 HB2 TYR 16 0.045 6.326 -5.943 124 2HB TYR 16 HB1 TYR 16 -1.684 6.374 -5.605 125 HD1 TYR 16 HD2 TYR 16 -3.305 5.463 -7.207 126 HD2 TYR 16 HD1 TYR 16 0.918 5.273 -7.957 127 HE1 TYR 16 HE2 TYR 16 -3.701 3.788 -8.992 128 HE2 TYR 16 HE1 TYR 16 0.528 3.595 -9.742 129 HH TYR 16 HH TYR 16 -2.669 2.851 -10.904 130 H ARG 17 HN ARG 17 1.509 8.284 -6.806 131 HA ARG 17 HA ARG 17 2.000 7.876 -9.714 132 1HB ARG 17 HB2 ARG 17 1.584 10.331 -9.354 133 2HB ARG 17 HB1 ARG 17 2.950 10.347 -8.240 134 1HG ARG 17 HG2 ARG 17 4.438 9.560 -10.038 135 2HG ARG 17 HG1 ARG 17 3.084 9.543 -11.162 136 1HD ARG 17 HD2 ARG 17 2.760 11.994 -10.674 137 2HD ARG 17 HD1 ARG 17 4.253 11.965 -9.749 138 HE ARG 17 HE ARG 17 4.001 12.192 -12.609 139 1HH1 ARG 17 HH21 ARG 17 5.868 10.556 -10.219 140 2HH1 ARG 17 HH22 ARG 17 7.140 10.143 -11.316 141 1HH2 ARG 17 HH11 ARG 17 5.665 11.689 -14.039 142 2HH2 ARG 17 HH12 ARG 17 7.044 10.811 -13.462 143 H ILE 18 HN ILE 18 3.878 6.761 -10.001 144 HA ILE 18 HA ILE 18 5.584 6.244 -7.639 145 HB ILE 18 HB ILE 18 5.736 5.170 -10.479 146 1HG1 ILE 18 HG12 ILE 18 4.763 3.795 -7.955 147 2HG1 ILE 18 HG11 ILE 18 3.675 4.579 -9.098 148 1HG2 ILE 18 HG22 ILE 18 7.226 4.513 -7.926 149 2HG2 ILE 18 HG21 ILE 18 7.146 3.392 -9.286 150 3HG2 ILE 18 HG23 ILE 18 7.904 4.973 -9.488 151 1HD1 ILE 18 HD13 ILE 18 5.600 2.337 -9.793 152 2HD1 ILE 18 HD12 ILE 18 3.868 2.142 -9.524 153 3HD1 ILE 18 HD11 ILE 18 4.444 3.094 -10.890 154 H GLU 19 HN GLU 19 7.271 7.602 -7.267 155 HA GLU 19 HA GLU 19 8.043 9.609 -9.159 156 1HB GLU 19 HB2 GLU 19 8.292 9.814 -6.687 157 2HB GLU 19 HB1 GLU 19 9.597 8.628 -6.750 158 1HG GLU 19 HG2 GLU 19 10.844 10.092 -8.301 159 2HG GLU 19 HG1 GLU 19 9.545 11.277 -8.219 160 H ASN 20 HN ASN 20 9.503 6.461 -8.278 161 HA ASN 20 HA ASN 20 10.877 6.396 -10.878 162 1HB ASN 20 HB2 ASN 20 12.438 6.552 -8.286 163 2HB ASN 20 HB1 ASN 20 13.133 6.080 -9.837 164 1HD2 ASN 20 HD22 ASN 20 13.027 9.923 -9.036 165 2HD2 ASN 20 HD21 ASN 20 13.096 8.664 -7.900 166 H TYR 21 HN TYR 21 11.675 4.310 -11.401 167 HA TYR 21 HA TYR 21 10.618 2.118 -9.679 168 1HB TYR 21 HB2 TYR 21 11.580 2.180 -12.559 169 2HB TYR 21 HB1 TYR 21 11.101 0.706 -11.719 170 HD1 TYR 21 HD1 TYR 21 8.764 0.366 -10.997 171 HD2 TYR 21 HD2 TYR 21 9.948 3.819 -13.261 172 HE1 TYR 21 HE1 TYR 21 6.387 0.843 -11.513 173 HE2 TYR 21 HE2 TYR 21 7.571 4.296 -13.776 174 HH TYR 21 HH TYR 21 5.253 3.664 -12.480 175 H THR 22 HN THR 22 12.075 1.029 -8.414 176 HA THR 22 HA THR 22 14.851 1.661 -8.499 177 HB THR 22 HB THR 22 14.012 0.932 -6.410 178 HG1 THR 22 HG1 THR 22 15.986 0.086 -6.561 179 1HG2 THR 22 HG22 THR 22 12.915 -1.420 -7.953 180 2HG2 THR 22 HG21 THR 22 13.061 -1.438 -6.195 181 3HG2 THR 22 HG23 THR 22 12.031 -0.244 -6.982 182 HA PRO 23 HA PRO 23 16.047 -1.085 -11.827 183 1HB PRO 23 HB2 PRO 23 18.732 -1.522 -10.991 184 2HB PRO 23 HB1 PRO 23 18.168 -0.240 -12.071 185 1HG PRO 23 HG2 PRO 23 19.006 -0.035 -9.248 186 2HG PRO 23 HG1 PRO 23 18.819 1.252 -10.449 187 1HD PRO 23 HD2 PRO 23 17.049 0.715 -8.289 188 2HD PRO 23 HD1 PRO 23 16.739 1.786 -9.672 189 H ASP 24 HN ASP 24 15.575 -1.953 -8.696 190 HA ASP 24 HA ASP 24 16.834 -4.521 -8.478 191 1HB ASP 24 HB2 ASP 24 14.326 -3.381 -7.202 192 2HB ASP 24 HB1 ASP 24 15.004 -4.954 -6.778 193 H LEU 25 HN LEU 25 13.684 -3.491 -9.783 194 HA LEU 25 HA LEU 25 13.445 -6.118 -11.184 195 1HB LEU 25 HB2 LEU 25 11.324 -4.785 -9.468 196 2HB LEU 25 HB1 LEU 25 10.984 -6.113 -10.565 197 HG LEU 25 HG LEU 25 13.082 -6.357 -8.394 198 1HD1 LEU 25 HD12 LEU 25 10.110 -6.880 -8.220 199 2HD1 LEU 25 HD11 LEU 25 11.285 -7.507 -7.064 200 3HD1 LEU 25 HD13 LEU 25 11.056 -5.766 -7.231 201 1HD2 LEU 25 HD22 LEU 25 11.476 -8.301 -10.073 202 2HD2 LEU 25 HD21 LEU 25 13.229 -8.126 -10.004 203 3HD2 LEU 25 HD23 LEU 25 12.355 -8.800 -8.631 204 HA PRO 26 HA PRO 26 12.290 -3.437 -14.571 205 1HB PRO 26 HB2 PRO 26 10.163 -5.105 -15.607 206 2HB PRO 26 HB1 PRO 26 11.816 -4.958 -16.218 207 1HG PRO 26 HG2 PRO 26 10.654 -7.165 -14.715 208 2HG PRO 26 HG1 PRO 26 12.264 -7.065 -15.439 209 1HD PRO 26 HD2 PRO 26 11.644 -6.956 -12.643 210 2HD PRO 26 HD1 PRO 26 13.225 -6.678 -13.397 211 H ARG 27 HN ARG 27 10.721 -1.835 -14.932 212 HA ARG 27 HA ARG 27 8.900 -1.273 -12.809 213 1HB ARG 27 HB2 ARG 27 8.095 0.559 -14.236 214 2HB ARG 27 HB1 ARG 27 9.853 0.466 -14.306 215 1HG ARG 27 HG2 ARG 27 9.622 -0.930 -16.390 216 2HG ARG 27 HG1 ARG 27 7.891 -0.587 -16.356 217 1HD ARG 27 HD2 ARG 27 8.378 1.841 -16.450 218 2HD ARG 27 HD1 ARG 27 10.104 1.481 -16.528 219 HE ARG 27 HE ARG 27 9.098 0.050 -18.648 220 1HH1 ARG 27 HH21 ARG 27 8.735 3.316 -17.553 221 2HH1 ARG 27 HH22 ARG 27 8.605 3.968 -19.153 222 1HH2 ARG 27 HH11 ARG 27 8.939 0.905 -20.734 223 2HH2 ARG 27 HH12 ARG 27 8.701 2.609 -20.944 224 H ALA 28 HN ALA 28 8.520 -3.001 -15.841 225 HA ALA 28 HA ALA 28 5.680 -2.988 -15.998 226 1HB ALA 28 HB3 ALA 28 7.618 -5.170 -16.822 227 2HB ALA 28 HB2 ALA 28 5.936 -5.053 -17.338 228 3HB ALA 28 HB1 ALA 28 7.098 -3.819 -17.829 229 H ASP 29 HN ASP 29 7.907 -5.031 -14.135 230 HA ASP 29 HA ASP 29 5.748 -6.756 -13.172 231 1HB ASP 29 HB2 ASP 29 8.665 -6.450 -12.430 232 2HB ASP 29 HB1 ASP 29 7.586 -7.564 -11.587 233 H VAL 30 HN VAL 30 7.588 -4.005 -11.913 234 HA VAL 30 HA VAL 30 6.468 -4.131 -9.258 235 HB VAL 30 HB VAL 30 7.767 -1.891 -10.833 236 1HG1 VAL 30 HG13 VAL 30 6.928 -1.985 -7.919 237 2HG1 VAL 30 HG12 VAL 30 8.033 -0.787 -8.590 238 3HG1 VAL 30 HG11 VAL 30 6.363 -0.848 -9.144 239 1HG2 VAL 30 HG21 VAL 30 9.078 -3.978 -10.157 240 2HG2 VAL 30 HG23 VAL 30 9.738 -2.440 -9.604 241 3HG2 VAL 30 HG22 VAL 30 8.841 -3.467 -8.487 242 H ASP 31 HN ASP 31 5.629 -2.196 -12.164 243 HA ASP 31 HA ASP 31 3.488 -0.746 -10.974 244 1HB ASP 31 HB2 ASP 31 4.417 -0.230 -13.226 245 2HB ASP 31 HB1 ASP 31 3.698 -1.720 -13.844 246 H HIS 32 HN HIS 32 3.542 -3.926 -12.573 247 HA HIS 32 HA HIS 32 0.740 -4.428 -12.490 248 1HB HIS 32 HB2 HIS 32 2.424 -5.818 -13.726 249 2HB HIS 32 HB1 HIS 32 2.972 -6.456 -12.175 250 HD1 HIS 32 HD1 HIS 32 -0.484 -5.977 -13.758 251 HD2 HIS 32 HD2 HIS 32 1.739 -8.873 -11.745 252 HE1 HIS 32 HE1 HIS 32 -1.983 -8.008 -13.540 253 H ALA 33 HN ALA 33 3.303 -5.209 -10.154 254 HA ALA 33 HA ALA 33 1.694 -6.532 -8.230 255 1HB ALA 33 HB2 ALA 33 4.186 -4.841 -7.899 256 2HB ALA 33 HB1 ALA 33 3.506 -5.856 -6.626 257 3HB ALA 33 HB3 ALA 33 4.118 -6.591 -8.109 258 H ILE 34 HN ILE 34 2.524 -3.078 -8.546 259 HA ILE 34 HA ILE 34 1.040 -2.262 -6.202 260 HB ILE 34 HB ILE 34 1.871 -0.650 -8.639 261 1HG1 ILE 34 HG12 ILE 34 3.814 -1.672 -7.556 262 2HG1 ILE 34 HG11 ILE 34 3.792 0.050 -7.218 263 1HG2 ILE 34 HG23 ILE 34 0.940 0.147 -5.871 264 2HG2 ILE 34 HG22 ILE 34 1.752 1.256 -6.978 265 3HG2 ILE 34 HG21 ILE 34 0.195 0.558 -7.415 266 1HD1 ILE 34 HD11 ILE 34 2.522 -0.671 -5.032 267 2HD1 ILE 34 HD13 ILE 34 3.218 -2.254 -5.375 268 3HD1 ILE 34 HD12 ILE 34 4.269 -0.863 -5.123 269 H GLU 35 HN GLU 35 0.286 -2.405 -9.677 270 HA GLU 35 HA GLU 35 -2.254 -1.121 -9.561 271 1HB GLU 35 HB2 GLU 35 -1.066 -1.683 -11.671 272 2HB GLU 35 HB1 GLU 35 -1.384 -3.393 -11.376 273 1HG GLU 35 HG2 GLU 35 -3.810 -2.973 -11.444 274 2HG GLU 35 HG1 GLU 35 -3.510 -1.254 -11.715 275 H LYS 36 HN LYS 36 -1.345 -4.527 -9.070 276 HA LYS 36 HA LYS 36 -4.022 -5.511 -8.830 277 1HB LYS 36 HB2 LYS 36 -1.374 -6.542 -7.804 278 2HB LYS 36 HB1 LYS 36 -2.886 -7.422 -7.578 279 1HG LYS 36 HG2 LYS 36 -3.248 -7.336 -10.053 280 2HG LYS 36 HG1 LYS 36 -1.650 -6.607 -10.221 281 1HD LYS 36 HD2 LYS 36 -2.151 -9.280 -8.878 282 2HD LYS 36 HD1 LYS 36 -1.695 -9.113 -10.571 283 1HE LYS 36 HE2 LYS 36 0.317 -7.740 -9.685 284 2HE LYS 36 HE1 LYS 36 -0.074 -8.445 -8.115 285 1HZ LYS 36 HZ2 LYS 36 -0.003 -10.653 -9.240 286 2HZ LYS 36 HZ1 LYS 36 0.633 -9.879 -10.614 287 3HZ LYS 36 HZ3 LYS 36 1.495 -9.858 -9.152 288 H ALA 37 HN ALA 37 -1.750 -4.244 -6.374 289 HA ALA 37 HA ALA 37 -3.378 -4.917 -4.127 290 1HB ALA 37 HB1 ALA 37 -0.969 -3.967 -4.154 291 2HB ALA 37 HB3 ALA 37 -1.738 -2.383 -4.256 292 3HB ALA 37 HB2 ALA 37 -2.045 -3.427 -2.868 293 H PHE 38 HN PHE 38 -3.282 -1.917 -6.088 294 HA PHE 38 HA PHE 38 -5.377 -0.603 -4.666 295 1HB PHE 38 HB2 PHE 38 -4.330 -0.372 -7.487 296 2HB PHE 38 HB1 PHE 38 -5.744 0.551 -6.982 297 HD1 PHE 38 HD2 PHE 38 -5.425 1.740 -4.574 298 HD2 PHE 38 HD1 PHE 38 -2.234 0.703 -7.269 299 HE1 PHE 38 HE2 PHE 38 -3.982 3.467 -3.532 300 HE2 PHE 38 HE1 PHE 38 -0.796 2.439 -6.222 301 HZ PHE 38 HZ PHE 38 -1.671 3.820 -4.356 302 H GLN 39 HN GLN 39 -5.451 -2.852 -7.423 303 HA GLN 39 HA GLN 39 -8.270 -2.701 -7.875 304 1HB GLN 39 HB2 GLN 39 -6.257 -4.897 -8.411 305 2HB GLN 39 HB1 GLN 39 -7.942 -4.989 -8.925 306 1HG GLN 39 HG2 GLN 39 -6.112 -2.686 -9.646 307 2HG GLN 39 HG1 GLN 39 -6.348 -4.095 -10.680 308 1HE2 GLN 39 HE22 GLN 39 -9.041 -1.151 -10.845 309 2HE2 GLN 39 HE21 GLN 39 -7.496 -0.981 -10.165 310 H LEU 40 HN LEU 40 -6.329 -4.843 -5.770 311 HA LEU 40 HA LEU 40 -8.483 -6.512 -4.941 312 1HB LEU 40 HB2 LEU 40 -5.986 -5.657 -3.470 313 2HB LEU 40 HB1 LEU 40 -7.114 -6.844 -2.827 314 HG LEU 40 HG LEU 40 -5.720 -7.083 -5.510 315 1HD1 LEU 40 HD12 LEU 40 -5.088 -8.198 -2.769 316 2HD1 LEU 40 HD11 LEU 40 -4.432 -8.895 -4.252 317 3HD1 LEU 40 HD13 LEU 40 -4.043 -7.232 -3.811 318 1HD2 LEU 40 HD21 LEU 40 -7.664 -8.799 -3.966 319 2HD2 LEU 40 HD23 LEU 40 -7.593 -8.480 -5.699 320 3HD2 LEU 40 HD22 LEU 40 -6.442 -9.586 -4.962 321 H TRP 41 HN TRP 41 -7.299 -3.480 -3.451 322 HA TRP 41 HA TRP 41 -9.282 -3.523 -1.352 323 1HB TRP 41 HB2 TRP 41 -7.602 -1.266 -2.477 324 2HB TRP 41 HB1 TRP 41 -8.634 -1.111 -1.056 325 HD1 TRP 41 HD1 TRP 41 -5.215 -2.013 -2.023 326 HE1 TRP 41 HE1 TRP 41 -3.977 -3.169 -0.080 327 HE3 TRP 41 HE3 TRP 41 -9.156 -3.003 1.058 328 HZ2 TRP 41 HZ2 TRP 41 -4.582 -4.363 2.446 329 HZ3 TRP 41 HZ3 TRP 41 -8.802 -4.150 3.224 330 HH2 TRP 41 HH2 TRP 41 -6.520 -4.831 3.921 331 H SER 42 HN SER 42 -9.167 -2.003 -4.565 332 HA SER 42 HA SER 42 -11.599 -0.490 -4.228 333 1HB SER 42 HB2 SER 42 -9.919 -0.002 -5.993 334 2HB SER 42 HB1 SER 42 -10.332 -1.520 -6.784 335 HG SER 42 HG SER 42 -11.561 0.859 -6.919 336 H ASN 43 HN ASN 43 -10.886 -3.716 -5.483 337 HA ASN 43 HA ASN 43 -13.397 -4.386 -6.570 338 1HB ASN 43 HB2 ASN 43 -11.359 -6.119 -5.149 339 2HB ASN 43 HB1 ASN 43 -12.739 -6.761 -6.039 340 1HD2 ASN 43 HD22 ASN 43 -11.337 -5.132 -9.135 341 2HD2 ASN 43 HD21 ASN 43 -12.747 -4.889 -8.221 342 H VAL 44 HN VAL 44 -12.440 -4.149 -3.204 343 HA VAL 44 HA VAL 44 -15.041 -5.384 -2.362 344 HB VAL 44 HB VAL 44 -13.939 -5.454 -0.100 345 1HG1 VAL 44 HG12 VAL 44 -13.951 -7.385 -1.683 346 2HG1 VAL 44 HG11 VAL 44 -12.409 -6.825 -2.335 347 3HG1 VAL 44 HG13 VAL 44 -12.517 -7.362 -0.657 348 1HG2 VAL 44 HG21 VAL 44 -12.309 -3.614 -0.580 349 2HG2 VAL 44 HG23 VAL 44 -11.530 -5.073 0.019 350 3HG2 VAL 44 HG22 VAL 44 -11.475 -4.685 -1.697 351 H THR 45 HN THR 45 -14.010 -2.383 -3.111 352 HA THR 45 HA THR 45 -15.917 -1.167 -1.214 353 HB THR 45 HB THR 45 -14.191 0.726 -0.836 354 HG1 THR 45 HG1 THR 45 -12.848 -0.806 -2.451 355 1HG2 THR 45 HG23 THR 45 -14.911 -0.881 0.908 356 2HG2 THR 45 HG22 THR 45 -13.672 -2.010 0.364 357 3HG2 THR 45 HG21 THR 45 -13.206 -0.464 1.069 358 HA PRO 46 HA PRO 46 -16.846 1.141 -4.907 359 1HB PRO 46 HB2 PRO 46 -17.805 3.513 -3.724 360 2HB PRO 46 HB1 PRO 46 -18.764 2.059 -4.041 361 1HG PRO 46 HG2 PRO 46 -17.697 3.060 -1.456 362 2HG PRO 46 HG1 PRO 46 -19.044 1.951 -1.754 363 1HD PRO 46 HD2 PRO 46 -16.485 1.200 -0.822 364 2HD PRO 46 HD1 PRO 46 -17.712 0.109 -1.500 365 H LEU 47 HN LEU 47 -14.245 1.779 -3.028 366 HA LEU 47 HA LEU 47 -13.569 4.488 -3.832 367 1HB LEU 47 HB2 LEU 47 -11.853 2.215 -2.783 368 2HB LEU 47 HB1 LEU 47 -11.296 3.875 -2.979 369 HG LEU 47 HG LEU 47 -13.680 3.066 -1.284 370 1HD1 LEU 47 HD12 LEU 47 -11.461 2.195 -0.441 371 2HD1 LEU 47 HD11 LEU 47 -10.928 3.871 -0.307 372 3HD1 LEU 47 HD13 LEU 47 -12.287 3.300 0.661 373 1HD2 LEU 47 HD21 LEU 47 -12.347 5.671 -1.959 374 2HD2 LEU 47 HD23 LEU 47 -14.053 5.314 -1.699 375 3HD2 LEU 47 HD22 LEU 47 -12.966 5.475 -0.322 376 H THR 48 HN THR 48 -12.048 5.104 -5.454 377 HA THR 48 HA THR 48 -11.357 3.008 -7.490 378 HB THR 48 HB THR 48 -12.023 4.425 -9.274 379 HG1 THR 48 HG1 THR 48 -12.312 6.578 -9.040 380 1HG2 THR 48 HG22 THR 48 -14.036 4.858 -7.045 381 2HG2 THR 48 HG21 THR 48 -14.356 5.094 -8.763 382 3HG2 THR 48 HG23 THR 48 -13.988 3.483 -8.147 383 H PHE 49 HN PHE 49 -9.290 3.272 -8.410 384 HA PHE 49 HA PHE 49 -7.633 5.546 -7.328 385 1HB PHE 49 HB2 PHE 49 -6.860 2.659 -7.847 386 2HB PHE 49 HB1 PHE 49 -5.705 3.942 -7.484 387 HD1 PHE 49 HD2 PHE 49 -5.604 4.974 -5.273 388 HD2 PHE 49 HD1 PHE 49 -8.432 1.858 -6.144 389 HE1 PHE 49 HE2 PHE 49 -6.051 4.702 -2.850 390 HE2 PHE 49 HE1 PHE 49 -8.875 1.583 -3.719 391 HZ PHE 49 HZ PHE 49 -7.684 3.004 -2.074 392 H THR 50 HN THR 50 -6.489 6.705 -8.834 393 HA THR 50 HA THR 50 -6.379 5.654 -11.646 394 HB THR 50 HB THR 50 -6.760 8.552 -10.844 395 HG1 THR 50 HG1 THR 50 -8.668 7.671 -10.390 396 1HG2 THR 50 HG21 THR 50 -6.898 7.089 -13.498 397 2HG2 THR 50 HG23 THR 50 -7.383 8.768 -13.262 398 3HG2 THR 50 HG22 THR 50 -5.701 8.294 -13.020 399 H LYS 51 HN LYS 51 -4.359 5.590 -12.462 400 HA LYS 51 HA LYS 51 -2.087 6.620 -10.929 401 1HB LYS 51 HB2 LYS 51 -1.964 4.473 -12.179 402 2HB LYS 51 HB1 LYS 51 -2.213 5.358 -13.684 403 1HG LYS 51 HG2 LYS 51 -0.119 6.520 -13.444 404 2HG LYS 51 HG1 LYS 51 0.087 5.929 -11.796 405 1HD LYS 51 HD2 LYS 51 1.486 4.635 -13.369 406 2HD LYS 51 HD1 LYS 51 0.251 3.611 -12.640 407 1HE LYS 51 HE2 LYS 51 0.603 3.424 -15.196 408 2HE LYS 51 HE1 LYS 51 -1.055 3.586 -14.617 409 1HZ LYS 51 HZ3 LYS 51 0.536 5.971 -15.291 410 2HZ LYS 51 HZ2 LYS 51 -0.250 5.090 -16.517 411 3HZ LYS 51 HZ1 LYS 51 -1.150 5.789 -15.254 412 H VAL 52 HN VAL 52 -0.828 8.434 -11.488 413 HA VAL 52 HA VAL 52 -1.727 10.034 -13.873 414 HB VAL 52 HB VAL 52 -1.286 12.078 -12.580 415 1HG1 VAL 52 HG12 VAL 52 -3.121 10.145 -11.132 416 2HG1 VAL 52 HG11 VAL 52 -3.165 11.901 -10.980 417 3HG1 VAL 52 HG13 VAL 52 -3.559 11.140 -12.521 418 1HG2 VAL 52 HG23 VAL 52 -0.452 10.080 -10.483 419 2HG2 VAL 52 HG22 VAL 52 0.390 11.532 -11.026 420 3HG2 VAL 52 HG21 VAL 52 -1.037 11.673 -10.005 421 H SER 53 HN SER 53 -0.081 10.517 -15.251 422 HA SER 53 HA SER 53 2.653 9.684 -14.526 423 1HB SER 53 HB2 SER 53 1.645 9.153 -16.763 424 2HB SER 53 HB1 SER 53 1.631 10.875 -17.119 425 HG SER 53 HG SER 53 3.990 9.620 -16.239 426 H GLU 54 HN GLU 54 0.838 12.549 -14.359 427 HA GLU 54 HA GLU 54 3.310 14.113 -13.870 428 1HB GLU 54 HB2 GLU 54 1.227 14.863 -15.945 429 2HB GLU 54 HB1 GLU 54 2.380 16.015 -15.276 430 1HG GLU 54 HG2 GLU 54 4.249 14.607 -16.066 431 2HG GLU 54 HG1 GLU 54 3.097 13.460 -16.746 432 H GLY 55 HN GLY 55 2.863 16.078 -12.673 433 1HA GLY 55 HA2 GLY 55 1.541 17.497 -11.300 434 2HA GLY 55 HA1 GLY 55 0.121 16.526 -11.694 435 H GLN 56 HN GLN 56 0.423 17.204 -9.098 436 HA GLN 56 HA GLN 56 1.904 15.157 -7.621 437 1HB GLN 56 HB2 GLN 56 -0.058 17.302 -6.757 438 2HB GLN 56 HB1 GLN 56 0.728 16.190 -5.634 439 1HG GLN 56 HG2 GLN 56 2.930 16.995 -6.290 440 2HG GLN 56 HG1 GLN 56 2.217 18.021 -7.537 441 1HE2 GLN 56 HE22 GLN 56 2.797 19.998 -4.335 442 2HE2 GLN 56 HE21 GLN 56 3.820 18.990 -5.240 443 H ALA 57 HN ALA 57 0.715 13.772 -6.010 444 HA ALA 57 HA ALA 57 -2.021 12.980 -6.938 445 1HB ALA 57 HB3 ALA 57 -0.106 11.512 -7.867 446 2HB ALA 57 HB2 ALA 57 0.092 10.943 -6.211 447 3HB ALA 57 HB1 ALA 57 -1.434 10.690 -7.055 448 H ASP 58 HN ASP 58 -3.187 11.728 -5.276 449 HA ASP 58 HA ASP 58 -2.981 12.881 -2.686 450 1HB ASP 58 HB2 ASP 58 -4.303 10.327 -3.631 451 2HB ASP 58 HB1 ASP 58 -4.484 10.964 -1.997 452 H ILE 59 HN ILE 59 -1.756 9.811 -3.988 453 HA ILE 59 HA ILE 59 -0.135 9.457 -1.475 454 HB ILE 59 HB ILE 59 -1.173 7.345 -3.396 455 1HG1 ILE 59 HG12 ILE 59 -1.957 7.854 -0.508 456 2HG1 ILE 59 HG11 ILE 59 -2.887 8.458 -1.878 457 1HG2 ILE 59 HG21 ILE 59 0.495 7.243 -0.875 458 2HG2 ILE 59 HG23 ILE 59 -0.335 5.828 -1.523 459 3HG2 ILE 59 HG22 ILE 59 0.919 6.628 -2.472 460 1HD1 ILE 59 HD13 ILE 59 -3.176 6.147 -2.705 461 2HD1 ILE 59 HD12 ILE 59 -2.263 5.543 -1.322 462 3HD1 ILE 59 HD11 ILE 59 -3.821 6.328 -1.074 463 H MET 60 HN MET 60 1.998 9.850 -1.876 464 HA MET 60 HA MET 60 3.044 9.483 -4.656 465 1HB MET 60 HB2 MET 60 4.178 10.972 -2.270 466 2HB MET 60 HB1 MET 60 4.987 10.817 -3.830 467 1HG MET 60 HG2 MET 60 2.973 11.850 -4.914 468 2HG MET 60 HG1 MET 60 2.304 12.130 -3.309 469 1HE MET 60 HE2 MET 60 4.459 13.212 -6.101 470 2HE MET 60 HE1 MET 60 5.659 14.333 -5.464 471 3HE MET 60 HE3 MET 60 5.831 12.595 -5.183 472 H ILE 61 HN ILE 61 4.391 7.817 -5.066 473 HA ILE 61 HA ILE 61 5.460 6.241 -2.746 474 HB ILE 61 HB ILE 61 4.786 5.336 -5.556 475 1HG1 ILE 61 HG12 ILE 61 3.455 4.609 -2.929 476 2HG1 ILE 61 HG11 ILE 61 2.837 5.848 -4.020 477 1HG2 ILE 61 HG23 ILE 61 5.957 3.944 -3.147 478 2HG2 ILE 61 HG22 ILE 61 5.168 3.057 -4.447 479 3HG2 ILE 61 HG21 ILE 61 6.604 4.020 -4.784 480 1HD1 ILE 61 HD13 ILE 61 3.283 2.937 -4.747 481 2HD1 ILE 61 HD12 ILE 61 1.718 3.684 -4.426 482 3HD1 ILE 61 HD11 ILE 61 2.661 4.181 -5.831 483 H SER 62 HN SER 62 7.660 6.079 -2.612 484 HA SER 62 HA SER 62 9.293 6.470 -5.059 485 1HB SER 62 HB2 SER 62 10.706 8.164 -3.979 486 2HB SER 62 HB1 SER 62 9.042 8.729 -4.084 487 HG SER 62 HG SER 62 9.604 7.293 -1.815 488 H PHE 63 HN PHE 63 11.576 5.921 -4.673 489 HA PHE 63 HA PHE 63 11.906 3.866 -2.514 490 1HB PHE 63 HB2 PHE 63 12.975 4.071 -5.340 491 2HB PHE 63 HB1 PHE 63 13.649 2.957 -4.152 492 HD1 PHE 63 HD1 PHE 63 10.676 3.763 -6.188 493 HD2 PHE 63 HD2 PHE 63 12.384 1.079 -3.303 494 HE1 PHE 63 HE1 PHE 63 8.833 2.140 -6.601 495 HE2 PHE 63 HE2 PHE 63 10.554 -0.536 -3.717 496 HZ PHE 63 HZ PHE 63 8.781 -0.006 -5.365 497 H VAL 64 HN VAL 64 13.577 4.195 -1.090 498 HA VAL 64 HA VAL 64 15.643 6.269 -1.781 499 HB VAL 64 HB VAL 64 15.523 7.039 0.569 500 1HG1 VAL 64 HG13 VAL 64 14.103 8.078 -1.236 501 2HG1 VAL 64 HG12 VAL 64 12.783 7.020 -0.743 502 3HG1 VAL 64 HG11 VAL 64 13.409 8.228 0.378 503 1HG2 VAL 64 HG23 VAL 64 13.225 5.054 0.709 504 2HG2 VAL 64 HG22 VAL 64 14.740 4.958 1.603 505 3HG2 VAL 64 HG21 VAL 64 13.594 6.246 1.951 506 H ARG 65 HN ARG 65 17.673 6.017 -0.550 507 HA ARG 65 HA ARG 65 18.141 3.183 0.340 508 1HB ARG 65 HB2 ARG 65 19.910 5.071 -1.222 509 2HB ARG 65 HB1 ARG 65 20.522 3.613 -0.440 510 1HG ARG 65 HG2 ARG 65 18.969 2.237 -1.725 511 2HG ARG 65 HG1 ARG 65 18.288 3.679 -2.485 512 1HD ARG 65 HD2 ARG 65 21.183 2.790 -2.687 513 2HD ARG 65 HD1 ARG 65 19.970 2.605 -3.956 514 HE ARG 65 HE ARG 65 19.929 5.322 -3.378 515 1HH1 ARG 65 HH21 ARG 65 22.349 3.002 -4.229 516 2HH1 ARG 65 HH22 ARG 65 23.338 4.152 -5.064 517 1HH2 ARG 65 HH11 ARG 65 21.226 6.827 -4.466 518 2HH2 ARG 65 HH12 ARG 65 22.699 6.300 -5.208 519 H GLY 66 HN GLY 66 19.187 2.906 2.259 520 1HA GLY 66 HA2 GLY 66 19.850 3.512 4.437 521 2HA GLY 66 HA1 GLY 66 21.023 4.493 3.561 522 H ASP 67 HN ASP 67 20.934 6.146 5.156 523 HA ASP 67 HA ASP 67 18.536 7.402 6.060 524 1HB ASP 67 HB2 ASP 67 20.807 7.669 7.111 525 2HB ASP 67 HB1 ASP 67 21.253 8.705 5.753 526 H HIS 68 HN HIS 68 17.283 9.014 5.160 527 HA HIS 68 HA HIS 68 18.271 10.343 2.667 528 1HB HIS 68 HB2 HIS 68 15.954 10.073 1.713 529 2HB HIS 68 HB1 HIS 68 16.851 8.565 1.865 530 HD1 HIS 68 HD1 HIS 68 16.413 7.449 4.452 531 HD2 HIS 68 HD2 HIS 68 13.418 9.763 2.710 532 HE1 HIS 68 HE1 HIS 68 14.257 6.834 5.631 533 H ARG 69 HN ARG 69 18.424 11.656 5.021 534 HA ARG 69 HA ARG 69 17.701 13.576 6.154 535 1HB ARG 69 HB2 ARG 69 16.370 13.991 3.455 536 2HB ARG 69 HB1 ARG 69 16.492 15.232 4.702 537 1HG ARG 69 HG2 ARG 69 18.942 15.079 4.649 538 2HG ARG 69 HG1 ARG 69 18.849 13.792 3.444 539 1HD ARG 69 HD2 ARG 69 19.295 15.901 2.303 540 2HD ARG 69 HD1 ARG 69 17.660 15.377 1.913 541 HE ARG 69 HE ARG 69 17.361 17.021 4.144 542 1HH1 ARG 69 HH21 ARG 69 18.828 17.279 1.026 543 2HH1 ARG 69 HH22 ARG 69 18.461 18.963 0.853 544 1HH2 ARG 69 HH11 ARG 69 16.878 19.215 3.923 545 2HH2 ARG 69 HH12 ARG 69 17.371 20.058 2.492 546 H ASP 70 HN ASP 70 16.243 11.366 6.899 547 HA ASP 70 HA ASP 70 13.552 12.568 7.399 548 1HB ASP 70 HB2 ASP 70 14.131 9.808 6.318 549 2HB ASP 70 HB1 ASP 70 12.661 10.133 7.234 550 H ASN 71 HN ASN 71 12.447 11.038 9.185 551 HA ASN 71 HA ASN 71 14.435 10.909 11.382 552 1HB ASN 71 HB2 ASN 71 12.266 12.081 11.707 553 2HB ASN 71 HB1 ASN 71 11.429 10.548 11.463 554 1HD2 ASN 71 HD22 ASN 71 13.370 11.244 15.002 555 2HD2 ASN 71 HD21 ASN 71 13.615 12.285 13.684 556 H SER 72 HN SER 72 13.771 8.768 9.095 557 HA SER 72 HA SER 72 14.001 6.458 10.989 558 1HB SER 72 HB2 SER 72 11.635 6.648 10.149 559 2HB SER 72 HB1 SER 72 12.255 6.439 8.512 560 HG SER 72 HG SER 72 12.184 4.385 8.934 561 HA PRO 73 HA PRO 73 17.109 6.359 7.543 562 1HB PRO 73 HB2 PRO 73 19.258 5.958 9.381 563 2HB PRO 73 HB1 PRO 73 18.882 7.452 8.515 564 1HG PRO 73 HG2 PRO 73 18.539 6.903 11.354 565 2HG PRO 73 HG1 PRO 73 18.277 8.428 10.497 566 1HD PRO 73 HD2 PRO 73 16.268 6.580 11.500 567 2HD PRO 73 HD1 PRO 73 16.009 8.144 10.699 568 H PHE 74 HN PHE 74 17.234 4.327 6.643 569 HA PHE 74 HA PHE 74 16.741 1.949 8.236 570 1HB PHE 74 HB2 PHE 74 17.671 2.257 5.364 571 2HB PHE 74 HB1 PHE 74 17.168 0.735 6.105 572 HD1 PHE 74 HD1 PHE 74 14.819 0.654 7.179 573 HD2 PHE 74 HD2 PHE 74 16.053 3.683 4.396 574 HE1 PHE 74 HE1 PHE 74 12.445 1.178 6.698 575 HE2 PHE 74 HE2 PHE 74 13.676 4.210 3.918 576 HZ PHE 74 HZ PHE 74 11.874 2.956 5.069 577 H ASP 75 HN ASP 75 18.198 0.347 8.831 578 HA ASP 75 HA ASP 75 21.088 0.762 8.211 579 1HB ASP 75 HB2 ASP 75 20.571 1.817 10.436 580 2HB ASP 75 HB1 ASP 75 20.031 0.237 11.005 581 H GLY 76 HN GLY 76 20.556 -1.078 6.800 582 1HA GLY 76 HA2 GLY 76 21.015 -3.372 6.437 583 2HA GLY 76 HA1 GLY 76 21.031 -3.627 8.184 584 HA PRO 77 HA PRO 77 16.965 -5.091 6.237 585 1HB PRO 77 HB2 PRO 77 17.398 -7.741 7.254 586 2HB PRO 77 HB1 PRO 77 17.447 -7.232 5.561 587 1HG PRO 77 HG2 PRO 77 19.690 -7.954 7.295 588 2HG PRO 77 HG1 PRO 77 19.706 -7.619 5.556 589 1HD PRO 77 HD2 PRO 77 20.695 -5.921 7.650 590 2HD PRO 77 HD1 PRO 77 20.596 -5.544 5.920 591 H GLY 78 HN GLY 78 18.296 -4.325 9.093 592 1HA GLY 78 HA2 GLY 78 16.386 -5.638 10.917 593 2HA GLY 78 HA1 GLY 78 17.647 -4.493 11.378 594 H GLY 79 HN GLY 79 15.054 -4.206 12.411 595 1HA GLY 79 HA2 GLY 79 13.556 -2.420 12.772 596 2HA GLY 79 HA1 GLY 79 14.469 -1.486 11.585 597 H ASN 80 HN ASN 80 12.175 -0.838 10.954 598 HA ASN 80 HA ASN 80 10.468 -2.805 9.702 599 1HB ASN 80 HB2 ASN 80 10.557 0.218 9.487 600 2HB ASN 80 HB1 ASN 80 9.316 -0.788 8.731 601 1HD2 ASN 80 HD22 ASN 80 8.137 -1.940 12.039 602 2HD2 ASN 80 HD21 ASN 80 8.664 -2.659 10.593 603 H LEU 81 HN LEU 81 10.082 -3.054 7.423 604 HA LEU 81 HA LEU 81 12.559 -2.729 5.831 605 1HB LEU 81 HB2 LEU 81 9.931 -3.974 4.979 606 2HB LEU 81 HB1 LEU 81 11.508 -4.199 4.237 607 HG LEU 81 HG LEU 81 10.610 -5.181 6.960 608 1HD1 LEU 81 HD11 LEU 81 9.962 -6.434 4.845 609 2HD1 LEU 81 HD13 LEU 81 11.683 -6.717 4.579 610 3HD1 LEU 81 HD12 LEU 81 10.893 -7.372 6.014 611 1HD2 LEU 81 HD21 LEU 81 13.360 -5.149 5.679 612 2HD2 LEU 81 HD23 LEU 81 12.902 -4.498 7.254 613 3HD2 LEU 81 HD22 LEU 81 12.934 -6.240 6.994 614 H ALA 82 HN ALA 82 9.835 -0.961 6.518 615 HA ALA 82 HA ALA 82 10.345 1.021 4.508 616 1HB ALA 82 HB2 ALA 82 9.214 -0.814 3.138 617 2HB ALA 82 HB1 ALA 82 7.770 -0.519 4.102 618 3HB ALA 82 HB3 ALA 82 8.430 0.759 3.084 619 H HIS 83 HN HIS 83 8.293 2.596 4.500 620 HA HIS 83 HA HIS 83 6.600 2.450 6.853 621 1HB HIS 83 HB2 HIS 83 7.560 4.402 8.026 622 2HB HIS 83 HB1 HIS 83 8.719 3.077 7.945 623 HD1 HIS 83 HD1 HIS 83 10.949 3.620 6.938 624 HD2 HIS 83 HD2 HIS 83 8.045 6.416 5.876 625 HE1 HIS 83 HE1 HIS 83 12.142 5.428 5.627 626 H ALA 84 HN ALA 84 5.387 4.608 7.108 627 HA ALA 84 HA ALA 84 5.321 6.236 4.628 628 1HB ALA 84 HB3 ALA 84 2.913 4.721 5.697 629 2HB ALA 84 HB2 ALA 84 2.870 5.914 4.399 630 3HB ALA 84 HB1 ALA 84 3.744 4.399 4.175 631 H PHE 85 HN PHE 85 3.829 8.132 4.928 632 HA PHE 85 HA PHE 85 4.010 9.113 7.734 633 1HB PHE 85 HB2 PHE 85 3.565 10.489 5.075 634 2HB PHE 85 HB1 PHE 85 3.454 11.328 6.623 635 HD1 PHE 85 HD1 PHE 85 5.410 11.634 8.037 636 HD2 PHE 85 HD2 PHE 85 5.693 9.664 4.237 637 HE1 PHE 85 HE1 PHE 85 7.874 11.863 8.108 638 HE2 PHE 85 HE2 PHE 85 8.162 9.888 4.302 639 HZ PHE 85 HZ PHE 85 9.251 10.989 6.240 640 H GLN 86 HN GLN 86 2.098 10.361 8.573 641 HA GLN 86 HA GLN 86 -0.275 8.804 8.348 642 1HB GLN 86 HB2 GLN 86 0.142 11.602 9.438 643 2HB GLN 86 HB1 GLN 86 -1.344 10.678 9.639 644 1HG GLN 86 HG2 GLN 86 -0.133 10.259 11.629 645 2HG GLN 86 HG1 GLN 86 0.157 8.828 10.644 646 1HE2 GLN 86 HE22 GLN 86 3.602 9.421 11.356 647 2HE2 GLN 86 HE21 GLN 86 2.270 8.408 11.644 648 HA PRO 87 HA PRO 87 -2.156 10.453 4.680 649 1HB PRO 87 HB2 PRO 87 -4.852 10.567 5.697 650 2HB PRO 87 HB1 PRO 87 -4.127 9.299 4.695 651 1HG PRO 87 HG2 PRO 87 -4.746 9.223 7.561 652 2HG PRO 87 HG1 PRO 87 -4.244 7.893 6.503 653 1HD PRO 87 HD2 PRO 87 -2.650 9.145 8.503 654 2HD PRO 87 HD1 PRO 87 -2.090 8.007 7.260 655 H GLY 88 HN GLY 88 -1.642 12.570 4.341 656 1HA GLY 88 HA2 GLY 88 -3.453 14.641 5.142 657 2HA GLY 88 HA1 GLY 88 -1.974 14.739 6.098 658 HA PRO 89 HA PRO 89 -1.599 16.799 1.807 659 1HB PRO 89 HB2 PRO 89 -1.098 19.354 2.998 660 2HB PRO 89 HB1 PRO 89 -2.556 18.858 2.127 661 1HG PRO 89 HG2 PRO 89 -2.177 19.204 5.031 662 2HG PRO 89 HG1 PRO 89 -3.687 19.056 4.120 663 1HD PRO 89 HD2 PRO 89 -2.544 17.054 5.774 664 2HD PRO 89 HD1 PRO 89 -3.864 16.822 4.607 665 H GLY 90 HN GLY 90 0.458 18.294 1.306 666 1HA GLY 90 HA2 GLY 90 2.791 18.513 1.400 667 2HA GLY 90 HA1 GLY 90 2.659 18.239 3.135 668 H ILE 91 HN ILE 91 4.114 16.674 3.598 669 HA ILE 91 HA ILE 91 4.760 14.515 1.752 670 HB ILE 91 HB ILE 91 6.382 15.591 3.340 671 1HG1 ILE 91 HG12 ILE 91 6.058 12.614 3.818 672 2HG1 ILE 91 HG11 ILE 91 6.682 13.288 2.317 673 1HG2 ILE 91 HG22 ILE 91 4.644 15.577 5.235 674 2HG2 ILE 91 HG21 ILE 91 5.085 13.886 5.468 675 3HG2 ILE 91 HG23 ILE 91 6.297 15.151 5.670 676 1HD1 ILE 91 HD13 ILE 91 8.367 14.551 3.880 677 2HD1 ILE 91 HD12 ILE 91 7.919 13.320 5.060 678 3HD1 ILE 91 HD11 ILE 91 8.641 12.847 3.524 679 H GLY 92 HN GLY 92 2.252 14.971 3.960 680 1HA GLY 92 HA2 GLY 92 1.935 12.415 5.155 681 2HA GLY 92 HA1 GLY 92 0.614 13.528 4.806 682 H GLY 93 HN GLY 93 1.124 10.507 4.439 683 1HA GLY 93 HA2 GLY 93 -0.080 9.020 3.020 684 2HA GLY 93 HA1 GLY 93 -0.268 10.319 1.840 685 H ASP 94 HN ASP 94 2.776 10.801 2.325 686 HA ASP 94 HA ASP 94 3.688 9.377 0.013 687 1HB ASP 94 HB2 ASP 94 5.197 10.792 2.232 688 2HB ASP 94 HB1 ASP 94 5.982 10.125 0.798 689 H ALA 95 HN ALA 95 4.814 7.451 -0.179 690 HA ALA 95 HA ALA 95 5.268 5.850 2.330 691 1HB ALA 95 HB2 ALA 95 3.354 5.061 0.824 692 2HB ALA 95 HB1 ALA 95 4.585 4.695 -0.386 693 3HB ALA 95 HB3 ALA 95 4.605 3.868 1.171 694 H HIS 96 HN HIS 96 7.376 5.230 2.579 695 HA HIS 96 HA HIS 96 9.207 5.415 0.204 696 1HB HIS 96 HB2 HIS 96 9.776 5.585 3.176 697 2HB HIS 96 HB1 HIS 96 11.012 5.610 1.919 698 HD2 HIS 96 HD2 HIS 96 8.181 7.808 0.525 699 HE1 HIS 96 HE1 HIS 96 10.723 10.270 2.865 700 HE2 HIS 96 HE2 HIS 96 8.854 10.250 1.174 701 H PHE 97 HN PHE 97 10.219 3.578 -0.481 702 HA PHE 97 HA PHE 97 9.872 1.081 1.151 703 1HB PHE 97 HB2 PHE 97 10.245 1.581 -1.807 704 2HB PHE 97 HB1 PHE 97 10.529 -0.008 -1.101 705 HD1 PHE 97 HD1 PHE 97 7.967 2.648 -1.583 706 HD2 PHE 97 HD2 PHE 97 8.722 -1.437 -0.490 707 HE1 PHE 97 HE1 PHE 97 5.539 2.165 -1.697 708 HE2 PHE 97 HE2 PHE 97 6.293 -1.915 -0.606 709 HZ PHE 97 HZ PHE 97 4.700 -0.115 -1.209 710 H ASP 98 HN ASP 98 11.671 0.058 1.910 711 HA ASP 98 HA ASP 98 14.253 1.342 1.858 712 1HB ASP 98 HB2 ASP 98 13.371 -0.194 3.656 713 2HB ASP 98 HB1 ASP 98 13.593 -1.543 2.544 714 H GLU 99 HN GLU 99 15.085 1.566 -0.204 715 HA GLU 99 HA GLU 99 14.946 -0.535 -2.188 716 1HB GLU 99 HB2 GLU 99 15.066 1.865 -2.755 717 2HB GLU 99 HB1 GLU 99 16.696 1.937 -2.103 718 1HG GLU 99 HG2 GLU 99 17.540 0.464 -3.778 719 2HG GLU 99 HG1 GLU 99 15.916 0.008 -4.296 720 H ASP 100 HN ASP 100 16.939 -0.160 0.521 721 HA ASP 100 HA ASP 100 19.379 -1.252 -0.636 722 1HB ASP 100 HB2 ASP 100 18.417 -0.921 2.215 723 2HB ASP 100 HB1 ASP 100 20.000 -1.573 1.801 724 H GLU 101 HN GLU 101 16.411 -2.587 0.514 725 HA GLU 101 HA GLU 101 17.531 -5.259 1.053 726 1HB GLU 101 HB2 GLU 101 14.679 -4.247 0.918 727 2HB GLU 101 HB1 GLU 101 15.167 -5.853 1.472 728 1HG GLU 101 HG2 GLU 101 16.413 -4.921 3.310 729 2HG GLU 101 HG1 GLU 101 16.204 -3.283 2.692 730 H ARG 102 HN ARG 102 16.776 -7.183 -0.151 731 HA ARG 102 HA ARG 102 16.656 -6.612 -3.053 732 1HB ARG 102 HB2 ARG 102 18.145 -8.405 -2.120 733 2HB ARG 102 HB1 ARG 102 16.697 -9.297 -1.644 734 1HG ARG 102 HG2 ARG 102 15.938 -9.316 -3.998 735 2HG ARG 102 HG1 ARG 102 17.398 -8.444 -4.468 736 1HD ARG 102 HD2 ARG 102 18.776 -10.307 -3.585 737 2HD ARG 102 HD1 ARG 102 17.300 -11.181 -3.179 738 HE ARG 102 HE ARG 102 16.998 -10.628 -5.870 739 1HH1 ARG 102 HH21 ARG 102 19.423 -12.053 -3.874 740 2HH1 ARG 102 HH22 ARG 102 19.985 -13.136 -5.102 741 1HH2 ARG 102 HH11 ARG 102 17.686 -12.058 -7.472 742 2HH2 ARG 102 HH12 ARG 102 19.004 -13.135 -7.147 743 H TRP 103 HN TRP 103 14.675 -6.211 -3.871 744 HA TRP 103 HA TRP 103 12.270 -7.458 -2.661 745 1HB TRP 103 HB2 TRP 103 12.620 -5.366 -4.819 746 2HB TRP 103 HB1 TRP 103 11.061 -5.935 -4.232 747 HD1 TRP 103 HD1 TRP 103 13.546 -3.330 -3.650 748 HE1 TRP 103 HE1 TRP 103 13.166 -2.152 -1.393 749 HE3 TRP 103 HE3 TRP 103 10.269 -6.605 -1.464 750 HZ2 TRP 103 HZ2 TRP 103 11.687 -2.532 1.007 751 HZ3 TRP 103 HZ3 TRP 103 9.395 -6.156 0.813 752 HH2 TRP 103 HH2 TRP 103 10.099 -4.125 2.049 753 H THR 104 HN THR 104 11.007 -8.955 -3.739 754 HA THR 104 HA THR 104 11.824 -9.748 -6.512 755 HB THR 104 HB THR 104 11.370 -12.119 -5.813 756 HG1 THR 104 HG1 THR 104 10.591 -10.870 -3.607 757 1HG2 THR 104 HG22 THR 104 13.600 -10.520 -4.551 758 2HG2 THR 104 HG21 THR 104 13.528 -12.273 -4.423 759 3HG2 THR 104 HG23 THR 104 13.661 -11.513 -6.005 760 H ASN 105 HN ASN 105 10.045 -11.143 -7.526 761 HA ASN 105 HA ASN 105 7.340 -10.102 -6.715 762 1HB ASN 105 HB2 ASN 105 8.352 -10.823 -9.485 763 2HB ASN 105 HB1 ASN 105 6.743 -10.220 -9.097 764 1HD2 ASN 105 HD22 ASN 105 8.131 -6.933 -8.147 765 2HD2 ASN 105 HD21 ASN 105 7.103 -8.096 -7.461 766 H ASN 106 HN ASN 106 8.818 -12.662 -5.986 767 HA ASN 106 HA ASN 106 6.557 -14.458 -6.660 768 1HB ASN 106 HB2 ASN 106 8.133 -16.255 -7.402 769 2HB ASN 106 HB1 ASN 106 8.112 -14.862 -8.488 770 1HD2 ASN 106 HD22 ASN 106 11.224 -14.028 -6.215 771 2HD2 ASN 106 HD21 ASN 106 9.610 -13.669 -5.848 772 H PHE 107 HN PHE 107 7.620 -16.819 -5.728 773 HA PHE 107 HA PHE 107 7.357 -16.549 -2.899 774 1HB PHE 107 HB2 PHE 107 8.001 -18.980 -2.893 775 2HB PHE 107 HB1 PHE 107 6.683 -18.582 -3.994 776 HD1 PHE 107 HD2 PHE 107 7.061 -18.501 -6.440 777 HD2 PHE 107 HD1 PHE 107 10.188 -19.636 -3.719 778 HE1 PHE 107 HE2 PHE 107 8.376 -19.427 -8.332 779 HE2 PHE 107 HE1 PHE 107 11.497 -20.560 -5.610 780 HZ PHE 107 HZ PHE 107 10.591 -20.456 -7.916 781 H ARG 108 HN ARG 108 9.973 -15.488 -4.534 782 HA ARG 108 HA ARG 108 12.197 -16.742 -3.290 783 1HB ARG 108 HB2 ARG 108 11.772 -13.955 -4.373 784 2HB ARG 108 HB1 ARG 108 13.306 -14.437 -3.646 785 1HG ARG 108 HG2 ARG 108 13.488 -16.311 -5.232 786 2HG ARG 108 HG1 ARG 108 11.949 -15.852 -5.959 787 1HD ARG 108 HD2 ARG 108 12.910 -13.661 -6.593 788 2HD ARG 108 HD1 ARG 108 14.455 -14.147 -5.889 789 HE ARG 108 HE ARG 108 13.988 -16.162 -7.663 790 1HH1 ARG 108 HH21 ARG 108 13.799 -12.722 -7.851 791 2HH1 ARG 108 HH22 ARG 108 14.323 -12.656 -9.503 792 1HH2 ARG 108 HH11 ARG 108 14.655 -16.091 -9.810 793 2HH2 ARG 108 HH12 ARG 108 14.788 -14.565 -10.614 794 H GLU 109 HN GLU 109 13.557 -14.713 -1.902 795 HA GLU 109 HA GLU 109 12.922 -15.195 0.742 796 1HB GLU 109 HB2 GLU 109 14.145 -12.697 -0.440 797 2HB GLU 109 HB1 GLU 109 14.128 -13.062 1.286 798 1HG GLU 109 HG2 GLU 109 15.333 -15.183 0.829 799 2HG GLU 109 HG1 GLU 109 15.393 -14.755 -0.883 800 H TYR 110 HN TYR 110 11.990 -12.094 -0.861 801 HA TYR 110 HA TYR 110 9.690 -11.943 1.084 802 1HB TYR 110 HB2 TYR 110 11.451 -9.695 0.056 803 2HB TYR 110 HB1 TYR 110 10.035 -9.484 1.083 804 HD1 TYR 110 HD2 TYR 110 10.004 -10.579 3.372 805 HD2 TYR 110 HD1 TYR 110 13.567 -10.292 0.990 806 HE1 TYR 110 HE2 TYR 110 11.383 -10.986 5.388 807 HE2 TYR 110 HE1 TYR 110 14.950 -10.697 3.008 808 HH TYR 110 HH TYR 110 13.482 -10.920 6.224 809 H ASN 111 HN ASN 111 7.735 -11.100 0.281 810 HA ASN 111 HA ASN 111 7.514 -11.051 -2.696 811 1HB ASN 111 HB2 ASN 111 5.441 -11.232 -0.487 812 2HB ASN 111 HB1 ASN 111 5.043 -11.130 -2.202 813 1HD2 ASN 111 HD22 ASN 111 5.276 -14.745 -1.135 814 2HD2 ASN 111 HD21 ASN 111 4.401 -13.419 -0.536 815 H LEU 112 HN LEU 112 7.787 -9.031 -3.512 816 HA LEU 112 HA LEU 112 7.602 -6.604 -2.064 817 1HB LEU 112 HB2 LEU 112 8.762 -6.832 -4.235 818 2HB LEU 112 HB1 LEU 112 7.212 -7.076 -5.035 819 HG LEU 112 HG LEU 112 6.483 -4.825 -4.316 820 1HD1 LEU 112 HD12 LEU 112 9.155 -4.863 -2.939 821 2HD1 LEU 112 HD11 LEU 112 8.514 -3.328 -3.519 822 3HD1 LEU 112 HD13 LEU 112 7.604 -4.275 -2.345 823 1HD2 LEU 112 HD23 LEU 112 7.725 -5.247 -6.480 824 2HD2 LEU 112 HD22 LEU 112 7.822 -3.592 -5.882 825 3HD2 LEU 112 HD21 LEU 112 9.187 -4.688 -5.668 826 H HIS 113 HN HIS 113 5.161 -8.215 -4.119 827 HA HIS 113 HA HIS 113 3.188 -6.189 -3.999 828 1HB HIS 113 HB2 HIS 113 3.053 -8.128 -5.509 829 2HB HIS 113 HB1 HIS 113 2.801 -9.190 -4.124 830 HD1 HIS 113 HD1 HIS 113 0.391 -9.874 -4.463 831 HD2 HIS 113 HD2 HIS 113 0.907 -5.743 -4.672 832 HE1 HIS 113 HE1 HIS 113 -1.931 -8.866 -4.562 833 H ARG 114 HN ARG 114 3.699 -8.955 -1.750 834 HA ARG 114 HA ARG 114 1.402 -8.449 -0.154 835 1HB ARG 114 HB2 ARG 114 2.712 -10.515 0.058 836 2HB ARG 114 HB1 ARG 114 4.070 -9.594 0.713 837 1HG ARG 114 HG2 ARG 114 2.827 -8.966 2.658 838 2HG ARG 114 HG1 ARG 114 1.314 -9.550 1.965 839 1HD ARG 114 HD2 ARG 114 2.126 -11.850 2.044 840 2HD ARG 114 HD1 ARG 114 3.697 -11.303 2.635 841 HE ARG 114 HE ARG 114 1.935 -10.280 4.495 842 1HH1 ARG 114 HH21 ARG 114 2.496 -13.374 3.074 843 2HH1 ARG 114 HH22 ARG 114 2.019 -14.252 4.487 844 1HH2 ARG 114 HH11 ARG 114 1.325 -11.422 6.352 845 2HH2 ARG 114 HH12 ARG 114 1.379 -13.153 6.346 846 H VAL 115 HN VAL 115 4.711 -7.154 0.139 847 HA VAL 115 HA VAL 115 4.151 -5.662 2.545 848 HB VAL 115 HB VAL 115 6.307 -5.400 0.425 849 1HG1 VAL 115 HG12 VAL 115 5.840 -3.785 2.942 850 2HG1 VAL 115 HG11 VAL 115 7.439 -3.940 2.213 851 3HG1 VAL 115 HG13 VAL 115 6.124 -3.193 1.309 852 1HG2 VAL 115 HG21 VAL 115 6.143 -6.587 3.204 853 2HG2 VAL 115 HG23 VAL 115 6.702 -7.346 1.714 854 3HG2 VAL 115 HG22 VAL 115 7.693 -6.124 2.504 855 H ALA 116 HN ALA 116 4.037 -4.868 -0.913 856 HA ALA 116 HA ALA 116 3.551 -2.087 -0.693 857 1HB ALA 116 HB1 ALA 116 2.470 -4.092 -2.700 858 2HB ALA 116 HB3 ALA 116 2.371 -2.342 -2.892 859 3HB ALA 116 HB2 ALA 116 3.944 -3.138 -2.860 860 H ALA 117 HN ALA 117 1.204 -4.779 -0.764 861 HA ALA 117 HA ALA 117 -1.152 -3.228 -0.471 862 1HB ALA 117 HB2 ALA 117 -1.007 -5.699 -0.992 863 2HB ALA 117 HB1 ALA 117 -0.664 -5.973 0.717 864 3HB ALA 117 HB3 ALA 117 -2.213 -5.284 0.227 865 H HIS 118 HN HIS 118 1.078 -4.534 1.972 866 HA HIS 118 HA HIS 118 -0.434 -3.867 4.286 867 1HB HIS 118 HB2 HIS 118 1.650 -5.273 4.252 868 2HB HIS 118 HB1 HIS 118 2.590 -3.800 4.001 869 HD1 HIS 118 HD1 HIS 118 0.453 -5.548 6.564 870 HD2 HIS 118 HD2 HIS 118 2.910 -2.191 6.308 871 HE1 HIS 118 HE1 HIS 118 0.727 -4.681 8.928 872 H GLU 119 HN GLU 119 2.082 -1.948 2.590 873 HA GLU 119 HA GLU 119 1.870 0.349 4.273 874 1HB GLU 119 HB2 GLU 119 2.703 0.049 1.376 875 2HB GLU 119 HB1 GLU 119 2.828 1.569 2.262 876 1HG GLU 119 HG2 GLU 119 4.266 0.482 3.944 877 2HG GLU 119 HG1 GLU 119 4.137 -1.050 3.075 878 H LEU 120 HN LEU 120 0.118 -0.572 1.319 879 HA LEU 120 HA LEU 120 -1.376 1.875 1.075 880 1HB LEU 120 HB2 LEU 120 -1.946 -0.949 0.137 881 2HB LEU 120 HB1 LEU 120 -2.950 0.434 -0.291 882 HG LEU 120 HG LEU 120 0.022 0.249 -0.853 883 1HD1 LEU 120 HD13 LEU 120 -2.396 -0.430 -2.530 884 2HD1 LEU 120 HD12 LEU 120 -0.843 -0.025 -3.258 885 3HD1 LEU 120 HD11 LEU 120 -0.979 -1.427 -2.197 886 1HD2 LEU 120 HD23 LEU 120 -2.126 2.282 -1.434 887 2HD2 LEU 120 HD22 LEU 120 -0.459 2.537 -0.915 888 3HD2 LEU 120 HD21 LEU 120 -0.801 2.085 -2.581 889 H GLY 121 HN GLY 121 -1.883 -1.132 2.852 890 1HA GLY 121 HA2 GLY 121 -4.593 -0.722 3.604 891 2HA GLY 121 HA1 GLY 121 -3.425 -1.655 4.543 892 H HIS 122 HN HIS 122 -1.557 0.428 5.072 893 HA HIS 122 HA HIS 122 -2.830 1.708 7.326 894 1HB HIS 122 HB2 HIS 122 -0.162 2.142 5.957 895 2HB HIS 122 HB1 HIS 122 -0.655 3.029 7.401 896 HD1 HIS 122 HD1 HIS 122 -1.729 1.117 9.293 897 HD2 HIS 122 HD2 HIS 122 1.355 -0.025 6.731 898 HE1 HIS 122 HE1 HIS 122 -0.662 -0.930 10.325 899 H SER 123 HN SER 123 -1.907 2.764 4.060 900 HA SER 123 HA SER 123 -2.502 5.526 4.335 901 1HB SER 123 HB2 SER 123 -2.578 5.617 1.963 902 2HB SER 123 HB1 SER 123 -1.457 4.308 2.318 903 HG SER 123 HG SER 123 -3.027 2.840 1.834 904 H LEU 124 HN LEU 124 -4.583 2.734 4.004 905 HA LEU 124 HA LEU 124 -6.969 4.355 3.463 906 1HB LEU 124 HB2 LEU 124 -6.657 1.429 4.205 907 2HB LEU 124 HB1 LEU 124 -8.170 2.190 3.712 908 HG LEU 124 HG LEU 124 -5.656 2.077 2.009 909 1HD1 LEU 124 HD11 LEU 124 -8.175 0.406 2.045 910 2HD1 LEU 124 HD13 LEU 124 -7.125 0.501 0.632 911 3HD1 LEU 124 HD12 LEU 124 -6.505 -0.149 2.150 912 1HD2 LEU 124 HD21 LEU 124 -8.412 3.242 1.631 913 2HD2 LEU 124 HD23 LEU 124 -6.847 3.933 1.206 914 3HD2 LEU 124 HD22 LEU 124 -7.526 2.637 0.231 915 H GLY 125 HN GLY 125 -5.110 3.791 6.183 916 1HA GLY 125 HA2 GLY 125 -5.594 4.634 8.369 917 2HA GLY 125 HA1 GLY 125 -7.300 4.732 7.928 918 H LEU 126 HN LEU 126 -5.967 1.726 7.059 919 HA LEU 126 HA LEU 126 -7.569 0.347 9.063 920 1HB LEU 126 HB2 LEU 126 -5.551 -0.670 7.039 921 2HB LEU 126 HB1 LEU 126 -6.569 -1.712 8.033 922 HG LEU 126 HG LEU 126 -7.635 0.412 6.145 923 1HD1 LEU 126 HD12 LEU 126 -7.114 -2.542 5.782 924 2HD1 LEU 126 HD11 LEU 126 -8.354 -1.710 4.842 925 3HD1 LEU 126 HD13 LEU 126 -6.668 -1.204 4.719 926 1HD2 LEU 126 HD23 LEU 126 -8.882 -1.604 8.001 927 2HD2 LEU 126 HD22 LEU 126 -9.381 0.047 7.645 928 3HD2 LEU 126 HD21 LEU 126 -9.710 -1.237 6.488 929 H SER 127 HN SER 127 -6.771 -0.947 10.805 930 HA SER 127 HA SER 127 -4.019 -0.193 11.724 931 1HB SER 127 HB2 SER 127 -6.453 -1.118 13.271 932 2HB SER 127 HB1 SER 127 -4.864 -0.879 13.988 933 HG SER 127 HG SER 127 -6.680 0.921 13.710 934 H HIS 128 HN HIS 128 -2.765 -1.872 12.792 935 HA HIS 128 HA HIS 128 -2.482 -4.243 11.332 936 1HB HIS 128 HB2 HIS 128 -1.763 -3.705 14.229 937 2HB HIS 128 HB1 HIS 128 -1.188 -5.089 13.306 938 HD1 HIS 128 HD1 HIS 128 -0.775 -1.372 13.640 939 HD2 HIS 128 HD2 HIS 128 0.774 -4.468 11.313 940 HE1 HIS 128 HE1 HIS 128 1.233 -0.420 12.422 941 H SER 129 HN SER 129 -2.730 -6.543 12.410 942 HA SER 129 HA SER 129 -5.200 -6.782 14.036 943 1HB SER 129 HB2 SER 129 -5.999 -6.731 11.688 944 2HB SER 129 HB1 SER 129 -4.921 -8.070 11.299 945 HG SER 129 HG SER 129 -6.163 -8.945 13.336 946 H THR 130 HN THR 130 -5.506 -9.007 14.835 947 HA THR 130 HA THR 130 -2.889 -10.388 15.153 948 HB THR 130 HB THR 130 -3.985 -11.546 17.027 949 HG1 THR 130 HG1 THR 130 -6.083 -11.316 17.392 950 1HG2 THR 130 HG22 THR 130 -4.384 -8.543 16.982 951 2HG2 THR 130 HG21 THR 130 -4.362 -9.537 18.439 952 3HG2 THR 130 HG23 THR 130 -2.911 -9.394 17.446 953 H ASP 131 HN ASP 131 -5.365 -10.659 13.014 954 HA ASP 131 HA ASP 131 -5.747 -13.568 13.181 955 1HB ASP 131 HB2 ASP 131 -7.499 -11.961 12.321 956 2HB ASP 131 HB1 ASP 131 -6.478 -11.713 10.902 957 H ILE 132 HN ILE 132 -4.332 -14.997 12.352 958 HA ILE 132 HA ILE 132 -1.929 -14.272 11.026 959 HB ILE 132 HB ILE 132 -3.402 -16.924 11.010 960 1HG1 ILE 132 HG12 ILE 132 -1.134 -16.006 12.800 961 2HG1 ILE 132 HG11 ILE 132 -2.829 -15.901 13.275 962 1HG2 ILE 132 HG21 ILE 132 -0.553 -16.143 10.356 963 2HG2 ILE 132 HG23 ILE 132 -1.049 -17.804 10.683 964 3HG2 ILE 132 HG22 ILE 132 -1.718 -16.940 9.297 965 1HD1 ILE 132 HD12 ILE 132 -3.021 -18.379 12.792 966 2HD1 ILE 132 HD11 ILE 132 -1.267 -18.407 12.596 967 3HD1 ILE 132 HD13 ILE 132 -1.977 -17.974 14.152 968 H GLY 133 HN GLY 133 -5.064 -15.331 9.753 969 1HA GLY 133 HA2 GLY 133 -4.220 -15.557 7.008 970 2HA GLY 133 HA1 GLY 133 -5.887 -15.431 7.562 971 H ALA 134 HN ALA 134 -4.170 -12.836 8.816 972 HA ALA 134 HA ALA 134 -5.295 -11.050 6.699 973 1HB ALA 134 HB2 ALA 134 -4.334 -10.497 9.514 974 2HB ALA 134 HB1 ALA 134 -4.887 -9.255 8.395 975 3HB ALA 134 HB3 ALA 134 -6.000 -10.505 8.944 976 H LEU 135 HN LEU 135 -3.991 -9.783 5.432 977 HA LEU 135 HA LEU 135 -1.161 -10.367 5.285 978 1HB LEU 135 HB2 LEU 135 -2.692 -8.042 4.055 979 2HB LEU 135 HB1 LEU 135 -1.097 -8.607 3.567 980 HG LEU 135 HG LEU 135 -3.599 -10.318 3.450 981 1HD1 LEU 135 HD11 LEU 135 -2.197 -8.684 1.317 982 2HD1 LEU 135 HD13 LEU 135 -3.403 -9.921 0.970 983 3HD1 LEU 135 HD12 LEU 135 -3.853 -8.484 1.887 984 1HD2 LEU 135 HD21 LEU 135 -0.740 -10.656 2.517 985 2HD2 LEU 135 HD23 LEU 135 -1.697 -11.749 3.518 986 3HD2 LEU 135 HD22 LEU 135 -2.057 -11.583 1.801 987 H MET 136 HN MET 136 -3.115 -8.028 6.960 988 HA MET 136 HA MET 136 -0.989 -6.131 7.501 989 1HB MET 136 HB2 MET 136 -3.569 -6.567 9.039 990 2HB MET 136 HB1 MET 136 -2.547 -5.128 9.085 991 1HG MET 136 HG2 MET 136 -3.962 -6.186 6.621 992 2HG MET 136 HG1 MET 136 -4.497 -4.811 7.585 993 1HE MET 136 HE3 MET 136 -3.305 -2.895 8.109 994 2HE MET 136 HE2 MET 136 -1.565 -3.148 8.198 995 3HE MET 136 HE1 MET 136 -2.223 -2.019 7.018 996 H TYR 137 HN TYR 137 -0.902 -9.198 8.305 997 HA TYR 137 HA TYR 137 -0.713 -9.246 11.142 998 1HB TYR 137 HB2 TYR 137 -0.723 -11.230 9.449 999 2HB TYR 137 HB1 TYR 137 1.024 -10.987 9.381 1000 HD1 TYR 137 HD2 TYR 137 -1.825 -11.700 11.659 1001 HD2 TYR 137 HD1 TYR 137 2.439 -11.697 11.194 1002 HE1 TYR 137 HE2 TYR 137 -1.590 -12.951 13.785 1003 HE2 TYR 137 HE1 TYR 137 2.671 -12.949 13.319 1004 HH TYR 137 HH TYR 137 1.100 -14.580 14.652 1005 HA PRO 138 HA PRO 138 2.976 -6.754 11.600 1006 1HB PRO 138 HB2 PRO 138 3.886 -8.123 13.983 1007 2HB PRO 138 HB1 PRO 138 3.055 -6.566 13.877 1008 1HG PRO 138 HG2 PRO 138 1.968 -9.118 14.765 1009 2HG PRO 138 HG1 PRO 138 1.185 -7.530 14.778 1010 1HD PRO 138 HD2 PRO 138 0.591 -9.721 13.026 1011 2HD PRO 138 HD1 PRO 138 -0.066 -8.070 12.947 1012 H SER 139 HN SER 139 3.398 -10.260 12.285 1013 HA SER 139 HA SER 139 6.180 -10.156 11.347 1014 1HB SER 139 HB2 SER 139 5.344 -11.617 13.238 1015 2HB SER 139 HB1 SER 139 4.547 -12.600 12.016 1016 HG SER 139 HG SER 139 6.416 -13.370 11.413 1017 H TYR 140 HN TYR 140 6.959 -10.950 9.427 1018 HA TYR 140 HA TYR 140 5.160 -11.140 7.182 1019 1HB TYR 140 HB2 TYR 140 7.551 -10.392 7.018 1020 2HB TYR 140 HB1 TYR 140 8.051 -12.055 7.339 1021 HD1 TYR 140 HD1 TYR 140 7.621 -13.843 5.714 1022 HD2 TYR 140 HD2 TYR 140 6.489 -9.779 4.911 1023 HE1 TYR 140 HE1 TYR 140 7.257 -14.416 3.329 1024 HE2 TYR 140 HE2 TYR 140 6.122 -10.351 2.520 1025 HH TYR 140 HH TYR 140 6.665 -13.672 1.328 1026 H THR 141 HN THR 141 4.507 -13.012 6.028 1027 HA THR 141 HA THR 141 5.280 -15.672 7.112 1028 HB THR 141 HB THR 141 2.967 -16.374 7.397 1029 HG1 THR 141 HG1 THR 141 2.535 -14.040 6.025 1030 1HG2 THR 141 HG22 THR 141 4.099 -15.152 9.274 1031 2HG2 THR 141 HG21 THR 141 3.322 -13.671 8.716 1032 3HG2 THR 141 HG23 THR 141 2.341 -15.013 9.302 1033 H PHE 142 HN PHE 142 4.671 -17.418 5.633 1034 HA PHE 142 HA PHE 142 4.958 -16.619 2.843 1035 1HB PHE 142 HB2 PHE 142 6.013 -18.681 3.819 1036 2HB PHE 142 HB1 PHE 142 4.399 -19.369 4.004 1037 HD1 PHE 142 HD1 PHE 142 3.061 -20.002 2.051 1038 HD2 PHE 142 HD2 PHE 142 7.024 -18.408 1.615 1039 HE1 PHE 142 HE1 PHE 142 3.102 -20.759 -0.311 1040 HE2 PHE 142 HE2 PHE 142 7.068 -19.163 -0.747 1041 HZ PHE 142 HZ PHE 142 5.106 -20.337 -1.711 1042 H SER 143 HN SER 143 3.288 -16.285 1.426 1043 HA SER 143 HA SER 143 0.580 -17.378 2.136 1044 1HB SER 143 HB2 SER 143 0.628 -14.927 2.445 1045 2HB SER 143 HB1 SER 143 1.210 -14.725 0.797 1046 HG SER 143 HG SER 143 -1.012 -16.309 0.974 1047 H GLY 144 HN GLY 144 -0.054 -18.833 0.662 1048 1HA GLY 144 HA2 GLY 144 1.335 -19.244 -1.818 1049 2HA GLY 144 HA1 GLY 144 -0.213 -19.977 -1.382 1050 H ASP 145 HN ASP 145 -1.848 -17.836 -1.045 1051 HA ASP 145 HA ASP 145 -1.793 -16.381 -3.676 1052 1HB ASP 145 HB2 ASP 145 -4.140 -17.555 -2.158 1053 2HB ASP 145 HB1 ASP 145 -4.299 -16.485 -3.551 1054 H VAL 146 HN VAL 146 -2.246 -14.181 -3.535 1055 HA VAL 146 HA VAL 146 -2.414 -13.065 -0.787 1056 HB VAL 146 HB VAL 146 -2.036 -11.682 -3.458 1057 1HG1 VAL 146 HG13 VAL 146 -1.789 -10.747 -0.589 1058 2HG1 VAL 146 HG12 VAL 146 -1.247 -9.813 -1.982 1059 3HG1 VAL 146 HG11 VAL 146 -2.960 -10.184 -1.780 1060 1HG2 VAL 146 HG23 VAL 146 -0.090 -12.610 -1.326 1061 2HG2 VAL 146 HG22 VAL 146 -0.139 -13.114 -3.015 1062 3HG2 VAL 146 HG21 VAL 146 0.338 -11.470 -2.599 1063 H GLN 147 HN GLN 147 -4.467 -12.916 -0.037 1064 HA GLN 147 HA GLN 147 -6.536 -11.591 -1.737 1065 1HB GLN 147 HB2 GLN 147 -6.844 -14.182 -0.187 1066 2HB GLN 147 HB1 GLN 147 -8.207 -13.249 -0.798 1067 1HG GLN 147 HG2 GLN 147 -7.406 -13.501 -3.089 1068 2HG GLN 147 HG1 GLN 147 -5.960 -14.337 -2.522 1069 1HE2 GLN 147 HE22 GLN 147 -8.897 -16.665 -3.470 1070 2HE2 GLN 147 HE21 GLN 147 -8.382 -15.231 -4.217 1071 H LEU 148 HN LEU 148 -8.182 -10.482 -0.407 1072 HA LEU 148 HA LEU 148 -7.108 -9.509 2.131 1073 1HB LEU 148 HB2 LEU 148 -9.848 -9.076 0.899 1074 2HB LEU 148 HB1 LEU 148 -9.174 -8.176 2.258 1075 HG LEU 148 HG LEU 148 -7.950 -8.278 -0.517 1076 1HD1 LEU 148 HD11 LEU 148 -9.620 -6.144 0.847 1077 2HD1 LEU 148 HD13 LEU 148 -8.763 -5.924 -0.677 1078 3HD1 LEU 148 HD12 LEU 148 -10.082 -7.088 -0.568 1079 1HD2 LEU 148 HD21 LEU 148 -7.232 -6.880 2.067 1080 2HD2 LEU 148 HD23 LEU 148 -6.184 -7.759 0.951 1081 3HD2 LEU 148 HD22 LEU 148 -6.783 -6.163 0.517 1082 H ALA 149 HN ALA 149 -8.287 -9.679 4.183 1083 HA ALA 149 HA ALA 149 -9.537 -12.374 4.490 1084 1HB ALA 149 HB3 ALA 149 -7.567 -11.663 5.918 1085 2HB ALA 149 HB2 ALA 149 -8.634 -10.465 6.657 1086 3HB ALA 149 HB1 ALA 149 -8.992 -12.184 6.820 1087 H GLN 150 HN GLN 150 -11.440 -12.537 5.923 1088 HA GLN 150 HA GLN 150 -13.507 -10.702 5.237 1089 1HB GLN 150 HB2 GLN 150 -13.950 -13.021 5.938 1090 2HB GLN 150 HB1 GLN 150 -13.390 -12.640 7.568 1091 1HG GLN 150 HG2 GLN 150 -15.187 -11.009 7.842 1092 2HG GLN 150 HG1 GLN 150 -15.700 -11.256 6.171 1093 1HE2 GLN 150 HE22 GLN 150 -17.676 -13.439 8.614 1094 2HE2 GLN 150 HE21 GLN 150 -17.265 -11.793 8.684 1095 H ASP 151 HN ASP 151 -11.421 -10.931 8.090 1096 HA ASP 151 HA ASP 151 -12.707 -8.975 9.696 1097 1HB ASP 151 HB2 ASP 151 -10.924 -10.458 10.530 1098 2HB ASP 151 HB1 ASP 151 -9.751 -9.642 9.497 1099 H ASP 152 HN ASP 152 -10.156 -8.600 7.224 1100 HA ASP 152 HA ASP 152 -9.984 -5.725 7.608 1101 1HB ASP 152 HB2 ASP 152 -9.008 -7.560 5.401 1102 2HB ASP 152 HB1 ASP 152 -8.700 -5.826 5.426 1103 H ILE 153 HN ILE 153 -11.642 -7.845 5.280 1104 HA ILE 153 HA ILE 153 -12.593 -5.788 3.546 1105 HB ILE 153 HB ILE 153 -13.720 -8.511 4.267 1106 1HG1 ILE 153 HG12 ILE 153 -12.320 -7.621 1.738 1107 2HG1 ILE 153 HG11 ILE 153 -11.448 -8.290 3.117 1108 1HG2 ILE 153 HG22 ILE 153 -14.551 -6.557 2.113 1109 2HG2 ILE 153 HG21 ILE 153 -14.969 -8.267 2.089 1110 3HG2 ILE 153 HG23 ILE 153 -15.561 -7.236 3.389 1111 1HD1 ILE 153 HD12 ILE 153 -13.796 -9.725 1.864 1112 2HD1 ILE 153 HD11 ILE 153 -12.147 -9.949 1.282 1113 3HD1 ILE 153 HD13 ILE 153 -12.563 -10.383 2.938 1114 H ASP 154 HN ASP 154 -14.178 -7.374 6.326 1115 HA ASP 154 HA ASP 154 -16.527 -5.768 6.282 1116 1HB ASP 154 HB2 ASP 154 -15.123 -7.234 8.522 1117 2HB ASP 154 HB1 ASP 154 -16.685 -6.440 8.726 1118 H GLY 155 HN GLY 155 -13.403 -5.276 7.898 1119 1HA GLY 155 HA2 GLY 155 -14.170 -3.008 9.434 1120 2HA GLY 155 HA1 GLY 155 -12.520 -3.377 8.947 1121 H ILE 156 HN ILE 156 -12.570 -3.083 6.209 1122 HA ILE 156 HA ILE 156 -12.672 -0.208 5.965 1123 HB ILE 156 HB ILE 156 -11.109 -1.760 4.682 1124 1HG1 ILE 156 HG12 ILE 156 -11.312 -0.376 2.561 1125 2HG1 ILE 156 HG11 ILE 156 -12.797 0.300 3.224 1126 1HG2 ILE 156 HG23 ILE 156 -13.055 -3.276 4.019 1127 2HG2 ILE 156 HG22 ILE 156 -13.461 -2.064 2.812 1128 3HG2 ILE 156 HG21 ILE 156 -11.905 -2.890 2.747 1129 1HD1 ILE 156 HD13 ILE 156 -10.373 0.408 4.973 1130 2HD1 ILE 156 HD12 ILE 156 -10.415 1.484 3.581 1131 3HD1 ILE 156 HD11 ILE 156 -11.689 1.566 4.792 1132 H GLN 157 HN GLN 157 -14.810 -2.832 4.924 1133 HA GLN 157 HA GLN 157 -16.571 -1.147 3.384 1134 1HB GLN 157 HB2 GLN 157 -16.969 -3.828 4.727 1135 2HB GLN 157 HB1 GLN 157 -18.209 -3.055 3.738 1136 1HG GLN 157 HG2 GLN 157 -16.693 -3.007 1.819 1137 2HG GLN 157 HG1 GLN 157 -15.401 -3.702 2.797 1138 1HE2 GLN 157 HE22 GLN 157 -17.187 -6.445 0.914 1139 2HE2 GLN 157 HE21 GLN 157 -16.447 -4.999 0.424 1140 H ALA 158 HN ALA 158 -16.539 -2.199 6.773 1141 HA ALA 158 HA ALA 158 -19.065 -1.137 7.530 1142 1HB ALA 158 HB3 ALA 158 -16.519 -1.369 9.163 1143 2HB ALA 158 HB2 ALA 158 -18.139 -1.141 9.822 1144 3HB ALA 158 HB1 ALA 158 -17.735 -2.632 8.970 1145 H ILE 159 HN ILE 159 -15.868 0.378 7.280 1146 HA ILE 159 HA ILE 159 -16.668 2.899 8.436 1147 HB ILE 159 HB ILE 159 -14.414 2.178 6.541 1148 1HG1 ILE 159 HG12 ILE 159 -14.346 2.810 9.509 1149 2HG1 ILE 159 HG11 ILE 159 -14.466 1.169 8.876 1150 1HG2 ILE 159 HG23 ILE 159 -15.185 4.776 7.867 1151 2HG2 ILE 159 HG22 ILE 159 -13.486 4.417 7.564 1152 3HG2 ILE 159 HG21 ILE 159 -14.625 4.490 6.220 1153 1HD1 ILE 159 HD12 ILE 159 -12.267 3.074 8.052 1154 2HD1 ILE 159 HD11 ILE 159 -12.105 1.971 9.418 1155 3HD1 ILE 159 HD13 ILE 159 -12.341 1.333 7.791 1156 H TYR 160 HN TYR 160 -16.355 1.777 5.054 1157 HA TYR 160 HA TYR 160 -17.690 4.269 4.113 1158 1HB TYR 160 HB2 TYR 160 -16.344 1.979 2.645 1159 2HB TYR 160 HB1 TYR 160 -17.200 3.285 1.830 1160 HD1 TYR 160 HD2 TYR 160 -16.384 5.599 1.952 1161 HD2 TYR 160 HD1 TYR 160 -14.183 2.347 3.687 1162 HE1 TYR 160 HE2 TYR 160 -14.365 7.033 2.074 1163 HE2 TYR 160 HE1 TYR 160 -12.161 3.778 3.811 1164 HH TYR 160 HH TYR 160 -11.473 6.120 2.230 1165 H GLY 161 HN GLY 161 -17.956 0.859 3.138 1166 1HA GLY 161 HA2 GLY 161 -20.506 0.225 4.003 1167 2HA GLY 161 HA1 GLY 161 -20.787 1.147 2.522 1168 H ARG 162 HN ARG 162 -21.685 -1.248 2.118 1169 HA ARG 162 HA ARG 162 -19.549 -3.111 1.253 1170 1HB ARG 162 HB2 ARG 162 -22.574 -3.306 1.284 1171 2HB ARG 162 HB1 ARG 162 -21.523 -4.570 0.635 1172 1HG ARG 162 HG2 ARG 162 -20.394 -4.758 2.806 1173 2HG ARG 162 HG1 ARG 162 -21.421 -3.485 3.466 1174 1HD ARG 162 HD2 ARG 162 -23.401 -4.970 2.752 1175 2HD ARG 162 HD1 ARG 162 -22.220 -6.264 2.571 1176 HE ARG 162 HE ARG 162 -23.364 -5.300 5.033 1177 1HH1 ARG 162 HH21 ARG 162 -20.332 -6.253 3.683 1178 2HH1 ARG 162 HH22 ARG 162 -19.591 -6.512 5.225 1179 1HH2 ARG 162 HH11 ARG 162 -22.413 -5.669 7.035 1180 2HH2 ARG 162 HH12 ARG 162 -20.771 -6.212 7.109 1181 H SER 163 HN SER 163 -19.116 -3.570 -0.912 1182 HA SER 163 HA SER 163 -19.909 -1.520 -2.820 1183 1HB SER 163 HB2 SER 163 -18.402 -4.104 -3.294 1184 2HB SER 163 HB1 SER 163 -18.484 -2.729 -4.392 1185 HG SER 163 HG SER 163 -16.584 -2.780 -3.045 1186 H GLN 164 HN GLN 164 -22.251 -1.907 -2.768 1187 HA GLN 164 HA GLN 164 -23.301 -4.457 -3.710 1188 1HB GLN 164 HB2 GLN 164 -24.545 -1.709 -3.396 1189 2HB GLN 164 HB1 GLN 164 -25.446 -3.133 -3.910 1190 1HG GLN 164 HG2 GLN 164 -24.900 -4.273 -1.817 1191 2HG GLN 164 HG1 GLN 164 -23.918 -2.899 -1.302 1192 1HE2 GLN 164 HE22 GLN 164 -26.707 -1.099 -0.091 1193 2HE2 GLN 164 HE21 GLN 164 -25.017 -1.242 -0.171 1194 H ASN 165 HN ASN 165 -22.279 -4.824 -5.743 1195 HA ASN 165 HA ASN 165 -23.461 -3.330 -7.990 1196 1HB ASN 165 HB2 ASN 165 -20.452 -3.440 -7.602 1197 2HB ASN 165 HB1 ASN 165 -21.294 -2.744 -8.986 1198 1HD2 ASN 165 HD22 ASN 165 -20.731 -0.499 -5.694 1199 2HD2 ASN 165 HD21 ASN 165 -20.005 -2.017 -5.904 1200 HA PRO 166 HA PRO 166 -22.520 -7.896 -8.541 1201 1HB PRO 166 HB2 PRO 166 -25.210 -8.296 -9.517 1202 2HB PRO 166 HB1 PRO 166 -24.514 -8.880 -7.998 1203 1HG PRO 166 HG2 PRO 166 -26.458 -6.760 -8.349 1204 2HG PRO 166 HG1 PRO 166 -25.779 -7.369 -6.831 1205 1HD PRO 166 HD2 PRO 166 -25.184 -4.859 -8.165 1206 2HD PRO 166 HD1 PRO 166 -24.542 -5.448 -6.621 1207 H VAL 167 HN VAL 167 -21.183 -7.127 -10.325 1208 HA VAL 167 HA VAL 167 -22.510 -6.331 -12.836 1209 HB VAL 167 HB VAL 167 -19.596 -6.766 -12.120 1210 1HG1 VAL 167 HG13 VAL 167 -20.943 -5.967 -14.708 1211 2HG1 VAL 167 HG12 VAL 167 -19.280 -5.499 -14.350 1212 3HG1 VAL 167 HG11 VAL 167 -19.713 -7.205 -14.450 1213 1HG2 VAL 167 HG21 VAL 167 -20.731 -4.809 -11.085 1214 2HG2 VAL 167 HG23 VAL 167 -19.488 -4.322 -12.238 1215 3HG2 VAL 167 HG22 VAL 167 -21.191 -4.250 -12.695 1216 H GLN 168 HN GLN 168 -22.692 -7.670 -14.651 1217 HA GLN 168 HA GLN 168 -22.481 -10.532 -14.148 1218 1HB GLN 168 HB2 GLN 168 -23.050 -9.171 -16.787 1219 2HB GLN 168 HB1 GLN 168 -23.551 -10.781 -16.284 1220 1HG GLN 168 HG2 GLN 168 -24.515 -8.146 -15.146 1221 2HG GLN 168 HG1 GLN 168 -25.459 -9.301 -16.085 1222 1HE2 GLN 168 HE22 GLN 168 -25.942 -11.540 -13.337 1223 2HE2 GLN 168 HE21 GLN 168 -25.959 -11.416 -15.029 1224 HA PRO 169 HA PRO 169 -18.334 -11.116 -15.630 1225 1HB PRO 169 HB2 PRO 169 -18.882 -13.451 -17.244 1226 2HB PRO 169 HB1 PRO 169 -18.196 -13.400 -15.614 1227 1HG PRO 169 HG2 PRO 169 -20.914 -14.149 -16.420 1228 2HG PRO 169 HG1 PRO 169 -20.150 -14.316 -14.832 1229 1HD PRO 169 HD2 PRO 169 -22.172 -12.449 -15.518 1230 2HD PRO 169 HD1 PRO 169 -21.185 -12.426 -14.044 No H/Q in entry = 1230 Start of MODEL 19 1 1H VAL 1 HT1 VAL 1 -7.813 13.043 13.763 2 2H VAL 1 HT3 VAL 1 -6.522 12.237 14.514 3 3H VAL 1 HT2 VAL 1 -7.977 11.413 14.214 4 HA VAL 1 HA VAL 1 -9.127 12.534 15.873 5 HB VAL 1 HB VAL 1 -6.343 12.425 17.048 6 1HG1 VAL 1 HG13 VAL 1 -8.376 13.119 18.409 7 2HG1 VAL 1 HG12 VAL 1 -9.003 11.489 18.159 8 3HG1 VAL 1 HG11 VAL 1 -7.492 11.728 19.038 9 1HG2 VAL 1 HG22 VAL 1 -8.157 10.098 16.330 10 2HG2 VAL 1 HG21 VAL 1 -6.583 10.448 15.616 11 3HG2 VAL 1 HG23 VAL 1 -6.698 9.977 17.312 12 H LEU 2 HN LEU 2 -6.088 14.170 15.080 13 HA LEU 2 HA LEU 2 -6.491 16.494 16.682 14 1HB LEU 2 HB2 LEU 2 -5.051 16.128 14.036 15 2HB LEU 2 HB1 LEU 2 -5.007 17.627 14.956 16 HG LEU 2 HG LEU 2 -3.013 16.287 15.434 17 1HD1 LEU 2 HD12 LEU 2 -4.398 17.551 17.307 18 2HD1 LEU 2 HD11 LEU 2 -4.635 15.919 17.934 19 3HD1 LEU 2 HD13 LEU 2 -3.005 16.559 17.732 20 1HD2 LEU 2 HD21 LEU 2 -4.316 14.085 14.944 21 2HD2 LEU 2 HD23 LEU 2 -3.056 14.059 16.175 22 3HD2 LEU 2 HD22 LEU 2 -4.748 14.144 16.654 23 H THR 3 HN THR 3 -7.583 15.631 13.434 24 HA THR 3 HA THR 3 -9.004 18.199 13.122 25 HB THR 3 HB THR 3 -9.633 17.324 10.925 26 HG1 THR 3 HG1 THR 3 -9.955 15.159 11.652 27 1HG2 THR 3 HG23 THR 3 -7.306 18.211 11.301 28 2HG2 THR 3 HG22 THR 3 -6.765 16.545 11.507 29 3HG2 THR 3 HG21 THR 3 -7.432 17.071 9.961 30 H GLU 4 HN GLU 4 -11.400 18.054 12.499 31 HA GLU 4 HA GLU 4 -12.834 16.685 14.599 32 1HB GLU 4 HB2 GLU 4 -13.625 18.816 13.594 33 2HB GLU 4 HB1 GLU 4 -13.887 17.984 12.063 34 1HG GLU 4 HG2 GLU 4 -16.001 18.175 13.300 35 2HG GLU 4 HG1 GLU 4 -15.526 16.483 13.171 36 H GLY 5 HN GLY 5 -13.695 14.652 14.567 37 1HA GLY 5 HA2 GLY 5 -14.577 12.649 13.673 38 2HA GLY 5 HA1 GLY 5 -14.452 13.354 12.060 39 H ASN 6 HN ASN 6 -13.668 10.895 11.938 40 HA ASN 6 HA ASN 6 -10.926 10.455 12.764 41 1HB ASN 6 HB2 ASN 6 -12.809 8.940 10.952 42 2HB ASN 6 HB1 ASN 6 -11.170 8.391 11.306 43 1HD2 ASN 6 HD22 ASN 6 -11.984 7.226 14.541 44 2HD2 ASN 6 HD21 ASN 6 -10.772 7.443 13.372 45 HA PRO 7 HA PRO 7 -9.275 12.643 9.180 46 1HB PRO 7 HB2 PRO 7 -6.734 11.296 9.252 47 2HB PRO 7 HB1 PRO 7 -7.113 12.900 9.894 48 1HG PRO 7 HG2 PRO 7 -6.653 10.422 11.377 49 2HG PRO 7 HG1 PRO 7 -6.833 12.066 12.007 50 1HD PRO 7 HD2 PRO 7 -8.749 9.947 12.189 51 2HD PRO 7 HD1 PRO 7 -8.989 11.648 12.648 52 H ARG 8 HN ARG 8 -10.403 11.767 7.438 53 HA ARG 8 HA ARG 8 -9.231 9.332 6.155 54 1HB ARG 8 HB2 ARG 8 -12.203 9.905 6.456 55 2HB ARG 8 HB1 ARG 8 -11.503 8.552 5.573 56 1HG ARG 8 HG2 ARG 8 -10.963 9.003 8.516 57 2HG ARG 8 HG1 ARG 8 -12.337 8.064 7.949 58 1HD ARG 8 HD2 ARG 8 -10.699 6.632 6.648 59 2HD ARG 8 HD1 ARG 8 -9.400 7.473 7.488 60 HE ARG 8 HE ARG 8 -11.095 6.588 9.518 61 1HH1 ARG 8 HH21 ARG 8 -9.362 5.223 6.871 62 2HH1 ARG 8 HH22 ARG 8 -9.147 3.682 7.632 63 1HH2 ARG 8 HH11 ARG 8 -10.812 4.592 10.538 64 2HH2 ARG 8 HH12 ARG 8 -9.959 3.328 9.716 65 H TRP 9 HN TRP 9 -9.655 9.291 3.816 66 HA TRP 9 HA TRP 9 -9.365 11.883 2.612 67 1HB TRP 9 HB2 TRP 9 -10.108 9.228 1.339 68 2HB TRP 9 HB1 TRP 9 -9.537 10.655 0.474 69 HD1 TRP 9 HD1 TRP 9 -8.356 7.790 2.653 70 HE1 TRP 9 HE1 TRP 9 -5.778 7.787 2.742 71 HE3 TRP 9 HE3 TRP 9 -7.389 12.251 0.354 72 HZ2 TRP 9 HZ2 TRP 9 -3.588 9.457 1.941 73 HZ3 TRP 9 HZ3 TRP 9 -5.052 13.016 0.027 74 HH2 TRP 9 HH2 TRP 9 -3.156 11.627 0.816 75 H GLU 10 HN GLU 10 -10.949 13.303 1.949 76 HA GLU 10 HA GLU 10 -13.729 12.709 2.517 77 1HB GLU 10 HB2 GLU 10 -12.360 15.044 1.170 78 2HB GLU 10 HB1 GLU 10 -14.107 14.968 1.405 79 1HG GLU 10 HG2 GLU 10 -13.800 14.760 3.829 80 2HG GLU 10 HG1 GLU 10 -12.048 14.749 3.624 81 H GLN 11 HN GLN 11 -11.769 12.799 -0.429 82 HA GLN 11 HA GLN 11 -14.130 12.381 -2.141 83 1HB GLN 11 HB2 GLN 11 -12.455 12.271 -3.969 84 2HB GLN 11 HB1 GLN 11 -12.250 13.718 -2.982 85 1HG GLN 11 HG2 GLN 11 -10.478 12.544 -1.682 86 2HG GLN 11 HG1 GLN 11 -10.649 11.153 -2.752 87 1HE2 GLN 11 HE22 GLN 11 -7.962 12.817 -4.459 88 2HE2 GLN 11 HE21 GLN 11 -8.279 11.664 -3.255 89 H THR 12 HN THR 12 -14.501 10.432 -3.362 90 HA THR 12 HA THR 12 -13.551 7.987 -1.974 91 HB THR 12 HB THR 12 -15.278 6.833 -3.231 92 HG1 THR 12 HG1 THR 12 -15.777 7.566 -5.114 93 1HG2 THR 12 HG23 THR 12 -16.242 9.544 -2.281 94 2HG2 THR 12 HG22 THR 12 -17.271 8.136 -2.547 95 3HG2 THR 12 HG21 THR 12 -16.044 8.106 -1.280 96 H HIS 13 HN HIS 13 -12.552 9.900 -4.504 97 HA HIS 13 HA HIS 13 -11.326 7.610 -6.004 98 1HB HIS 13 HB2 HIS 13 -11.830 10.477 -6.863 99 2HB HIS 13 HB1 HIS 13 -11.071 9.233 -7.856 100 HD1 HIS 13 HD1 HIS 13 -13.745 10.557 -8.720 101 HD2 HIS 13 HD2 HIS 13 -13.499 6.984 -6.590 102 HE1 HIS 13 HE1 HIS 13 -15.910 9.318 -9.146 103 H LEU 14 HN LEU 14 -9.205 7.328 -5.573 104 HA LEU 14 HA LEU 14 -7.614 9.642 -4.516 105 1HB LEU 14 HB2 LEU 14 -7.212 6.648 -4.253 106 2HB LEU 14 HB1 LEU 14 -6.067 7.854 -3.669 107 HG LEU 14 HG LEU 14 -8.974 7.695 -2.806 108 1HD1 LEU 14 HD13 LEU 14 -6.429 6.653 -1.543 109 2HD1 LEU 14 HD12 LEU 14 -7.910 6.914 -0.621 110 3HD1 LEU 14 HD11 LEU 14 -7.888 5.745 -1.943 111 1HD2 LEU 14 HD22 LEU 14 -6.653 9.496 -2.129 112 2HD2 LEU 14 HD21 LEU 14 -8.355 9.901 -2.355 113 3HD2 LEU 14 HD23 LEU 14 -7.827 9.121 -0.869 114 H THR 15 HN THR 15 -5.336 9.722 -5.230 115 HA THR 15 HA THR 15 -4.875 8.536 -7.942 116 HB THR 15 HB THR 15 -3.929 10.689 -8.676 117 HG1 THR 15 HG1 THR 15 -3.850 11.152 -6.118 118 1HG2 THR 15 HG22 THR 15 -6.720 10.904 -7.510 119 2HG2 THR 15 HG21 THR 15 -6.045 12.007 -8.709 120 3HG2 THR 15 HG23 THR 15 -6.302 10.311 -9.118 121 H TYR 16 HN TYR 16 -2.599 8.253 -8.445 122 HA TYR 16 HA TYR 16 -0.696 8.724 -6.215 123 1HB TYR 16 HB2 TYR 16 0.033 6.418 -6.137 124 2HB TYR 16 HB1 TYR 16 -1.711 6.452 -5.879 125 HD1 TYR 16 HD1 TYR 16 0.986 5.591 -8.223 126 HD2 TYR 16 HD2 TYR 16 -3.260 5.661 -7.595 127 HE1 TYR 16 HE1 TYR 16 0.672 4.091 -10.173 128 HE2 TYR 16 HE2 TYR 16 -3.577 4.164 -9.545 129 HH TYR 16 HH TYR 16 -0.842 3.203 -11.586 130 H ARG 17 HN ARG 17 1.566 8.430 -6.900 131 HA ARG 17 HA ARG 17 1.996 8.276 -9.846 132 1HB ARG 17 HB2 ARG 17 1.734 10.646 -9.519 133 2HB ARG 17 HB1 ARG 17 2.760 10.627 -8.086 134 1HG ARG 17 HG2 ARG 17 4.724 10.096 -9.429 135 2HG ARG 17 HG1 ARG 17 3.731 9.905 -10.875 136 1HD ARG 17 HD2 ARG 17 4.885 12.115 -10.770 137 2HD ARG 17 HD1 ARG 17 3.129 12.272 -10.803 138 HE ARG 17 HE ARG 17 3.786 12.202 -8.093 139 1HH1 ARG 17 HH21 ARG 17 4.679 14.041 -10.867 140 2HH1 ARG 17 HH22 ARG 17 4.981 15.493 -9.971 141 1HH2 ARG 17 HH11 ARG 17 4.175 14.083 -6.904 142 2HH2 ARG 17 HH12 ARG 17 4.692 15.518 -7.727 143 H ILE 18 HN ILE 18 3.794 7.106 -10.293 144 HA ILE 18 HA ILE 18 5.599 6.352 -8.061 145 HB ILE 18 HB ILE 18 5.584 5.472 -10.970 146 1HG1 ILE 18 HG12 ILE 18 4.665 3.963 -8.509 147 2HG1 ILE 18 HG11 ILE 18 3.567 4.831 -9.583 148 1HG2 ILE 18 HG21 ILE 18 7.094 4.478 -8.534 149 2HG2 ILE 18 HG23 ILE 18 7.029 3.626 -10.076 150 3HG2 ILE 18 HG22 ILE 18 7.787 5.216 -9.979 151 1HD1 ILE 18 HD13 ILE 18 5.488 2.703 -10.553 152 2HD1 ILE 18 HD12 ILE 18 3.819 2.364 -10.096 153 3HD1 ILE 18 HD11 ILE 18 4.162 3.441 -11.450 154 H GLU 19 HN GLU 19 7.201 7.809 -7.674 155 HA GLU 19 HA GLU 19 7.980 9.821 -9.552 156 1HB GLU 19 HB2 GLU 19 8.208 9.875 -7.006 157 2HB GLU 19 HB1 GLU 19 9.656 8.889 -7.219 158 1HG GLU 19 HG2 GLU 19 10.376 11.181 -7.159 159 2HG GLU 19 HG1 GLU 19 10.493 10.650 -8.836 160 H ASN 20 HN ASN 20 9.461 6.687 -8.695 161 HA ASN 20 HA ASN 20 10.828 6.649 -11.272 162 1HB ASN 20 HB2 ASN 20 12.279 8.139 -9.817 163 2HB ASN 20 HB1 ASN 20 12.566 6.732 -8.792 164 1HD2 ASN 20 HD22 ASN 20 15.103 5.538 -10.898 165 2HD2 ASN 20 HD21 ASN 20 14.432 5.618 -9.341 166 H TYR 21 HN TYR 21 11.754 4.582 -11.723 167 HA TYR 21 HA TYR 21 10.746 2.414 -9.938 168 1HB TYR 21 HB2 TYR 21 11.744 2.412 -12.806 169 2HB TYR 21 HB1 TYR 21 11.252 0.961 -11.934 170 HD1 TYR 21 HD1 TYR 21 8.911 0.570 -11.353 171 HD2 TYR 21 HD2 TYR 21 10.110 4.094 -13.493 172 HE1 TYR 21 HE1 TYR 21 6.548 1.005 -11.955 173 HE2 TYR 21 HE2 TYR 21 7.743 4.535 -14.093 174 HH TYR 21 HH TYR 21 5.596 3.957 -13.656 175 H THR 22 HN THR 22 12.210 1.233 -8.729 176 HA THR 22 HA THR 22 14.992 1.958 -8.756 177 HB THR 22 HB THR 22 14.076 1.198 -6.676 178 HG1 THR 22 HG1 THR 22 15.440 -0.636 -6.275 179 1HG2 THR 22 HG23 THR 22 13.244 -1.239 -8.259 180 2HG2 THR 22 HG22 THR 22 13.277 -1.218 -6.497 181 3HG2 THR 22 HG21 THR 22 12.215 -0.115 -7.371 182 HA PRO 23 HA PRO 23 16.232 -0.817 -12.029 183 1HB PRO 23 HB2 PRO 23 18.899 -1.284 -11.174 184 2HB PRO 23 HB1 PRO 23 18.362 0.016 -12.247 185 1HG PRO 23 HG2 PRO 23 19.196 0.191 -9.425 186 2HG PRO 23 HG1 PRO 23 18.997 1.493 -10.608 187 1HD PRO 23 HD2 PRO 23 17.231 0.879 -8.446 188 2HD PRO 23 HD1 PRO 23 16.942 2.028 -9.772 189 H ASP 24 HN ASP 24 15.772 -1.673 -8.867 190 HA ASP 24 HA ASP 24 17.028 -4.221 -8.631 191 1HB ASP 24 HB2 ASP 24 14.453 -3.136 -7.461 192 2HB ASP 24 HB1 ASP 24 15.147 -4.692 -7.004 193 H LEU 25 HN LEU 25 13.886 -3.272 -10.003 194 HA LEU 25 HA LEU 25 13.828 -5.848 -11.482 195 1HB LEU 25 HB2 LEU 25 11.613 -4.747 -9.728 196 2HB LEU 25 HB1 LEU 25 11.320 -5.973 -10.951 197 HG LEU 25 HG LEU 25 13.427 -6.349 -8.809 198 1HD1 LEU 25 HD12 LEU 25 10.503 -7.127 -8.687 199 2HD1 LEU 25 HD11 LEU 25 11.739 -7.636 -7.537 200 3HD1 LEU 25 HD13 LEU 25 11.298 -5.931 -7.665 201 1HD2 LEU 25 HD23 LEU 25 11.912 -8.174 -10.696 202 2HD2 LEU 25 HD22 LEU 25 13.655 -7.945 -10.576 203 3HD2 LEU 25 HD21 LEU 25 12.790 -8.788 -9.298 204 HA PRO 26 HA PRO 26 12.728 -3.164 -14.826 205 1HB PRO 26 HB2 PRO 26 10.762 -4.863 -16.051 206 2HB PRO 26 HB1 PRO 26 12.473 -4.727 -16.481 207 1HG PRO 26 HG2 PRO 26 11.120 -6.885 -15.007 208 2HG PRO 26 HG1 PRO 26 12.741 -6.876 -15.717 209 1HD PRO 26 HD2 PRO 26 12.148 -6.740 -12.954 210 2HD PRO 26 HD1 PRO 26 13.719 -6.385 -13.701 211 H ARG 27 HN ARG 27 11.068 -1.653 -15.310 212 HA ARG 27 HA ARG 27 9.125 -1.152 -13.291 213 1HB ARG 27 HB2 ARG 27 8.214 0.526 -14.859 214 2HB ARG 27 HB1 ARG 27 9.976 0.604 -14.798 215 1HG ARG 27 HG2 ARG 27 10.024 -0.911 -16.819 216 2HG ARG 27 HG1 ARG 27 8.282 -0.707 -16.938 217 1HD ARG 27 HD2 ARG 27 10.381 1.466 -17.101 218 2HD ARG 27 HD1 ARG 27 9.358 0.906 -18.418 219 HE ARG 27 HE ARG 27 8.705 2.912 -16.458 220 1HH1 ARG 27 HH21 ARG 27 7.303 0.199 -18.078 221 2HH1 ARG 27 HH22 ARG 27 5.679 0.665 -17.702 222 1HH2 ARG 27 HH11 ARG 27 6.603 3.522 -15.984 223 2HH2 ARG 27 HH12 ARG 27 5.283 2.547 -16.538 224 H ALA 28 HN ALA 28 8.986 -3.082 -16.211 225 HA ALA 28 HA ALA 28 6.171 -3.252 -16.559 226 1HB ALA 28 HB3 ALA 28 7.901 -4.169 -18.137 227 2HB ALA 28 HB2 ALA 28 8.171 -5.488 -16.998 228 3HB ALA 28 HB1 ALA 28 6.601 -5.305 -17.781 229 H ASP 29 HN ASP 29 8.327 -4.972 -14.334 230 HA ASP 29 HA ASP 29 6.156 -6.715 -13.387 231 1HB ASP 29 HB2 ASP 29 8.989 -6.248 -12.418 232 2HB ASP 29 HB1 ASP 29 7.872 -7.379 -11.653 233 H VAL 30 HN VAL 30 7.767 -3.751 -12.342 234 HA VAL 30 HA VAL 30 6.617 -3.700 -9.699 235 HB VAL 30 HB VAL 30 7.712 -1.466 -11.429 236 1HG1 VAL 30 HG11 VAL 30 6.887 -1.591 -8.524 237 2HG1 VAL 30 HG13 VAL 30 8.002 -0.368 -9.136 238 3HG1 VAL 30 HG12 VAL 30 6.353 -0.447 -9.754 239 1HG2 VAL 30 HG22 VAL 30 9.312 -3.292 -10.865 240 2HG2 VAL 30 HG21 VAL 30 9.739 -1.772 -10.079 241 3HG2 VAL 30 HG23 VAL 30 8.952 -3.051 -9.155 242 H ASP 31 HN ASP 31 5.693 -1.950 -12.706 243 HA ASP 31 HA ASP 31 3.491 -0.557 -11.607 244 1HB ASP 31 HB2 ASP 31 2.619 -0.418 -13.897 245 2HB ASP 31 HB1 ASP 31 4.366 -0.171 -13.900 246 H HIS 32 HN HIS 32 3.607 -3.817 -13.028 247 HA HIS 32 HA HIS 32 0.840 -4.419 -12.780 248 1HB HIS 32 HB2 HIS 32 2.411 -5.793 -14.079 249 2HB HIS 32 HB1 HIS 32 3.231 -6.273 -12.594 250 HD1 HIS 32 HD1 HIS 32 -0.466 -6.197 -13.605 251 HD2 HIS 32 HD2 HIS 32 2.355 -8.795 -11.969 252 HE1 HIS 32 HE1 HIS 32 -1.686 -8.362 -13.101 253 H ALA 33 HN ALA 33 3.528 -5.030 -10.506 254 HA ALA 33 HA ALA 33 1.977 -6.295 -8.488 255 1HB ALA 33 HB3 ALA 33 4.499 -4.629 -8.323 256 2HB ALA 33 HB2 ALA 33 3.818 -5.487 -6.941 257 3HB ALA 33 HB1 ALA 33 4.375 -6.388 -8.351 258 H ILE 34 HN ILE 34 2.862 -2.843 -8.850 259 HA ILE 34 HA ILE 34 1.333 -2.010 -6.540 260 HB ILE 34 HB ILE 34 2.195 -0.369 -8.943 261 1HG1 ILE 34 HG12 ILE 34 4.140 -1.454 -7.947 262 2HG1 ILE 34 HG11 ILE 34 4.146 0.250 -7.509 263 1HG2 ILE 34 HG22 ILE 34 1.351 0.366 -6.128 264 2HG2 ILE 34 HG21 ILE 34 2.116 1.496 -7.247 265 3HG2 ILE 34 HG23 ILE 34 0.543 0.802 -7.633 266 1HD1 ILE 34 HD12 ILE 34 2.893 -0.555 -5.352 267 2HD1 ILE 34 HD11 ILE 34 3.527 -2.141 -5.788 268 3HD1 ILE 34 HD13 ILE 34 4.632 -0.808 -5.474 269 H GLU 35 HN GLU 35 0.688 -1.894 -10.054 270 HA GLU 35 HA GLU 35 -1.898 -0.705 -9.863 271 1HB GLU 35 HB2 GLU 35 -0.583 -0.934 -11.977 272 2HB GLU 35 HB1 GLU 35 -0.924 -2.664 -11.962 273 1HG GLU 35 HG2 GLU 35 -3.332 -2.220 -12.072 274 2HG GLU 35 HG1 GLU 35 -3.031 -0.483 -12.010 275 H LYS 36 HN LYS 36 -0.883 -4.103 -9.819 276 HA LYS 36 HA LYS 36 -3.506 -5.231 -9.852 277 1HB LYS 36 HB2 LYS 36 -1.422 -6.520 -10.268 278 2HB LYS 36 HB1 LYS 36 -0.992 -6.341 -8.567 279 1HG LYS 36 HG2 LYS 36 -2.817 -7.675 -7.849 280 2HG LYS 36 HG1 LYS 36 -3.627 -7.550 -9.410 281 1HD LYS 36 HD2 LYS 36 -2.601 -9.765 -9.190 282 2HD LYS 36 HD1 LYS 36 -1.777 -8.848 -10.450 283 1HE LYS 36 HE2 LYS 36 0.099 -8.416 -9.074 284 2HE LYS 36 HE1 LYS 36 -0.775 -8.841 -7.602 285 1HZ LYS 36 HZ1 LYS 36 -0.972 -11.136 -8.626 286 2HZ LYS 36 HZ3 LYS 36 0.221 -10.643 -9.726 287 3HZ LYS 36 HZ2 LYS 36 0.563 -10.680 -8.062 288 H ALA 37 HN ALA 37 -1.466 -4.070 -7.184 289 HA ALA 37 HA ALA 37 -3.098 -5.056 -5.050 290 1HB ALA 37 HB2 ALA 37 -0.760 -4.106 -4.839 291 2HB ALA 37 HB1 ALA 37 -1.471 -2.502 -5.015 292 3HB ALA 37 HB3 ALA 37 -1.907 -3.513 -3.637 293 H PHE 38 HN PHE 38 -3.129 -1.893 -6.743 294 HA PHE 38 HA PHE 38 -5.225 -0.755 -5.187 295 1HB PHE 38 HB2 PHE 38 -4.266 -0.256 -8.011 296 2HB PHE 38 HB1 PHE 38 -5.679 0.588 -7.381 297 HD1 PHE 38 HD2 PHE 38 -5.310 1.558 -4.881 298 HD2 PHE 38 HD1 PHE 38 -2.197 0.822 -7.754 299 HE1 PHE 38 HE2 PHE 38 -3.840 3.170 -3.705 300 HE2 PHE 38 HE1 PHE 38 -0.731 2.441 -6.573 301 HZ PHE 38 HZ PHE 38 -1.551 3.611 -4.551 302 H GLN 39 HN GLN 39 -5.338 -2.842 -8.087 303 HA GLN 39 HA GLN 39 -8.153 -2.676 -8.514 304 1HB GLN 39 HB2 GLN 39 -6.206 -4.940 -9.022 305 2HB GLN 39 HB1 GLN 39 -7.892 -4.985 -9.533 306 1HG GLN 39 HG2 GLN 39 -7.544 -2.931 -10.859 307 2HG GLN 39 HG1 GLN 39 -5.853 -2.895 -10.356 308 1HE2 GLN 39 HE22 GLN 39 -6.463 -4.814 -13.658 309 2HE2 GLN 39 HE21 GLN 39 -7.156 -3.364 -13.112 310 H LEU 40 HN LEU 40 -6.256 -4.869 -6.423 311 HA LEU 40 HA LEU 40 -8.448 -6.453 -5.551 312 1HB LEU 40 HB2 LEU 40 -5.879 -5.690 -4.149 313 2HB LEU 40 HB1 LEU 40 -7.025 -6.853 -3.490 314 HG LEU 40 HG LEU 40 -5.723 -7.091 -6.219 315 1HD1 LEU 40 HD11 LEU 40 -4.134 -7.260 -4.271 316 2HD1 LEU 40 HD13 LEU 40 -5.081 -8.627 -3.686 317 3HD1 LEU 40 HD12 LEU 40 -4.247 -8.732 -5.237 318 1HD2 LEU 40 HD23 LEU 40 -7.694 -8.751 -4.655 319 2HD2 LEU 40 HD22 LEU 40 -7.637 -8.417 -6.386 320 3HD2 LEU 40 HD21 LEU 40 -6.525 -9.582 -5.681 321 H TRP 41 HN TRP 41 -7.178 -3.379 -4.264 322 HA TRP 41 HA TRP 41 -9.041 -3.339 -2.044 323 1HB TRP 41 HB2 TRP 41 -7.371 -1.170 -3.344 324 2HB TRP 41 HB1 TRP 41 -8.376 -0.893 -1.922 325 HD1 TRP 41 HD1 TRP 41 -4.968 -1.796 -2.807 326 HE1 TRP 41 HE1 TRP 41 -3.738 -2.899 -0.828 327 HE3 TRP 41 HE3 TRP 41 -8.936 -2.817 0.240 328 HZ2 TRP 41 HZ2 TRP 41 -4.355 -4.062 1.708 329 HZ3 TRP 41 HZ3 TRP 41 -8.586 -3.926 2.431 330 HH2 TRP 41 HH2 TRP 41 -6.302 -4.547 3.167 331 H SER 42 HN SER 42 -9.030 -1.881 -5.285 332 HA SER 42 HA SER 42 -11.505 -0.440 -4.924 333 1HB SER 42 HB2 SER 42 -9.916 0.188 -6.679 334 2HB SER 42 HB1 SER 42 -10.123 -1.384 -7.449 335 HG SER 42 HG SER 42 -12.327 -0.855 -7.740 336 H ASN 43 HN ASN 43 -10.701 -3.620 -6.258 337 HA ASN 43 HA ASN 43 -13.140 -4.339 -7.403 338 1HB ASN 43 HB2 ASN 43 -11.156 -6.023 -5.866 339 2HB ASN 43 HB1 ASN 43 -12.517 -6.704 -6.757 340 1HD2 ASN 43 HD22 ASN 43 -9.429 -6.463 -8.959 341 2HD2 ASN 43 HD21 ASN 43 -9.659 -7.099 -7.402 342 H VAL 44 HN VAL 44 -12.366 -4.171 -3.954 343 HA VAL 44 HA VAL 44 -15.068 -5.318 -3.327 344 HB VAL 44 HB VAL 44 -14.129 -5.518 -1.000 345 1HG1 VAL 44 HG13 VAL 44 -14.121 -7.370 -2.717 346 2HG1 VAL 44 HG12 VAL 44 -12.471 -6.902 -3.130 347 3HG1 VAL 44 HG11 VAL 44 -12.841 -7.500 -1.513 348 1HG2 VAL 44 HG23 VAL 44 -12.350 -3.717 -1.485 349 2HG2 VAL 44 HG22 VAL 44 -11.810 -5.142 -0.598 350 3HG2 VAL 44 HG21 VAL 44 -11.461 -4.988 -2.318 351 H THR 45 HN THR 45 -13.908 -2.340 -3.908 352 HA THR 45 HA THR 45 -15.884 -1.135 -2.072 353 HB THR 45 HB THR 45 -14.142 0.675 -1.494 354 HG1 THR 45 HG1 THR 45 -12.723 -0.878 -3.074 355 1HG2 THR 45 HG23 THR 45 -14.990 -1.017 0.114 356 2HG2 THR 45 HG22 THR 45 -13.713 -2.118 -0.406 357 3HG2 THR 45 HG21 THR 45 -13.301 -0.606 0.400 358 HA PRO 46 HA PRO 46 -16.552 1.326 -5.723 359 1HB PRO 46 HB2 PRO 46 -17.411 3.729 -4.490 360 2HB PRO 46 HB1 PRO 46 -18.447 2.365 -4.938 361 1HG PRO 46 HG2 PRO 46 -17.516 3.181 -2.249 362 2HG PRO 46 HG1 PRO 46 -18.871 2.129 -2.688 363 1HD PRO 46 HD2 PRO 46 -16.385 1.270 -1.630 364 2HD PRO 46 HD1 PRO 46 -17.615 0.237 -2.390 365 H LEU 47 HN LEU 47 -14.022 1.706 -3.729 366 HA LEU 47 HA LEU 47 -13.129 4.399 -4.326 367 1HB LEU 47 HB2 LEU 47 -11.593 1.950 -3.408 368 2HB LEU 47 HB1 LEU 47 -10.915 3.573 -3.494 369 HG LEU 47 HG LEU 47 -13.348 2.824 -1.846 370 1HD1 LEU 47 HD13 LEU 47 -10.420 3.064 -1.142 371 2HD1 LEU 47 HD12 LEU 47 -11.692 3.181 0.074 372 3HD1 LEU 47 HD11 LEU 47 -11.496 1.699 -0.861 373 1HD2 LEU 47 HD23 LEU 47 -11.779 5.362 -2.279 374 2HD2 LEU 47 HD22 LEU 47 -13.524 5.136 -2.177 375 3HD2 LEU 47 HD21 LEU 47 -12.546 5.078 -0.717 376 H THR 48 HN THR 48 -11.674 5.087 -5.899 377 HA THR 48 HA THR 48 -10.864 3.086 -7.984 378 HB THR 48 HB THR 48 -11.355 4.785 -9.711 379 HG1 THR 48 HG1 THR 48 -12.313 6.688 -9.145 380 1HG2 THR 48 HG21 THR 48 -13.679 4.206 -7.856 381 2HG2 THR 48 HG23 THR 48 -13.828 4.721 -9.537 382 3HG2 THR 48 HG22 THR 48 -13.097 3.161 -9.153 383 H PHE 49 HN PHE 49 -8.806 3.446 -8.864 384 HA PHE 49 HA PHE 49 -7.226 5.712 -7.671 385 1HB PHE 49 HB2 PHE 49 -6.343 2.871 -8.253 386 2HB PHE 49 HB1 PHE 49 -5.276 4.168 -7.716 387 HD1 PHE 49 HD2 PHE 49 -5.427 5.073 -5.446 388 HD2 PHE 49 HD1 PHE 49 -7.988 1.879 -6.748 389 HE1 PHE 49 HE2 PHE 49 -6.043 4.610 -3.091 390 HE2 PHE 49 HE1 PHE 49 -8.602 1.414 -4.390 391 HZ PHE 49 HZ PHE 49 -7.631 2.778 -2.562 392 H THR 50 HN THR 50 -6.245 6.991 -9.140 393 HA THR 50 HA THR 50 -5.889 5.968 -11.944 394 HB THR 50 HB THR 50 -6.631 8.772 -11.056 395 HG1 THR 50 HG1 THR 50 -8.282 7.118 -10.980 396 1HG2 THR 50 HG21 THR 50 -6.019 7.533 -13.743 397 2HG2 THR 50 HG23 THR 50 -6.970 9.012 -13.590 398 3HG2 THR 50 HG22 THR 50 -5.304 8.971 -13.016 399 H LYS 51 HN LYS 51 -3.827 6.092 -12.683 400 HA LYS 51 HA LYS 51 -1.739 7.227 -10.986 401 1HB LYS 51 HB2 LYS 51 -1.384 5.166 -12.347 402 2HB LYS 51 HB1 LYS 51 -1.552 6.133 -13.812 403 1HG LYS 51 HG2 LYS 51 0.387 7.503 -13.138 404 2HG LYS 51 HG1 LYS 51 0.559 6.541 -11.669 405 1HD LYS 51 HD2 LYS 51 0.871 4.506 -13.074 406 2HD LYS 51 HD1 LYS 51 0.794 5.519 -14.516 407 1HE LYS 51 HE2 LYS 51 2.747 6.810 -13.701 408 2HE LYS 51 HE1 LYS 51 2.837 5.760 -12.287 409 1HZ LYS 51 HZ3 LYS 51 2.927 4.690 -15.043 410 2HZ LYS 51 HZ2 LYS 51 4.330 5.189 -14.226 411 3HZ LYS 51 HZ1 LYS 51 3.385 3.923 -13.603 412 H VAL 52 HN VAL 52 -0.606 9.146 -11.348 413 HA VAL 52 HA VAL 52 -1.483 10.843 -13.671 414 HB VAL 52 HB VAL 52 -1.335 12.804 -12.203 415 1HG1 VAL 52 HG11 VAL 52 -3.482 11.561 -12.402 416 2HG1 VAL 52 HG13 VAL 52 -3.047 10.622 -10.974 417 3HG1 VAL 52 HG12 VAL 52 -3.315 12.360 -10.839 418 1HG2 VAL 52 HG22 VAL 52 -0.530 10.717 -10.164 419 2HG2 VAL 52 HG21 VAL 52 0.325 12.195 -10.608 420 3HG2 VAL 52 HG23 VAL 52 -1.171 12.288 -9.681 421 H SER 53 HN SER 53 0.216 11.588 -14.869 422 HA SER 53 HA SER 53 2.957 10.980 -13.925 423 1HB SER 53 HB2 SER 53 2.133 10.449 -16.269 424 2HB SER 53 HB1 SER 53 2.115 12.183 -16.571 425 HG SER 53 HG SER 53 4.406 11.980 -15.675 426 H GLU 54 HN GLU 54 0.867 13.581 -13.666 427 HA GLU 54 HA GLU 54 3.152 15.404 -13.142 428 1HB GLU 54 HB2 GLU 54 0.893 16.016 -15.070 429 2HB GLU 54 HB1 GLU 54 1.946 17.253 -14.385 430 1HG GLU 54 HG2 GLU 54 3.919 16.104 -15.341 431 2HG GLU 54 HG1 GLU 54 2.861 14.877 -16.036 432 H GLY 55 HN GLY 55 2.578 17.163 -11.725 433 1HA GLY 55 HA2 GLY 55 1.182 18.323 -10.186 434 2HA GLY 55 HA1 GLY 55 -0.158 17.267 -10.640 435 H GLN 56 HN GLN 56 0.162 17.692 -7.978 436 HA GLN 56 HA GLN 56 1.844 15.561 -6.818 437 1HB GLN 56 HB2 GLN 56 -0.149 17.442 -5.508 438 2HB GLN 56 HB1 GLN 56 0.975 16.378 -4.660 439 1HG GLN 56 HG2 GLN 56 1.864 18.506 -6.626 440 2HG GLN 56 HG1 GLN 56 1.766 18.768 -4.884 441 1HE2 GLN 56 HE22 GLN 56 5.166 17.341 -6.109 442 2HE2 GLN 56 HE21 GLN 56 4.156 18.457 -6.893 443 H ALA 57 HN ALA 57 1.053 13.621 -5.991 444 HA ALA 57 HA ALA 57 -1.808 12.990 -6.634 445 1HB ALA 57 HB3 ALA 57 0.275 11.699 -7.616 446 2HB ALA 57 HB2 ALA 57 0.266 10.889 -6.050 447 3HB ALA 57 HB1 ALA 57 -1.153 10.806 -7.098 448 H ASP 58 HN ASP 58 -3.016 11.725 -5.069 449 HA ASP 58 HA ASP 58 -2.727 12.595 -2.378 450 1HB ASP 58 HB2 ASP 58 -4.199 10.227 -3.560 451 2HB ASP 58 HB1 ASP 58 -4.330 10.706 -1.868 452 H ILE 59 HN ILE 59 -1.706 9.596 -3.988 453 HA ILE 59 HA ILE 59 -0.088 8.904 -1.546 454 HB ILE 59 HB ILE 59 -1.242 7.061 -3.663 455 1HG1 ILE 59 HG12 ILE 59 -1.955 7.288 -0.724 456 2HG1 ILE 59 HG11 ILE 59 -2.876 8.065 -2.011 457 1HG2 ILE 59 HG23 ILE 59 0.436 6.548 -1.192 458 2HG2 ILE 59 HG22 ILE 59 -0.448 5.286 -2.050 459 3HG2 ILE 59 HG21 ILE 59 0.842 6.165 -2.867 460 1HD1 ILE 59 HD11 ILE 59 -2.295 5.094 -1.973 461 2HD1 ILE 59 HD13 ILE 59 -3.754 5.793 -1.274 462 3HD1 ILE 59 HD12 ILE 59 -3.441 5.953 -3.002 463 H MET 60 HN MET 60 2.004 9.420 -1.957 464 HA MET 60 HA MET 60 3.037 9.170 -4.749 465 1HB MET 60 HB2 MET 60 4.197 10.548 -2.306 466 2HB MET 60 HB1 MET 60 4.949 10.511 -3.904 467 1HG MET 60 HG2 MET 60 2.937 11.593 -4.869 468 2HG MET 60 HG1 MET 60 2.211 11.654 -3.267 469 1HE MET 60 HE3 MET 60 4.900 12.564 -5.603 470 2HE MET 60 HE2 MET 60 5.639 14.053 -5.026 471 3HE MET 60 HE1 MET 60 6.122 12.510 -4.328 472 H ILE 61 HN ILE 61 4.483 7.615 -5.272 473 HA ILE 61 HA ILE 61 5.566 5.867 -3.081 474 HB ILE 61 HB ILE 61 4.993 5.190 -5.981 475 1HG1 ILE 61 HG12 ILE 61 3.609 4.168 -3.485 476 2HG1 ILE 61 HG11 ILE 61 2.988 5.511 -4.447 477 1HG2 ILE 61 HG23 ILE 61 6.207 3.667 -3.678 478 2HG2 ILE 61 HG22 ILE 61 5.385 2.816 -4.985 479 3HG2 ILE 61 HG21 ILE 61 6.793 3.818 -5.333 480 1HD1 ILE 61 HD12 ILE 61 3.556 2.727 -5.509 481 2HD1 ILE 61 HD11 ILE 61 1.956 3.354 -5.112 482 3HD1 ILE 61 HD13 ILE 61 2.881 4.071 -6.430 483 H SER 62 HN SER 62 7.769 5.785 -2.914 484 HA SER 62 HA SER 62 9.433 6.396 -5.293 485 1HB SER 62 HB2 SER 62 10.712 8.115 -4.133 486 2HB SER 62 HB1 SER 62 9.012 8.575 -4.147 487 HG SER 62 HG SER 62 8.839 7.997 -2.037 488 H PHE 63 HN PHE 63 11.643 5.716 -5.021 489 HA PHE 63 HA PHE 63 12.017 3.690 -2.838 490 1HB PHE 63 HB2 PHE 63 13.142 3.875 -5.652 491 2HB PHE 63 HB1 PHE 63 13.700 2.713 -4.456 492 HD1 PHE 63 HD2 PHE 63 12.261 0.905 -3.665 493 HD2 PHE 63 HD1 PHE 63 10.905 3.707 -6.624 494 HE1 PHE 63 HE2 PHE 63 10.347 -0.579 -4.191 495 HE2 PHE 63 HE1 PHE 63 8.987 2.223 -7.150 496 HZ PHE 63 HZ PHE 63 8.711 0.077 -5.935 497 H VAL 64 HN VAL 64 13.753 4.003 -1.447 498 HA VAL 64 HA VAL 64 15.855 5.986 -2.235 499 HB VAL 64 HB VAL 64 15.684 7.131 -0.106 500 1HG1 VAL 64 HG11 VAL 64 14.151 7.716 -2.066 501 2HG1 VAL 64 HG13 VAL 64 12.874 6.872 -1.190 502 3HG1 VAL 64 HG12 VAL 64 13.638 8.295 -0.481 503 1HG2 VAL 64 HG21 VAL 64 13.516 5.087 0.457 504 2HG2 VAL 64 HG23 VAL 64 15.010 5.340 1.361 505 3HG2 VAL 64 HG22 VAL 64 13.733 6.554 1.412 506 H ARG 65 HN ARG 65 17.681 5.970 -0.579 507 HA ARG 65 HA ARG 65 18.106 3.220 0.554 508 1HB ARG 65 HB2 ARG 65 20.006 4.927 -1.087 509 2HB ARG 65 HB1 ARG 65 20.510 3.500 -0.180 510 1HG ARG 65 HG2 ARG 65 18.924 2.119 -1.467 511 2HG ARG 65 HG1 ARG 65 18.424 3.547 -2.378 512 1HD ARG 65 HD2 ARG 65 20.724 3.819 -3.220 513 2HD ARG 65 HD1 ARG 65 21.236 2.404 -2.303 514 HE ARG 65 HE ARG 65 19.114 1.509 -3.881 515 1HH1 ARG 65 HH21 ARG 65 22.132 3.105 -4.360 516 2HH1 ARG 65 HH22 ARG 65 22.398 2.412 -5.925 517 1HH2 ARG 65 HH11 ARG 65 19.443 0.592 -5.912 518 2HH2 ARG 65 HH12 ARG 65 20.870 0.991 -6.809 519 H GLY 66 HN GLY 66 19.308 3.184 2.490 520 1HA GLY 66 HA2 GLY 66 19.979 4.047 4.569 521 2HA GLY 66 HA1 GLY 66 20.948 5.138 3.585 522 H ASP 67 HN ASP 67 20.663 6.924 4.947 523 HA ASP 67 HA ASP 67 18.120 7.819 5.936 524 1HB ASP 67 HB2 ASP 67 20.262 8.504 6.941 525 2HB ASP 67 HB1 ASP 67 20.677 9.381 5.469 526 H HIS 68 HN HIS 68 16.569 9.037 4.990 527 HA HIS 68 HA HIS 68 17.178 10.469 2.436 528 1HB HIS 68 HB2 HIS 68 15.050 9.625 1.496 529 2HB HIS 68 HB1 HIS 68 16.165 8.304 1.848 530 HD1 HIS 68 HD1 HIS 68 15.763 7.160 4.329 531 HD2 HIS 68 HD2 HIS 68 12.576 9.293 2.699 532 HE1 HIS 68 HE1 HIS 68 13.689 6.425 5.587 533 H ARG 69 HN ARG 69 17.094 11.999 4.594 534 HA ARG 69 HA ARG 69 15.940 13.715 5.708 535 1HB ARG 69 HB2 ARG 69 14.299 13.479 3.172 536 2HB ARG 69 HB1 ARG 69 14.063 14.748 4.370 537 1HG ARG 69 HG2 ARG 69 16.387 15.465 4.096 538 2HG ARG 69 HG1 ARG 69 16.659 14.186 2.912 539 1HD ARG 69 HD2 ARG 69 14.777 15.168 1.555 540 2HD ARG 69 HD1 ARG 69 14.750 16.534 2.663 541 HE ARG 69 HE ARG 69 16.556 16.135 0.460 542 1HH1 ARG 69 HH21 ARG 69 16.541 17.184 3.751 543 2HH1 ARG 69 HH22 ARG 69 18.074 17.977 3.626 544 1HH2 ARG 69 HH11 ARG 69 18.530 17.176 0.296 545 2HH2 ARG 69 HH12 ARG 69 19.196 17.971 1.683 546 H ASP 70 HN ASP 70 15.367 11.323 6.798 547 HA ASP 70 HA ASP 70 12.475 11.580 7.492 548 1HB ASP 70 HB2 ASP 70 12.882 9.731 5.769 549 2HB ASP 70 HB1 ASP 70 13.810 8.903 7.019 550 H ASN 71 HN ASN 71 12.018 10.787 9.637 551 HA ASN 71 HA ASN 71 14.379 10.907 11.412 552 1HB ASN 71 HB2 ASN 71 11.411 10.754 12.029 553 2HB ASN 71 HB1 ASN 71 12.690 11.000 13.220 554 1HD2 ASN 71 HD22 ASN 71 13.493 14.313 11.787 555 2HD2 ASN 71 HD21 ASN 71 14.336 12.897 12.197 556 H SER 72 HN SER 72 13.164 8.514 9.656 557 HA SER 72 HA SER 72 13.790 6.449 11.727 558 1HB SER 72 HB2 SER 72 11.308 6.672 11.430 559 2HB SER 72 HB1 SER 72 11.520 6.244 9.735 560 HG SER 72 HG SER 72 11.334 4.634 11.827 561 HA PRO 73 HA PRO 73 16.017 5.947 7.646 562 1HB PRO 73 HB2 PRO 73 18.478 5.458 9.052 563 2HB PRO 73 HB1 PRO 73 18.054 6.888 8.100 564 1HG PRO 73 HG2 PRO 73 18.267 6.672 10.993 565 2HG PRO 73 HG1 PRO 73 17.936 8.118 10.029 566 1HD PRO 73 HD2 PRO 73 16.072 6.618 11.654 567 2HD PRO 73 HD1 PRO 73 15.736 8.064 10.681 568 H PHE 74 HN PHE 74 16.895 3.887 6.857 569 HA PHE 74 HA PHE 74 15.821 1.596 8.299 570 1HB PHE 74 HB2 PHE 74 17.570 1.714 5.821 571 2HB PHE 74 HB1 PHE 74 16.701 0.292 6.402 572 HD1 PHE 74 HD1 PHE 74 14.106 0.757 6.936 573 HD2 PHE 74 HD2 PHE 74 16.514 3.003 4.174 574 HE1 PHE 74 HE1 PHE 74 12.059 1.520 5.772 575 HE2 PHE 74 HE2 PHE 74 14.462 3.765 3.010 576 HZ PHE 74 HZ PHE 74 12.236 3.025 3.807 577 H ASP 75 HN ASP 75 16.936 0.203 9.612 578 HA ASP 75 HA ASP 75 19.837 0.773 10.088 579 1HB ASP 75 HB2 ASP 75 18.247 0.952 12.019 580 2HB ASP 75 HB1 ASP 75 17.874 -0.760 11.820 581 H GLY 76 HN GLY 76 19.775 -0.620 7.875 582 1HA GLY 76 HA2 GLY 76 20.835 -2.578 7.056 583 2HA GLY 76 HA1 GLY 76 20.695 -3.307 8.657 584 HA PRO 77 HA PRO 77 17.434 -4.999 5.722 585 1HB PRO 77 HB2 PRO 77 18.275 -7.675 6.469 586 2HB PRO 77 HB1 PRO 77 18.373 -6.907 4.878 587 1HG PRO 77 HG2 PRO 77 20.558 -7.489 6.661 588 2HG PRO 77 HG1 PRO 77 20.637 -6.646 5.107 589 1HD PRO 77 HD2 PRO 77 20.882 -5.507 7.782 590 2HD PRO 77 HD1 PRO 77 21.085 -4.697 6.215 591 H GLY 78 HN GLY 78 18.046 -4.655 8.910 592 1HA GLY 78 HA2 GLY 78 15.891 -6.465 9.894 593 2HA GLY 78 HA1 GLY 78 17.006 -5.541 10.905 594 H GLY 79 HN GLY 79 14.544 -5.196 11.739 595 1HA GLY 79 HA2 GLY 79 13.026 -3.466 12.241 596 2HA GLY 79 HA1 GLY 79 13.968 -2.407 11.190 597 H ASN 80 HN ASN 80 11.731 -1.679 10.506 598 HA ASN 80 HA ASN 80 10.040 -3.499 9.012 599 1HB ASN 80 HB2 ASN 80 10.193 -0.468 9.041 600 2HB ASN 80 HB1 ASN 80 8.942 -1.389 8.206 601 1HD2 ASN 80 HD21 ASN 80 9.317 0.312 10.973 602 2HD2 ASN 80 HD22 ASN 80 8.327 -0.582 12.023 603 H LEU 81 HN LEU 81 9.825 -3.618 6.697 604 HA LEU 81 HA LEU 81 12.372 -3.131 5.277 605 1HB LEU 81 HB2 LEU 81 9.833 -4.292 4.106 606 2HB LEU 81 HB1 LEU 81 11.493 -4.541 3.565 607 HG LEU 81 HG LEU 81 10.177 -5.611 6.073 608 1HD1 LEU 81 HD11 LEU 81 9.876 -6.884 3.972 609 2HD1 LEU 81 HD13 LEU 81 11.627 -6.947 3.770 610 3HD1 LEU 81 HD12 LEU 81 10.867 -7.770 5.131 611 1HD2 LEU 81 HD22 LEU 81 13.104 -5.395 5.343 612 2HD2 LEU 81 HD21 LEU 81 12.321 -4.947 6.857 613 3HD2 LEU 81 HD23 LEU 81 12.518 -6.648 6.436 614 H ALA 82 HN ALA 82 9.436 -1.528 5.802 615 HA ALA 82 HA ALA 82 10.124 0.685 4.114 616 1HB ALA 82 HB2 ALA 82 9.395 -0.887 2.320 617 2HB ALA 82 HB1 ALA 82 7.828 -1.031 3.113 618 3HB ALA 82 HB3 ALA 82 8.339 0.517 2.443 619 H HIS 83 HN HIS 83 8.165 2.268 4.034 620 HA HIS 83 HA HIS 83 5.996 1.803 5.901 621 1HB HIS 83 HB2 HIS 83 6.653 3.451 7.598 622 2HB HIS 83 HB1 HIS 83 7.844 2.153 7.514 623 HD1 HIS 83 HD1 HIS 83 10.190 2.950 7.397 624 HD2 HIS 83 HD2 HIS 83 7.556 5.747 5.776 625 HE1 HIS 83 HE1 HIS 83 11.591 4.952 6.730 626 H ALA 84 HN ALA 84 4.817 3.965 6.311 627 HA ALA 84 HA ALA 84 5.269 5.983 4.186 628 1HB ALA 84 HB3 ALA 84 3.708 4.160 3.308 629 2HB ALA 84 HB2 ALA 84 2.552 4.688 4.532 630 3HB ALA 84 HB1 ALA 84 3.068 5.802 3.265 631 H PHE 85 HN PHE 85 3.798 7.886 4.553 632 HA PHE 85 HA PHE 85 3.628 8.440 7.451 633 1HB PHE 85 HB2 PHE 85 3.290 10.143 4.974 634 2HB PHE 85 HB1 PHE 85 3.054 10.765 6.608 635 HD1 PHE 85 HD2 PHE 85 5.498 9.492 4.170 636 HD2 PHE 85 HD1 PHE 85 4.932 11.002 8.151 637 HE1 PHE 85 HE2 PHE 85 7.942 9.820 4.390 638 HE2 PHE 85 HE1 PHE 85 7.378 11.334 8.373 639 HZ PHE 85 HZ PHE 85 8.885 10.742 6.492 640 H GLN 86 HN GLN 86 1.659 9.493 8.324 641 HA GLN 86 HA GLN 86 -0.693 7.989 7.803 642 1HB GLN 86 HB2 GLN 86 -0.243 10.628 9.215 643 2HB GLN 86 HB1 GLN 86 -1.815 9.837 9.176 644 1HG GLN 86 HG2 GLN 86 -0.936 7.888 10.307 645 2HG GLN 86 HG1 GLN 86 0.711 8.508 10.186 646 1HE2 GLN 86 HE22 GLN 86 -1.292 9.460 13.440 647 2HE2 GLN 86 HE21 GLN 86 -1.547 8.081 12.482 648 HA PRO 87 HA PRO 87 -2.392 10.006 4.224 649 1HB PRO 87 HB2 PRO 87 -5.115 10.149 5.184 650 2HB PRO 87 HB1 PRO 87 -4.421 8.947 4.087 651 1HG PRO 87 HG2 PRO 87 -5.113 8.638 6.919 652 2HG PRO 87 HG1 PRO 87 -4.641 7.388 5.757 653 1HD PRO 87 HD2 PRO 87 -3.047 8.368 7.895 654 2HD PRO 87 HD1 PRO 87 -2.492 7.347 6.553 655 H GLY 88 HN GLY 88 -1.847 12.172 4.046 656 1HA GLY 88 HA2 GLY 88 -3.610 14.180 5.073 657 2HA GLY 88 HA1 GLY 88 -2.141 14.137 6.043 658 HA PRO 89 HA PRO 89 -1.686 16.681 2.019 659 1HB PRO 89 HB2 PRO 89 -1.206 19.070 3.551 660 2HB PRO 89 HB1 PRO 89 -2.602 18.724 2.521 661 1HG PRO 89 HG2 PRO 89 -2.469 18.750 5.446 662 2HG PRO 89 HG1 PRO 89 -3.898 18.626 4.411 663 1HD PRO 89 HD2 PRO 89 -2.732 16.523 5.957 664 2HD PRO 89 HD1 PRO 89 -4.029 16.370 4.753 665 H GLY 90 HN GLY 90 0.400 18.013 1.595 666 1HA GLY 90 HA2 GLY 90 2.721 18.301 1.809 667 2HA GLY 90 HA1 GLY 90 2.564 17.845 3.503 668 H ILE 91 HN ILE 91 3.984 16.226 3.837 669 HA ILE 91 HA ILE 91 4.670 14.294 1.764 670 HB ILE 91 HB ILE 91 6.253 15.188 3.526 671 1HG1 ILE 91 HG12 ILE 91 6.043 12.175 3.725 672 2HG1 ILE 91 HG11 ILE 91 6.513 12.960 2.218 673 1HG2 ILE 91 HG23 ILE 91 4.418 14.856 5.347 674 2HG2 ILE 91 HG22 ILE 91 4.988 13.189 5.399 675 3HG2 ILE 91 HG21 ILE 91 6.094 14.509 5.773 676 1HD1 ILE 91 HD11 ILE 91 7.899 13.642 4.810 677 2HD1 ILE 91 HD13 ILE 91 8.403 12.252 3.847 678 3HD1 ILE 91 HD12 ILE 91 8.474 13.873 3.160 679 H GLY 92 HN GLY 92 2.159 14.522 4.033 680 1HA GLY 92 HA2 GLY 92 1.789 11.904 4.970 681 2HA GLY 92 HA1 GLY 92 0.461 12.996 4.588 682 H GLY 93 HN GLY 93 1.031 10.004 4.052 683 1HA GLY 93 HA2 GLY 93 0.006 8.626 2.410 684 2HA GLY 93 HA1 GLY 93 -0.129 10.024 1.345 685 H ASP 94 HN ASP 94 2.878 10.532 2.003 686 HA ASP 94 HA ASP 94 3.904 9.265 -0.356 687 1HB ASP 94 HB2 ASP 94 5.300 10.586 1.982 688 2HB ASP 94 HB1 ASP 94 6.152 9.998 0.553 689 H ALA 95 HN ALA 95 4.794 7.262 -0.634 690 HA ALA 95 HA ALA 95 5.222 5.563 1.806 691 1HB ALA 95 HB2 ALA 95 3.512 4.807 0.127 692 2HB ALA 95 HB1 ALA 95 4.810 4.676 -1.061 693 3HB ALA 95 HB3 ALA 95 4.823 3.653 0.374 694 H HIS 96 HN HIS 96 7.285 4.929 2.239 695 HA HIS 96 HA HIS 96 9.389 5.399 0.148 696 1HB HIS 96 HB2 HIS 96 9.577 5.287 3.173 697 2HB HIS 96 HB1 HIS 96 10.954 5.478 2.091 698 HD2 HIS 96 HD2 HIS 96 8.238 7.736 0.563 699 HE1 HIS 96 HE1 HIS 96 10.351 9.994 3.479 700 HE2 HIS 96 HE2 HIS 96 8.713 10.110 1.549 701 H PHE 97 HN PHE 97 10.432 3.630 -0.634 702 HA PHE 97 HA PHE 97 9.994 0.991 0.729 703 1HB PHE 97 HB2 PHE 97 10.472 1.796 -2.140 704 2HB PHE 97 HB1 PHE 97 10.757 0.141 -1.607 705 HD1 PHE 97 HD1 PHE 97 8.159 2.836 -1.647 706 HD2 PHE 97 HD2 PHE 97 8.966 -1.376 -1.402 707 HE1 PHE 97 HE1 PHE 97 5.730 2.358 -1.817 708 HE2 PHE 97 HE2 PHE 97 6.537 -1.851 -1.574 709 HZ PHE 97 HZ PHE 97 4.920 0.017 -1.781 710 H ASP 98 HN ASP 98 11.747 -0.065 1.557 711 HA ASP 98 HA ASP 98 14.334 1.214 1.641 712 1HB ASP 98 HB2 ASP 98 13.408 -0.375 3.381 713 2HB ASP 98 HB1 ASP 98 13.717 -1.693 2.248 714 H GLU 99 HN GLU 99 15.158 1.486 -0.451 715 HA GLU 99 HA GLU 99 15.178 -0.646 -2.418 716 1HB GLU 99 HB2 GLU 99 15.173 1.769 -2.987 717 2HB GLU 99 HB1 GLU 99 16.785 1.917 -2.318 718 1HG GLU 99 HG2 GLU 99 17.686 0.404 -3.987 719 2HG GLU 99 HG1 GLU 99 16.068 0.039 -4.584 720 H ASP 100 HN ASP 100 17.083 -0.132 0.348 721 HA ASP 100 HA ASP 100 19.604 -1.079 -0.762 722 1HB ASP 100 HB2 ASP 100 18.597 -0.830 2.081 723 2HB ASP 100 HB1 ASP 100 20.211 -1.409 1.679 724 H GLU 101 HN GLU 101 16.706 -2.613 0.369 725 HA GLU 101 HA GLU 101 18.034 -5.227 0.761 726 1HB GLU 101 HB2 GLU 101 15.133 -4.353 0.909 727 2HB GLU 101 HB1 GLU 101 15.683 -6.004 1.210 728 1HG GLU 101 HG2 GLU 101 17.128 -5.219 3.030 729 2HG GLU 101 HG1 GLU 101 16.643 -3.552 2.717 730 H ARG 102 HN ARG 102 17.157 -7.155 -0.494 731 HA ARG 102 HA ARG 102 16.978 -6.419 -3.367 732 1HB ARG 102 HB2 ARG 102 18.587 -8.170 -2.691 733 2HB ARG 102 HB1 ARG 102 17.264 -9.135 -2.037 734 1HG ARG 102 HG2 ARG 102 16.268 -9.363 -4.245 735 2HG ARG 102 HG1 ARG 102 17.463 -8.264 -4.937 736 1HD ARG 102 HD2 ARG 102 19.264 -9.831 -4.364 737 2HD ARG 102 HD1 ARG 102 18.102 -10.922 -3.617 738 HE ARG 102 HE ARG 102 17.176 -10.608 -6.219 739 1HH1 ARG 102 HH21 ARG 102 20.123 -11.496 -4.665 740 2HH1 ARG 102 HH22 ARG 102 20.634 -12.549 -5.942 741 1HH2 ARG 102 HH11 ARG 102 17.845 -11.958 -7.909 742 2HH2 ARG 102 HH12 ARG 102 19.348 -12.809 -7.775 743 H TRP 103 HN TRP 103 15.007 -6.178 -4.238 744 HA TRP 103 HA TRP 103 12.645 -7.440 -2.961 745 1HB TRP 103 HB2 TRP 103 12.979 -5.354 -5.131 746 2HB TRP 103 HB1 TRP 103 11.408 -6.009 -4.662 747 HD1 TRP 103 HD1 TRP 103 13.757 -3.324 -3.805 748 HE1 TRP 103 HE1 TRP 103 13.155 -2.272 -1.529 749 HE3 TRP 103 HE3 TRP 103 10.471 -6.814 -2.081 750 HZ2 TRP 103 HZ2 TRP 103 11.488 -2.847 0.736 751 HZ3 TRP 103 HZ3 TRP 103 9.392 -6.548 0.127 752 HH2 TRP 103 HH2 TRP 103 9.894 -4.573 1.541 753 H THR 104 HN THR 104 11.392 -9.010 -3.950 754 HA THR 104 HA THR 104 12.233 -9.968 -6.671 755 HB THR 104 HB THR 104 11.856 -12.275 -5.917 756 HG1 THR 104 HG1 THR 104 10.363 -12.015 -4.333 757 1HG2 THR 104 HG22 THR 104 14.097 -11.037 -5.571 758 2HG2 THR 104 HG21 THR 104 13.655 -10.995 -3.864 759 3HG2 THR 104 HG23 THR 104 13.851 -12.543 -4.686 760 H ASN 105 HN ASN 105 10.460 -11.411 -7.621 761 HA ASN 105 HA ASN 105 7.749 -10.306 -6.936 762 1HB ASN 105 HB2 ASN 105 8.803 -11.284 -9.609 763 2HB ASN 105 HB1 ASN 105 7.178 -10.673 -9.305 764 1HD2 ASN 105 HD22 ASN 105 9.879 -8.018 -10.344 765 2HD2 ASN 105 HD21 ASN 105 9.879 -9.664 -10.759 766 H ASN 106 HN ASN 106 9.118 -12.684 -5.824 767 HA ASN 106 HA ASN 106 7.011 -14.669 -6.480 768 1HB ASN 106 HB2 ASN 106 8.956 -16.417 -6.484 769 2HB ASN 106 HB1 ASN 106 8.666 -15.466 -7.942 770 1HD2 ASN 106 HD22 ASN 106 12.050 -14.487 -7.853 771 2HD2 ASN 106 HD21 ASN 106 10.803 -15.229 -8.733 772 H PHE 107 HN PHE 107 8.029 -16.773 -4.956 773 HA PHE 107 HA PHE 107 7.508 -15.765 -2.263 774 1HB PHE 107 HB2 PHE 107 7.636 -18.164 -1.623 775 2HB PHE 107 HB1 PHE 107 6.527 -17.887 -2.966 776 HD1 PHE 107 HD2 PHE 107 9.839 -19.199 -1.997 777 HD2 PHE 107 HD1 PHE 107 7.041 -18.660 -5.214 778 HE1 PHE 107 HE2 PHE 107 11.147 -20.767 -3.399 779 HE2 PHE 107 HE1 PHE 107 8.352 -20.231 -6.617 780 HZ PHE 107 HZ PHE 107 10.404 -21.287 -5.707 781 H ARG 108 HN ARG 108 10.239 -15.483 -3.907 782 HA ARG 108 HA ARG 108 12.262 -16.793 -2.404 783 1HB ARG 108 HB2 ARG 108 12.252 -14.192 -3.942 784 2HB ARG 108 HB1 ARG 108 13.708 -14.834 -3.192 785 1HG ARG 108 HG2 ARG 108 13.468 -16.916 -4.465 786 2HG ARG 108 HG1 ARG 108 12.015 -16.288 -5.236 787 1HD ARG 108 HD2 ARG 108 13.331 -14.399 -6.139 788 2HD ARG 108 HD1 ARG 108 14.785 -15.043 -5.393 789 HE ARG 108 HE ARG 108 13.607 -15.815 -7.919 790 1HH1 ARG 108 HH21 ARG 108 15.086 -17.205 -5.120 791 2HH1 ARG 108 HH22 ARG 108 15.553 -18.651 -5.949 792 1HH2 ARG 108 HH11 ARG 108 14.226 -17.663 -8.991 793 2HH2 ARG 108 HH12 ARG 108 15.069 -18.909 -8.134 794 H GLU 109 HN GLU 109 13.847 -14.538 -1.522 795 HA GLU 109 HA GLU 109 13.393 -14.471 1.183 796 1HB GLU 109 HB2 GLU 109 14.507 -12.285 -0.585 797 2HB GLU 109 HB1 GLU 109 14.578 -12.232 1.176 798 1HG GLU 109 HG2 GLU 109 15.799 -14.376 1.194 799 2HG GLU 109 HG1 GLU 109 15.734 -14.424 -0.569 800 H TYR 110 HN TYR 110 12.312 -11.764 -0.949 801 HA TYR 110 HA TYR 110 9.991 -11.387 0.917 802 1HB TYR 110 HB2 TYR 110 11.830 -9.211 -0.118 803 2HB TYR 110 HB1 TYR 110 10.337 -8.934 0.776 804 HD1 TYR 110 HD2 TYR 110 10.118 -9.860 3.127 805 HD2 TYR 110 HD1 TYR 110 13.850 -9.755 1.005 806 HE1 TYR 110 HE2 TYR 110 11.341 -10.136 5.265 807 HE2 TYR 110 HE1 TYR 110 15.077 -10.029 3.141 808 HH TYR 110 HH TYR 110 14.635 -10.937 5.413 809 H ASN 111 HN ASN 111 8.106 -10.670 -0.055 810 HA ASN 111 HA ASN 111 8.101 -10.623 -3.046 811 1HB ASN 111 HB2 ASN 111 6.564 -12.228 -1.982 812 2HB ASN 111 HB1 ASN 111 5.831 -10.922 -1.052 813 1HD2 ASN 111 HD22 ASN 111 4.914 -11.340 -5.019 814 2HD2 ASN 111 HD21 ASN 111 6.193 -12.229 -4.344 815 H LEU 112 HN LEU 112 8.184 -8.601 -3.885 816 HA LEU 112 HA LEU 112 7.843 -6.214 -2.403 817 1HB LEU 112 HB2 LEU 112 9.085 -6.318 -4.524 818 2HB LEU 112 HB1 LEU 112 7.588 -6.643 -5.394 819 HG LEU 112 HG LEU 112 6.694 -4.440 -4.646 820 1HD1 LEU 112 HD11 LEU 112 9.358 -4.363 -3.235 821 2HD1 LEU 112 HD13 LEU 112 8.604 -2.856 -3.759 822 3HD1 LEU 112 HD12 LEU 112 7.766 -3.910 -2.627 823 1HD2 LEU 112 HD21 LEU 112 8.088 -4.802 -6.775 824 2HD2 LEU 112 HD23 LEU 112 7.942 -3.142 -6.200 825 3HD2 LEU 112 HD22 LEU 112 9.420 -4.055 -5.894 826 H HIS 113 HN HIS 113 5.513 -7.845 -4.588 827 HA HIS 113 HA HIS 113 3.485 -5.872 -4.401 828 1HB HIS 113 HB2 HIS 113 3.384 -7.678 -6.050 829 2HB HIS 113 HB1 HIS 113 3.175 -8.867 -4.763 830 HD1 HIS 113 HD1 HIS 113 0.781 -9.597 -5.130 831 HD2 HIS 113 HD2 HIS 113 1.160 -5.446 -5.035 832 HE1 HIS 113 HE1 HIS 113 -1.573 -8.662 -5.125 833 H ARG 114 HN ARG 114 4.034 -8.739 -2.313 834 HA ARG 114 HA ARG 114 1.706 -8.383 -0.714 835 1HB ARG 114 HB2 ARG 114 3.078 -10.421 -0.599 836 2HB ARG 114 HB1 ARG 114 4.402 -9.495 0.112 837 1HG ARG 114 HG2 ARG 114 3.158 -9.041 2.095 838 2HG ARG 114 HG1 ARG 114 1.649 -9.583 1.359 839 1HD ARG 114 HD2 ARG 114 2.465 -11.878 1.268 840 2HD ARG 114 HD1 ARG 114 4.039 -11.370 1.889 841 HE ARG 114 HE ARG 114 2.350 -10.525 3.867 842 1HH1 ARG 114 HH21 ARG 114 2.714 -13.457 2.094 843 2HH1 ARG 114 HH22 ARG 114 2.250 -14.474 3.416 844 1HH2 ARG 114 HH11 ARG 114 1.762 -11.837 5.618 845 2HH2 ARG 114 HH12 ARG 114 1.714 -13.556 5.414 846 H VAL 115 HN VAL 115 4.958 -6.981 -0.408 847 HA VAL 115 HA VAL 115 4.373 -5.606 2.067 848 HB VAL 115 HB VAL 115 6.504 -5.189 -0.050 849 1HG1 VAL 115 HG11 VAL 115 6.002 -3.757 2.570 850 2HG1 VAL 115 HG13 VAL 115 7.600 -3.817 1.824 851 3HG1 VAL 115 HG12 VAL 115 6.258 -3.050 0.974 852 1HG2 VAL 115 HG21 VAL 115 6.443 -6.446 2.711 853 2HG2 VAL 115 HG23 VAL 115 6.800 -7.246 1.177 854 3HG2 VAL 115 HG22 VAL 115 7.931 -6.075 1.851 855 H ALA 116 HN ALA 116 4.220 -4.686 -1.367 856 HA ALA 116 HA ALA 116 3.633 -1.938 -0.982 857 1HB ALA 116 HB2 ALA 116 4.084 -3.175 -3.187 858 2HB ALA 116 HB1 ALA 116 2.382 -3.635 -3.148 859 3HB ALA 116 HB3 ALA 116 2.833 -1.932 -3.224 860 H ALA 117 HN ALA 117 1.445 -4.760 -1.142 861 HA ALA 117 HA ALA 117 -0.988 -3.307 -0.827 862 1HB ALA 117 HB1 ALA 117 -0.794 -5.754 -1.419 863 2HB ALA 117 HB3 ALA 117 -0.377 -6.073 0.264 864 3HB ALA 117 HB2 ALA 117 -1.964 -5.422 -0.141 865 H HIS 118 HN HIS 118 1.316 -4.604 1.529 866 HA HIS 118 HA HIS 118 -0.172 -4.010 3.882 867 1HB HIS 118 HB2 HIS 118 1.847 -5.441 3.863 868 2HB HIS 118 HB1 HIS 118 2.837 -4.029 3.495 869 HD1 HIS 118 HD1 HIS 118 0.904 -5.654 6.267 870 HD2 HIS 118 HD2 HIS 118 3.184 -2.210 5.681 871 HE1 HIS 118 HE1 HIS 118 1.327 -4.676 8.562 872 H GLU 119 HN GLU 119 2.236 -2.061 2.087 873 HA GLU 119 HA GLU 119 2.194 0.186 3.854 874 1HB GLU 119 HB2 GLU 119 2.708 0.039 0.866 875 2HB GLU 119 HB1 GLU 119 2.981 1.481 1.843 876 1HG GLU 119 HG2 GLU 119 4.572 0.236 3.252 877 2HG GLU 119 HG1 GLU 119 4.300 -1.213 2.282 878 H LEU 120 HN LEU 120 0.212 -0.670 1.042 879 HA LEU 120 HA LEU 120 -1.279 1.764 0.922 880 1HB LEU 120 HB2 LEU 120 -1.976 -1.061 0.072 881 2HB LEU 120 HB1 LEU 120 -2.998 0.333 -0.272 882 HG LEU 120 HG LEU 120 -0.092 0.090 -1.109 883 1HD1 LEU 120 HD12 LEU 120 -2.674 -0.544 -2.538 884 2HD1 LEU 120 HD11 LEU 120 -1.230 -0.081 -3.437 885 3HD1 LEU 120 HD13 LEU 120 -1.210 -1.519 -2.418 886 1HD2 LEU 120 HD23 LEU 120 -2.200 2.216 -1.383 887 2HD2 LEU 120 HD22 LEU 120 -0.461 2.381 -1.147 888 3HD2 LEU 120 HD21 LEU 120 -1.095 1.979 -2.738 889 H GLY 121 HN GLY 121 -1.749 -1.218 2.779 890 1HA GLY 121 HA2 GLY 121 -4.347 -0.649 3.782 891 2HA GLY 121 HA1 GLY 121 -3.143 -1.634 4.618 892 H HIS 122 HN HIS 122 -1.131 0.342 4.912 893 HA HIS 122 HA HIS 122 -2.028 1.669 7.297 894 1HB HIS 122 HB2 HIS 122 0.434 1.933 5.564 895 2HB HIS 122 HB1 HIS 122 0.184 2.988 6.954 896 HD1 HIS 122 HD1 HIS 122 -0.348 1.598 9.287 897 HD2 HIS 122 HD2 HIS 122 1.598 -0.489 6.250 898 HE1 HIS 122 HE1 HIS 122 0.713 -0.421 10.377 899 H SER 123 HN SER 123 -1.593 2.783 3.946 900 HA SER 123 HA SER 123 -2.180 5.550 4.491 901 1HB SER 123 HB2 SER 123 -2.451 5.776 2.091 902 2HB SER 123 HB1 SER 123 -1.092 4.697 2.389 903 HG SER 123 HG SER 123 -2.476 3.811 0.836 904 H LEU 124 HN LEU 124 -4.150 2.713 4.066 905 HA LEU 124 HA LEU 124 -6.624 4.263 3.662 906 1HB LEU 124 HB2 LEU 124 -6.102 1.306 4.082 907 2HB LEU 124 HB1 LEU 124 -7.693 1.994 3.762 908 HG LEU 124 HG LEU 124 -5.299 2.373 1.940 909 1HD1 LEU 124 HD13 LEU 124 -7.573 0.376 1.750 910 2HD1 LEU 124 HD12 LEU 124 -6.374 0.674 0.490 911 3HD1 LEU 124 HD11 LEU 124 -5.875 -0.002 2.041 912 1HD2 LEU 124 HD22 LEU 124 -8.218 3.126 1.827 913 2HD2 LEU 124 HD21 LEU 124 -6.805 4.070 1.362 914 3HD2 LEU 124 HD23 LEU 124 -7.374 2.766 0.323 915 H GLY 125 HN GLY 125 -4.675 3.662 6.248 916 1HA GLY 125 HA2 GLY 125 -5.116 4.245 8.511 917 2HA GLY 125 HA1 GLY 125 -6.838 4.289 8.142 918 H LEU 126 HN LEU 126 -5.485 1.421 6.959 919 HA LEU 126 HA LEU 126 -6.883 -0.127 8.995 920 1HB LEU 126 HB2 LEU 126 -4.982 -1.057 6.818 921 2HB LEU 126 HB1 LEU 126 -6.067 -2.085 7.752 922 HG LEU 126 HG LEU 126 -6.943 0.175 5.929 923 1HD1 LEU 126 HD13 LEU 126 -5.976 -1.948 4.862 924 2HD1 LEU 126 HD12 LEU 126 -7.367 -2.793 5.542 925 3HD1 LEU 126 HD11 LEU 126 -7.609 -1.499 4.369 926 1HD2 LEU 126 HD21 LEU 126 -8.401 -1.715 7.770 927 2HD2 LEU 126 HD23 LEU 126 -8.657 0.011 7.521 928 3HD2 LEU 126 HD22 LEU 126 -9.199 -1.142 6.305 929 H SER 127 HN SER 127 -5.897 -1.503 10.565 930 HA SER 127 HA SER 127 -3.051 -0.801 11.225 931 1HB SER 127 HB2 SER 127 -5.420 -1.529 12.945 932 2HB SER 127 HB1 SER 127 -3.769 -1.593 13.557 933 HG SER 127 HG SER 127 -3.942 0.682 12.333 934 H HIS 128 HN HIS 128 -1.970 -2.614 12.544 935 HA HIS 128 HA HIS 128 -1.833 -4.985 10.947 936 1HB HIS 128 HB2 HIS 128 -0.891 -4.498 13.788 937 2HB HIS 128 HB1 HIS 128 -0.438 -5.885 12.801 938 HD1 HIS 128 HD1 HIS 128 1.717 -3.893 13.786 939 HD2 HIS 128 HD2 HIS 128 -0.170 -3.607 10.080 940 HE1 HIS 128 HE1 HIS 128 3.263 -2.551 12.294 941 H SER 129 HN SER 129 -2.223 -7.245 11.921 942 HA SER 129 HA SER 129 -4.503 -7.338 13.824 943 1HB SER 129 HB2 SER 129 -5.606 -7.156 11.658 944 2HB SER 129 HB1 SER 129 -4.609 -8.450 11.001 945 HG SER 129 HG SER 129 -5.762 -9.887 12.070 946 H THR 130 HN THR 130 -4.966 -9.601 14.495 947 HA THR 130 HA THR 130 -2.437 -11.142 14.669 948 HB THR 130 HB THR 130 -3.468 -12.285 16.519 949 HG1 THR 130 HG1 THR 130 -5.869 -10.930 16.317 950 1HG2 THR 130 HG22 THR 130 -2.697 -9.957 16.931 951 2HG2 THR 130 HG21 THR 130 -4.325 -9.378 16.580 952 3HG2 THR 130 HG23 THR 130 -4.038 -10.408 17.984 953 H ASP 131 HN ASP 131 -4.895 -11.078 12.516 954 HA ASP 131 HA ASP 131 -5.444 -13.963 12.365 955 1HB ASP 131 HB2 ASP 131 -7.102 -12.185 11.670 956 2HB ASP 131 HB1 ASP 131 -6.045 -11.821 10.310 957 H ILE 132 HN ILE 132 -4.019 -15.338 11.456 958 HA ILE 132 HA ILE 132 -1.613 -14.544 10.182 959 HB ILE 132 HB ILE 132 -3.117 -17.173 10.111 960 1HG1 ILE 132 HG12 ILE 132 -0.644 -16.351 11.661 961 2HG1 ILE 132 HG11 ILE 132 -2.276 -16.259 12.323 962 1HG2 ILE 132 HG21 ILE 132 -0.363 -16.411 9.106 963 2HG2 ILE 132 HG23 ILE 132 -0.803 -18.074 9.496 964 3HG2 ILE 132 HG22 ILE 132 -1.657 -17.214 8.218 965 1HD1 ILE 132 HD11 ILE 132 -1.052 -18.796 11.204 966 2HD1 ILE 132 HD13 ILE 132 -1.057 -18.379 12.918 967 3HD1 ILE 132 HD12 ILE 132 -2.581 -18.648 12.071 968 H GLY 133 HN GLY 133 -4.724 -15.547 8.747 969 1HA GLY 133 HA2 GLY 133 -3.713 -15.504 6.045 970 2HA GLY 133 HA1 GLY 133 -5.415 -15.514 6.501 971 H ALA 134 HN ALA 134 -3.881 -12.953 8.074 972 HA ALA 134 HA ALA 134 -5.040 -11.042 6.100 973 1HB ALA 134 HB3 ALA 134 -4.077 -10.689 8.948 974 2HB ALA 134 HB2 ALA 134 -4.603 -9.355 7.926 975 3HB ALA 134 HB1 ALA 134 -5.738 -10.629 8.359 976 H LEU 135 HN LEU 135 -3.794 -9.659 4.923 977 HA LEU 135 HA LEU 135 -0.962 -10.166 4.663 978 1HB LEU 135 HB2 LEU 135 -2.653 -7.864 3.629 979 2HB LEU 135 HB1 LEU 135 -1.019 -8.246 3.090 980 HG LEU 135 HG LEU 135 -3.421 -10.088 2.846 981 1HD1 LEU 135 HD13 LEU 135 -1.948 -8.359 0.842 982 2HD1 LEU 135 HD12 LEU 135 -3.077 -9.635 0.385 983 3HD1 LEU 135 HD11 LEU 135 -3.643 -8.242 1.307 984 1HD2 LEU 135 HD23 LEU 135 -0.489 -10.372 2.184 985 2HD2 LEU 135 HD22 LEU 135 -1.575 -11.542 2.935 986 3HD2 LEU 135 HD21 LEU 135 -1.689 -11.221 1.209 987 H MET 136 HN MET 136 -2.890 -7.810 6.433 988 HA MET 136 HA MET 136 -0.691 -6.021 7.026 989 1HB MET 136 HB2 MET 136 -3.267 -6.395 8.584 990 2HB MET 136 HB1 MET 136 -2.199 -4.993 8.633 991 1HG MET 136 HG2 MET 136 -3.707 -5.961 6.188 992 2HG MET 136 HG1 MET 136 -4.152 -4.574 7.177 993 1HE MET 136 HE3 MET 136 -2.852 -2.747 7.713 994 2HE MET 136 HE2 MET 136 -1.116 -3.040 7.708 995 3HE MET 136 HE1 MET 136 -1.809 -1.878 6.581 996 H TYR 137 HN TYR 137 -0.516 -9.048 7.724 997 HA TYR 137 HA TYR 137 -0.454 -9.323 10.545 998 1HB TYR 137 HB2 TYR 137 -0.183 -11.112 8.674 999 2HB TYR 137 HB1 TYR 137 1.530 -10.702 8.728 1000 HD1 TYR 137 HD2 TYR 137 -1.309 -12.106 10.633 1001 HD2 TYR 137 HD1 TYR 137 2.907 -11.289 10.646 1002 HE1 TYR 137 HE2 TYR 137 -1.035 -13.549 12.631 1003 HE2 TYR 137 HE1 TYR 137 3.179 -12.725 12.645 1004 HH TYR 137 HH TYR 137 0.428 -14.521 14.010 1005 HA PRO 138 HA PRO 138 2.882 -6.539 11.581 1006 1HB PRO 138 HB2 PRO 138 3.912 -8.228 13.715 1007 2HB PRO 138 HB1 PRO 138 2.974 -6.734 13.855 1008 1HG PRO 138 HG2 PRO 138 2.061 -9.453 14.300 1009 2HG PRO 138 HG1 PRO 138 1.142 -7.955 14.493 1010 1HD PRO 138 HD2 PRO 138 0.807 -9.915 12.434 1011 2HD PRO 138 HD1 PRO 138 0.005 -8.337 12.548 1012 H SER 139 HN SER 139 3.984 -9.932 12.056 1013 HA SER 139 HA SER 139 6.614 -9.265 10.967 1014 1HB SER 139 HB2 SER 139 7.160 -11.588 11.422 1015 2HB SER 139 HB1 SER 139 6.258 -10.942 12.790 1016 HG SER 139 HG SER 139 5.578 -12.880 10.948 1017 H TYR 140 HN TYR 140 7.549 -10.278 9.078 1018 HA TYR 140 HA TYR 140 5.622 -10.532 6.866 1019 1HB TYR 140 HB2 TYR 140 7.712 -9.261 6.532 1020 2HB TYR 140 HB1 TYR 140 8.654 -10.707 6.900 1021 HD1 TYR 140 HD1 TYR 140 8.695 -12.614 5.365 1022 HD2 TYR 140 HD2 TYR 140 6.525 -9.034 4.407 1023 HE1 TYR 140 HE1 TYR 140 8.528 -13.347 3.002 1024 HE2 TYR 140 HE2 TYR 140 6.356 -9.767 2.040 1025 HH TYR 140 HH TYR 140 8.093 -12.562 0.852 1026 H THR 141 HN THR 141 4.918 -12.477 6.088 1027 HA THR 141 HA THR 141 6.601 -14.878 6.328 1028 HB THR 141 HB THR 141 4.720 -16.149 7.460 1029 HG1 THR 141 HG1 THR 141 2.964 -14.985 7.463 1030 1HG2 THR 141 HG23 THR 141 6.799 -15.219 8.628 1031 2HG2 THR 141 HG22 THR 141 5.770 -13.898 9.184 1032 3HG2 THR 141 HG21 THR 141 5.411 -15.556 9.661 1033 H PHE 142 HN PHE 142 6.239 -16.156 4.564 1034 HA PHE 142 HA PHE 142 4.163 -15.362 2.650 1035 1HB PHE 142 HB2 PHE 142 6.429 -16.065 1.902 1036 2HB PHE 142 HB1 PHE 142 6.136 -17.669 2.568 1037 HD1 PHE 142 HD1 PHE 142 4.539 -19.205 1.515 1038 HD2 PHE 142 HD2 PHE 142 5.280 -15.297 -0.108 1039 HE1 PHE 142 HE1 PHE 142 3.432 -19.873 -0.602 1040 HE2 PHE 142 HE2 PHE 142 4.169 -15.966 -2.223 1041 HZ PHE 142 HZ PHE 142 3.246 -18.254 -2.470 1042 H SER 143 HN SER 143 2.142 -16.256 2.600 1043 HA SER 143 HA SER 143 1.712 -18.888 3.992 1044 1HB SER 143 HB2 SER 143 -0.025 -16.416 3.875 1045 2HB SER 143 HB1 SER 143 -0.646 -17.991 4.362 1046 HG SER 143 HG SER 143 0.725 -17.991 6.088 1047 H GLY 144 HN GLY 144 1.788 -17.448 1.001 1048 1HA GLY 144 HA2 GLY 144 1.118 -19.321 -0.717 1049 2HA GLY 144 HA1 GLY 144 -0.502 -19.040 -0.080 1050 H ASP 145 HN ASP 145 -1.544 -18.018 -1.713 1051 HA ASP 145 HA ASP 145 -0.221 -16.067 -3.428 1052 1HB ASP 145 HB2 ASP 145 -2.165 -17.655 -4.037 1053 2HB ASP 145 HB1 ASP 145 -3.204 -16.500 -3.205 1054 H VAL 146 HN VAL 146 -1.243 -13.827 -3.691 1055 HA VAL 146 HA VAL 146 -1.570 -12.622 -0.989 1056 HB VAL 146 HB VAL 146 -1.128 -11.347 -3.709 1057 1HG1 VAL 146 HG12 VAL 146 -1.182 -10.194 -0.904 1058 2HG1 VAL 146 HG11 VAL 146 -0.576 -9.328 -2.316 1059 3HG1 VAL 146 HG13 VAL 146 -2.273 -9.797 -2.232 1060 1HG2 VAL 146 HG23 VAL 146 0.741 -12.768 -2.720 1061 2HG2 VAL 146 HG22 VAL 146 1.159 -11.084 -3.026 1062 3HG2 VAL 146 HG21 VAL 146 0.795 -11.615 -1.386 1063 H GLN 147 HN GLN 147 -3.686 -12.610 -0.346 1064 HA GLN 147 HA GLN 147 -5.695 -11.391 -2.191 1065 1HB GLN 147 HB2 GLN 147 -6.019 -13.993 -0.659 1066 2HB GLN 147 HB1 GLN 147 -7.359 -13.113 -1.393 1067 1HG GLN 147 HG2 GLN 147 -6.356 -13.332 -3.603 1068 2HG GLN 147 HG1 GLN 147 -4.925 -14.094 -2.911 1069 1HE2 GLN 147 HE21 GLN 147 -6.461 -15.469 -4.865 1070 2HE2 GLN 147 HE22 GLN 147 -7.231 -16.789 -4.126 1071 H LEU 148 HN LEU 148 -7.541 -10.471 -0.984 1072 HA LEU 148 HA LEU 148 -6.677 -9.319 1.550 1073 1HB LEU 148 HB2 LEU 148 -9.377 -9.189 0.170 1074 2HB LEU 148 HB1 LEU 148 -8.865 -8.180 1.518 1075 HG LEU 148 HG LEU 148 -7.466 -8.282 -1.172 1076 1HD1 LEU 148 HD12 LEU 148 -9.823 -7.280 -1.112 1077 2HD1 LEU 148 HD11 LEU 148 -9.152 -6.031 -0.064 1078 3HD1 LEU 148 HD13 LEU 148 -8.542 -6.224 -1.706 1079 1HD2 LEU 148 HD22 LEU 148 -7.005 -6.780 1.402 1080 2HD2 LEU 148 HD21 LEU 148 -5.829 -7.540 0.330 1081 3HD2 LEU 148 HD23 LEU 148 -6.579 -6.014 -0.127 1082 H ALA 149 HN ALA 149 -7.883 -9.552 3.577 1083 HA ALA 149 HA ALA 149 -8.999 -12.313 3.901 1084 1HB ALA 149 HB1 ALA 149 -7.627 -10.373 5.763 1085 2HB ALA 149 HB3 ALA 149 -8.590 -11.709 6.397 1086 3HB ALA 149 HB2 ALA 149 -7.183 -12.036 5.388 1087 H GLN 150 HN GLN 150 -11.012 -12.562 5.037 1088 HA GLN 150 HA GLN 150 -13.011 -10.653 4.498 1089 1HB GLN 150 HB2 GLN 150 -13.453 -13.031 5.122 1090 2HB GLN 150 HB1 GLN 150 -12.984 -12.659 6.780 1091 1HG GLN 150 HG2 GLN 150 -15.417 -12.577 6.591 1092 2HG GLN 150 HG1 GLN 150 -14.804 -10.949 6.873 1093 1HE2 GLN 150 HE22 GLN 150 -16.569 -9.845 4.029 1094 2HE2 GLN 150 HE21 GLN 150 -16.199 -9.613 5.670 1095 H ASP 151 HN ASP 151 -10.905 -11.036 7.312 1096 HA ASP 151 HA ASP 151 -12.168 -9.155 9.030 1097 1HB ASP 151 HB2 ASP 151 -10.311 -10.631 9.759 1098 2HB ASP 151 HB1 ASP 151 -9.202 -9.733 8.722 1099 H ASP 152 HN ASP 152 -9.813 -8.754 6.398 1100 HA ASP 152 HA ASP 152 -9.573 -5.880 6.754 1101 1HB ASP 152 HB2 ASP 152 -8.883 -7.746 4.468 1102 2HB ASP 152 HB1 ASP 152 -8.553 -6.013 4.429 1103 H ILE 153 HN ILE 153 -11.518 -8.014 4.652 1104 HA ILE 153 HA ILE 153 -12.717 -5.958 3.072 1105 HB ILE 153 HB ILE 153 -13.940 -8.571 4.020 1106 1HG1 ILE 153 HG12 ILE 153 -11.901 -9.082 2.847 1107 2HG1 ILE 153 HG11 ILE 153 -13.227 -9.387 1.735 1108 1HG2 ILE 153 HG22 ILE 153 -14.684 -6.601 1.857 1109 2HG2 ILE 153 HG21 ILE 153 -15.234 -8.276 1.819 1110 3HG2 ILE 153 HG23 ILE 153 -15.691 -7.227 3.161 1111 1HD1 ILE 153 HD12 ILE 153 -12.810 -6.927 0.955 1112 2HD1 ILE 153 HD11 ILE 153 -11.236 -7.133 1.728 1113 3HD1 ILE 153 HD13 ILE 153 -11.716 -8.197 0.408 1114 H ASP 154 HN ASP 154 -13.851 -7.496 6.091 1115 HA ASP 154 HA ASP 154 -16.184 -5.896 6.393 1116 1HB ASP 154 HB2 ASP 154 -14.407 -7.263 8.432 1117 2HB ASP 154 HB1 ASP 154 -15.924 -6.468 8.856 1118 H GLY 155 HN GLY 155 -12.840 -5.366 7.445 1119 1HA GLY 155 HA2 GLY 155 -13.360 -2.998 8.972 1120 2HA GLY 155 HA1 GLY 155 -11.788 -3.481 8.348 1121 H ILE 156 HN ILE 156 -12.112 -3.339 5.610 1122 HA ILE 156 HA ILE 156 -12.038 -0.494 5.191 1123 HB ILE 156 HB ILE 156 -10.796 -2.275 3.841 1124 1HG1 ILE 156 HG12 ILE 156 -11.106 -0.972 1.681 1125 2HG1 ILE 156 HG11 ILE 156 -12.407 -0.095 2.482 1126 1HG2 ILE 156 HG21 ILE 156 -12.937 -3.614 3.456 1127 2HG2 ILE 156 HG23 ILE 156 -13.374 -2.393 2.263 1128 3HG2 ILE 156 HG22 ILE 156 -11.919 -3.366 2.042 1129 1HD1 ILE 156 HD13 ILE 156 -9.779 -0.220 3.911 1130 2HD1 ILE 156 HD12 ILE 156 -9.882 0.807 2.485 1131 3HD1 ILE 156 HD11 ILE 156 -10.969 1.079 3.843 1132 H GLN 157 HN GLN 157 -14.479 -2.964 4.495 1133 HA GLN 157 HA GLN 157 -16.264 -1.227 3.065 1134 1HB GLN 157 HB2 GLN 157 -16.740 -3.769 4.648 1135 2HB GLN 157 HB1 GLN 157 -17.995 -2.956 3.709 1136 1HG GLN 157 HG2 GLN 157 -16.668 -3.198 1.664 1137 2HG GLN 157 HG1 GLN 157 -15.362 -3.949 2.583 1138 1HE2 GLN 157 HE22 GLN 157 -17.572 -6.617 1.098 1139 2HE2 GLN 157 HE21 GLN 157 -16.738 -5.297 0.434 1140 H ALA 158 HN ALA 158 -15.908 -2.043 6.499 1141 HA ALA 158 HA ALA 158 -18.256 -0.757 7.451 1142 1HB ALA 158 HB3 ALA 158 -15.551 -1.206 8.732 1143 2HB ALA 158 HB2 ALA 158 -16.924 -0.530 9.607 1144 3HB ALA 158 HB1 ALA 158 -17.015 -2.164 8.951 1145 H ILE 159 HN ILE 159 -14.994 0.548 6.802 1146 HA ILE 159 HA ILE 159 -15.565 3.176 7.841 1147 HB ILE 159 HB ILE 159 -13.601 2.328 5.689 1148 1HG1 ILE 159 HG12 ILE 159 -13.121 2.853 8.637 1149 2HG1 ILE 159 HG11 ILE 159 -13.381 1.242 7.971 1150 1HG2 ILE 159 HG23 ILE 159 -13.941 4.877 7.289 1151 2HG2 ILE 159 HG22 ILE 159 -12.431 4.459 6.482 1152 3HG2 ILE 159 HG21 ILE 159 -13.898 4.698 5.535 1153 1HD1 ILE 159 HD12 ILE 159 -11.267 3.026 6.776 1154 2HD1 ILE 159 HD11 ILE 159 -10.929 2.123 8.253 1155 3HD1 ILE 159 HD13 ILE 159 -11.370 1.265 6.777 1156 H TYR 160 HN TYR 160 -15.590 1.890 4.500 1157 HA TYR 160 HA TYR 160 -17.037 4.343 3.612 1158 1HB TYR 160 HB2 TYR 160 -15.620 2.100 2.159 1159 2HB TYR 160 HB1 TYR 160 -16.655 3.251 1.312 1160 HD1 TYR 160 HD1 TYR 160 -13.512 2.821 3.193 1161 HD2 TYR 160 HD2 TYR 160 -16.049 5.604 1.125 1162 HE1 TYR 160 HE1 TYR 160 -11.670 4.482 3.166 1163 HE2 TYR 160 HE2 TYR 160 -14.207 7.265 1.099 1164 HH TYR 160 HH TYR 160 -12.032 7.599 1.499 1165 H GLY 161 HN GLY 161 -17.296 0.858 2.842 1166 1HA GLY 161 HA2 GLY 161 -19.764 0.188 3.773 1167 2HA GLY 161 HA1 GLY 161 -20.181 1.170 2.368 1168 H ARG 162 HN ARG 162 -21.123 -1.066 1.796 1169 HA ARG 162 HA ARG 162 -19.083 -2.942 0.714 1170 1HB ARG 162 HB2 ARG 162 -22.081 -3.132 1.098 1171 2HB ARG 162 HB1 ARG 162 -21.123 -4.382 0.299 1172 1HG ARG 162 HG2 ARG 162 -19.738 -4.630 2.314 1173 2HG ARG 162 HG1 ARG 162 -20.659 -3.358 3.115 1174 1HD ARG 162 HD2 ARG 162 -22.716 -4.722 2.891 1175 2HD ARG 162 HD1 ARG 162 -21.762 -6.011 2.150 1176 HE ARG 162 HE ARG 162 -20.451 -5.584 4.522 1177 1HH1 ARG 162 HH21 ARG 162 -23.741 -6.073 3.613 1178 2HH1 ARG 162 HH22 ARG 162 -24.158 -6.908 5.072 1179 1HH2 ARG 162 HH11 ARG 162 -20.981 -6.659 6.435 1180 2HH2 ARG 162 HH12 ARG 162 -22.596 -7.241 6.669 1181 H SER 163 HN SER 163 -18.835 -3.282 -1.489 1182 HA SER 163 HA SER 163 -19.866 -1.210 -3.251 1183 1HB SER 163 HB2 SER 163 -18.218 -3.704 -3.702 1184 2HB SER 163 HB1 SER 163 -18.748 -2.682 -5.034 1185 HG SER 163 HG SER 163 -17.226 -1.341 -4.516 1186 H GLN 164 HN GLN 164 -22.164 -1.529 -3.105 1187 HA GLN 164 HA GLN 164 -23.383 -4.085 -3.748 1188 1HB GLN 164 HB2 GLN 164 -24.468 -1.261 -3.597 1189 2HB GLN 164 HB1 GLN 164 -25.479 -2.651 -3.992 1190 1HG GLN 164 HG2 GLN 164 -25.026 -3.682 -1.865 1191 2HG GLN 164 HG1 GLN 164 -23.786 -2.485 -1.487 1192 1HE2 GLN 164 HE22 GLN 164 -27.053 -1.518 0.154 1193 2HE2 GLN 164 HE21 GLN 164 -26.110 -2.929 0.194 1194 H ASN 165 HN ASN 165 -23.031 -4.882 -5.781 1195 HA ASN 165 HA ASN 165 -24.073 -3.395 -8.054 1196 1HB ASN 165 HB2 ASN 165 -21.203 -4.238 -8.377 1197 2HB ASN 165 HB1 ASN 165 -22.140 -3.110 -9.339 1198 1HD2 ASN 165 HD22 ASN 165 -20.329 -1.822 -5.917 1199 2HD2 ASN 165 HD21 ASN 165 -20.430 -3.483 -6.251 1200 HA PRO 166 HA PRO 166 -22.851 -7.831 -9.400 1201 1HB PRO 166 HB2 PRO 166 -22.592 -9.537 -7.069 1202 2HB PRO 166 HB1 PRO 166 -21.354 -9.148 -8.270 1203 1HG PRO 166 HG2 PRO 166 -21.415 -8.260 -5.559 1204 2HG PRO 166 HG1 PRO 166 -20.306 -7.710 -6.826 1205 1HD PRO 166 HD2 PRO 166 -22.650 -6.333 -5.690 1206 2HD PRO 166 HD1 PRO 166 -21.325 -5.650 -6.649 1207 H VAL 167 HN VAL 167 -25.164 -7.087 -9.599 1208 HA VAL 167 HA VAL 167 -27.087 -8.432 -7.784 1209 HB VAL 167 HB VAL 167 -27.530 -6.564 -10.136 1210 1HG1 VAL 167 HG11 VAL 167 -29.398 -7.667 -8.017 1211 2HG1 VAL 167 HG13 VAL 167 -29.815 -6.360 -9.123 1212 3HG1 VAL 167 HG12 VAL 167 -29.474 -7.971 -9.752 1213 1HG2 VAL 167 HG23 VAL 167 -26.317 -5.649 -8.084 1214 2HG2 VAL 167 HG22 VAL 167 -27.821 -4.829 -8.505 1215 3HG2 VAL 167 HG21 VAL 167 -27.789 -5.986 -7.174 1216 H GLN 168 HN GLN 168 -27.530 -10.513 -8.288 1217 HA GLN 168 HA GLN 168 -27.525 -11.354 -11.156 1218 1HB GLN 168 HB2 GLN 168 -27.517 -13.179 -8.753 1219 2HB GLN 168 HB1 GLN 168 -27.070 -13.559 -10.415 1220 1HG GLN 168 HG2 GLN 168 -25.588 -11.636 -8.594 1221 2HG GLN 168 HG1 GLN 168 -25.063 -13.266 -9.009 1222 1HE2 GLN 168 HE22 GLN 168 -23.997 -12.383 -12.297 1223 2HE2 GLN 168 HE21 GLN 168 -24.425 -13.673 -11.280 1224 HA PRO 169 HA PRO 169 -31.672 -12.981 -9.310 1225 1HB PRO 169 HB2 PRO 169 -32.699 -10.948 -7.512 1226 2HB PRO 169 HB1 PRO 169 -32.324 -12.637 -7.137 1227 1HG PRO 169 HG2 PRO 169 -30.875 -10.339 -6.253 1228 2HG PRO 169 HG1 PRO 169 -30.394 -12.031 -6.054 1229 1HD PRO 169 HD2 PRO 169 -29.329 -10.019 -7.914 1230 2HD PRO 169 HD1 PRO 169 -28.647 -11.603 -7.482 No H/Q in entry = 1230 Start of MODEL 20 1 1H VAL 1 HT1 VAL 1 -7.949 14.335 14.616 2 2H VAL 1 HT3 VAL 1 -6.660 15.154 13.880 3 3H VAL 1 HT2 VAL 1 -6.380 14.193 15.253 4 HA VAL 1 HA VAL 1 -7.216 15.719 16.698 5 HB VAL 1 HB VAL 1 -6.360 17.393 14.315 6 1HG1 VAL 1 HG13 VAL 1 -6.675 18.008 17.261 7 2HG1 VAL 1 HG12 VAL 1 -5.719 19.014 16.171 8 3HG1 VAL 1 HG11 VAL 1 -7.452 18.820 15.902 9 1HG2 VAL 1 HG23 VAL 1 -4.684 15.709 15.027 10 2HG2 VAL 1 HG22 VAL 1 -4.145 17.346 15.400 11 3HG2 VAL 1 HG21 VAL 1 -4.788 16.317 16.680 12 H LEU 2 HN LEU 2 -8.185 17.316 13.651 13 HA LEU 2 HA LEU 2 -10.558 18.443 14.744 14 1HB LEU 2 HB2 LEU 2 -9.898 17.736 11.871 15 2HB LEU 2 HB1 LEU 2 -11.230 18.777 12.365 16 HG LEU 2 HG LEU 2 -8.323 19.303 13.045 17 1HD1 LEU 2 HD13 LEU 2 -10.065 20.362 10.805 18 2HD1 LEU 2 HD12 LEU 2 -8.553 21.122 11.300 19 3HD1 LEU 2 HD11 LEU 2 -8.545 19.481 10.655 20 1HD2 LEU 2 HD22 LEU 2 -10.921 20.754 13.529 21 2HD2 LEU 2 HD21 LEU 2 -9.551 20.522 14.614 22 3HD2 LEU 2 HD23 LEU 2 -9.446 21.693 13.303 23 H THR 3 HN THR 3 -10.095 15.479 12.822 24 HA THR 3 HA THR 3 -12.918 14.694 13.370 25 HB THR 3 HB THR 3 -12.619 13.019 11.673 26 HG1 THR 3 HG1 THR 3 -9.870 13.678 11.887 27 1HG2 THR 3 HG21 THR 3 -12.820 15.406 10.915 28 2HG2 THR 3 HG23 THR 3 -11.063 15.456 10.771 29 3HG2 THR 3 HG22 THR 3 -12.000 14.360 9.756 30 H GLU 4 HN GLU 4 -13.223 12.340 14.033 31 HA GLU 4 HA GLU 4 -11.653 11.813 16.412 32 1HB GLU 4 HB2 GLU 4 -14.075 11.196 16.156 33 2HB GLU 4 HB1 GLU 4 -13.594 9.972 14.981 34 1HG GLU 4 HG2 GLU 4 -12.184 8.881 16.680 35 2HG GLU 4 HG1 GLU 4 -12.659 10.101 17.862 36 H GLY 5 HN GLY 5 -9.816 10.599 16.557 37 1HA GLY 5 HA2 GLY 5 -8.134 9.057 15.972 38 2HA GLY 5 HA1 GLY 5 -9.252 8.375 14.790 39 H ASN 6 HN ASN 6 -7.481 8.264 13.239 40 HA ASN 6 HA ASN 6 -6.138 10.705 12.426 41 1HB ASN 6 HB2 ASN 6 -6.255 7.907 11.301 42 2HB ASN 6 HB1 ASN 6 -5.410 9.202 10.456 43 1HD2 ASN 6 HD22 ASN 6 -3.861 7.772 13.983 44 2HD2 ASN 6 HD21 ASN 6 -5.487 7.466 13.601 45 HA PRO 7 HA PRO 7 -9.224 12.222 9.611 46 1HB PRO 7 HB2 PRO 7 -7.418 12.986 7.500 47 2HB PRO 7 HB1 PRO 7 -8.099 14.027 8.757 48 1HG PRO 7 HG2 PRO 7 -5.367 12.977 8.549 49 2HG PRO 7 HG1 PRO 7 -5.995 14.210 9.654 50 1HD PRO 7 HD2 PRO 7 -5.272 11.544 10.348 51 2HD PRO 7 HD1 PRO 7 -6.154 12.703 11.368 52 H ARG 8 HN ARG 8 -9.862 11.882 7.164 53 HA ARG 8 HA ARG 8 -8.820 9.312 6.068 54 1HB ARG 8 HB2 ARG 8 -11.741 9.879 6.676 55 2HB ARG 8 HB1 ARG 8 -11.166 8.517 5.713 56 1HG ARG 8 HG2 ARG 8 -9.856 7.701 7.639 57 2HG ARG 8 HG1 ARG 8 -10.430 9.060 8.608 58 1HD ARG 8 HD2 ARG 8 -12.776 8.285 8.226 59 2HD ARG 8 HD1 ARG 8 -12.137 6.875 7.382 60 HE ARG 8 HE ARG 8 -10.851 6.815 9.837 61 1HH1 ARG 8 HH21 ARG 8 -14.105 7.019 8.712 62 2HH1 ARG 8 HH22 ARG 8 -14.772 6.189 10.078 63 1HH2 ARG 8 HH11 ARG 8 -11.705 5.722 11.630 64 2HH2 ARG 8 HH12 ARG 8 -13.414 5.453 11.727 65 H TRP 9 HN TRP 9 -9.326 9.066 3.789 66 HA TRP 9 HA TRP 9 -9.343 11.573 2.356 67 1HB TRP 9 HB2 TRP 9 -9.713 8.725 1.377 68 2HB TRP 9 HB1 TRP 9 -9.472 10.123 0.330 69 HD1 TRP 9 HD1 TRP 9 -7.647 7.712 2.566 70 HE1 TRP 9 HE1 TRP 9 -5.116 8.194 2.473 71 HE3 TRP 9 HE3 TRP 9 -7.683 12.146 0.028 72 HZ2 TRP 9 HZ2 TRP 9 -3.340 10.199 1.457 73 HZ3 TRP 9 HZ3 TRP 9 -5.561 13.318 -0.486 74 HH2 TRP 9 HH2 TRP 9 -3.394 12.352 0.224 75 H GLU 10 HN GLU 10 -11.112 12.768 1.849 76 HA GLU 10 HA GLU 10 -13.798 11.645 2.244 77 1HB GLU 10 HB2 GLU 10 -12.822 14.379 1.373 78 2HB GLU 10 HB1 GLU 10 -14.526 13.969 1.571 79 1HG GLU 10 HG2 GLU 10 -14.105 13.368 3.932 80 2HG GLU 10 HG1 GLU 10 -12.404 13.789 3.730 81 H GLN 11 HN GLN 11 -11.582 11.927 -0.334 82 HA GLN 11 HA GLN 11 -13.632 12.022 -2.451 83 1HB GLN 11 HB2 GLN 11 -10.631 11.582 -2.595 84 2HB GLN 11 HB1 GLN 11 -11.694 11.840 -3.978 85 1HG GLN 11 HG2 GLN 11 -12.282 14.059 -3.178 86 2HG GLN 11 HG1 GLN 11 -11.357 13.806 -1.697 87 1HE2 GLN 11 HE22 GLN 11 -9.234 15.665 -4.206 88 2HE2 GLN 11 HE21 GLN 11 -10.766 15.960 -3.536 89 H THR 12 HN THR 12 -14.215 10.244 -3.745 90 HA THR 12 HA THR 12 -13.617 7.580 -2.582 91 HB THR 12 HB THR 12 -15.378 6.777 -4.112 92 HG1 THR 12 HG1 THR 12 -15.946 9.395 -4.872 93 1HG2 THR 12 HG23 THR 12 -16.139 9.310 -2.633 94 2HG2 THR 12 HG22 THR 12 -17.262 8.053 -3.153 95 3HG2 THR 12 HG21 THR 12 -16.043 7.695 -1.930 96 H HIS 13 HN HIS 13 -12.311 9.609 -4.859 97 HA HIS 13 HA HIS 13 -11.141 7.335 -6.434 98 1HB HIS 13 HB2 HIS 13 -11.688 10.191 -7.313 99 2HB HIS 13 HB1 HIS 13 -10.871 8.968 -8.286 100 HD1 HIS 13 HD1 HIS 13 -12.311 7.146 -9.373 101 HD2 HIS 13 HD2 HIS 13 -14.502 9.706 -6.920 102 HE1 HIS 13 HE1 HIS 13 -14.753 6.619 -9.788 103 H LEU 14 HN LEU 14 -8.942 7.191 -6.291 104 HA LEU 14 HA LEU 14 -7.408 9.559 -5.263 105 1HB LEU 14 HB2 LEU 14 -7.024 6.651 -4.477 106 2HB LEU 14 HB1 LEU 14 -6.037 8.003 -3.929 107 HG LEU 14 HG LEU 14 -9.027 7.805 -3.461 108 1HD1 LEU 14 HD12 LEU 14 -6.697 7.075 -1.668 109 2HD1 LEU 14 HD11 LEU 14 -8.360 7.249 -1.106 110 3HD1 LEU 14 HD13 LEU 14 -7.949 5.991 -2.272 111 1HD2 LEU 14 HD22 LEU 14 -6.844 9.694 -2.559 112 2HD2 LEU 14 HD21 LEU 14 -8.414 10.081 -3.260 113 3HD2 LEU 14 HD23 LEU 14 -8.311 9.493 -1.604 114 H THR 15 HN THR 15 -5.106 9.474 -5.874 115 HA THR 15 HA THR 15 -4.559 7.766 -8.277 116 HB THR 15 HB THR 15 -3.545 9.690 -9.381 117 HG1 THR 15 HG1 THR 15 -4.449 11.148 -7.126 118 1HG2 THR 15 HG22 THR 15 -6.005 9.273 -9.621 119 2HG2 THR 15 HG21 THR 15 -6.282 10.441 -8.328 120 3HG2 THR 15 HG23 THR 15 -5.554 10.963 -9.847 121 H TYR 16 HN TYR 16 -2.235 7.545 -8.729 122 HA TYR 16 HA TYR 16 -0.427 8.248 -6.471 123 1HB TYR 16 HB2 TYR 16 0.396 5.942 -6.287 124 2HB TYR 16 HB1 TYR 16 -1.329 6.003 -5.933 125 HD1 TYR 16 HD2 TYR 16 -2.988 5.329 -7.707 126 HD2 TYR 16 HD1 TYR 16 1.239 4.710 -8.149 127 HE1 TYR 16 HE2 TYR 16 -3.417 3.691 -9.519 128 HE2 TYR 16 HE1 TYR 16 0.810 3.072 -9.960 129 HH TYR 16 HH TYR 16 -2.084 2.801 -11.545 130 H ARG 17 HN ARG 17 1.848 8.083 -7.075 131 HA ARG 17 HA ARG 17 2.396 7.629 -9.964 132 1HB ARG 17 HB2 ARG 17 1.853 10.035 -9.732 133 2HB ARG 17 HB1 ARG 17 3.118 10.194 -8.516 134 1HG ARG 17 HG2 ARG 17 4.808 9.500 -10.174 135 2HG ARG 17 HG1 ARG 17 3.542 9.320 -11.389 136 1HD ARG 17 HD2 ARG 17 2.974 11.717 -11.144 137 2HD ARG 17 HD1 ARG 17 4.271 11.893 -9.960 138 HE ARG 17 HE ARG 17 5.576 10.859 -12.150 139 1HH1 ARG 17 HH21 ARG 17 3.388 13.459 -11.589 140 2HH1 ARG 17 HH22 ARG 17 4.058 14.470 -12.825 141 1HH2 ARG 17 HH11 ARG 17 6.464 12.159 -13.773 142 2HH2 ARG 17 HH12 ARG 17 5.796 13.730 -14.067 143 H ILE 18 HN ILE 18 4.311 6.622 -10.246 144 HA ILE 18 HA ILE 18 6.049 6.163 -7.893 145 HB ILE 18 HB ILE 18 6.100 5.049 -10.718 146 1HG1 ILE 18 HG12 ILE 18 5.384 3.695 -8.102 147 2HG1 ILE 18 HG11 ILE 18 4.184 4.389 -9.192 148 1HG2 ILE 18 HG22 ILE 18 7.804 4.494 -8.278 149 2HG2 ILE 18 HG21 ILE 18 7.682 3.367 -9.629 150 3HG2 ILE 18 HG23 ILE 18 8.343 4.981 -9.885 151 1HD1 ILE 18 HD12 ILE 18 6.204 2.286 -10.016 152 2HD1 ILE 18 HD11 ILE 18 4.545 1.926 -9.538 153 3HD1 ILE 18 HD13 ILE 18 4.858 2.895 -10.979 154 H GLU 19 HN GLU 19 7.769 7.517 -7.560 155 HA GLU 19 HA GLU 19 8.507 9.538 -9.459 156 1HB GLU 19 HB2 GLU 19 9.895 8.510 -6.975 157 2HB GLU 19 HB1 GLU 19 10.486 9.878 -7.919 158 1HG GLU 19 HG2 GLU 19 8.329 11.039 -7.582 159 2HG GLU 19 HG1 GLU 19 7.753 9.674 -6.624 160 H ASN 20 HN ASN 20 9.980 6.392 -8.637 161 HA ASN 20 HA ASN 20 11.233 6.301 -11.271 162 1HB ASN 20 HB2 ASN 20 13.554 6.237 -10.478 163 2HB ASN 20 HB1 ASN 20 12.808 7.770 -10.030 164 1HD2 ASN 20 HD22 ASN 20 12.368 5.699 -6.694 165 2HD2 ASN 20 HD21 ASN 20 11.304 5.672 -8.016 166 H TYR 21 HN TYR 21 12.245 4.204 -11.662 167 HA TYR 21 HA TYR 21 11.192 2.083 -9.834 168 1HB TYR 21 HB2 TYR 21 12.157 1.965 -12.711 169 2HB TYR 21 HB1 TYR 21 11.599 0.575 -11.783 170 HD1 TYR 21 HD1 TYR 21 9.241 0.327 -11.161 171 HD2 TYR 21 HD2 TYR 21 10.600 3.687 -13.471 172 HE1 TYR 21 HE1 TYR 21 6.895 0.862 -11.764 173 HE2 TYR 21 HE2 TYR 21 8.253 4.224 -14.071 174 HH TYR 21 HH TYR 21 6.122 3.325 -14.137 175 H THR 22 HN THR 22 12.640 0.895 -8.646 176 HA THR 22 HA THR 22 15.429 1.576 -8.705 177 HB THR 22 HB THR 22 14.532 0.852 -6.613 178 HG1 THR 22 HG1 THR 22 16.338 -0.823 -7.894 179 1HG2 THR 22 HG21 THR 22 13.629 -1.601 -8.137 180 2HG2 THR 22 HG23 THR 22 13.604 -1.487 -6.379 181 3HG2 THR 22 HG22 THR 22 12.612 -0.398 -7.348 182 HA PRO 23 HA PRO 23 16.617 -1.198 -12.004 183 1HB PRO 23 HB2 PRO 23 19.259 -1.747 -11.075 184 2HB PRO 23 HB1 PRO 23 18.784 -0.475 -12.210 185 1HG PRO 23 HG2 PRO 23 19.559 -0.214 -9.377 186 2HG PRO 23 HG1 PRO 23 19.422 1.048 -10.611 187 1HD PRO 23 HD2 PRO 23 17.604 0.604 -8.470 188 2HD PRO 23 HD1 PRO 23 17.339 1.651 -9.882 189 H ASP 24 HN ASP 24 16.143 -2.072 -8.826 190 HA ASP 24 HA ASP 24 17.269 -4.700 -8.699 191 1HB ASP 24 HB2 ASP 24 14.857 -3.477 -7.339 192 2HB ASP 24 HB1 ASP 24 15.453 -5.097 -6.974 193 H LEU 25 HN LEU 25 14.155 -3.511 -9.919 194 HA LEU 25 HA LEU 25 13.820 -6.090 -11.368 195 1HB LEU 25 HB2 LEU 25 11.784 -4.714 -9.603 196 2HB LEU 25 HB1 LEU 25 11.317 -5.893 -10.822 197 HG LEU 25 HG LEU 25 13.420 -6.558 -8.756 198 1HD1 LEU 25 HD13 LEU 25 10.411 -6.674 -8.473 199 2HD1 LEU 25 HD12 LEU 25 11.495 -7.662 -7.493 200 3HD1 LEU 25 HD11 LEU 25 11.572 -5.903 -7.392 201 1HD2 LEU 25 HD22 LEU 25 11.503 -8.163 -10.478 202 2HD2 LEU 25 HD21 LEU 25 13.263 -8.161 -10.555 203 3HD2 LEU 25 HD23 LEU 25 12.444 -8.870 -9.169 204 HA PRO 26 HA PRO 26 12.927 -3.328 -14.724 205 1HB PRO 26 HB2 PRO 26 10.860 -4.888 -15.959 206 2HB PRO 26 HB1 PRO 26 12.580 -4.878 -16.375 207 1HG PRO 26 HG2 PRO 26 11.064 -6.935 -14.926 208 2HG PRO 26 HG1 PRO 26 12.698 -7.035 -15.597 209 1HD PRO 26 HD2 PRO 26 12.027 -6.832 -12.839 210 2HD PRO 26 HD1 PRO 26 13.645 -6.646 -13.549 211 H ARG 27 HN ARG 27 11.279 -1.796 -15.336 212 HA ARG 27 HA ARG 27 9.436 -1.096 -13.261 213 1HB ARG 27 HB2 ARG 27 8.693 0.653 -14.788 214 2HB ARG 27 HB1 ARG 27 10.450 0.512 -14.873 215 1HG ARG 27 HG2 ARG 27 10.134 -1.030 -16.857 216 2HG ARG 27 HG1 ARG 27 8.426 -0.589 -16.839 217 1HD ARG 27 HD2 ARG 27 9.048 1.796 -17.075 218 2HD ARG 27 HD1 ARG 27 10.749 1.334 -17.140 219 HE ARG 27 HE ARG 27 9.592 -0.155 -19.165 220 1HH1 ARG 27 HH21 ARG 27 9.652 3.158 -18.219 221 2HH1 ARG 27 HH22 ARG 27 9.512 3.762 -19.836 222 1HH2 ARG 27 HH11 ARG 27 9.413 0.611 -21.287 223 2HH2 ARG 27 HH12 ARG 27 9.384 2.319 -21.577 224 H ALA 28 HN ALA 28 9.037 -2.882 -16.287 225 HA ALA 28 HA ALA 28 6.203 -2.836 -16.425 226 1HB ALA 28 HB1 ALA 28 7.740 -3.689 -18.214 227 2HB ALA 28 HB3 ALA 28 7.995 -5.137 -17.240 228 3HB ALA 28 HB2 ALA 28 6.389 -4.768 -17.868 229 H ASP 29 HN ASP 29 8.364 -5.043 -14.643 230 HA ASP 29 HA ASP 29 6.113 -6.655 -13.700 231 1HB ASP 29 HB2 ASP 29 9.068 -6.579 -13.060 232 2HB ASP 29 HB1 ASP 29 7.953 -7.584 -12.132 233 H VAL 30 HN VAL 30 7.989 -3.929 -12.504 234 HA VAL 30 HA VAL 30 7.037 -4.086 -9.781 235 HB VAL 30 HB VAL 30 8.184 -1.815 -11.424 236 1HG1 VAL 30 HG11 VAL 30 7.335 -1.920 -8.523 237 2HG1 VAL 30 HG13 VAL 30 8.521 -0.757 -9.118 238 3HG1 VAL 30 HG12 VAL 30 6.875 -0.737 -9.748 239 1HG2 VAL 30 HG22 VAL 30 9.608 -3.828 -10.793 240 2HG2 VAL 30 HG21 VAL 30 10.211 -2.272 -10.219 241 3HG2 VAL 30 HG23 VAL 30 9.376 -3.359 -9.108 242 H ASP 31 HN ASP 31 5.953 -2.266 -12.656 243 HA ASP 31 HA ASP 31 3.869 -0.812 -11.378 244 1HB ASP 31 HB2 ASP 31 4.622 -0.338 -13.681 245 2HB ASP 31 HB1 ASP 31 3.967 -1.886 -14.216 246 H HIS 32 HN HIS 32 3.907 -4.052 -12.836 247 HA HIS 32 HA HIS 32 1.130 -4.610 -12.548 248 1HB HIS 32 HB2 HIS 32 2.652 -6.049 -13.855 249 2HB HIS 32 HB1 HIS 32 3.466 -6.538 -12.367 250 HD1 HIS 32 HD1 HIS 32 -0.102 -6.497 -13.731 251 HD2 HIS 32 HD2 HIS 32 2.339 -8.809 -11.267 252 HE1 HIS 32 HE1 HIS 32 -1.479 -8.506 -13.042 253 H ALA 33 HN ALA 33 3.848 -5.236 -10.310 254 HA ALA 33 HA ALA 33 2.339 -6.489 -8.260 255 1HB ALA 33 HB2 ALA 33 4.864 -6.293 -8.382 256 2HB ALA 33 HB1 ALA 33 4.690 -4.634 -7.810 257 3HB ALA 33 HB3 ALA 33 4.174 -5.977 -6.790 258 H ILE 34 HN ILE 34 3.112 -3.029 -8.715 259 HA ILE 34 HA ILE 34 1.607 -2.175 -6.400 260 HB ILE 34 HB ILE 34 2.382 -0.645 -8.904 261 1HG1 ILE 34 HG12 ILE 34 4.362 -1.537 -7.793 262 2HG1 ILE 34 HG11 ILE 34 4.266 0.196 -7.497 263 1HG2 ILE 34 HG22 ILE 34 1.351 0.226 -6.205 264 2HG2 ILE 34 HG21 ILE 34 2.197 1.324 -7.296 265 3HG2 ILE 34 HG23 ILE 34 0.678 0.581 -7.795 266 1HD1 ILE 34 HD13 ILE 34 2.975 -0.558 -5.309 267 2HD1 ILE 34 HD12 ILE 34 3.812 -2.082 -5.596 268 3HD1 ILE 34 HD11 ILE 34 4.737 -0.601 -5.359 269 H GLU 35 HN GLU 35 0.899 -2.212 -9.894 270 HA GLU 35 HA GLU 35 -1.731 -1.151 -9.738 271 1HB GLU 35 HB2 GLU 35 -0.444 -1.432 -11.845 272 2HB GLU 35 HB1 GLU 35 -0.627 -3.179 -11.706 273 1HG GLU 35 HG2 GLU 35 -2.320 -2.335 -13.232 274 2HG GLU 35 HG1 GLU 35 -3.118 -2.869 -11.756 275 H LYS 36 HN LYS 36 -0.551 -4.490 -9.473 276 HA LYS 36 HA LYS 36 -3.096 -5.762 -9.431 277 1HB LYS 36 HB2 LYS 36 -0.864 -6.903 -9.677 278 2HB LYS 36 HB1 LYS 36 -0.618 -6.669 -7.947 279 1HG LYS 36 HG2 LYS 36 -2.664 -7.949 -7.468 280 2HG LYS 36 HG1 LYS 36 -2.941 -8.167 -9.197 281 1HD LYS 36 HD2 LYS 36 -0.797 -9.374 -9.393 282 2HD LYS 36 HD1 LYS 36 -0.517 -9.160 -7.664 283 1HE LYS 36 HE2 LYS 36 -2.533 -10.457 -7.152 284 2HE LYS 36 HE1 LYS 36 -2.883 -10.627 -8.872 285 1HZ LYS 36 HZ1 LYS 36 -0.293 -11.463 -8.600 286 2HZ LYS 36 HZ3 LYS 36 -1.075 -12.108 -7.240 287 3HZ LYS 36 HZ2 LYS 36 -1.656 -12.458 -8.797 288 H ALA 37 HN ALA 37 -1.159 -4.366 -6.787 289 HA ALA 37 HA ALA 37 -2.833 -5.296 -4.660 290 1HB ALA 37 HB1 ALA 37 -0.554 -4.355 -4.328 291 2HB ALA 37 HB3 ALA 37 -1.174 -2.760 -4.754 292 3HB ALA 37 HB2 ALA 37 -1.755 -3.573 -3.300 293 H PHE 38 HN PHE 38 -2.885 -2.216 -6.493 294 HA PHE 38 HA PHE 38 -5.029 -1.036 -5.034 295 1HB PHE 38 HB2 PHE 38 -4.011 -0.677 -7.853 296 2HB PHE 38 HB1 PHE 38 -5.446 0.184 -7.301 297 HD1 PHE 38 HD2 PHE 38 -5.185 1.340 -4.912 298 HD2 PHE 38 HD1 PHE 38 -1.929 0.368 -7.540 299 HE1 PHE 38 HE2 PHE 38 -3.770 3.033 -3.784 300 HE2 PHE 38 HE1 PHE 38 -0.515 2.066 -6.413 301 HZ PHE 38 HZ PHE 38 -1.437 3.398 -4.535 302 H GLN 39 HN GLN 39 -5.062 -3.229 -7.835 303 HA GLN 39 HA GLN 39 -7.858 -3.104 -8.338 304 1HB GLN 39 HB2 GLN 39 -5.845 -5.327 -8.743 305 2HB GLN 39 HB1 GLN 39 -7.509 -5.412 -9.324 306 1HG GLN 39 HG2 GLN 39 -7.162 -3.345 -10.630 307 2HG GLN 39 HG1 GLN 39 -5.496 -3.264 -10.054 308 1HE2 GLN 39 HE22 GLN 39 -5.242 -6.702 -11.843 309 2HE2 GLN 39 HE21 GLN 39 -5.552 -6.397 -10.202 310 H LEU 40 HN LEU 40 -5.996 -5.193 -6.125 311 HA LEU 40 HA LEU 40 -8.171 -6.822 -5.277 312 1HB LEU 40 HB2 LEU 40 -5.704 -5.941 -3.748 313 2HB LEU 40 HB1 LEU 40 -6.790 -7.232 -3.237 314 HG LEU 40 HG LEU 40 -5.302 -7.187 -5.880 315 1HD1 LEU 40 HD13 LEU 40 -4.672 -8.458 -3.213 316 2HD1 LEU 40 HD12 LEU 40 -4.031 -9.114 -4.718 317 3HD1 LEU 40 HD11 LEU 40 -3.626 -7.468 -4.232 318 1HD2 LEU 40 HD23 LEU 40 -7.221 -9.103 -4.562 319 2HD2 LEU 40 HD22 LEU 40 -7.111 -8.618 -6.253 320 3HD2 LEU 40 HD21 LEU 40 -5.942 -9.752 -5.589 321 H TRP 41 HN TRP 41 -7.030 -3.676 -4.041 322 HA TRP 41 HA TRP 41 -8.934 -3.635 -1.852 323 1HB TRP 41 HB2 TRP 41 -7.329 -1.449 -3.201 324 2HB TRP 41 HB1 TRP 41 -8.352 -1.172 -1.792 325 HD1 TRP 41 HD1 TRP 41 -4.919 -1.990 -2.666 326 HE1 TRP 41 HE1 TRP 41 -3.634 -2.962 -0.651 327 HE3 TRP 41 HE3 TRP 41 -8.828 -3.018 0.463 328 HZ2 TRP 41 HZ2 TRP 41 -4.193 -4.037 1.940 329 HZ3 TRP 41 HZ3 TRP 41 -8.421 -4.019 2.694 330 HH2 TRP 41 HH2 TRP 41 -6.112 -4.528 3.436 331 H SER 42 HN SER 42 -8.893 -2.246 -5.126 332 HA SER 42 HA SER 42 -11.403 -0.850 -4.852 333 1HB SER 42 HB2 SER 42 -9.754 -0.239 -6.569 334 2HB SER 42 HB1 SER 42 -9.955 -1.809 -7.340 335 HG SER 42 HG SER 42 -12.074 -1.270 -7.805 336 H ASN 43 HN ASN 43 -10.549 -4.139 -5.627 337 HA ASN 43 HA ASN 43 -12.890 -4.934 -7.011 338 1HB ASN 43 HB2 ASN 43 -11.013 -6.459 -5.200 339 2HB ASN 43 HB1 ASN 43 -12.334 -7.236 -6.075 340 1HD2 ASN 43 HD22 ASN 43 -9.179 -7.262 -8.176 341 2HD2 ASN 43 HD21 ASN 43 -9.502 -7.768 -6.588 342 H VAL 44 HN VAL 44 -12.283 -4.753 -3.496 343 HA VAL 44 HA VAL 44 -15.125 -5.566 -3.029 344 HB VAL 44 HB VAL 44 -14.489 -6.081 -0.781 345 1HG1 VAL 44 HG12 VAL 44 -13.769 -7.633 -2.667 346 2HG1 VAL 44 HG11 VAL 44 -12.151 -6.952 -2.492 347 3HG1 VAL 44 HG13 VAL 44 -12.892 -7.822 -1.148 348 1HG2 VAL 44 HG23 VAL 44 -11.990 -4.529 -1.470 349 2HG2 VAL 44 HG22 VAL 44 -13.085 -4.309 -0.104 350 3HG2 VAL 44 HG21 VAL 44 -11.996 -5.694 -0.144 351 H THR 45 HN THR 45 -13.793 -2.750 -3.723 352 HA THR 45 HA THR 45 -15.560 -1.296 -1.828 353 HB THR 45 HB THR 45 -13.878 0.365 -1.314 354 HG1 THR 45 HG1 THR 45 -12.848 0.075 -3.431 355 1HG2 THR 45 HG22 THR 45 -13.911 -1.905 -0.094 356 2HG2 THR 45 HG21 THR 45 -12.457 -2.273 -1.024 357 3HG2 THR 45 HG23 THR 45 -12.474 -0.905 0.083 358 HA PRO 46 HA PRO 46 -16.488 0.774 -5.684 359 1HB PRO 46 HB2 PRO 46 -17.518 3.177 -4.613 360 2HB PRO 46 HB1 PRO 46 -18.450 1.703 -4.918 361 1HG PRO 46 HG2 PRO 46 -17.537 2.811 -2.330 362 2HG PRO 46 HG1 PRO 46 -18.805 1.616 -2.646 363 1HD PRO 46 HD2 PRO 46 -16.209 1.070 -1.609 364 2HD PRO 46 HD1 PRO 46 -17.390 -0.122 -2.199 365 H LEU 47 HN LEU 47 -14.022 1.481 -3.669 366 HA LEU 47 HA LEU 47 -13.283 4.156 -4.521 367 1HB LEU 47 HB2 LEU 47 -11.577 1.935 -3.355 368 2HB LEU 47 HB1 LEU 47 -11.093 3.622 -3.504 369 HG LEU 47 HG LEU 47 -13.469 2.632 -1.900 370 1HD1 LEU 47 HD13 LEU 47 -11.223 1.988 -0.982 371 2HD1 LEU 47 HD12 LEU 47 -10.798 3.699 -0.938 372 3HD1 LEU 47 HD11 LEU 47 -12.114 3.093 0.067 373 1HD2 LEU 47 HD23 LEU 47 -12.329 5.354 -2.522 374 2HD2 LEU 47 HD22 LEU 47 -14.015 4.845 -2.434 375 3HD2 LEU 47 HD21 LEU 47 -13.093 5.085 -0.954 376 H THR 48 HN THR 48 -11.672 4.726 -6.059 377 HA THR 48 HA THR 48 -10.819 2.546 -7.942 378 HB THR 48 HB THR 48 -11.375 3.893 -9.836 379 HG1 THR 48 HG1 THR 48 -11.272 5.876 -7.948 380 1HG2 THR 48 HG22 THR 48 -13.302 2.763 -8.761 381 2HG2 THR 48 HG21 THR 48 -13.603 4.214 -7.804 382 3HG2 THR 48 HG23 THR 48 -13.787 4.260 -9.557 383 H PHE 49 HN PHE 49 -8.726 2.769 -8.707 384 HA PHE 49 HA PHE 49 -7.169 5.155 -7.752 385 1HB PHE 49 HB2 PHE 49 -6.317 2.254 -7.945 386 2HB PHE 49 HB1 PHE 49 -5.233 3.593 -7.561 387 HD1 PHE 49 HD2 PHE 49 -5.414 4.804 -5.442 388 HD2 PHE 49 HD1 PHE 49 -8.033 1.525 -6.365 389 HE1 PHE 49 HE2 PHE 49 -6.123 4.703 -3.068 390 HE2 PHE 49 HE1 PHE 49 -8.746 1.425 -3.991 391 HZ PHE 49 HZ PHE 49 -7.789 3.013 -2.342 392 H THR 50 HN THR 50 -6.004 6.194 -9.301 393 HA THR 50 HA THR 50 -5.710 4.887 -11.987 394 HB THR 50 HB THR 50 -6.356 7.795 -11.429 395 HG1 THR 50 HG1 THR 50 -7.886 5.582 -11.685 396 1HG2 THR 50 HG23 THR 50 -6.048 6.201 -13.985 397 2HG2 THR 50 HG22 THR 50 -6.713 7.833 -13.909 398 3HG2 THR 50 HG21 THR 50 -5.036 7.542 -13.447 399 H LYS 51 HN LYS 51 -3.729 5.033 -12.893 400 HA LYS 51 HA LYS 51 -1.513 6.161 -11.363 401 1HB LYS 51 HB2 LYS 51 -1.146 4.095 -12.589 402 2HB LYS 51 HB1 LYS 51 -1.698 4.832 -14.087 403 1HG LYS 51 HG2 LYS 51 0.755 4.670 -14.057 404 2HG LYS 51 HG1 LYS 51 0.261 6.356 -14.058 405 1HD LYS 51 HD2 LYS 51 0.722 6.573 -11.705 406 2HD LYS 51 HD1 LYS 51 0.942 4.831 -11.532 407 1HE LYS 51 HE2 LYS 51 2.662 6.493 -13.382 408 2HE LYS 51 HE1 LYS 51 3.079 6.240 -11.689 409 1HZ LYS 51 HZ3 LYS 51 2.625 3.760 -12.335 410 2HZ LYS 51 HZ2 LYS 51 3.012 4.320 -13.892 411 3HZ LYS 51 HZ1 LYS 51 4.133 4.480 -12.626 412 H VAL 52 HN VAL 52 -0.439 8.106 -11.806 413 HA VAL 52 HA VAL 52 -1.412 9.703 -14.167 414 HB VAL 52 HB VAL 52 -1.214 11.725 -12.809 415 1HG1 VAL 52 HG12 VAL 52 -2.856 9.491 -11.599 416 2HG1 VAL 52 HG11 VAL 52 -3.019 11.179 -11.108 417 3HG1 VAL 52 HG13 VAL 52 -3.383 10.702 -12.767 418 1HG2 VAL 52 HG23 VAL 52 -0.257 9.764 -10.714 419 2HG2 VAL 52 HG22 VAL 52 0.544 11.228 -11.284 420 3HG2 VAL 52 HG21 VAL 52 -0.897 11.349 -10.277 421 H SER 53 HN SER 53 0.196 10.330 -15.492 422 HA SER 53 HA SER 53 2.999 9.837 -14.657 423 1HB SER 53 HB2 SER 53 2.009 9.063 -16.886 424 2HB SER 53 HB1 SER 53 2.020 10.757 -17.366 425 HG SER 53 HG SER 53 4.319 10.670 -16.689 426 H GLU 54 HN GLU 54 0.830 12.414 -14.689 427 HA GLU 54 HA GLU 54 3.074 14.347 -14.406 428 1HB GLU 54 HB2 GLU 54 0.754 14.637 -16.339 429 2HB GLU 54 HB1 GLU 54 1.781 15.982 -15.844 430 1HG GLU 54 HG2 GLU 54 3.765 14.786 -16.704 431 2HG GLU 54 HG1 GLU 54 2.736 13.446 -17.206 432 H GLY 55 HN GLY 55 2.344 16.352 -13.335 433 1HA GLY 55 HA2 GLY 55 0.918 17.599 -11.905 434 2HA GLY 55 HA1 GLY 55 -0.355 16.409 -12.188 435 H GLN 56 HN GLN 56 -0.055 17.221 -9.619 436 HA GLN 56 HA GLN 56 1.792 15.451 -8.175 437 1HB GLN 56 HB2 GLN 56 -0.401 17.331 -7.246 438 2HB GLN 56 HB1 GLN 56 0.625 16.403 -6.152 439 1HG GLN 56 HG2 GLN 56 2.630 17.476 -7.114 440 2HG GLN 56 HG1 GLN 56 1.603 18.408 -8.205 441 1HE2 GLN 56 HE22 GLN 56 2.318 20.468 -5.134 442 2HE2 GLN 56 HE21 GLN 56 3.304 19.704 -6.285 443 H ALA 57 HN ALA 57 1.113 13.686 -6.848 444 HA ALA 57 HA ALA 57 -1.594 12.573 -7.533 445 1HB ALA 57 HB2 ALA 57 0.545 11.369 -8.335 446 2HB ALA 57 HB1 ALA 57 0.786 10.943 -6.642 447 3HB ALA 57 HB3 ALA 57 -0.663 10.402 -7.491 448 H ASP 58 HN ASP 58 -2.781 11.602 -5.834 449 HA ASP 58 HA ASP 58 -2.549 12.810 -3.269 450 1HB ASP 58 HB2 ASP 58 -3.992 10.300 -4.164 451 2HB ASP 58 HB1 ASP 58 -4.146 10.981 -2.544 452 H ILE 59 HN ILE 59 -1.420 9.663 -4.475 453 HA ILE 59 HA ILE 59 0.080 9.281 -1.895 454 HB ILE 59 HB ILE 59 -0.882 7.217 -3.900 455 1HG1 ILE 59 HG12 ILE 59 -1.807 7.718 -1.057 456 2HG1 ILE 59 HG11 ILE 59 -2.642 8.358 -2.471 457 1HG2 ILE 59 HG21 ILE 59 0.570 6.993 -1.249 458 2HG2 ILE 59 HG23 ILE 59 -0.173 5.628 -2.082 459 3HG2 ILE 59 HG22 ILE 59 1.169 6.493 -2.831 460 1HD1 ILE 59 HD12 ILE 59 -2.866 6.025 -3.339 461 2HD1 ILE 59 HD11 ILE 59 -2.152 5.433 -1.840 462 3HD1 ILE 59 HD13 ILE 59 -3.705 6.270 -1.807 463 H MET 60 HN MET 60 2.209 9.662 -2.145 464 HA MET 60 HA MET 60 3.450 9.383 -4.846 465 1HB MET 60 HB2 MET 60 4.491 10.679 -2.305 466 2HB MET 60 HB1 MET 60 5.294 10.702 -3.877 467 1HG MET 60 HG2 MET 60 2.493 11.762 -3.431 468 2HG MET 60 HG1 MET 60 3.931 12.778 -3.358 469 1HE MET 60 HE2 MET 60 5.679 12.758 -4.932 470 2HE MET 60 HE1 MET 60 5.512 12.715 -6.685 471 3HE MET 60 HE3 MET 60 4.792 14.037 -5.756 472 H ILE 61 HN ILE 61 4.847 7.724 -5.235 473 HA ILE 61 HA ILE 61 5.811 6.087 -2.904 474 HB ILE 61 HB ILE 61 4.986 5.216 -5.685 475 1HG1 ILE 61 HG12 ILE 61 3.930 4.391 -2.965 476 2HG1 ILE 61 HG11 ILE 61 3.205 5.673 -3.935 477 1HG2 ILE 61 HG22 ILE 61 6.405 3.763 -3.445 478 2HG2 ILE 61 HG21 ILE 61 5.477 2.902 -4.672 479 3HG2 ILE 61 HG23 ILE 61 6.871 3.873 -5.143 480 1HD1 ILE 61 HD12 ILE 61 3.606 2.822 -4.882 481 2HD1 ILE 61 HD11 ILE 61 2.085 3.469 -4.267 482 3HD1 ILE 61 HD13 ILE 61 2.778 4.111 -5.756 483 H SER 62 HN SER 62 8.000 5.840 -2.767 484 HA SER 62 HA SER 62 9.669 6.143 -5.198 485 1HB SER 62 HB2 SER 62 11.081 7.861 -4.181 486 2HB SER 62 HB1 SER 62 9.420 8.437 -4.277 487 HG SER 62 HG SER 62 9.223 8.264 -2.146 488 H PHE 63 HN PHE 63 11.949 5.585 -4.750 489 HA PHE 63 HA PHE 63 12.194 3.581 -2.529 490 1HB PHE 63 HB2 PHE 63 13.478 3.755 -5.271 491 2HB PHE 63 HB1 PHE 63 14.014 2.629 -4.032 492 HD1 PHE 63 HD1 PHE 63 11.288 3.497 -6.353 493 HD2 PHE 63 HD2 PHE 63 12.614 0.756 -3.323 494 HE1 PHE 63 HE1 PHE 63 9.485 1.911 -6.993 495 HE2 PHE 63 HE2 PHE 63 10.816 -0.825 -3.963 496 HZ PHE 63 HZ PHE 63 9.253 -0.247 -5.798 497 H VAL 64 HN VAL 64 13.849 3.920 -1.044 498 HA VAL 64 HA VAL 64 15.907 6.015 -1.679 499 HB VAL 64 HB VAL 64 15.646 6.820 0.687 500 1HG1 VAL 64 HG11 VAL 64 14.580 7.946 -1.281 501 2HG1 VAL 64 HG13 VAL 64 13.129 6.984 -1.000 502 3HG1 VAL 64 HG12 VAL 64 13.660 8.154 0.209 503 1HG2 VAL 64 HG22 VAL 64 14.553 4.772 1.559 504 2HG2 VAL 64 HG21 VAL 64 13.568 6.203 1.867 505 3HG2 VAL 64 HG23 VAL 64 13.145 5.106 0.552 506 H ARG 65 HN ARG 65 17.773 5.938 -0.158 507 HA ARG 65 HA ARG 65 18.298 3.158 0.863 508 1HB ARG 65 HB2 ARG 65 20.133 5.082 -0.597 509 2HB ARG 65 HB1 ARG 65 20.701 3.633 0.232 510 1HG ARG 65 HG2 ARG 65 19.278 2.234 -1.183 511 2HG ARG 65 HG1 ARG 65 18.644 3.667 -1.994 512 1HD ARG 65 HD2 ARG 65 20.417 2.640 -3.348 513 2HD ARG 65 HD1 ARG 65 20.938 4.221 -2.764 514 HE ARG 65 HE ARG 65 21.879 2.483 -0.835 515 1HH1 ARG 65 HH21 ARG 65 22.056 2.721 -4.269 516 2HH1 ARG 65 HH22 ARG 65 23.618 1.981 -4.373 517 1HH2 ARG 65 HH11 ARG 65 23.921 1.517 -0.952 518 2HH2 ARG 65 HH12 ARG 65 24.676 1.306 -2.497 519 H GLY 66 HN GLY 66 18.997 3.078 2.959 520 1HA GLY 66 HA2 GLY 66 19.481 3.856 5.124 521 2HA GLY 66 HA1 GLY 66 20.744 4.761 4.297 522 H ASP 67 HN ASP 67 20.586 6.609 5.570 523 HA ASP 67 HA ASP 67 18.151 7.922 6.288 524 1HB ASP 67 HB2 ASP 67 20.423 8.294 7.332 525 2HB ASP 67 HB1 ASP 67 20.853 9.235 5.903 526 H HIS 68 HN HIS 68 16.903 9.383 5.217 527 HA HIS 68 HA HIS 68 17.884 10.519 2.630 528 1HB HIS 68 HB2 HIS 68 15.640 10.019 1.642 529 2HB HIS 68 HB1 HIS 68 16.562 8.565 2.027 530 HD1 HIS 68 HD1 HIS 68 16.036 7.741 4.694 531 HD2 HIS 68 HD2 HIS 68 13.073 9.827 2.631 532 HE1 HIS 68 HE1 HIS 68 13.853 7.250 5.883 533 H ARG 69 HN ARG 69 17.951 12.145 4.728 534 HA ARG 69 HA ARG 69 17.054 14.083 5.695 535 1HB ARG 69 HB2 ARG 69 15.631 14.052 3.021 536 2HB ARG 69 HB1 ARG 69 15.512 15.393 4.161 537 1HG ARG 69 HG2 ARG 69 17.969 15.646 4.120 538 2HG ARG 69 HG1 ARG 69 18.084 14.311 2.974 539 1HD ARG 69 HD2 ARG 69 16.749 15.576 1.341 540 2HD ARG 69 HD1 ARG 69 16.586 16.904 2.489 541 HE ARG 69 HE ARG 69 19.339 16.502 2.251 542 1HH1 ARG 69 HH21 ARG 69 16.683 17.140 0.144 543 2HH1 ARG 69 HH22 ARG 69 17.642 18.005 -1.010 544 1HH2 ARG 69 HH11 ARG 69 20.598 17.624 0.758 545 2HH2 ARG 69 HH12 ARG 69 19.855 18.281 -0.663 546 H ASP 70 HN ASP 70 15.999 11.960 6.858 547 HA ASP 70 HA ASP 70 13.144 12.710 7.287 548 1HB ASP 70 HB2 ASP 70 13.390 10.697 5.702 549 2HB ASP 70 HB1 ASP 70 14.028 9.820 7.092 550 H ASN 71 HN ASN 71 12.375 11.897 9.427 551 HA ASN 71 HA ASN 71 14.578 11.988 11.396 552 1HB ASN 71 HB2 ASN 71 11.559 12.002 11.673 553 2HB ASN 71 HB1 ASN 71 12.664 12.026 13.047 554 1HD2 ASN 71 HD22 ASN 71 13.929 15.283 11.335 555 2HD2 ASN 71 HD21 ASN 71 14.571 13.720 11.201 556 H SER 72 HN SER 72 13.464 9.587 9.591 557 HA SER 72 HA SER 72 13.840 7.555 11.758 558 1HB SER 72 HB2 SER 72 11.789 7.375 9.532 559 2HB SER 72 HB1 SER 72 12.093 6.162 10.772 560 HG SER 72 HG SER 72 10.653 8.479 10.890 561 HA PRO 73 HA PRO 73 16.514 6.929 7.975 562 1HB PRO 73 HB2 PRO 73 18.855 6.603 9.569 563 2HB PRO 73 HB1 PRO 73 18.423 8.028 8.615 564 1HG PRO 73 HG2 PRO 73 18.385 7.719 11.525 565 2HG PRO 73 HG1 PRO 73 18.171 9.195 10.571 566 1HD PRO 73 HD2 PRO 73 16.130 7.697 11.953 567 2HD PRO 73 HD1 PRO 73 15.909 9.133 10.934 568 H PHE 74 HN PHE 74 17.128 4.837 7.282 569 HA PHE 74 HA PHE 74 16.262 2.617 8.953 570 1HB PHE 74 HB2 PHE 74 17.604 2.751 6.243 571 2HB PHE 74 HB1 PHE 74 17.156 1.233 7.022 572 HD1 PHE 74 HD1 PHE 74 14.819 0.619 7.354 573 HD2 PHE 74 HD2 PHE 74 15.893 4.310 5.437 574 HE1 PHE 74 HE1 PHE 74 12.491 0.874 6.545 575 HE2 PHE 74 HE2 PHE 74 13.562 4.564 4.627 576 HZ PHE 74 HZ PHE 74 11.862 2.846 5.180 577 H ASP 75 HN ASP 75 17.530 1.178 10.086 578 HA ASP 75 HA ASP 75 20.439 1.846 10.325 579 1HB ASP 75 HB2 ASP 75 19.041 1.909 12.399 580 2HB ASP 75 HB1 ASP 75 18.684 0.196 12.172 581 H GLY 76 HN GLY 76 20.378 0.561 8.109 582 1HA GLY 76 HA2 GLY 76 21.341 -1.350 7.102 583 2HA GLY 76 HA1 GLY 76 21.446 -2.083 8.702 584 HA PRO 77 HA PRO 77 18.051 -4.115 6.188 585 1HB PRO 77 HB2 PRO 77 19.093 -6.667 7.121 586 2HB PRO 77 HB1 PRO 77 19.021 -6.059 5.461 587 1HG PRO 77 HG2 PRO 77 21.371 -6.349 7.089 588 2HG PRO 77 HG1 PRO 77 21.273 -5.633 5.474 589 1HD PRO 77 HD2 PRO 77 21.655 -4.272 8.025 590 2HD PRO 77 HD1 PRO 77 21.689 -3.572 6.393 591 H GLY 78 HN GLY 78 18.901 -3.506 9.296 592 1HA GLY 78 HA2 GLY 78 16.919 -5.300 10.584 593 2HA GLY 78 HA1 GLY 78 18.020 -4.202 11.419 594 H GLY 79 HN GLY 79 15.469 -4.057 12.265 595 1HA GLY 79 HA2 GLY 79 13.889 -2.356 12.708 596 2HA GLY 79 HA1 GLY 79 14.715 -1.338 11.526 597 H ASN 80 HN ASN 80 12.478 -0.805 10.808 598 HA ASN 80 HA ASN 80 10.813 -2.847 9.617 599 1HB ASN 80 HB2 ASN 80 10.853 0.169 9.359 600 2HB ASN 80 HB1 ASN 80 9.641 -0.852 8.585 601 1HD2 ASN 80 HD22 ASN 80 8.523 -2.004 11.967 602 2HD2 ASN 80 HD21 ASN 80 9.174 -2.771 10.600 603 H LEU 81 HN LEU 81 10.447 -3.201 7.355 604 HA LEU 81 HA LEU 81 12.877 -2.824 5.697 605 1HB LEU 81 HB2 LEU 81 10.317 -4.199 4.849 606 2HB LEU 81 HB1 LEU 81 11.953 -4.482 4.265 607 HG LEU 81 HG LEU 81 10.934 -5.138 7.047 608 1HD1 LEU 81 HD11 LEU 81 11.667 -6.900 4.690 609 2HD1 LEU 81 HD13 LEU 81 11.209 -7.477 6.292 610 3HD1 LEU 81 HD12 LEU 81 10.036 -6.614 5.297 611 1HD2 LEU 81 HD21 LEU 81 13.607 -5.678 5.713 612 2HD2 LEU 81 HD23 LEU 81 13.335 -4.586 7.070 613 3HD2 LEU 81 HD22 LEU 81 13.111 -6.319 7.275 614 H ALA 82 HN ALA 82 9.964 -1.260 6.299 615 HA ALA 82 HA ALA 82 10.375 0.754 4.314 616 1HB ALA 82 HB1 ALA 82 8.350 -1.405 3.683 617 2HB ALA 82 HB3 ALA 82 8.227 0.217 3.001 618 3HB ALA 82 HB2 ALA 82 9.635 -0.785 2.647 619 H HIS 83 HN HIS 83 8.473 2.331 4.356 620 HA HIS 83 HA HIS 83 6.427 1.902 6.384 621 1HB HIS 83 HB2 HIS 83 7.176 3.580 7.978 622 2HB HIS 83 HB1 HIS 83 8.447 2.373 7.786 623 HD1 HIS 83 HD1 HIS 83 9.153 5.243 8.720 624 HD2 HIS 83 HD2 HIS 83 9.247 4.006 4.743 625 HE1 HIS 83 HE1 HIS 83 10.713 6.833 7.514 626 H ALA 84 HN ALA 84 5.186 4.024 6.735 627 HA ALA 84 HA ALA 84 5.479 5.959 4.507 628 1HB ALA 84 HB3 ALA 84 2.987 4.300 4.996 629 2HB ALA 84 HB2 ALA 84 3.066 5.694 3.918 630 3HB ALA 84 HB1 ALA 84 4.015 4.251 3.564 631 H PHE 85 HN PHE 85 3.830 7.768 4.813 632 HA PHE 85 HA PHE 85 3.689 8.425 7.713 633 1HB PHE 85 HB2 PHE 85 3.431 10.091 5.195 634 2HB PHE 85 HB1 PHE 85 3.180 10.735 6.819 635 HD1 PHE 85 HD2 PHE 85 5.656 9.366 4.451 636 HD2 PHE 85 HD1 PHE 85 5.033 10.947 8.401 637 HE1 PHE 85 HE2 PHE 85 8.105 9.620 4.740 638 HE2 PHE 85 HE1 PHE 85 7.483 11.200 8.684 639 HZ PHE 85 HZ PHE 85 9.018 10.535 6.852 640 H GLN 86 HN GLN 86 1.646 9.638 8.402 641 HA GLN 86 HA GLN 86 -0.631 8.001 7.873 642 1HB GLN 86 HB2 GLN 86 -0.316 10.691 9.211 643 2HB GLN 86 HB1 GLN 86 -1.877 9.881 9.095 644 1HG GLN 86 HG2 GLN 86 -0.761 9.376 11.242 645 2HG GLN 86 HG1 GLN 86 -0.961 7.920 10.266 646 1HE2 GLN 86 HE22 GLN 86 2.504 7.346 9.950 647 2HE2 GLN 86 HE21 GLN 86 0.933 6.822 9.578 648 HA PRO 87 HA PRO 87 -2.181 9.858 4.143 649 1HB PRO 87 HB2 PRO 87 -4.967 9.766 4.805 650 2HB PRO 87 HB1 PRO 87 -4.052 8.558 3.891 651 1HG PRO 87 HG2 PRO 87 -5.014 8.417 6.672 652 2HG PRO 87 HG1 PRO 87 -4.403 7.113 5.643 653 1HD PRO 87 HD2 PRO 87 -3.021 8.291 7.821 654 2HD PRO 87 HD1 PRO 87 -2.317 7.231 6.581 655 H GLY 88 HN GLY 88 -1.723 12.057 4.088 656 1HA GLY 88 HA2 GLY 88 -3.746 13.944 4.847 657 2HA GLY 88 HA1 GLY 88 -2.427 13.989 6.014 658 HA PRO 89 HA PRO 89 -1.567 16.550 2.076 659 1HB PRO 89 HB2 PRO 89 -1.305 18.915 3.722 660 2HB PRO 89 HB1 PRO 89 -2.516 18.598 2.472 661 1HG PRO 89 HG2 PRO 89 -2.877 18.581 5.364 662 2HG PRO 89 HG1 PRO 89 -4.109 18.395 4.107 663 1HD PRO 89 HD2 PRO 89 -3.098 16.340 5.838 664 2HD PRO 89 HD1 PRO 89 -4.210 16.137 4.467 665 H GLY 90 HN GLY 90 0.482 18.212 2.148 666 1HA GLY 90 HA2 GLY 90 2.778 18.422 2.567 667 2HA GLY 90 HA1 GLY 90 2.433 17.869 4.204 668 H ILE 91 HN ILE 91 3.814 16.225 4.617 669 HA ILE 91 HA ILE 91 4.723 14.410 2.513 670 HB ILE 91 HB ILE 91 6.154 15.221 4.434 671 1HG1 ILE 91 HG12 ILE 91 5.873 12.205 4.363 672 2HG1 ILE 91 HG11 ILE 91 6.606 13.130 3.053 673 1HG2 ILE 91 HG23 ILE 91 4.265 14.884 6.117 674 2HG2 ILE 91 HG22 ILE 91 4.642 13.162 6.052 675 3HG2 ILE 91 HG21 ILE 91 5.855 14.310 6.619 676 1HD1 ILE 91 HD13 ILE 91 7.530 13.256 5.936 677 2HD1 ILE 91 HD12 ILE 91 8.277 12.241 4.702 678 3HD1 ILE 91 HD11 ILE 91 8.313 13.997 4.540 679 H GLY 92 HN GLY 92 1.988 14.514 4.481 680 1HA GLY 92 HA2 GLY 92 1.642 11.804 5.253 681 2HA GLY 92 HA1 GLY 92 0.320 12.927 4.940 682 H GLY 93 HN GLY 93 0.810 10.008 4.194 683 1HA GLY 93 HA2 GLY 93 -0.200 8.784 2.410 684 2HA GLY 93 HA1 GLY 93 -0.197 10.247 1.427 685 H ASP 94 HN ASP 94 2.736 10.629 2.236 686 HA ASP 94 HA ASP 94 3.892 9.424 -0.083 687 1HB ASP 94 HB2 ASP 94 5.144 10.571 2.427 688 2HB ASP 94 HB1 ASP 94 6.084 10.041 1.031 689 H ALA 95 HN ALA 95 5.334 7.601 -0.232 690 HA ALA 95 HA ALA 95 5.447 5.789 2.144 691 1HB ALA 95 HB2 ALA 95 3.497 5.185 0.628 692 2HB ALA 95 HB1 ALA 95 4.682 4.835 -0.630 693 3HB ALA 95 HB3 ALA 95 4.679 3.899 0.865 694 H HIS 96 HN HIS 96 7.529 5.181 2.422 695 HA HIS 96 HA HIS 96 9.391 5.288 0.073 696 1HB HIS 96 HB2 HIS 96 10.064 5.330 3.026 697 2HB HIS 96 HB1 HIS 96 11.171 5.610 1.689 698 HD2 HIS 96 HD2 HIS 96 8.343 7.757 0.486 699 HE1 HIS 96 HE1 HIS 96 10.319 9.998 3.509 700 HE2 HIS 96 HE2 HIS 96 8.674 10.106 1.586 701 H PHE 97 HN PHE 97 10.552 3.486 -0.485 702 HA PHE 97 HA PHE 97 10.030 0.959 1.055 703 1HB PHE 97 HB2 PHE 97 10.536 1.511 -1.876 704 2HB PHE 97 HB1 PHE 97 10.743 -0.102 -1.194 705 HD1 PHE 97 HD1 PHE 97 8.283 2.684 -1.550 706 HD2 PHE 97 HD2 PHE 97 8.876 -1.506 -0.820 707 HE1 PHE 97 HE1 PHE 97 5.835 2.310 -1.699 708 HE2 PHE 97 HE2 PHE 97 6.428 -1.881 -0.972 709 HZ PHE 97 HZ PHE 97 4.907 0.028 -1.410 710 H ASP 98 HN ASP 98 11.812 -0.146 1.848 711 HA ASP 98 HA ASP 98 14.377 1.165 1.898 712 1HB ASP 98 HB2 ASP 98 13.603 -0.373 3.686 713 2HB ASP 98 HB1 ASP 98 13.707 -1.727 2.556 714 H GLU 99 HN GLU 99 15.373 1.427 -0.051 715 HA GLU 99 HA GLU 99 15.309 -0.594 -2.146 716 1HB GLU 99 HB2 GLU 99 15.475 1.953 -2.413 717 2HB GLU 99 HB1 GLU 99 17.169 1.776 -1.994 718 1HG GLU 99 HG2 GLU 99 17.482 0.202 -3.869 719 2HG GLU 99 HG1 GLU 99 15.780 0.379 -4.297 720 H ASP 100 HN ASP 100 17.176 -0.254 0.666 721 HA ASP 100 HA ASP 100 19.697 -1.240 -0.410 722 1HB ASP 100 HB2 ASP 100 18.620 -1.149 2.428 723 2HB ASP 100 HB1 ASP 100 20.271 -1.593 1.999 724 H GLU 101 HN GLU 101 16.719 -2.640 0.610 725 HA GLU 101 HA GLU 101 17.860 -5.338 0.973 726 1HB GLU 101 HB2 GLU 101 15.040 -4.237 1.079 727 2HB GLU 101 HB1 GLU 101 15.433 -5.941 1.324 728 1HG GLU 101 HG2 GLU 101 16.848 -5.402 3.220 729 2HG GLU 101 HG1 GLU 101 16.646 -3.674 2.929 730 H ARG 102 HN ARG 102 17.059 -7.161 -0.372 731 HA ARG 102 HA ARG 102 16.840 -6.328 -3.217 732 1HB ARG 102 HB2 ARG 102 18.469 -8.098 -2.493 733 2HB ARG 102 HB1 ARG 102 17.100 -9.113 -2.041 734 1HG ARG 102 HG2 ARG 102 16.263 -9.021 -4.362 735 2HG ARG 102 HG1 ARG 102 17.636 -8.011 -4.816 736 1HD ARG 102 HD2 ARG 102 19.166 -9.846 -4.053 737 2HD ARG 102 HD1 ARG 102 17.750 -10.859 -3.781 738 HE ARG 102 HE ARG 102 17.479 -10.022 -6.412 739 1HH1 ARG 102 HH21 ARG 102 19.907 -11.548 -4.499 740 2HH1 ARG 102 HH22 ARG 102 20.572 -12.446 -5.822 741 1HH2 ARG 102 HH11 ARG 102 18.338 -11.182 -8.150 742 2HH2 ARG 102 HH12 ARG 102 19.688 -12.235 -7.888 743 H TRP 103 HN TRP 103 14.809 -6.024 -3.977 744 HA TRP 103 HA TRP 103 12.517 -7.385 -2.696 745 1HB TRP 103 HB2 TRP 103 12.708 -5.285 -4.872 746 2HB TRP 103 HB1 TRP 103 11.187 -5.950 -4.279 747 HD1 TRP 103 HD1 TRP 103 13.461 -3.169 -3.688 748 HE1 TRP 103 HE1 TRP 103 13.040 -2.088 -1.384 749 HE3 TRP 103 HE3 TRP 103 10.560 -6.776 -1.539 750 HZ2 TRP 103 HZ2 TRP 103 11.657 -2.681 1.053 751 HZ3 TRP 103 HZ3 TRP 103 9.709 -6.497 0.768 752 HH2 TRP 103 HH2 TRP 103 10.249 -4.455 2.068 753 H THR 104 HN THR 104 11.183 -8.867 -3.757 754 HA THR 104 HA THR 104 12.036 -9.785 -6.485 755 HB THR 104 HB THR 104 11.589 -12.113 -5.767 756 HG1 THR 104 HG1 THR 104 11.643 -12.070 -3.233 757 1HG2 THR 104 HG21 THR 104 13.602 -10.517 -4.170 758 2HG2 THR 104 HG23 THR 104 13.535 -12.279 -4.121 759 3HG2 THR 104 HG22 THR 104 13.882 -11.451 -5.640 760 H ASN 105 HN ASN 105 10.298 -10.823 -7.688 761 HA ASN 105 HA ASN 105 7.579 -9.871 -6.843 762 1HB ASN 105 HB2 ASN 105 8.732 -10.448 -9.590 763 2HB ASN 105 HB1 ASN 105 7.049 -10.021 -9.286 764 1HD2 ASN 105 HD22 ASN 105 8.559 -6.770 -7.852 765 2HD2 ASN 105 HD21 ASN 105 8.004 -8.146 -7.028 766 H ASN 106 HN ASN 106 9.023 -12.432 -6.151 767 HA ASN 106 HA ASN 106 6.824 -14.264 -6.956 768 1HB ASN 106 HB2 ASN 106 8.709 -16.023 -7.354 769 2HB ASN 106 HB1 ASN 106 8.381 -14.844 -8.623 770 1HD2 ASN 106 HD22 ASN 106 11.793 -13.972 -8.556 771 2HD2 ASN 106 HD21 ASN 106 10.477 -14.512 -9.482 772 H PHE 107 HN PHE 107 7.868 -16.583 -5.839 773 HA PHE 107 HA PHE 107 7.395 -16.127 -3.036 774 1HB PHE 107 HB2 PHE 107 7.886 -18.534 -2.805 775 2HB PHE 107 HB1 PHE 107 6.811 -18.241 -4.175 776 HD1 PHE 107 HD1 PHE 107 10.237 -19.141 -3.155 777 HD2 PHE 107 HD2 PHE 107 7.596 -18.461 -6.474 778 HE1 PHE 107 HE1 PHE 107 11.887 -20.188 -4.683 779 HE2 PHE 107 HE2 PHE 107 9.244 -19.511 -8.001 780 HZ PHE 107 HZ PHE 107 11.391 -20.374 -7.104 781 H ARG 108 HN ARG 108 10.211 -15.673 -4.864 782 HA ARG 108 HA ARG 108 12.238 -16.711 -3.193 783 1HB ARG 108 HB2 ARG 108 12.263 -14.147 -4.808 784 2HB ARG 108 HB1 ARG 108 13.688 -14.890 -4.090 785 1HG ARG 108 HG2 ARG 108 13.280 -16.954 -5.380 786 2HG ARG 108 HG1 ARG 108 11.852 -16.218 -6.105 787 1HD ARG 108 HD2 ARG 108 13.255 -14.466 -7.117 788 2HD ARG 108 HD1 ARG 108 14.689 -15.175 -6.377 789 HE ARG 108 HE ARG 108 13.537 -17.260 -7.826 790 1HH1 ARG 108 HH21 ARG 108 14.619 -14.043 -8.455 791 2HH1 ARG 108 HH22 ARG 108 15.070 -14.378 -10.093 792 1HH2 ARG 108 HH11 ARG 108 14.124 -17.710 -9.954 793 2HH2 ARG 108 HH12 ARG 108 14.792 -16.454 -10.941 794 H GLU 109 HN GLU 109 13.778 -15.143 -1.976 795 HA GLU 109 HA GLU 109 13.563 -14.568 0.460 796 1HB GLU 109 HB2 GLU 109 13.922 -12.258 -1.453 797 2HB GLU 109 HB1 GLU 109 14.251 -12.153 0.276 798 1HG GLU 109 HG2 GLU 109 15.871 -14.002 0.087 799 2HG GLU 109 HG1 GLU 109 15.548 -14.110 -1.644 800 H TYR 110 HN TYR 110 12.211 -11.607 -0.860 801 HA TYR 110 HA TYR 110 9.819 -11.962 0.936 802 1HB TYR 110 HB2 TYR 110 11.296 -9.413 0.217 803 2HB TYR 110 HB1 TYR 110 9.872 -9.521 1.251 804 HD1 TYR 110 HD2 TYR 110 10.004 -10.868 3.393 805 HD2 TYR 110 HD1 TYR 110 13.472 -9.852 1.071 806 HE1 TYR 110 HE2 TYR 110 11.452 -11.353 5.346 807 HE2 TYR 110 HE1 TYR 110 14.925 -10.334 3.019 808 HH TYR 110 HH TYR 110 14.892 -10.631 5.308 809 H ASN 111 HN ASN 111 7.825 -11.460 0.096 810 HA ASN 111 HA ASN 111 7.634 -11.159 -2.814 811 1HB ASN 111 HB2 ASN 111 6.059 -12.608 -1.538 812 2HB ASN 111 HB1 ASN 111 5.457 -11.180 -0.697 813 1HD2 ASN 111 HD22 ASN 111 3.034 -11.396 -3.367 814 2HD2 ASN 111 HD21 ASN 111 3.341 -11.967 -1.799 815 H LEU 112 HN LEU 112 7.978 -9.132 -3.615 816 HA LEU 112 HA LEU 112 7.795 -6.719 -2.141 817 1HB LEU 112 HB2 LEU 112 9.016 -6.919 -4.280 818 2HB LEU 112 HB1 LEU 112 7.491 -7.142 -5.132 819 HG LEU 112 HG LEU 112 6.762 -4.882 -4.389 820 1HD1 LEU 112 HD12 LEU 112 9.442 -4.966 -3.016 821 2HD1 LEU 112 HD11 LEU 112 8.769 -3.421 -3.534 822 3HD1 LEU 112 HD13 LEU 112 7.889 -4.423 -2.382 823 1HD2 LEU 112 HD21 LEU 112 9.392 -5.136 -5.865 824 2HD2 LEU 112 HD23 LEU 112 7.773 -4.999 -6.552 825 3HD2 LEU 112 HD22 LEU 112 8.509 -3.613 -5.747 826 H HIS 113 HN HIS 113 5.390 -8.350 -4.186 827 HA HIS 113 HA HIS 113 3.441 -6.294 -4.175 828 1HB HIS 113 HB2 HIS 113 3.303 -8.277 -5.630 829 2HB HIS 113 HB1 HIS 113 3.010 -9.295 -4.219 830 HD1 HIS 113 HD1 HIS 113 0.586 -9.938 -4.655 831 HD2 HIS 113 HD2 HIS 113 1.208 -5.820 -4.824 832 HE1 HIS 113 HE1 HIS 113 -1.705 -8.870 -4.806 833 H ARG 114 HN ARG 114 3.885 -9.003 -1.860 834 HA ARG 114 HA ARG 114 1.600 -8.423 -0.273 835 1HB ARG 114 HB2 ARG 114 2.911 -10.508 -0.033 836 2HB ARG 114 HB1 ARG 114 4.252 -9.577 0.637 837 1HG ARG 114 HG2 ARG 114 2.974 -8.932 2.554 838 2HG ARG 114 HG1 ARG 114 1.478 -9.536 1.844 839 1HD ARG 114 HD2 ARG 114 2.264 -11.826 1.995 840 2HD ARG 114 HD1 ARG 114 3.858 -11.285 2.526 841 HE ARG 114 HE ARG 114 2.154 -10.214 4.420 842 1HH1 ARG 114 HH21 ARG 114 2.696 -13.337 3.053 843 2HH1 ARG 114 HH22 ARG 114 2.243 -14.189 4.491 844 1HH2 ARG 114 HH11 ARG 114 1.563 -11.313 6.302 845 2HH2 ARG 114 HH12 ARG 114 1.604 -13.044 6.330 846 H VAL 115 HN VAL 115 4.934 -7.180 -0.027 847 HA VAL 115 HA VAL 115 4.396 -5.621 2.343 848 HB VAL 115 HB VAL 115 6.565 -5.410 0.238 849 1HG1 VAL 115 HG11 VAL 115 6.088 -3.864 2.787 850 2HG1 VAL 115 HG13 VAL 115 7.718 -4.094 2.154 851 3HG1 VAL 115 HG12 VAL 115 6.509 -3.249 1.189 852 1HG2 VAL 115 HG22 VAL 115 6.351 -6.690 2.973 853 2HG2 VAL 115 HG21 VAL 115 6.805 -7.446 1.446 854 3HG2 VAL 115 HG23 VAL 115 7.909 -6.324 2.239 855 H ALA 116 HN ALA 116 4.324 -4.862 -1.142 856 HA ALA 116 HA ALA 116 3.917 -2.059 -0.894 857 1HB ALA 116 HB3 ALA 116 4.277 -3.422 -3.041 858 2HB ALA 116 HB2 ALA 116 2.553 -3.786 -2.971 859 3HB ALA 116 HB1 ALA 116 3.096 -2.116 -3.134 860 H ALA 117 HN ALA 117 1.586 -4.743 -0.898 861 HA ALA 117 HA ALA 117 -0.781 -3.179 -0.674 862 1HB ALA 117 HB2 ALA 117 -0.710 -5.647 -1.139 863 2HB ALA 117 HB1 ALA 117 -0.277 -5.907 0.551 864 3HB ALA 117 HB3 ALA 117 -1.843 -5.209 0.141 865 H HIS 118 HN HIS 118 1.502 -4.353 1.773 866 HA HIS 118 HA HIS 118 -0.015 -3.702 4.086 867 1HB HIS 118 HB2 HIS 118 2.113 -5.008 4.078 868 2HB HIS 118 HB1 HIS 118 2.990 -3.517 3.737 869 HD1 HIS 118 HD1 HIS 118 0.920 -5.175 6.416 870 HD2 HIS 118 HD2 HIS 118 3.376 -1.841 5.968 871 HE1 HIS 118 HE1 HIS 118 1.281 -4.239 8.739 872 H GLU 119 HN GLU 119 2.412 -1.700 2.345 873 HA GLU 119 HA GLU 119 2.067 0.608 3.997 874 1HB GLU 119 HB2 GLU 119 2.993 0.295 1.133 875 2HB GLU 119 HB1 GLU 119 2.991 1.847 1.975 876 1HG GLU 119 HG2 GLU 119 4.473 0.970 3.695 877 2HG GLU 119 HG1 GLU 119 4.397 -0.642 2.984 878 H LEU 120 HN LEU 120 0.405 -0.448 1.037 879 HA LEU 120 HA LEU 120 -1.165 1.927 0.709 880 1HB LEU 120 HB2 LEU 120 -1.730 -0.942 -0.097 881 2HB LEU 120 HB1 LEU 120 -2.679 0.445 -0.630 882 HG LEU 120 HG LEU 120 0.302 0.116 -1.095 883 1HD1 LEU 120 HD13 LEU 120 -1.010 -1.541 -2.358 884 2HD1 LEU 120 HD12 LEU 120 -2.037 -0.255 -2.991 885 3HD1 LEU 120 HD11 LEU 120 -0.334 -0.325 -3.441 886 1HD2 LEU 120 HD23 LEU 120 -1.710 2.264 -1.728 887 2HD2 LEU 120 HD22 LEU 120 -0.023 2.418 -1.238 888 3HD2 LEU 120 HD21 LEU 120 -0.418 1.962 -2.890 889 H GLY 121 HN GLY 121 -1.677 -1.052 2.568 890 1HA GLY 121 HA2 GLY 121 -4.365 -0.582 3.349 891 2HA GLY 121 HA1 GLY 121 -3.198 -1.503 4.301 892 H HIS 122 HN HIS 122 -1.307 0.587 4.749 893 HA HIS 122 HA HIS 122 -2.532 1.898 7.004 894 1HB HIS 122 HB2 HIS 122 0.109 2.293 5.578 895 2HB HIS 122 HB1 HIS 122 -0.362 3.269 6.971 896 HD1 HIS 122 HD1 HIS 122 -1.118 1.753 9.152 897 HD2 HIS 122 HD2 HIS 122 1.289 -0.104 6.300 898 HE1 HIS 122 HE1 HIS 122 -0.115 -0.281 10.278 899 H SER 123 HN SER 123 -1.732 2.954 3.712 900 HA SER 123 HA SER 123 -2.375 5.707 4.004 901 1HB SER 123 HB2 SER 123 -2.732 3.877 1.610 902 2HB SER 123 HB1 SER 123 -2.865 5.632 1.550 903 HG SER 123 HG SER 123 -0.716 4.371 1.179 904 H LEU 124 HN LEU 124 -4.383 2.854 3.678 905 HA LEU 124 HA LEU 124 -6.847 4.407 3.291 906 1HB LEU 124 HB2 LEU 124 -6.410 1.459 3.849 907 2HB LEU 124 HB1 LEU 124 -7.953 2.191 3.416 908 HG LEU 124 HG LEU 124 -5.463 2.348 1.690 909 1HD1 LEU 124 HD12 LEU 124 -7.833 0.462 1.570 910 2HD1 LEU 124 HD11 LEU 124 -6.655 0.655 0.271 911 3HD1 LEU 124 HD13 LEU 124 -6.145 0.027 1.838 912 1HD2 LEU 124 HD21 LEU 124 -8.338 3.225 1.382 913 2HD2 LEU 124 HD23 LEU 124 -6.860 4.110 1.004 914 3HD2 LEU 124 HD22 LEU 124 -7.394 2.802 -0.044 915 H GLY 125 HN GLY 125 -4.887 3.911 5.888 916 1HA GLY 125 HA2 GLY 125 -5.337 4.585 8.123 917 2HA GLY 125 HA1 GLY 125 -7.061 4.566 7.763 918 H LEU 126 HN LEU 126 -5.609 1.697 6.692 919 HA LEU 126 HA LEU 126 -6.942 0.179 8.800 920 1HB LEU 126 HB2 LEU 126 -5.077 -0.758 6.597 921 2HB LEU 126 HB1 LEU 126 -6.066 -1.804 7.614 922 HG LEU 126 HG LEU 126 -7.145 0.347 5.768 923 1HD1 LEU 126 HD11 LEU 126 -6.108 -1.632 4.619 924 2HD1 LEU 126 HD13 LEU 126 -7.240 -2.670 5.486 925 3HD1 LEU 126 HD12 LEU 126 -7.842 -1.482 4.329 926 1HD2 LEU 126 HD21 LEU 126 -8.402 -1.597 7.702 927 2HD2 LEU 126 HD23 LEU 126 -8.787 0.102 7.425 928 3HD2 LEU 126 HD22 LEU 126 -9.290 -1.114 6.257 929 H SER 127 HN SER 127 -5.992 -0.850 10.533 930 HA SER 127 HA SER 127 -3.104 -0.225 11.039 931 1HB SER 127 HB2 SER 127 -5.402 -0.799 12.926 932 2HB SER 127 HB1 SER 127 -3.724 -0.656 13.441 933 HG SER 127 HG SER 127 -4.479 1.368 13.623 934 H HIS 128 HN HIS 128 -2.083 -1.948 12.546 935 HA HIS 128 HA HIS 128 -2.027 -4.451 11.157 936 1HB HIS 128 HB2 HIS 128 -1.052 -3.760 13.947 937 2HB HIS 128 HB1 HIS 128 -0.622 -5.220 13.056 938 HD1 HIS 128 HD1 HIS 128 1.505 -3.078 13.910 939 HD2 HIS 128 HD2 HIS 128 -0.299 -3.247 10.155 940 HE1 HIS 128 HE1 HIS 128 3.067 -1.889 12.311 941 H SER 129 HN SER 129 -2.490 -6.594 12.277 942 HA SER 129 HA SER 129 -4.668 -6.508 14.278 943 1HB SER 129 HB2 SER 129 -5.771 -6.321 12.033 944 2HB SER 129 HB1 SER 129 -5.042 -7.861 11.589 945 HG SER 129 HG SER 129 -7.299 -7.530 12.799 946 H THR 130 HN THR 130 -5.219 -8.776 14.990 947 HA THR 130 HA THR 130 -2.732 -10.407 15.065 948 HB THR 130 HB THR 130 -3.829 -11.569 16.943 949 HG1 THR 130 HG1 THR 130 -5.870 -10.295 17.573 950 1HG2 THR 130 HG21 THR 130 -3.875 -8.546 17.019 951 2HG2 THR 130 HG23 THR 130 -4.083 -9.550 18.454 952 3HG2 THR 130 HG22 THR 130 -2.574 -9.615 17.543 953 H ASP 131 HN ASP 131 -5.117 -10.269 12.943 954 HA ASP 131 HA ASP 131 -6.017 -13.060 12.940 955 1HB ASP 131 HB2 ASP 131 -7.475 -11.253 12.083 956 2HB ASP 131 HB1 ASP 131 -6.289 -10.899 10.825 957 H ILE 132 HN ILE 132 -4.780 -14.674 12.172 958 HA ILE 132 HA ILE 132 -2.252 -14.318 10.929 959 HB ILE 132 HB ILE 132 -4.103 -16.716 10.828 960 1HG1 ILE 132 HG12 ILE 132 -1.771 -16.159 12.683 961 2HG1 ILE 132 HG11 ILE 132 -3.449 -15.836 13.119 962 1HG2 ILE 132 HG23 ILE 132 -1.170 -16.331 10.197 963 2HG2 ILE 132 HG22 ILE 132 -1.858 -17.914 10.557 964 3HG2 ILE 132 HG21 ILE 132 -2.423 -17.006 9.155 965 1HD1 ILE 132 HD13 ILE 132 -2.337 -18.535 12.293 966 2HD1 ILE 132 HD12 ILE 132 -2.724 -18.050 13.944 967 3HD1 ILE 132 HD11 ILE 132 -4.010 -18.206 12.746 968 H GLY 133 HN GLY 133 -5.456 -14.925 9.511 969 1HA GLY 133 HA2 GLY 133 -4.448 -15.191 6.813 970 2HA GLY 133 HA1 GLY 133 -6.137 -14.972 7.260 971 H ALA 134 HN ALA 134 -4.315 -12.502 8.669 972 HA ALA 134 HA ALA 134 -5.240 -10.612 6.556 973 1HB ALA 134 HB2 ALA 134 -4.323 -10.246 9.412 974 2HB ALA 134 HB1 ALA 134 -4.511 -8.883 8.312 975 3HB ALA 134 HB3 ALA 134 -5.902 -9.887 8.716 976 H LEU 135 HN LEU 135 -3.834 -9.397 5.345 977 HA LEU 135 HA LEU 135 -1.109 -10.313 5.068 978 1HB LEU 135 HB2 LEU 135 -2.445 -7.804 4.001 979 2HB LEU 135 HB1 LEU 135 -0.907 -8.458 3.440 980 HG LEU 135 HG LEU 135 -3.541 -9.964 3.334 981 1HD1 LEU 135 HD13 LEU 135 -3.442 -7.912 1.873 982 2HD1 LEU 135 HD12 LEU 135 -2.050 -8.627 1.061 983 3HD1 LEU 135 HD11 LEU 135 -3.621 -9.423 0.982 984 1HD2 LEU 135 HD23 LEU 135 -0.722 -10.539 2.408 985 2HD2 LEU 135 HD22 LEU 135 -1.834 -11.589 3.286 986 3HD2 LEU 135 HD21 LEU 135 -2.096 -11.267 1.576 987 H MET 136 HN MET 136 -2.660 -7.699 6.810 988 HA MET 136 HA MET 136 -0.250 -6.190 7.300 989 1HB MET 136 HB2 MET 136 -2.772 -6.206 8.972 990 2HB MET 136 HB1 MET 136 -1.579 -4.912 8.848 991 1HG MET 136 HG2 MET 136 -2.117 -4.798 6.370 992 2HG MET 136 HG1 MET 136 -3.466 -5.888 6.689 993 1HE MET 136 HE2 MET 136 -2.182 -2.459 6.465 994 2HE MET 136 HE1 MET 136 -2.972 -1.490 7.706 995 3HE MET 136 HE3 MET 136 -1.738 -2.677 8.156 996 H TYR 137 HN TYR 137 -0.427 -9.202 8.036 997 HA TYR 137 HA TYR 137 -0.239 -9.381 10.875 998 1HB TYR 137 HB2 TYR 137 -0.464 -11.271 9.108 999 2HB TYR 137 HB1 TYR 137 1.293 -11.187 9.001 1000 HD1 TYR 137 HD2 TYR 137 -1.438 -11.375 11.568 1001 HD2 TYR 137 HD1 TYR 137 2.564 -12.501 10.483 1002 HE1 TYR 137 HE2 TYR 137 -1.273 -12.762 13.617 1003 HE2 TYR 137 HE1 TYR 137 2.725 -13.890 12.534 1004 HH TYR 137 HH TYR 137 0.683 -13.618 15.105 1005 HA PRO 138 HA PRO 138 3.662 -7.232 11.375 1006 1HB PRO 138 HB2 PRO 138 4.455 -8.740 13.714 1007 2HB PRO 138 HB1 PRO 138 3.768 -7.111 13.652 1008 1HG PRO 138 HG2 PRO 138 2.459 -9.580 14.480 1009 2HG PRO 138 HG1 PRO 138 1.821 -7.930 14.537 1010 1HD PRO 138 HD2 PRO 138 1.030 -10.013 12.733 1011 2HD PRO 138 HD1 PRO 138 0.521 -8.310 12.699 1012 H SER 139 HN SER 139 3.758 -10.787 11.893 1013 HA SER 139 HA SER 139 6.568 -10.891 11.052 1014 1HB SER 139 HB2 SER 139 5.546 -12.429 12.776 1015 2HB SER 139 HB1 SER 139 4.668 -13.204 11.462 1016 HG SER 139 HG SER 139 6.561 -13.879 10.591 1017 H TYR 140 HN TYR 140 7.337 -11.453 9.077 1018 HA TYR 140 HA TYR 140 5.520 -11.482 6.802 1019 1HB TYR 140 HB2 TYR 140 7.785 -10.480 6.669 1020 2HB TYR 140 HB1 TYR 140 8.496 -12.070 6.947 1021 HD1 TYR 140 HD1 TYR 140 8.400 -13.818 5.229 1022 HD2 TYR 140 HD2 TYR 140 6.692 -9.936 4.562 1023 HE1 TYR 140 HE1 TYR 140 8.242 -14.304 2.801 1024 HE2 TYR 140 HE2 TYR 140 6.526 -10.423 2.137 1025 HH TYR 140 HH TYR 140 6.627 -12.074 0.583 1026 H THR 141 HN THR 141 4.880 -13.293 5.602 1027 HA THR 141 HA THR 141 6.073 -15.936 6.205 1028 HB THR 141 HB THR 141 3.823 -16.924 6.670 1029 HG1 THR 141 HG1 THR 141 2.105 -15.615 6.924 1030 1HG2 THR 141 HG23 THR 141 5.457 -16.076 8.469 1031 2HG2 THR 141 HG22 THR 141 4.368 -14.698 8.631 1032 3HG2 THR 141 HG21 THR 141 3.783 -16.329 8.961 1033 H PHE 142 HN PHE 142 5.412 -17.559 4.618 1034 HA PHE 142 HA PHE 142 4.909 -16.370 1.994 1035 1HB PHE 142 HB2 PHE 142 6.488 -18.259 2.279 1036 2HB PHE 142 HB1 PHE 142 5.159 -19.279 2.829 1037 HD1 PHE 142 HD2 PHE 142 6.037 -17.011 -0.030 1038 HD2 PHE 142 HD1 PHE 142 4.066 -20.612 1.239 1039 HE1 PHE 142 HE2 PHE 142 5.483 -17.539 -2.385 1040 HE2 PHE 142 HE1 PHE 142 3.514 -21.139 -1.121 1041 HZ PHE 142 HZ PHE 142 4.224 -19.603 -2.932 1042 H SER 143 HN SER 143 2.858 -15.872 1.406 1043 HA SER 143 HA SER 143 0.596 -17.552 2.437 1044 1HB SER 143 HB2 SER 143 -0.810 -15.587 1.953 1045 2HB SER 143 HB1 SER 143 0.506 -15.167 3.045 1046 HG SER 143 HG SER 143 0.438 -14.785 0.229 1047 H GLY 144 HN GLY 144 2.471 -17.548 -0.191 1048 1HA GLY 144 HA2 GLY 144 2.129 -18.316 -2.387 1049 2HA GLY 144 HA1 GLY 144 0.524 -18.830 -1.863 1050 H ASP 145 HN ASP 145 -1.131 -17.794 -2.853 1051 HA ASP 145 HA ASP 145 -0.615 -15.426 -4.484 1052 1HB ASP 145 HB2 ASP 145 -3.141 -16.966 -3.822 1053 2HB ASP 145 HB1 ASP 145 -3.111 -15.564 -4.894 1054 H VAL 146 HN VAL 146 -1.767 -13.374 -4.173 1055 HA VAL 146 HA VAL 146 -2.072 -12.722 -1.280 1056 HB VAL 146 HB VAL 146 -1.855 -10.935 -3.721 1057 1HG1 VAL 146 HG11 VAL 146 -1.983 -10.351 -0.751 1058 2HG1 VAL 146 HG13 VAL 146 -1.434 -9.175 -1.945 1059 3HG1 VAL 146 HG12 VAL 146 -3.088 -9.784 -2.002 1060 1HG2 VAL 146 HG23 VAL 146 0.123 -11.791 -1.589 1061 2HG2 VAL 146 HG22 VAL 146 0.247 -12.049 -3.329 1062 3HG2 VAL 146 HG21 VAL 146 0.398 -10.422 -2.666 1063 H GLN 147 HN GLN 147 -4.117 -12.781 -0.507 1064 HA GLN 147 HA GLN 147 -6.341 -11.734 -2.222 1065 1HB GLN 147 HB2 GLN 147 -6.311 -14.301 -0.606 1066 2HB GLN 147 HB1 GLN 147 -7.784 -13.558 -1.231 1067 1HG GLN 147 HG2 GLN 147 -6.892 -13.713 -3.528 1068 2HG GLN 147 HG1 GLN 147 -5.422 -14.462 -2.903 1069 1HE2 GLN 147 HE22 GLN 147 -8.028 -17.109 -1.659 1070 2HE2 GLN 147 HE21 GLN 147 -7.479 -15.744 -0.812 1071 H LEU 148 HN LEU 148 -7.924 -10.590 -1.027 1072 HA LEU 148 HA LEU 148 -7.061 -9.637 1.589 1073 1HB LEU 148 HB2 LEU 148 -9.685 -9.197 0.126 1074 2HB LEU 148 HB1 LEU 148 -9.133 -8.301 1.539 1075 HG LEU 148 HG LEU 148 -7.698 -8.392 -1.132 1076 1HD1 LEU 148 HD11 LEU 148 -9.496 -6.331 0.168 1077 2HD1 LEU 148 HD13 LEU 148 -8.406 -5.943 -1.164 1078 3HD1 LEU 148 HD12 LEU 148 -9.706 -7.112 -1.399 1079 1HD2 LEU 148 HD23 LEU 148 -7.096 -7.125 1.539 1080 2HD2 LEU 148 HD22 LEU 148 -6.004 -7.949 0.425 1081 3HD2 LEU 148 HD21 LEU 148 -6.563 -6.320 0.062 1082 H ALA 149 HN ALA 149 -8.131 -10.022 3.585 1083 HA ALA 149 HA ALA 149 -9.731 -12.558 3.649 1084 1HB ALA 149 HB2 ALA 149 -7.577 -12.510 4.917 1085 2HB ALA 149 HB1 ALA 149 -8.219 -11.189 5.894 1086 3HB ALA 149 HB3 ALA 149 -8.979 -12.779 5.952 1087 H GLN 150 HN GLN 150 -11.354 -12.585 5.521 1088 HA GLN 150 HA GLN 150 -13.273 -10.517 5.169 1089 1HB GLN 150 HB2 GLN 150 -13.850 -12.770 6.013 1090 2HB GLN 150 HB1 GLN 150 -12.972 -12.432 7.505 1091 1HG GLN 150 HG2 GLN 150 -14.491 -10.616 8.050 1092 2HG GLN 150 HG1 GLN 150 -15.310 -10.787 6.498 1093 1HE2 GLN 150 HE22 GLN 150 -17.505 -12.674 8.704 1094 2HE2 GLN 150 HE21 GLN 150 -17.187 -11.074 8.236 1095 H ASP 151 HN ASP 151 -10.783 -11.010 7.649 1096 HA ASP 151 HA ASP 151 -11.511 -8.921 9.415 1097 1HB ASP 151 HB2 ASP 151 -9.739 -10.575 9.909 1098 2HB ASP 151 HB1 ASP 151 -8.723 -9.856 8.659 1099 H ASP 152 HN ASP 152 -9.430 -8.816 6.507 1100 HA ASP 152 HA ASP 152 -8.946 -5.959 6.777 1101 1HB ASP 152 HB2 ASP 152 -8.494 -7.920 4.514 1102 2HB ASP 152 HB1 ASP 152 -8.040 -6.218 4.422 1103 H ILE 153 HN ILE 153 -11.140 -7.959 4.805 1104 HA ILE 153 HA ILE 153 -12.184 -5.835 3.216 1105 HB ILE 153 HB ILE 153 -13.466 -8.422 4.144 1106 1HG1 ILE 153 HG12 ILE 153 -12.327 -7.664 1.440 1107 2HG1 ILE 153 HG11 ILE 153 -11.369 -8.462 2.685 1108 1HG2 ILE 153 HG23 ILE 153 -14.365 -6.321 2.162 1109 2HG2 ILE 153 HG22 ILE 153 -14.952 -7.983 2.106 1110 3HG2 ILE 153 HG21 ILE 153 -15.271 -6.982 3.523 1111 1HD1 ILE 153 HD13 ILE 153 -14.008 -9.575 1.718 1112 2HD1 ILE 153 HD12 ILE 153 -12.472 -10.000 0.964 1113 3HD1 ILE 153 HD11 ILE 153 -12.764 -10.399 2.657 1114 H ASP 154 HN ASP 154 -13.390 -7.193 6.309 1115 HA ASP 154 HA ASP 154 -15.590 -5.397 6.585 1116 1HB ASP 154 HB2 ASP 154 -13.903 -6.815 8.664 1117 2HB ASP 154 HB1 ASP 154 -15.353 -5.892 9.059 1118 H GLY 155 HN GLY 155 -12.190 -5.099 7.587 1119 1HA GLY 155 HA2 GLY 155 -12.452 -2.690 9.076 1120 2HA GLY 155 HA1 GLY 155 -10.968 -3.230 8.295 1121 H ILE 156 HN ILE 156 -11.456 -3.076 5.642 1122 HA ILE 156 HA ILE 156 -11.479 -0.228 5.187 1123 HB ILE 156 HB ILE 156 -10.179 -1.843 3.797 1124 1HG1 ILE 156 HG12 ILE 156 -10.740 -0.816 1.602 1125 2HG1 ILE 156 HG11 ILE 156 -12.225 -0.171 2.298 1126 1HG2 ILE 156 HG23 ILE 156 -12.036 -3.553 3.740 1127 2HG2 ILE 156 HG22 ILE 156 -12.855 -2.531 2.559 1128 3HG2 ILE 156 HG21 ILE 156 -11.284 -3.237 2.179 1129 1HD1 ILE 156 HD12 ILE 156 -9.625 0.436 3.673 1130 2HD1 ILE 156 HD11 ILE 156 -10.016 1.300 2.188 1131 3HD1 ILE 156 HD13 ILE 156 -11.096 1.406 3.575 1132 H GLN 157 HN GLN 157 -13.859 -2.809 4.641 1133 HA GLN 157 HA GLN 157 -15.786 -1.086 3.342 1134 1HB GLN 157 HB2 GLN 157 -16.087 -3.725 4.800 1135 2HB GLN 157 HB1 GLN 157 -17.419 -2.911 3.979 1136 1HG GLN 157 HG2 GLN 157 -16.157 -2.977 1.860 1137 2HG GLN 157 HG1 GLN 157 -14.827 -3.795 2.681 1138 1HE2 GLN 157 HE22 GLN 157 -16.995 -6.419 1.131 1139 2HE2 GLN 157 HE21 GLN 157 -16.085 -5.116 0.537 1140 H ALA 158 HN ALA 158 -15.126 -1.980 6.702 1141 HA ALA 158 HA ALA 158 -17.496 -0.926 7.866 1142 1HB ALA 158 HB1 ALA 158 -14.673 -1.234 8.902 1143 2HB ALA 158 HB3 ALA 158 -15.962 -0.568 9.906 1144 3HB ALA 158 HB2 ALA 158 -16.088 -2.214 9.285 1145 H ILE 159 HN ILE 159 -14.430 0.648 6.982 1146 HA ILE 159 HA ILE 159 -15.100 3.219 8.089 1147 HB ILE 159 HB ILE 159 -13.279 2.438 5.791 1148 1HG1 ILE 159 HG12 ILE 159 -12.560 3.266 8.611 1149 2HG1 ILE 159 HG11 ILE 159 -12.806 1.581 8.153 1150 1HG2 ILE 159 HG21 ILE 159 -13.676 5.067 7.241 1151 2HG2 ILE 159 HG23 ILE 159 -12.234 4.701 6.295 1152 3HG2 ILE 159 HG22 ILE 159 -13.810 4.762 5.509 1153 1HD1 ILE 159 HD12 ILE 159 -10.872 3.424 6.730 1154 2HD1 ILE 159 HD11 ILE 159 -10.400 2.353 8.049 1155 3HD1 ILE 159 HD13 ILE 159 -11.019 1.677 6.543 1156 H TYR 160 HN TYR 160 -15.332 1.920 4.769 1157 HA TYR 160 HA TYR 160 -17.059 4.214 3.993 1158 1HB TYR 160 HB2 TYR 160 -15.713 1.999 2.428 1159 2HB TYR 160 HB1 TYR 160 -16.872 3.108 1.698 1160 HD1 TYR 160 HD2 TYR 160 -16.380 5.531 1.549 1161 HD2 TYR 160 HD1 TYR 160 -13.490 2.729 3.055 1162 HE1 TYR 160 HE2 TYR 160 -14.591 7.227 1.273 1163 HE2 TYR 160 HE1 TYR 160 -11.702 4.430 2.783 1164 HH TYR 160 HH TYR 160 -12.221 7.375 1.052 1165 H GLY 161 HN GLY 161 -17.189 0.756 3.140 1166 1HA GLY 161 HA2 GLY 161 -19.431 -0.134 4.444 1167 2HA GLY 161 HA1 GLY 161 -20.113 0.836 3.136 1168 H ARG 162 HN ARG 162 -20.963 -1.440 2.580 1169 HA ARG 162 HA ARG 162 -18.964 -3.215 1.315 1170 1HB ARG 162 HB2 ARG 162 -21.973 -3.384 1.637 1171 2HB ARG 162 HB1 ARG 162 -21.019 -4.594 0.781 1172 1HG ARG 162 HG2 ARG 162 -19.633 -4.864 2.871 1173 2HG ARG 162 HG1 ARG 162 -20.784 -3.812 3.697 1174 1HD ARG 162 HD2 ARG 162 -22.618 -5.391 2.996 1175 2HD ARG 162 HD1 ARG 162 -21.374 -6.482 2.388 1176 HE ARG 162 HE ARG 162 -20.623 -5.973 5.019 1177 1HH1 ARG 162 HH21 ARG 162 -23.439 -7.089 3.365 1178 2HH1 ARG 162 HH22 ARG 162 -23.975 -8.087 4.675 1179 1HH2 ARG 162 HH11 ARG 162 -21.307 -7.271 6.738 1180 2HH2 ARG 162 HH12 ARG 162 -22.766 -8.192 6.585 1181 H SER 163 HN SER 163 -18.883 -3.597 -0.948 1182 HA SER 163 HA SER 163 -19.696 -1.340 -2.601 1183 1HB SER 163 HB2 SER 163 -18.621 -4.015 -3.529 1184 2HB SER 163 HB1 SER 163 -18.566 -2.483 -4.396 1185 HG SER 163 HG SER 163 -16.593 -3.047 -3.290 1186 H GLN 164 HN GLN 164 -22.073 -1.700 -1.996 1187 HA GLN 164 HA GLN 164 -23.405 -3.979 -3.267 1188 1HB GLN 164 HB2 GLN 164 -24.532 -1.469 -1.991 1189 2HB GLN 164 HB1 GLN 164 -25.487 -2.860 -2.508 1190 1HG GLN 164 HG2 GLN 164 -23.231 -2.998 -0.486 1191 2HG GLN 164 HG1 GLN 164 -24.941 -2.895 -0.063 1192 1HE2 GLN 164 HE22 GLN 164 -23.579 -6.507 -0.538 1193 2HE2 GLN 164 HE21 GLN 164 -22.770 -5.162 0.107 1194 H ASN 165 HN ASN 165 -23.641 -3.992 -5.432 1195 HA ASN 165 HA ASN 165 -24.910 -1.753 -6.774 1196 1HB ASN 165 HB2 ASN 165 -22.029 -2.428 -7.373 1197 2HB ASN 165 HB1 ASN 165 -23.062 -1.597 -8.531 1198 1HD2 ASN 165 HD22 ASN 165 -21.497 0.459 -5.432 1199 2HD2 ASN 165 HD21 ASN 165 -21.084 -1.157 -5.743 1200 HA PRO 166 HA PRO 166 -24.435 -5.496 -9.784 1201 1HB PRO 166 HB2 PRO 166 -24.326 -7.895 -8.123 1202 2HB PRO 166 HB1 PRO 166 -23.187 -7.374 -9.374 1203 1HG PRO 166 HG2 PRO 166 -22.680 -7.392 -6.588 1204 2HG PRO 166 HG1 PRO 166 -21.702 -6.570 -7.814 1205 1HD PRO 166 HD2 PRO 166 -23.597 -5.419 -5.868 1206 2HD PRO 166 HD1 PRO 166 -22.310 -4.604 -6.780 1207 H VAL 167 HN VAL 167 -26.604 -5.030 -10.120 1208 HA VAL 167 HA VAL 167 -28.653 -5.834 -8.190 1209 HB VAL 167 HB VAL 167 -30.190 -4.988 -10.044 1210 1HG1 VAL 167 HG13 VAL 167 -29.358 -3.600 -8.129 1211 2HG1 VAL 167 HG12 VAL 167 -28.011 -3.084 -9.144 1212 3HG1 VAL 167 HG11 VAL 167 -29.664 -2.661 -9.589 1213 1HG2 VAL 167 HG22 VAL 167 -28.441 -5.449 -11.837 1214 2HG2 VAL 167 HG21 VAL 167 -29.210 -3.865 -11.922 1215 3HG2 VAL 167 HG23 VAL 167 -27.587 -4.022 -11.251 1216 H GLN 168 HN GLN 168 -30.239 -7.453 -8.575 1217 HA GLN 168 HA GLN 168 -29.281 -9.714 -10.142 1218 1HB GLN 168 HB2 GLN 168 -31.861 -9.287 -8.599 1219 2HB GLN 168 HB1 GLN 168 -31.350 -10.826 -9.282 1220 1HG GLN 168 HG2 GLN 168 -29.454 -10.951 -7.832 1221 2HG GLN 168 HG1 GLN 168 -29.647 -9.271 -7.330 1222 1HE2 GLN 168 HE22 GLN 168 -31.356 -11.945 -5.035 1223 2HE2 GLN 168 HE21 GLN 168 -29.944 -12.143 -5.954 1224 HA PRO 169 HA PRO 169 -31.426 -8.773 -13.916 1225 1HB PRO 169 HB2 PRO 169 -32.461 -11.437 -14.371 1226 2HB PRO 169 HB1 PRO 169 -31.045 -10.684 -15.118 1227 1HG PRO 169 HG2 PRO 169 -31.112 -12.731 -13.031 1228 2HG PRO 169 HG1 PRO 169 -29.711 -12.108 -13.915 1229 1HD PRO 169 HD2 PRO 169 -30.346 -11.591 -11.191 1230 2HD PRO 169 HD1 PRO 169 -29.103 -10.774 -12.157 No H/Q in entry = 1230 Start of MODEL 21 1 1H VAL 1 HT2 VAL 1 7.196 16.223 42.625 2 2H VAL 1 HT1 VAL 1 7.908 15.715 41.170 3 3H VAL 1 HT3 VAL 1 8.854 16.473 42.355 4 HA VAL 1 HA VAL 1 8.505 18.174 40.841 5 HB VAL 1 HB VAL 1 6.890 16.973 39.445 6 1HG1 VAL 1 HG12 VAL 1 5.602 16.039 41.396 7 2HG1 VAL 1 HG11 VAL 1 4.841 17.620 41.581 8 3HG1 VAL 1 HG13 VAL 1 4.583 16.683 40.108 9 1HG2 VAL 1 HG23 VAL 1 7.007 19.546 39.472 10 2HG2 VAL 1 HG22 VAL 1 5.563 18.825 38.762 11 3HG2 VAL 1 HG21 VAL 1 5.505 19.487 40.395 12 H LEU 2 HN LEU 2 8.169 20.264 41.690 13 HA LEU 2 HA LEU 2 6.905 20.356 44.373 14 1HB LEU 2 HB2 LEU 2 7.751 22.865 44.114 15 2HB LEU 2 HB1 LEU 2 8.887 21.572 44.485 16 HG LEU 2 HG LEU 2 8.357 22.100 41.577 17 1HD1 LEU 2 HD13 LEU 2 10.030 23.924 43.331 18 2HD1 LEU 2 HD12 LEU 2 10.060 23.920 41.568 19 3HD1 LEU 2 HD11 LEU 2 8.588 24.377 42.423 20 1HD2 LEU 2 HD22 LEU 2 10.844 21.489 43.215 21 2HD2 LEU 2 HD21 LEU 2 9.924 20.331 42.254 22 3HD2 LEU 2 HD23 LEU 2 10.804 21.635 41.459 23 H THR 3 HN THR 3 6.056 21.008 41.137 24 HA THR 3 HA THR 3 4.015 23.039 41.884 25 HB THR 3 HB THR 3 3.694 23.310 39.490 26 HG1 THR 3 HG1 THR 3 3.921 21.488 38.458 27 1HG2 THR 3 HG22 THR 3 5.677 24.382 40.579 28 2HG2 THR 3 HG21 THR 3 6.651 23.000 40.079 29 3HG2 THR 3 HG23 THR 3 5.924 24.052 38.863 30 H GLU 4 HN GLU 4 1.751 22.672 41.314 31 HA GLU 4 HA GLU 4 0.865 19.985 41.957 32 1HB GLU 4 HB2 GLU 4 -0.384 22.065 42.586 33 2HB GLU 4 HB1 GLU 4 -0.763 22.309 40.883 34 1HG GLU 4 HG2 GLU 4 -2.011 20.248 40.789 35 2HG GLU 4 HG1 GLU 4 -1.472 19.787 42.404 36 H GLY 5 HN GLY 5 0.522 18.337 40.542 37 1HA GLY 5 HA2 GLY 5 0.010 17.235 38.517 38 2HA GLY 5 HA1 GLY 5 -0.452 18.798 37.838 39 H ASN 6 HN ASN 6 0.794 17.862 35.911 40 HA ASN 6 HA ASN 6 3.679 17.666 36.166 41 1HB ASN 6 HB2 ASN 6 1.819 17.792 33.783 42 2HB ASN 6 HB1 ASN 6 3.565 17.663 33.610 43 1HD2 ASN 6 HD22 ASN 6 3.471 14.384 35.392 44 2HD2 ASN 6 HD21 ASN 6 4.228 15.878 35.664 45 HA PRO 7 HA PRO 7 4.689 21.970 35.860 46 1HB PRO 7 HB2 PRO 7 6.755 21.634 33.830 47 2HB PRO 7 HB1 PRO 7 6.960 21.945 35.560 48 1HG PRO 7 HG2 PRO 7 7.408 19.455 34.153 49 2HG PRO 7 HG1 PRO 7 7.622 19.776 35.879 50 1HD PRO 7 HD2 PRO 7 5.553 18.196 34.656 51 2HD PRO 7 HD1 PRO 7 5.718 18.613 36.373 52 H ARG 8 HN ARG 8 2.823 22.757 34.836 53 HA ARG 8 HA ARG 8 3.029 23.172 31.886 54 1HB ARG 8 HB2 ARG 8 0.664 22.014 33.390 55 2HB ARG 8 HB1 ARG 8 0.527 22.696 31.770 56 1HG ARG 8 HG2 ARG 8 2.125 21.076 30.901 57 2HG ARG 8 HG1 ARG 8 2.425 20.452 32.525 58 1HD ARG 8 HD2 ARG 8 0.843 19.009 31.270 59 2HD ARG 8 HD1 ARG 8 0.092 19.711 32.698 60 HE ARG 8 HE ARG 8 -0.475 21.498 30.619 61 1HH1 ARG 8 HH21 ARG 8 -0.926 18.146 31.302 62 2HH1 ARG 8 HH22 ARG 8 -2.378 18.014 30.368 63 1HH2 ARG 8 HH11 ARG 8 -2.371 21.343 29.396 64 2HH2 ARG 8 HH12 ARG 8 -3.196 19.823 29.288 65 H TRP 9 HN TRP 9 2.356 25.227 31.278 66 HA TRP 9 HA TRP 9 1.910 27.197 33.344 67 1HB TRP 9 HB2 TRP 9 1.615 27.307 30.329 68 2HB TRP 9 HB1 TRP 9 1.369 28.706 31.370 69 HD1 TRP 9 HD1 TRP 9 4.070 26.403 30.012 70 HE1 TRP 9 HE1 TRP 9 6.383 27.428 30.511 71 HE3 TRP 9 HE3 TRP 9 2.689 30.267 33.056 72 HZ2 TRP 9 HZ2 TRP 9 7.506 29.601 32.008 73 HZ3 TRP 9 HZ3 TRP 9 4.396 31.795 34.000 74 HH2 TRP 9 HH2 TRP 9 6.797 31.467 33.481 75 H GLU 10 HN GLU 10 -0.033 28.025 34.102 76 HA GLU 10 HA GLU 10 -2.430 26.473 33.611 77 1HB GLU 10 HB2 GLU 10 -2.002 29.076 35.104 78 2HB GLU 10 HB1 GLU 10 -3.516 28.173 35.092 79 1HG GLU 10 HG2 GLU 10 -2.357 26.208 36.035 80 2HG GLU 10 HG1 GLU 10 -0.842 27.113 36.054 81 H GLN 11 HN GLN 11 -1.246 29.622 32.491 82 HA GLN 11 HA GLN 11 -3.789 30.209 31.123 83 1HB GLN 11 HB2 GLN 11 -1.103 31.617 31.049 84 2HB GLN 11 HB1 GLN 11 -2.583 32.218 30.304 85 1HG GLN 11 HG2 GLN 11 -3.683 32.257 32.511 86 2HG GLN 11 HG1 GLN 11 -2.199 31.659 33.257 87 1HE2 GLN 11 HE22 GLN 11 -2.467 35.515 33.170 88 2HE2 GLN 11 HE21 GLN 11 -3.680 34.368 33.470 89 H THR 12 HN THR 12 -4.063 30.218 28.846 90 HA THR 12 HA THR 12 -2.242 28.393 27.375 91 HB THR 12 HB THR 12 -3.977 28.412 25.644 92 HG1 THR 12 HG1 THR 12 -5.010 30.233 25.534 93 1HG2 THR 12 HG22 THR 12 -5.041 28.143 28.464 94 2HG2 THR 12 HG21 THR 12 -5.903 27.587 27.031 95 3HG2 THR 12 HG23 THR 12 -4.353 26.865 27.463 96 H HIS 13 HN HIS 13 -2.509 31.646 27.968 97 HA HIS 13 HA HIS 13 -1.179 32.403 25.386 98 1HB HIS 13 HB2 HIS 13 -2.877 34.090 27.260 99 2HB HIS 13 HB1 HIS 13 -2.037 34.697 25.833 100 HD1 HIS 13 HD1 HIS 13 -4.506 31.876 26.596 101 HD2 HIS 13 HD2 HIS 13 -3.695 34.701 23.640 102 HE1 HIS 13 HE1 HIS 13 -6.311 31.613 24.839 103 H LEU 14 HN LEU 14 0.884 33.171 25.649 104 HA LEU 14 HA LEU 14 1.752 33.966 28.414 105 1HB LEU 14 HB2 LEU 14 3.324 32.404 26.346 106 2HB LEU 14 HB1 LEU 14 3.925 32.917 27.923 107 HG LEU 14 HG LEU 14 1.530 31.103 27.491 108 1HD1 LEU 14 HD12 LEU 14 3.651 30.032 26.828 109 2HD1 LEU 14 HD11 LEU 14 4.354 30.455 28.390 110 3HD1 LEU 14 HD13 LEU 14 3.014 29.311 28.305 111 1HD2 LEU 14 HD21 LEU 14 2.875 32.289 29.916 112 2HD2 LEU 14 HD23 LEU 14 1.158 32.055 29.593 113 3HD2 LEU 14 HD22 LEU 14 2.163 30.682 30.043 114 H THR 15 HN THR 15 3.581 35.437 28.442 115 HA THR 15 HA THR 15 3.812 37.122 25.964 116 HB THR 15 HB THR 15 3.886 39.091 27.370 117 HG1 THR 15 HG1 THR 15 4.087 37.152 29.366 118 1HG2 THR 15 HG23 THR 15 1.606 37.200 27.933 119 2HG2 THR 15 HG22 THR 15 1.644 38.807 28.649 120 3HG2 THR 15 HG21 THR 15 1.631 38.625 26.895 121 H TYR 16 HN TYR 16 5.908 38.131 25.696 122 HA TYR 16 HA TYR 16 8.043 37.252 27.572 123 1HB TYR 16 HB2 TYR 16 9.392 36.244 25.851 124 2HB TYR 16 HB1 TYR 16 7.800 35.496 25.778 125 HD1 TYR 16 HD2 TYR 16 6.184 36.139 23.995 126 HD2 TYR 16 HD1 TYR 16 10.217 37.617 24.064 127 HE1 TYR 16 HE2 TYR 16 5.972 36.829 21.623 128 HE2 TYR 16 HE1 TYR 16 10.006 38.303 21.694 129 HH TYR 16 HH TYR 16 7.962 38.947 20.141 130 H ARG 17 HN ARG 17 10.023 38.470 27.305 131 HA ARG 17 HA ARG 17 9.882 40.864 25.534 132 1HB ARG 17 HB2 ARG 17 8.808 41.516 27.677 133 2HB ARG 17 HB1 ARG 17 10.255 41.008 28.545 134 1HG ARG 17 HG2 ARG 17 11.586 42.691 27.311 135 2HG ARG 17 HG1 ARG 17 10.140 43.202 26.445 136 1HD ARG 17 HD2 ARG 17 9.088 43.684 28.684 137 2HD ARG 17 HD1 ARG 17 10.648 43.379 29.432 138 HE ARG 17 HE ARG 17 9.789 45.813 28.166 139 1HH1 ARG 17 HH21 ARG 17 12.564 43.737 28.298 140 2HH1 ARG 17 HH22 ARG 17 13.646 44.971 27.750 141 1HH2 ARG 17 HH11 ARG 17 11.194 47.395 27.482 142 2HH2 ARG 17 HH12 ARG 17 12.877 47.033 27.298 143 H ILE 18 HN ILE 18 11.916 41.514 24.867 144 HA ILE 18 HA ILE 18 14.232 39.933 25.854 145 HB ILE 18 HB ILE 18 14.004 41.929 23.574 146 1HG1 ILE 18 HG12 ILE 18 14.380 38.927 23.444 147 2HG1 ILE 18 HG11 ILE 18 12.785 39.679 23.397 148 1HG2 ILE 18 HG21 ILE 18 16.277 40.235 24.631 149 2HG2 ILE 18 HG23 ILE 18 16.241 40.786 22.955 150 3HG2 ILE 18 HG22 ILE 18 16.274 41.961 24.269 151 1HD1 ILE 18 HD13 ILE 18 13.487 41.016 21.433 152 2HD1 ILE 18 HD12 ILE 18 15.060 40.219 21.464 153 3HD1 ILE 18 HD11 ILE 18 13.604 39.285 21.116 154 H GLU 19 HN GLU 19 15.345 40.777 27.525 155 HA GLU 19 HA GLU 19 14.893 43.400 28.550 156 1HB GLU 19 HB2 GLU 19 15.729 41.434 29.858 157 2HB GLU 19 HB1 GLU 19 17.286 41.617 29.053 158 1HG GLU 19 HG2 GLU 19 17.491 43.902 29.942 159 2HG GLU 19 HG1 GLU 19 15.922 43.740 30.734 160 H ASN 20 HN ASN 20 17.531 42.127 26.494 161 HA ASN 20 HA ASN 20 18.028 44.814 25.493 162 1HB ASN 20 HB2 ASN 20 19.180 44.935 27.674 163 2HB ASN 20 HB1 ASN 20 20.148 43.527 27.237 164 1HD2 ASN 20 HD22 ASN 20 22.531 45.565 25.661 165 2HD2 ASN 20 HD21 ASN 20 22.194 44.184 26.588 166 H TYR 21 HN TYR 21 19.407 44.814 23.669 167 HA TYR 21 HA TYR 21 19.843 42.121 22.473 168 1HB TYR 21 HB2 TYR 21 19.878 44.908 21.273 169 2HB TYR 21 HB1 TYR 21 20.135 43.420 20.365 170 HD1 TYR 21 HD2 TYR 21 17.669 45.462 22.197 171 HD2 TYR 21 HD1 TYR 21 18.315 41.867 19.938 172 HE1 TYR 21 HE2 TYR 21 15.217 45.175 21.953 173 HE2 TYR 21 HE1 TYR 21 15.869 41.579 19.695 174 HH TYR 21 HH TYR 21 13.681 43.953 20.180 175 H THR 22 HN THR 22 21.897 41.362 22.059 176 HA THR 22 HA THR 22 24.154 42.818 23.170 177 HB THR 22 HB THR 22 24.282 40.473 23.452 178 HG1 THR 22 HG1 THR 22 26.079 39.900 22.105 179 1HG2 THR 22 HG21 THR 22 23.404 40.389 20.569 180 2HG2 THR 22 HG23 THR 22 24.217 39.002 21.295 181 3HG2 THR 22 HG22 THR 22 22.695 39.584 21.970 182 HA PRO 23 HA PRO 23 25.236 44.894 19.352 183 1HB PRO 23 HB2 PRO 23 28.062 44.938 19.774 184 2HB PRO 23 HB1 PRO 23 26.911 46.211 20.208 185 1HG PRO 23 HG2 PRO 23 28.290 44.304 21.976 186 2HG PRO 23 HG1 PRO 23 27.399 45.772 22.408 187 1HD PRO 23 HD2 PRO 23 26.507 43.093 22.795 188 2HD PRO 23 HD1 PRO 23 25.534 44.571 22.961 189 H ASP 24 HN ASP 24 25.921 41.729 20.102 190 HA ASP 24 HA ASP 24 27.864 41.002 18.126 191 1HB ASP 24 HB2 ASP 24 25.599 39.430 19.384 192 2HB ASP 24 HB1 ASP 24 26.790 38.713 18.299 193 H LEU 25 HN LEU 25 24.333 41.254 18.028 194 HA LEU 25 HA LEU 25 24.467 41.408 15.067 195 1HB LEU 25 HB2 LEU 25 22.686 39.545 16.669 196 2HB LEU 25 HB1 LEU 25 22.414 39.907 14.972 197 HG LEU 25 HG LEU 25 25.021 38.767 16.018 198 1HD1 LEU 25 HD13 LEU 25 22.501 37.399 15.082 199 2HD1 LEU 25 HD12 LEU 25 24.075 36.614 14.955 200 3HD1 LEU 25 HD11 LEU 25 23.451 37.085 16.536 201 1HD2 LEU 25 HD22 LEU 25 23.816 39.212 13.279 202 2HD2 LEU 25 HD21 LEU 25 25.407 39.688 13.869 203 3HD2 LEU 25 HD23 LEU 25 25.064 37.995 13.531 204 HA PRO 26 HA PRO 26 21.684 44.756 15.896 205 1HB PRO 26 HB2 PRO 26 19.970 44.444 13.627 206 2HB PRO 26 HB1 PRO 26 21.391 45.489 13.747 207 1HG PRO 26 HG2 PRO 26 21.110 42.931 12.319 208 2HG PRO 26 HG1 PRO 26 22.390 44.144 12.174 209 1HD PRO 26 HD2 PRO 26 22.629 41.624 13.454 210 2HD PRO 26 HD1 PRO 26 23.774 42.976 13.579 211 H ARG 27 HN ARG 27 19.464 45.134 16.586 212 HA ARG 27 HA ARG 27 18.217 42.830 17.787 213 1HB ARG 27 HB2 ARG 27 16.446 44.439 18.449 214 2HB ARG 27 HB1 ARG 27 18.055 45.064 18.799 215 1HG ARG 27 HG2 ARG 27 18.002 46.355 16.682 216 2HG ARG 27 HG1 ARG 27 16.365 45.766 16.380 217 1HD ARG 27 HD2 ARG 27 16.277 47.992 17.413 218 2HD ARG 27 HD1 ARG 27 15.624 46.785 18.520 219 HE ARG 27 HE ARG 27 18.314 46.942 19.196 220 1HH1 ARG 27 HH21 ARG 27 15.677 49.143 18.853 221 2HH1 ARG 27 HH22 ARG 27 16.266 50.241 20.056 222 1HH2 ARG 27 HH11 ARG 27 19.093 48.361 20.769 223 2HH2 ARG 27 HH12 ARG 27 18.201 49.799 21.140 224 H ALA 28 HN ALA 28 17.726 44.590 14.789 225 HA ALA 28 HA ALA 28 15.125 43.653 14.116 226 1HB ALA 28 HB2 ALA 28 17.466 44.243 12.280 227 2HB ALA 28 HB1 ALA 28 15.779 44.120 11.780 228 3HB ALA 28 HB3 ALA 28 16.287 45.424 12.853 229 H ASP 29 HN ASP 29 18.327 42.183 13.620 230 HA ASP 29 HA ASP 29 17.253 39.905 12.160 231 1HB ASP 29 HB2 ASP 29 19.929 40.420 13.484 232 2HB ASP 29 HB1 ASP 29 19.555 38.932 12.613 233 H VAL 30 HN VAL 30 18.151 40.560 15.519 234 HA VAL 30 HA VAL 30 17.834 37.843 16.424 235 HB VAL 30 HB VAL 30 17.793 40.507 17.855 236 1HG1 VAL 30 HG11 VAL 30 17.534 37.689 18.917 237 2HG1 VAL 30 HG13 VAL 30 18.206 38.986 19.906 238 3HG1 VAL 30 HG12 VAL 30 16.553 39.103 19.305 239 1HG2 VAL 30 HG22 VAL 30 19.913 39.661 16.756 240 2HG2 VAL 30 HG21 VAL 30 20.042 39.913 18.495 241 3HG2 VAL 30 HG23 VAL 30 19.851 38.282 17.852 242 H ASP 31 HN ASP 31 15.608 40.652 16.361 243 HA ASP 31 HA ASP 31 13.493 39.384 17.788 244 1HB ASP 31 HB2 ASP 31 13.440 41.483 15.601 245 2HB ASP 31 HB1 ASP 31 11.994 40.952 16.458 246 H HIS 32 HN HIS 32 14.314 39.395 14.337 247 HA HIS 32 HA HIS 32 12.072 37.896 13.422 248 1HB HIS 32 HB2 HIS 32 13.659 39.060 11.912 249 2HB HIS 32 HB1 HIS 32 14.908 37.891 12.337 250 HD1 HIS 32 HD1 HIS 32 11.273 37.644 11.182 251 HD2 HIS 32 HD2 HIS 32 14.987 35.907 10.427 252 HE1 HIS 32 HE1 HIS 32 10.892 35.884 9.402 253 H ALA 33 HN ALA 33 15.320 36.802 14.411 254 HA ALA 33 HA ALA 33 14.873 34.020 14.066 255 1HB ALA 33 HB2 ALA 33 16.659 35.483 16.033 256 2HB ALA 33 HB1 ALA 33 16.759 33.757 15.688 257 3HB ALA 33 HB3 ALA 33 17.107 34.931 14.419 258 H ILE 34 HN ILE 34 14.513 36.016 17.024 259 HA ILE 34 HA ILE 34 13.517 33.819 18.616 260 HB ILE 34 HB ILE 34 13.178 36.815 18.984 261 1HG1 ILE 34 HG12 ILE 34 15.543 36.238 18.907 262 2HG1 ILE 34 HG11 ILE 34 15.095 36.566 20.576 263 1HG2 ILE 34 HG22 ILE 34 12.783 34.474 20.857 264 2HG2 ILE 34 HG21 ILE 34 12.933 36.142 21.411 265 3HG2 ILE 34 HG23 ILE 34 11.590 35.677 20.367 266 1HD1 ILE 34 HD11 ILE 34 14.697 33.959 20.678 267 2HD1 ILE 34 HD13 ILE 34 15.760 33.945 19.272 268 3HD1 ILE 34 HD12 ILE 34 16.331 34.605 20.803 269 H GLU 35 HN GLU 35 11.924 36.462 16.837 270 HA GLU 35 HA GLU 35 9.246 35.880 17.598 271 1HB GLU 35 HB2 GLU 35 9.962 37.954 16.429 272 2HB GLU 35 HB1 GLU 35 10.243 37.015 14.965 273 1HG GLU 35 HG2 GLU 35 7.912 36.440 14.799 274 2HG GLU 35 HG1 GLU 35 7.570 37.129 16.385 275 H LYS 36 HN LYS 36 11.135 34.726 14.804 276 HA LYS 36 HA LYS 36 9.091 33.165 13.603 277 1HB LYS 36 HB2 LYS 36 11.207 33.702 12.470 278 2HB LYS 36 HB1 LYS 36 12.085 32.686 13.613 279 1HG LYS 36 HG2 LYS 36 11.028 30.702 12.813 280 2HG LYS 36 HG1 LYS 36 9.826 31.620 11.909 281 1HD LYS 36 HD2 LYS 36 11.550 30.741 10.391 282 2HD LYS 36 HD1 LYS 36 11.614 32.502 10.442 283 1HE LYS 36 HE2 LYS 36 13.336 30.881 12.311 284 2HE LYS 36 HE1 LYS 36 13.846 31.150 10.644 285 1HZ LYS 36 HZ3 LYS 36 12.966 33.593 11.588 286 2HZ LYS 36 HZ2 LYS 36 13.917 32.938 12.835 287 3HZ LYS 36 HZ1 LYS 36 14.567 33.128 11.276 288 H ALA 37 HN ALA 37 11.390 32.355 16.175 289 HA ALA 37 HA ALA 37 10.860 29.565 16.262 290 1HB ALA 37 HB3 ALA 37 12.715 30.756 17.471 291 2HB ALA 37 HB2 ALA 37 11.517 31.342 18.626 292 3HB ALA 37 HB1 ALA 37 11.827 29.611 18.477 293 H PHE 38 HN PHE 38 9.238 32.255 18.026 294 HA PHE 38 HA PHE 38 7.481 30.578 19.527 295 1HB PHE 38 HB2 PHE 38 7.261 33.426 18.555 296 2HB PHE 38 HB1 PHE 38 5.921 32.668 19.410 297 HD1 PHE 38 HD2 PHE 38 6.512 31.467 21.661 298 HD2 PHE 38 HD1 PHE 38 8.988 34.437 19.792 299 HE1 PHE 38 HE2 PHE 38 7.623 31.908 23.833 300 HE2 PHE 38 HE1 PHE 38 10.097 34.877 21.967 301 HZ PHE 38 HZ PHE 38 9.414 33.614 23.985 302 H GLN 39 HN GLN 39 7.107 31.951 16.242 303 HA GLN 39 HA GLN 39 4.431 31.019 15.865 304 1HB GLN 39 HB2 GLN 39 6.669 31.690 13.956 305 2HB GLN 39 HB1 GLN 39 5.167 30.999 13.347 306 1HG GLN 39 HG2 GLN 39 4.897 33.370 13.219 307 2HG GLN 39 HG1 GLN 39 3.949 32.864 14.613 308 1HE2 GLN 39 HE22 GLN 39 5.959 34.619 16.937 309 2HE2 GLN 39 HE21 GLN 39 4.656 33.552 16.717 310 H LEU 40 HN LEU 40 7.544 29.390 15.329 311 HA LEU 40 HA LEU 40 6.500 27.088 14.034 312 1HB LEU 40 HB2 LEU 40 8.879 27.382 15.884 313 2HB LEU 40 HB1 LEU 40 8.540 25.928 14.949 314 HG LEU 40 HG LEU 40 8.944 28.691 13.761 315 1HD1 LEU 40 HD13 LEU 40 10.968 27.554 14.854 316 2HD1 LEU 40 HD12 LEU 40 10.824 26.330 13.593 317 3HD1 LEU 40 HD11 LEU 40 11.144 28.008 13.159 318 1HD2 LEU 40 HD22 LEU 40 8.264 25.989 12.624 319 2HD2 LEU 40 HD21 LEU 40 7.701 27.585 12.131 320 3HD2 LEU 40 HD23 LEU 40 9.314 27.046 11.683 321 H TRP 41 HN TRP 41 6.997 27.685 17.537 322 HA TRP 41 HA TRP 41 5.922 25.098 18.280 323 1HB TRP 41 HB2 TRP 41 6.366 27.655 19.840 324 2HB TRP 41 HB1 TRP 41 5.774 26.164 20.575 325 HD1 TRP 41 HD1 TRP 41 8.895 27.906 19.667 326 HE1 TRP 41 HE1 TRP 41 10.922 26.330 19.914 327 HE3 TRP 41 HE3 TRP 41 6.477 23.438 20.162 328 HZ2 TRP 41 HZ2 TRP 41 11.444 23.538 20.270 329 HZ3 TRP 41 HZ3 TRP 41 7.760 21.337 20.456 330 HH2 TRP 41 HH2 TRP 41 10.239 21.382 20.510 331 H SER 42 HN SER 42 4.539 28.364 18.053 332 HA SER 42 HA SER 42 1.959 27.634 19.122 333 1HB SER 42 HB2 SER 42 2.659 29.963 19.096 334 2HB SER 42 HB1 SER 42 2.801 29.934 17.340 335 HG SER 42 HG SER 42 0.658 30.447 18.813 336 H ASN 43 HN ASN 43 3.261 27.836 15.829 337 HA ASN 43 HA ASN 43 0.910 27.528 14.349 338 1HB ASN 43 HB2 ASN 43 3.694 26.459 13.864 339 2HB ASN 43 HB1 ASN 43 2.396 26.293 12.680 340 1HD2 ASN 43 HD22 ASN 43 2.516 30.225 13.244 341 2HD2 ASN 43 HD21 ASN 43 1.700 29.135 14.255 342 H VAL 44 HN VAL 44 2.604 25.097 16.255 343 HA VAL 44 HA VAL 44 0.703 23.004 15.255 344 HB VAL 44 HB VAL 44 2.317 21.432 16.445 345 1HG1 VAL 44 HG13 VAL 44 3.163 23.160 14.108 346 2HG1 VAL 44 HG12 VAL 44 4.080 21.742 14.618 347 3HG1 VAL 44 HG11 VAL 44 2.418 21.563 14.059 348 1HG2 VAL 44 HG22 VAL 44 3.316 23.319 17.829 349 2HG2 VAL 44 HG21 VAL 44 4.492 22.268 17.040 350 3HG2 VAL 44 HG23 VAL 44 4.128 23.853 16.363 351 H THR 45 HN THR 45 0.587 25.213 17.615 352 HA THR 45 HA THR 45 -0.921 23.375 19.373 353 HB THR 45 HB THR 45 0.201 24.458 21.404 354 HG1 THR 45 HG1 THR 45 2.363 24.896 19.688 355 1HG2 THR 45 HG22 THR 45 0.628 22.129 20.636 356 2HG2 THR 45 HG21 THR 45 1.927 22.731 19.609 357 3HG2 THR 45 HG23 THR 45 2.052 22.873 21.359 358 HA PRO 46 HA PRO 46 -3.612 26.931 19.511 359 1HB PRO 46 HB2 PRO 46 -4.761 26.477 22.064 360 2HB PRO 46 HB1 PRO 46 -5.357 25.832 20.528 361 1HG PRO 46 HG2 PRO 46 -3.902 24.427 22.687 362 2HG PRO 46 HG1 PRO 46 -4.873 23.747 21.371 363 1HD PRO 46 HD2 PRO 46 -2.040 23.727 21.521 364 2HD PRO 46 HD1 PRO 46 -3.022 23.368 20.082 365 H LEU 47 HN LEU 47 -0.843 26.689 21.226 366 HA LEU 47 HA LEU 47 -1.289 28.703 23.282 367 1HB LEU 47 HB2 LEU 47 1.306 27.704 22.068 368 2HB LEU 47 HB1 LEU 47 1.175 28.699 23.514 369 HG LEU 47 HG LEU 47 -0.098 25.959 23.226 370 1HD1 LEU 47 HD13 LEU 47 2.498 26.799 24.556 371 2HD1 LEU 47 HD12 LEU 47 1.765 25.201 24.695 372 3HD1 LEU 47 HD11 LEU 47 2.344 25.774 23.130 373 1HD2 LEU 47 HD23 LEU 47 0.203 27.952 25.486 374 2HD2 LEU 47 HD22 LEU 47 -1.250 27.112 24.948 375 3HD2 LEU 47 HD21 LEU 47 -0.002 26.233 25.823 376 H THR 48 HN THR 48 -0.692 30.881 23.227 377 HA THR 48 HA THR 48 0.115 32.000 20.557 378 HB THR 48 HB THR 48 -1.428 33.853 20.897 379 HG1 THR 48 HG1 THR 48 -1.862 34.261 22.899 380 1HG2 THR 48 HG23 THR 48 -2.775 31.185 21.393 381 2HG2 THR 48 HG22 THR 48 -3.589 32.640 20.822 382 3HG2 THR 48 HG21 THR 48 -2.366 31.864 19.818 383 H PHE 49 HN PHE 49 1.567 33.748 20.705 384 HA PHE 49 HA PHE 49 2.532 34.438 23.469 385 1HB PHE 49 HB2 PHE 49 4.132 34.089 20.916 386 2HB PHE 49 HB1 PHE 49 4.787 34.672 22.448 387 HD1 PHE 49 HD1 PHE 49 3.379 31.757 20.675 388 HD2 PHE 49 HD2 PHE 49 5.080 33.185 24.351 389 HE1 PHE 49 HE1 PHE 49 3.669 29.419 21.448 390 HE2 PHE 49 HE2 PHE 49 5.366 30.849 25.127 391 HZ PHE 49 HZ PHE 49 4.665 28.963 23.674 392 H THR 50 HN THR 50 2.738 36.603 23.890 393 HA THR 50 HA THR 50 2.231 38.516 21.629 394 HB THR 50 HB THR 50 1.423 38.797 24.541 395 HG1 THR 50 HG1 THR 50 -0.685 38.600 23.582 396 1HG2 THR 50 HG21 THR 50 0.920 40.514 22.092 397 2HG2 THR 50 HG23 THR 50 0.149 40.755 23.659 398 3HG2 THR 50 HG22 THR 50 1.893 40.955 23.496 399 H LYS 51 HN LYS 51 3.763 40.017 21.314 400 HA LYS 51 HA LYS 51 6.138 40.082 22.999 401 1HB LYS 51 HB2 LYS 51 6.285 40.387 20.547 402 2HB LYS 51 HB1 LYS 51 5.301 41.841 20.669 403 1HG LYS 51 HG2 LYS 51 7.658 42.456 20.499 404 2HG LYS 51 HG1 LYS 51 7.056 42.886 22.095 405 1HD LYS 51 HD2 LYS 51 8.185 41.084 23.136 406 2HD LYS 51 HD1 LYS 51 8.414 40.237 21.607 407 1HE LYS 51 HE2 LYS 51 9.978 41.977 20.860 408 2HE LYS 51 HE1 LYS 51 9.713 42.873 22.355 409 1HZ LYS 51 HZ1 LYS 51 10.589 40.992 23.595 410 2HZ LYS 51 HZ3 LYS 51 10.850 40.136 22.153 411 3HZ LYS 51 HZ2 LYS 51 11.730 41.556 22.469 412 H VAL 52 HN VAL 52 6.513 41.502 24.667 413 HA VAL 52 HA VAL 52 4.720 43.909 24.897 414 HB VAL 52 HB VAL 52 4.604 43.569 27.303 415 1HG1 VAL 52 HG12 VAL 52 3.949 41.078 25.700 416 2HG1 VAL 52 HG11 VAL 52 3.361 41.385 27.334 417 3HG1 VAL 52 HG13 VAL 52 2.881 42.448 26.011 418 1HG2 VAL 52 HG22 VAL 52 6.492 41.288 26.694 419 2HG2 VAL 52 HG21 VAL 52 6.690 42.593 27.864 420 3HG2 VAL 52 HG23 VAL 52 5.523 41.307 28.168 421 H SER 53 HN SER 53 5.871 45.755 25.073 422 HA SER 53 HA SER 53 8.809 45.567 25.439 423 1HB SER 53 HB2 SER 53 7.697 46.909 23.574 424 2HB SER 53 HB1 SER 53 7.183 48.041 24.822 425 HG SER 53 HG SER 53 9.623 47.780 25.376 426 H GLU 54 HN GLU 54 6.155 46.013 27.431 427 HA GLU 54 HA GLU 54 7.876 47.222 29.524 428 1HB GLU 54 HB2 GLU 54 5.244 48.418 28.605 429 2HB GLU 54 HB1 GLU 54 6.008 48.812 30.143 430 1HG GLU 54 HG2 GLU 54 8.029 49.581 28.930 431 2HG GLU 54 HG1 GLU 54 7.232 49.224 27.399 432 H GLY 55 HN GLY 55 6.872 46.996 31.685 433 1HA GLY 55 HA2 GLY 55 5.426 45.943 33.251 434 2HA GLY 55 HA1 GLY 55 4.525 45.234 31.909 435 H GLN 56 HN GLN 56 5.059 43.514 33.909 436 HA GLN 56 HA GLN 56 7.624 42.150 33.448 437 1HB GLN 56 HB2 GLN 56 6.616 42.250 35.712 438 2HB GLN 56 HB1 GLN 56 5.239 41.316 35.126 439 1HG GLN 56 HG2 GLN 56 6.744 39.448 34.544 440 2HG GLN 56 HG1 GLN 56 8.126 40.382 35.118 441 1HE2 GLN 56 HE22 GLN 56 7.657 39.043 38.333 442 2HE2 GLN 56 HE21 GLN 56 8.726 39.397 37.063 443 H ALA 57 HN ALA 57 7.861 40.139 32.439 444 HA ALA 57 HA ALA 57 5.485 39.133 30.897 445 1HB ALA 57 HB3 ALA 57 7.353 40.294 29.569 446 2HB ALA 57 HB2 ALA 57 8.362 38.913 29.995 447 3HB ALA 57 HB1 ALA 57 6.897 38.675 29.042 448 H ASP 58 HN ASP 58 5.253 36.892 30.789 449 HA ASP 58 HA ASP 58 6.171 35.353 32.990 450 1HB ASP 58 HB2 ASP 58 5.072 34.542 30.291 451 2HB ASP 58 HB1 ASP 58 5.378 33.390 31.593 452 H ILE 59 HN ILE 59 7.386 35.521 29.634 453 HA ILE 59 HA ILE 59 9.741 33.854 30.471 454 HB ILE 59 HB ILE 59 8.657 34.470 27.706 455 1HG1 ILE 59 HG12 ILE 59 8.692 31.847 29.226 456 2HG1 ILE 59 HG11 ILE 59 7.291 32.918 29.181 457 1HG2 ILE 59 HG23 ILE 59 10.983 32.803 28.692 458 2HG2 ILE 59 HG22 ILE 59 10.291 32.623 27.080 459 3HG2 ILE 59 HG21 ILE 59 11.031 34.152 27.557 460 1HD1 ILE 59 HD11 ILE 59 7.319 32.779 26.687 461 2HD1 ILE 59 HD13 ILE 59 8.637 31.614 26.797 462 3HD1 ILE 59 HD12 ILE 59 7.049 31.214 27.453 463 H MET 60 HN MET 60 11.382 35.198 31.085 464 HA MET 60 HA MET 60 11.783 37.771 29.622 465 1HB MET 60 HB2 MET 60 13.102 36.728 32.151 466 2HB MET 60 HB1 MET 60 13.322 38.331 31.457 467 1HG MET 60 HG2 MET 60 10.623 37.242 32.293 468 2HG MET 60 HG1 MET 60 11.636 38.227 33.345 469 1HE MET 60 HE2 MET 60 12.826 40.451 32.268 470 2HE MET 60 HE1 MET 60 11.609 41.695 31.998 471 3HE MET 60 HE3 MET 60 11.545 40.689 33.452 472 H ILE 61 HN ILE 61 13.496 38.021 28.260 473 HA ILE 61 HA ILE 61 15.522 35.807 28.077 474 HB ILE 61 HB ILE 61 14.374 37.608 25.920 475 1HG1 ILE 61 HG12 ILE 61 14.298 34.590 26.170 476 2HG1 ILE 61 HG11 ILE 61 13.000 35.638 26.744 477 1HG2 ILE 61 HG22 ILE 61 16.694 35.677 25.924 478 2HG2 ILE 61 HG21 ILE 61 15.804 36.023 24.443 479 3HG2 ILE 61 HG23 ILE 61 16.630 37.324 25.297 480 1HD1 ILE 61 HD11 ILE 61 14.046 35.573 23.896 481 2HD1 ILE 61 HD13 ILE 61 12.558 34.799 24.444 482 3HD1 ILE 61 HD12 ILE 61 12.707 36.556 24.487 483 H SER 62 HN SER 62 17.622 36.454 28.417 484 HA SER 62 HA SER 62 18.371 39.269 27.853 485 1HB SER 62 HB2 SER 62 19.270 39.648 30.085 486 2HB SER 62 HB1 SER 62 17.559 39.253 30.209 487 HG SER 62 HG SER 62 19.199 37.061 30.237 488 H PHE 63 HN PHE 63 20.690 39.586 27.896 489 HA PHE 63 HA PHE 63 22.205 37.055 27.370 490 1HB PHE 63 HB2 PHE 63 22.553 39.886 26.343 491 2HB PHE 63 HB1 PHE 63 23.740 38.608 26.087 492 HD1 PHE 63 HD2 PHE 63 23.210 36.638 24.730 493 HD2 PHE 63 HD1 PHE 63 20.393 39.846 25.199 494 HE1 PHE 63 HE2 PHE 63 21.886 35.750 22.833 495 HE2 PHE 63 HE1 PHE 63 19.063 38.949 23.296 496 HZ PHE 63 HZ PHE 63 19.815 36.907 22.117 497 H VAL 64 HN VAL 64 24.133 36.709 28.475 498 HA VAL 64 HA VAL 64 25.045 38.839 30.373 499 HB VAL 64 HB VAL 64 25.294 37.063 32.121 500 1HG1 VAL 64 HG11 VAL 64 23.320 38.587 32.018 501 2HG1 VAL 64 HG13 VAL 64 22.479 37.389 31.035 502 3HG1 VAL 64 HG12 VAL 64 22.917 37.012 32.701 503 1HG2 VAL 64 HG23 VAL 64 25.337 35.135 30.569 504 2HG2 VAL 64 HG22 VAL 64 24.069 34.947 31.781 505 3HG2 VAL 64 HG21 VAL 64 23.658 35.448 30.140 506 H ARG 65 HN ARG 65 27.222 38.345 31.271 507 HA ARG 65 HA ARG 65 28.902 36.702 29.403 508 1HB ARG 65 HB2 ARG 65 29.422 39.469 30.527 509 2HB ARG 65 HB1 ARG 65 30.678 38.474 29.788 510 1HG ARG 65 HG2 ARG 65 29.407 38.372 27.703 511 2HG ARG 65 HG1 ARG 65 28.102 39.311 28.429 512 1HD ARG 65 HD2 ARG 65 30.955 40.295 28.141 513 2HD ARG 65 HD1 ARG 65 29.654 40.689 27.020 514 HE ARG 65 HE ARG 65 28.663 41.402 29.526 515 1HH1 ARG 65 HH21 ARG 65 31.413 42.103 27.572 516 2HH1 ARG 65 HH22 ARG 65 31.647 43.687 28.233 517 1HH2 ARG 65 HH11 ARG 65 28.951 43.465 30.404 518 2HH2 ARG 65 HH12 ARG 65 30.253 44.458 29.837 519 H GLY 66 HN GLY 66 30.464 35.467 30.396 520 1HA GLY 66 HA2 GLY 66 31.309 34.184 32.189 521 2HA GLY 66 HA1 GLY 66 31.844 35.768 32.741 522 H ASP 67 HN ASP 67 31.472 35.651 34.919 523 HA ASP 67 HA ASP 67 29.141 34.364 36.067 524 1HB ASP 67 HB2 ASP 67 31.344 34.553 37.226 525 2HB ASP 67 HB1 ASP 67 31.088 36.294 37.362 526 H HIS 68 HN HIS 68 27.175 35.232 36.469 527 HA HIS 68 HA HIS 68 26.874 38.211 36.539 528 1HB HIS 68 HB2 HIS 68 24.737 37.936 35.254 529 2HB HIS 68 HB1 HIS 68 26.176 37.546 34.314 530 HD1 HIS 68 HD1 HIS 68 26.745 34.928 34.095 531 HD2 HIS 68 HD2 HIS 68 22.929 35.828 35.500 532 HE1 HIS 68 HE1 HIS 68 25.385 32.801 33.889 533 H ARG 69 HN ARG 69 27.021 37.047 38.893 534 HA ARG 69 HA ARG 69 25.883 36.572 40.883 535 1HB ARG 69 HB2 ARG 69 23.768 38.133 39.378 536 2HB ARG 69 HB1 ARG 69 23.594 37.641 41.063 537 1HG ARG 69 HG2 ARG 69 25.666 38.850 41.633 538 2HG ARG 69 HG1 ARG 69 25.842 39.345 39.948 539 1HD ARG 69 HD2 ARG 69 23.657 40.512 40.080 540 2HD ARG 69 HD1 ARG 69 23.523 40.045 41.773 541 HE ARG 69 HE ARG 69 25.977 41.356 41.594 542 1HH1 ARG 69 HH21 ARG 69 22.686 42.024 40.807 543 2HH1 ARG 69 HH22 ARG 69 22.823 43.725 41.097 544 1HH2 ARG 69 HH11 ARG 69 26.175 43.575 41.974 545 2HH2 ARG 69 HH12 ARG 69 24.798 44.603 41.758 546 H ASP 70 HN ASP 70 26.003 34.315 39.514 547 HA ASP 70 HA ASP 70 23.334 33.089 39.965 548 1HB ASP 70 HB2 ASP 70 23.386 31.912 37.823 549 2HB ASP 70 HB1 ASP 70 23.449 33.652 37.541 550 H ASN 71 HN ASN 71 23.544 30.640 39.878 551 HA ASN 71 HA ASN 71 26.025 29.864 41.302 552 1HB ASN 71 HB2 ASN 71 23.356 28.506 40.868 553 2HB ASN 71 HB1 ASN 71 24.719 27.706 41.652 554 1HD2 ASN 71 HD22 ASN 71 24.609 30.386 44.304 555 2HD2 ASN 71 HD21 ASN 71 25.753 29.963 43.123 556 H SER 72 HN SER 72 25.351 30.124 38.159 557 HA SER 72 HA SER 72 26.976 27.707 37.451 558 1HB SER 72 HB2 SER 72 24.554 28.698 35.921 559 2HB SER 72 HB1 SER 72 25.590 27.351 35.459 560 HG SER 72 HG SER 72 23.498 27.364 37.103 561 HA PRO 73 HA PRO 73 28.505 31.731 35.624 562 1HB PRO 73 HB2 PRO 73 31.180 31.038 36.486 563 2HB PRO 73 HB1 PRO 73 30.166 32.364 37.074 564 1HG PRO 73 HG2 PRO 73 30.860 29.951 38.488 565 2HG PRO 73 HG1 PRO 73 29.794 31.251 39.040 566 1HD PRO 73 HD2 PRO 73 29.049 28.582 38.114 567 2HD PRO 73 HD1 PRO 73 28.010 29.842 38.805 568 H PHE 74 HN PHE 74 29.453 31.724 33.527 569 HA PHE 74 HA PHE 74 29.821 29.102 32.304 570 1HB PHE 74 HB2 PHE 74 30.361 31.866 31.171 571 2HB PHE 74 HB1 PHE 74 30.324 30.368 30.244 572 HD1 PHE 74 HD1 PHE 74 28.191 29.096 29.989 573 HD2 PHE 74 HD2 PHE 74 28.343 32.944 31.890 574 HE1 PHE 74 HE1 PHE 74 25.733 29.317 29.739 575 HE2 PHE 74 HE2 PHE 74 25.888 33.160 31.644 576 HZ PHE 74 HZ PHE 74 24.582 31.350 30.568 577 H ASP 75 HN ASP 75 31.731 28.058 31.926 578 HA ASP 75 HA ASP 75 34.226 29.368 32.913 579 1HB ASP 75 HB2 ASP 75 33.610 27.138 33.838 580 2HB ASP 75 HB1 ASP 75 33.698 26.463 32.210 581 H GLY 76 HN GLY 76 33.758 30.581 30.669 582 1HA GLY 76 HA2 GLY 76 34.931 31.061 28.671 583 2HA GLY 76 HA1 GLY 76 35.737 29.497 28.796 584 HA PRO 77 HA PRO 77 32.442 29.438 25.438 585 1HB PRO 77 HB2 PRO 77 34.446 28.206 23.718 586 2HB PRO 77 HB1 PRO 77 33.630 29.761 23.504 587 1HG PRO 77 HG2 PRO 77 36.369 29.346 24.250 588 2HG PRO 77 HG1 PRO 77 35.506 30.891 24.183 589 1HD PRO 77 HD2 PRO 77 36.331 29.388 26.548 590 2HD PRO 77 HD1 PRO 77 35.614 31.010 26.466 591 H GLY 78 HN GLY 78 34.062 27.391 27.445 592 1HA GLY 78 HA2 GLY 78 33.216 24.864 26.122 593 2HA GLY 78 HA1 GLY 78 34.190 24.987 27.588 594 H GLY 79 HN GLY 79 32.207 23.232 27.827 595 1HA GLY 79 HA2 GLY 79 30.450 22.714 29.308 596 2HA GLY 79 HA1 GLY 79 30.523 24.375 29.893 597 H ASN 80 HN ASN 80 28.153 24.382 29.865 598 HA ASN 80 HA ASN 80 26.691 23.986 27.396 599 1HB ASN 80 HB2 ASN 80 25.962 25.342 30.005 600 2HB ASN 80 HB1 ASN 80 24.835 25.172 28.660 601 1HD2 ASN 80 HD22 ASN 80 25.209 22.108 31.156 602 2HD2 ASN 80 HD21 ASN 80 25.650 23.707 31.519 603 H LEU 81 HN LEU 81 25.784 25.608 26.032 604 HA LEU 81 HA LEU 81 27.396 28.092 25.905 605 1HB LEU 81 HB2 LEU 81 25.228 27.111 24.021 606 2HB LEU 81 HB1 LEU 81 26.413 28.377 23.700 607 HG LEU 81 HG LEU 81 26.985 25.431 24.136 608 1HD1 LEU 81 HD11 LEU 81 27.095 27.273 21.741 609 2HD1 LEU 81 HD13 LEU 81 27.964 25.739 21.784 610 3HD1 LEU 81 HD12 LEU 81 26.205 25.759 21.912 611 1HD2 LEU 81 HD23 LEU 81 28.782 27.853 24.016 612 2HD2 LEU 81 HD22 LEU 81 28.858 26.464 25.098 613 3HD2 LEU 81 HD21 LEU 81 29.367 26.299 23.419 614 H ALA 82 HN ALA 82 24.580 27.108 27.373 615 HA ALA 82 HA ALA 82 23.807 29.754 28.156 616 1HB ALA 82 HB2 ALA 82 22.961 29.855 25.813 617 2HB ALA 82 HB1 ALA 82 21.999 28.411 26.116 618 3HB ALA 82 HB3 ALA 82 21.643 29.903 26.981 619 H HIS 83 HN HIS 83 21.418 29.547 29.180 620 HA HIS 83 HA HIS 83 20.568 26.884 29.893 621 1HB HIS 83 HB2 HIS 83 21.146 26.946 32.291 622 2HB HIS 83 HB1 HIS 83 22.590 26.923 31.285 623 HD1 HIS 83 HD1 HIS 83 22.936 28.026 34.062 624 HD2 HIS 83 HD2 HIS 83 21.792 30.441 30.862 625 HE1 HIS 83 HE1 HIS 83 23.557 30.400 34.691 626 H ALA 84 HN ALA 84 18.765 26.957 31.464 627 HA ALA 84 HA ALA 84 17.619 29.664 31.912 628 1HB ALA 84 HB3 ALA 84 16.328 27.424 30.337 629 2HB ALA 84 HB2 ALA 84 15.399 28.746 31.046 630 3HB ALA 84 HB1 ALA 84 16.616 29.085 29.817 631 H PHE 85 HN PHE 85 15.635 29.480 33.320 632 HA PHE 85 HA PHE 85 16.170 27.489 35.458 633 1HB PHE 85 HB2 PHE 85 14.419 29.963 35.347 634 2HB PHE 85 HB1 PHE 85 14.578 28.918 36.760 635 HD1 PHE 85 HD2 PHE 85 16.281 31.346 34.585 636 HD2 PHE 85 HD1 PHE 85 16.647 28.819 38.037 637 HE1 PHE 85 HE2 PHE 85 18.363 32.527 35.228 638 HE2 PHE 85 HE1 PHE 85 18.732 29.996 38.679 639 HZ PHE 85 HZ PHE 85 19.589 31.853 37.275 640 H GLN 86 HN GLN 86 14.256 26.447 36.481 641 HA GLN 86 HA GLN 86 12.640 25.160 34.501 642 1HB GLN 86 HB2 GLN 86 12.581 25.250 37.517 643 2HB GLN 86 HB1 GLN 86 11.342 24.379 36.615 644 1HG GLN 86 HG2 GLN 86 13.090 22.805 37.185 645 2HG GLN 86 HG1 GLN 86 13.192 23.114 35.453 646 1HE2 GLN 86 HE22 GLN 86 16.161 24.506 37.920 647 2HE2 GLN 86 HE21 GLN 86 14.674 24.031 38.585 648 HA PRO 87 HA PRO 87 9.437 28.183 34.060 649 1HB PRO 87 HB2 PRO 87 7.199 26.397 33.975 650 2HB PRO 87 HB1 PRO 87 8.098 27.044 32.594 651 1HG PRO 87 HG2 PRO 87 8.196 24.332 33.734 652 2HG PRO 87 HG1 PRO 87 8.824 24.905 32.182 653 1HD PRO 87 HD2 PRO 87 10.381 24.235 34.462 654 2HD PRO 87 HD1 PRO 87 10.948 25.104 33.018 655 H GLY 88 HN GLY 88 9.399 29.206 36.085 656 1HA GLY 88 HA2 GLY 88 7.199 28.434 37.869 657 2HA GLY 88 HA1 GLY 88 8.803 28.355 38.601 658 HA PRO 89 HA PRO 89 6.978 32.738 38.676 659 1HB PRO 89 HB2 PRO 89 7.111 32.813 41.538 660 2HB PRO 89 HB1 PRO 89 5.650 32.735 40.543 661 1HG PRO 89 HG2 PRO 89 6.875 30.606 42.149 662 2HG PRO 89 HG1 PRO 89 5.289 30.622 41.362 663 1HD PRO 89 HD2 PRO 89 7.591 29.151 40.516 664 2HD PRO 89 HD1 PRO 89 6.066 29.346 39.628 665 H GLY 90 HN GLY 90 8.146 34.615 39.877 666 1HA GLY 90 HA2 GLY 90 10.130 35.752 40.367 667 2HA GLY 90 HA1 GLY 90 10.727 34.236 41.041 668 H ILE 91 HN ILE 91 12.719 33.994 40.134 669 HA ILE 91 HA ILE 91 13.342 34.851 37.454 670 HB ILE 91 HB ILE 91 14.988 34.645 39.363 671 1HG1 ILE 91 HG12 ILE 91 15.819 33.016 36.948 672 2HG1 ILE 91 HG11 ILE 91 15.595 34.765 36.875 673 1HG2 ILE 91 HG21 ILE 91 14.084 32.318 39.980 674 2HG2 ILE 91 HG23 ILE 91 15.051 31.711 38.635 675 3HG2 ILE 91 HG22 ILE 91 15.836 32.517 39.995 676 1HD1 ILE 91 HD11 ILE 91 17.443 33.354 38.821 677 2HD1 ILE 91 HD13 ILE 91 17.967 34.119 37.320 678 3HD1 ILE 91 HD12 ILE 91 17.272 35.098 38.613 679 H GLY 92 HN GLY 92 11.589 32.203 38.524 680 1HA GLY 92 HA2 GLY 92 12.549 30.118 36.813 681 2HA GLY 92 HA1 GLY 92 10.902 30.232 37.436 682 H GLY 93 HN GLY 93 11.826 29.518 34.685 683 1HA GLY 93 HA2 GLY 93 10.751 29.841 32.590 684 2HA GLY 93 HA1 GLY 93 9.983 31.289 33.236 685 H ASP 94 HN ASP 94 12.706 32.247 34.188 686 HA ASP 94 HA ASP 94 13.331 33.893 31.935 687 1HB ASP 94 HB2 ASP 94 14.892 33.242 34.443 688 2HB ASP 94 HB1 ASP 94 15.409 34.448 33.266 689 H ALA 95 HN ALA 95 15.252 33.881 30.586 690 HA ALA 95 HA ALA 95 16.808 31.337 30.528 691 1HB ALA 95 HB2 ALA 95 14.783 31.268 28.941 692 2HB ALA 95 HB1 ALA 95 15.628 32.497 28.000 693 3HB ALA 95 HB3 ALA 95 16.358 30.910 28.236 694 H HIS 96 HN HIS 96 18.929 31.859 30.418 695 HA HIS 96 HA HIS 96 19.700 34.544 29.329 696 1HB HIS 96 HB2 HIS 96 21.289 32.705 31.136 697 2HB HIS 96 HB1 HIS 96 21.684 34.363 30.705 698 HD2 HIS 96 HD2 HIS 96 18.046 34.862 31.467 699 HE1 HIS 96 HE1 HIS 96 20.036 34.679 35.222 700 HE2 HIS 96 HE2 HIS 96 17.893 35.330 34.037 701 H PHE 97 HN PHE 97 21.434 34.689 27.864 702 HA PHE 97 HA PHE 97 22.274 32.110 26.561 703 1HB PHE 97 HB2 PHE 97 21.740 34.841 25.392 704 2HB PHE 97 HB1 PHE 97 22.547 33.557 24.500 705 HD1 PHE 97 HD1 PHE 97 19.445 34.239 26.491 706 HD2 PHE 97 HD2 PHE 97 21.253 32.017 23.291 707 HE1 PHE 97 HE1 PHE 97 17.231 33.295 25.895 708 HE2 PHE 97 HE2 PHE 97 19.044 31.077 22.696 709 HZ PHE 97 HZ PHE 97 17.030 31.713 23.997 710 H ASP 98 HN ASP 98 24.461 31.822 26.242 711 HA ASP 98 HA ASP 98 26.300 33.523 27.685 712 1HB ASP 98 HB2 ASP 98 26.599 31.048 27.314 713 2HB ASP 98 HB1 ASP 98 26.981 31.405 25.628 714 H GLU 99 HN GLU 99 26.639 35.537 26.917 715 HA GLU 99 HA GLU 99 26.578 36.190 24.085 716 1HB GLU 99 HB2 GLU 99 25.876 37.707 25.964 717 2HB GLU 99 HB1 GLU 99 27.571 37.863 26.399 718 1HG GLU 99 HG2 GLU 99 28.104 38.917 24.314 719 2HG GLU 99 HG1 GLU 99 26.525 38.515 23.636 720 H ASP 100 HN ASP 100 28.919 34.631 25.851 721 HA ASP 100 HA ASP 100 31.263 36.070 24.889 722 1HB ASP 100 HB2 ASP 100 30.952 33.289 26.053 723 2HB ASP 100 HB1 ASP 100 32.503 34.044 25.682 724 H GLU 101 HN GLU 101 29.242 33.500 23.648 725 HA GLU 101 HA GLU 101 31.207 32.729 21.592 726 1HB GLU 101 HB2 GLU 101 28.323 31.930 22.092 727 2HB GLU 101 HB1 GLU 101 29.295 31.300 20.760 728 1HG GLU 101 HG2 GLU 101 29.508 29.693 22.506 729 2HG GLU 101 HG1 GLU 101 31.013 30.610 22.535 730 H ARG 102 HN ARG 102 30.764 33.004 19.288 731 HA ARG 102 HA ARG 102 29.456 35.604 18.726 732 1HB ARG 102 HB2 ARG 102 31.703 35.149 17.808 733 2HB ARG 102 HB1 ARG 102 31.072 33.745 16.950 734 1HG ARG 102 HG2 ARG 102 29.664 35.131 15.575 735 2HG ARG 102 HG1 ARG 102 30.026 36.559 16.543 736 1HD ARG 102 HD2 ARG 102 32.376 36.443 15.878 737 2HD ARG 102 HD1 ARG 102 32.082 34.969 14.965 738 HE ARG 102 HE ARG 102 31.652 37.703 14.094 739 1HH1 ARG 102 HH21 ARG 102 30.279 34.547 13.921 740 2HH1 ARG 102 HH22 ARG 102 29.276 34.924 12.561 741 1HH2 ARG 102 HH11 ARG 102 30.363 38.207 12.335 742 2HH2 ARG 102 HH12 ARG 102 29.321 36.996 11.664 743 H TRP 103 HN TRP 103 27.306 35.490 18.352 744 HA TRP 103 HA TRP 103 26.080 33.039 17.278 745 1HB TRP 103 HB2 TRP 103 24.864 35.709 18.047 746 2HB TRP 103 HB1 TRP 103 23.956 34.259 17.622 747 HD1 TRP 103 HD1 TRP 103 25.548 35.972 20.496 748 HE1 TRP 103 HE1 TRP 103 25.502 34.455 22.580 749 HE3 TRP 103 HE3 TRP 103 24.209 31.545 18.334 750 HZ2 TRP 103 HZ2 TRP 103 24.970 31.722 23.243 751 HZ3 TRP 103 HZ3 TRP 103 23.943 29.503 19.711 752 HH2 TRP 103 HH2 TRP 103 24.321 29.585 22.160 753 H THR 104 HN THR 104 24.912 32.946 15.302 754 HA THR 104 HA THR 104 25.314 35.225 13.398 755 HB THR 104 HB THR 104 26.011 33.734 11.661 756 HG1 THR 104 HG1 THR 104 25.763 31.563 13.436 757 1HG2 THR 104 HG23 THR 104 27.658 34.334 13.582 758 2HG2 THR 104 HG22 THR 104 27.472 32.643 14.055 759 3HG2 THR 104 HG21 THR 104 28.113 33.049 12.464 760 H ASN 105 HN ASN 105 23.830 35.024 11.499 761 HA ASN 105 HA ASN 105 21.231 33.743 12.287 762 1HB ASN 105 HB2 ASN 105 21.736 36.232 10.625 763 2HB ASN 105 HB1 ASN 105 20.150 35.552 11.000 764 1HD2 ASN 105 HD22 ASN 105 20.651 36.311 14.603 765 2HD2 ASN 105 HD21 ASN 105 20.304 34.930 13.680 766 H ASN 106 HN ASN 106 23.497 32.584 10.738 767 HA ASN 106 HA ASN 106 21.910 31.764 8.364 768 1HB ASN 106 HB2 ASN 106 24.015 31.961 6.955 769 2HB ASN 106 HB1 ASN 106 23.282 33.498 7.420 770 1HD2 ASN 106 HD22 ASN 106 26.186 32.814 10.107 771 2HD2 ASN 106 HD21 ASN 106 24.734 31.937 10.087 772 H PHE 107 HN PHE 107 23.885 30.138 7.195 773 HA PHE 107 HA PHE 107 23.830 27.879 9.021 774 1HB PHE 107 HB2 PHE 107 24.927 26.658 7.206 775 2HB PHE 107 HB1 PHE 107 23.597 27.626 6.567 776 HD1 PHE 107 HD1 PHE 107 24.036 29.713 5.323 777 HD2 PHE 107 HD2 PHE 107 27.236 27.195 6.692 778 HE1 PHE 107 HE1 PHE 107 25.607 30.883 3.802 779 HE2 PHE 107 HE2 PHE 107 28.807 28.366 5.170 780 HZ PHE 107 HZ PHE 107 27.992 30.211 3.725 781 H ARG 108 HN ARG 108 25.778 30.431 9.317 782 HA ARG 108 HA ARG 108 28.416 29.408 9.217 783 1HB ARG 108 HB2 ARG 108 27.155 31.547 10.930 784 2HB ARG 108 HB1 ARG 108 28.866 31.153 11.057 785 1HG ARG 108 HG2 ARG 108 29.142 31.569 8.636 786 2HG ARG 108 HG1 ARG 108 27.441 32.008 8.527 787 1HD ARG 108 HD2 ARG 108 27.852 33.799 10.233 788 2HD ARG 108 HD1 ARG 108 29.568 33.408 10.164 789 HE ARG 108 HE ARG 108 28.874 33.884 7.517 790 1HH1 ARG 108 HH21 ARG 108 28.609 35.520 10.537 791 2HH1 ARG 108 HH22 ARG 108 28.702 37.104 9.841 792 1HH2 ARG 108 HH11 ARG 108 28.998 35.946 6.587 793 2HH2 ARG 108 HH12 ARG 108 28.922 37.345 7.605 794 H GLU 109 HN GLU 109 29.487 29.665 11.748 795 HA GLU 109 HA GLU 109 29.482 27.089 12.750 796 1HB GLU 109 HB2 GLU 109 29.975 29.696 14.198 797 2HB GLU 109 HB1 GLU 109 30.385 28.114 14.858 798 1HG GLU 109 HG2 GLU 109 31.849 27.664 12.947 799 2HG GLU 109 HG1 GLU 109 31.401 29.207 12.219 800 H TYR 110 HN TYR 110 27.699 29.785 14.375 801 HA TYR 110 HA TYR 110 25.893 27.673 15.549 802 1HB TYR 110 HB2 TYR 110 26.860 30.270 16.765 803 2HB TYR 110 HB1 TYR 110 25.673 29.191 17.499 804 HD1 TYR 110 HD2 TYR 110 26.317 26.970 18.320 805 HD2 TYR 110 HD1 TYR 110 29.210 29.658 16.632 806 HE1 TYR 110 HE2 TYR 110 28.149 25.582 19.252 807 HE2 TYR 110 HE1 TYR 110 31.043 28.275 17.565 808 HH TYR 110 HH TYR 110 30.401 25.169 19.096 809 H ASN 111 HN ASN 111 23.721 28.066 15.632 810 HA ASN 111 HA ASN 111 22.712 30.466 14.141 811 1HB ASN 111 HB2 ASN 111 21.497 27.719 14.575 812 2HB ASN 111 HB1 ASN 111 20.667 29.055 13.777 813 1HD2 ASN 111 HD22 ASN 111 22.316 27.010 11.120 814 2HD2 ASN 111 HD21 ASN 111 21.111 26.727 12.281 815 H LEU 112 HN LEU 112 21.813 31.967 15.494 816 HA LEU 112 HA LEU 112 21.413 31.556 18.273 817 1HB LEU 112 HB2 LEU 112 21.672 33.793 17.282 818 2HB LEU 112 HB1 LEU 112 20.121 33.622 16.462 819 HG LEU 112 HG LEU 112 18.985 33.442 18.658 820 1HD1 LEU 112 HD12 LEU 112 21.826 33.567 19.647 821 2HD1 LEU 112 HD11 LEU 112 20.533 34.225 20.649 822 3HD1 LEU 112 HD13 LEU 112 20.505 32.527 20.179 823 1HD2 LEU 112 HD21 LEU 112 19.290 35.653 17.580 824 2HD2 LEU 112 HD23 LEU 112 19.290 35.781 19.339 825 3HD2 LEU 112 HD22 LEU 112 20.810 35.856 18.450 826 H HIS 113 HN HIS 113 19.045 31.466 15.608 827 HA HIS 113 HA HIS 113 16.725 31.095 17.199 828 1HB HIS 113 HB2 HIS 113 16.690 31.596 14.772 829 2HB HIS 113 HB1 HIS 113 17.299 29.974 14.440 830 HD1 HIS 113 HD1 HIS 113 15.660 28.075 15.882 831 HD2 HIS 113 HD2 HIS 113 13.967 31.610 14.475 832 HE1 HIS 113 HE1 HIS 113 13.160 27.677 15.767 833 H ARG 114 HN ARG 114 19.035 28.698 15.928 834 HA ARG 114 HA ARG 114 17.587 26.366 16.648 835 1HB ARG 114 HB2 ARG 114 19.668 26.453 15.232 836 2HB ARG 114 HB1 ARG 114 20.599 26.701 16.707 837 1HG ARG 114 HG2 ARG 114 20.753 24.383 16.460 838 2HG ARG 114 HG1 ARG 114 19.353 24.509 17.518 839 1HD ARG 114 HD2 ARG 114 18.917 22.954 15.656 840 2HD ARG 114 HD1 ARG 114 17.857 24.358 15.551 841 HE ARG 114 HE ARG 114 20.067 25.042 14.012 842 1HH1 ARG 114 HH21 ARG 114 17.784 22.460 14.156 843 2HH1 ARG 114 HH22 ARG 114 17.873 22.114 12.460 844 1HH2 ARG 114 HH11 ARG 114 20.197 24.604 11.807 845 2HH2 ARG 114 HH12 ARG 114 19.241 23.328 11.131 846 H VAL 115 HN VAL 115 20.063 28.131 18.554 847 HA VAL 115 HA VAL 115 19.736 26.409 20.854 848 HB VAL 115 HB VAL 115 20.923 29.182 20.538 849 1HG1 VAL 115 HG11 VAL 115 20.684 27.392 22.961 850 2HG1 VAL 115 HG13 VAL 115 21.966 28.597 22.822 851 3HG1 VAL 115 HG12 VAL 115 20.279 29.100 22.818 852 1HG2 VAL 115 HG21 VAL 115 22.040 26.374 20.710 853 2HG2 VAL 115 HG23 VAL 115 22.284 27.570 19.439 854 3HG2 VAL 115 HG22 VAL 115 23.038 27.792 21.016 855 H ALA 116 HN ALA 116 18.354 29.531 19.891 856 HA ALA 116 HA ALA 116 16.975 30.108 22.298 857 1HB ALA 116 HB1 ALA 116 17.238 31.557 20.179 858 2HB ALA 116 HB3 ALA 116 15.837 30.680 19.560 859 3HB ALA 116 HB2 ALA 116 15.695 31.647 21.029 860 H ALA 117 HN ALA 117 15.880 28.237 19.452 861 HA ALA 117 HA ALA 117 13.290 27.612 20.443 862 1HB ALA 117 HB2 ALA 117 14.173 27.176 18.101 863 2HB ALA 117 HB1 ALA 117 14.995 25.765 18.765 864 3HB ALA 117 HB3 ALA 117 13.234 25.860 18.808 865 H HIS 118 HN HIS 118 16.404 25.978 20.912 866 HA HIS 118 HA HIS 118 15.414 23.689 22.277 867 1HB HIS 118 HB2 HIS 118 17.752 23.935 21.478 868 2HB HIS 118 HB1 HIS 118 18.035 25.151 22.722 869 HD1 HIS 118 HD1 HIS 118 17.679 21.484 22.195 870 HD2 HIS 118 HD2 HIS 118 18.081 24.101 25.415 871 HE1 HIS 118 HE1 HIS 118 18.225 20.056 24.214 872 H GLU 119 HN GLU 119 16.515 26.835 23.559 873 HA GLU 119 HA GLU 119 16.030 26.243 26.309 874 1HB GLU 119 HB2 GLU 119 16.013 28.856 24.778 875 2HB GLU 119 HB1 GLU 119 15.892 28.758 26.535 876 1HG GLU 119 HG2 GLU 119 18.036 27.541 26.619 877 2HG GLU 119 HG1 GLU 119 18.163 27.643 24.862 878 H LEU 120 HN LEU 120 13.941 27.586 23.766 879 HA LEU 120 HA LEU 120 11.695 28.130 25.462 880 1HB LEU 120 HB2 LEU 120 11.836 27.449 22.509 881 2HB LEU 120 HB1 LEU 120 10.374 28.001 23.321 882 HG LEU 120 HG LEU 120 12.975 29.565 23.257 883 1HD1 LEU 120 HD12 LEU 120 11.763 29.229 21.014 884 2HD1 LEU 120 HD11 LEU 120 10.458 30.186 21.703 885 3HD1 LEU 120 HD13 LEU 120 12.059 30.894 21.506 886 1HD2 LEU 120 HD23 LEU 120 10.223 30.060 24.388 887 2HD2 LEU 120 HD22 LEU 120 11.797 30.396 25.106 888 3HD2 LEU 120 HD21 LEU 120 11.181 31.429 23.823 889 H GLY 121 HN GLY 121 12.780 25.244 23.725 890 1HA GLY 121 HA2 GLY 121 10.488 23.627 24.068 891 2HA GLY 121 HA1 GLY 121 12.137 23.001 23.987 892 H HIS 122 HN HIS 122 13.221 24.211 26.287 893 HA HIS 122 HA HIS 122 12.238 22.437 28.338 894 1HB HIS 122 HB2 HIS 122 14.192 24.747 28.359 895 2HB HIS 122 HB1 HIS 122 13.779 23.859 29.825 896 HD1 HIS 122 HD1 HIS 122 14.140 21.137 29.598 897 HD2 HIS 122 HD2 HIS 122 16.200 23.536 26.883 898 HE1 HIS 122 HE1 HIS 122 16.004 19.708 28.653 899 H SER 123 HN SER 123 11.830 25.906 27.684 900 HA SER 123 HA SER 123 10.479 26.633 30.066 901 1HB SER 123 HB2 SER 123 9.637 28.526 28.850 902 2HB SER 123 HB1 SER 123 11.236 28.184 28.194 903 HG SER 123 HG SER 123 10.190 27.022 26.515 904 H LEU 124 HN LEU 124 9.357 24.859 27.249 905 HA LEU 124 HA LEU 124 6.537 25.026 28.077 906 1HB LEU 124 HB2 LEU 124 7.875 23.367 25.918 907 2HB LEU 124 HB1 LEU 124 6.135 23.548 26.136 908 HG LEU 124 HG LEU 124 8.046 25.852 25.627 909 1HD1 LEU 124 HD11 LEU 124 7.886 24.317 23.684 910 2HD1 LEU 124 HD13 LEU 124 6.130 24.473 23.718 911 3HD1 LEU 124 HD12 LEU 124 7.132 25.875 23.348 912 1HD2 LEU 124 HD23 LEU 124 5.060 25.610 26.002 913 2HD2 LEU 124 HD22 LEU 124 6.172 26.811 26.660 914 3HD2 LEU 124 HD21 LEU 124 5.703 26.886 24.967 915 H GLY 125 HN GLY 125 9.147 23.330 29.193 916 1HA GLY 125 HA2 GLY 125 9.123 21.629 30.849 917 2HA GLY 125 HA1 GLY 125 7.402 21.396 30.550 918 H LEU 126 HN LEU 126 9.446 21.385 27.762 919 HA LEU 126 HA LEU 126 8.787 18.567 27.278 920 1HB LEU 126 HB2 LEU 126 10.411 20.592 25.710 921 2HB LEU 126 HB1 LEU 126 10.108 18.947 25.159 922 HG LEU 126 HG LEU 126 7.933 20.939 25.860 923 1HD1 LEU 126 HD12 LEU 126 9.230 21.663 23.893 924 2HD1 LEU 126 HD11 LEU 126 8.989 20.084 23.148 925 3HD1 LEU 126 HD13 LEU 126 7.610 21.148 23.425 926 1HD2 LEU 126 HD21 LEU 126 7.969 18.081 24.929 927 2HD2 LEU 126 HD23 LEU 126 6.852 18.893 26.024 928 3HD2 LEU 126 HD22 LEU 126 6.710 19.133 24.286 929 H SER 127 HN SER 127 10.360 16.863 27.094 930 HA SER 127 HA SER 127 12.900 17.394 28.601 931 1HB SER 127 HB2 SER 127 11.305 14.862 28.144 932 2HB SER 127 HB1 SER 127 12.932 14.863 28.821 933 HG SER 127 HG SER 127 11.962 15.251 30.638 934 H HIS 128 HN HIS 128 14.850 16.351 27.804 935 HA HIS 128 HA HIS 128 15.378 16.752 25.071 936 1HB HIS 128 HB2 HIS 128 16.723 14.879 27.040 937 2HB HIS 128 HB1 HIS 128 17.376 15.272 25.450 938 HD1 HIS 128 HD1 HIS 128 18.291 16.130 28.572 939 HD2 HIS 128 HD2 HIS 128 16.883 18.537 25.473 940 HE1 HIS 128 HE1 HIS 128 19.116 18.475 29.055 941 H SER 129 HN SER 129 16.171 14.809 23.600 942 HA SER 129 HA SER 129 14.472 12.400 23.871 943 1HB SER 129 HB2 SER 129 13.024 14.020 22.695 944 2HB SER 129 HB1 SER 129 14.277 14.262 21.482 945 HG SER 129 HG SER 129 14.099 11.818 21.330 946 H THR 130 HN THR 130 14.993 10.831 22.027 947 HA THR 130 HA THR 130 17.928 10.924 21.521 948 HB THR 130 HB THR 130 17.750 8.537 21.127 949 HG1 THR 130 HG1 THR 130 15.093 8.324 21.712 950 1HG2 THR 130 HG21 THR 130 17.662 9.459 23.504 951 2HG2 THR 130 HG23 THR 130 15.925 9.153 23.455 952 3HG2 THR 130 HG22 THR 130 17.062 7.814 23.294 953 H ASP 131 HN ASP 131 15.305 11.983 19.889 954 HA ASP 131 HA ASP 131 15.883 10.775 17.271 955 1HB ASP 131 HB2 ASP 131 13.574 11.461 17.956 956 2HB ASP 131 HB1 ASP 131 14.109 13.139 17.945 957 H ILE 132 HN ILE 132 17.556 11.453 16.073 958 HA ILE 132 HA ILE 132 19.153 13.739 16.634 959 HB ILE 132 HB ILE 132 18.850 12.124 14.082 960 1HG1 ILE 132 HG12 ILE 132 21.038 12.100 16.183 961 2HG1 ILE 132 HG11 ILE 132 19.673 10.982 16.198 962 1HG2 ILE 132 HG23 ILE 132 20.836 14.266 14.888 963 2HG2 ILE 132 HG22 ILE 132 21.149 13.109 13.595 964 3HG2 ILE 132 HG21 ILE 132 19.804 14.242 13.457 965 1HD1 ILE 132 HD11 ILE 132 20.307 10.207 13.927 966 2HD1 ILE 132 HD13 ILE 132 21.698 11.290 13.960 967 3HD1 ILE 132 HD12 ILE 132 21.602 9.942 15.094 968 H GLY 133 HN GLY 133 16.461 13.286 14.358 969 1HA GLY 133 HA2 GLY 133 16.719 15.878 13.121 970 2HA GLY 133 HA1 GLY 133 15.302 14.837 13.034 971 H ALA 134 HN ALA 134 16.164 15.414 16.273 972 HA ALA 134 HA ALA 134 13.908 17.358 16.516 973 1HB ALA 134 HB3 ALA 134 15.358 15.659 18.563 974 2HB ALA 134 HB2 ALA 134 14.105 16.831 18.968 975 3HB ALA 134 HB1 ALA 134 13.714 15.437 17.965 976 H LEU 135 HN LEU 135 14.209 19.410 17.313 977 HA LEU 135 HA LEU 135 16.872 20.544 17.251 978 1HB LEU 135 HB2 LEU 135 14.310 21.715 18.398 979 2HB LEU 135 HB1 LEU 135 15.762 22.617 17.966 980 HG LEU 135 HG LEU 135 13.958 21.091 16.061 981 1HD1 LEU 135 HD13 LEU 135 13.100 23.281 16.837 982 2HD1 LEU 135 HD12 LEU 135 14.599 24.044 16.311 983 3HD1 LEU 135 HD11 LEU 135 13.516 23.319 15.124 984 1HD2 LEU 135 HD21 LEU 135 16.671 22.356 15.711 985 2HD2 LEU 135 HD23 LEU 135 16.080 20.818 15.088 986 3HD2 LEU 135 HD22 LEU 135 15.542 22.328 14.359 987 H MET 136 HN MET 136 14.828 19.167 19.696 988 HA MET 136 HA MET 136 16.222 20.307 21.969 989 1HB MET 136 HB2 MET 136 14.455 17.847 21.775 990 2HB MET 136 HB1 MET 136 14.955 18.626 23.274 991 1HG MET 136 HG2 MET 136 13.318 19.932 21.075 992 2HG MET 136 HG1 MET 136 12.677 19.335 22.604 993 1HE MET 136 HE3 MET 136 13.470 19.873 24.739 994 2HE MET 136 HE2 MET 136 15.149 20.406 24.769 995 3HE MET 136 HE1 MET 136 13.875 21.502 25.296 996 H TYR 137 HN TYR 137 17.310 18.179 19.683 997 HA TYR 137 HA TYR 137 18.482 16.101 21.213 998 1HB TYR 137 HB2 TYR 137 18.319 16.329 18.653 999 2HB TYR 137 HB1 TYR 137 19.785 17.304 18.768 1000 HD1 TYR 137 HD2 TYR 137 18.360 13.974 19.726 1001 HD2 TYR 137 HD1 TYR 137 21.903 16.262 18.897 1002 HE1 TYR 137 HE2 TYR 137 19.723 11.903 19.824 1003 HE2 TYR 137 HE1 TYR 137 23.261 14.187 18.996 1004 HH TYR 137 HH TYR 137 22.912 11.746 18.700 1005 HA PRO 138 HA PRO 138 21.460 18.507 23.550 1006 1HB PRO 138 HB2 PRO 138 23.377 16.365 23.785 1007 2HB PRO 138 HB1 PRO 138 22.193 16.894 24.987 1008 1HG PRO 138 HG2 PRO 138 22.119 14.504 23.302 1009 2HG PRO 138 HG1 PRO 138 21.056 14.934 24.650 1010 1HD PRO 138 HD2 PRO 138 20.371 14.959 21.883 1011 2HD PRO 138 HD1 PRO 138 19.406 15.618 23.223 1012 H SER 139 HN SER 139 22.688 16.525 20.819 1013 HA SER 139 HA SER 139 25.090 18.212 20.598 1014 1HB SER 139 HB2 SER 139 24.862 15.676 20.022 1015 2HB SER 139 HB1 SER 139 24.210 16.249 18.490 1016 HG SER 139 HG SER 139 26.479 17.557 19.327 1017 H TYR 140 HN TYR 140 25.463 19.797 19.084 1018 HA TYR 140 HA TYR 140 23.188 21.112 17.884 1019 1HB TYR 140 HB2 TYR 140 25.215 22.325 18.643 1020 2HB TYR 140 HB1 TYR 140 26.149 21.535 17.376 1021 HD1 TYR 140 HD2 TYR 140 23.529 24.005 18.113 1022 HD2 TYR 140 HD1 TYR 140 25.847 22.135 15.018 1023 HE1 TYR 140 HE2 TYR 140 22.801 25.753 16.514 1024 HE2 TYR 140 HE1 TYR 140 25.118 23.884 13.416 1025 HH TYR 140 HH TYR 140 22.877 26.475 14.424 1026 H THR 141 HN THR 141 22.658 21.273 15.648 1027 HA THR 141 HA THR 141 24.160 19.636 13.699 1028 HB THR 141 HB THR 141 22.097 18.414 12.996 1029 HG1 THR 141 HG1 THR 141 20.571 18.426 14.982 1030 1HG2 THR 141 HG21 THR 141 23.808 17.447 14.587 1031 2HG2 THR 141 HG23 THR 141 22.744 17.923 15.909 1032 3HG2 THR 141 HG22 THR 141 22.196 16.744 14.719 1033 H PHE 142 HN PHE 142 22.971 19.828 11.482 1034 HA PHE 142 HA PHE 142 21.306 22.209 11.135 1035 1HB PHE 142 HB2 PHE 142 23.580 23.173 11.401 1036 2HB PHE 142 HB1 PHE 142 24.145 22.176 10.064 1037 HD1 PHE 142 HD2 PHE 142 22.047 25.039 11.030 1038 HD2 PHE 142 HD1 PHE 142 23.502 22.665 7.761 1039 HE1 PHE 142 HE2 PHE 142 21.282 26.775 9.432 1040 HE2 PHE 142 HE1 PHE 142 22.737 24.400 6.162 1041 HZ PHE 142 HZ PHE 142 21.627 26.453 6.997 1042 H SER 143 HN SER 143 19.857 21.160 9.813 1043 HA SER 143 HA SER 143 20.875 19.387 7.647 1044 1HB SER 143 HB2 SER 143 18.587 18.596 7.483 1045 2HB SER 143 HB1 SER 143 19.050 18.612 9.183 1046 HG SER 143 HG SER 143 16.999 19.800 8.097 1047 H GLY 144 HN GLY 144 20.217 22.607 7.975 1048 1HA GLY 144 HA2 GLY 144 20.261 24.170 6.146 1049 2HA GLY 144 HA1 GLY 144 19.733 22.890 5.058 1050 H ASP 145 HN ASP 145 17.703 22.312 7.408 1051 HA ASP 145 HA ASP 145 15.780 24.529 6.809 1052 1HB ASP 145 HB2 ASP 145 15.266 21.547 6.597 1053 2HB ASP 145 HB1 ASP 145 13.993 22.769 6.604 1054 H VAL 146 HN VAL 146 14.988 25.307 8.712 1055 HA VAL 146 HA VAL 146 15.350 23.674 11.173 1056 HB VAL 146 HB VAL 146 14.497 26.562 10.814 1057 1HG1 VAL 146 HG13 VAL 146 15.097 24.846 13.231 1058 2HG1 VAL 146 HG12 VAL 146 15.252 26.602 13.293 1059 3HG1 VAL 146 HG11 VAL 146 13.690 25.867 12.933 1060 1HG2 VAL 146 HG22 VAL 146 16.825 26.042 10.063 1061 2HG2 VAL 146 HG21 VAL 146 16.785 27.107 11.469 1062 3HG2 VAL 146 HG23 VAL 146 17.166 25.397 11.670 1063 H GLN 147 HN GLN 147 13.655 22.275 11.401 1064 HA GLN 147 HA GLN 147 10.912 23.446 11.529 1065 1HB GLN 147 HB2 GLN 147 11.729 20.954 10.002 1066 2HB GLN 147 HB1 GLN 147 10.060 21.341 10.419 1067 1HG GLN 147 HG2 GLN 147 10.237 23.469 9.186 1068 2HG GLN 147 HG1 GLN 147 11.906 23.086 8.766 1069 1HE2 GLN 147 HE22 GLN 147 9.357 20.307 7.198 1070 2HE2 GLN 147 HE21 GLN 147 9.400 20.579 8.871 1071 H LEU 148 HN LEU 148 9.459 22.080 12.831 1072 HA LEU 148 HA LEU 148 10.860 20.918 15.107 1073 1HB LEU 148 HB2 LEU 148 7.913 21.038 14.412 1074 2HB LEU 148 HB1 LEU 148 8.552 20.450 15.947 1075 HG LEU 148 HG LEU 148 9.027 23.233 14.824 1076 1HD1 LEU 148 HD13 LEU 148 7.139 22.246 16.985 1077 2HD1 LEU 148 HD12 LEU 148 7.466 23.944 16.634 1078 3HD1 LEU 148 HD11 LEU 148 6.679 22.930 15.425 1079 1HD2 LEU 148 HD21 LEU 148 9.919 21.773 17.306 1080 2HD2 LEU 148 HD23 LEU 148 10.818 22.897 16.286 1081 3HD2 LEU 148 HD22 LEU 148 9.609 23.507 17.409 1082 H ALA 149 HN ALA 149 10.430 18.687 15.858 1083 HA ALA 149 HA ALA 149 10.335 16.791 13.549 1084 1HB ALA 149 HB3 ALA 149 11.362 16.563 16.388 1085 2HB ALA 149 HB2 ALA 149 11.176 15.161 15.336 1086 3HB ALA 149 HB1 ALA 149 12.287 16.456 14.890 1087 H GLN 150 HN GLN 150 8.997 14.864 13.766 1088 HA GLN 150 HA GLN 150 6.363 15.397 14.681 1089 1HB GLN 150 HB2 GLN 150 6.990 13.696 12.958 1090 2HB GLN 150 HB1 GLN 150 7.644 12.685 14.247 1091 1HG GLN 150 HG2 GLN 150 5.434 12.619 15.325 1092 2HG GLN 150 HG1 GLN 150 4.773 13.633 14.043 1093 1HE2 GLN 150 HE22 GLN 150 4.032 10.772 12.142 1094 2HE2 GLN 150 HE21 GLN 150 3.537 12.292 12.715 1095 H ASP 151 HN ASP 151 9.039 13.635 16.220 1096 HA ASP 151 HA ASP 151 7.623 12.639 18.471 1097 1HB ASP 151 HB2 ASP 151 9.948 11.985 17.889 1098 2HB ASP 151 HB1 ASP 151 10.502 13.592 18.360 1099 H ASP 152 HN ASP 152 9.163 15.813 17.927 1100 HA ASP 152 HA ASP 152 8.572 16.735 20.626 1101 1HB ASP 152 HB2 ASP 152 9.415 18.175 18.096 1102 2HB ASP 152 HB1 ASP 152 9.182 18.990 19.644 1103 H ILE 153 HN ILE 153 7.078 17.151 17.417 1104 HA ILE 153 HA ILE 153 5.061 19.011 18.225 1105 HB ILE 153 HB ILE 153 5.038 16.916 16.027 1106 1HG1 ILE 153 HG12 ILE 153 5.456 19.910 15.838 1107 2HG1 ILE 153 HG11 ILE 153 6.790 18.765 15.959 1108 1HG2 ILE 153 HG23 ILE 153 3.171 19.225 16.626 1109 2HG2 ILE 153 HG22 ILE 153 3.249 18.427 15.055 1110 3HG2 ILE 153 HG21 ILE 153 2.750 17.518 16.481 1111 1HD1 ILE 153 HD12 ILE 153 4.640 18.635 13.824 1112 2HD1 ILE 153 HD11 ILE 153 6.214 19.396 13.590 1113 3HD1 ILE 153 HD13 ILE 153 6.110 17.665 13.907 1114 H ASP 154 HN ASP 154 4.941 15.438 17.937 1115 HA ASP 154 HA ASP 154 2.270 15.133 18.879 1116 1HB ASP 154 HB2 ASP 154 4.660 13.284 19.012 1117 2HB ASP 154 HB1 ASP 154 3.047 12.802 19.533 1118 H GLY 155 HN GLY 155 5.346 15.249 20.660 1119 1HA GLY 155 HA2 GLY 155 4.288 14.540 23.203 1120 2HA GLY 155 HA1 GLY 155 5.763 15.470 22.955 1121 H ILE 156 HN ILE 156 4.855 17.826 21.840 1122 HA ILE 156 HA ILE 156 3.696 19.093 24.152 1123 HB ILE 156 HB ILE 156 5.274 20.217 22.538 1124 1HG1 ILE 156 HG12 ILE 156 3.977 22.407 22.571 1125 2HG1 ILE 156 HG11 ILE 156 2.604 21.496 23.195 1126 1HG2 ILE 156 HG21 ILE 156 4.169 19.427 20.463 1127 2HG2 ILE 156 HG23 ILE 156 2.786 20.460 20.820 1128 3HG2 ILE 156 HG22 ILE 156 4.360 21.176 20.495 1129 1HD1 ILE 156 HD13 ILE 156 5.253 21.230 24.596 1130 2HD1 ILE 156 HD12 ILE 156 4.300 22.688 24.849 1131 3HD1 ILE 156 HD11 ILE 156 3.619 21.116 25.253 1132 H GLN 157 HN GLN 157 2.380 18.061 21.038 1133 HA GLN 157 HA GLN 157 -0.178 19.317 21.376 1134 1HB GLN 157 HB2 GLN 157 0.731 16.935 19.745 1135 2HB GLN 157 HB1 GLN 157 -0.934 17.525 19.715 1136 1HG GLN 157 HG2 GLN 157 -0.196 19.718 18.968 1137 2HG GLN 157 HG1 GLN 157 1.495 19.242 19.125 1138 1HE2 GLN 157 HE22 GLN 157 0.362 18.827 15.543 1139 2HE2 GLN 157 HE21 GLN 157 0.315 20.134 16.626 1140 H ALA 158 HN ALA 158 1.082 16.130 22.339 1141 HA ALA 158 HA ALA 158 -1.389 15.046 23.265 1142 1HB ALA 158 HB3 ALA 158 0.777 13.779 23.015 1143 2HB ALA 158 HB2 ALA 158 1.347 14.576 24.481 1144 3HB ALA 158 HB1 ALA 158 -0.047 13.496 24.549 1145 H ILE 159 HN ILE 159 1.036 17.090 24.876 1146 HA ILE 159 HA ILE 159 -0.202 17.065 27.463 1147 HB ILE 159 HB ILE 159 1.547 19.139 26.102 1148 1HG1 ILE 159 HG12 ILE 159 2.208 17.097 28.246 1149 2HG1 ILE 159 HG11 ILE 159 2.481 16.829 26.523 1150 1HG2 ILE 159 HG21 ILE 159 0.540 18.923 28.948 1151 2HG2 ILE 159 HG23 ILE 159 1.960 19.872 28.513 1152 3HG2 ILE 159 HG22 ILE 159 0.382 20.291 27.849 1153 1HD1 ILE 159 HD12 ILE 159 3.609 19.214 28.005 1154 2HD1 ILE 159 HD11 ILE 159 4.491 17.699 27.818 1155 3HD1 ILE 159 HD13 ILE 159 4.044 18.640 26.398 1156 H TYR 160 HN TYR 160 -0.425 19.406 24.774 1157 HA TYR 160 HA TYR 160 -2.781 20.671 26.087 1158 1HB TYR 160 HB2 TYR 160 -0.992 21.446 23.773 1159 2HB TYR 160 HB1 TYR 160 -2.504 22.291 24.108 1160 HD1 TYR 160 HD1 TYR 160 0.887 21.542 25.359 1161 HD2 TYR 160 HD2 TYR 160 -2.777 23.659 26.095 1162 HE1 TYR 160 HE1 TYR 160 2.012 22.877 27.122 1163 HE2 TYR 160 HE2 TYR 160 -1.654 24.994 27.857 1164 HH TYR 160 HH TYR 160 0.311 25.511 28.797 1165 H GLY 161 HN GLY 161 -2.004 19.922 22.676 1166 1HA GLY 161 HA2 GLY 161 -3.760 17.959 22.003 1167 2HA GLY 161 HA1 GLY 161 -4.843 19.341 22.170 1168 H ARG 162 HN ARG 162 -5.166 18.854 19.803 1169 HA ARG 162 HA ARG 162 -2.968 19.705 18.016 1170 1HB ARG 162 HB2 ARG 162 -5.800 18.740 17.504 1171 2HB ARG 162 HB1 ARG 162 -4.669 19.212 16.232 1172 1HG ARG 162 HG2 ARG 162 -3.134 17.471 16.824 1173 2HG ARG 162 HG1 ARG 162 -4.008 17.120 18.311 1174 1HD ARG 162 HD2 ARG 162 -4.544 15.428 16.661 1175 2HD ARG 162 HD1 ARG 162 -5.975 16.394 16.964 1176 HE ARG 162 HE ARG 162 -4.286 16.197 14.498 1177 1HH1 ARG 162 HH21 ARG 162 -6.715 17.958 16.179 1178 2HH1 ARG 162 HH22 ARG 162 -7.162 18.900 14.797 1179 1HH2 ARG 162 HH11 ARG 162 -4.844 17.401 12.700 1180 2HH2 ARG 162 HH12 ARG 162 -6.102 18.585 12.825 1181 H SER 163 HN SER 163 -3.200 21.580 16.618 1182 HA SER 163 HA SER 163 -4.587 23.794 17.900 1183 1HB SER 163 HB2 SER 163 -3.123 23.554 15.257 1184 2HB SER 163 HB1 SER 163 -3.820 25.062 15.844 1185 HG SER 163 HG SER 163 -2.197 23.617 17.590 1186 H GLN 164 HN GLN 164 -6.816 22.891 17.799 1187 HA GLN 164 HA GLN 164 -8.033 22.452 15.188 1188 1HB GLN 164 HB2 GLN 164 -9.225 22.776 17.956 1189 2HB GLN 164 HB1 GLN 164 -10.184 22.447 16.513 1190 1HG GLN 164 HG2 GLN 164 -8.897 20.384 16.117 1191 2HG GLN 164 HG1 GLN 164 -7.929 20.709 17.554 1192 1HE2 GLN 164 HE22 GLN 164 -11.034 18.507 18.218 1193 2HE2 GLN 164 HE21 GLN 164 -9.980 18.491 16.889 1194 H ASN 165 HN ASN 165 -8.001 24.266 13.913 1195 HA ASN 165 HA ASN 165 -9.750 26.489 14.720 1196 1HB ASN 165 HB2 ASN 165 -6.793 26.860 14.175 1197 2HB ASN 165 HB1 ASN 165 -7.961 28.178 14.088 1198 1HD2 ASN 165 HD22 ASN 165 -8.611 28.114 17.655 1199 2HD2 ASN 165 HD21 ASN 165 -9.411 28.342 16.177 1200 HA PRO 166 HA PRO 166 -9.625 25.191 10.247 1201 1HB PRO 166 HB2 PRO 166 -12.501 24.984 10.238 1202 2HB PRO 166 HB1 PRO 166 -11.330 23.665 10.134 1203 1HG PRO 166 HG2 PRO 166 -13.032 24.327 12.378 1204 2HG PRO 166 HG1 PRO 166 -11.859 23.009 12.264 1205 1HD PRO 166 HD2 PRO 166 -11.619 25.501 13.758 1206 2HD PRO 166 HD1 PRO 166 -10.498 24.126 13.729 1207 H VAL 167 HN VAL 167 -9.007 27.458 9.985 1208 HA VAL 167 HA VAL 167 -11.180 29.470 9.939 1209 HB VAL 167 HB VAL 167 -9.170 30.962 9.241 1210 1HG1 VAL 167 HG12 VAL 167 -9.220 29.564 11.931 1211 2HG1 VAL 167 HG11 VAL 167 -8.380 31.078 11.595 1212 3HG1 VAL 167 HG13 VAL 167 -10.138 31.002 11.490 1213 1HG2 VAL 167 HG22 VAL 167 -7.761 28.956 8.610 1214 2HG2 VAL 167 HG21 VAL 167 -6.973 30.080 9.717 1215 3HG2 VAL 167 HG23 VAL 167 -7.655 28.574 10.329 1216 H GLN 168 HN GLN 168 -11.993 30.340 8.034 1217 HA GLN 168 HA GLN 168 -11.472 28.841 5.578 1218 1HB GLN 168 HB2 GLN 168 -13.315 31.168 6.202 1219 2HB GLN 168 HB1 GLN 168 -13.280 30.331 4.652 1220 1HG GLN 168 HG2 GLN 168 -15.040 29.305 5.901 1221 2HG GLN 168 HG1 GLN 168 -13.690 28.174 5.963 1222 1HE2 GLN 168 HE21 GLN 168 -13.211 27.431 8.033 1223 2HE2 GLN 168 HE22 GLN 168 -13.569 28.256 9.473 1224 HA PRO 169 HA PRO 169 -8.429 31.566 3.820 1225 1HB PRO 169 HB2 PRO 169 -9.733 31.753 1.214 1226 2HB PRO 169 HB1 PRO 169 -8.279 30.843 1.651 1227 1HG PRO 169 HG2 PRO 169 -10.928 29.794 1.136 1228 2HG PRO 169 HG1 PRO 169 -9.468 28.888 1.561 1229 1HD PRO 169 HD2 PRO 169 -11.761 29.335 3.228 1230 2HD PRO 169 HD1 PRO 169 -10.236 28.550 3.687 No H/Q in entry = 1230 Start of MODEL 22 1 1H VAL 1 HT3 VAL 1 -7.683 14.112 15.333 2 2H VAL 1 HT2 VAL 1 -6.103 14.656 15.023 3 3H VAL 1 HT1 VAL 1 -6.402 13.592 16.314 4 HA VAL 1 HA VAL 1 -7.352 15.195 17.631 5 HB VAL 1 HB VAL 1 -5.445 16.841 15.953 6 1HG1 VAL 1 HG12 VAL 1 -6.213 16.804 18.885 7 2HG1 VAL 1 HG11 VAL 1 -4.864 17.737 18.237 8 3HG1 VAL 1 HG13 VAL 1 -6.513 18.097 17.722 9 1HG2 VAL 1 HG21 VAL 1 -4.886 14.677 17.999 10 2HG2 VAL 1 HG23 VAL 1 -4.347 14.726 16.320 11 3HG2 VAL 1 HG22 VAL 1 -3.686 15.867 17.492 12 H LEU 2 HN LEU 2 -6.921 16.850 14.478 13 HA LEU 2 HA LEU 2 -8.945 18.790 14.941 14 1HB LEU 2 HB2 LEU 2 -7.263 18.990 13.143 15 2HB LEU 2 HB1 LEU 2 -7.999 17.627 12.304 16 HG LEU 2 HG LEU 2 -10.116 18.904 12.102 17 1HD1 LEU 2 HD11 LEU 2 -8.543 20.887 13.730 18 2HD1 LEU 2 HD13 LEU 2 -9.728 21.489 12.569 19 3HD1 LEU 2 HD12 LEU 2 -10.237 20.418 13.872 20 1HD2 LEU 2 HD22 LEU 2 -7.587 20.235 11.098 21 2HD2 LEU 2 HD21 LEU 2 -8.565 19.030 10.261 22 3HD2 LEU 2 HD23 LEU 2 -9.201 20.653 10.523 23 H THR 3 HN THR 3 -9.114 15.702 13.150 24 HA THR 3 HA THR 3 -12.092 15.894 13.157 25 HB THR 3 HB THR 3 -12.007 14.031 11.557 26 HG1 THR 3 HG1 THR 3 -9.232 14.177 12.103 27 1HG2 THR 3 HG21 THR 3 -11.732 16.368 10.752 28 2HG2 THR 3 HG23 THR 3 -9.981 16.175 10.866 29 3HG2 THR 3 HG22 THR 3 -10.903 15.202 9.722 30 H GLU 4 HN GLU 4 -13.298 13.898 13.822 31 HA GLU 4 HA GLU 4 -12.364 12.960 16.380 32 1HB GLU 4 HB2 GLU 4 -14.774 13.146 15.770 33 2HB GLU 4 HB1 GLU 4 -14.565 11.806 14.642 34 1HG GLU 4 HG2 GLU 4 -13.867 10.339 16.495 35 2HG GLU 4 HG1 GLU 4 -14.051 11.677 17.628 36 H GLY 5 HN GLY 5 -11.132 11.200 16.861 37 1HA GLY 5 HA2 GLY 5 -9.956 9.186 16.580 38 2HA GLY 5 HA1 GLY 5 -11.051 8.809 15.250 39 H ASN 6 HN ASN 6 -9.114 7.999 14.104 40 HA ASN 6 HA ASN 6 -7.011 9.875 13.419 41 1HB ASN 6 HB2 ASN 6 -7.764 7.130 12.412 42 2HB ASN 6 HB1 ASN 6 -6.419 8.041 11.725 43 1HD2 ASN 6 HD22 ASN 6 -4.333 7.642 14.591 44 2HD2 ASN 6 HD21 ASN 6 -4.593 8.566 13.190 45 HA PRO 7 HA PRO 7 -9.157 11.847 10.052 46 1HB PRO 7 HB2 PRO 7 -6.888 12.145 8.318 47 2HB PRO 7 HB1 PRO 7 -7.544 13.352 9.432 48 1HG PRO 7 HG2 PRO 7 -5.101 11.747 9.718 49 2HG PRO 7 HG1 PRO 7 -5.632 13.133 10.682 50 1HD PRO 7 HD2 PRO 7 -5.637 10.403 11.512 51 2HD PRO 7 HD1 PRO 7 -6.395 11.771 12.356 52 H ARG 8 HN ARG 8 -9.829 11.327 7.821 53 HA ARG 8 HA ARG 8 -8.805 8.755 6.714 54 1HB ARG 8 HB2 ARG 8 -11.706 9.332 7.404 55 2HB ARG 8 HB1 ARG 8 -11.182 7.989 6.388 56 1HG ARG 8 HG2 ARG 8 -9.792 7.127 8.241 57 2HG ARG 8 HG1 ARG 8 -10.329 8.462 9.260 58 1HD ARG 8 HD2 ARG 8 -12.681 7.688 8.981 59 2HD ARG 8 HD1 ARG 8 -12.091 6.311 8.053 60 HE ARG 8 HE ARG 8 -10.675 6.205 10.455 61 1HH1 ARG 8 HH21 ARG 8 -13.970 6.322 9.455 62 2HH1 ARG 8 HH22 ARG 8 -14.554 5.422 10.814 63 1HH2 ARG 8 HH11 ARG 8 -11.420 5.044 12.246 64 2HH2 ARG 8 HH12 ARG 8 -13.112 4.699 12.395 65 H TRP 9 HN TRP 9 -9.371 8.506 4.432 66 HA TRP 9 HA TRP 9 -9.340 11.013 3.008 67 1HB TRP 9 HB2 TRP 9 -9.836 8.183 2.037 68 2HB TRP 9 HB1 TRP 9 -9.572 9.572 0.982 69 HD1 TRP 9 HD1 TRP 9 -7.774 7.019 3.020 70 HE1 TRP 9 HE1 TRP 9 -5.235 7.453 2.950 71 HE3 TRP 9 HE3 TRP 9 -7.726 11.647 0.857 72 HZ2 TRP 9 HZ2 TRP 9 -3.421 9.495 2.093 73 HZ3 TRP 9 HZ3 TRP 9 -5.580 12.810 0.424 74 HH2 TRP 9 HH2 TRP 9 -3.431 11.741 1.038 75 H GLU 10 HN GLU 10 -11.075 12.288 2.677 76 HA GLU 10 HA GLU 10 -13.799 11.255 3.049 77 1HB GLU 10 HB2 GLU 10 -12.755 13.999 2.283 78 2HB GLU 10 HB1 GLU 10 -14.449 13.625 2.602 79 1HG GLU 10 HG2 GLU 10 -12.237 13.101 4.600 80 2HG GLU 10 HG1 GLU 10 -13.186 14.587 4.579 81 H GLN 11 HN GLN 11 -11.627 11.521 0.447 82 HA GLN 11 HA GLN 11 -13.702 11.935 -1.609 83 1HB GLN 11 HB2 GLN 11 -10.732 11.352 -1.794 84 2HB GLN 11 HB1 GLN 11 -11.776 11.628 -3.187 85 1HG GLN 11 HG2 GLN 11 -11.436 13.603 -0.912 86 2HG GLN 11 HG1 GLN 11 -10.542 13.682 -2.432 87 1HE2 GLN 11 HE22 GLN 11 -14.234 15.214 -2.299 88 2HE2 GLN 11 HE21 GLN 11 -13.350 14.792 -0.913 89 H THR 12 HN THR 12 -14.444 10.346 -3.027 90 HA THR 12 HA THR 12 -14.028 7.537 -2.154 91 HB THR 12 HB THR 12 -15.887 7.044 -3.720 92 HG1 THR 12 HG1 THR 12 -15.441 9.741 -4.351 93 1HG2 THR 12 HG23 THR 12 -16.328 7.820 -1.373 94 2HG2 THR 12 HG22 THR 12 -16.513 9.457 -2.001 95 3HG2 THR 12 HG21 THR 12 -17.635 8.190 -2.497 96 H HIS 13 HN HIS 13 -12.656 9.732 -4.204 97 HA HIS 13 HA HIS 13 -11.562 7.599 -6.005 98 1HB HIS 13 HB2 HIS 13 -12.263 10.477 -6.688 99 2HB HIS 13 HB1 HIS 13 -11.370 9.388 -7.750 100 HD1 HIS 13 HD1 HIS 13 -14.750 9.653 -6.029 101 HD2 HIS 13 HD2 HIS 13 -12.980 7.684 -9.248 102 HE1 HIS 13 HE1 HIS 13 -16.623 8.489 -7.275 103 H LEU 14 HN LEU 14 -9.341 7.537 -6.002 104 HA LEU 14 HA LEU 14 -7.838 9.896 -4.924 105 1HB LEU 14 HB2 LEU 14 -7.376 6.985 -4.194 106 2HB LEU 14 HB1 LEU 14 -6.395 8.346 -3.656 107 HG LEU 14 HG LEU 14 -9.370 8.110 -3.109 108 1HD1 LEU 14 HD12 LEU 14 -6.980 7.278 -1.451 109 2HD1 LEU 14 HD11 LEU 14 -8.573 7.573 -0.750 110 3HD1 LEU 14 HD13 LEU 14 -8.356 6.287 -1.940 111 1HD2 LEU 14 HD22 LEU 14 -7.172 9.989 -2.226 112 2HD2 LEU 14 HD21 LEU 14 -8.763 10.383 -2.872 113 3HD2 LEU 14 HD23 LEU 14 -8.609 9.759 -1.233 114 H THR 15 HN THR 15 -5.567 9.892 -5.614 115 HA THR 15 HA THR 15 -5.083 8.284 -8.106 116 HB THR 15 HB THR 15 -4.099 10.224 -9.145 117 HG1 THR 15 HG1 THR 15 -4.650 11.552 -6.703 118 1HG2 THR 15 HG22 THR 15 -6.634 10.000 -9.087 119 2HG2 THR 15 HG21 THR 15 -6.621 11.205 -7.800 120 3HG2 THR 15 HG23 THR 15 -6.022 11.622 -9.405 121 H TYR 16 HN TYR 16 -2.771 7.997 -8.588 122 HA TYR 16 HA TYR 16 -0.915 8.535 -6.333 123 1HB TYR 16 HB2 TYR 16 -0.212 6.211 -6.170 124 2HB TYR 16 HB1 TYR 16 -1.949 6.306 -5.887 125 HD1 TYR 16 HD2 TYR 16 -3.553 5.548 -7.593 126 HD2 TYR 16 HD1 TYR 16 0.686 5.173 -8.186 127 HE1 TYR 16 HE2 TYR 16 -3.954 3.957 -9.451 128 HE2 TYR 16 HE1 TYR 16 0.283 3.581 -10.047 129 HH TYR 16 HH TYR 16 -2.066 1.889 -10.535 130 H ARG 17 HN ARG 17 1.342 8.249 -6.960 131 HA ARG 17 HA ARG 17 1.871 7.840 -9.852 132 1HB ARG 17 HB2 ARG 17 1.374 10.260 -9.607 133 2HB ARG 17 HB1 ARG 17 2.626 10.382 -8.373 134 1HG ARG 17 HG2 ARG 17 4.327 9.673 -10.009 135 2HG ARG 17 HG1 ARG 17 3.081 9.526 -11.248 136 1HD ARG 17 HD2 ARG 17 2.603 11.916 -11.100 137 2HD ARG 17 HD1 ARG 17 3.750 12.088 -9.770 138 HE ARG 17 HE ARG 17 5.260 10.992 -11.821 139 1HH1 ARG 17 HH21 ARG 17 3.188 13.717 -11.408 140 2HH1 ARG 17 HH22 ARG 17 4.036 14.702 -12.554 141 1HH2 ARG 17 HH11 ARG 17 6.376 12.257 -13.318 142 2HH2 ARG 17 HH12 ARG 17 5.840 13.871 -13.641 143 H ILE 18 HN ILE 18 3.829 6.837 -10.137 144 HA ILE 18 HA ILE 18 5.511 6.369 -7.737 145 HB ILE 18 HB ILE 18 5.716 5.267 -10.561 146 1HG1 ILE 18 HG12 ILE 18 4.825 3.898 -8.007 147 2HG1 ILE 18 HG11 ILE 18 3.703 4.595 -9.175 148 1HG2 ILE 18 HG22 ILE 18 7.207 4.613 -8.002 149 2HG2 ILE 18 HG21 ILE 18 7.262 3.618 -9.457 150 3HG2 ILE 18 HG23 ILE 18 7.897 5.262 -9.490 151 1HD1 ILE 18 HD13 ILE 18 4.639 3.138 -10.939 152 2HD1 ILE 18 HD12 ILE 18 5.741 2.428 -9.761 153 3HD1 ILE 18 HD11 ILE 18 4.002 2.187 -9.597 154 H GLU 19 HN GLU 19 7.209 7.702 -7.351 155 HA GLU 19 HA GLU 19 7.941 9.799 -9.171 156 1HB GLU 19 HB2 GLU 19 9.258 8.722 -6.672 157 2HB GLU 19 HB1 GLU 19 9.848 10.139 -7.541 158 1HG GLU 19 HG2 GLU 19 7.649 11.228 -7.267 159 2HG GLU 19 HG1 GLU 19 7.060 9.815 -6.394 160 H ASN 20 HN ASN 20 9.496 6.682 -8.392 161 HA ASN 20 HA ASN 20 10.845 6.739 -10.980 162 1HB ASN 20 HB2 ASN 20 13.126 6.741 -10.144 163 2HB ASN 20 HB1 ASN 20 12.314 8.194 -9.565 164 1HD2 ASN 20 HD22 ASN 20 14.024 6.723 -6.617 165 2HD2 ASN 20 HD21 ASN 20 14.498 7.436 -8.083 166 H TYR 21 HN TYR 21 12.033 4.736 -11.379 167 HA TYR 21 HA TYR 21 10.957 2.464 -9.755 168 1HB TYR 21 HB2 TYR 21 12.079 2.560 -12.575 169 2HB TYR 21 HB1 TYR 21 11.501 1.103 -11.767 170 HD1 TYR 21 HD1 TYR 21 9.120 0.794 -11.271 171 HD2 TYR 21 HD2 TYR 21 10.529 4.277 -13.352 172 HE1 TYR 21 HE1 TYR 21 6.801 1.309 -11.978 173 HE2 TYR 21 HE2 TYR 21 8.207 4.794 -14.059 174 HH TYR 21 HH TYR 21 5.463 2.895 -12.876 175 H THR 22 HN THR 22 12.400 1.174 -8.649 176 HA THR 22 HA THR 22 15.157 2.005 -8.479 177 HB THR 22 HB THR 22 14.241 1.073 -6.493 178 HG1 THR 22 HG1 THR 22 15.537 -0.797 -6.197 179 1HG2 THR 22 HG21 THR 22 13.328 -1.180 -8.289 180 2HG2 THR 22 HG23 THR 22 13.334 -1.314 -6.531 181 3HG2 THR 22 HG22 THR 22 12.333 -0.095 -7.319 182 HA PRO 23 HA PRO 23 16.621 -0.442 -11.923 183 1HB PRO 23 HB2 PRO 23 19.227 -0.989 -10.896 184 2HB PRO 23 HB1 PRO 23 18.770 0.363 -11.942 185 1HG PRO 23 HG2 PRO 23 19.377 0.397 -9.057 186 2HG PRO 23 HG1 PRO 23 19.275 1.757 -10.186 187 1HD PRO 23 HD2 PRO 23 17.351 1.090 -8.202 188 2HD PRO 23 HD1 PRO 23 17.132 2.242 -9.539 189 H ASP 24 HN ASP 24 15.964 -1.531 -8.879 190 HA ASP 24 HA ASP 24 17.140 -4.145 -8.829 191 1HB ASP 24 HB2 ASP 24 14.640 -3.025 -7.533 192 2HB ASP 24 HB1 ASP 24 15.243 -4.653 -7.221 193 H LEU 25 HN LEU 25 14.065 -2.928 -10.137 194 HA LEU 25 HA LEU 25 13.859 -5.401 -11.773 195 1HB LEU 25 HB2 LEU 25 11.691 -4.264 -9.989 196 2HB LEU 25 HB1 LEU 25 11.352 -5.406 -11.281 197 HG LEU 25 HG LEU 25 13.321 -5.949 -9.039 198 1HD1 LEU 25 HD12 LEU 25 10.377 -6.571 -9.299 199 2HD1 LEU 25 HD11 LEU 25 11.439 -7.489 -8.233 200 3HD1 LEU 25 HD13 LEU 25 11.204 -5.760 -7.971 201 1HD2 LEU 25 HD23 LEU 25 12.193 -7.554 -11.336 202 2HD2 LEU 25 HD22 LEU 25 13.856 -7.460 -10.756 203 3HD2 LEU 25 HD21 LEU 25 12.661 -8.380 -9.850 204 HA PRO 26 HA PRO 26 12.946 -2.458 -14.963 205 1HB PRO 26 HB2 PRO 26 10.848 -4.003 -16.236 206 2HB PRO 26 HB1 PRO 26 12.534 -3.835 -16.747 207 1HG PRO 26 HG2 PRO 26 11.267 -6.139 -15.500 208 2HG PRO 26 HG1 PRO 26 12.924 -5.999 -16.105 209 1HD PRO 26 HD2 PRO 26 12.102 -6.099 -13.359 210 2HD PRO 26 HD1 PRO 26 13.740 -5.807 -13.982 211 H ARG 27 HN ARG 27 11.235 -0.931 -15.569 212 HA ARG 27 HA ARG 27 9.377 -0.383 -13.432 213 1HB ARG 27 HB2 ARG 27 8.568 1.430 -14.906 214 2HB ARG 27 HB1 ARG 27 10.331 1.408 -14.845 215 1HG ARG 27 HG2 ARG 27 10.281 -0.002 -16.953 216 2HG ARG 27 HG1 ARG 27 8.553 0.334 -17.046 217 1HD ARG 27 HD2 ARG 27 8.980 2.736 -17.166 218 2HD ARG 27 HD1 ARG 27 10.709 2.467 -16.943 219 HE ARG 27 HE ARG 27 10.092 0.970 -19.192 220 1HH1 ARG 27 HH21 ARG 27 9.619 4.228 -18.156 221 2HH1 ARG 27 HH22 ARG 27 9.714 4.891 -19.753 222 1HH2 ARG 27 HH11 ARG 27 10.216 1.821 -21.286 223 2HH2 ARG 27 HH12 ARG 27 10.049 3.529 -21.524 224 H ALA 28 HN ALA 28 9.142 -2.039 -16.511 225 HA ALA 28 HA ALA 28 6.318 -2.092 -16.803 226 1HB ALA 28 HB3 ALA 28 8.004 -2.850 -18.514 227 2HB ALA 28 HB2 ALA 28 8.231 -4.313 -17.556 228 3HB ALA 28 HB1 ALA 28 6.661 -3.968 -18.281 229 H ASP 29 HN ASP 29 8.476 -4.289 -15.004 230 HA ASP 29 HA ASP 29 6.261 -6.019 -14.216 231 1HB ASP 29 HB2 ASP 29 9.149 -5.834 -13.331 232 2HB ASP 29 HB1 ASP 29 8.020 -7.028 -12.693 233 H VAL 30 HN VAL 30 7.939 -3.270 -12.837 234 HA VAL 30 HA VAL 30 6.951 -3.615 -10.145 235 HB VAL 30 HB VAL 30 8.013 -1.217 -11.658 236 1HG1 VAL 30 HG12 VAL 30 7.035 -1.490 -8.812 237 2HG1 VAL 30 HG11 VAL 30 8.264 -0.300 -9.242 238 3HG1 VAL 30 HG13 VAL 30 6.666 -0.224 -9.984 239 1HG2 VAL 30 HG22 VAL 30 9.595 -3.073 -11.160 240 2HG2 VAL 30 HG21 VAL 30 10.001 -1.610 -10.263 241 3HG2 VAL 30 HG23 VAL 30 9.183 -2.944 -9.451 242 H ASP 31 HN ASP 31 5.790 -1.830 -12.987 243 HA ASP 31 HA ASP 31 3.598 -0.497 -11.743 244 1HB ASP 31 HB2 ASP 31 3.970 -1.555 -14.561 245 2HB ASP 31 HB1 ASP 31 2.580 -0.585 -14.072 246 H HIS 32 HN HIS 32 3.929 -3.741 -13.116 247 HA HIS 32 HA HIS 32 1.216 -4.563 -12.947 248 1HB HIS 32 HB2 HIS 32 3.022 -5.820 -14.114 249 2HB HIS 32 HB1 HIS 32 3.703 -6.249 -12.545 250 HD1 HIS 32 HD1 HIS 32 0.795 -6.942 -14.804 251 HD2 HIS 32 HD2 HIS 32 2.217 -8.206 -11.094 252 HE1 HIS 32 HE1 HIS 32 -0.557 -8.988 -14.178 253 H ALA 33 HN ALA 33 3.857 -5.003 -10.552 254 HA ALA 33 HA ALA 33 2.293 -6.320 -8.572 255 1HB ALA 33 HB1 ALA 33 4.724 -4.534 -8.358 256 2HB ALA 33 HB3 ALA 33 4.025 -5.361 -6.966 257 3HB ALA 33 HB2 ALA 33 4.671 -6.296 -8.314 258 H ILE 34 HN ILE 34 2.906 -2.838 -9.051 259 HA ILE 34 HA ILE 34 1.396 -1.998 -6.739 260 HB ILE 34 HB ILE 34 2.097 -0.501 -9.280 261 1HG1 ILE 34 HG12 ILE 34 4.093 -1.313 -8.119 262 2HG1 ILE 34 HG11 ILE 34 3.957 0.429 -7.918 263 1HG2 ILE 34 HG22 ILE 34 0.969 0.386 -6.628 264 2HG2 ILE 34 HG21 ILE 34 1.849 1.497 -7.675 265 3HG2 ILE 34 HG23 ILE 34 0.367 0.730 -8.247 266 1HD1 ILE 34 HD12 ILE 34 2.661 -0.268 -5.691 267 2HD1 ILE 34 HD11 ILE 34 3.594 -1.749 -5.893 268 3HD1 ILE 34 HD13 ILE 34 4.420 -0.203 -5.735 269 H GLU 35 HN GLU 35 0.591 -2.389 -10.173 270 HA GLU 35 HA GLU 35 -2.002 -1.240 -10.083 271 1HB GLU 35 HB2 GLU 35 -0.842 -1.815 -12.179 272 2HB GLU 35 HB1 GLU 35 -0.994 -3.530 -11.797 273 1HG GLU 35 HG2 GLU 35 -3.447 -3.345 -11.848 274 2HG GLU 35 HG1 GLU 35 -3.317 -1.616 -12.179 275 H LYS 36 HN LYS 36 -1.009 -4.652 -9.555 276 HA LYS 36 HA LYS 36 -3.661 -5.617 -9.115 277 1HB LYS 36 HB2 LYS 36 -0.962 -6.626 -8.205 278 2HB LYS 36 HB1 LYS 36 -2.460 -7.461 -7.791 279 1HG LYS 36 HG2 LYS 36 -3.035 -7.624 -10.183 280 2HG LYS 36 HG1 LYS 36 -1.529 -6.805 -10.597 281 1HD LYS 36 HD2 LYS 36 -0.195 -8.616 -9.885 282 2HD LYS 36 HD1 LYS 36 -1.497 -9.316 -8.920 283 1HE LYS 36 HE2 LYS 36 -2.669 -10.063 -10.847 284 2HE LYS 36 HE1 LYS 36 -1.704 -9.057 -11.925 285 1HZ LYS 36 HZ3 LYS 36 -0.609 -11.289 -10.306 286 2HZ LYS 36 HZ2 LYS 36 -1.076 -11.434 -11.933 287 3HZ LYS 36 HZ1 LYS 36 0.203 -10.402 -11.502 288 H ALA 37 HN ALA 37 -1.308 -4.188 -6.858 289 HA ALA 37 HA ALA 37 -2.723 -4.807 -4.469 290 1HB ALA 37 HB3 ALA 37 -0.406 -3.810 -4.619 291 2HB ALA 37 HB2 ALA 37 -1.165 -2.262 -4.986 292 3HB ALA 37 HB1 ALA 37 -1.455 -3.039 -3.430 293 H PHE 38 HN PHE 38 -2.892 -1.787 -6.428 294 HA PHE 38 HA PHE 38 -4.997 -0.611 -4.903 295 1HB PHE 38 HB2 PHE 38 -4.087 -0.262 -7.766 296 2HB PHE 38 HB1 PHE 38 -5.495 0.605 -7.153 297 HD1 PHE 38 HD2 PHE 38 -5.111 1.732 -4.742 298 HD2 PHE 38 HD1 PHE 38 -2.009 0.810 -7.572 299 HE1 PHE 38 HE2 PHE 38 -3.634 3.416 -3.675 300 HE2 PHE 38 HE1 PHE 38 -0.536 2.494 -6.503 301 HZ PHE 38 HZ PHE 38 -1.349 3.798 -4.555 302 H GLN 39 HN GLN 39 -5.099 -2.782 -7.720 303 HA GLN 39 HA GLN 39 -7.916 -2.706 -8.117 304 1HB GLN 39 HB2 GLN 39 -5.876 -4.869 -8.673 305 2HB GLN 39 HB1 GLN 39 -7.565 -4.980 -9.174 306 1HG GLN 39 HG2 GLN 39 -7.360 -2.966 -10.510 307 2HG GLN 39 HG1 GLN 39 -5.721 -2.692 -9.920 308 1HE2 GLN 39 HE22 GLN 39 -5.741 -4.549 -13.259 309 2HE2 GLN 39 HE21 GLN 39 -6.581 -3.166 -12.748 310 H LEU 40 HN LEU 40 -5.939 -4.865 -6.064 311 HA LEU 40 HA LEU 40 -8.082 -6.534 -5.224 312 1HB LEU 40 HB2 LEU 40 -5.529 -5.726 -3.821 313 2HB LEU 40 HB1 LEU 40 -6.642 -6.921 -3.162 314 HG LEU 40 HG LEU 40 -5.416 -7.113 -5.929 315 1HD1 LEU 40 HD13 LEU 40 -4.548 -8.384 -3.315 316 2HD1 LEU 40 HD12 LEU 40 -3.928 -8.842 -4.901 317 3HD1 LEU 40 HD11 LEU 40 -3.632 -7.221 -4.272 318 1HD2 LEU 40 HD21 LEU 40 -7.230 -8.851 -4.267 319 2HD2 LEU 40 HD23 LEU 40 -7.246 -8.547 -6.005 320 3HD2 LEU 40 HD22 LEU 40 -6.053 -9.642 -5.315 321 H TRP 41 HN TRP 41 -6.943 -3.436 -3.866 322 HA TRP 41 HA TRP 41 -8.793 -3.539 -1.637 323 1HB TRP 41 HB2 TRP 41 -7.217 -1.275 -2.879 324 2HB TRP 41 HB1 TRP 41 -8.227 -1.075 -1.449 325 HD1 TRP 41 HD1 TRP 41 -4.813 -1.921 -2.435 326 HE1 TRP 41 HE1 TRP 41 -3.506 -2.975 -0.483 327 HE3 TRP 41 HE3 TRP 41 -8.667 -2.924 0.765 328 HZ2 TRP 41 HZ2 TRP 41 -4.022 -4.096 2.093 329 HZ3 TRP 41 HZ3 TRP 41 -8.228 -3.987 2.963 330 HH2 TRP 41 HH2 TRP 41 -5.912 -4.575 3.630 331 H SER 42 HN SER 42 -8.891 -1.993 -4.848 332 HA SER 42 HA SER 42 -11.366 -0.588 -4.376 333 1HB SER 42 HB2 SER 42 -9.919 0.149 -6.165 334 2HB SER 42 HB1 SER 42 -9.984 -1.435 -6.934 335 HG SER 42 HG SER 42 -11.632 0.628 -7.238 336 H ASN 43 HN ASN 43 -10.615 -3.829 -5.485 337 HA ASN 43 HA ASN 43 -13.085 -4.486 -6.703 338 1HB ASN 43 HB2 ASN 43 -11.127 -6.213 -5.168 339 2HB ASN 43 HB1 ASN 43 -12.484 -6.853 -6.095 340 1HD2 ASN 43 HD22 ASN 43 -9.353 -6.642 -8.236 341 2HD2 ASN 43 HD21 ASN 43 -9.632 -7.300 -6.697 342 H VAL 44 HN VAL 44 -12.133 -4.602 -3.264 343 HA VAL 44 HA VAL 44 -14.909 -5.470 -2.576 344 HB VAL 44 HB VAL 44 -14.050 -6.140 -0.450 345 1HG1 VAL 44 HG13 VAL 44 -13.453 -7.529 -2.495 346 2HG1 VAL 44 HG12 VAL 44 -11.858 -6.781 -2.440 347 3HG1 VAL 44 HG11 VAL 44 -12.410 -7.776 -1.094 348 1HG2 VAL 44 HG21 VAL 44 -11.677 -4.439 -1.231 349 2HG2 VAL 44 HG23 VAL 44 -12.647 -4.370 0.239 350 3HG2 VAL 44 HG22 VAL 44 -11.520 -5.701 -0.008 351 H THR 45 HN THR 45 -13.748 -2.612 -3.266 352 HA THR 45 HA THR 45 -15.326 -1.287 -1.139 353 HB THR 45 HB THR 45 -13.623 0.397 -0.707 354 HG1 THR 45 HG1 THR 45 -12.748 0.127 -2.912 355 1HG2 THR 45 HG21 THR 45 -13.569 -1.893 0.464 356 2HG2 THR 45 HG23 THR 45 -12.202 -2.255 -0.587 357 3HG2 THR 45 HG22 THR 45 -12.107 -0.912 0.546 358 HA PRO 46 HA PRO 46 -16.667 0.976 -4.767 359 1HB PRO 46 HB2 PRO 46 -17.534 3.334 -3.463 360 2HB PRO 46 HB1 PRO 46 -18.519 1.891 -3.745 361 1HG PRO 46 HG2 PRO 46 -17.306 2.840 -1.217 362 2HG PRO 46 HG1 PRO 46 -18.623 1.682 -1.455 363 1HD PRO 46 HD2 PRO 46 -15.952 1.037 -0.731 364 2HD PRO 46 HD1 PRO 46 -17.202 -0.101 -1.283 365 H LEU 47 HN LEU 47 -13.993 1.592 -2.997 366 HA LEU 47 HA LEU 47 -13.335 4.297 -3.838 367 1HB LEU 47 HB2 LEU 47 -11.544 2.068 -2.817 368 2HB LEU 47 HB1 LEU 47 -11.087 3.764 -2.966 369 HG LEU 47 HG LEU 47 -13.352 2.723 -1.234 370 1HD1 LEU 47 HD11 LEU 47 -10.500 3.523 -0.625 371 2HD1 LEU 47 HD13 LEU 47 -11.753 3.507 0.614 372 3HD1 LEU 47 HD12 LEU 47 -11.320 2.015 -0.219 373 1HD2 LEU 47 HD21 LEU 47 -12.266 5.467 -1.863 374 2HD2 LEU 47 HD23 LEU 47 -13.943 4.941 -1.709 375 3HD2 LEU 47 HD22 LEU 47 -12.954 5.156 -0.269 376 H THR 48 HN THR 48 -11.830 4.903 -5.453 377 HA THR 48 HA THR 48 -11.086 2.783 -7.446 378 HB THR 48 HB THR 48 -11.615 4.408 -9.243 379 HG1 THR 48 HG1 THR 48 -13.197 6.051 -7.930 380 1HG2 THR 48 HG22 THR 48 -13.847 3.744 -7.311 381 2HG2 THR 48 HG21 THR 48 -14.122 4.378 -8.934 382 3HG2 THR 48 HG23 THR 48 -13.339 2.814 -8.720 383 H PHE 49 HN PHE 49 -9.070 3.153 -8.480 384 HA PHE 49 HA PHE 49 -7.496 5.512 -7.482 385 1HB PHE 49 HB2 PHE 49 -6.536 2.661 -7.859 386 2HB PHE 49 HB1 PHE 49 -5.514 4.033 -7.420 387 HD1 PHE 49 HD2 PHE 49 -5.756 5.147 -5.239 388 HD2 PHE 49 HD1 PHE 49 -8.096 1.694 -6.268 389 HE1 PHE 49 HE2 PHE 49 -6.393 4.870 -2.860 390 HE2 PHE 49 HE1 PHE 49 -8.731 1.415 -3.885 391 HZ PHE 49 HZ PHE 49 -7.878 3.004 -2.181 392 H THR 50 HN THR 50 -6.610 6.696 -9.057 393 HA THR 50 HA THR 50 -6.349 5.519 -11.808 394 HB THR 50 HB THR 50 -6.968 8.381 -11.015 395 HG1 THR 50 HG1 THR 50 -8.678 6.813 -10.788 396 1HG2 THR 50 HG21 THR 50 -6.584 7.012 -13.684 397 2HG2 THR 50 HG23 THR 50 -7.392 8.572 -13.515 398 3HG2 THR 50 HG22 THR 50 -5.701 8.398 -13.045 399 H LYS 51 HN LYS 51 -4.314 5.575 -12.640 400 HA LYS 51 HA LYS 51 -2.152 6.761 -11.068 401 1HB LYS 51 HB2 LYS 51 -1.898 4.610 -12.337 402 2HB LYS 51 HB1 LYS 51 -2.019 5.530 -13.837 403 1HG LYS 51 HG2 LYS 51 -0.059 6.873 -13.177 404 2HG LYS 51 HG1 LYS 51 0.069 5.954 -11.676 405 1HD LYS 51 HD2 LYS 51 0.393 3.882 -12.984 406 2HD LYS 51 HD1 LYS 51 0.294 4.815 -14.477 407 1HE LYS 51 HE2 LYS 51 2.249 6.158 -13.746 408 2HE LYS 51 HE1 LYS 51 2.371 5.166 -12.293 409 1HZ LYS 51 HZ2 LYS 51 2.391 3.238 -14.013 410 2HZ LYS 51 HZ1 LYS 51 2.912 4.448 -15.086 411 3HZ LYS 51 HZ3 LYS 51 3.817 4.106 -13.694 412 H VAL 52 HN VAL 52 -1.086 8.675 -11.517 413 HA VAL 52 HA VAL 52 -2.034 10.248 -13.899 414 HB VAL 52 HB VAL 52 -1.703 12.270 -12.540 415 1HG1 VAL 52 HG13 VAL 52 -3.466 10.096 -11.394 416 2HG1 VAL 52 HG12 VAL 52 -3.523 11.762 -10.818 417 3HG1 VAL 52 HG11 VAL 52 -3.920 11.395 -12.496 418 1HG2 VAL 52 HG21 VAL 52 -0.892 10.248 -10.433 419 2HG2 VAL 52 HG23 VAL 52 0.047 11.612 -11.040 420 3HG2 VAL 52 HG22 VAL 52 -1.371 11.897 -10.033 421 H SER 53 HN SER 53 -0.446 10.929 -15.252 422 HA SER 53 HA SER 53 2.359 10.277 -14.548 423 1HB SER 53 HB2 SER 53 1.361 9.644 -16.770 424 2HB SER 53 HB1 SER 53 1.252 11.359 -17.153 425 HG SER 53 HG SER 53 3.694 10.841 -16.227 426 H GLU 54 HN GLU 54 0.347 12.947 -14.258 427 HA GLU 54 HA GLU 54 2.693 14.735 -13.939 428 1HB GLU 54 HB2 GLU 54 0.365 15.328 -15.793 429 2HB GLU 54 HB1 GLU 54 1.490 16.556 -15.219 430 1HG GLU 54 HG2 GLU 54 3.366 15.314 -16.239 431 2HG GLU 54 HG1 GLU 54 2.237 14.089 -16.816 432 H GLY 55 HN GLY 55 2.095 16.707 -12.723 433 1HA GLY 55 HA2 GLY 55 0.772 17.929 -11.182 434 2HA GLY 55 HA1 GLY 55 -0.576 16.844 -11.526 435 H GLN 56 HN GLN 56 -0.057 17.535 -8.905 436 HA GLN 56 HA GLN 56 1.604 15.479 -7.641 437 1HB GLN 56 HB2 GLN 56 1.345 17.754 -6.660 438 2HB GLN 56 HB1 GLN 56 -0.373 17.438 -6.422 439 1HG GLN 56 HG2 GLN 56 0.865 17.033 -4.336 440 2HG GLN 56 HG1 GLN 56 0.194 15.523 -4.950 441 1HE2 GLN 56 HE22 GLN 56 3.370 14.031 -4.922 442 2HE2 GLN 56 HE21 GLN 56 1.698 13.880 -4.668 443 H ALA 57 HN ALA 57 0.844 13.587 -6.691 444 HA ALA 57 HA ALA 57 -2.032 12.913 -7.186 445 1HB ALA 57 HB1 ALA 57 0.069 11.551 -8.066 446 2HB ALA 57 HB3 ALA 57 0.033 10.858 -6.445 447 3HB ALA 57 HB2 ALA 57 -1.372 10.707 -7.502 448 H ASP 58 HN ASP 58 -3.189 11.762 -5.507 449 HA ASP 58 HA ASP 58 -2.874 12.843 -2.895 450 1HB ASP 58 HB2 ASP 58 -4.378 10.422 -3.907 451 2HB ASP 58 HB1 ASP 58 -4.466 10.969 -2.232 452 H ILE 59 HN ILE 59 -1.802 9.734 -4.264 453 HA ILE 59 HA ILE 59 -0.228 9.266 -1.736 454 HB ILE 59 HB ILE 59 -1.332 7.243 -3.714 455 1HG1 ILE 59 HG12 ILE 59 -2.134 7.733 -0.833 456 2HG1 ILE 59 HG11 ILE 59 -2.990 8.446 -2.199 457 1HG2 ILE 59 HG22 ILE 59 0.248 6.992 -1.140 458 2HG2 ILE 59 HG21 ILE 59 -0.638 5.648 -1.858 459 3HG2 ILE 59 HG23 ILE 59 0.697 6.392 -2.737 460 1HD1 ILE 59 HD13 ILE 59 -2.550 5.472 -1.805 461 2HD1 ILE 59 HD12 ILE 59 -4.045 6.327 -1.427 462 3HD1 ILE 59 HD11 ILE 59 -3.485 6.228 -3.095 463 H MET 60 HN MET 60 1.899 9.649 -2.109 464 HA MET 60 HA MET 60 3.008 9.267 -4.853 465 1HB MET 60 HB2 MET 60 4.205 10.620 -2.416 466 2HB MET 60 HB1 MET 60 4.935 10.557 -4.020 467 1HG MET 60 HG2 MET 60 2.209 11.755 -3.448 468 2HG MET 60 HG1 MET 60 3.691 12.701 -3.563 469 1HE MET 60 HE1 MET 60 5.294 12.496 -5.243 470 2HE MET 60 HE3 MET 60 5.099 11.921 -6.904 471 3HE MET 60 HE2 MET 60 4.547 13.530 -6.453 472 H ILE 61 HN ILE 61 4.456 7.662 -5.276 473 HA ILE 61 HA ILE 61 5.472 6.010 -2.975 474 HB ILE 61 HB ILE 61 4.774 5.110 -5.789 475 1HG1 ILE 61 HG12 ILE 61 3.454 4.362 -3.164 476 2HG1 ILE 61 HG11 ILE 61 2.857 5.659 -4.200 477 1HG2 ILE 61 HG22 ILE 61 6.033 3.749 -3.408 478 2HG2 ILE 61 HG21 ILE 61 5.109 2.816 -4.585 479 3HG2 ILE 61 HG23 ILE 61 6.538 3.713 -5.096 480 1HD1 ILE 61 HD11 ILE 61 2.621 4.062 -6.066 481 2HD1 ILE 61 HD13 ILE 61 3.209 2.764 -5.026 482 3HD1 ILE 61 HD12 ILE 61 1.672 3.551 -4.670 483 H SER 62 HN SER 62 7.673 5.886 -2.854 484 HA SER 62 HA SER 62 9.291 6.238 -5.320 485 1HB SER 62 HB2 SER 62 10.603 8.048 -4.413 486 2HB SER 62 HB1 SER 62 8.908 8.517 -4.304 487 HG SER 62 HG SER 62 9.020 8.417 -2.195 488 H PHE 63 HN PHE 63 11.640 5.813 -4.847 489 HA PHE 63 HA PHE 63 11.964 3.836 -2.603 490 1HB PHE 63 HB2 PHE 63 13.223 3.935 -5.363 491 2HB PHE 63 HB1 PHE 63 13.710 2.811 -4.096 492 HD1 PHE 63 HD1 PHE 63 11.056 3.736 -6.469 493 HD2 PHE 63 HD2 PHE 63 12.241 0.983 -3.394 494 HE1 PHE 63 HE1 PHE 63 9.228 2.198 -7.142 495 HE2 PHE 63 HE2 PHE 63 10.413 -0.553 -4.061 496 HZ PHE 63 HZ PHE 63 8.908 0.054 -5.937 497 H VAL 64 HN VAL 64 13.744 4.188 -1.243 498 HA VAL 64 HA VAL 64 15.743 6.259 -2.054 499 HB VAL 64 HB VAL 64 15.560 7.295 0.193 500 1HG1 VAL 64 HG11 VAL 64 14.284 8.126 -1.824 501 2HG1 VAL 64 HG13 VAL 64 12.889 7.224 -1.233 502 3HG1 VAL 64 HG12 VAL 64 13.552 8.549 -0.276 503 1HG2 VAL 64 HG22 VAL 64 13.188 5.418 0.429 504 2HG2 VAL 64 HG21 VAL 64 14.641 5.402 1.429 505 3HG2 VAL 64 HG23 VAL 64 13.513 6.754 1.533 506 H ARG 65 HN ARG 65 17.572 6.336 -0.388 507 HA ARG 65 HA ARG 65 18.149 3.584 0.676 508 1HB ARG 65 HB2 ARG 65 19.985 5.533 -0.742 509 2HB ARG 65 HB1 ARG 65 20.558 4.119 0.139 510 1HG ARG 65 HG2 ARG 65 19.260 2.650 -1.314 511 2HG ARG 65 HG1 ARG 65 18.602 4.038 -2.177 512 1HD ARG 65 HD2 ARG 65 20.886 4.691 -2.843 513 2HD ARG 65 HD1 ARG 65 21.544 3.294 -2.003 514 HE ARG 65 HE ARG 65 20.421 3.372 -4.671 515 1HH1 ARG 65 HH21 ARG 65 20.448 1.411 -1.822 516 2HH1 ARG 65 HH22 ARG 65 19.949 -0.018 -2.661 517 1HH2 ARG 65 HH11 ARG 65 19.781 1.512 -5.755 518 2HH2 ARG 65 HH12 ARG 65 19.581 0.036 -4.872 519 H GLY 66 HN GLY 66 18.835 3.523 2.754 520 1HA GLY 66 HA2 GLY 66 19.273 4.284 4.926 521 2HA GLY 66 HA1 GLY 66 20.464 5.306 4.129 522 H ASP 67 HN ASP 67 20.200 7.180 5.272 523 HA ASP 67 HA ASP 67 17.712 8.256 6.174 524 1HB ASP 67 HB2 ASP 67 19.971 8.873 7.063 525 2HB ASP 67 HB1 ASP 67 20.263 9.773 5.574 526 H HIS 68 HN HIS 68 16.240 9.562 5.202 527 HA HIS 68 HA HIS 68 16.901 10.859 2.607 528 1HB HIS 68 HB2 HIS 68 14.669 10.069 1.733 529 2HB HIS 68 HB1 HIS 68 15.864 8.791 1.943 530 HD1 HIS 68 HD1 HIS 68 15.669 7.462 4.340 531 HD2 HIS 68 HD2 HIS 68 12.305 9.589 3.096 532 HE1 HIS 68 HE1 HIS 68 13.713 6.555 5.671 533 H ARG 69 HN ARG 69 16.873 12.453 4.661 534 HA ARG 69 HA ARG 69 15.811 14.245 5.726 535 1HB ARG 69 HB2 ARG 69 14.091 13.976 3.244 536 2HB ARG 69 HB1 ARG 69 13.923 15.297 4.401 537 1HG ARG 69 HG2 ARG 69 16.285 15.909 4.052 538 2HG ARG 69 HG1 ARG 69 16.456 14.590 2.894 539 1HD ARG 69 HD2 ARG 69 16.076 16.652 1.667 540 2HD ARG 69 HD1 ARG 69 14.640 15.639 1.517 541 HE ARG 69 HE ARG 69 14.077 17.220 3.710 542 1HH1 ARG 69 HH21 ARG 69 15.132 17.761 0.472 543 2HH1 ARG 69 HH22 ARG 69 14.355 19.301 0.336 544 1HH2 ARG 69 HH11 ARG 69 13.050 19.226 3.544 545 2HH2 ARG 69 HH12 ARG 69 13.175 20.130 2.072 546 H ASP 70 HN ASP 70 15.169 11.898 6.941 547 HA ASP 70 HA ASP 70 12.346 12.388 7.755 548 1HB ASP 70 HB2 ASP 70 12.542 10.487 6.015 549 2HB ASP 70 HB1 ASP 70 13.336 9.568 7.295 550 H ASN 71 HN ASN 71 11.874 11.439 9.877 551 HA ASN 71 HA ASN 71 14.251 11.529 11.629 552 1HB ASN 71 HB2 ASN 71 11.287 11.361 12.253 553 2HB ASN 71 HB1 ASN 71 12.566 11.558 13.452 554 1HD2 ASN 71 HD22 ASN 71 13.421 14.865 11.912 555 2HD2 ASN 71 HD21 ASN 71 14.252 13.400 12.123 556 H SER 72 HN SER 72 13.040 9.141 9.848 557 HA SER 72 HA SER 72 13.634 7.065 11.927 558 1HB SER 72 HB2 SER 72 11.166 7.285 11.601 559 2HB SER 72 HB1 SER 72 11.393 6.905 9.897 560 HG SER 72 HG SER 72 11.184 5.238 11.949 561 HA PRO 73 HA PRO 73 15.948 6.518 7.896 562 1HB PRO 73 HB2 PRO 73 18.372 6.070 9.392 563 2HB PRO 73 HB1 PRO 73 17.982 7.457 8.367 564 1HG PRO 73 HG2 PRO 73 18.131 7.388 11.259 565 2HG PRO 73 HG1 PRO 73 17.765 8.777 10.225 566 1HD PRO 73 HD2 PRO 73 15.926 7.260 11.884 567 2HD PRO 73 HD1 PRO 73 15.576 8.686 10.887 568 H PHE 74 HN PHE 74 16.755 4.476 7.132 569 HA PHE 74 HA PHE 74 15.788 2.171 8.638 570 1HB PHE 74 HB2 PHE 74 17.330 2.376 6.032 571 2HB PHE 74 HB1 PHE 74 16.653 0.882 6.681 572 HD1 PHE 74 HD1 PHE 74 14.191 0.610 6.909 573 HD2 PHE 74 HD2 PHE 74 15.928 4.051 5.014 574 HE1 PHE 74 HE1 PHE 74 11.994 1.162 5.898 575 HE2 PHE 74 HE2 PHE 74 13.730 4.606 4.008 576 HZ PHE 74 HZ PHE 74 11.763 3.162 4.449 577 H ASP 75 HN ASP 75 17.064 0.661 9.739 578 HA ASP 75 HA ASP 75 19.902 1.452 10.204 579 1HB ASP 75 HB2 ASP 75 18.383 1.058 12.166 580 2HB ASP 75 HB1 ASP 75 18.237 -0.626 11.659 581 H GLY 76 HN GLY 76 19.985 0.514 7.790 582 1HA GLY 76 HA2 GLY 76 21.225 -1.123 6.595 583 2HA GLY 76 HA1 GLY 76 21.251 -2.120 8.050 584 HA PRO 77 HA PRO 77 18.167 -3.846 4.993 585 1HB PRO 77 HB2 PRO 77 19.271 -6.474 5.355 586 2HB PRO 77 HB1 PRO 77 19.422 -5.442 3.926 587 1HG PRO 77 HG2 PRO 77 21.484 -6.107 5.863 588 2HG PRO 77 HG1 PRO 77 21.646 -5.137 4.390 589 1HD PRO 77 HD2 PRO 77 21.595 -4.206 7.138 590 2HD PRO 77 HD1 PRO 77 21.802 -3.234 5.667 591 H GLY 78 HN GLY 78 18.936 -3.952 8.208 592 1HA GLY 78 HA2 GLY 78 16.892 -5.991 8.954 593 2HA GLY 78 HA1 GLY 78 18.049 -5.237 10.056 594 H GLY 79 HN GLY 79 15.649 -5.125 11.092 595 1HA GLY 79 HA2 GLY 79 14.183 -3.522 12.018 596 2HA GLY 79 HA1 GLY 79 14.976 -2.293 11.030 597 H ASN 80 HN ASN 80 12.866 -1.434 10.459 598 HA ASN 80 HA ASN 80 10.905 -3.097 9.125 599 1HB ASN 80 HB2 ASN 80 11.261 -0.091 9.245 600 2HB ASN 80 HB1 ASN 80 9.878 -0.889 8.494 601 1HD2 ASN 80 HD22 ASN 80 9.082 -0.138 12.100 602 2HD2 ASN 80 HD21 ASN 80 9.584 0.820 10.793 603 H LEU 81 HN LEU 81 10.432 -3.172 6.882 604 HA LEU 81 HA LEU 81 12.790 -2.713 5.143 605 1HB LEU 81 HB2 LEU 81 10.142 -4.007 4.435 606 2HB LEU 81 HB1 LEU 81 11.669 -4.149 3.564 607 HG LEU 81 HG LEU 81 11.055 -5.211 6.335 608 1HD1 LEU 81 HD11 LEU 81 11.669 -6.528 3.678 609 2HD1 LEU 81 HD13 LEU 81 11.641 -7.389 5.215 610 3HD1 LEU 81 HD12 LEU 81 10.170 -6.638 4.600 611 1HD2 LEU 81 HD21 LEU 81 13.642 -4.904 4.815 612 2HD2 LEU 81 HD23 LEU 81 13.304 -4.538 6.506 613 3HD2 LEU 81 HD22 LEU 81 13.444 -6.214 5.978 614 H ALA 82 HN ALA 82 9.913 -1.109 5.971 615 HA ALA 82 HA ALA 82 10.372 1.015 4.093 616 1HB ALA 82 HB1 ALA 82 8.011 -0.798 3.489 617 2HB ALA 82 HB3 ALA 82 8.342 0.747 2.707 618 3HB ALA 82 HB2 ALA 82 9.439 -0.611 2.475 619 H HIS 83 HN HIS 83 8.393 2.599 4.188 620 HA HIS 83 HA HIS 83 6.540 2.188 6.390 621 1HB HIS 83 HB2 HIS 83 7.408 4.050 7.808 622 2HB HIS 83 HB1 HIS 83 8.503 2.673 7.739 623 HD1 HIS 83 HD1 HIS 83 9.974 5.048 8.496 624 HD2 HIS 83 HD2 HIS 83 9.125 4.331 4.480 625 HE1 HIS 83 HE1 HIS 83 11.616 6.439 7.159 626 H ALA 84 HN ALA 84 5.304 4.308 6.823 627 HA ALA 84 HA ALA 84 5.363 6.180 4.521 628 1HB ALA 84 HB1 ALA 84 2.983 4.454 5.260 629 2HB ALA 84 HB3 ALA 84 2.886 5.860 4.199 630 3HB ALA 84 HB2 ALA 84 3.852 4.463 3.726 631 H PHE 85 HN PHE 85 3.778 7.992 4.891 632 HA PHE 85 HA PHE 85 3.841 8.779 7.754 633 1HB PHE 85 HB2 PHE 85 3.175 10.330 5.233 634 2HB PHE 85 HB1 PHE 85 3.239 11.025 6.855 635 HD1 PHE 85 HD1 PHE 85 5.371 11.279 8.037 636 HD2 PHE 85 HD2 PHE 85 5.206 9.620 4.073 637 HE1 PHE 85 HE1 PHE 85 7.822 11.569 7.808 638 HE2 PHE 85 HE2 PHE 85 7.655 9.914 3.850 639 HZ PHE 85 HZ PHE 85 8.964 10.885 5.717 640 H GLN 86 HN GLN 86 1.818 9.898 8.600 641 HA GLN 86 HA GLN 86 -0.449 8.174 8.276 642 1HB GLN 86 HB2 GLN 86 -0.034 10.836 9.641 643 2HB GLN 86 HB1 GLN 86 -1.602 10.030 9.655 644 1HG GLN 86 HG2 GLN 86 -0.363 9.421 11.671 645 2HG GLN 86 HG1 GLN 86 -0.505 8.005 10.628 646 1HE2 GLN 86 HE22 GLN 86 2.988 7.598 10.722 647 2HE2 GLN 86 HE21 GLN 86 1.453 6.883 10.840 648 HA PRO 87 HA PRO 87 -2.452 9.952 4.738 649 1HB PRO 87 HB2 PRO 87 -5.123 10.012 5.860 650 2HB PRO 87 HB1 PRO 87 -4.445 8.827 4.735 651 1HG PRO 87 HG2 PRO 87 -4.980 8.499 7.582 652 2HG PRO 87 HG1 PRO 87 -4.430 7.278 6.424 653 1HD PRO 87 HD2 PRO 87 -2.873 8.476 8.503 654 2HD PRO 87 HD1 PRO 87 -2.288 7.405 7.214 655 H GLY 88 HN GLY 88 -2.000 12.105 4.440 656 1HA GLY 88 HA2 GLY 88 -3.781 14.108 5.479 657 2HA GLY 88 HA1 GLY 88 -2.228 14.183 6.310 658 HA PRO 89 HA PRO 89 -2.245 16.334 2.007 659 1HB PRO 89 HB2 PRO 89 -1.819 18.900 3.238 660 2HB PRO 89 HB1 PRO 89 -3.250 18.366 2.345 661 1HG PRO 89 HG2 PRO 89 -2.930 18.702 5.245 662 2HG PRO 89 HG1 PRO 89 -4.417 18.429 4.323 663 1HD PRO 89 HD2 PRO 89 -3.107 16.530 5.991 664 2HD PRO 89 HD1 PRO 89 -4.421 16.197 4.841 665 H GLY 90 HN GLY 90 -0.302 18.120 1.561 666 1HA GLY 90 HA2 GLY 90 2.022 18.429 1.514 667 2HA GLY 90 HA1 GLY 90 1.993 18.080 3.240 668 H ILE 91 HN ILE 91 3.586 16.604 3.542 669 HA ILE 91 HA ILE 91 4.177 14.535 1.566 670 HB ILE 91 HB ILE 91 5.904 15.647 3.018 671 1HG1 ILE 91 HG12 ILE 91 5.743 12.653 3.468 672 2HG1 ILE 91 HG11 ILE 91 6.201 13.377 1.928 673 1HG2 ILE 91 HG21 ILE 91 4.308 15.482 5.073 674 2HG2 ILE 91 HG23 ILE 91 4.942 13.844 5.241 675 3HG2 ILE 91 HG22 ILE 91 6.034 15.228 5.333 676 1HD1 ILE 91 HD13 ILE 91 8.008 14.642 3.168 677 2HD1 ILE 91 HD12 ILE 91 7.631 13.653 4.578 678 3HD1 ILE 91 HD11 ILE 91 8.239 12.895 3.107 679 H GLY 92 HN GLY 92 1.918 14.842 4.067 680 1HA GLY 92 HA2 GLY 92 1.858 12.238 5.192 681 2HA GLY 92 HA1 GLY 92 0.460 13.299 5.059 682 H GLY 93 HN GLY 93 0.792 10.342 4.579 683 1HA GLY 93 HA2 GLY 93 -0.522 8.918 3.194 684 2HA GLY 93 HA1 GLY 93 -0.746 10.253 2.064 685 H ASP 94 HN ASP 94 2.360 10.588 2.366 686 HA ASP 94 HA ASP 94 3.004 9.167 -0.049 687 1HB ASP 94 HB2 ASP 94 4.725 10.577 1.994 688 2HB ASP 94 HB1 ASP 94 5.368 9.871 0.509 689 H ALA 95 HN ALA 95 4.692 7.503 -0.260 690 HA ALA 95 HA ALA 95 5.108 5.811 2.160 691 1HB ALA 95 HB1 ALA 95 3.061 5.036 0.855 692 2HB ALA 95 HB3 ALA 95 4.158 4.658 -0.474 693 3HB ALA 95 HB2 ALA 95 4.323 3.824 1.072 694 H HIS 96 HN HIS 96 7.242 5.376 2.266 695 HA HIS 96 HA HIS 96 8.877 5.419 -0.246 696 1HB HIS 96 HB2 HIS 96 9.755 5.660 2.647 697 2HB HIS 96 HB1 HIS 96 10.790 5.824 1.230 698 HD2 HIS 96 HD2 HIS 96 7.825 7.870 0.087 699 HE1 HIS 96 HE1 HIS 96 10.134 10.366 2.645 700 HE2 HIS 96 HE2 HIS 96 8.293 10.314 0.903 701 H PHE 97 HN PHE 97 10.360 3.717 -0.626 702 HA PHE 97 HA PHE 97 9.932 1.211 0.982 703 1HB PHE 97 HB2 PHE 97 10.307 1.652 -1.985 704 2HB PHE 97 HB1 PHE 97 10.572 0.076 -1.242 705 HD1 PHE 97 HD1 PHE 97 8.043 2.827 -1.483 706 HD2 PHE 97 HD2 PHE 97 8.746 -1.370 -0.907 707 HE1 PHE 97 HE1 PHE 97 5.602 2.408 -1.552 708 HE2 PHE 97 HE2 PHE 97 6.303 -1.788 -0.977 709 HZ PHE 97 HZ PHE 97 4.733 0.101 -1.301 710 H ASP 98 HN ASP 98 11.797 0.204 1.714 711 HA ASP 98 HA ASP 98 14.304 1.616 1.632 712 1HB ASP 98 HB2 ASP 98 13.598 -0.007 3.435 713 2HB ASP 98 HB1 ASP 98 13.870 -1.317 2.284 714 H GLU 99 HN GLU 99 15.345 1.842 -0.313 715 HA GLU 99 HA GLU 99 15.122 -0.119 -2.433 716 1HB GLU 99 HB2 GLU 99 15.533 2.379 -2.699 717 2HB GLU 99 HB1 GLU 99 17.195 2.070 -2.208 718 1HG GLU 99 HG2 GLU 99 17.500 0.528 -4.083 719 2HG GLU 99 HG1 GLU 99 15.810 0.723 -4.543 720 H ASP 100 HN ASP 100 16.946 -0.114 0.406 721 HA ASP 100 HA ASP 100 19.332 -1.415 -0.703 722 1HB ASP 100 HB2 ASP 100 18.363 -0.982 2.134 723 2HB ASP 100 HB1 ASP 100 19.866 -1.818 1.740 724 H GLU 101 HN GLU 101 16.186 -2.420 0.174 725 HA GLU 101 HA GLU 101 16.956 -5.159 0.910 726 1HB GLU 101 HB2 GLU 101 14.258 -3.902 0.307 727 2HB GLU 101 HB1 GLU 101 14.484 -5.560 0.863 728 1HG GLU 101 HG2 GLU 101 15.494 -3.138 2.375 729 2HG GLU 101 HG1 GLU 101 13.947 -3.920 2.704 730 H ARG 102 HN ARG 102 16.525 -7.020 -0.424 731 HA ARG 102 HA ARG 102 16.715 -6.426 -3.320 732 1HB ARG 102 HB2 ARG 102 18.190 -8.142 -2.247 733 2HB ARG 102 HB1 ARG 102 16.756 -9.101 -1.882 734 1HG ARG 102 HG2 ARG 102 16.226 -9.229 -4.279 735 2HG ARG 102 HG1 ARG 102 17.653 -8.268 -4.660 736 1HD ARG 102 HD2 ARG 102 19.031 -10.027 -3.481 737 2HD ARG 102 HD1 ARG 102 17.586 -11.027 -3.390 738 HE ARG 102 HE ARG 102 19.328 -10.740 -5.653 739 1HH1 ARG 102 HH21 ARG 102 15.962 -10.839 -4.890 740 2HH1 ARG 102 HH22 ARG 102 15.481 -11.157 -6.521 741 1HH2 ARG 102 HH11 ARG 102 18.712 -11.172 -7.756 742 2HH2 ARG 102 HH12 ARG 102 17.032 -11.354 -8.138 743 H TRP 103 HN TRP 103 14.755 -5.998 -4.234 744 HA TRP 103 HA TRP 103 12.317 -7.319 -3.250 745 1HB TRP 103 HB2 TRP 103 12.754 -5.339 -5.503 746 2HB TRP 103 HB1 TRP 103 11.184 -5.867 -4.906 747 HD1 TRP 103 HD1 TRP 103 13.565 -3.170 -4.484 748 HE1 TRP 103 HE1 TRP 103 13.197 -1.905 -2.268 749 HE3 TRP 103 HE3 TRP 103 10.501 -6.478 -2.072 750 HZ2 TRP 103 HZ2 TRP 103 11.796 -2.252 0.201 751 HZ3 TRP 103 HZ3 TRP 103 9.671 -5.984 0.209 752 HH2 TRP 103 HH2 TRP 103 10.313 -3.880 1.347 753 H THR 104 HN THR 104 11.006 -8.712 -4.505 754 HA THR 104 HA THR 104 12.173 -9.737 -7.061 755 HB THR 104 HB THR 104 11.863 -12.035 -6.357 756 HG1 THR 104 HG1 THR 104 11.105 -11.123 -3.807 757 1HG2 THR 104 HG21 THR 104 13.876 -10.500 -5.453 758 2HG2 THR 104 HG23 THR 104 13.141 -10.906 -3.902 759 3HG2 THR 104 HG22 THR 104 13.711 -12.186 -4.969 760 H ASN 105 HN ASN 105 10.565 -11.049 -8.288 761 HA ASN 105 HA ASN 105 7.776 -10.029 -7.856 762 1HB ASN 105 HB2 ASN 105 9.158 -10.950 -10.394 763 2HB ASN 105 HB1 ASN 105 7.483 -10.412 -10.289 764 1HD2 ASN 105 HD22 ASN 105 10.071 -7.618 -11.071 765 2HD2 ASN 105 HD21 ASN 105 10.108 -9.241 -11.564 766 H ASN 106 HN ASN 106 9.090 -12.461 -6.686 767 HA ASN 106 HA ASN 106 7.013 -14.407 -7.533 768 1HB ASN 106 HB2 ASN 106 8.932 -16.166 -7.593 769 2HB ASN 106 HB1 ASN 106 8.749 -15.093 -8.981 770 1HD2 ASN 106 HD22 ASN 106 12.167 -14.300 -8.570 771 2HD2 ASN 106 HD21 ASN 106 10.992 -15.013 -9.566 772 H PHE 107 HN PHE 107 8.018 -16.599 -6.108 773 HA PHE 107 HA PHE 107 7.438 -15.756 -3.363 774 1HB PHE 107 HB2 PHE 107 8.123 -18.488 -4.489 775 2HB PHE 107 HB1 PHE 107 7.480 -18.168 -2.878 776 HD1 PHE 107 HD1 PHE 107 5.193 -17.121 -2.640 777 HD2 PHE 107 HD2 PHE 107 6.694 -18.556 -6.399 778 HE1 PHE 107 HE1 PHE 107 2.887 -17.132 -3.559 779 HE2 PHE 107 HE2 PHE 107 4.391 -18.563 -7.316 780 HZ PHE 107 HZ PHE 107 2.488 -17.853 -5.897 781 H ARG 108 HN ARG 108 10.057 -15.062 -4.797 782 HA ARG 108 HA ARG 108 12.196 -16.522 -3.622 783 1HB ARG 108 HB2 ARG 108 11.942 -13.710 -4.676 784 2HB ARG 108 HB1 ARG 108 13.450 -14.264 -3.961 785 1HG ARG 108 HG2 ARG 108 12.114 -15.910 -6.106 786 2HG ARG 108 HG1 ARG 108 13.095 -14.516 -6.551 787 1HD ARG 108 HD2 ARG 108 14.981 -15.507 -5.202 788 2HD ARG 108 HD1 ARG 108 13.998 -16.948 -4.971 789 HE ARG 108 HE ARG 108 14.033 -16.507 -7.735 790 1HH1 ARG 108 HH21 ARG 108 16.290 -17.012 -5.177 791 2HH1 ARG 108 HH22 ARG 108 17.486 -17.739 -6.198 792 1HH2 ARG 108 HH11 ARG 108 15.570 -17.458 -9.078 793 2HH2 ARG 108 HH12 ARG 108 17.075 -17.994 -8.411 794 H GLU 109 HN GLU 109 13.715 -14.609 -2.241 795 HA GLU 109 HA GLU 109 12.973 -15.030 0.413 796 1HB GLU 109 HB2 GLU 109 14.586 -12.761 -0.773 797 2HB GLU 109 HB1 GLU 109 14.475 -13.085 0.956 798 1HG GLU 109 HG2 GLU 109 15.363 -15.363 0.580 799 2HG GLU 109 HG1 GLU 109 15.497 -15.015 -1.144 800 H TYR 110 HN TYR 110 12.542 -11.871 -1.293 801 HA TYR 110 HA TYR 110 10.282 -11.312 0.626 802 1HB TYR 110 HB2 TYR 110 12.324 -9.431 -0.582 803 2HB TYR 110 HB1 TYR 110 10.891 -8.895 0.296 804 HD1 TYR 110 HD2 TYR 110 10.645 -9.349 2.716 805 HD2 TYR 110 HD1 TYR 110 14.175 -10.489 0.551 806 HE1 TYR 110 HE2 TYR 110 11.849 -9.688 4.858 807 HE2 TYR 110 HE1 TYR 110 15.381 -10.824 2.689 808 HH TYR 110 HH TYR 110 13.791 -10.938 5.701 809 H ASN 111 HN ASN 111 8.391 -10.570 -0.206 810 HA ASN 111 HA ASN 111 8.177 -10.361 -3.187 811 1HB ASN 111 HB2 ASN 111 6.766 -12.082 -2.025 812 2HB ASN 111 HB1 ASN 111 5.984 -10.778 -1.134 813 1HD2 ASN 111 HD22 ASN 111 4.006 -11.553 -4.257 814 2HD2 ASN 111 HD21 ASN 111 4.550 -12.510 -2.965 815 H LEU 112 HN LEU 112 8.147 -8.279 -3.875 816 HA LEU 112 HA LEU 112 7.863 -6.012 -2.196 817 1HB LEU 112 HB2 LEU 112 8.928 -5.904 -4.396 818 2HB LEU 112 HB1 LEU 112 7.394 -6.261 -5.180 819 HG LEU 112 HG LEU 112 6.440 -4.161 -4.291 820 1HD1 LEU 112 HD11 LEU 112 9.128 -4.016 -2.931 821 2HD1 LEU 112 HD13 LEU 112 8.262 -2.531 -3.329 822 3HD1 LEU 112 HD12 LEU 112 7.527 -3.718 -2.257 823 1HD2 LEU 112 HD21 LEU 112 9.076 -3.945 -5.766 824 2HD2 LEU 112 HD23 LEU 112 7.458 -4.013 -6.463 825 3HD2 LEU 112 HD22 LEU 112 7.971 -2.586 -5.562 826 H HIS 113 HN HIS 113 5.448 -7.651 -4.238 827 HA HIS 113 HA HIS 113 3.355 -5.775 -3.872 828 1HB HIS 113 HB2 HIS 113 3.303 -7.603 -5.529 829 2HB HIS 113 HB1 HIS 113 3.154 -8.778 -4.227 830 HD1 HIS 113 HD1 HIS 113 0.825 -9.332 -5.531 831 HD2 HIS 113 HD2 HIS 113 0.998 -5.674 -3.541 832 HE1 HIS 113 HE1 HIS 113 -1.566 -8.541 -5.279 833 H ARG 114 HN ARG 114 4.282 -8.573 -1.831 834 HA ARG 114 HA ARG 114 2.063 -8.433 -0.044 835 1HB ARG 114 HB2 ARG 114 4.924 -9.303 0.426 836 2HB ARG 114 HB1 ARG 114 3.648 -9.481 1.629 837 1HG ARG 114 HG2 ARG 114 2.334 -10.823 0.015 838 2HG ARG 114 HG1 ARG 114 3.644 -10.687 -1.155 839 1HD ARG 114 HD2 ARG 114 5.107 -11.647 0.833 840 2HD ARG 114 HD1 ARG 114 3.558 -12.235 1.426 841 HE ARG 114 HE ARG 114 5.101 -13.405 -0.666 842 1HH1 ARG 114 HH21 ARG 114 1.850 -12.461 0.012 843 2HH1 ARG 114 HH22 ARG 114 1.177 -13.416 -1.263 844 1HH2 ARG 114 HH11 ARG 114 4.235 -14.660 -2.309 845 2HH2 ARG 114 HH12 ARG 114 2.522 -14.670 -2.567 846 H VAL 115 HN VAL 115 5.237 -6.810 0.088 847 HA VAL 115 HA VAL 115 4.675 -5.439 2.566 848 HB VAL 115 HB VAL 115 6.685 -4.905 0.358 849 1HG1 VAL 115 HG11 VAL 115 6.300 -3.583 3.054 850 2HG1 VAL 115 HG13 VAL 115 7.817 -3.509 2.159 851 3HG1 VAL 115 HG12 VAL 115 6.355 -2.803 1.473 852 1HG2 VAL 115 HG22 VAL 115 6.823 -6.225 3.083 853 2HG2 VAL 115 HG21 VAL 115 7.117 -6.978 1.515 854 3HG2 VAL 115 HG23 VAL 115 8.250 -5.783 2.148 855 H ALA 116 HN ALA 116 4.356 -4.548 -0.861 856 HA ALA 116 HA ALA 116 3.675 -1.824 -0.489 857 1HB ALA 116 HB3 ALA 116 4.113 -2.978 -2.697 858 2HB ALA 116 HB2 ALA 116 2.487 -3.654 -2.590 859 3HB ALA 116 HB1 ALA 116 2.712 -1.907 -2.694 860 H ALA 117 HN ALA 117 1.550 -4.697 -0.597 861 HA ALA 117 HA ALA 117 -0.894 -3.301 -0.202 862 1HB ALA 117 HB3 ALA 117 -0.043 -6.080 0.658 863 2HB ALA 117 HB2 ALA 117 -1.699 -5.484 0.776 864 3HB ALA 117 HB1 ALA 117 -0.931 -5.645 -0.804 865 H HIS 118 HN HIS 118 1.485 -4.566 2.120 866 HA HIS 118 HA HIS 118 0.027 -3.968 4.491 867 1HB HIS 118 HB2 HIS 118 2.123 -5.329 4.419 868 2HB HIS 118 HB1 HIS 118 3.034 -3.852 4.101 869 HD1 HIS 118 HD1 HIS 118 1.376 -5.764 6.812 870 HD2 HIS 118 HD2 HIS 118 3.018 -1.963 6.318 871 HE1 HIS 118 HE1 HIS 118 1.614 -4.781 9.132 872 H GLU 119 HN GLU 119 2.342 -1.992 2.616 873 HA GLU 119 HA GLU 119 2.301 0.283 4.331 874 1HB GLU 119 HB2 GLU 119 2.730 0.043 1.337 875 2HB GLU 119 HB1 GLU 119 2.953 1.549 2.230 876 1HG GLU 119 HG2 GLU 119 4.632 0.450 3.671 877 2HG GLU 119 HG1 GLU 119 4.414 -1.054 2.776 878 H LEU 120 HN LEU 120 0.218 -0.664 1.613 879 HA LEU 120 HA LEU 120 -1.367 1.728 1.606 880 1HB LEU 120 HB2 LEU 120 -2.019 -1.102 0.724 881 2HB LEU 120 HB1 LEU 120 -3.078 0.278 0.445 882 HG LEU 120 HG LEU 120 -0.218 0.051 -0.549 883 1HD1 LEU 120 HD11 LEU 120 -1.759 -1.524 -1.669 884 2HD1 LEU 120 HD13 LEU 120 -2.855 -0.191 -2.035 885 3HD1 LEU 120 HD12 LEU 120 -1.251 -0.242 -2.769 886 1HD2 LEU 120 HD21 LEU 120 -2.308 2.215 -0.646 887 2HD2 LEU 120 HD23 LEU 120 -0.558 2.353 -0.469 888 3HD2 LEU 120 HD22 LEU 120 -1.257 2.013 -2.048 889 H GLY 121 HN GLY 121 -1.597 -1.341 3.372 890 1HA GLY 121 HA2 GLY 121 -4.130 -1.054 4.538 891 2HA GLY 121 HA1 GLY 121 -2.767 -1.811 5.364 892 H HIS 122 HN HIS 122 -1.022 0.311 5.676 893 HA HIS 122 HA HIS 122 -2.188 1.729 7.898 894 1HB HIS 122 HB2 HIS 122 0.380 2.079 6.339 895 2HB HIS 122 HB1 HIS 122 -0.059 3.163 7.658 896 HD1 HIS 122 HD1 HIS 122 -0.409 2.020 10.047 897 HD2 HIS 122 HD2 HIS 122 1.391 -0.399 7.168 898 HE1 HIS 122 HE1 HIS 122 0.640 0.083 11.295 899 H SER 123 HN SER 123 -1.539 2.608 4.522 900 HA SER 123 HA SER 123 -2.236 5.360 4.701 901 1HB SER 123 HB2 SER 123 -1.172 4.285 2.706 902 2HB SER 123 HB1 SER 123 -2.706 3.495 2.354 903 HG SER 123 HG SER 123 -2.029 5.770 1.465 904 H LEU 124 HN LEU 124 -4.219 2.454 4.327 905 HA LEU 124 HA LEU 124 -6.683 4.004 3.971 906 1HB LEU 124 HB2 LEU 124 -6.242 1.052 4.521 907 2HB LEU 124 HB1 LEU 124 -7.789 1.783 4.107 908 HG LEU 124 HG LEU 124 -5.321 1.931 2.350 909 1HD1 LEU 124 HD11 LEU 124 -7.716 0.074 2.261 910 2HD1 LEU 124 HD13 LEU 124 -6.577 0.273 0.929 911 3HD1 LEU 124 HD12 LEU 124 -6.025 -0.381 2.471 912 1HD2 LEU 124 HD22 LEU 124 -8.176 2.875 2.095 913 2HD2 LEU 124 HD21 LEU 124 -6.684 3.715 1.677 914 3HD2 LEU 124 HD23 LEU 124 -7.283 2.419 0.646 915 H GLY 125 HN GLY 125 -4.731 3.475 6.581 916 1HA GLY 125 HA2 GLY 125 -5.158 4.071 8.834 917 2HA GLY 125 HA1 GLY 125 -6.867 4.216 8.438 918 H LEU 126 HN LEU 126 -5.517 1.238 7.408 919 HA LEU 126 HA LEU 126 -7.129 -0.198 9.377 920 1HB LEU 126 HB2 LEU 126 -5.177 -1.186 7.275 921 2HB LEU 126 HB1 LEU 126 -6.172 -2.241 8.276 922 HG LEU 126 HG LEU 126 -7.261 -0.086 6.438 923 1HD1 LEU 126 HD11 LEU 126 -6.932 -3.075 6.086 924 2HD1 LEU 126 HD13 LEU 126 -8.014 -2.103 5.089 925 3HD1 LEU 126 HD12 LEU 126 -6.279 -1.792 5.068 926 1HD2 LEU 126 HD21 LEU 126 -8.501 -2.108 8.303 927 2HD2 LEU 126 HD23 LEU 126 -8.959 -0.429 8.014 928 3HD2 LEU 126 HD22 LEU 126 -9.362 -1.665 6.830 929 H SER 127 HN SER 127 -6.308 -1.594 11.022 930 HA SER 127 HA SER 127 -3.571 -0.838 11.976 931 1HB SER 127 HB2 SER 127 -6.017 -1.881 13.415 932 2HB SER 127 HB1 SER 127 -4.435 -1.748 14.176 933 HG SER 127 HG SER 127 -6.258 0.198 13.495 934 H HIS 128 HN HIS 128 -2.362 -2.571 13.113 935 HA HIS 128 HA HIS 128 -2.071 -4.909 11.482 936 1HB HIS 128 HB2 HIS 128 -1.079 -4.394 14.304 937 2HB HIS 128 HB1 HIS 128 -0.477 -5.642 13.212 938 HD1 HIS 128 HD1 HIS 128 1.091 -3.014 14.365 939 HD2 HIS 128 HD2 HIS 128 -0.368 -3.598 10.504 940 HE1 HIS 128 HE1 HIS 128 2.426 -1.480 12.855 941 H SER 129 HN SER 129 -2.167 -7.188 12.526 942 HA SER 129 HA SER 129 -4.358 -7.505 14.501 943 1HB SER 129 HB2 SER 129 -5.499 -7.448 12.302 944 2HB SER 129 HB1 SER 129 -4.448 -8.738 11.725 945 HG SER 129 HG SER 129 -6.276 -9.721 12.459 946 H THR 130 HN THR 130 -4.438 -9.731 15.336 947 HA THR 130 HA THR 130 -1.759 -11.010 15.238 948 HB THR 130 HB THR 130 -2.550 -12.265 17.211 949 HG1 THR 130 HG1 THR 130 -4.774 -12.274 16.528 950 1HG2 THR 130 HG22 THR 130 -1.543 -10.000 17.465 951 2HG2 THR 130 HG21 THR 130 -3.162 -9.304 17.407 952 3HG2 THR 130 HG23 THR 130 -2.707 -10.368 18.739 953 H ASP 131 HN ASP 131 -4.342 -11.261 13.344 954 HA ASP 131 HA ASP 131 -4.696 -14.186 13.388 955 1HB ASP 131 HB2 ASP 131 -6.583 -12.672 12.786 956 2HB ASP 131 HB1 ASP 131 -5.671 -12.135 11.377 957 H ILE 132 HN ILE 132 -3.381 -15.547 12.281 958 HA ILE 132 HA ILE 132 -1.095 -14.658 10.851 959 HB ILE 132 HB ILE 132 -2.527 -17.330 10.706 960 1HG1 ILE 132 HG12 ILE 132 -0.090 -16.519 12.317 961 2HG1 ILE 132 HG11 ILE 132 -1.725 -16.529 12.974 962 1HG2 ILE 132 HG21 ILE 132 0.264 -16.489 9.869 963 2HG2 ILE 132 HG23 ILE 132 -0.279 -18.163 9.982 964 3HG2 ILE 132 HG22 ILE 132 -1.019 -17.075 8.810 965 1HD1 ILE 132 HD12 ILE 132 -0.409 -18.945 11.701 966 2HD1 ILE 132 HD11 ILE 132 -0.433 -18.641 13.439 967 3HD1 ILE 132 HD13 ILE 132 -1.943 -18.906 12.568 968 H GLY 133 HN GLY 133 -4.309 -15.657 9.688 969 1HA GLY 133 HA2 GLY 133 -3.617 -15.530 6.895 970 2HA GLY 133 HA1 GLY 133 -5.255 -15.503 7.544 971 H ALA 134 HN ALA 134 -3.385 -13.052 8.962 972 HA ALA 134 HA ALA 134 -4.700 -11.024 7.202 973 1HB ALA 134 HB3 ALA 134 -3.398 -10.757 9.925 974 2HB ALA 134 HB2 ALA 134 -4.111 -9.427 9.019 975 3HB ALA 134 HB1 ALA 134 -5.126 -10.751 9.584 976 H LEU 135 HN LEU 135 -3.505 -9.787 5.841 977 HA LEU 135 HA LEU 135 -0.699 -10.339 5.429 978 1HB LEU 135 HB2 LEU 135 -2.387 -8.016 4.435 979 2HB LEU 135 HB1 LEU 135 -0.811 -8.489 3.799 980 HG LEU 135 HG LEU 135 -3.291 -10.238 3.788 981 1HD1 LEU 135 HD12 LEU 135 -3.277 -8.231 2.234 982 2HD1 LEU 135 HD11 LEU 135 -1.874 -8.950 1.443 983 3HD1 LEU 135 HD13 LEU 135 -3.422 -9.795 1.434 984 1HD2 LEU 135 HD22 LEU 135 -0.419 -10.671 2.978 985 2HD2 LEU 135 HD21 LEU 135 -1.523 -11.769 3.806 986 3HD2 LEU 135 HD23 LEU 135 -1.697 -11.485 2.076 987 H MET 136 HN MET 136 -2.514 -7.847 7.117 988 HA MET 136 HA MET 136 -0.260 -6.107 7.585 989 1HB MET 136 HB2 MET 136 -2.796 -6.311 9.222 990 2HB MET 136 HB1 MET 136 -1.721 -4.923 9.083 991 1HG MET 136 HG2 MET 136 -2.229 -5.020 6.549 992 2HG MET 136 HG1 MET 136 -3.564 -6.078 6.994 993 1HE MET 136 HE3 MET 136 -1.771 -2.897 7.275 994 2HE MET 136 HE2 MET 136 -2.934 -1.661 7.733 995 3HE MET 136 HE1 MET 136 -2.200 -2.664 8.974 996 H TYR 137 HN TYR 137 -0.147 -9.091 8.446 997 HA TYR 137 HA TYR 137 -0.043 -9.172 11.283 998 1HB TYR 137 HB2 TYR 137 0.084 -11.119 9.597 999 2HB TYR 137 HB1 TYR 137 1.803 -10.751 9.482 1000 HD1 TYR 137 HD1 TYR 137 3.268 -10.955 11.496 1001 HD2 TYR 137 HD2 TYR 137 -0.850 -12.170 11.539 1002 HE1 TYR 137 HE1 TYR 137 3.669 -12.244 13.578 1003 HE2 TYR 137 HE2 TYR 137 -0.451 -13.456 13.619 1004 HH TYR 137 HH TYR 137 1.249 -14.394 14.901 1005 HA PRO 138 HA PRO 138 3.392 -6.412 12.001 1006 1HB PRO 138 HB2 PRO 138 4.435 -7.991 14.220 1007 2HB PRO 138 HB1 PRO 138 3.582 -6.441 14.274 1008 1HG PRO 138 HG2 PRO 138 2.543 -9.065 14.955 1009 2HG PRO 138 HG1 PRO 138 1.712 -7.507 15.062 1010 1HD PRO 138 HD2 PRO 138 1.189 -9.594 13.181 1011 2HD PRO 138 HD1 PRO 138 0.496 -7.960 13.173 1012 H SER 139 HN SER 139 4.381 -9.834 12.582 1013 HA SER 139 HA SER 139 6.992 -9.280 11.351 1014 1HB SER 139 HB2 SER 139 7.002 -10.763 13.233 1015 2HB SER 139 HB1 SER 139 5.739 -11.767 12.529 1016 HG SER 139 HG SER 139 8.310 -12.083 12.280 1017 H TYR 140 HN TYR 140 7.652 -9.911 9.341 1018 HA TYR 140 HA TYR 140 5.748 -10.416 7.278 1019 1HB TYR 140 HB2 TYR 140 8.001 -9.455 6.880 1020 2HB TYR 140 HB1 TYR 140 8.730 -10.997 7.323 1021 HD1 TYR 140 HD1 TYR 140 8.521 -12.960 5.869 1022 HD2 TYR 140 HD2 TYR 140 6.832 -9.170 4.760 1023 HE1 TYR 140 HE1 TYR 140 8.260 -13.758 3.536 1024 HE2 TYR 140 HE2 TYR 140 6.565 -9.970 2.426 1025 HH TYR 140 HH TYR 140 6.939 -13.272 1.567 1026 H THR 141 HN THR 141 5.025 -12.360 6.379 1027 HA THR 141 HA THR 141 6.279 -14.908 7.200 1028 HB THR 141 HB THR 141 4.026 -15.835 7.882 1029 HG1 THR 141 HG1 THR 141 2.488 -14.258 8.495 1030 1HG2 THR 141 HG22 THR 141 5.808 -15.102 9.497 1031 2HG2 THR 141 HG21 THR 141 4.996 -13.540 9.601 1032 3HG2 THR 141 HG23 THR 141 4.170 -15.001 10.143 1033 H PHE 142 HN PHE 142 5.278 -16.754 5.980 1034 HA PHE 142 HA PHE 142 4.867 -15.968 3.202 1035 1HB PHE 142 HB2 PHE 142 6.111 -18.043 4.039 1036 2HB PHE 142 HB1 PHE 142 4.526 -18.735 4.378 1037 HD1 PHE 142 HD1 PHE 142 6.569 -17.194 1.660 1038 HD2 PHE 142 HD2 PHE 142 3.268 -19.755 2.651 1039 HE1 PHE 142 HE1 PHE 142 6.369 -17.855 -0.721 1040 HE2 PHE 142 HE2 PHE 142 3.066 -20.415 0.268 1041 HZ PHE 142 HZ PHE 142 4.619 -19.463 -1.418 1042 H SER 143 HN SER 143 2.926 -15.657 2.223 1043 HA SER 143 HA SER 143 0.435 -16.604 3.617 1044 1HB SER 143 HB2 SER 143 0.708 -14.142 3.686 1045 2HB SER 143 HB1 SER 143 0.833 -14.114 1.930 1046 HG SER 143 HG SER 143 -1.308 -15.463 2.363 1047 H GLY 144 HN GLY 144 2.280 -17.544 1.209 1048 1HA GLY 144 HA2 GLY 144 1.867 -18.702 -0.798 1049 2HA GLY 144 HA1 GLY 144 0.180 -18.794 -0.285 1050 H ASP 145 HN ASP 145 -1.141 -17.882 -1.778 1051 HA ASP 145 HA ASP 145 -0.139 -15.931 -3.699 1052 1HB ASP 145 HB2 ASP 145 -2.459 -15.897 -4.528 1053 2HB ASP 145 HB1 ASP 145 -1.924 -17.561 -4.291 1054 H VAL 146 HN VAL 146 -1.367 -13.768 -3.925 1055 HA VAL 146 HA VAL 146 -1.519 -12.522 -1.222 1056 HB VAL 146 HB VAL 146 -1.423 -11.271 -3.985 1057 1HG1 VAL 146 HG13 VAL 146 -1.369 -10.123 -1.184 1058 2HG1 VAL 146 HG12 VAL 146 -0.831 -9.219 -2.601 1059 3HG1 VAL 146 HG11 VAL 146 -2.508 -9.753 -2.479 1060 1HG2 VAL 146 HG21 VAL 146 0.629 -12.561 -3.114 1061 2HG2 VAL 146 HG23 VAL 146 0.893 -10.878 -3.573 1062 3HG2 VAL 146 HG22 VAL 146 0.742 -11.314 -1.870 1063 H GLN 147 HN GLN 147 -3.534 -12.584 -0.370 1064 HA GLN 147 HA GLN 147 -5.811 -11.617 -2.041 1065 1HB GLN 147 HB2 GLN 147 -5.755 -14.145 -0.366 1066 2HB GLN 147 HB1 GLN 147 -7.241 -13.396 -0.951 1067 1HG GLN 147 HG2 GLN 147 -6.446 -13.615 -3.273 1068 2HG GLN 147 HG1 GLN 147 -4.955 -14.359 -2.695 1069 1HE2 GLN 147 HE22 GLN 147 -7.747 -16.898 -3.525 1070 2HE2 GLN 147 HE21 GLN 147 -7.316 -15.478 -4.347 1071 H LEU 148 HN LEU 148 -7.518 -10.663 -0.733 1072 HA LEU 148 HA LEU 148 -6.508 -9.426 1.713 1073 1HB LEU 148 HB2 LEU 148 -9.308 -9.361 0.541 1074 2HB LEU 148 HB1 LEU 148 -8.670 -8.277 1.778 1075 HG LEU 148 HG LEU 148 -7.627 -8.526 -1.062 1076 1HD1 LEU 148 HD12 LEU 148 -9.292 -6.420 0.349 1077 2HD1 LEU 148 HD11 LEU 148 -8.518 -6.167 -1.216 1078 3HD1 LEU 148 HD13 LEU 148 -9.768 -7.398 -1.040 1079 1HD2 LEU 148 HD21 LEU 148 -6.726 -6.960 1.360 1080 2HD2 LEU 148 HD23 LEU 148 -5.751 -7.862 0.198 1081 3HD2 LEU 148 HD22 LEU 148 -6.453 -6.314 -0.258 1082 H ALA 149 HN ALA 149 -7.555 -9.646 3.816 1083 HA ALA 149 HA ALA 149 -8.622 -12.408 4.253 1084 1HB ALA 149 HB1 ALA 149 -6.589 -11.602 5.534 1085 2HB ALA 149 HB3 ALA 149 -7.637 -10.421 6.321 1086 3HB ALA 149 HB2 ALA 149 -7.926 -12.146 6.546 1087 H GLN 150 HN GLN 150 -10.434 -12.622 5.782 1088 HA GLN 150 HA GLN 150 -12.624 -10.910 5.192 1089 1HB GLN 150 HB2 GLN 150 -12.899 -13.222 6.026 1090 2HB GLN 150 HB1 GLN 150 -12.237 -12.740 7.588 1091 1HG GLN 150 HG2 GLN 150 -14.087 -11.208 7.955 1092 2HG GLN 150 HG1 GLN 150 -14.716 -11.522 6.338 1093 1HE2 GLN 150 HE22 GLN 150 -16.567 -13.709 8.752 1094 2HE2 GLN 150 HE21 GLN 150 -16.369 -12.033 8.577 1095 H ASP 151 HN ASP 151 -10.330 -10.935 7.890 1096 HA ASP 151 HA ASP 151 -11.596 -8.979 9.516 1097 1HB ASP 151 HB2 ASP 151 -9.667 -10.334 10.266 1098 2HB ASP 151 HB1 ASP 151 -8.630 -9.479 9.123 1099 H ASP 152 HN ASP 152 -9.339 -8.610 6.779 1100 HA ASP 152 HA ASP 152 -9.217 -5.715 7.057 1101 1HB ASP 152 HB2 ASP 152 -8.414 -7.604 4.833 1102 2HB ASP 152 HB1 ASP 152 -8.172 -5.858 4.752 1103 H ILE 153 HN ILE 153 -10.986 -7.966 4.925 1104 HA ILE 153 HA ILE 153 -12.232 -5.957 3.325 1105 HB ILE 153 HB ILE 153 -13.143 -8.748 4.081 1106 1HG1 ILE 153 HG12 ILE 153 -11.900 -7.703 1.521 1107 2HG1 ILE 153 HG11 ILE 153 -10.966 -8.446 2.820 1108 1HG2 ILE 153 HG22 ILE 153 -14.203 -6.777 2.037 1109 2HG2 ILE 153 HG21 ILE 153 -14.546 -8.506 1.978 1110 3HG2 ILE 153 HG23 ILE 153 -15.095 -7.544 3.350 1111 1HD1 ILE 153 HD13 ILE 153 -12.333 -10.500 2.621 1112 2HD1 ILE 153 HD12 ILE 153 -13.241 -9.760 1.302 1113 3HD1 ILE 153 HD11 ILE 153 -11.525 -10.115 1.100 1114 H ASP 154 HN ASP 154 -13.441 -7.665 6.232 1115 HA ASP 154 HA ASP 154 -15.884 -6.187 6.396 1116 1HB ASP 154 HB2 ASP 154 -14.259 -7.637 8.495 1117 2HB ASP 154 HB1 ASP 154 -15.839 -6.922 8.824 1118 H GLY 155 HN GLY 155 -12.677 -5.602 7.785 1119 1HA GLY 155 HA2 GLY 155 -13.430 -3.371 9.417 1120 2HA GLY 155 HA1 GLY 155 -11.793 -3.731 8.880 1121 H ILE 156 HN ILE 156 -11.933 -3.419 6.146 1122 HA ILE 156 HA ILE 156 -11.983 -0.548 5.917 1123 HB ILE 156 HB ILE 156 -10.506 -2.096 4.575 1124 1HG1 ILE 156 HG12 ILE 156 -10.769 -0.768 2.446 1125 2HG1 ILE 156 HG11 ILE 156 -12.258 -0.097 3.106 1126 1HG2 ILE 156 HG22 ILE 156 -12.514 -3.621 4.034 1127 2HG2 ILE 156 HG21 ILE 156 -12.907 -2.447 2.779 1128 3HG2 ILE 156 HG23 ILE 156 -11.366 -3.306 2.737 1129 1HD1 ILE 156 HD11 ILE 156 -9.782 0.097 4.789 1130 2HD1 ILE 156 HD13 ILE 156 -9.919 1.156 3.387 1131 3HD1 ILE 156 HD12 ILE 156 -11.141 1.212 4.652 1132 H GLN 157 HN GLN 157 -14.246 -3.088 4.875 1133 HA GLN 157 HA GLN 157 -15.986 -1.339 3.405 1134 1HB GLN 157 HB2 GLN 157 -16.481 -3.968 4.819 1135 2HB GLN 157 HB1 GLN 157 -17.719 -3.135 3.875 1136 1HG GLN 157 HG2 GLN 157 -16.305 -3.227 1.881 1137 2HG GLN 157 HG1 GLN 157 -15.014 -3.995 2.810 1138 1HE2 GLN 157 HE22 GLN 157 -17.319 -6.538 1.085 1139 2HE2 GLN 157 HE21 GLN 157 -16.636 -5.100 0.495 1140 H ALA 158 HN ALA 158 -15.897 -2.329 6.818 1141 HA ALA 158 HA ALA 158 -18.345 -1.120 7.610 1142 1HB ALA 158 HB2 ALA 158 -15.787 -1.450 9.212 1143 2HB ALA 158 HB1 ALA 158 -17.384 -1.127 9.888 1144 3HB ALA 158 HB3 ALA 158 -17.067 -2.654 9.064 1145 H ILE 159 HN ILE 159 -15.059 0.218 7.331 1146 HA ILE 159 HA ILE 159 -15.699 2.793 8.428 1147 HB ILE 159 HB ILE 159 -13.567 1.900 6.468 1148 1HG1 ILE 159 HG12 ILE 159 -13.359 2.695 9.385 1149 2HG1 ILE 159 HG11 ILE 159 -13.567 1.027 8.853 1150 1HG2 ILE 159 HG21 ILE 159 -14.097 4.585 7.754 1151 2HG2 ILE 159 HG23 ILE 159 -12.478 4.115 7.238 1152 3HG2 ILE 159 HG22 ILE 159 -13.780 4.227 6.057 1153 1HD1 ILE 159 HD11 ILE 159 -11.317 2.820 7.905 1154 2HD1 ILE 159 HD13 ILE 159 -11.164 1.688 9.248 1155 3HD1 ILE 159 HD12 ILE 159 -11.489 1.088 7.622 1156 H TYR 160 HN TYR 160 -15.525 1.670 5.026 1157 HA TYR 160 HA TYR 160 -16.896 4.171 4.167 1158 1HB TYR 160 HB2 TYR 160 -15.567 1.923 2.633 1159 2HB TYR 160 HB1 TYR 160 -16.445 3.241 1.858 1160 HD1 TYR 160 HD2 TYR 160 -15.606 5.538 1.929 1161 HD2 TYR 160 HD1 TYR 160 -13.443 2.319 3.773 1162 HE1 TYR 160 HE2 TYR 160 -13.602 6.988 2.106 1163 HE2 TYR 160 HE1 TYR 160 -11.439 3.768 3.955 1164 HH TYR 160 HH TYR 160 -11.566 7.192 3.107 1165 H GLY 161 HN GLY 161 -17.211 0.739 3.192 1166 1HA GLY 161 HA2 GLY 161 -19.720 0.077 4.051 1167 2HA GLY 161 HA1 GLY 161 -20.075 1.134 2.685 1168 H ARG 162 HN ARG 162 -21.045 -0.851 1.724 1169 HA ARG 162 HA ARG 162 -19.126 -2.926 0.828 1170 1HB ARG 162 HB2 ARG 162 -22.128 -2.670 0.507 1171 2HB ARG 162 HB1 ARG 162 -21.170 -4.032 -0.077 1172 1HG ARG 162 HG2 ARG 162 -20.374 -4.415 2.263 1173 2HG ARG 162 HG1 ARG 162 -21.467 -3.139 2.804 1174 1HD ARG 162 HD2 ARG 162 -22.567 -5.298 3.090 1175 2HD ARG 162 HD1 ARG 162 -23.375 -4.400 1.805 1176 HE ARG 162 HE ARG 162 -21.453 -5.919 0.484 1177 1HH1 ARG 162 HH21 ARG 162 -24.052 -6.482 2.680 1178 2HH1 ARG 162 HH22 ARG 162 -24.385 -8.073 2.082 1179 1HH2 ARG 162 HH11 ARG 162 -21.866 -7.994 -0.300 1180 2HH2 ARG 162 HH12 ARG 162 -23.146 -8.931 0.396 1181 H SER 163 HN SER 163 -18.600 -3.245 -1.337 1182 HA SER 163 HA SER 163 -18.890 -0.915 -3.067 1183 1HB SER 163 HB2 SER 163 -17.849 -3.638 -3.871 1184 2HB SER 163 HB1 SER 163 -17.448 -2.072 -4.574 1185 HG SER 163 HG SER 163 -16.745 -1.639 -2.251 1186 H GLN 164 HN GLN 164 -21.197 -0.819 -3.377 1187 HA GLN 164 HA GLN 164 -22.695 -3.086 -4.353 1188 1HB GLN 164 HB2 GLN 164 -23.240 -0.104 -4.493 1189 2HB GLN 164 HB1 GLN 164 -24.395 -1.333 -5.009 1190 1HG GLN 164 HG2 GLN 164 -23.193 -1.187 -2.228 1191 2HG GLN 164 HG1 GLN 164 -24.778 -0.543 -2.661 1192 1HE2 GLN 164 HE22 GLN 164 -24.608 -4.353 -1.640 1193 2HE2 GLN 164 HE21 GLN 164 -23.504 -3.154 -1.168 1194 H ASN 165 HN ASN 165 -22.674 -3.935 -6.368 1195 HA ASN 165 HA ASN 165 -22.220 -2.219 -8.721 1196 1HB ASN 165 HB2 ASN 165 -20.324 -4.467 -7.978 1197 2HB ASN 165 HB1 ASN 165 -20.338 -3.638 -9.536 1198 1HD2 ASN 165 HD22 ASN 165 -18.556 -1.878 -6.351 1199 2HD2 ASN 165 HD21 ASN 165 -19.257 -3.420 -6.235 1200 HA PRO 166 HA PRO 166 -25.083 -5.864 -9.191 1201 1HB PRO 166 HB2 PRO 166 -27.030 -4.110 -10.419 1202 2HB PRO 166 HB1 PRO 166 -27.130 -4.900 -8.842 1203 1HG PRO 166 HG2 PRO 166 -26.726 -2.095 -9.358 1204 2HG PRO 166 HG1 PRO 166 -26.759 -2.903 -7.784 1205 1HD PRO 166 HD2 PRO 166 -24.444 -1.874 -9.245 1206 2HD PRO 166 HD1 PRO 166 -24.507 -2.509 -7.588 1207 H VAL 167 HN VAL 167 -22.939 -5.640 -10.794 1208 HA VAL 167 HA VAL 167 -23.704 -4.920 -13.540 1209 HB VAL 167 HB VAL 167 -21.204 -6.202 -12.404 1210 1HG1 VAL 167 HG12 VAL 167 -21.992 -5.395 -15.207 1211 2HG1 VAL 167 HG11 VAL 167 -20.300 -5.437 -14.713 1212 3HG1 VAL 167 HG13 VAL 167 -21.268 -6.908 -14.661 1213 1HG2 VAL 167 HG21 VAL 167 -21.833 -3.396 -13.377 1214 2HG2 VAL 167 HG23 VAL 167 -21.541 -3.875 -11.704 1215 3HG2 VAL 167 HG22 VAL 167 -20.235 -3.958 -12.886 1216 H GLN 168 HN GLN 168 -24.056 -6.387 -15.231 1217 HA GLN 168 HA GLN 168 -25.036 -9.010 -14.431 1218 1HB GLN 168 HB2 GLN 168 -24.660 -8.118 -17.296 1219 2HB GLN 168 HB1 GLN 168 -25.897 -9.184 -16.632 1220 1HG GLN 168 HG2 GLN 168 -25.658 -6.208 -16.103 1221 2HG GLN 168 HG1 GLN 168 -26.847 -6.980 -17.151 1222 1HE2 GLN 168 HE22 GLN 168 -27.487 -6.871 -13.162 1223 2HE2 GLN 168 HE21 GLN 168 -26.144 -6.115 -13.873 1224 HA PRO 169 HA PRO 169 -21.236 -11.234 -15.122 1225 1HB PRO 169 HB2 PRO 169 -22.443 -13.474 -16.508 1226 2HB PRO 169 HB1 PRO 169 -21.930 -13.396 -14.816 1227 1HG PRO 169 HG2 PRO 169 -24.645 -13.347 -15.866 1228 2HG PRO 169 HG1 PRO 169 -24.129 -13.385 -14.173 1229 1HD PRO 169 HD2 PRO 169 -25.277 -11.157 -15.565 1230 2HD PRO 169 HD1 PRO 169 -24.603 -11.163 -13.923 No H/Q in entry = 1230 Start of MODEL 23 1 1H VAL 1 HT2 VAL 1 5.826 26.719 43.725 2 2H VAL 1 HT1 VAL 1 6.165 27.345 45.267 3 3H VAL 1 HT3 VAL 1 7.366 27.349 44.072 4 HA VAL 1 HA VAL 1 7.965 25.563 45.398 5 HB VAL 1 HB VAL 1 6.006 25.467 46.806 6 1HG1 VAL 1 HG12 VAL 1 4.593 24.587 44.279 7 2HG1 VAL 1 HG11 VAL 1 3.892 24.405 45.886 8 3HG1 VAL 1 HG13 VAL 1 4.257 26.012 45.261 9 1HG2 VAL 1 HG22 VAL 1 7.377 23.340 46.378 10 2HG2 VAL 1 HG21 VAL 1 5.765 23.108 47.056 11 3HG2 VAL 1 HG23 VAL 1 6.049 22.821 45.340 12 H LEU 2 HN LEU 2 8.311 23.285 44.664 13 HA LEU 2 HA LEU 2 8.388 23.129 41.800 14 1HB LEU 2 HB2 LEU 2 10.029 21.952 43.207 15 2HB LEU 2 HB1 LEU 2 8.749 20.941 43.873 16 HG LEU 2 HG LEU 2 8.298 20.031 41.604 17 1HD1 LEU 2 HD12 LEU 2 10.493 21.967 40.871 18 2HD1 LEU 2 HD11 LEU 2 10.221 20.516 39.907 19 3HD1 LEU 2 HD13 LEU 2 8.937 21.710 40.081 20 1HD2 LEU 2 HD22 LEU 2 11.111 19.868 42.698 21 2HD2 LEU 2 HD21 LEU 2 9.786 18.727 42.928 22 3HD2 LEU 2 HD23 LEU 2 10.568 18.866 41.353 23 H THR 3 HN THR 3 7.123 21.818 40.386 24 HA THR 3 HA THR 3 4.380 21.293 41.375 25 HB THR 3 HB THR 3 3.775 21.094 39.059 26 HG1 THR 3 HG1 THR 3 5.937 21.358 37.690 27 1HG2 THR 3 HG23 THR 3 4.414 23.388 39.908 28 2HG2 THR 3 HG22 THR 3 5.987 23.158 39.146 29 3HG2 THR 3 HG21 THR 3 4.526 23.197 38.161 30 H GLU 4 HN GLU 4 3.527 19.212 41.594 31 HA GLU 4 HA GLU 4 5.421 17.043 41.853 32 1HB GLU 4 HB2 GLU 4 3.336 17.276 43.238 33 2HB GLU 4 HB1 GLU 4 2.397 16.855 41.804 34 1HG GLU 4 HG2 GLU 4 3.606 14.712 41.632 35 2HG GLU 4 HG1 GLU 4 4.549 15.125 43.064 36 H GLY 5 HN GLY 5 6.286 17.023 39.644 37 1HA GLY 5 HA2 GLY 5 6.466 15.979 37.555 38 2HA GLY 5 HA1 GLY 5 5.125 14.949 38.052 39 H ASN 6 HN ASN 6 5.084 18.505 37.676 40 HA ASN 6 HA ASN 6 3.535 18.253 35.176 41 1HB ASN 6 HB2 ASN 6 2.312 19.390 37.708 42 2HB ASN 6 HB1 ASN 6 1.589 19.489 36.103 43 1HD2 ASN 6 HD22 ASN 6 0.548 16.081 36.069 44 2HD2 ASN 6 HD21 ASN 6 0.837 17.452 35.111 45 HA PRO 7 HA PRO 7 5.921 22.231 35.760 46 1HB PRO 7 HB2 PRO 7 7.682 21.789 33.618 47 2HB PRO 7 HB1 PRO 7 8.051 21.464 35.318 48 1HG PRO 7 HG2 PRO 7 7.506 19.532 33.151 49 2HG PRO 7 HG1 PRO 7 8.251 19.249 34.732 50 1HD PRO 7 HD2 PRO 7 5.560 18.596 33.951 51 2HD PRO 7 HD1 PRO 7 6.277 18.439 35.566 52 H ARG 8 HN ARG 8 3.749 22.960 34.888 53 HA ARG 8 HA ARG 8 4.009 23.809 32.047 54 1HB ARG 8 HB2 ARG 8 1.659 22.257 33.174 55 2HB ARG 8 HB1 ARG 8 1.587 23.169 31.666 56 1HG ARG 8 HG2 ARG 8 3.442 21.811 30.757 57 2HG ARG 8 HG1 ARG 8 3.507 20.897 32.264 58 1HD ARG 8 HD2 ARG 8 1.108 21.069 30.414 59 2HD ARG 8 HD1 ARG 8 2.194 19.683 30.567 60 HE ARG 8 HE ARG 8 1.316 20.102 33.154 61 1HH1 ARG 8 HH21 ARG 8 -0.134 19.671 30.056 62 2HH1 ARG 8 HH22 ARG 8 -1.578 18.951 30.684 63 1HH2 ARG 8 HH11 ARG 8 -0.562 19.164 33.991 64 2HH2 ARG 8 HH12 ARG 8 -1.821 18.664 32.912 65 H TRP 9 HN TRP 9 3.069 25.836 31.691 66 HA TRP 9 HA TRP 9 2.414 27.420 34.020 67 1HB TRP 9 HB2 TRP 9 1.938 28.027 31.082 68 2HB TRP 9 HB1 TRP 9 1.840 29.185 32.407 69 HD1 TRP 9 HD1 TRP 9 4.259 27.535 30.086 70 HE1 TRP 9 HE1 TRP 9 6.654 28.344 30.595 71 HE3 TRP 9 HE3 TRP 9 3.455 29.961 34.511 72 HZ2 TRP 9 HZ2 TRP 9 8.044 29.823 32.608 73 HZ3 TRP 9 HZ3 TRP 9 5.331 31.060 35.699 74 HH2 TRP 9 HH2 TRP 9 7.622 30.994 34.755 75 H GLU 10 HN GLU 10 0.335 28.260 34.613 76 HA GLU 10 HA GLU 10 -1.869 26.421 34.224 77 1HB GLU 10 HB2 GLU 10 -1.722 29.181 35.456 78 2HB GLU 10 HB1 GLU 10 -3.188 28.205 35.441 79 1HG GLU 10 HG2 GLU 10 -2.139 26.478 36.748 80 2HG GLU 10 HG1 GLU 10 -0.561 27.256 36.603 81 H GLN 11 HN GLN 11 -1.056 29.592 32.896 82 HA GLN 11 HA GLN 11 -3.598 29.737 31.426 83 1HB GLN 11 HB2 GLN 11 -2.473 31.846 30.445 84 2HB GLN 11 HB1 GLN 11 -2.885 31.855 32.155 85 1HG GLN 11 HG2 GLN 11 -0.646 32.742 31.899 86 2HG GLN 11 HG1 GLN 11 -0.516 31.167 32.666 87 1HE2 GLN 11 HE22 GLN 11 0.274 31.034 28.652 88 2HE2 GLN 11 HE21 GLN 11 -1.172 31.730 29.203 89 H THR 12 HN THR 12 -3.658 29.986 29.081 90 HA THR 12 HA THR 12 -1.704 28.171 27.748 91 HB THR 12 HB THR 12 -3.447 28.097 25.952 92 HG1 THR 12 HG1 THR 12 -4.957 29.593 27.828 93 1HG2 THR 12 HG22 THR 12 -3.412 26.457 27.816 94 2HG2 THR 12 HG21 THR 12 -4.468 27.519 28.748 95 3HG2 THR 12 HG23 THR 12 -5.055 26.780 27.257 96 H HIS 13 HN HIS 13 -2.364 31.477 28.090 97 HA HIS 13 HA HIS 13 -1.067 32.156 25.472 98 1HB HIS 13 HB2 HIS 13 -2.678 33.902 27.365 99 2HB HIS 13 HB1 HIS 13 -1.999 34.412 25.819 100 HD1 HIS 13 HD1 HIS 13 -5.061 34.480 26.295 101 HD2 HIS 13 HD2 HIS 13 -3.054 31.276 24.543 102 HE1 HIS 13 HE1 HIS 13 -6.779 33.222 24.924 103 H LEU 14 HN LEU 14 1.071 32.596 25.691 104 HA LEU 14 HA LEU 14 2.086 33.608 28.323 105 1HB LEU 14 HB2 LEU 14 3.451 32.148 26.047 106 2HB LEU 14 HB1 LEU 14 4.308 32.803 27.441 107 HG LEU 14 HG LEU 14 1.968 30.925 27.831 108 1HD1 LEU 14 HD13 LEU 14 4.855 30.192 27.259 109 2HD1 LEU 14 HD12 LEU 14 3.688 29.082 27.983 110 3HD1 LEU 14 HD11 LEU 14 3.429 29.696 26.348 111 1HD2 LEU 14 HD21 LEU 14 4.460 31.612 29.435 112 2HD2 LEU 14 HD23 LEU 14 2.803 32.052 29.835 113 3HD2 LEU 14 HD22 LEU 14 3.305 30.365 29.894 114 H THR 15 HN THR 15 3.891 35.145 28.209 115 HA THR 15 HA THR 15 3.957 36.849 25.755 116 HB THR 15 HB THR 15 3.770 38.869 27.071 117 HG1 THR 15 HG1 THR 15 4.786 37.569 28.934 118 1HG2 THR 15 HG22 THR 15 1.642 37.586 26.488 119 2HG2 THR 15 HG21 THR 15 1.638 37.022 28.160 120 3HG2 THR 15 HG23 THR 15 1.504 38.747 27.808 121 H TYR 16 HN TYR 16 5.986 38.141 25.666 122 HA TYR 16 HA TYR 16 8.071 37.315 27.634 123 1HB TYR 16 HB2 TYR 16 9.625 36.571 25.960 124 2HB TYR 16 HB1 TYR 16 8.123 35.687 25.702 125 HD1 TYR 16 HD1 TYR 16 10.330 38.349 24.425 126 HD2 TYR 16 HD2 TYR 16 6.710 36.131 23.765 127 HE1 TYR 16 HE1 TYR 16 10.233 39.200 22.099 128 HE2 TYR 16 HE2 TYR 16 6.611 36.987 21.439 129 HH TYR 16 HH TYR 16 8.429 37.871 19.731 130 H ARG 17 HN ARG 17 10.023 38.616 27.478 131 HA ARG 17 HA ARG 17 9.768 41.160 25.947 132 1HB ARG 17 HB2 ARG 17 8.734 41.461 28.234 133 2HB ARG 17 HB1 ARG 17 10.307 41.089 28.930 134 1HG ARG 17 HG2 ARG 17 11.271 42.971 27.558 135 2HG ARG 17 HG1 ARG 17 9.629 43.406 27.106 136 1HD ARG 17 HD2 ARG 17 10.803 43.338 29.889 137 2HD ARG 17 HD1 ARG 17 10.284 44.770 29.008 138 HE ARG 17 HE ARG 17 8.647 43.071 30.649 139 1HH1 ARG 17 HH21 ARG 17 8.576 44.691 27.600 140 2HH1 ARG 17 HH22 ARG 17 6.854 44.605 27.462 141 1HH2 ARG 17 HH11 ARG 17 6.419 42.988 30.489 142 2HH2 ARG 17 HH12 ARG 17 5.635 43.657 29.096 143 H ILE 18 HN ILE 18 11.742 41.687 25.111 144 HA ILE 18 HA ILE 18 14.119 40.177 26.040 145 HB ILE 18 HB ILE 18 13.806 42.168 23.760 146 1HG1 ILE 18 HG12 ILE 18 13.976 39.139 23.664 147 2HG1 ILE 18 HG11 ILE 18 12.455 40.023 23.611 148 1HG2 ILE 18 HG22 ILE 18 16.027 40.281 24.592 149 2HG2 ILE 18 HG21 ILE 18 15.940 41.015 22.992 150 3HG2 ILE 18 HG23 ILE 18 16.120 42.034 24.422 151 1HD1 ILE 18 HD11 ILE 18 14.606 40.800 21.670 152 2HD1 ILE 18 HD13 ILE 18 13.692 39.322 21.371 153 3HD1 ILE 18 HD12 ILE 18 12.853 40.867 21.490 154 H GLU 19 HN GLU 19 15.338 41.068 27.640 155 HA GLU 19 HA GLU 19 14.895 43.708 28.639 156 1HB GLU 19 HB2 GLU 19 17.162 41.752 29.062 157 2HB GLU 19 HB1 GLU 19 17.038 43.287 29.926 158 1HG GLU 19 HG2 GLU 19 14.818 42.630 30.781 159 2HG GLU 19 HG1 GLU 19 14.939 41.094 29.921 160 H ASN 20 HN ASN 20 17.395 42.432 26.450 161 HA ASN 20 HA ASN 20 17.776 45.096 25.340 162 1HB ASN 20 HB2 ASN 20 20.134 45.352 25.938 163 2HB ASN 20 HB1 ASN 20 19.160 45.245 27.405 164 1HD2 ASN 20 HD22 ASN 20 22.133 42.864 27.523 165 2HD2 ASN 20 HD21 ASN 20 22.028 44.509 27.123 166 H TYR 21 HN TYR 21 19.295 45.034 23.502 167 HA TYR 21 HA TYR 21 19.352 42.320 22.267 168 1HB TYR 21 HB2 TYR 21 19.693 45.109 21.133 169 2HB TYR 21 HB1 TYR 21 19.910 43.639 20.187 170 HD1 TYR 21 HD1 TYR 21 18.012 42.198 19.631 171 HD2 TYR 21 HD2 TYR 21 17.489 45.788 21.929 172 HE1 TYR 21 HE1 TYR 21 15.566 42.092 19.242 173 HE2 TYR 21 HE2 TYR 21 15.045 45.684 21.538 174 HH TYR 21 HH TYR 21 13.635 43.979 19.206 175 H THR 22 HN THR 22 21.269 41.285 21.946 176 HA THR 22 HA THR 22 23.680 42.343 23.098 177 HB THR 22 HB THR 22 23.397 39.966 23.112 178 HG1 THR 22 HG1 THR 22 25.445 41.151 21.840 179 1HG2 THR 22 HG23 THR 22 21.869 39.855 21.146 180 2HG2 THR 22 HG22 THR 22 23.256 40.093 20.085 181 3HG2 THR 22 HG21 THR 22 23.144 38.642 21.076 182 HA PRO 23 HA PRO 23 24.880 44.653 19.426 183 1HB PRO 23 HB2 PRO 23 27.674 44.713 20.042 184 2HB PRO 23 HB1 PRO 23 26.481 45.967 20.413 185 1HG PRO 23 HG2 PRO 23 27.762 44.063 22.250 186 2HG PRO 23 HG1 PRO 23 26.789 45.489 22.639 187 1HD PRO 23 HD2 PRO 23 25.971 42.762 22.880 188 2HD PRO 23 HD1 PRO 23 24.945 44.205 23.046 189 H ASP 24 HN ASP 24 25.560 41.483 20.140 190 HA ASP 24 HA ASP 24 27.624 40.793 18.280 191 1HB ASP 24 HB2 ASP 24 25.296 39.200 19.384 192 2HB ASP 24 HB1 ASP 24 26.552 38.498 18.367 193 H LEU 25 HN LEU 25 24.109 41.066 17.938 194 HA LEU 25 HA LEU 25 24.457 41.126 14.979 195 1HB LEU 25 HB2 LEU 25 22.515 39.428 16.572 196 2HB LEU 25 HB1 LEU 25 22.287 39.756 14.862 197 HG LEU 25 HG LEU 25 24.883 38.609 15.906 198 1HD1 LEU 25 HD12 LEU 25 22.361 37.123 15.140 199 2HD1 LEU 25 HD11 LEU 25 23.949 36.367 15.240 200 3HD1 LEU 25 HD13 LEU 25 23.212 37.063 16.682 201 1HD2 LEU 25 HD21 LEU 25 23.510 38.783 13.214 202 2HD2 LEU 25 HD23 LEU 25 25.128 39.324 13.659 203 3HD2 LEU 25 HD22 LEU 25 24.781 37.603 13.514 204 HA PRO 26 HA PRO 26 21.886 44.707 15.367 205 1HB PRO 26 HB2 PRO 26 20.171 44.160 13.104 206 2HB PRO 26 HB1 PRO 26 21.561 45.253 13.169 207 1HG PRO 26 HG2 PRO 26 21.394 42.618 11.908 208 2HG PRO 26 HG1 PRO 26 22.709 43.800 11.816 209 1HD PRO 26 HD2 PRO 26 22.753 41.340 13.253 210 2HD PRO 26 HD1 PRO 26 23.952 42.647 13.355 211 H ARG 27 HN ARG 27 19.707 45.255 16.101 212 HA ARG 27 HA ARG 27 18.382 43.093 17.473 213 1HB ARG 27 HB2 ARG 27 16.732 44.788 18.132 214 2HB ARG 27 HB1 ARG 27 18.366 45.425 18.312 215 1HG ARG 27 HG2 ARG 27 18.119 46.436 16.009 216 2HG ARG 27 HG1 ARG 27 16.418 45.988 16.064 217 1HD ARG 27 HD2 ARG 27 16.190 47.268 18.191 218 2HD ARG 27 HD1 ARG 27 17.856 47.806 18.030 219 HE ARG 27 HE ARG 27 15.539 48.938 16.746 220 1HH1 ARG 27 HH21 ARG 27 18.811 48.062 16.057 221 2HH1 ARG 27 HH22 ARG 27 18.902 49.054 14.641 222 1HH2 ARG 27 HH11 ARG 27 15.659 50.233 14.926 223 2HH2 ARG 27 HH12 ARG 27 17.126 50.286 14.006 224 H ALA 28 HN ALA 28 17.799 44.759 14.422 225 HA ALA 28 HA ALA 28 15.160 43.832 13.913 226 1HB ALA 28 HB1 ALA 28 16.481 45.531 12.560 227 2HB ALA 28 HB3 ALA 28 17.330 44.171 11.828 228 3HB ALA 28 HB2 ALA 28 15.589 44.345 11.606 229 H ASP 29 HN ASP 29 18.313 42.299 13.366 230 HA ASP 29 HA ASP 29 17.120 39.954 12.089 231 1HB ASP 29 HB2 ASP 29 19.911 40.617 13.050 232 2HB ASP 29 HB1 ASP 29 19.496 39.046 12.366 233 H VAL 30 HN VAL 30 18.342 40.769 15.327 234 HA VAL 30 HA VAL 30 18.194 38.071 16.336 235 HB VAL 30 HB VAL 30 18.197 40.764 17.720 236 1HG1 VAL 30 HG12 VAL 30 18.164 37.957 18.843 237 2HG1 VAL 30 HG11 VAL 30 18.832 39.313 19.752 238 3HG1 VAL 30 HG13 VAL 30 17.134 39.320 19.280 239 1HG2 VAL 30 HG22 VAL 30 20.257 40.067 16.488 240 2HG2 VAL 30 HG21 VAL 30 20.518 40.182 18.228 241 3HG2 VAL 30 HG23 VAL 30 20.313 38.603 17.469 242 H ASP 31 HN ASP 31 15.935 40.838 16.473 243 HA ASP 31 HA ASP 31 13.957 39.572 18.079 244 1HB ASP 31 HB2 ASP 31 13.901 41.976 17.535 245 2HB ASP 31 HB1 ASP 31 13.572 41.590 15.846 246 H HIS 32 HN HIS 32 14.465 39.539 14.561 247 HA HIS 32 HA HIS 32 12.109 38.095 13.887 248 1HB HIS 32 HB2 HIS 32 13.628 39.226 12.252 249 2HB HIS 32 HB1 HIS 32 14.809 37.942 12.513 250 HD1 HIS 32 HD1 HIS 32 11.034 37.889 11.891 251 HD2 HIS 32 HD2 HIS 32 14.538 36.178 10.418 252 HE1 HIS 32 HE1 HIS 32 10.333 36.291 10.054 253 H ALA 33 HN ALA 33 15.345 36.952 14.855 254 HA ALA 33 HA ALA 33 14.883 34.170 14.451 255 1HB ALA 33 HB3 ALA 33 17.117 35.140 14.942 256 2HB ALA 33 HB2 ALA 33 16.591 35.476 16.592 257 3HB ALA 33 HB1 ALA 33 16.723 33.811 16.032 258 H ILE 34 HN ILE 34 14.344 36.189 17.356 259 HA ILE 34 HA ILE 34 13.294 34.013 18.947 260 HB ILE 34 HB ILE 34 12.858 37.006 19.180 261 1HG1 ILE 34 HG12 ILE 34 15.230 36.446 19.286 262 2HG1 ILE 34 HG11 ILE 34 14.659 36.884 20.891 263 1HG2 ILE 34 HG23 ILE 34 12.405 34.761 21.164 264 2HG2 ILE 34 HG22 ILE 34 12.376 36.474 21.576 265 3HG2 ILE 34 HG21 ILE 34 11.179 35.819 20.462 266 1HD1 ILE 34 HD13 ILE 34 14.268 34.275 21.137 267 2HD1 ILE 34 HD12 ILE 34 15.445 34.188 19.829 268 3HD1 ILE 34 HD11 ILE 34 15.878 34.954 21.355 269 H GLU 35 HN GLU 35 11.777 36.611 17.053 270 HA GLU 35 HA GLU 35 9.076 35.935 17.616 271 1HB GLU 35 HB2 GLU 35 9.766 38.041 16.519 272 2HB GLU 35 HB1 GLU 35 10.264 37.132 15.093 273 1HG GLU 35 HG2 GLU 35 7.942 36.345 14.777 274 2HG GLU 35 HG1 GLU 35 7.443 37.252 16.207 275 H LYS 36 HN LYS 36 11.267 34.821 15.046 276 HA LYS 36 HA LYS 36 9.383 33.238 13.621 277 1HB LYS 36 HB2 LYS 36 11.651 33.893 12.802 278 2HB LYS 36 HB1 LYS 36 12.355 32.731 13.926 279 1HG LYS 36 HG2 LYS 36 11.117 30.905 12.824 280 2HG LYS 36 HG1 LYS 36 10.395 32.064 11.708 281 1HD LYS 36 HD2 LYS 36 12.611 32.656 10.844 282 2HD LYS 36 HD1 LYS 36 13.372 31.553 11.993 283 1HE LYS 36 HE2 LYS 36 12.170 29.654 10.957 284 2HE LYS 36 HE1 LYS 36 11.436 30.760 9.797 285 1HZ LYS 36 HZ3 LYS 36 13.937 31.401 9.410 286 2HZ LYS 36 HZ2 LYS 36 14.203 29.824 9.987 287 3HZ LYS 36 HZ1 LYS 36 13.238 30.079 8.612 288 H ALA 37 HN ALA 37 11.477 32.385 16.389 289 HA ALA 37 HA ALA 37 10.854 29.591 16.355 290 1HB ALA 37 HB3 ALA 37 12.721 30.763 17.650 291 2HB ALA 37 HB2 ALA 37 11.494 31.164 18.849 292 3HB ALA 37 HB1 ALA 37 11.865 29.477 18.498 293 H PHE 38 HN PHE 38 9.405 32.247 18.313 294 HA PHE 38 HA PHE 38 7.513 30.593 19.651 295 1HB PHE 38 HB2 PHE 38 7.508 33.520 18.899 296 2HB PHE 38 HB1 PHE 38 6.107 32.796 19.683 297 HD1 PHE 38 HD2 PHE 38 6.560 31.435 21.866 298 HD2 PHE 38 HD1 PHE 38 9.302 34.302 20.217 299 HE1 PHE 38 HE2 PHE 38 7.647 31.671 24.083 300 HE2 PHE 38 HE1 PHE 38 10.389 34.537 22.435 301 HZ PHE 38 HZ PHE 38 9.560 33.222 24.368 302 H GLN 39 HN GLN 39 7.350 32.233 16.496 303 HA GLN 39 HA GLN 39 4.629 31.607 15.921 304 1HB GLN 39 HB2 GLN 39 7.025 32.028 14.115 305 2HB GLN 39 HB1 GLN 39 5.389 31.798 13.500 306 1HG GLN 39 HG2 GLN 39 4.610 33.746 14.780 307 2HG GLN 39 HG1 GLN 39 6.225 33.974 15.439 308 1HE2 GLN 39 HE22 GLN 39 7.154 34.481 11.704 309 2HE2 GLN 39 HE21 GLN 39 7.293 33.073 12.643 310 H LEU 40 HN LEU 40 7.623 29.742 15.364 311 HA LEU 40 HA LEU 40 6.421 27.605 13.912 312 1HB LEU 40 HB2 LEU 40 8.843 27.648 15.727 313 2HB LEU 40 HB1 LEU 40 8.375 26.235 14.791 314 HG LEU 40 HG LEU 40 8.916 28.965 13.573 315 1HD1 LEU 40 HD12 LEU 40 10.716 26.528 13.778 316 2HD1 LEU 40 HD11 LEU 40 11.080 27.987 12.856 317 3HD1 LEU 40 HD13 LEU 40 10.957 28.061 14.612 318 1HD2 LEU 40 HD22 LEU 40 8.293 26.219 12.476 319 2HD2 LEU 40 HD21 LEU 40 7.633 27.781 11.992 320 3HD2 LEU 40 HD23 LEU 40 9.271 27.337 11.526 321 H TRP 41 HN TRP 41 6.790 28.066 17.432 322 HA TRP 41 HA TRP 41 5.712 25.450 18.061 323 1HB TRP 41 HB2 TRP 41 6.064 27.968 19.705 324 2HB TRP 41 HB1 TRP 41 5.459 26.451 20.375 325 HD1 TRP 41 HD1 TRP 41 8.585 28.259 19.728 326 HE1 TRP 41 HE1 TRP 41 10.621 26.698 19.976 327 HE3 TRP 41 HE3 TRP 41 6.223 23.732 19.793 328 HZ2 TRP 41 HZ2 TRP 41 11.176 23.900 20.172 329 HZ3 TRP 41 HZ3 TRP 41 7.531 21.635 20.006 330 HH2 TRP 41 HH2 TRP 41 10.004 21.714 20.196 331 H SER 42 HN SER 42 4.338 28.713 17.876 332 HA SER 42 HA SER 42 1.719 27.950 18.808 333 1HB SER 42 HB2 SER 42 2.497 30.278 18.868 334 2HB SER 42 HB1 SER 42 2.595 30.306 17.108 335 HG SER 42 HG SER 42 0.476 30.422 16.988 336 H ASN 43 HN ASN 43 3.209 28.117 15.593 337 HA ASN 43 HA ASN 43 0.906 27.894 13.987 338 1HB ASN 43 HB2 ASN 43 3.662 26.692 13.612 339 2HB ASN 43 HB1 ASN 43 2.411 26.664 12.371 340 1HD2 ASN 43 HD22 ASN 43 4.598 29.753 12.025 341 2HD2 ASN 43 HD21 ASN 43 4.982 28.108 12.186 342 H VAL 44 HN VAL 44 2.488 25.451 15.973 343 HA VAL 44 HA VAL 44 0.581 23.382 14.931 344 HB VAL 44 HB VAL 44 2.162 21.767 16.050 345 1HG1 VAL 44 HG11 VAL 44 2.211 22.311 13.611 346 2HG1 VAL 44 HG13 VAL 44 3.392 23.577 13.949 347 3HG1 VAL 44 HG12 VAL 44 3.798 21.889 14.249 348 1HG2 VAL 44 HG21 VAL 44 3.146 23.527 17.577 349 2HG2 VAL 44 HG23 VAL 44 4.343 22.555 16.724 350 3HG2 VAL 44 HG22 VAL 44 3.982 24.191 16.173 351 H THR 45 HN THR 45 0.481 25.536 17.375 352 HA THR 45 HA THR 45 -1.013 23.614 19.066 353 HB THR 45 HB THR 45 0.094 24.697 21.130 354 HG1 THR 45 HG1 THR 45 2.262 25.382 20.613 355 1HG2 THR 45 HG22 THR 45 1.715 22.909 19.303 356 2HG2 THR 45 HG21 THR 45 1.992 23.118 21.028 357 3HG2 THR 45 HG23 THR 45 0.501 22.375 20.460 358 HA PRO 46 HA PRO 46 -3.789 27.078 19.359 359 1HB PRO 46 HB2 PRO 46 -4.914 26.541 21.895 360 2HB PRO 46 HB1 PRO 46 -5.474 25.863 20.359 361 1HG PRO 46 HG2 PRO 46 -3.928 24.545 22.518 362 2HG PRO 46 HG1 PRO 46 -4.896 23.810 21.229 363 1HD PRO 46 HD2 PRO 46 -2.067 23.910 21.315 364 2HD PRO 46 HD1 PRO 46 -3.059 23.508 19.899 365 H LEU 47 HN LEU 47 -1.045 26.743 21.146 366 HA LEU 47 HA LEU 47 -1.440 28.725 23.220 367 1HB LEU 47 HB2 LEU 47 1.117 27.725 21.928 368 2HB LEU 47 HB1 LEU 47 1.032 28.677 23.409 369 HG LEU 47 HG LEU 47 -0.286 25.972 23.040 370 1HD1 LEU 47 HD11 LEU 47 2.344 26.772 24.315 371 2HD1 LEU 47 HD13 LEU 47 1.561 25.221 24.612 372 3HD1 LEU 47 HD12 LEU 47 2.101 25.640 22.983 373 1HD2 LEU 47 HD23 LEU 47 -0.006 27.905 25.346 374 2HD2 LEU 47 HD22 LEU 47 -1.453 27.068 24.777 375 3HD2 LEU 47 HD21 LEU 47 -0.208 26.182 25.647 376 H THR 48 HN THR 48 -0.719 30.897 23.240 377 HA THR 48 HA THR 48 -0.055 32.080 20.558 378 HB THR 48 HB THR 48 -1.529 33.993 21.152 379 HG1 THR 48 HG1 THR 48 -1.678 32.519 23.471 380 1HG2 THR 48 HG22 THR 48 -2.850 31.267 21.177 381 2HG2 THR 48 HG21 THR 48 -3.677 32.785 20.830 382 3HG2 THR 48 HG23 THR 48 -2.412 32.202 19.746 383 H PHE 49 HN PHE 49 1.497 33.692 20.630 384 HA PHE 49 HA PHE 49 2.573 34.427 23.338 385 1HB PHE 49 HB2 PHE 49 4.065 33.982 20.740 386 2HB PHE 49 HB1 PHE 49 4.792 34.603 22.222 387 HD1 PHE 49 HD2 PHE 49 5.074 33.174 24.191 388 HD2 PHE 49 HD1 PHE 49 3.320 31.667 20.574 389 HE1 PHE 49 HE2 PHE 49 5.343 30.857 25.028 390 HE2 PHE 49 HE1 PHE 49 3.582 29.350 21.410 391 HZ PHE 49 HZ PHE 49 4.595 28.942 23.638 392 H THR 50 HN THR 50 2.764 36.556 23.739 393 HA THR 50 HA THR 50 2.337 38.491 21.484 394 HB THR 50 HB THR 50 1.470 38.734 24.376 395 HG1 THR 50 HG1 THR 50 -0.622 38.715 23.264 396 1HG2 THR 50 HG21 THR 50 1.308 40.578 21.991 397 2HG2 THR 50 HG23 THR 50 0.223 40.740 23.375 398 3HG2 THR 50 HG22 THR 50 1.965 40.918 23.593 399 H LYS 51 HN LYS 51 3.911 39.969 21.213 400 HA LYS 51 HA LYS 51 6.209 40.002 23.043 401 1HB LYS 51 HB2 LYS 51 6.554 40.104 20.593 402 2HB LYS 51 HB1 LYS 51 5.653 41.620 20.534 403 1HG LYS 51 HG2 LYS 51 7.309 42.718 21.940 404 2HG LYS 51 HG1 LYS 51 8.161 41.197 22.182 405 1HD LYS 51 HD2 LYS 51 9.379 42.361 20.483 406 2HD LYS 51 HD1 LYS 51 8.467 41.103 19.655 407 1HE LYS 51 HE2 LYS 51 6.884 42.638 18.807 408 2HE LYS 51 HE1 LYS 51 7.339 43.887 19.964 409 1HZ LYS 51 HZ3 LYS 51 9.549 43.039 18.368 410 2HZ LYS 51 HZ2 LYS 51 8.276 43.635 17.413 411 3HZ LYS 51 HZ1 LYS 51 8.950 44.602 18.638 412 H VAL 52 HN VAL 52 6.607 41.578 24.565 413 HA VAL 52 HA VAL 52 4.874 44.040 24.547 414 HB VAL 52 HB VAL 52 5.049 43.908 27.087 415 1HG1 VAL 52 HG11 VAL 52 3.580 41.787 25.501 416 2HG1 VAL 52 HG13 VAL 52 3.297 42.068 27.218 417 3HG1 VAL 52 HG12 VAL 52 2.956 43.345 26.048 418 1HG2 VAL 52 HG23 VAL 52 6.951 42.232 26.985 419 2HG2 VAL 52 HG22 VAL 52 5.641 41.794 28.081 420 3HG2 VAL 52 HG21 VAL 52 5.764 41.025 26.499 421 H SER 53 HN SER 53 5.984 45.956 24.939 422 HA SER 53 HA SER 53 8.951 45.746 25.002 423 1HB SER 53 HB2 SER 53 8.056 47.193 23.282 424 2HB SER 53 HB1 SER 53 7.077 48.065 24.460 425 HG SER 53 HG SER 53 9.090 49.103 23.884 426 H GLU 54 HN GLU 54 6.362 46.359 27.153 427 HA GLU 54 HA GLU 54 8.296 47.197 29.240 428 1HB GLU 54 HB2 GLU 54 5.881 48.821 28.408 429 2HB GLU 54 HB1 GLU 54 6.670 49.017 29.973 430 1HG GLU 54 HG2 GLU 54 8.807 49.519 28.817 431 2HG GLU 54 HG1 GLU 54 7.995 49.351 27.262 432 H GLY 55 HN GLY 55 7.319 47.071 31.430 433 1HA GLY 55 HA2 GLY 55 5.696 46.252 32.987 434 2HA GLY 55 HA1 GLY 55 4.788 45.548 31.649 435 H GLN 56 HN GLN 56 5.070 43.858 33.674 436 HA GLN 56 HA GLN 56 7.556 42.313 33.514 437 1HB GLN 56 HB2 GLN 56 4.910 41.821 34.911 438 2HB GLN 56 HB1 GLN 56 6.292 40.730 35.023 439 1HG GLN 56 HG2 GLN 56 7.676 42.561 35.928 440 2HG GLN 56 HG1 GLN 56 6.296 43.655 35.820 441 1HE2 GLN 56 HE22 GLN 56 4.812 40.964 38.266 442 2HE2 GLN 56 HE21 GLN 56 4.733 40.938 36.570 443 H ALA 57 HN ALA 57 7.571 40.025 32.810 444 HA ALA 57 HA ALA 57 5.361 39.263 30.947 445 1HB ALA 57 HB2 ALA 57 7.244 40.391 29.681 446 2HB ALA 57 HB1 ALA 57 8.292 39.069 30.199 447 3HB ALA 57 HB3 ALA 57 6.897 38.740 29.171 448 H ASP 58 HN ASP 58 5.179 36.996 30.642 449 HA ASP 58 HA ASP 58 5.835 35.391 32.885 450 1HB ASP 58 HB2 ASP 58 5.036 34.652 30.064 451 2HB ASP 58 HB1 ASP 58 5.201 33.467 31.360 452 H ILE 59 HN ILE 59 7.489 35.701 29.726 453 HA ILE 59 HA ILE 59 9.767 34.111 30.890 454 HB ILE 59 HB ILE 59 8.974 34.367 27.971 455 1HG1 ILE 59 HG12 ILE 59 8.842 31.947 29.801 456 2HG1 ILE 59 HG11 ILE 59 7.448 32.964 29.437 457 1HG2 ILE 59 HG21 ILE 59 11.161 32.871 29.444 458 2HG2 ILE 59 HG23 ILE 59 10.696 32.496 27.785 459 3HG2 ILE 59 HG22 ILE 59 11.358 34.083 28.178 460 1HD1 ILE 59 HD12 ILE 59 7.852 32.530 26.990 461 2HD1 ILE 59 HD11 ILE 59 9.094 31.368 27.458 462 3HD1 ILE 59 HD13 ILE 59 7.411 31.089 27.909 463 H MET 60 HN MET 60 11.492 35.374 31.290 464 HA MET 60 HA MET 60 11.819 37.926 29.767 465 1HB MET 60 HB2 MET 60 13.128 36.985 32.336 466 2HB MET 60 HB1 MET 60 13.338 38.568 31.591 467 1HG MET 60 HG2 MET 60 10.651 37.461 32.445 468 2HG MET 60 HG1 MET 60 11.628 38.523 33.453 469 1HE MET 60 HE2 MET 60 12.701 40.521 32.628 470 2HE MET 60 HE1 MET 60 11.957 41.737 31.594 471 3HE MET 60 HE3 MET 60 11.262 41.369 33.178 472 H ILE 61 HN ILE 61 13.466 38.102 28.329 473 HA ILE 61 HA ILE 61 15.576 35.966 28.286 474 HB ILE 61 HB ILE 61 14.411 37.610 26.022 475 1HG1 ILE 61 HG12 ILE 61 14.335 34.621 26.528 476 2HG1 ILE 61 HG11 ILE 61 13.034 35.718 26.986 477 1HG2 ILE 61 HG21 ILE 61 16.668 35.595 26.130 478 2HG2 ILE 61 HG23 ILE 61 15.842 36.022 24.631 479 3HG2 ILE 61 HG22 ILE 61 16.730 37.251 25.531 480 1HD1 ILE 61 HD11 ILE 61 12.973 36.477 24.561 481 2HD1 ILE 61 HD13 ILE 61 14.053 35.130 24.201 482 3HD1 ILE 61 HD12 ILE 61 12.444 34.821 24.846 483 H SER 62 HN SER 62 17.645 36.650 28.569 484 HA SER 62 HA SER 62 18.347 39.468 27.946 485 1HB SER 62 HB2 SER 62 19.189 39.929 30.148 486 2HB SER 62 HB1 SER 62 17.549 39.324 30.349 487 HG SER 62 HG SER 62 18.306 37.510 31.183 488 H PHE 63 HN PHE 63 20.676 39.817 27.993 489 HA PHE 63 HA PHE 63 22.223 37.317 27.407 490 1HB PHE 63 HB2 PHE 63 22.453 40.167 26.409 491 2HB PHE 63 HB1 PHE 63 23.712 38.964 26.144 492 HD1 PHE 63 HD2 PHE 63 23.334 37.027 24.709 493 HD2 PHE 63 HD1 PHE 63 20.265 39.970 25.315 494 HE1 PHE 63 HE2 PHE 63 22.071 36.100 22.791 495 HE2 PHE 63 HE1 PHE 63 18.997 39.038 23.396 496 HZ PHE 63 HZ PHE 63 19.902 37.104 22.134 497 H VAL 64 HN VAL 64 24.058 36.914 28.626 498 HA VAL 64 HA VAL 64 25.020 39.079 30.473 499 HB VAL 64 HB VAL 64 25.251 37.351 32.243 500 1HG1 VAL 64 HG11 VAL 64 23.240 38.798 32.121 501 2HG1 VAL 64 HG13 VAL 64 22.455 37.600 31.092 502 3HG1 VAL 64 HG12 VAL 64 22.851 37.202 32.763 503 1HG2 VAL 64 HG21 VAL 64 23.779 35.647 30.208 504 2HG2 VAL 64 HG23 VAL 64 25.406 35.366 30.827 505 3HG2 VAL 64 HG22 VAL 64 24.015 35.200 31.898 506 H ARG 65 HN ARG 65 27.200 38.596 31.381 507 HA ARG 65 HA ARG 65 28.891 36.927 29.540 508 1HB ARG 65 HB2 ARG 65 29.417 39.701 30.642 509 2HB ARG 65 HB1 ARG 65 30.673 38.693 29.928 510 1HG ARG 65 HG2 ARG 65 29.448 38.605 27.819 511 2HG ARG 65 HG1 ARG 65 28.128 39.546 28.520 512 1HD ARG 65 HD2 ARG 65 30.997 40.489 28.218 513 2HD ARG 65 HD1 ARG 65 29.642 40.998 27.208 514 HE ARG 65 HE ARG 65 28.802 41.585 29.780 515 1HH1 ARG 65 HH21 ARG 65 31.565 42.279 27.835 516 2HH1 ARG 65 HH22 ARG 65 31.884 43.800 28.599 517 1HH2 ARG 65 HH11 ARG 65 29.205 43.563 30.785 518 2HH2 ARG 65 HH12 ARG 65 30.548 44.526 30.269 519 H GLY 66 HN GLY 66 30.487 35.726 30.551 520 1HA GLY 66 HA2 GLY 66 31.468 34.547 32.333 521 2HA GLY 66 HA1 GLY 66 31.764 36.160 32.980 522 H ASP 67 HN ASP 67 31.409 35.499 35.139 523 HA ASP 67 HA ASP 67 29.076 34.069 36.010 524 1HB ASP 67 HB2 ASP 67 31.220 34.300 37.310 525 2HB ASP 67 HB1 ASP 67 30.769 35.971 37.650 526 H HIS 68 HN HIS 68 27.048 34.786 36.382 527 HA HIS 68 HA HIS 68 26.565 37.711 36.770 528 1HB HIS 68 HB2 HIS 68 24.655 37.608 35.211 529 2HB HIS 68 HB1 HIS 68 26.164 37.220 34.385 530 HD1 HIS 68 HD1 HIS 68 26.664 34.540 34.161 531 HD2 HIS 68 HD2 HIS 68 22.724 35.626 34.992 532 HE1 HIS 68 HE1 HIS 68 25.236 32.519 33.625 533 H ARG 69 HN ARG 69 26.491 36.437 38.989 534 HA ARG 69 HA ARG 69 25.183 35.639 40.766 535 1HB ARG 69 HB2 ARG 69 22.985 36.894 39.095 536 2HB ARG 69 HB1 ARG 69 22.811 36.378 40.769 537 1HG ARG 69 HG2 ARG 69 24.583 37.951 41.445 538 2HG ARG 69 HG1 ARG 69 24.761 38.471 39.766 539 1HD ARG 69 HD2 ARG 69 22.228 38.688 41.423 540 2HD ARG 69 HD1 ARG 69 23.304 40.028 41.006 541 HE ARG 69 HE ARG 69 22.653 38.997 38.548 542 1HH1 ARG 69 HH21 ARG 69 20.907 39.985 41.350 543 2HH1 ARG 69 HH22 ARG 69 19.496 40.463 40.465 544 1HH2 ARG 69 HH11 ARG 69 20.823 39.606 37.376 545 2HH2 ARG 69 HH12 ARG 69 19.447 40.245 38.213 546 H ASP 70 HN ASP 70 25.841 33.640 39.089 547 HA ASP 70 HA ASP 70 23.381 31.950 39.074 548 1HB ASP 70 HB2 ASP 70 23.904 32.887 36.749 549 2HB ASP 70 HB1 ASP 70 25.385 31.927 36.802 550 H ASN 71 HN ASN 71 23.870 29.693 39.363 551 HA ASN 71 HA ASN 71 26.444 29.253 40.742 552 1HB ASN 71 HB2 ASN 71 23.971 27.546 40.386 553 2HB ASN 71 HB1 ASN 71 25.415 26.992 41.233 554 1HD2 ASN 71 HD22 ASN 71 22.977 28.638 43.636 555 2HD2 ASN 71 HD21 ASN 71 22.770 27.428 42.467 556 H SER 72 HN SER 72 25.700 29.308 37.622 557 HA SER 72 HA SER 72 27.603 27.092 36.960 558 1HB SER 72 HB2 SER 72 25.063 27.761 35.439 559 2HB SER 72 HB1 SER 72 26.271 26.575 34.951 560 HG SER 72 HG SER 72 25.694 25.293 36.602 561 HA PRO 73 HA PRO 73 28.676 31.303 35.199 562 1HB PRO 73 HB2 PRO 73 31.436 30.764 35.933 563 2HB PRO 73 HB1 PRO 73 30.369 32.025 36.561 564 1HG PRO 73 HG2 PRO 73 31.241 29.655 37.935 565 2HG PRO 73 HG1 PRO 73 30.106 30.880 38.524 566 1HD PRO 73 HD2 PRO 73 29.514 28.175 37.626 567 2HD PRO 73 HD1 PRO 73 28.401 29.375 38.307 568 H PHE 74 HN PHE 74 29.692 31.558 33.157 569 HA PHE 74 HA PHE 74 30.055 29.105 31.636 570 1HB PHE 74 HB2 PHE 74 30.590 31.986 30.855 571 2HB PHE 74 HB1 PHE 74 30.480 30.619 29.746 572 HD1 PHE 74 HD1 PHE 74 28.301 29.363 29.529 573 HD2 PHE 74 HD2 PHE 74 28.632 33.042 31.717 574 HE1 PHE 74 HE1 PHE 74 25.836 29.631 29.451 575 HE2 PHE 74 HE2 PHE 74 26.169 33.313 31.636 576 HZ PHE 74 HZ PHE 74 24.769 31.607 30.504 577 H ASP 75 HN ASP 75 31.999 28.378 30.666 578 HA ASP 75 HA ASP 75 34.537 29.662 31.578 579 1HB ASP 75 HB2 ASP 75 33.987 27.790 33.141 580 2HB ASP 75 HB1 ASP 75 33.957 26.689 31.763 581 H GLY 76 HN GLY 76 34.456 30.357 29.307 582 1HA GLY 76 HA2 GLY 76 35.523 30.152 27.209 583 2HA GLY 76 HA1 GLY 76 35.909 28.476 27.599 584 HA PRO 77 HA PRO 77 32.363 28.761 24.501 585 1HB PRO 77 HB2 PRO 77 33.794 27.107 22.647 586 2HB PRO 77 HB1 PRO 77 33.456 28.838 22.487 587 1HG PRO 77 HG2 PRO 77 36.008 27.543 23.103 588 2HG PRO 77 HG1 PRO 77 35.698 29.250 22.752 589 1HD PRO 77 HD2 PRO 77 36.296 28.090 25.318 590 2HD PRO 77 HD1 PRO 77 35.873 29.779 24.973 591 H GLY 78 HN GLY 78 33.979 26.595 26.436 592 1HA GLY 78 HA2 GLY 78 32.550 24.170 25.505 593 2HA GLY 78 HA1 GLY 78 33.719 24.242 26.826 594 H GLY 79 HN GLY 79 31.478 22.878 27.399 595 1HA GLY 79 HA2 GLY 79 29.936 22.801 29.196 596 2HA GLY 79 HA1 GLY 79 30.264 24.508 29.502 597 H ASN 80 HN ASN 80 27.827 24.555 29.724 598 HA ASN 80 HA ASN 80 26.189 24.162 27.372 599 1HB ASN 80 HB2 ASN 80 25.720 25.655 29.967 600 2HB ASN 80 HB1 ASN 80 24.490 25.477 28.717 601 1HD2 ASN 80 HD22 ASN 80 24.201 22.648 31.207 602 2HD2 ASN 80 HD21 ASN 80 24.209 24.338 31.368 603 H LEU 81 HN LEU 81 25.359 25.775 25.955 604 HA LEU 81 HA LEU 81 27.071 28.188 25.716 605 1HB LEU 81 HB2 LEU 81 24.768 27.413 23.907 606 2HB LEU 81 HB1 LEU 81 26.165 28.416 23.523 607 HG LEU 81 HG LEU 81 26.237 25.444 24.121 608 1HD1 LEU 81 HD13 LEU 81 26.585 27.024 21.557 609 2HD1 LEU 81 HD12 LEU 81 26.872 25.290 21.719 610 3HD1 LEU 81 HD11 LEU 81 25.248 25.941 21.942 611 1HD2 LEU 81 HD21 LEU 81 28.392 27.448 23.394 612 2HD2 LEU 81 HD23 LEU 81 28.314 26.444 24.842 613 3HD2 LEU 81 HD22 LEU 81 28.615 25.704 23.273 614 H ALA 82 HN ALA 82 24.211 27.277 27.179 615 HA ALA 82 HA ALA 82 23.519 29.893 28.086 616 1HB ALA 82 HB3 ALA 82 21.864 28.774 25.800 617 2HB ALA 82 HB2 ALA 82 21.314 30.074 26.858 618 3HB ALA 82 HB1 ALA 82 22.723 30.312 25.825 619 H HIS 83 HN HIS 83 21.128 29.709 29.110 620 HA HIS 83 HA HIS 83 20.202 26.995 29.569 621 1HB HIS 83 HB2 HIS 83 20.678 27.083 32.085 622 2HB HIS 83 HB1 HIS 83 22.046 26.726 31.035 623 HD1 HIS 83 HD1 HIS 83 23.558 27.697 33.014 624 HD2 HIS 83 HD2 HIS 83 21.096 30.485 31.135 625 HE1 HIS 83 HE1 HIS 83 24.429 29.982 33.674 626 H ALA 84 HN ALA 84 18.567 27.015 31.489 627 HA ALA 84 HA ALA 84 17.267 29.655 31.848 628 1HB ALA 84 HB3 ALA 84 16.003 27.267 30.482 629 2HB ALA 84 HB2 ALA 84 15.050 28.573 31.184 630 3HB ALA 84 HB1 ALA 84 16.160 28.907 29.854 631 H PHE 85 HN PHE 85 15.531 29.530 33.493 632 HA PHE 85 HA PHE 85 16.225 27.531 35.583 633 1HB PHE 85 HB2 PHE 85 14.602 30.094 35.629 634 2HB PHE 85 HB1 PHE 85 14.762 29.022 37.018 635 HD1 PHE 85 HD2 PHE 85 16.532 31.373 34.783 636 HD2 PHE 85 HD1 PHE 85 16.885 28.789 38.204 637 HE1 PHE 85 HE2 PHE 85 18.705 32.419 35.354 638 HE2 PHE 85 HE1 PHE 85 19.057 29.839 38.772 639 HZ PHE 85 HZ PHE 85 19.968 31.654 37.349 640 H GLN 86 HN GLN 86 14.316 26.543 36.793 641 HA GLN 86 HA GLN 86 12.585 25.228 34.953 642 1HB GLN 86 HB2 GLN 86 12.214 25.562 37.946 643 2HB GLN 86 HB1 GLN 86 11.446 24.335 36.943 644 1HG GLN 86 HG2 GLN 86 14.448 24.635 37.187 645 2HG GLN 86 HG1 GLN 86 13.498 23.540 38.193 646 1HE2 GLN 86 HE22 GLN 86 14.187 22.598 34.275 647 2HE2 GLN 86 HE21 GLN 86 14.586 24.139 34.864 648 HA PRO 87 HA PRO 87 9.400 28.263 34.329 649 1HB PRO 87 HB2 PRO 87 7.167 26.439 34.500 650 2HB PRO 87 HB1 PRO 87 7.946 27.062 33.037 651 1HG PRO 87 HG2 PRO 87 8.173 24.390 34.214 652 2HG PRO 87 HG1 PRO 87 8.759 24.954 32.643 653 1HD PRO 87 HD2 PRO 87 10.366 24.350 34.908 654 2HD PRO 87 HD1 PRO 87 10.896 25.179 33.430 655 H GLY 88 HN GLY 88 9.159 29.569 36.112 656 1HA GLY 88 HA2 GLY 88 7.105 28.937 38.056 657 2HA GLY 88 HA1 GLY 88 8.718 28.890 38.771 658 HA PRO 89 HA PRO 89 6.973 33.311 38.382 659 1HB PRO 89 HB2 PRO 89 6.916 33.657 41.223 660 2HB PRO 89 HB1 PRO 89 5.520 33.511 40.147 661 1HG PRO 89 HG2 PRO 89 6.604 31.515 42.017 662 2HG PRO 89 HG1 PRO 89 5.050 31.507 41.167 663 1HD PRO 89 HD2 PRO 89 7.305 29.874 40.561 664 2HD PRO 89 HD1 PRO 89 5.847 30.076 39.565 665 H GLY 90 HN GLY 90 8.090 35.212 39.817 666 1HA GLY 90 HA2 GLY 90 10.099 36.312 40.292 667 2HA GLY 90 HA1 GLY 90 10.610 34.798 41.032 668 H ILE 91 HN ILE 91 12.463 34.062 40.181 669 HA ILE 91 HA ILE 91 13.396 34.981 37.566 670 HB ILE 91 HB ILE 91 14.945 34.744 39.469 671 1HG1 ILE 91 HG12 ILE 91 15.613 32.634 37.402 672 2HG1 ILE 91 HG11 ILE 91 15.682 34.362 37.049 673 1HG2 ILE 91 HG23 ILE 91 13.754 32.797 40.495 674 2HG2 ILE 91 HG22 ILE 91 14.402 31.771 39.215 675 3HG2 ILE 91 HG21 ILE 91 15.494 32.547 40.360 676 1HD1 ILE 91 HD13 ILE 91 17.264 34.671 38.932 677 2HD1 ILE 91 HD12 ILE 91 17.211 32.935 39.248 678 3HD1 ILE 91 HD11 ILE 91 17.899 33.537 37.738 679 H GLY 92 HN GLY 92 11.533 32.348 38.664 680 1HA GLY 92 HA2 GLY 92 12.436 30.255 36.961 681 2HA GLY 92 HA1 GLY 92 10.792 30.401 37.578 682 H GLY 93 HN GLY 93 12.158 29.860 34.814 683 1HA GLY 93 HA2 GLY 93 11.035 29.997 32.693 684 2HA GLY 93 HA1 GLY 93 10.152 31.410 33.266 685 H ASP 94 HN ASP 94 12.929 32.374 34.328 686 HA ASP 94 HA ASP 94 13.508 34.100 32.109 687 1HB ASP 94 HB2 ASP 94 15.123 33.398 34.572 688 2HB ASP 94 HB1 ASP 94 15.627 34.616 33.400 689 H ALA 95 HN ALA 95 15.412 34.107 30.747 690 HA ALA 95 HA ALA 95 16.931 31.552 30.586 691 1HB ALA 95 HB1 ALA 95 14.939 31.435 29.037 692 2HB ALA 95 HB3 ALA 95 15.616 32.810 28.166 693 3HB ALA 95 HB2 ALA 95 16.499 31.286 28.231 694 H HIS 96 HN HIS 96 19.028 32.073 30.520 695 HA HIS 96 HA HIS 96 19.835 34.776 29.527 696 1HB HIS 96 HB2 HIS 96 21.405 32.803 31.200 697 2HB HIS 96 HB1 HIS 96 21.823 34.481 30.876 698 HD2 HIS 96 HD2 HIS 96 18.202 35.002 31.651 699 HE1 HIS 96 HE1 HIS 96 20.131 34.475 35.404 700 HE2 HIS 96 HE2 HIS 96 18.027 35.285 34.246 701 H PHE 97 HN PHE 97 21.437 34.985 27.960 702 HA PHE 97 HA PHE 97 22.241 32.477 26.519 703 1HB PHE 97 HB2 PHE 97 21.619 35.271 25.570 704 2HB PHE 97 HB1 PHE 97 22.570 34.169 24.576 705 HD1 PHE 97 HD1 PHE 97 19.326 34.481 26.397 706 HD2 PHE 97 HD2 PHE 97 21.509 32.503 23.276 707 HE1 PHE 97 HE1 PHE 97 17.240 33.378 25.637 708 HE2 PHE 97 HE2 PHE 97 19.423 31.401 22.512 709 HZ PHE 97 HZ PHE 97 17.286 31.838 23.692 710 H ASP 98 HN ASP 98 24.390 32.106 26.177 711 HA ASP 98 HA ASP 98 26.395 33.534 27.667 712 1HB ASP 98 HB2 ASP 98 26.612 31.152 27.031 713 2HB ASP 98 HB1 ASP 98 26.686 31.606 25.329 714 H GLU 99 HN GLU 99 26.616 35.705 27.104 715 HA GLU 99 HA GLU 99 26.591 36.557 24.312 716 1HB GLU 99 HB2 GLU 99 25.774 37.937 26.262 717 2HB GLU 99 HB1 GLU 99 27.454 38.156 26.728 718 1HG GLU 99 HG2 GLU 99 27.962 39.249 24.617 719 2HG GLU 99 HG1 GLU 99 26.345 38.896 24.007 720 H ASP 100 HN ASP 100 29.014 35.223 26.312 721 HA ASP 100 HA ASP 100 31.242 36.760 25.240 722 1HB ASP 100 HB2 ASP 100 31.109 34.110 26.703 723 2HB ASP 100 HB1 ASP 100 32.622 34.865 26.200 724 H GLU 101 HN GLU 101 29.353 34.092 24.135 725 HA GLU 101 HA GLU 101 31.385 33.167 22.208 726 1HB GLU 101 HB2 GLU 101 28.473 32.425 22.621 727 2HB GLU 101 HB1 GLU 101 29.530 31.676 21.425 728 1HG GLU 101 HG2 GLU 101 31.014 30.861 23.154 729 2HG GLU 101 HG1 GLU 101 30.118 31.739 24.393 730 H ARG 102 HN ARG 102 30.852 33.200 19.842 731 HA ARG 102 HA ARG 102 29.641 35.816 19.118 732 1HB ARG 102 HB2 ARG 102 31.865 35.106 18.174 733 2HB ARG 102 HB1 ARG 102 31.033 33.796 17.333 734 1HG ARG 102 HG2 ARG 102 29.606 35.436 16.173 735 2HG ARG 102 HG1 ARG 102 30.431 36.753 17.006 736 1HD ARG 102 HD2 ARG 102 32.573 36.045 15.982 737 2HD ARG 102 HD1 ARG 102 31.724 34.757 15.122 738 HE ARG 102 HE ARG 102 30.348 37.007 14.347 739 1HH1 ARG 102 HH21 ARG 102 33.685 36.161 14.548 740 2HH1 ARG 102 HH22 ARG 102 34.136 37.064 13.140 741 1HH2 ARG 102 HH11 ARG 102 30.919 38.182 12.496 742 2HH2 ARG 102 HH12 ARG 102 32.572 38.207 11.981 743 H TRP 103 HN TRP 103 27.494 35.797 18.695 744 HA TRP 103 HA TRP 103 26.163 33.290 17.879 745 1HB TRP 103 HB2 TRP 103 25.127 36.059 18.546 746 2HB TRP 103 HB1 TRP 103 24.089 34.715 18.067 747 HD1 TRP 103 HD1 TRP 103 25.484 36.279 21.048 748 HE1 TRP 103 HE1 TRP 103 25.359 34.699 23.081 749 HE3 TRP 103 HE3 TRP 103 24.448 31.874 18.682 750 HZ2 TRP 103 HZ2 TRP 103 24.883 31.931 23.633 751 HZ3 TRP 103 HZ3 TRP 103 24.171 29.786 19.982 752 HH2 TRP 103 HH2 TRP 103 24.385 29.807 22.452 753 H THR 104 HN THR 104 24.999 33.080 15.900 754 HA THR 104 HA THR 104 25.421 35.213 13.847 755 HB THR 104 HB THR 104 26.194 33.585 12.219 756 HG1 THR 104 HG1 THR 104 25.570 31.624 12.574 757 1HG2 THR 104 HG23 THR 104 27.792 34.628 13.945 758 2HG2 THR 104 HG22 THR 104 27.776 33.049 14.730 759 3HG2 THR 104 HG21 THR 104 28.369 33.204 13.078 760 H ASN 105 HN ASN 105 23.978 34.941 11.982 761 HA ASN 105 HA ASN 105 21.420 33.554 12.726 762 1HB ASN 105 HB2 ASN 105 21.977 35.966 10.971 763 2HB ASN 105 HB1 ASN 105 20.399 35.190 11.100 764 1HD2 ASN 105 HD22 ASN 105 20.444 36.049 14.776 765 2HD2 ASN 105 HD21 ASN 105 20.512 34.580 13.930 766 H ASN 106 HN ASN 106 23.796 32.368 11.340 767 HA ASN 106 HA ASN 106 22.353 31.404 8.916 768 1HB ASN 106 HB2 ASN 106 24.701 31.579 7.758 769 2HB ASN 106 HB1 ASN 106 23.698 33.026 7.888 770 1HD2 ASN 106 HD22 ASN 106 26.417 34.634 9.453 771 2HD2 ASN 106 HD21 ASN 106 25.302 34.636 8.172 772 H PHE 107 HN PHE 107 24.364 29.778 7.896 773 HA PHE 107 HA PHE 107 24.311 27.587 9.829 774 1HB PHE 107 HB2 PHE 107 25.724 27.659 7.152 775 2HB PHE 107 HB1 PHE 107 25.192 26.237 8.049 776 HD1 PHE 107 HD2 PHE 107 22.620 26.176 8.657 777 HD2 PHE 107 HD1 PHE 107 24.319 28.515 5.479 778 HE1 PHE 107 HE2 PHE 107 20.402 26.297 7.558 779 HE2 PHE 107 HE1 PHE 107 22.099 28.640 4.383 780 HZ PHE 107 HZ PHE 107 20.141 27.530 5.422 781 H ARG 108 HN ARG 108 26.178 30.162 9.917 782 HA ARG 108 HA ARG 108 28.865 29.280 9.787 783 1HB ARG 108 HB2 ARG 108 27.515 31.401 11.460 784 2HB ARG 108 HB1 ARG 108 29.254 31.136 11.517 785 1HG ARG 108 HG2 ARG 108 29.432 31.516 9.106 786 2HG ARG 108 HG1 ARG 108 27.686 31.725 8.989 787 1HD ARG 108 HD2 ARG 108 27.819 33.675 10.502 788 2HD ARG 108 HD1 ARG 108 29.567 33.468 10.610 789 HE ARG 108 HE ARG 108 29.108 33.685 7.891 790 1HH1 ARG 108 HH21 ARG 108 28.297 35.488 10.715 791 2HH1 ARG 108 HH22 ARG 108 28.284 37.016 9.899 792 1HH2 ARG 108 HH11 ARG 108 29.094 35.666 6.805 793 2HH2 ARG 108 HH12 ARG 108 28.734 37.117 7.681 794 H GLU 109 HN GLU 109 29.889 29.749 12.376 795 HA GLU 109 HA GLU 109 30.092 27.216 13.435 796 1HB GLU 109 HB2 GLU 109 30.210 29.870 14.878 797 2HB GLU 109 HB1 GLU 109 30.715 28.341 15.600 798 1HG GLU 109 HG2 GLU 109 32.333 28.005 13.767 799 2HG GLU 109 HG1 GLU 109 31.833 29.536 13.048 800 H TYR 110 HN TYR 110 27.904 29.698 14.910 801 HA TYR 110 HA TYR 110 26.164 27.402 15.793 802 1HB TYR 110 HB2 TYR 110 26.868 29.871 17.398 803 2HB TYR 110 HB1 TYR 110 25.759 28.599 17.900 804 HD1 TYR 110 HD2 TYR 110 26.663 26.200 18.068 805 HD2 TYR 110 HD1 TYR 110 29.193 29.661 17.792 806 HE1 TYR 110 HE2 TYR 110 28.560 24.890 18.989 807 HE2 TYR 110 HE1 TYR 110 31.089 28.351 18.713 808 HH TYR 110 HH TYR 110 30.641 25.012 19.824 809 H ASN 111 HN ASN 111 24.020 27.650 15.480 810 HA ASN 111 HA ASN 111 23.058 30.183 14.240 811 1HB ASN 111 HB2 ASN 111 22.553 27.912 13.204 812 2HB ASN 111 HB1 ASN 111 21.541 27.583 14.610 813 1HD2 ASN 111 HD22 ASN 111 18.969 29.005 12.574 814 2HD2 ASN 111 HD21 ASN 111 19.634 27.546 13.131 815 H LEU 112 HN LEU 112 22.332 31.643 15.718 816 HA LEU 112 HA LEU 112 21.711 31.106 18.423 817 1HB LEU 112 HB2 LEU 112 22.194 33.360 17.574 818 2HB LEU 112 HB1 LEU 112 20.700 33.344 16.644 819 HG LEU 112 HG LEU 112 19.402 33.152 18.756 820 1HD1 LEU 112 HD12 LEU 112 22.175 33.103 19.935 821 2HD1 LEU 112 HD11 LEU 112 20.829 33.751 20.871 822 3HD1 LEU 112 HD13 LEU 112 20.788 32.081 20.315 823 1HD2 LEU 112 HD21 LEU 112 20.032 35.363 17.718 824 2HD2 LEU 112 HD23 LEU 112 19.700 35.436 19.448 825 3HD2 LEU 112 HD22 LEU 112 21.366 35.452 18.868 826 H HIS 113 HN HIS 113 19.527 31.313 15.610 827 HA HIS 113 HA HIS 113 17.091 31.117 17.041 828 1HB HIS 113 HB2 HIS 113 17.237 31.687 14.642 829 2HB HIS 113 HB1 HIS 113 17.715 30.028 14.284 830 HD1 HIS 113 HD1 HIS 113 15.719 28.896 13.285 831 HD2 HIS 113 HD2 HIS 113 14.676 31.304 16.520 832 HE1 HIS 113 HE1 HIS 113 13.232 28.569 13.648 833 H ARG 114 HN ARG 114 19.114 28.475 15.695 834 HA ARG 114 HA ARG 114 17.375 26.348 16.402 835 1HB ARG 114 HB2 ARG 114 19.447 26.122 14.994 836 2HB ARG 114 HB1 ARG 114 20.407 26.266 16.468 837 1HG ARG 114 HG2 ARG 114 19.307 24.299 17.414 838 2HG ARG 114 HG1 ARG 114 18.278 24.163 15.996 839 1HD ARG 114 HD2 ARG 114 21.281 23.840 16.118 840 2HD ARG 114 HD1 ARG 114 20.110 22.579 15.767 841 HE ARG 114 HE ARG 114 21.318 24.363 13.874 842 1HH1 ARG 114 HH21 ARG 114 18.212 23.068 14.675 843 2HH1 ARG 114 HH22 ARG 114 17.538 23.419 13.123 844 1HH2 ARG 114 HH11 ARG 114 20.457 24.778 11.857 845 2HH2 ARG 114 HH12 ARG 114 18.806 24.372 11.528 846 H VAL 115 HN VAL 115 19.834 28.050 18.287 847 HA VAL 115 HA VAL 115 19.622 26.357 20.612 848 HB VAL 115 HB VAL 115 20.592 29.201 20.230 849 1HG1 VAL 115 HG12 VAL 115 20.616 27.400 22.654 850 2HG1 VAL 115 HG11 VAL 115 21.769 28.720 22.458 851 3HG1 VAL 115 HG13 VAL 115 20.042 29.064 22.535 852 1HG2 VAL 115 HG21 VAL 115 21.930 26.491 20.349 853 2HG2 VAL 115 HG23 VAL 115 22.015 27.694 19.062 854 3HG2 VAL 115 HG22 VAL 115 22.825 27.987 20.601 855 H ALA 116 HN ALA 116 18.046 29.393 19.623 856 HA ALA 116 HA ALA 116 16.671 29.919 22.053 857 1HB ALA 116 HB2 ALA 116 16.818 31.401 19.969 858 2HB ALA 116 HB1 ALA 116 15.519 30.416 19.299 859 3HB ALA 116 HB3 ALA 116 15.250 31.349 20.773 860 H ALA 117 HN ALA 117 15.712 27.914 19.250 861 HA ALA 117 HA ALA 117 13.131 27.191 20.196 862 1HB ALA 117 HB2 ALA 117 15.138 25.683 18.496 863 2HB ALA 117 HB1 ALA 117 13.513 25.074 18.821 864 3HB ALA 117 HB3 ALA 117 13.729 26.591 17.946 865 H HIS 118 HN HIS 118 16.321 25.727 20.791 866 HA HIS 118 HA HIS 118 15.433 23.505 22.328 867 1HB HIS 118 HB2 HIS 118 17.752 23.811 21.475 868 2HB HIS 118 HB1 HIS 118 17.998 25.085 22.669 869 HD1 HIS 118 HD1 HIS 118 17.415 21.369 22.389 870 HD2 HIS 118 HD2 HIS 118 18.473 24.162 25.297 871 HE1 HIS 118 HE1 HIS 118 18.124 20.045 24.430 872 H GLU 119 HN GLU 119 16.496 26.743 23.447 873 HA GLU 119 HA GLU 119 16.036 26.268 26.221 874 1HB GLU 119 HB2 GLU 119 15.924 28.841 24.618 875 2HB GLU 119 HB1 GLU 119 15.901 28.772 26.380 876 1HG GLU 119 HG2 GLU 119 18.086 27.637 26.378 877 2HG GLU 119 HG1 GLU 119 18.110 27.677 24.614 878 H LEU 120 HN LEU 120 13.902 27.515 23.668 879 HA LEU 120 HA LEU 120 11.705 28.118 25.412 880 1HB LEU 120 HB2 LEU 120 11.794 27.489 22.448 881 2HB LEU 120 HB1 LEU 120 10.345 28.035 23.286 882 HG LEU 120 HG LEU 120 12.965 29.563 23.199 883 1HD1 LEU 120 HD12 LEU 120 11.702 29.352 21.001 884 2HD1 LEU 120 HD11 LEU 120 10.381 30.227 21.772 885 3HD1 LEU 120 HD13 LEU 120 11.953 31.000 21.571 886 1HD2 LEU 120 HD23 LEU 120 10.322 30.004 24.557 887 2HD2 LEU 120 HD22 LEU 120 11.949 30.398 25.109 888 3HD2 LEU 120 HD21 LEU 120 11.160 31.416 23.911 889 H GLY 121 HN GLY 121 12.640 25.184 23.656 890 1HA GLY 121 HA2 GLY 121 10.254 23.703 24.088 891 2HA GLY 121 HA1 GLY 121 11.852 22.981 23.889 892 H HIS 122 HN HIS 122 13.109 24.152 26.165 893 HA HIS 122 HA HIS 122 12.241 22.331 28.215 894 1HB HIS 122 HB2 HIS 122 14.144 24.688 28.257 895 2HB HIS 122 HB1 HIS 122 13.856 23.663 29.663 896 HD1 HIS 122 HD1 HIS 122 13.725 20.904 28.404 897 HD2 HIS 122 HD2 HIS 122 16.583 23.735 27.307 898 HE1 HIS 122 HE1 HIS 122 15.651 19.619 27.380 899 H SER 123 HN SER 123 11.756 25.810 27.692 900 HA SER 123 HA SER 123 10.464 26.373 30.170 901 1HB SER 123 HB2 SER 123 9.730 28.386 29.162 902 2HB SER 123 HB1 SER 123 11.228 28.010 28.318 903 HG SER 123 HG SER 123 9.198 26.747 27.127 904 H LEU 124 HN LEU 124 9.350 24.778 27.259 905 HA LEU 124 HA LEU 124 6.522 24.905 28.059 906 1HB LEU 124 HB2 LEU 124 7.914 23.356 25.851 907 2HB LEU 124 HB1 LEU 124 6.167 23.453 26.066 908 HG LEU 124 HG LEU 124 7.972 25.863 25.667 909 1HD1 LEU 124 HD11 LEU 124 7.916 24.333 23.689 910 2HD1 LEU 124 HD13 LEU 124 6.160 24.498 23.655 911 3HD1 LEU 124 HD12 LEU 124 7.183 25.904 23.365 912 1HD2 LEU 124 HD22 LEU 124 4.993 25.452 25.952 913 2HD2 LEU 124 HD21 LEU 124 6.019 26.688 26.676 914 3HD2 LEU 124 HD23 LEU 124 5.591 26.788 24.970 915 H GLY 125 HN GLY 125 9.123 23.213 29.168 916 1HA GLY 125 HA2 GLY 125 9.085 21.483 30.797 917 2HA GLY 125 HA1 GLY 125 7.386 21.198 30.423 918 H LEU 126 HN LEU 126 9.562 21.317 27.730 919 HA LEU 126 HA LEU 126 8.999 18.499 27.150 920 1HB LEU 126 HB2 LEU 126 10.737 20.523 25.705 921 2HB LEU 126 HB1 LEU 126 10.322 18.923 25.087 922 HG LEU 126 HG LEU 126 8.309 21.075 25.802 923 1HD1 LEU 126 HD13 LEU 126 9.852 21.431 23.740 924 2HD1 LEU 126 HD12 LEU 126 8.952 20.100 23.020 925 3HD1 LEU 126 HD11 LEU 126 8.112 21.573 23.502 926 1HD2 LEU 126 HD23 LEU 126 8.097 18.234 24.838 927 2HD2 LEU 126 HD22 LEU 126 7.089 19.101 25.995 928 3HD2 LEU 126 HD21 LEU 126 6.903 19.403 24.272 929 H SER 127 HN SER 127 10.597 16.844 26.986 930 HA SER 127 HA SER 127 13.008 17.323 28.698 931 1HB SER 127 HB2 SER 127 11.599 14.743 27.951 932 2HB SER 127 HB1 SER 127 13.015 14.866 28.994 933 HG SER 127 HG SER 127 10.480 15.100 29.671 934 H HIS 128 HN HIS 128 14.997 16.183 28.041 935 HA HIS 128 HA HIS 128 15.738 16.735 25.348 936 1HB HIS 128 HB2 HIS 128 17.024 14.996 27.467 937 2HB HIS 128 HB1 HIS 128 17.792 15.381 25.926 938 HD1 HIS 128 HD1 HIS 128 16.679 16.967 29.159 939 HD2 HIS 128 HD2 HIS 128 18.731 18.052 25.696 940 HE1 HIS 128 HE1 HIS 128 17.673 19.254 29.600 941 H SER 129 HN SER 129 16.732 14.942 23.879 942 HA SER 129 HA SER 129 15.269 12.364 24.009 943 1HB SER 129 HB2 SER 129 13.792 13.953 22.755 944 2HB SER 129 HB1 SER 129 15.091 14.182 21.588 945 HG SER 129 HG SER 129 13.310 12.412 21.379 946 H THR 130 HN THR 130 16.150 10.774 22.501 947 HA THR 130 HA THR 130 19.020 11.293 21.885 948 HB THR 130 HB THR 130 19.179 8.826 21.742 949 HG1 THR 130 HG1 THR 130 16.606 8.577 22.758 950 1HG2 THR 130 HG22 THR 130 17.763 9.856 24.215 951 2HG2 THR 130 HG21 THR 130 18.698 8.363 24.126 952 3HG2 THR 130 HG23 THR 130 19.499 9.919 23.913 953 H ASP 131 HN ASP 131 16.311 11.756 20.218 954 HA ASP 131 HA ASP 131 16.949 10.224 17.787 955 1HB ASP 131 HB2 ASP 131 14.601 10.709 18.391 956 2HB ASP 131 HB1 ASP 131 14.927 12.436 18.265 957 H ILE 132 HN ILE 132 18.361 10.928 16.266 958 HA ILE 132 HA ILE 132 19.858 13.322 16.536 959 HB ILE 132 HB ILE 132 19.369 11.608 14.079 960 1HG1 ILE 132 HG12 ILE 132 21.741 11.718 15.971 961 2HG1 ILE 132 HG11 ILE 132 20.442 10.533 16.103 962 1HG2 ILE 132 HG23 ILE 132 21.293 13.878 14.627 963 2HG2 ILE 132 HG22 ILE 132 21.585 12.685 13.363 964 3HG2 ILE 132 HG21 ILE 132 20.160 13.719 13.289 965 1HD1 ILE 132 HD12 ILE 132 22.123 10.931 13.613 966 2HD1 ILE 132 HD11 ILE 132 22.434 9.691 14.825 967 3HD1 ILE 132 HD13 ILE 132 20.938 9.656 13.893 968 H GLY 133 HN GLY 133 17.008 12.626 14.502 969 1HA GLY 133 HA2 GLY 133 17.040 15.214 13.222 970 2HA GLY 133 HA1 GLY 133 15.694 14.079 13.205 971 H ALA 134 HN ALA 134 16.581 14.654 16.414 972 HA ALA 134 HA ALA 134 14.268 16.512 16.723 973 1HB ALA 134 HB1 ALA 134 15.822 14.821 18.693 974 2HB ALA 134 HB3 ALA 134 14.625 16.014 19.193 975 3HB ALA 134 HB2 ALA 134 14.138 14.639 18.204 976 H LEU 135 HN LEU 135 14.547 18.613 17.309 977 HA LEU 135 HA LEU 135 17.190 19.787 17.275 978 1HB LEU 135 HB2 LEU 135 14.551 20.974 18.197 979 2HB LEU 135 HB1 LEU 135 16.018 21.883 17.828 980 HG LEU 135 HG LEU 135 14.490 20.154 15.858 981 1HD1 LEU 135 HD13 LEU 135 14.659 23.152 16.262 982 2HD1 LEU 135 HD12 LEU 135 14.017 22.404 14.799 983 3HD1 LEU 135 HD11 LEU 135 13.217 22.140 16.349 984 1HD2 LEU 135 HD23 LEU 135 17.061 21.728 15.712 985 2HD2 LEU 135 HD22 LEU 135 16.693 20.134 15.052 986 3HD2 LEU 135 HD21 LEU 135 16.056 21.576 14.269 987 H MET 136 HN MET 136 15.044 18.637 19.774 988 HA MET 136 HA MET 136 16.350 19.996 21.965 989 1HB MET 136 HB2 MET 136 14.692 17.457 21.985 990 2HB MET 136 HB1 MET 136 15.073 18.453 23.387 991 1HG MET 136 HG2 MET 136 13.481 19.353 20.966 992 2HG MET 136 HG1 MET 136 12.809 18.955 22.545 993 1HE MET 136 HE2 MET 136 13.481 19.863 24.611 994 2HE MET 136 HE1 MET 136 15.141 20.450 24.597 995 3HE MET 136 HE3 MET 136 13.808 21.566 24.919 996 H TYR 137 HN TYR 137 17.832 18.030 19.942 997 HA TYR 137 HA TYR 137 18.859 15.898 21.508 998 1HB TYR 137 HB2 TYR 137 19.122 16.380 18.961 999 2HB TYR 137 HB1 TYR 137 20.523 17.338 19.435 1000 HD1 TYR 137 HD2 TYR 137 19.035 13.940 19.485 1001 HD2 TYR 137 HD1 TYR 137 22.565 16.282 20.158 1002 HE1 TYR 137 HE2 TYR 137 20.381 11.864 19.638 1003 HE2 TYR 137 HE1 TYR 137 23.913 14.208 20.312 1004 HH TYR 137 HH TYR 137 23.653 11.778 19.382 1005 HA PRO 138 HA PRO 138 21.211 18.236 24.509 1006 1HB PRO 138 HB2 PRO 138 23.324 16.261 24.733 1007 2HB PRO 138 HB1 PRO 138 21.986 16.557 25.853 1008 1HG PRO 138 HG2 PRO 138 22.297 14.352 23.975 1009 2HG PRO 138 HG1 PRO 138 21.029 14.588 25.187 1010 1HD PRO 138 HD2 PRO 138 20.741 14.828 22.357 1011 2HD PRO 138 HD1 PRO 138 19.538 15.260 23.587 1012 H SER 139 HN SER 139 23.328 16.493 22.184 1013 HA SER 139 HA SER 139 25.255 18.700 22.231 1014 1HB SER 139 HB2 SER 139 25.140 16.204 20.520 1015 2HB SER 139 HB1 SER 139 26.504 17.316 20.613 1016 HG SER 139 HG SER 139 25.853 15.297 22.245 1017 H TYR 140 HN TYR 140 25.753 20.074 20.510 1018 HA TYR 140 HA TYR 140 23.560 20.941 18.865 1019 1HB TYR 140 HB2 TYR 140 25.464 22.388 19.665 1020 2HB TYR 140 HB1 TYR 140 26.509 21.556 18.513 1021 HD1 TYR 140 HD2 TYR 140 23.685 23.881 18.909 1022 HD2 TYR 140 HD1 TYR 140 26.255 21.885 16.105 1023 HE1 TYR 140 HE2 TYR 140 22.899 25.403 17.108 1024 HE2 TYR 140 HE1 TYR 140 25.474 23.404 14.306 1025 HH TYR 140 HH TYR 140 23.110 24.853 14.023 1026 H THR 141 HN THR 141 23.318 20.720 16.566 1027 HA THR 141 HA THR 141 25.157 18.841 15.172 1028 HB THR 141 HB THR 141 23.285 17.457 14.381 1029 HG1 THR 141 HG1 THR 141 21.246 17.793 15.467 1030 1HG2 THR 141 HG22 THR 141 24.510 17.009 16.595 1031 2HG2 THR 141 HG21 THR 141 23.066 17.640 17.385 1032 3HG2 THR 141 HG23 THR 141 22.957 16.206 16.365 1033 H PHE 142 HN PHE 142 25.030 19.003 12.896 1034 HA PHE 142 HA PHE 142 24.171 21.624 11.940 1035 1HB PHE 142 HB2 PHE 142 26.260 20.397 11.184 1036 2HB PHE 142 HB1 PHE 142 25.201 19.285 10.316 1037 HD1 PHE 142 HD1 PHE 142 23.864 20.044 8.399 1038 HD2 PHE 142 HD2 PHE 142 26.537 22.694 10.464 1039 HE1 PHE 142 HE1 PHE 142 23.720 21.655 6.519 1040 HE2 PHE 142 HE2 PHE 142 26.395 24.305 8.588 1041 HZ PHE 142 HZ PHE 142 24.985 23.789 6.615 1042 H SER 143 HN SER 143 22.124 22.007 11.250 1043 HA SER 143 HA SER 143 20.599 19.780 9.933 1044 1HB SER 143 HB2 SER 143 19.674 20.093 12.167 1045 2HB SER 143 HB1 SER 143 19.569 21.831 11.919 1046 HG SER 143 HG SER 143 18.213 21.202 10.029 1047 H GLY 144 HN GLY 144 19.833 20.353 7.953 1048 1HA GLY 144 HA2 GLY 144 20.553 22.719 6.637 1049 2HA GLY 144 HA1 GLY 144 19.200 21.705 6.137 1050 H ASP 145 HN ASP 145 17.087 22.296 6.767 1051 HA ASP 145 HA ASP 145 16.782 25.135 7.522 1052 1HB ASP 145 HB2 ASP 145 15.422 23.945 5.704 1053 2HB ASP 145 HB1 ASP 145 14.574 23.127 7.015 1054 H VAL 146 HN VAL 146 15.362 25.764 9.310 1055 HA VAL 146 HA VAL 146 15.597 23.880 11.607 1056 HB VAL 146 HB VAL 146 14.872 26.821 11.492 1057 1HG1 VAL 146 HG12 VAL 146 15.274 24.872 13.774 1058 2HG1 VAL 146 HG11 VAL 146 15.344 26.619 13.994 1059 3HG1 VAL 146 HG13 VAL 146 13.852 25.861 13.437 1060 1HG2 VAL 146 HG23 VAL 146 17.249 26.165 10.890 1061 2HG2 VAL 146 HG22 VAL 146 17.107 27.224 12.291 1062 3HG2 VAL 146 HG21 VAL 146 17.401 25.502 12.517 1063 H GLN 147 HN GLN 147 13.842 22.562 11.751 1064 HA GLN 147 HA GLN 147 11.144 23.833 11.795 1065 1HB GLN 147 HB2 GLN 147 11.911 21.356 10.219 1066 2HB GLN 147 HB1 GLN 147 10.248 21.821 10.570 1067 1HG GLN 147 HG2 GLN 147 10.615 23.986 9.426 1068 2HG GLN 147 HG1 GLN 147 12.268 23.492 9.049 1069 1HE2 GLN 147 HE22 GLN 147 11.013 22.162 6.025 1070 2HE2 GLN 147 HE21 GLN 147 12.071 23.267 6.760 1071 H LEU 148 HN LEU 148 9.584 22.469 12.983 1072 HA LEU 148 HA LEU 148 10.839 21.242 15.301 1073 1HB LEU 148 HB2 LEU 148 7.926 21.353 14.458 1074 2HB LEU 148 HB1 LEU 148 8.512 20.862 16.049 1075 HG LEU 148 HG LEU 148 9.064 23.566 14.785 1076 1HD1 LEU 148 HD12 LEU 148 6.644 23.160 15.337 1077 2HD1 LEU 148 HD11 LEU 148 7.122 22.902 17.016 1078 3HD1 LEU 148 HD13 LEU 148 7.377 24.474 16.258 1079 1HD2 LEU 148 HD23 LEU 148 9.831 22.237 17.372 1080 2HD2 LEU 148 HD22 LEU 148 10.761 23.332 16.352 1081 3HD2 LEU 148 HD21 LEU 148 9.498 23.970 17.397 1082 H ALA 149 HN ALA 149 10.509 19.008 15.976 1083 HA ALA 149 HA ALA 149 10.460 17.139 13.655 1084 1HB ALA 149 HB3 ALA 149 11.339 16.819 16.541 1085 2HB ALA 149 HB2 ALA 149 11.304 15.492 15.379 1086 3HB ALA 149 HB1 ALA 149 12.373 16.871 15.111 1087 H GLN 150 HN GLN 150 9.050 15.291 13.679 1088 HA GLN 150 HA GLN 150 6.420 15.750 14.599 1089 1HB GLN 150 HB2 GLN 150 6.965 14.119 12.820 1090 2HB GLN 150 HB1 GLN 150 7.750 13.084 14.010 1091 1HG GLN 150 HG2 GLN 150 5.621 12.821 15.215 1092 2HG GLN 150 HG1 GLN 150 4.828 13.894 14.061 1093 1HE2 GLN 150 HE22 GLN 150 4.038 11.111 12.061 1094 2HE2 GLN 150 HE21 GLN 150 3.512 12.542 12.806 1095 H ASP 151 HN ASP 151 9.103 13.971 16.104 1096 HA ASP 151 HA ASP 151 7.715 12.842 18.292 1097 1HB ASP 151 HB2 ASP 151 10.104 12.397 17.810 1098 2HB ASP 151 HB1 ASP 151 10.504 14.051 18.270 1099 H ASP 152 HN ASP 152 8.940 16.144 17.790 1100 HA ASP 152 HA ASP 152 8.157 17.027 20.456 1101 1HB ASP 152 HB2 ASP 152 8.980 18.497 17.940 1102 2HB ASP 152 HB1 ASP 152 8.529 19.335 19.423 1103 H ILE 153 HN ILE 153 6.752 17.234 17.182 1104 HA ILE 153 HA ILE 153 4.533 18.896 17.854 1105 HB ILE 153 HB ILE 153 4.668 16.651 15.815 1106 1HG1 ILE 153 HG12 ILE 153 6.424 18.237 15.335 1107 2HG1 ILE 153 HG11 ILE 153 5.119 18.537 14.200 1108 1HG2 ILE 153 HG22 ILE 153 2.741 18.934 16.233 1109 2HG2 ILE 153 HG21 ILE 153 2.912 18.137 14.671 1110 3HG2 ILE 153 HG23 ILE 153 2.387 17.216 16.079 1111 1HD1 ILE 153 HD12 ILE 153 4.318 20.281 15.977 1112 2HD1 ILE 153 HD11 ILE 153 5.977 20.170 16.572 1113 3HD1 ILE 153 HD13 ILE 153 5.669 20.690 14.919 1114 H ASP 154 HN ASP 154 4.716 15.329 17.692 1115 HA ASP 154 HA ASP 154 2.068 14.852 18.619 1116 1HB ASP 154 HB2 ASP 154 4.593 13.196 18.804 1117 2HB ASP 154 HB1 ASP 154 3.005 12.594 19.280 1118 H GLY 155 HN GLY 155 5.121 15.218 20.392 1119 1HA GLY 155 HA2 GLY 155 4.009 14.568 22.969 1120 2HA GLY 155 HA1 GLY 155 5.546 15.385 22.693 1121 H ILE 156 HN ILE 156 4.764 17.746 21.450 1122 HA ILE 156 HA ILE 156 3.737 19.195 23.716 1123 HB ILE 156 HB ILE 156 5.321 20.139 21.974 1124 1HG1 ILE 156 HG12 ILE 156 4.156 22.401 21.943 1125 2HG1 ILE 156 HG11 ILE 156 2.758 21.610 22.663 1126 1HG2 ILE 156 HG22 ILE 156 3.870 19.249 20.062 1127 2HG2 ILE 156 HG21 ILE 156 2.808 20.621 20.369 1128 3HG2 ILE 156 HG23 ILE 156 4.482 20.894 19.886 1129 1HD1 ILE 156 HD12 ILE 156 5.440 21.273 23.982 1130 2HD1 ILE 156 HD11 ILE 156 4.558 22.782 24.200 1131 3HD1 ILE 156 HD13 ILE 156 3.828 21.263 24.702 1132 H GLN 157 HN GLN 157 2.272 18.139 20.641 1133 HA GLN 157 HA GLN 157 -0.227 19.511 21.046 1134 1HB GLN 157 HB2 GLN 157 0.498 17.024 19.474 1135 2HB GLN 157 HB1 GLN 157 -1.140 17.682 19.503 1136 1HG GLN 157 HG2 GLN 157 -0.332 19.808 18.600 1137 2HG GLN 157 HG1 GLN 157 1.331 19.214 18.635 1138 1HE2 GLN 157 HE22 GLN 157 -0.319 18.636 15.229 1139 2HE2 GLN 157 HE21 GLN 157 -0.276 20.010 16.224 1140 H ALA 158 HN ALA 158 0.947 16.291 21.984 1141 HA ALA 158 HA ALA 158 -1.516 15.317 23.038 1142 1HB ALA 158 HB2 ALA 158 0.582 13.957 22.637 1143 2HB ALA 158 HB1 ALA 158 1.241 14.666 24.109 1144 3HB ALA 158 HB3 ALA 158 -0.204 13.660 24.185 1145 H ILE 159 HN ILE 159 1.075 17.242 24.526 1146 HA ILE 159 HA ILE 159 -0.024 17.193 27.175 1147 HB ILE 159 HB ILE 159 1.800 19.171 25.782 1148 1HG1 ILE 159 HG12 ILE 159 2.378 17.068 27.889 1149 2HG1 ILE 159 HG11 ILE 159 2.570 16.793 26.158 1150 1HG2 ILE 159 HG22 ILE 159 0.812 19.037 28.636 1151 2HG2 ILE 159 HG21 ILE 159 2.349 19.800 28.228 1152 3HG2 ILE 159 HG23 ILE 159 0.847 20.427 27.552 1153 1HD1 ILE 159 HD11 ILE 159 3.931 19.056 27.639 1154 2HD1 ILE 159 HD13 ILE 159 4.688 17.488 27.362 1155 3HD1 ILE 159 HD12 ILE 159 4.252 18.510 25.992 1156 H TYR 160 HN TYR 160 -0.250 19.671 24.597 1157 HA TYR 160 HA TYR 160 -2.433 21.000 26.123 1158 1HB TYR 160 HB2 TYR 160 -0.770 21.787 23.724 1159 2HB TYR 160 HB1 TYR 160 -2.217 22.687 24.184 1160 HD1 TYR 160 HD2 TYR 160 -2.340 23.880 26.317 1161 HD2 TYR 160 HD1 TYR 160 1.229 21.811 25.121 1162 HE1 TYR 160 HE2 TYR 160 -1.067 25.059 28.090 1163 HE2 TYR 160 HE1 TYR 160 2.505 22.986 26.897 1164 HH TYR 160 HH TYR 160 2.394 24.914 28.265 1165 H GLY 161 HN GLY 161 -1.970 20.302 22.645 1166 1HA GLY 161 HA2 GLY 161 -3.963 18.511 22.116 1167 2HA GLY 161 HA1 GLY 161 -4.873 20.006 22.333 1168 H ARG 162 HN ARG 162 -5.386 19.520 19.986 1169 HA ARG 162 HA ARG 162 -3.226 20.065 18.060 1170 1HB ARG 162 HB2 ARG 162 -6.193 19.529 17.763 1171 2HB ARG 162 HB1 ARG 162 -5.129 19.858 16.395 1172 1HG ARG 162 HG2 ARG 162 -3.715 17.931 17.042 1173 2HG ARG 162 HG1 ARG 162 -4.801 17.598 18.390 1174 1HD ARG 162 HD2 ARG 162 -5.625 17.619 15.474 1175 2HD ARG 162 HD1 ARG 162 -5.296 16.168 16.418 1176 HE ARG 162 HE ARG 162 -7.222 17.460 17.911 1177 1HH1 ARG 162 HH21 ARG 162 -6.867 16.576 14.597 1178 2HH1 ARG 162 HH22 ARG 162 -8.555 16.270 14.359 1179 1HH2 ARG 162 HH11 ARG 162 -9.431 17.059 17.618 1180 2HH2 ARG 162 HH12 ARG 162 -10.005 16.543 16.068 1181 H SER 163 HN SER 163 -3.351 21.908 16.557 1182 HA SER 163 HA SER 163 -4.146 24.364 17.902 1183 1HB SER 163 HB2 SER 163 -3.133 23.868 15.089 1184 2HB SER 163 HB1 SER 163 -3.371 25.462 15.797 1185 HG SER 163 HG SER 163 -1.998 24.236 17.569 1186 H GLN 164 HN GLN 164 -6.486 23.213 17.879 1187 HA GLN 164 HA GLN 164 -7.999 23.503 15.423 1188 1HB GLN 164 HB2 GLN 164 -8.824 23.153 18.316 1189 2HB GLN 164 HB1 GLN 164 -9.974 23.204 16.979 1190 1HG GLN 164 HG2 GLN 164 -8.885 21.277 15.931 1191 2HG GLN 164 HG1 GLN 164 -7.671 21.248 17.210 1192 1HE2 GLN 164 HE22 GLN 164 -10.440 18.827 18.049 1193 2HE2 GLN 164 HE21 GLN 164 -9.422 19.009 16.704 1194 H ASN 165 HN ASN 165 -8.970 25.323 14.644 1195 HA ASN 165 HA ASN 165 -9.811 27.494 16.429 1196 1HB ASN 165 HB2 ASN 165 -7.628 27.960 14.375 1197 2HB ASN 165 HB1 ASN 165 -8.432 29.217 15.314 1198 1HD2 ASN 165 HD22 ASN 165 -5.309 27.312 16.925 1199 2HD2 ASN 165 HD21 ASN 165 -5.710 27.227 15.277 1200 HA PRO 166 HA PRO 166 -12.105 26.871 12.413 1201 1HB PRO 166 HB2 PRO 166 -14.608 26.680 13.795 1202 2HB PRO 166 HB1 PRO 166 -13.712 25.356 13.041 1203 1HG PRO 166 HG2 PRO 166 -14.063 25.887 15.885 1204 2HG PRO 166 HG1 PRO 166 -13.265 24.503 15.123 1205 1HD PRO 166 HD2 PRO 166 -12.020 26.757 16.467 1206 2HD PRO 166 HD1 PRO 166 -11.222 25.348 15.743 1207 H VAL 167 HN VAL 167 -11.201 29.286 13.710 1208 HA VAL 167 HA VAL 167 -13.523 31.057 13.970 1209 HB VAL 167 HB VAL 167 -11.840 32.787 14.397 1210 1HG1 VAL 167 HG11 VAL 167 -12.498 31.216 16.210 1211 2HG1 VAL 167 HG13 VAL 167 -11.152 30.170 15.760 1212 3HG1 VAL 167 HG12 VAL 167 -10.839 31.785 16.396 1213 1HG2 VAL 167 HG22 VAL 167 -9.951 30.606 13.490 1214 2HG2 VAL 167 HG21 VAL 167 -10.108 32.239 12.843 1215 3HG2 VAL 167 HG23 VAL 167 -9.408 31.988 14.443 1216 H GLN 168 HN GLN 168 -14.222 32.525 12.451 1217 HA GLN 168 HA GLN 168 -13.343 32.107 9.695 1218 1HB GLN 168 HB2 GLN 168 -15.324 34.140 10.765 1219 2HB GLN 168 HB1 GLN 168 -15.206 33.546 9.107 1220 1HG GLN 168 HG2 GLN 168 -15.655 31.219 10.031 1221 2HG GLN 168 HG1 GLN 168 -16.048 31.995 11.566 1222 1HE2 GLN 168 HE22 GLN 168 -18.852 31.845 8.723 1223 2HE2 GLN 168 HE21 GLN 168 -17.434 30.914 8.694 1224 HA PRO 169 HA PRO 169 -10.376 35.422 9.631 1225 1HB PRO 169 HB2 PRO 169 -11.130 36.472 7.048 1226 2HB PRO 169 HB1 PRO 169 -9.777 35.396 7.422 1227 1HG PRO 169 HG2 PRO 169 -12.309 34.727 6.116 1228 2HG PRO 169 HG1 PRO 169 -10.873 33.713 6.313 1229 1HD PRO 169 HD2 PRO 169 -13.346 33.413 7.700 1230 2HD PRO 169 HD1 PRO 169 -11.818 32.582 8.066 No H/Q in entry = 1230 Start of MODEL 24 1 1H VAL 1 HT2 VAL 1 -5.220 13.947 16.577 2 2H VAL 1 HT1 VAL 1 -6.464 13.423 17.609 3 3H VAL 1 HT3 VAL 1 -6.792 13.719 15.972 4 HA VAL 1 HA VAL 1 -7.634 15.550 17.211 5 HB VAL 1 HB VAL 1 -6.096 16.879 18.641 6 1HG1 VAL 1 HG12 VAL 1 -7.519 14.991 19.547 7 2HG1 VAL 1 HG11 VAL 1 -6.092 13.958 19.448 8 3HG1 VAL 1 HG13 VAL 1 -6.092 15.362 20.515 9 1HG2 VAL 1 HG21 VAL 1 -4.186 14.626 17.957 10 2HG2 VAL 1 HG23 VAL 1 -3.969 16.344 17.621 11 3HG2 VAL 1 HG22 VAL 1 -3.923 15.758 19.284 12 H LEU 2 HN LEU 2 -4.888 14.920 15.260 13 HA LEU 2 HA LEU 2 -4.181 17.549 14.416 14 1HB LEU 2 HB2 LEU 2 -4.172 14.941 12.863 15 2HB LEU 2 HB1 LEU 2 -3.376 16.418 12.330 16 HG LEU 2 HG LEU 2 -2.768 15.048 14.969 17 1HD1 LEU 2 HD12 LEU 2 -2.206 13.576 13.063 18 2HD1 LEU 2 HD11 LEU 2 -1.277 14.884 12.329 19 3HD1 LEU 2 HD13 LEU 2 -0.749 14.177 13.855 20 1HD2 LEU 2 HD21 LEU 2 -1.568 17.355 13.424 21 2HD2 LEU 2 HD23 LEU 2 -2.012 17.285 15.128 22 3HD2 LEU 2 HD22 LEU 2 -0.584 16.431 14.556 23 H THR 3 HN THR 3 -6.696 15.318 13.318 24 HA THR 3 HA THR 3 -8.005 17.590 11.862 25 HB THR 3 HB THR 3 -8.480 16.221 9.999 26 HG1 THR 3 HG1 THR 3 -9.183 14.367 10.894 27 1HG2 THR 3 HG22 THR 3 -6.030 16.837 10.314 28 2HG2 THR 3 HG21 THR 3 -5.780 15.185 10.879 29 3HG2 THR 3 HG23 THR 3 -6.340 15.478 9.232 30 H GLU 4 HN GLU 4 -10.204 15.877 11.056 31 HA GLU 4 HA GLU 4 -11.864 16.113 13.386 32 1HB GLU 4 HB2 GLU 4 -12.661 16.177 10.994 33 2HB GLU 4 HB1 GLU 4 -12.368 14.442 10.901 34 1HG GLU 4 HG2 GLU 4 -14.720 14.818 11.396 35 2HG GLU 4 HG1 GLU 4 -13.949 14.123 12.818 36 H GLY 5 HN GLY 5 -12.851 14.341 14.595 37 1HA GLY 5 HA2 GLY 5 -11.005 12.373 15.491 38 2HA GLY 5 HA1 GLY 5 -12.732 12.356 15.834 39 H ASN 6 HN ASN 6 -11.711 12.302 12.495 40 HA ASN 6 HA ASN 6 -11.817 9.371 12.316 41 1HB ASN 6 HB2 ASN 6 -13.884 11.111 10.937 42 2HB ASN 6 HB1 ASN 6 -13.703 9.366 10.741 43 1HD2 ASN 6 HD22 ASN 6 -15.639 10.832 13.995 44 2HD2 ASN 6 HD21 ASN 6 -14.975 11.870 12.828 45 HA PRO 7 HA PRO 7 -9.158 11.817 9.313 46 1HB PRO 7 HB2 PRO 7 -7.059 9.866 9.847 47 2HB PRO 7 HB1 PRO 7 -7.049 11.604 10.179 48 1HG PRO 7 HG2 PRO 7 -7.277 9.483 12.103 49 2HG PRO 7 HG1 PRO 7 -7.379 11.222 12.414 50 1HD PRO 7 HD2 PRO 7 -9.536 9.270 12.436 51 2HD PRO 7 HD1 PRO 7 -9.619 10.997 12.841 52 H ARG 8 HN ARG 8 -10.514 10.994 7.642 53 HA ARG 8 HA ARG 8 -9.530 8.474 6.394 54 1HB ARG 8 HB2 ARG 8 -12.462 9.112 6.879 55 2HB ARG 8 HB1 ARG 8 -11.847 7.724 5.979 56 1HG ARG 8 HG2 ARG 8 -10.637 6.975 8.008 57 2HG ARG 8 HG1 ARG 8 -11.329 8.320 8.907 58 1HD ARG 8 HD2 ARG 8 -13.615 7.421 8.174 59 2HD ARG 8 HD1 ARG 8 -12.770 5.948 7.709 60 HE ARG 8 HE ARG 8 -13.545 6.689 10.367 61 1HH1 ARG 8 HH21 ARG 8 -10.840 5.383 8.654 62 2HH1 ARG 8 HH22 ARG 8 -10.057 4.811 10.087 63 1HH2 ARG 8 HH11 ARG 8 -12.540 5.933 12.220 64 2HH2 ARG 8 HH12 ARG 8 -11.021 5.111 12.097 65 H TRP 9 HN TRP 9 -9.812 8.476 4.099 66 HA TRP 9 HA TRP 9 -9.766 11.092 2.902 67 1HB TRP 9 HB2 TRP 9 -10.048 8.331 1.675 68 2HB TRP 9 HB1 TRP 9 -9.800 9.809 0.743 69 HD1 TRP 9 HD1 TRP 9 -8.032 7.401 3.089 70 HE1 TRP 9 HE1 TRP 9 -5.508 7.933 3.101 71 HE3 TRP 9 HE3 TRP 9 -8.032 11.742 0.399 72 HZ2 TRP 9 HZ2 TRP 9 -3.724 9.936 2.102 73 HZ3 TRP 9 HZ3 TRP 9 -5.910 12.939 -0.056 74 HH2 TRP 9 HH2 TRP 9 -3.759 12.042 0.790 75 H GLU 10 HN GLU 10 -11.478 12.338 2.369 76 HA GLU 10 HA GLU 10 -14.197 11.328 2.654 77 1HB GLU 10 HB2 GLU 10 -13.067 13.989 1.750 78 2HB GLU 10 HB1 GLU 10 -14.797 13.668 1.872 79 1HG GLU 10 HG2 GLU 10 -14.565 13.158 4.254 80 2HG GLU 10 HG1 GLU 10 -12.818 13.383 4.154 81 H GLN 11 HN GLN 11 -11.942 11.566 0.066 82 HA GLN 11 HA GLN 11 -14.017 11.568 -2.035 83 1HB GLN 11 HB2 GLN 11 -10.998 11.340 -2.122 84 2HB GLN 11 HB1 GLN 11 -12.027 11.331 -3.553 85 1HG GLN 11 HG2 GLN 11 -12.879 13.550 -3.005 86 2HG GLN 11 HG1 GLN 11 -11.959 13.558 -1.499 87 1HE2 GLN 11 HE22 GLN 11 -10.004 15.324 -4.209 88 2HE2 GLN 11 HE21 GLN 11 -11.575 15.525 -3.601 89 H THR 12 HN THR 12 -14.480 9.765 -3.360 90 HA THR 12 HA THR 12 -13.753 7.126 -2.192 91 HB THR 12 HB THR 12 -15.553 6.230 -3.480 92 HG1 THR 12 HG1 THR 12 -16.435 7.314 -5.198 93 1HG2 THR 12 HG22 THR 12 -16.224 7.721 -1.583 94 2HG2 THR 12 HG21 THR 12 -16.406 9.039 -2.740 95 3HG2 THR 12 HG23 THR 12 -17.442 7.617 -2.855 96 H HIS 13 HN HIS 13 -12.613 9.277 -4.437 97 HA HIS 13 HA HIS 13 -11.313 7.135 -6.091 98 1HB HIS 13 HB2 HIS 13 -11.992 9.994 -6.861 99 2HB HIS 13 HB1 HIS 13 -11.202 8.807 -7.898 100 HD1 HIS 13 HD1 HIS 13 -12.659 6.743 -8.671 101 HD2 HIS 13 HD2 HIS 13 -14.784 9.690 -6.631 102 HE1 HIS 13 HE1 HIS 13 -15.114 6.264 -9.073 103 H LEU 14 HN LEU 14 -9.101 7.130 -5.995 104 HA LEU 14 HA LEU 14 -7.700 9.555 -4.918 105 1HB LEU 14 HB2 LEU 14 -7.148 6.665 -4.183 106 2HB LEU 14 HB1 LEU 14 -6.223 8.058 -3.629 107 HG LEU 14 HG LEU 14 -9.193 7.699 -3.128 108 1HD1 LEU 14 HD11 LEU 14 -6.813 7.103 -1.345 109 2HD1 LEU 14 HD13 LEU 14 -8.492 7.118 -0.804 110 3HD1 LEU 14 HD12 LEU 14 -7.958 5.928 -1.990 111 1HD2 LEU 14 HD21 LEU 14 -7.102 9.703 -2.260 112 2HD2 LEU 14 HD23 LEU 14 -8.721 9.998 -2.892 113 3HD2 LEU 14 HD22 LEU 14 -8.515 9.401 -1.249 114 H THR 15 HN THR 15 -5.416 9.634 -5.528 115 HA THR 15 HA THR 15 -4.756 8.023 -7.973 116 HB THR 15 HB THR 15 -3.846 9.987 -9.029 117 HG1 THR 15 HG1 THR 15 -4.223 12.031 -7.773 118 1HG2 THR 15 HG22 THR 15 -6.363 9.633 -9.054 119 2HG2 THR 15 HG21 THR 15 -6.462 10.860 -7.791 120 3HG2 THR 15 HG23 THR 15 -5.829 11.283 -9.381 121 H TYR 16 HN TYR 16 -2.463 7.713 -8.302 122 HA TYR 16 HA TYR 16 -0.693 8.490 -6.037 123 1HB TYR 16 HB2 TYR 16 0.105 6.224 -5.701 124 2HB TYR 16 HB1 TYR 16 -1.647 6.233 -5.507 125 HD1 TYR 16 HD1 TYR 16 1.157 5.208 -7.661 126 HD2 TYR 16 HD2 TYR 16 -3.111 5.215 -7.177 127 HE1 TYR 16 HE1 TYR 16 0.953 3.496 -9.442 128 HE2 TYR 16 HE2 TYR 16 -3.316 3.504 -8.962 129 HH TYR 16 HH TYR 16 -0.633 1.769 -10.157 130 H ARG 17 HN ARG 17 1.595 8.273 -6.596 131 HA ARG 17 HA ARG 17 2.161 7.850 -9.497 132 1HB ARG 17 HB2 ARG 17 1.709 10.261 -9.223 133 2HB ARG 17 HB1 ARG 17 2.909 10.340 -7.933 134 1HG ARG 17 HG2 ARG 17 4.694 9.769 -9.456 135 2HG ARG 17 HG1 ARG 17 3.548 9.426 -10.750 136 1HD ARG 17 HD2 ARG 17 4.471 11.625 -11.146 137 2HD ARG 17 HD1 ARG 17 2.802 11.832 -10.616 138 HE ARG 17 HE ARG 17 4.255 11.995 -8.270 139 1HH1 ARG 17 HH21 ARG 17 4.338 13.497 -11.375 140 2HH1 ARG 17 HH22 ARG 17 4.970 14.997 -10.780 141 1HH2 ARG 17 HH11 ARG 17 5.082 13.945 -7.479 142 2HH2 ARG 17 HH12 ARG 17 5.393 15.249 -8.576 143 H ILE 18 HN ILE 18 4.076 6.815 -9.805 144 HA ILE 18 HA ILE 18 5.773 6.267 -7.440 145 HB ILE 18 HB ILE 18 5.966 5.274 -10.309 146 1HG1 ILE 18 HG12 ILE 18 5.044 3.813 -7.814 147 2HG1 ILE 18 HG11 ILE 18 3.940 4.548 -8.975 148 1HG2 ILE 18 HG23 ILE 18 7.442 4.484 -7.780 149 2HG2 ILE 18 HG22 ILE 18 7.503 3.577 -9.292 150 3HG2 ILE 18 HG21 ILE 18 8.142 5.219 -9.222 151 1HD1 ILE 18 HD11 ILE 18 6.036 2.516 -9.776 152 2HD1 ILE 18 HD13 ILE 18 4.393 2.065 -9.323 153 3HD1 ILE 18 HD12 ILE 18 4.670 3.089 -10.732 154 H GLU 19 HN GLU 19 7.393 7.696 -7.009 155 HA GLU 19 HA GLU 19 8.113 9.792 -8.826 156 1HB GLU 19 HB2 GLU 19 8.358 9.835 -6.297 157 2HB GLU 19 HB1 GLU 19 9.795 8.830 -6.502 158 1HG GLU 19 HG2 GLU 19 10.780 10.543 -7.986 159 2HG GLU 19 HG1 GLU 19 9.346 11.548 -7.773 160 H ASN 20 HN ASN 20 9.688 6.693 -8.033 161 HA ASN 20 HA ASN 20 11.086 6.774 -10.608 162 1HB ASN 20 HB2 ASN 20 13.350 6.637 -9.620 163 2HB ASN 20 HB1 ASN 20 12.567 8.168 -9.222 164 1HD2 ASN 20 HD22 ASN 20 13.374 7.497 -5.843 165 2HD2 ASN 20 HD21 ASN 20 13.577 8.534 -7.171 166 H TYR 21 HN TYR 21 12.360 4.765 -10.955 167 HA TYR 21 HA TYR 21 11.218 2.464 -9.401 168 1HB TYR 21 HB2 TYR 21 12.226 2.652 -12.256 169 2HB TYR 21 HB1 TYR 21 11.770 1.142 -11.468 170 HD1 TYR 21 HD1 TYR 21 9.439 0.684 -10.863 171 HD2 TYR 21 HD2 TYR 21 10.557 4.306 -12.878 172 HE1 TYR 21 HE1 TYR 21 7.062 1.111 -11.412 173 HE2 TYR 21 HE2 TYR 21 8.180 4.736 -13.431 174 HH TYR 21 HH TYR 21 5.617 2.484 -12.390 175 H THR 22 HN THR 22 12.655 1.120 -8.372 176 HA THR 22 HA THR 22 15.449 1.890 -8.295 177 HB THR 22 HB THR 22 14.591 1.061 -6.248 178 HG1 THR 22 HG1 THR 22 15.778 -1.297 -7.165 179 1HG2 THR 22 HG21 THR 22 13.522 -1.237 -7.901 180 2HG2 THR 22 HG23 THR 22 13.546 -1.245 -6.139 181 3HG2 THR 22 HG22 THR 22 12.594 -0.038 -7.002 182 HA PRO 23 HA PRO 23 16.648 -0.684 -11.750 183 1HB PRO 23 HB2 PRO 23 19.295 -1.258 -10.808 184 2HB PRO 23 HB1 PRO 23 18.822 0.021 -11.936 185 1HG PRO 23 HG2 PRO 23 19.597 0.271 -9.112 186 2HG PRO 23 HG1 PRO 23 19.400 1.548 -10.322 187 1HD PRO 23 HD2 PRO 23 17.628 0.991 -8.159 188 2HD PRO 23 HD1 PRO 23 17.322 2.082 -9.530 189 H ASP 24 HN ASP 24 16.123 -1.688 -8.645 190 HA ASP 24 HA ASP 24 17.256 -4.313 -8.573 191 1HB ASP 24 HB2 ASP 24 14.795 -3.139 -7.252 192 2HB ASP 24 HB1 ASP 24 15.393 -4.762 -6.911 193 H LEU 25 HN LEU 25 14.161 -3.089 -9.824 194 HA LEU 25 HA LEU 25 13.858 -5.615 -11.374 195 1HB LEU 25 HB2 LEU 25 11.718 -4.302 -9.669 196 2HB LEU 25 HB1 LEU 25 11.397 -5.588 -10.821 197 HG LEU 25 HG LEU 25 13.345 -5.852 -8.512 198 1HD1 LEU 25 HD13 LEU 25 11.015 -5.455 -7.737 199 2HD1 LEU 25 HD12 LEU 25 10.483 -6.830 -8.705 200 3HD1 LEU 25 HD11 LEU 25 11.583 -7.078 -7.349 201 1HD2 LEU 25 HD21 LEU 25 12.218 -7.738 -10.590 202 2HD2 LEU 25 HD23 LEU 25 13.894 -7.524 -10.084 203 3HD2 LEU 25 HD22 LEU 25 12.755 -8.355 -9.029 204 HA PRO 26 HA PRO 26 12.935 -2.718 -14.621 205 1HB PRO 26 HB2 PRO 26 10.881 -4.254 -15.913 206 2HB PRO 26 HB1 PRO 26 12.598 -4.203 -16.338 207 1HG PRO 26 HG2 PRO 26 11.119 -6.339 -14.964 208 2HG PRO 26 HG1 PRO 26 12.746 -6.391 -15.657 209 1HD PRO 26 HD2 PRO 26 12.117 -6.324 -12.888 210 2HD PRO 26 HD1 PRO 26 13.720 -6.063 -13.607 211 H ARG 27 HN ARG 27 11.246 -1.156 -15.125 212 HA ARG 27 HA ARG 27 9.377 -0.709 -12.978 213 1HB ARG 27 HB2 ARG 27 8.576 1.177 -14.354 214 2HB ARG 27 HB1 ARG 27 10.337 1.144 -14.279 215 1HG ARG 27 HG2 ARG 27 10.402 -0.007 -16.470 216 2HG ARG 27 HG1 ARG 27 8.641 0.067 -16.553 217 1HD ARG 27 HD2 ARG 27 9.642 1.917 -17.830 218 2HD ARG 27 HD1 ARG 27 8.742 2.533 -16.444 219 HE ARG 27 HE ARG 27 11.311 2.275 -15.468 220 1HH1 ARG 27 HH21 ARG 27 9.840 3.737 -18.221 221 2HH1 ARG 27 HH22 ARG 27 10.999 5.020 -18.326 222 1HH2 ARG 27 HH11 ARG 27 12.829 3.945 -15.583 223 2HH2 ARG 27 HH12 ARG 27 12.690 5.139 -16.830 224 H ALA 28 HN ALA 28 9.096 -2.241 -16.133 225 HA ALA 28 HA ALA 28 6.263 -2.204 -16.376 226 1HB ALA 28 HB1 ALA 28 7.911 -2.955 -18.144 227 2HB ALA 28 HB3 ALA 28 8.078 -4.467 -17.249 228 3HB ALA 28 HB2 ALA 28 6.519 -4.018 -17.940 229 H ASP 29 HN ASP 29 8.416 -4.456 -14.660 230 HA ASP 29 HA ASP 29 6.208 -6.182 -13.851 231 1HB ASP 29 HB2 ASP 29 9.101 -5.993 -12.969 232 2HB ASP 29 HB1 ASP 29 7.968 -7.184 -12.329 233 H VAL 30 HN VAL 30 7.954 -3.452 -12.439 234 HA VAL 30 HA VAL 30 6.900 -3.793 -9.771 235 HB VAL 30 HB VAL 30 7.995 -1.346 -11.188 236 1HG1 VAL 30 HG12 VAL 30 7.237 -1.835 -8.297 237 2HG1 VAL 30 HG11 VAL 30 8.315 -0.533 -8.798 238 3HG1 VAL 30 HG13 VAL 30 6.645 -0.561 -9.364 239 1HG2 VAL 30 HG23 VAL 30 9.504 -3.364 -10.821 240 2HG2 VAL 30 HG22 VAL 30 10.057 -1.867 -10.070 241 3HG2 VAL 30 HG21 VAL 30 9.283 -3.111 -9.089 242 H ASP 31 HN ASP 31 5.894 -1.743 -12.533 243 HA ASP 31 HA ASP 31 3.714 -0.477 -11.204 244 1HB ASP 31 HB2 ASP 31 4.167 -1.173 -14.116 245 2HB ASP 31 HB1 ASP 31 2.764 -0.258 -13.564 246 H HIS 32 HN HIS 32 3.913 -3.548 -12.962 247 HA HIS 32 HA HIS 32 1.143 -4.188 -12.920 248 1HB HIS 32 HB2 HIS 32 2.821 -5.439 -14.243 249 2HB HIS 32 HB1 HIS 32 3.534 -6.051 -12.753 250 HD1 HIS 32 HD1 HIS 32 -0.054 -5.878 -14.069 251 HD2 HIS 32 HD2 HIS 32 2.588 -8.603 -12.342 252 HE1 HIS 32 HE1 HIS 32 -1.322 -8.057 -13.838 253 H ALA 33 HN ALA 33 3.735 -4.896 -10.572 254 HA ALA 33 HA ALA 33 2.152 -6.360 -8.717 255 1HB ALA 33 HB1 ALA 33 4.547 -4.565 -8.232 256 2HB ALA 33 HB3 ALA 33 3.883 -5.693 -7.051 257 3HB ALA 33 HB2 ALA 33 4.586 -6.299 -8.551 258 H ILE 34 HN ILE 34 2.807 -2.856 -8.935 259 HA ILE 34 HA ILE 34 1.257 -2.193 -6.587 260 HB ILE 34 HB ILE 34 2.002 -0.484 -8.986 261 1HG1 ILE 34 HG12 ILE 34 4.004 -1.370 -7.922 262 2HG1 ILE 34 HG11 ILE 34 3.839 0.328 -7.488 263 1HG2 ILE 34 HG23 ILE 34 1.078 0.267 -6.197 264 2HG2 ILE 34 HG22 ILE 34 1.688 1.408 -7.394 265 3HG2 ILE 34 HG21 ILE 34 0.191 0.529 -7.698 266 1HD1 ILE 34 HD12 ILE 34 2.557 -0.646 -5.385 267 2HD1 ILE 34 HD11 ILE 34 3.454 -2.111 -5.783 268 3HD1 ILE 34 HD13 ILE 34 4.318 -0.620 -5.417 269 H GLU 35 HN GLU 35 0.530 -2.314 -10.063 270 HA GLU 35 HA GLU 35 -2.084 -1.199 -9.917 271 1HB GLU 35 HB2 GLU 35 -0.870 -1.619 -12.044 272 2HB GLU 35 HB1 GLU 35 -1.087 -3.354 -11.807 273 1HG GLU 35 HG2 GLU 35 -3.538 -3.056 -11.830 274 2HG GLU 35 HG1 GLU 35 -3.324 -1.320 -12.060 275 H LYS 36 HN LYS 36 -1.023 -4.608 -9.642 276 HA LYS 36 HA LYS 36 -3.641 -5.699 -9.295 277 1HB LYS 36 HB2 LYS 36 -0.921 -6.668 -8.409 278 2HB LYS 36 HB1 LYS 36 -2.393 -7.604 -8.141 279 1HG LYS 36 HG2 LYS 36 -2.864 -7.472 -10.592 280 2HG LYS 36 HG1 LYS 36 -1.309 -6.673 -10.813 281 1HD LYS 36 HD2 LYS 36 -1.675 -9.424 -9.584 282 2HD LYS 36 HD1 LYS 36 -1.206 -9.132 -11.257 283 1HE LYS 36 HE2 LYS 36 0.720 -7.706 -10.234 284 2HE LYS 36 HE1 LYS 36 0.355 -8.573 -8.742 285 1HZ LYS 36 HZ1 LYS 36 0.515 -10.653 -10.149 286 2HZ LYS 36 HZ3 LYS 36 1.248 -9.682 -11.330 287 3HZ LYS 36 HZ2 LYS 36 1.971 -9.850 -9.801 288 H ALA 37 HN ALA 37 -1.349 -4.344 -6.942 289 HA ALA 37 HA ALA 37 -2.736 -5.182 -4.603 290 1HB ALA 37 HB1 ALA 37 -0.432 -3.963 -4.873 291 2HB ALA 37 HB3 ALA 37 -1.391 -2.487 -4.763 292 3HB ALA 37 HB2 ALA 37 -1.399 -3.648 -3.434 293 H PHE 38 HN PHE 38 -3.012 -2.080 -6.394 294 HA PHE 38 HA PHE 38 -5.170 -1.049 -4.843 295 1HB PHE 38 HB2 PHE 38 -4.253 -0.557 -7.681 296 2HB PHE 38 HB1 PHE 38 -5.670 0.260 -7.024 297 HD1 PHE 38 HD2 PHE 38 -5.289 1.272 -4.564 298 HD2 PHE 38 HD1 PHE 38 -2.190 0.531 -7.447 299 HE1 PHE 38 HE2 PHE 38 -3.828 2.913 -3.416 300 HE2 PHE 38 HE1 PHE 38 -0.730 2.173 -6.297 301 HZ PHE 38 HZ PHE 38 -1.548 3.364 -4.282 302 H GLN 39 HN GLN 39 -5.165 -3.111 -7.752 303 HA GLN 39 HA GLN 39 -7.978 -3.112 -8.193 304 1HB GLN 39 HB2 GLN 39 -5.872 -5.209 -8.764 305 2HB GLN 39 HB1 GLN 39 -7.547 -5.353 -9.297 306 1HG GLN 39 HG2 GLN 39 -5.804 -2.962 -9.942 307 2HG GLN 39 HG1 GLN 39 -5.971 -4.354 -11.014 308 1HE2 GLN 39 HE22 GLN 39 -8.704 -1.530 -11.324 309 2HE2 GLN 39 HE21 GLN 39 -7.116 -1.317 -10.763 310 H LEU 40 HN LEU 40 -5.961 -5.277 -6.187 311 HA LEU 40 HA LEU 40 -8.076 -7.004 -5.378 312 1HB LEU 40 HB2 LEU 40 -5.552 -6.166 -3.934 313 2HB LEU 40 HB1 LEU 40 -6.638 -7.414 -3.331 314 HG LEU 40 HG LEU 40 -5.315 -7.471 -6.062 315 1HD1 LEU 40 HD11 LEU 40 -4.590 -8.863 -3.466 316 2HD1 LEU 40 HD13 LEU 40 -3.878 -9.243 -5.034 317 3HD1 LEU 40 HD12 LEU 40 -3.626 -7.653 -4.313 318 1HD2 LEU 40 HD22 LEU 40 -7.186 -9.304 -4.570 319 2HD2 LEU 40 HD21 LEU 40 -7.149 -8.899 -6.286 320 3HD2 LEU 40 HD23 LEU 40 -5.968 -10.023 -5.622 321 H TRP 41 HN TRP 41 -6.951 -3.933 -3.935 322 HA TRP 41 HA TRP 41 -8.854 -4.079 -1.745 323 1HB TRP 41 HB2 TRP 41 -7.260 -1.780 -2.907 324 2HB TRP 41 HB1 TRP 41 -8.283 -1.631 -1.479 325 HD1 TRP 41 HD1 TRP 41 -4.849 -2.374 -2.436 326 HE1 TRP 41 HE1 TRP 41 -3.556 -3.489 -0.505 327 HE3 TRP 41 HE3 TRP 41 -8.744 -3.616 0.625 328 HZ2 TRP 41 HZ2 TRP 41 -4.105 -4.749 2.005 329 HZ3 TRP 41 HZ3 TRP 41 -8.330 -4.774 2.778 330 HH2 TRP 41 HH2 TRP 41 -6.018 -5.341 3.470 331 H SER 42 HN SER 42 -8.797 -2.422 -4.889 332 HA SER 42 HA SER 42 -11.292 -1.039 -4.514 333 1HB SER 42 HB2 SER 42 -9.640 -0.348 -6.205 334 2HB SER 42 HB1 SER 42 -9.895 -1.856 -7.078 335 HG SER 42 HG SER 42 -12.262 -0.988 -6.819 336 H ASN 43 HN ASN 43 -10.452 -4.155 -5.975 337 HA ASN 43 HA ASN 43 -12.902 -4.816 -7.156 338 1HB ASN 43 HB2 ASN 43 -10.885 -6.570 -5.741 339 2HB ASN 43 HB1 ASN 43 -12.253 -7.211 -6.652 340 1HD2 ASN 43 HD22 ASN 43 -9.256 -6.891 -8.926 341 2HD2 ASN 43 HD21 ASN 43 -9.509 -7.676 -7.442 342 H VAL 44 HN VAL 44 -12.071 -4.815 -3.720 343 HA VAL 44 HA VAL 44 -14.746 -6.016 -3.094 344 HB VAL 44 HB VAL 44 -13.777 -6.244 -0.781 345 1HG1 VAL 44 HG13 VAL 44 -12.443 -7.543 -3.166 346 2HG1 VAL 44 HG12 VAL 44 -12.117 -8.052 -1.510 347 3HG1 VAL 44 HG11 VAL 44 -13.748 -8.186 -2.169 348 1HG2 VAL 44 HG23 VAL 44 -12.057 -4.408 -1.180 349 2HG2 VAL 44 HG22 VAL 44 -11.425 -5.879 -0.443 350 3HG2 VAL 44 HG21 VAL 44 -11.168 -5.570 -2.158 351 H THR 45 HN THR 45 -13.699 -3.002 -3.640 352 HA THR 45 HA THR 45 -15.640 -1.889 -1.717 353 HB THR 45 HB THR 45 -13.920 -0.042 -1.157 354 HG1 THR 45 HG1 THR 45 -12.461 -1.811 -2.633 355 1HG2 THR 45 HG21 THR 45 -14.716 -1.788 0.435 356 2HG2 THR 45 HG23 THR 45 -13.407 -2.835 -0.110 357 3HG2 THR 45 HG22 THR 45 -13.038 -1.324 0.715 358 HA PRO 46 HA PRO 46 -16.511 0.627 -5.279 359 1HB PRO 46 HB2 PRO 46 -17.402 2.972 -3.963 360 2HB PRO 46 HB1 PRO 46 -18.407 1.580 -4.396 361 1HG PRO 46 HG2 PRO 46 -17.381 2.372 -1.731 362 2HG PRO 46 HG1 PRO 46 -18.733 1.302 -2.134 363 1HD PRO 46 HD2 PRO 46 -16.199 0.465 -1.195 364 2HD PRO 46 HD1 PRO 46 -17.427 -0.571 -1.955 365 H LEU 47 HN LEU 47 -13.929 1.102 -3.330 366 HA LEU 47 HA LEU 47 -13.182 3.823 -4.037 367 1HB LEU 47 HB2 LEU 47 -11.466 1.525 -3.047 368 2HB LEU 47 HB1 LEU 47 -10.974 3.215 -3.114 369 HG LEU 47 HG LEU 47 -13.322 2.169 -1.504 370 1HD1 LEU 47 HD11 LEU 47 -10.540 3.006 -0.630 371 2HD1 LEU 47 HD13 LEU 47 -11.862 2.566 0.452 372 3HD1 LEU 47 HD12 LEU 47 -11.168 1.358 -0.628 373 1HD2 LEU 47 HD23 LEU 47 -12.094 4.892 -1.929 374 2HD2 LEU 47 HD22 LEU 47 -13.797 4.435 -1.895 375 3HD2 LEU 47 HD21 LEU 47 -12.880 4.517 -0.394 376 H THR 48 HN THR 48 -11.627 4.466 -5.589 377 HA THR 48 HA THR 48 -10.796 2.402 -7.601 378 HB THR 48 HB THR 48 -11.399 3.860 -9.417 379 HG1 THR 48 HG1 THR 48 -11.015 5.729 -7.689 380 1HG2 THR 48 HG23 THR 48 -13.238 2.546 -8.244 381 2HG2 THR 48 HG22 THR 48 -13.693 4.059 -7.460 382 3HG2 THR 48 HG21 THR 48 -13.780 3.914 -9.216 383 H PHE 49 HN PHE 49 -8.777 2.871 -8.598 384 HA PHE 49 HA PHE 49 -7.272 5.215 -7.478 385 1HB PHE 49 HB2 PHE 49 -6.269 2.376 -7.838 386 2HB PHE 49 HB1 PHE 49 -5.277 3.750 -7.349 387 HD1 PHE 49 HD2 PHE 49 -5.537 4.785 -5.152 388 HD2 PHE 49 HD1 PHE 49 -7.955 1.436 -6.328 389 HE1 PHE 49 HE2 PHE 49 -6.246 4.471 -2.798 390 HE2 PHE 49 HE1 PHE 49 -8.662 1.120 -3.971 391 HZ PHE 49 HZ PHE 49 -7.807 2.637 -2.205 392 H THR 50 HN THR 50 -6.126 6.349 -8.976 393 HA THR 50 HA THR 50 -5.948 5.225 -11.759 394 HB THR 50 HB THR 50 -6.273 8.120 -10.903 395 HG1 THR 50 HG1 THR 50 -8.272 7.603 -12.264 396 1HG2 THR 50 HG22 THR 50 -6.128 6.791 -13.623 397 2HG2 THR 50 HG21 THR 50 -6.596 8.470 -13.359 398 3HG2 THR 50 HG23 THR 50 -4.967 7.935 -12.949 399 H LYS 51 HN LYS 51 -3.937 5.085 -12.565 400 HA LYS 51 HA LYS 51 -1.648 6.016 -10.982 401 1HB LYS 51 HB2 LYS 51 -1.674 3.813 -12.192 402 2HB LYS 51 HB1 LYS 51 -1.702 4.705 -13.714 403 1HG LYS 51 HG2 LYS 51 0.443 5.700 -13.265 404 2HG LYS 51 HG1 LYS 51 0.442 5.083 -11.615 405 1HD LYS 51 HD2 LYS 51 1.868 3.632 -12.900 406 2HD LYS 51 HD1 LYS 51 0.381 2.745 -12.576 407 1HE LYS 51 HE2 LYS 51 0.691 4.338 -15.120 408 2HE LYS 51 HE1 LYS 51 1.334 2.703 -14.995 409 1HZ LYS 51 HZ3 LYS 51 -1.304 2.827 -13.966 410 2HZ LYS 51 HZ2 LYS 51 -1.263 3.428 -15.555 411 3HZ LYS 51 HZ1 LYS 51 -0.689 1.864 -15.219 412 H VAL 52 HN VAL 52 -0.580 7.934 -11.353 413 HA VAL 52 HA VAL 52 -1.006 9.315 -13.992 414 HB VAL 52 HB VAL 52 -1.018 11.462 -12.816 415 1HG1 VAL 52 HG12 VAL 52 -3.160 10.204 -13.146 416 2HG1 VAL 52 HG11 VAL 52 -2.983 9.556 -11.515 417 3HG1 VAL 52 HG13 VAL 52 -3.196 11.290 -11.757 418 1HG2 VAL 52 HG23 VAL 52 -0.570 9.698 -10.405 419 2HG2 VAL 52 HG22 VAL 52 0.340 11.121 -10.912 420 3HG2 VAL 52 HG21 VAL 52 -1.279 11.305 -10.238 421 H SER 53 HN SER 53 0.890 9.784 -14.987 422 HA SER 53 HA SER 53 3.415 9.334 -13.497 423 1HB SER 53 HB2 SER 53 3.020 8.334 -15.779 424 2HB SER 53 HB1 SER 53 3.030 9.968 -16.436 425 HG SER 53 HG SER 53 5.095 8.815 -16.446 426 H GLU 54 HN GLU 54 1.400 11.925 -14.139 427 HA GLU 54 HA GLU 54 3.610 13.838 -13.585 428 1HB GLU 54 HB2 GLU 54 1.672 14.090 -15.910 429 2HB GLU 54 HB1 GLU 54 2.719 15.391 -15.345 430 1HG GLU 54 HG2 GLU 54 4.705 13.986 -15.794 431 2HG GLU 54 HG1 GLU 54 3.655 12.692 -16.368 432 H GLY 55 HN GLY 55 2.755 15.926 -12.803 433 1HA GLY 55 HA2 GLY 55 1.066 17.304 -11.826 434 2HA GLY 55 HA1 GLY 55 -0.115 16.022 -12.104 435 H GLN 56 HN GLN 56 -0.167 17.181 -9.640 436 HA GLN 56 HA GLN 56 1.543 15.728 -7.755 437 1HB GLN 56 HB2 GLN 56 -0.866 17.537 -7.384 438 2HB GLN 56 HB1 GLN 56 0.010 16.800 -6.043 439 1HG GLN 56 HG2 GLN 56 2.043 17.946 -6.645 440 2HG GLN 56 HG1 GLN 56 1.333 18.523 -8.153 441 1HE2 GLN 56 HE22 GLN 56 1.099 21.186 -5.456 442 2HE2 GLN 56 HE21 GLN 56 2.398 20.258 -6.033 443 H ALA 57 HN ALA 57 0.706 14.182 -6.195 444 HA ALA 57 HA ALA 57 -1.901 12.899 -6.920 445 1HB ALA 57 HB1 ALA 57 -0.008 11.644 -7.974 446 2HB ALA 57 HB3 ALA 57 0.679 11.400 -6.367 447 3HB ALA 57 HB2 ALA 57 -0.883 10.693 -6.776 448 H ASP 58 HN ASP 58 -3.014 12.063 -5.146 449 HA ASP 58 HA ASP 58 -2.500 13.187 -2.589 450 1HB ASP 58 HB2 ASP 58 -4.179 10.809 -3.422 451 2HB ASP 58 HB1 ASP 58 -4.172 11.462 -1.784 452 H ILE 59 HN ILE 59 -1.742 9.951 -3.874 453 HA ILE 59 HA ILE 59 -0.166 9.387 -1.378 454 HB ILE 59 HB ILE 59 -1.223 7.482 -3.493 455 1HG1 ILE 59 HG12 ILE 59 -2.110 7.836 -0.617 456 2HG1 ILE 59 HG11 ILE 59 -2.933 8.597 -1.979 457 1HG2 ILE 59 HG21 ILE 59 0.221 7.045 -0.861 458 2HG2 ILE 59 HG23 ILE 59 -0.567 5.763 -1.780 459 3HG2 ILE 59 HG22 ILE 59 0.808 6.623 -2.470 460 1HD1 ILE 59 HD13 ILE 59 -2.446 5.614 -1.771 461 2HD1 ILE 59 HD12 ILE 59 -3.943 6.398 -1.265 462 3HD1 ILE 59 HD11 ILE 59 -3.448 6.449 -2.957 463 H MET 60 HN MET 60 1.974 9.759 -1.658 464 HA MET 60 HA MET 60 3.160 9.493 -4.389 465 1HB MET 60 HB2 MET 60 4.312 10.720 -1.867 466 2HB MET 60 HB1 MET 60 5.044 10.766 -3.468 467 1HG MET 60 HG2 MET 60 2.331 11.935 -2.776 468 2HG MET 60 HG1 MET 60 3.814 12.872 -2.935 469 1HE MET 60 HE3 MET 60 5.322 12.721 -4.708 470 2HE MET 60 HE2 MET 60 5.019 12.291 -6.389 471 3HE MET 60 HE1 MET 60 4.486 13.854 -5.779 472 H ILE 61 HN ILE 61 4.633 7.904 -4.817 473 HA ILE 61 HA ILE 61 5.509 6.128 -2.555 474 HB ILE 61 HB ILE 61 4.896 5.403 -5.434 475 1HG1 ILE 61 HG12 ILE 61 3.555 4.493 -2.871 476 2HG1 ILE 61 HG11 ILE 61 2.945 5.814 -3.869 477 1HG2 ILE 61 HG22 ILE 61 6.102 3.867 -3.131 478 2HG2 ILE 61 HG21 ILE 61 5.252 3.038 -4.433 479 3HG2 ILE 61 HG23 ILE 61 6.686 4.000 -4.789 480 1HD1 ILE 61 HD13 ILE 61 2.851 4.247 -5.813 481 2HD1 ILE 61 HD12 ILE 61 3.339 2.936 -4.739 482 3HD1 ILE 61 HD11 ILE 61 1.795 3.753 -4.489 483 H SER 62 HN SER 62 7.700 5.932 -2.336 484 HA SER 62 HA SER 62 9.435 6.432 -4.696 485 1HB SER 62 HB2 SER 62 10.835 8.011 -3.365 486 2HB SER 62 HB1 SER 62 9.224 8.639 -3.695 487 HG SER 62 HG SER 62 9.363 8.926 -1.574 488 H PHE 63 HN PHE 63 11.649 5.775 -4.322 489 HA PHE 63 HA PHE 63 11.940 3.706 -2.164 490 1HB PHE 63 HB2 PHE 63 13.043 3.840 -4.990 491 2HB PHE 63 HB1 PHE 63 13.582 2.668 -3.794 492 HD1 PHE 63 HD1 PHE 63 10.758 3.758 -5.895 493 HD2 PHE 63 HD2 PHE 63 12.142 0.857 -3.046 494 HE1 PHE 63 HE1 PHE 63 8.819 2.306 -6.429 495 HE2 PHE 63 HE2 PHE 63 10.203 -0.594 -3.579 496 HZ PHE 63 HZ PHE 63 8.540 0.131 -5.269 497 H VAL 64 HN VAL 64 13.766 3.927 -0.842 498 HA VAL 64 HA VAL 64 15.845 5.926 -1.655 499 HB VAL 64 HB VAL 64 15.772 6.937 0.573 500 1HG1 VAL 64 HG13 VAL 64 14.281 7.720 -1.360 501 2HG1 VAL 64 HG12 VAL 64 12.959 6.903 -0.526 502 3HG1 VAL 64 HG11 VAL 64 13.804 8.238 0.257 503 1HG2 VAL 64 HG23 VAL 64 13.492 4.986 0.985 504 2HG2 VAL 64 HG22 VAL 64 14.992 5.082 1.906 505 3HG2 VAL 64 HG21 VAL 64 13.789 6.366 2.043 506 H ARG 65 HN ARG 65 17.742 5.851 -0.086 507 HA ARG 65 HA ARG 65 18.207 3.054 0.911 508 1HB ARG 65 HB2 ARG 65 20.073 4.905 -0.594 509 2HB ARG 65 HB1 ARG 65 20.613 3.447 0.239 510 1HG ARG 65 HG2 ARG 65 19.086 2.091 -1.133 511 2HG ARG 65 HG1 ARG 65 18.543 3.547 -1.973 512 1HD ARG 65 HD2 ARG 65 20.248 2.448 -3.324 513 2HD ARG 65 HD1 ARG 65 20.910 3.952 -2.684 514 HE ARG 65 HE ARG 65 21.599 2.020 -0.799 515 1HH1 ARG 65 HH21 ARG 65 22.016 2.529 -4.185 516 2HH1 ARG 65 HH22 ARG 65 23.505 1.649 -4.265 517 1HH2 ARG 65 HH11 ARG 65 23.532 0.875 -0.884 518 2HH2 ARG 65 HH12 ARG 65 24.362 0.708 -2.395 519 H GLY 66 HN GLY 66 19.032 2.914 2.944 520 1HA GLY 66 HA2 GLY 66 19.595 3.633 5.106 521 2HA GLY 66 HA1 GLY 66 20.819 4.574 4.258 522 H ASP 67 HN ASP 67 20.688 6.406 5.563 523 HA ASP 67 HA ASP 67 18.246 7.650 6.391 524 1HB ASP 67 HB2 ASP 67 20.534 8.049 7.389 525 2HB ASP 67 HB1 ASP 67 20.915 9.021 5.967 526 H HIS 68 HN HIS 68 16.963 9.159 5.384 527 HA HIS 68 HA HIS 68 17.862 10.284 2.761 528 1HB HIS 68 HB2 HIS 68 15.586 9.805 1.848 529 2HB HIS 68 HB1 HIS 68 16.508 8.348 2.215 530 HD1 HIS 68 HD1 HIS 68 16.024 7.413 4.795 531 HD2 HIS 68 HD2 HIS 68 13.081 9.763 3.006 532 HE1 HIS 68 HE1 HIS 68 13.881 6.967 6.067 533 H ARG 69 HN ARG 69 18.095 12.030 4.593 534 HA ARG 69 HA ARG 69 17.304 14.027 5.538 535 1HB ARG 69 HB2 ARG 69 15.476 13.762 3.131 536 2HB ARG 69 HB1 ARG 69 15.559 15.204 4.140 537 1HG ARG 69 HG2 ARG 69 17.967 15.421 3.642 538 2HG ARG 69 HG1 ARG 69 17.886 13.978 2.629 539 1HD ARG 69 HD2 ARG 69 16.241 15.094 1.164 540 2HD ARG 69 HD1 ARG 69 16.318 16.536 2.175 541 HE ARG 69 HE ARG 69 18.957 16.091 1.434 542 1HH1 ARG 69 HH21 ARG 69 15.922 16.421 -0.172 543 2HH1 ARG 69 HH22 ARG 69 16.603 17.134 -1.597 544 1HH2 ARG 69 HH11 ARG 69 19.862 17.025 -0.419 545 2HH2 ARG 69 HH12 ARG 69 18.832 17.475 -1.737 546 H ASP 70 HN ASP 70 16.334 11.749 6.804 547 HA ASP 70 HA ASP 70 13.651 12.699 7.715 548 1HB ASP 70 HB2 ASP 70 14.394 9.908 6.824 549 2HB ASP 70 HB1 ASP 70 13.073 10.184 7.959 550 H ASN 71 HN ASN 71 13.146 11.918 9.912 551 HA ASN 71 HA ASN 71 15.604 11.759 11.555 552 1HB ASN 71 HB2 ASN 71 12.683 12.056 12.321 553 2HB ASN 71 HB1 ASN 71 14.034 12.102 13.453 554 1HD2 ASN 71 HD22 ASN 71 15.196 15.145 11.412 555 2HD2 ASN 71 HD21 ASN 71 15.763 13.546 11.408 556 H SER 72 HN SER 72 13.970 9.493 9.957 557 HA SER 72 HA SER 72 14.340 7.443 12.121 558 1HB SER 72 HB2 SER 72 12.090 7.535 10.092 559 2HB SER 72 HB1 SER 72 12.363 6.253 11.269 560 HG SER 72 HG SER 72 12.310 8.142 12.825 561 HA PRO 73 HA PRO 73 16.628 6.486 8.141 562 1HB PRO 73 HB2 PRO 73 18.918 5.697 9.719 563 2HB PRO 73 HB1 PRO 73 18.778 7.093 8.640 564 1HG PRO 73 HG2 PRO 73 18.843 7.102 11.533 565 2HG PRO 73 HG1 PRO 73 18.709 8.495 10.450 566 1HD PRO 73 HD2 PRO 73 16.635 7.327 12.109 567 2HD PRO 73 HD1 PRO 73 16.518 8.747 11.053 568 H PHE 74 HN PHE 74 17.303 4.312 7.464 569 HA PHE 74 HA PHE 74 15.841 2.217 8.872 570 1HB PHE 74 HB2 PHE 74 17.633 2.173 6.428 571 2HB PHE 74 HB1 PHE 74 16.760 0.764 7.032 572 HD1 PHE 74 HD1 PHE 74 14.302 0.676 6.969 573 HD2 PHE 74 HD2 PHE 74 16.458 4.030 5.375 574 HE1 PHE 74 HE1 PHE 74 12.259 1.423 5.782 575 HE2 PHE 74 HE2 PHE 74 14.412 4.779 4.187 576 HZ PHE 74 HZ PHE 74 12.312 3.475 4.392 577 H ASP 75 HN ASP 75 16.739 0.488 10.029 578 HA ASP 75 HA ASP 75 19.570 0.865 10.899 579 1HB ASP 75 HB2 ASP 75 17.809 0.761 12.645 580 2HB ASP 75 HB1 ASP 75 17.374 -0.856 12.088 581 H GLY 76 HN GLY 76 19.941 -0.128 8.567 582 1HA GLY 76 HA2 GLY 76 20.955 -1.961 7.482 583 2HA GLY 76 HA1 GLY 76 20.816 -2.860 8.994 584 HA PRO 77 HA PRO 77 17.752 -4.479 5.850 585 1HB PRO 77 HB2 PRO 77 18.626 -7.166 6.444 586 2HB PRO 77 HB1 PRO 77 18.861 -6.264 4.940 587 1HG PRO 77 HG2 PRO 77 20.865 -6.938 6.915 588 2HG PRO 77 HG1 PRO 77 21.090 -6.027 5.414 589 1HD PRO 77 HD2 PRO 77 21.055 -5.004 8.139 590 2HD PRO 77 HD1 PRO 77 21.374 -4.109 6.640 591 H GLY 78 HN GLY 78 18.341 -4.518 9.126 592 1HA GLY 78 HA2 GLY 78 16.086 -6.340 9.808 593 2HA GLY 78 HA1 GLY 78 17.221 -5.628 10.956 594 H GLY 79 HN GLY 79 14.694 -5.360 11.717 595 1HA GLY 79 HA2 GLY 79 13.351 -3.592 12.552 596 2HA GLY 79 HA1 GLY 79 14.245 -2.466 11.529 597 H ASN 80 HN ASN 80 12.137 -1.563 10.937 598 HA ASN 80 HA ASN 80 10.154 -3.159 9.564 599 1HB ASN 80 HB2 ASN 80 10.671 -0.175 9.676 600 2HB ASN 80 HB1 ASN 80 9.291 -0.887 8.841 601 1HD2 ASN 80 HD22 ASN 80 8.392 -0.062 12.433 602 2HD2 ASN 80 HD21 ASN 80 9.098 0.858 11.194 603 H LEU 81 HN LEU 81 9.850 -3.402 7.313 604 HA LEU 81 HA LEU 81 12.272 -2.959 5.667 605 1HB LEU 81 HB2 LEU 81 9.642 -4.161 4.763 606 2HB LEU 81 HB1 LEU 81 11.238 -4.395 4.057 607 HG LEU 81 HG LEU 81 10.319 -5.381 6.775 608 1HD1 LEU 81 HD11 LEU 81 9.451 -6.642 4.823 609 2HD1 LEU 81 HD13 LEU 81 11.103 -6.859 4.245 610 3HD1 LEU 81 HD12 LEU 81 10.594 -7.601 5.762 611 1HD2 LEU 81 HD22 LEU 81 12.996 -5.516 5.369 612 2HD2 LEU 81 HD21 LEU 81 12.655 -4.839 6.961 613 3HD2 LEU 81 HD23 LEU 81 12.563 -6.579 6.703 614 H ALA 82 HN ALA 82 9.511 -1.261 6.472 615 HA ALA 82 HA ALA 82 9.984 0.834 4.576 616 1HB ALA 82 HB1 ALA 82 7.683 -1.052 3.998 617 2HB ALA 82 HB3 ALA 82 7.777 0.583 3.344 618 3HB ALA 82 HB2 ALA 82 9.003 -0.611 2.915 619 H HIS 83 HN HIS 83 7.937 2.388 4.640 620 HA HIS 83 HA HIS 83 6.195 2.086 6.945 621 1HB HIS 83 HB2 HIS 83 7.129 4.017 8.221 622 2HB HIS 83 HB1 HIS 83 8.237 2.647 8.155 623 HD1 HIS 83 HD1 HIS 83 10.552 3.219 7.444 624 HD2 HIS 83 HD2 HIS 83 7.786 5.976 5.985 625 HE1 HIS 83 HE1 HIS 83 11.883 4.992 6.224 626 H ALA 84 HN ALA 84 4.975 4.235 7.317 627 HA ALA 84 HA ALA 84 4.941 5.998 4.931 628 1HB ALA 84 HB2 ALA 84 3.399 4.140 4.381 629 2HB ALA 84 HB1 ALA 84 2.508 4.446 5.872 630 3HB ALA 84 HB3 ALA 84 2.526 5.658 4.591 631 H PHE 85 HN PHE 85 3.345 7.820 5.295 632 HA PHE 85 HA PHE 85 3.428 8.646 8.172 633 1HB PHE 85 HB2 PHE 85 3.138 10.225 5.599 634 2HB PHE 85 HB1 PHE 85 3.034 10.938 7.210 635 HD1 PHE 85 HD2 PHE 85 5.254 9.308 4.759 636 HD2 PHE 85 HD1 PHE 85 4.995 11.126 8.642 637 HE1 PHE 85 HE2 PHE 85 7.728 9.421 4.870 638 HE2 PHE 85 HE1 PHE 85 7.469 11.237 8.755 639 HZ PHE 85 HZ PHE 85 8.836 10.387 6.868 640 H GLN 86 HN GLN 86 1.496 9.857 8.969 641 HA GLN 86 HA GLN 86 -0.897 8.405 8.501 642 1HB GLN 86 HB2 GLN 86 -0.421 11.114 9.765 643 2HB GLN 86 HB1 GLN 86 -1.996 10.317 9.760 644 1HG GLN 86 HG2 GLN 86 0.514 9.003 10.827 645 2HG GLN 86 HG1 GLN 86 -0.603 9.917 11.844 646 1HE2 GLN 86 HE22 GLN 86 -3.305 7.475 11.116 647 2HE2 GLN 86 HE21 GLN 86 -3.099 9.153 10.973 648 HA PRO 87 HA PRO 87 -2.426 10.238 4.752 649 1HB PRO 87 HB2 PRO 87 -5.178 10.451 5.636 650 2HB PRO 87 HB1 PRO 87 -4.470 9.222 4.577 651 1HG PRO 87 HG2 PRO 87 -5.263 8.946 7.371 652 2HG PRO 87 HG1 PRO 87 -4.693 7.688 6.265 653 1HD PRO 87 HD2 PRO 87 -3.243 8.797 8.464 654 2HD PRO 87 HD1 PRO 87 -2.614 7.701 7.214 655 H GLY 88 HN GLY 88 -1.864 12.373 4.459 656 1HA GLY 88 HA2 GLY 88 -3.616 14.471 5.311 657 2HA GLY 88 HA1 GLY 88 -2.179 14.463 6.330 658 HA PRO 89 HA PRO 89 -1.483 16.732 2.205 659 1HB PRO 89 HB2 PRO 89 -0.952 19.195 3.579 660 2HB PRO 89 HB1 PRO 89 -2.351 18.823 2.563 661 1HG PRO 89 HG2 PRO 89 -2.238 19.049 5.482 662 2HG PRO 89 HG1 PRO 89 -3.663 18.900 4.442 663 1HD PRO 89 HD2 PRO 89 -2.562 16.867 6.136 664 2HD PRO 89 HD1 PRO 89 -3.878 16.685 4.959 665 H GLY 90 HN GLY 90 0.633 18.311 2.007 666 1HA GLY 90 HA2 GLY 90 2.966 18.404 2.175 667 2HA GLY 90 HA1 GLY 90 2.745 18.047 3.887 668 H ILE 91 HN ILE 91 4.016 16.350 4.402 669 HA ILE 91 HA ILE 91 4.721 14.311 2.433 670 HB ILE 91 HB ILE 91 6.285 15.170 4.213 671 1HG1 ILE 91 HG12 ILE 91 5.780 12.190 4.441 672 2HG1 ILE 91 HG11 ILE 91 6.525 12.932 3.026 673 1HG2 ILE 91 HG23 ILE 91 4.469 15.152 5.999 674 2HG2 ILE 91 HG22 ILE 91 4.679 13.402 6.073 675 3HG2 ILE 91 HG21 ILE 91 6.019 14.468 6.489 676 1HD1 ILE 91 HD11 ILE 91 8.248 13.944 4.567 677 2HD1 ILE 91 HD13 ILE 91 7.564 12.972 5.871 678 3HD1 ILE 91 HD12 ILE 91 8.302 12.184 4.477 679 H GLY 92 HN GLY 92 2.079 14.755 4.477 680 1HA GLY 92 HA2 GLY 92 1.597 12.136 5.470 681 2HA GLY 92 HA1 GLY 92 0.339 13.318 5.124 682 H GLY 93 HN GLY 93 0.662 10.317 4.564 683 1HA GLY 93 HA2 GLY 93 -0.482 9.027 2.913 684 2HA GLY 93 HA1 GLY 93 -0.469 10.424 1.838 685 H ASP 94 HN ASP 94 2.545 10.645 2.600 686 HA ASP 94 HA ASP 94 3.532 9.300 0.262 687 1HB ASP 94 HB2 ASP 94 4.963 10.525 2.632 688 2HB ASP 94 HB1 ASP 94 5.795 9.894 1.210 689 H ALA 95 HN ALA 95 4.982 7.484 0.150 690 HA ALA 95 HA ALA 95 5.144 5.753 2.579 691 1HB ALA 95 HB1 ALA 95 4.006 4.987 -0.120 692 2HB ALA 95 HB3 ALA 95 4.592 3.788 1.035 693 3HB ALA 95 HB2 ALA 95 3.238 4.836 1.460 694 H HIS 96 HN HIS 96 7.259 5.286 2.834 695 HA HIS 96 HA HIS 96 9.060 5.323 0.450 696 1HB HIS 96 HB2 HIS 96 9.701 5.422 3.412 697 2HB HIS 96 HB1 HIS 96 10.874 5.547 2.102 698 HD2 HIS 96 HD2 HIS 96 7.944 7.730 0.922 699 HE1 HIS 96 HE1 HIS 96 10.508 10.126 3.327 700 HE2 HIS 96 HE2 HIS 96 8.589 10.154 1.669 701 H PHE 97 HN PHE 97 10.366 3.572 -0.046 702 HA PHE 97 HA PHE 97 9.876 1.025 1.477 703 1HB PHE 97 HB2 PHE 97 10.249 1.529 -1.481 704 2HB PHE 97 HB1 PHE 97 10.416 -0.073 -0.766 705 HD1 PHE 97 HD1 PHE 97 8.062 2.765 -1.265 706 HD2 PHE 97 HD2 PHE 97 8.510 -1.350 -0.124 707 HE1 PHE 97 HE1 PHE 97 5.602 2.480 -1.319 708 HE2 PHE 97 HE2 PHE 97 6.048 -1.636 -0.177 709 HZ PHE 97 HZ PHE 97 4.592 0.279 -0.779 710 H ASP 98 HN ASP 98 11.669 -0.163 2.045 711 HA ASP 98 HA ASP 98 14.250 1.126 2.101 712 1HB ASP 98 HB2 ASP 98 13.411 -0.543 3.789 713 2HB ASP 98 HB1 ASP 98 13.615 -1.807 2.574 714 H GLU 99 HN GLU 99 15.226 1.467 0.125 715 HA GLU 99 HA GLU 99 15.093 -0.508 -2.021 716 1HB GLU 99 HB2 GLU 99 15.229 1.984 -2.358 717 2HB GLU 99 HB1 GLU 99 16.890 1.911 -1.805 718 1HG GLU 99 HG2 GLU 99 17.522 0.475 -3.636 719 2HG GLU 99 HG1 GLU 99 15.838 0.273 -4.122 720 H ASP 100 HN ASP 100 17.036 -0.194 0.752 721 HA ASP 100 HA ASP 100 19.503 -1.249 -0.410 722 1HB ASP 100 HB2 ASP 100 18.539 -0.999 2.456 723 2HB ASP 100 HB1 ASP 100 20.134 -1.600 2.009 724 H GLU 101 HN GLU 101 16.524 -2.524 0.714 725 HA GLU 101 HA GLU 101 17.545 -5.228 1.231 726 1HB GLU 101 HB2 GLU 101 14.749 -4.069 1.044 727 2HB GLU 101 HB1 GLU 101 15.096 -5.749 1.462 728 1HG GLU 101 HG2 GLU 101 16.296 -5.100 3.436 729 2HG GLU 101 HG1 GLU 101 16.268 -3.400 2.966 730 H ARG 102 HN ARG 102 16.748 -7.087 -0.070 731 HA ARG 102 HA ARG 102 16.830 -6.423 -2.948 732 1HB ARG 102 HB2 ARG 102 18.195 -8.290 -2.033 733 2HB ARG 102 HB1 ARG 102 16.712 -9.119 -1.560 734 1HG ARG 102 HG2 ARG 102 15.986 -9.247 -3.878 735 2HG ARG 102 HG1 ARG 102 17.375 -8.292 -4.399 736 1HD ARG 102 HD2 ARG 102 18.891 -10.059 -3.539 737 2HD ARG 102 HD1 ARG 102 17.482 -11.029 -3.099 738 HE ARG 102 HE ARG 102 17.071 -10.527 -5.774 739 1HH1 ARG 102 HH21 ARG 102 19.677 -11.713 -3.854 740 2HH1 ARG 102 HH22 ARG 102 20.310 -12.733 -5.104 741 1HH2 ARG 102 HH11 ARG 102 17.881 -11.854 -7.417 742 2HH2 ARG 102 HH12 ARG 102 19.291 -12.814 -7.119 743 H TRP 103 HN TRP 103 14.908 -5.848 -3.820 744 HA TRP 103 HA TRP 103 12.386 -7.010 -2.792 745 1HB TRP 103 HB2 TRP 103 12.983 -4.874 -4.862 746 2HB TRP 103 HB1 TRP 103 11.353 -5.419 -4.463 747 HD1 TRP 103 HD1 TRP 103 13.774 -2.875 -3.525 748 HE1 TRP 103 HE1 TRP 103 13.219 -1.843 -1.229 749 HE3 TRP 103 HE3 TRP 103 10.364 -6.277 -1.831 750 HZ2 TRP 103 HZ2 TRP 103 11.550 -2.390 1.030 751 HZ3 TRP 103 HZ3 TRP 103 9.309 -5.999 0.394 752 HH2 TRP 103 HH2 TRP 103 9.896 -4.062 1.825 753 H THR 104 HN THR 104 11.253 -8.570 -3.875 754 HA THR 104 HA THR 104 12.091 -9.275 -6.664 755 HB THR 104 HB THR 104 12.036 -11.632 -6.109 756 HG1 THR 104 HG1 THR 104 10.452 -10.983 -4.267 757 1HG2 THR 104 HG23 THR 104 14.111 -10.254 -5.611 758 2HG2 THR 104 HG22 THR 104 13.605 -10.266 -3.921 759 3HG2 THR 104 HG21 THR 104 13.987 -11.781 -4.738 760 H ASN 105 HN ASN 105 10.421 -10.369 -7.865 761 HA ASN 105 HA ASN 105 7.660 -9.773 -6.852 762 1HB ASN 105 HB2 ASN 105 8.789 -10.009 -9.659 763 2HB ASN 105 HB1 ASN 105 7.065 -9.881 -9.310 764 1HD2 ASN 105 HD22 ASN 105 8.570 -6.439 -9.857 765 2HD2 ASN 105 HD21 ASN 105 8.616 -7.865 -10.778 766 H ASN 106 HN ASN 106 9.226 -12.172 -6.172 767 HA ASN 106 HA ASN 106 7.302 -14.199 -7.183 768 1HB ASN 106 HB2 ASN 106 9.379 -15.737 -7.531 769 2HB ASN 106 HB1 ASN 106 8.999 -14.546 -8.773 770 1HD2 ASN 106 HD22 ASN 106 12.303 -13.357 -8.473 771 2HD2 ASN 106 HD21 ASN 106 11.106 -14.001 -9.489 772 H PHE 107 HN PHE 107 8.647 -16.443 -6.078 773 HA PHE 107 HA PHE 107 7.953 -16.094 -3.269 774 1HB PHE 107 HB2 PHE 107 9.294 -18.529 -4.447 775 2HB PHE 107 HB1 PHE 107 8.141 -18.443 -3.115 776 HD1 PHE 107 HD1 PHE 107 5.841 -17.167 -3.843 777 HD2 PHE 107 HD2 PHE 107 8.448 -19.353 -6.464 778 HE1 PHE 107 HE1 PHE 107 3.965 -17.504 -5.428 779 HE2 PHE 107 HE2 PHE 107 6.572 -19.690 -8.049 780 HZ PHE 107 HZ PHE 107 4.330 -18.765 -7.532 781 H ARG 108 HN ARG 108 10.632 -15.058 -4.731 782 HA ARG 108 HA ARG 108 12.804 -16.279 -3.372 783 1HB ARG 108 HB2 ARG 108 12.405 -13.517 -4.522 784 2HB ARG 108 HB1 ARG 108 13.926 -13.993 -3.772 785 1HG ARG 108 HG2 ARG 108 14.104 -15.908 -5.309 786 2HG ARG 108 HG1 ARG 108 12.585 -15.446 -6.071 787 1HD ARG 108 HD2 ARG 108 13.579 -13.276 -6.722 788 2HD ARG 108 HD1 ARG 108 15.104 -13.761 -5.978 789 HE ARG 108 HE ARG 108 14.618 -15.801 -7.758 790 1HH1 ARG 108 HH21 ARG 108 14.636 -12.356 -7.924 791 2HH1 ARG 108 HH22 ARG 108 15.187 -12.306 -9.565 792 1HH2 ARG 108 HH11 ARG 108 15.333 -15.754 -9.901 793 2HH2 ARG 108 HH12 ARG 108 15.583 -14.229 -10.683 794 H GLU 109 HN GLU 109 14.048 -14.079 -2.038 795 HA GLU 109 HA GLU 109 13.422 -14.550 0.608 796 1HB GLU 109 HB2 GLU 109 14.472 -11.995 -0.628 797 2HB GLU 109 HB1 GLU 109 14.498 -12.344 1.101 798 1HG GLU 109 HG2 GLU 109 15.754 -14.150 -0.979 799 2HG GLU 109 HG1 GLU 109 16.647 -12.904 -0.105 800 H TYR 110 HN TYR 110 12.294 -11.562 -1.095 801 HA TYR 110 HA TYR 110 9.873 -11.625 0.688 802 1HB TYR 110 HB2 TYR 110 11.551 -9.188 0.030 803 2HB TYR 110 HB1 TYR 110 10.077 -9.200 0.998 804 HD1 TYR 110 HD2 TYR 110 10.030 -10.411 3.191 805 HD2 TYR 110 HD1 TYR 110 13.649 -9.886 0.940 806 HE1 TYR 110 HE2 TYR 110 11.365 -10.970 5.205 807 HE2 TYR 110 HE1 TYR 110 14.984 -10.447 2.952 808 HH TYR 110 HH TYR 110 13.515 -10.756 6.100 809 H ASN 111 HN ASN 111 7.997 -10.689 -0.190 810 HA ASN 111 HA ASN 111 8.034 -10.365 -3.162 811 1HB ASN 111 HB2 ASN 111 5.677 -10.727 -1.284 812 2HB ASN 111 HB1 ASN 111 5.637 -10.788 -3.047 813 1HD2 ASN 111 HD22 ASN 111 5.853 -14.303 -1.814 814 2HD2 ASN 111 HD21 ASN 111 4.732 -13.038 -1.655 815 H LEU 112 HN LEU 112 8.027 -8.285 -3.871 816 HA LEU 112 HA LEU 112 7.714 -6.012 -2.199 817 1HB LEU 112 HB2 LEU 112 8.884 -5.902 -4.343 818 2HB LEU 112 HB1 LEU 112 7.391 -6.269 -5.203 819 HG LEU 112 HG LEU 112 6.391 -4.167 -4.438 820 1HD1 LEU 112 HD12 LEU 112 8.933 -4.003 -2.820 821 2HD1 LEU 112 HD11 LEU 112 8.090 -2.528 -3.293 822 3HD1 LEU 112 HD13 LEU 112 7.269 -3.730 -2.301 823 1HD2 LEU 112 HD22 LEU 112 7.861 -4.237 -6.481 824 2HD2 LEU 112 HD21 LEU 112 7.777 -2.647 -5.722 825 3HD2 LEU 112 HD23 LEU 112 9.195 -3.667 -5.478 826 H HIS 113 HN HIS 113 5.364 -7.604 -4.357 827 HA HIS 113 HA HIS 113 3.265 -5.724 -4.057 828 1HB HIS 113 HB2 HIS 113 3.235 -7.518 -5.738 829 2HB HIS 113 HB1 HIS 113 3.072 -8.721 -4.460 830 HD1 HIS 113 HD1 HIS 113 0.749 -9.298 -5.724 831 HD2 HIS 113 HD2 HIS 113 0.906 -5.600 -3.808 832 HE1 HIS 113 HE1 HIS 113 -1.645 -8.504 -5.505 833 H ARG 114 HN ARG 114 3.955 -8.653 -2.107 834 HA ARG 114 HA ARG 114 1.677 -8.451 -0.418 835 1HB ARG 114 HB2 ARG 114 3.239 -10.414 -0.520 836 2HB ARG 114 HB1 ARG 114 4.422 -9.463 0.378 837 1HG ARG 114 HG2 ARG 114 2.811 -9.200 2.223 838 2HG ARG 114 HG1 ARG 114 1.628 -10.156 1.337 839 1HD ARG 114 HD2 ARG 114 3.289 -12.038 1.292 840 2HD ARG 114 HD1 ARG 114 4.333 -11.095 2.346 841 HE ARG 114 HE ARG 114 2.073 -12.693 3.138 842 1HH1 ARG 114 HH21 ARG 114 3.533 -9.626 3.773 843 2HH1 ARG 114 HH22 ARG 114 2.694 -9.404 5.270 844 1HH2 ARG 114 HH11 ARG 114 1.002 -12.418 5.085 845 2HH2 ARG 114 HH12 ARG 114 1.272 -10.982 6.015 846 H VAL 115 HN VAL 115 4.957 -7.086 0.014 847 HA VAL 115 HA VAL 115 4.288 -5.811 2.518 848 HB VAL 115 HB VAL 115 6.497 -5.257 0.517 849 1HG1 VAL 115 HG13 VAL 115 5.909 -4.124 3.257 850 2HG1 VAL 115 HG12 VAL 115 7.544 -4.149 2.597 851 3HG1 VAL 115 HG11 VAL 115 6.273 -3.251 1.768 852 1HG2 VAL 115 HG21 VAL 115 6.303 -6.866 3.077 853 2HG2 VAL 115 HG23 VAL 115 6.750 -7.442 1.470 854 3HG2 VAL 115 HG22 VAL 115 7.846 -6.391 2.366 855 H ALA 116 HN ALA 116 4.302 -4.741 -0.876 856 HA ALA 116 HA ALA 116 3.741 -1.995 -0.436 857 1HB ALA 116 HB3 ALA 116 2.835 -3.847 -2.665 858 2HB ALA 116 HB2 ALA 116 2.654 -2.092 -2.705 859 3HB ALA 116 HB1 ALA 116 4.264 -2.814 -2.668 860 H ALA 117 HN ALA 117 1.596 -4.813 -0.615 861 HA ALA 117 HA ALA 117 -0.885 -3.436 -0.429 862 1HB ALA 117 HB3 ALA 117 -0.438 -5.940 -0.886 863 2HB ALA 117 HB2 ALA 117 -0.357 -6.113 0.867 864 3HB ALA 117 HB1 ALA 117 -1.840 -5.538 0.106 865 H HIS 118 HN HIS 118 1.372 -4.569 2.068 866 HA HIS 118 HA HIS 118 -0.248 -4.018 4.340 867 1HB HIS 118 HB2 HIS 118 1.890 -5.265 4.446 868 2HB HIS 118 HB1 HIS 118 2.766 -3.779 4.076 869 HD1 HIS 118 HD1 HIS 118 0.582 -5.317 6.746 870 HD2 HIS 118 HD2 HIS 118 3.143 -2.065 6.273 871 HE1 HIS 118 HE1 HIS 118 0.877 -4.303 9.046 872 H GLU 119 HN GLU 119 2.165 -1.915 2.713 873 HA GLU 119 HA GLU 119 1.682 0.344 4.413 874 1HB GLU 119 HB2 GLU 119 2.752 0.163 1.578 875 2HB GLU 119 HB1 GLU 119 2.694 1.665 2.499 876 1HG GLU 119 HG2 GLU 119 4.866 0.906 2.950 877 2HG GLU 119 HG1 GLU 119 3.978 0.294 4.342 878 H LEU 120 HN LEU 120 0.214 -0.687 1.335 879 HA LEU 120 HA LEU 120 -1.384 1.652 0.952 880 1HB LEU 120 HB2 LEU 120 -1.823 -1.228 0.122 881 2HB LEU 120 HB1 LEU 120 -2.873 0.090 -0.388 882 HG LEU 120 HG LEU 120 0.124 0.034 -0.859 883 1HD1 LEU 120 HD12 LEU 120 -2.169 -0.704 -2.701 884 2HD1 LEU 120 HD11 LEU 120 -0.496 -0.497 -3.221 885 3HD1 LEU 120 HD13 LEU 120 -0.918 -1.787 -2.095 886 1HD2 LEU 120 HD21 LEU 120 -2.111 1.924 -1.576 887 2HD2 LEU 120 HD23 LEU 120 -0.463 2.283 -1.064 888 3HD2 LEU 120 HD22 LEU 120 -0.773 1.737 -2.706 889 H GLY 121 HN GLY 121 -1.949 -1.344 2.765 890 1HA GLY 121 HA2 GLY 121 -4.661 -0.851 3.453 891 2HA GLY 121 HA1 GLY 121 -3.551 -1.834 4.408 892 H HIS 122 HN HIS 122 -1.641 0.165 5.057 893 HA HIS 122 HA HIS 122 -2.929 1.412 7.300 894 1HB HIS 122 HB2 HIS 122 -0.241 1.873 5.986 895 2HB HIS 122 HB1 HIS 122 -0.759 2.744 7.429 896 HD1 HIS 122 HD1 HIS 122 -1.815 0.881 9.331 897 HD2 HIS 122 HD2 HIS 122 1.178 -0.370 6.712 898 HE1 HIS 122 HE1 HIS 122 -0.738 -1.152 10.392 899 H SER 123 HN SER 123 -1.983 2.579 4.091 900 HA SER 123 HA SER 123 -2.586 5.327 4.441 901 1HB SER 123 HB2 SER 123 -2.894 3.565 1.990 902 2HB SER 123 HB1 SER 123 -3.009 5.321 1.966 903 HG SER 123 HG SER 123 -0.829 3.759 1.957 904 H LEU 124 HN LEU 124 -4.651 2.527 3.937 905 HA LEU 124 HA LEU 124 -7.057 4.147 3.511 906 1HB LEU 124 HB2 LEU 124 -6.753 1.187 4.105 907 2HB LEU 124 HB1 LEU 124 -8.242 1.980 3.593 908 HG LEU 124 HG LEU 124 -5.670 1.937 1.986 909 1HD1 LEU 124 HD13 LEU 124 -6.866 -0.290 2.280 910 2HD1 LEU 124 HD12 LEU 124 -8.235 0.430 1.434 911 3HD1 LEU 124 HD11 LEU 124 -6.685 0.256 0.613 912 1HD2 LEU 124 HD22 LEU 124 -8.405 3.137 1.568 913 2HD2 LEU 124 HD21 LEU 124 -6.819 3.832 1.231 914 3HD2 LEU 124 HD23 LEU 124 -7.480 2.591 0.170 915 H GLY 125 HN GLY 125 -5.177 3.549 6.152 916 1HA GLY 125 HA2 GLY 125 -5.638 4.255 8.375 917 2HA GLY 125 HA1 GLY 125 -7.352 4.322 7.979 918 H LEU 126 HN LEU 126 -5.726 1.396 7.095 919 HA LEU 126 HA LEU 126 -7.364 -0.091 9.011 920 1HB LEU 126 HB2 LEU 126 -5.207 -1.029 7.095 921 2HB LEU 126 HB1 LEU 126 -6.269 -2.091 8.015 922 HG LEU 126 HG LEU 126 -7.250 0.013 6.062 923 1HD1 LEU 126 HD13 LEU 126 -5.910 -1.952 5.079 924 2HD1 LEU 126 HD12 LEU 126 -7.240 -2.975 5.617 925 3HD1 LEU 126 HD11 LEU 126 -7.532 -1.697 4.438 926 1HD2 LEU 126 HD22 LEU 126 -8.581 -2.072 7.788 927 2HD2 LEU 126 HD21 LEU 126 -9.059 -0.402 7.488 928 3HD2 LEU 126 HD23 LEU 126 -9.321 -1.627 6.252 929 H SER 127 HN SER 127 -6.556 -1.361 10.752 930 HA SER 127 HA SER 127 -3.948 -0.378 11.843 931 1HB SER 127 HB2 SER 127 -6.406 -1.560 13.144 932 2HB SER 127 HB1 SER 127 -4.890 -1.324 14.010 933 HG SER 127 HG SER 127 -5.944 0.794 12.512 934 H HIS 128 HN HIS 128 -2.806 -2.042 13.254 935 HA HIS 128 HA HIS 128 -2.156 -4.352 11.651 936 1HB HIS 128 HB2 HIS 128 -1.411 -3.543 14.472 937 2HB HIS 128 HB1 HIS 128 -0.782 -4.993 13.690 938 HD1 HIS 128 HD1 HIS 128 -0.427 -1.298 13.774 939 HD2 HIS 128 HD2 HIS 128 0.913 -4.447 11.393 940 HE1 HIS 128 HE1 HIS 128 1.441 -0.367 12.338 941 H SER 129 HN SER 129 -2.142 -6.607 12.755 942 HA SER 129 HA SER 129 -4.450 -7.073 14.548 943 1HB SER 129 HB2 SER 129 -5.358 -7.106 12.201 944 2HB SER 129 HB1 SER 129 -4.256 -8.433 11.842 945 HG SER 129 HG SER 129 -6.464 -8.345 13.593 946 H THR 130 HN THR 130 -4.410 -9.248 15.440 947 HA THR 130 HA THR 130 -1.659 -10.398 15.444 948 HB THR 130 HB THR 130 -2.388 -11.530 17.512 949 HG1 THR 130 HG1 THR 130 -4.807 -10.100 17.201 950 1HG2 THR 130 HG22 THR 130 -2.895 -8.560 17.284 951 2HG2 THR 130 HG21 THR 130 -2.925 -9.401 18.834 952 3HG2 THR 130 HG23 THR 130 -1.445 -9.374 17.874 953 H ASP 131 HN ASP 131 -4.229 -10.852 13.578 954 HA ASP 131 HA ASP 131 -4.527 -13.772 13.839 955 1HB ASP 131 HB2 ASP 131 -6.423 -12.271 13.147 956 2HB ASP 131 HB1 ASP 131 -5.550 -11.942 11.650 957 H ILE 132 HN ILE 132 -3.186 -15.183 12.857 958 HA ILE 132 HA ILE 132 -0.950 -14.402 11.281 959 HB ILE 132 HB ILE 132 -2.350 -17.086 11.479 960 1HG1 ILE 132 HG12 ILE 132 0.213 -16.150 12.795 961 2HG1 ILE 132 HG11 ILE 132 -1.361 -16.024 13.582 962 1HG2 ILE 132 HG21 ILE 132 0.279 -16.242 10.244 963 2HG2 ILE 132 HG23 ILE 132 -0.039 -17.906 10.736 964 3HG2 ILE 132 HG22 ILE 132 -1.032 -17.150 9.491 965 1HD1 ILE 132 HD11 ILE 132 -1.681 -18.469 13.291 966 2HD1 ILE 132 HD13 ILE 132 -0.074 -18.578 12.572 967 3HD1 ILE 132 HD12 ILE 132 -0.254 -18.105 14.261 968 H GLY 133 HN GLY 133 -4.170 -15.582 10.325 969 1HA GLY 133 HA2 GLY 133 -3.554 -15.741 7.516 970 2HA GLY 133 HA1 GLY 133 -5.174 -15.704 8.205 971 H ALA 134 HN ALA 134 -3.544 -13.037 9.384 972 HA ALA 134 HA ALA 134 -4.861 -11.283 7.359 973 1HB ALA 134 HB1 ALA 134 -3.743 -10.704 10.116 974 2HB ALA 134 HB3 ALA 134 -4.394 -9.472 9.038 975 3HB ALA 134 HB2 ALA 134 -5.441 -10.753 9.648 976 H LEU 135 HN LEU 135 -3.674 -9.864 6.101 977 HA LEU 135 HA LEU 135 -0.886 -10.453 5.654 978 1HB LEU 135 HB2 LEU 135 -2.597 -8.119 4.740 979 2HB LEU 135 HB1 LEU 135 -0.982 -8.472 4.131 980 HG LEU 135 HG LEU 135 -3.312 -10.409 3.985 981 1HD1 LEU 135 HD11 LEU 135 -2.231 -8.399 2.002 982 2HD1 LEU 135 HD13 LEU 135 -3.169 -9.803 1.495 983 3HD1 LEU 135 HD12 LEU 135 -3.893 -8.597 2.558 984 1HD2 LEU 135 HD22 LEU 135 -0.444 -10.453 3.048 985 2HD2 LEU 135 HD21 LEU 135 -1.390 -11.735 3.800 986 3HD2 LEU 135 HD23 LEU 135 -1.665 -11.311 2.113 987 H MET 136 HN MET 136 -2.613 -7.974 7.459 988 HA MET 136 HA MET 136 -0.304 -6.313 7.924 989 1HB MET 136 HB2 MET 136 -2.817 -6.492 9.599 990 2HB MET 136 HB1 MET 136 -1.696 -5.133 9.500 991 1HG MET 136 HG2 MET 136 -2.216 -5.032 7.013 992 2HG MET 136 HG1 MET 136 -3.522 -6.176 7.324 993 1HE MET 136 HE3 MET 136 -1.865 -2.958 8.654 994 2HE MET 136 HE2 MET 136 -2.507 -2.605 7.052 995 3HE MET 136 HE1 MET 136 -3.172 -1.782 8.460 996 H TYR 137 HN TYR 137 -0.244 -9.314 8.667 997 HA TYR 137 HA TYR 137 -0.024 -9.484 11.504 998 1HB TYR 137 HB2 TYR 137 -0.120 -11.378 9.742 999 2HB TYR 137 HB1 TYR 137 1.619 -11.144 9.590 1000 HD1 TYR 137 HD2 TYR 137 -0.969 -11.473 12.304 1001 HD2 TYR 137 HD1 TYR 137 2.979 -12.470 10.948 1002 HE1 TYR 137 HE2 TYR 137 -0.620 -12.854 14.333 1003 HE2 TYR 137 HE1 TYR 137 3.331 -13.850 12.978 1004 HH TYR 137 HH TYR 137 0.713 -14.398 15.301 1005 HA PRO 138 HA PRO 138 3.712 -6.999 11.877 1006 1HB PRO 138 HB2 PRO 138 4.563 -8.163 14.358 1007 2HB PRO 138 HB1 PRO 138 3.656 -6.661 14.133 1008 1HG PRO 138 HG2 PRO 138 2.679 -9.253 15.098 1009 2HG PRO 138 HG1 PRO 138 1.857 -7.686 15.116 1010 1HD PRO 138 HD2 PRO 138 1.268 -9.885 13.395 1011 2HD PRO 138 HD1 PRO 138 0.625 -8.232 13.267 1012 H SER 139 HN SER 139 3.781 -9.856 10.612 1013 HA SER 139 HA SER 139 6.714 -9.997 10.585 1014 1HB SER 139 HB2 SER 139 5.906 -11.398 12.582 1015 2HB SER 139 HB1 SER 139 5.233 -12.501 11.390 1016 HG SER 139 HG SER 139 7.779 -12.206 12.198 1017 H TYR 140 HN TYR 140 7.345 -10.513 8.576 1018 HA TYR 140 HA TYR 140 5.523 -10.999 6.446 1019 1HB TYR 140 HB2 TYR 140 7.787 -10.070 6.122 1020 2HB TYR 140 HB1 TYR 140 8.491 -11.610 6.609 1021 HD1 TYR 140 HD1 TYR 140 8.358 -13.580 5.159 1022 HD2 TYR 140 HD2 TYR 140 6.681 -9.810 3.956 1023 HE1 TYR 140 HE1 TYR 140 8.199 -14.395 2.822 1024 HE2 TYR 140 HE2 TYR 140 6.520 -10.630 1.621 1025 HH TYR 140 HH TYR 140 7.576 -13.925 0.748 1026 H THR 141 HN THR 141 4.703 -12.878 5.593 1027 HA THR 141 HA THR 141 5.920 -15.482 6.252 1028 HB THR 141 HB THR 141 3.699 -16.364 7.082 1029 HG1 THR 141 HG1 THR 141 2.457 -14.617 6.277 1030 1HG2 THR 141 HG21 THR 141 5.654 -15.608 8.562 1031 2HG2 THR 141 HG23 THR 141 4.731 -14.130 8.833 1032 3HG2 THR 141 HG22 THR 141 4.069 -15.686 9.331 1033 H PHE 142 HN PHE 142 5.897 -16.559 4.344 1034 HA PHE 142 HA PHE 142 4.093 -15.719 2.194 1035 1HB PHE 142 HB2 PHE 142 6.411 -16.364 1.681 1036 2HB PHE 142 HB1 PHE 142 6.113 -17.980 2.322 1037 HD1 PHE 142 HD1 PHE 142 5.002 -15.556 -0.288 1038 HD2 PHE 142 HD2 PHE 142 5.119 -19.661 0.974 1039 HE1 PHE 142 HE1 PHE 142 4.105 -16.259 -2.490 1040 HE2 PHE 142 HE2 PHE 142 4.221 -20.363 -1.229 1041 HZ PHE 142 HZ PHE 142 3.714 -18.662 -2.960 1042 H SER 143 HN SER 143 2.167 -16.668 1.707 1043 HA SER 143 HA SER 143 1.629 -19.447 2.630 1044 1HB SER 143 HB2 SER 143 -0.022 -17.011 3.338 1045 2HB SER 143 HB1 SER 143 -0.659 -18.651 3.417 1046 HG SER 143 HG SER 143 0.465 -18.981 5.165 1047 H GLY 144 HN GLY 144 1.501 -20.191 0.509 1048 1HA GLY 144 HA2 GLY 144 0.603 -20.490 -1.639 1049 2HA GLY 144 HA1 GLY 144 -0.925 -20.036 -0.883 1050 H ASP 145 HN ASP 145 -1.820 -18.586 -2.285 1051 HA ASP 145 HA ASP 145 -0.148 -16.584 -3.655 1052 1HB ASP 145 HB2 ASP 145 -3.114 -17.196 -3.703 1053 2HB ASP 145 HB1 ASP 145 -2.381 -15.883 -4.627 1054 H VAL 146 HN VAL 146 -0.949 -14.244 -3.603 1055 HA VAL 146 HA VAL 146 -1.346 -13.463 -0.761 1056 HB VAL 146 HB VAL 146 -0.680 -11.777 -3.196 1057 1HG1 VAL 146 HG13 VAL 146 -0.669 -11.174 -0.222 1058 2HG1 VAL 146 HG12 VAL 146 -0.028 -10.099 -1.465 1059 3HG1 VAL 146 HG11 VAL 146 -1.751 -10.472 -1.426 1060 1HG2 VAL 146 HG22 VAL 146 1.069 -13.457 -2.573 1061 2HG2 VAL 146 HG21 VAL 146 1.605 -11.794 -2.331 1062 3HG2 VAL 146 HG23 VAL 146 1.105 -12.769 -0.950 1063 H GLN 147 HN GLN 147 -3.453 -13.309 -0.194 1064 HA GLN 147 HA GLN 147 -5.303 -11.769 -1.972 1065 1HB GLN 147 HB2 GLN 147 -5.923 -14.377 -0.544 1066 2HB GLN 147 HB1 GLN 147 -7.124 -13.359 -1.339 1067 1HG GLN 147 HG2 GLN 147 -4.717 -14.581 -2.722 1068 2HG GLN 147 HG1 GLN 147 -6.354 -15.235 -2.790 1069 1HE2 GLN 147 HE22 GLN 147 -5.449 -12.582 -5.528 1070 2HE2 GLN 147 HE21 GLN 147 -4.384 -13.668 -4.772 1071 H LEU 148 HN LEU 148 -7.136 -10.845 -0.738 1072 HA LEU 148 HA LEU 148 -6.225 -9.790 1.814 1073 1HB LEU 148 HB2 LEU 148 -8.963 -9.568 0.524 1074 2HB LEU 148 HB1 LEU 148 -8.334 -8.556 1.823 1075 HG LEU 148 HG LEU 148 -7.124 -8.761 -0.951 1076 1HD1 LEU 148 HD11 LEU 148 -9.373 -7.635 -0.829 1077 2HD1 LEU 148 HD13 LEU 148 -8.674 -6.475 0.299 1078 3HD1 LEU 148 HD12 LEU 148 -8.071 -6.570 -1.356 1079 1HD2 LEU 148 HD22 LEU 148 -6.400 -7.254 1.562 1080 2HD2 LEU 148 HD21 LEU 148 -5.349 -8.130 0.450 1081 3HD2 LEU 148 HD23 LEU 148 -6.009 -6.564 -0.013 1082 H ALA 149 HN ALA 149 -7.441 -10.035 3.846 1083 HA ALA 149 HA ALA 149 -8.633 -12.772 4.113 1084 1HB ALA 149 HB1 ALA 149 -7.311 -10.915 6.110 1085 2HB ALA 149 HB3 ALA 149 -8.150 -12.397 6.571 1086 3HB ALA 149 HB2 ALA 149 -6.719 -12.477 5.543 1087 H GLN 150 HN GLN 150 -10.588 -12.992 5.357 1088 HA GLN 150 HA GLN 150 -12.602 -11.093 4.851 1089 1HB GLN 150 HB2 GLN 150 -13.073 -13.435 5.502 1090 2HB GLN 150 HB1 GLN 150 -12.485 -13.095 7.130 1091 1HG GLN 150 HG2 GLN 150 -14.255 -11.478 7.499 1092 2HG GLN 150 HG1 GLN 150 -14.784 -11.616 5.822 1093 1HE2 GLN 150 HE22 GLN 150 -17.002 -13.830 7.830 1094 2HE2 GLN 150 HE21 GLN 150 -16.695 -12.162 7.760 1095 H ASP 151 HN ASP 151 -10.419 -11.398 7.623 1096 HA ASP 151 HA ASP 151 -11.671 -9.512 9.349 1097 1HB ASP 151 HB2 ASP 151 -9.758 -10.935 10.042 1098 2HB ASP 151 HB1 ASP 151 -8.702 -10.029 8.958 1099 H ASP 152 HN ASP 152 -9.406 -9.112 6.657 1100 HA ASP 152 HA ASP 152 -9.208 -6.232 6.971 1101 1HB ASP 152 HB2 ASP 152 -8.522 -8.117 4.699 1102 2HB ASP 152 HB1 ASP 152 -8.216 -6.381 4.638 1103 H ILE 153 HN ILE 153 -11.146 -8.430 4.939 1104 HA ILE 153 HA ILE 153 -12.386 -6.445 3.309 1105 HB ILE 153 HB ILE 153 -13.577 -9.037 4.354 1106 1HG1 ILE 153 HG12 ILE 153 -11.521 -9.538 3.176 1107 2HG1 ILE 153 HG11 ILE 153 -12.864 -9.942 2.118 1108 1HG2 ILE 153 HG22 ILE 153 -14.325 -7.214 2.060 1109 2HG2 ILE 153 HG21 ILE 153 -14.925 -8.865 2.219 1110 3HG2 ILE 153 HG23 ILE 153 -15.319 -7.662 3.446 1111 1HD1 ILE 153 HD13 ILE 153 -12.538 -7.501 1.211 1112 2HD1 ILE 153 HD12 ILE 153 -10.936 -7.645 1.934 1113 3HD1 ILE 153 HD11 ILE 153 -11.443 -8.775 0.681 1114 H ASP 154 HN ASP 154 -13.504 -7.903 6.372 1115 HA ASP 154 HA ASP 154 -15.864 -6.327 6.622 1116 1HB ASP 154 HB2 ASP 154 -14.107 -7.669 8.688 1117 2HB ASP 154 HB1 ASP 154 -15.644 -6.899 9.085 1118 H GLY 155 HN GLY 155 -12.553 -5.763 7.740 1119 1HA GLY 155 HA2 GLY 155 -13.087 -3.441 9.295 1120 2HA GLY 155 HA1 GLY 155 -11.528 -3.838 8.582 1121 H ILE 156 HN ILE 156 -11.883 -3.626 5.907 1122 HA ILE 156 HA ILE 156 -12.104 -0.774 5.560 1123 HB ILE 156 HB ILE 156 -10.627 -2.320 4.201 1124 1HG1 ILE 156 HG12 ILE 156 -11.101 -1.072 2.040 1125 2HG1 ILE 156 HG11 ILE 156 -12.534 -0.408 2.817 1126 1HG2 ILE 156 HG22 ILE 156 -12.565 -3.955 3.813 1127 2HG2 ILE 156 HG21 ILE 156 -13.129 -2.821 2.586 1128 3HG2 ILE 156 HG23 ILE 156 -11.550 -3.589 2.420 1129 1HD1 ILE 156 HD11 ILE 156 -9.925 -0.134 4.273 1130 2HD1 ILE 156 HD13 ILE 156 -10.197 0.887 2.863 1131 3HD1 ILE 156 HD12 ILE 156 -11.309 0.958 4.225 1132 H GLN 157 HN GLN 157 -14.266 -3.490 4.756 1133 HA GLN 157 HA GLN 157 -16.191 -1.860 3.371 1134 1HB GLN 157 HB2 GLN 157 -16.465 -4.527 4.782 1135 2HB GLN 157 HB1 GLN 157 -17.786 -3.762 3.894 1136 1HG GLN 157 HG2 GLN 157 -16.383 -3.716 1.856 1137 2HG GLN 157 HG1 GLN 157 -15.078 -4.504 2.743 1138 1HE2 GLN 157 HE22 GLN 157 -17.890 -7.234 3.095 1139 2HE2 GLN 157 HE21 GLN 157 -17.624 -5.930 4.148 1140 H ALA 158 HN ALA 158 -15.819 -2.805 6.778 1141 HA ALA 158 HA ALA 158 -18.275 -1.710 7.722 1142 1HB ALA 158 HB1 ALA 158 -15.574 -1.938 9.091 1143 2HB ALA 158 HB3 ALA 158 -17.075 -1.523 9.919 1144 3HB ALA 158 HB2 ALA 158 -16.891 -3.107 9.166 1145 H ILE 159 HN ILE 159 -15.092 -0.236 7.163 1146 HA ILE 159 HA ILE 159 -15.777 2.355 8.212 1147 HB ILE 159 HB ILE 159 -13.691 1.459 6.201 1148 1HG1 ILE 159 HG12 ILE 159 -13.384 2.368 9.076 1149 2HG1 ILE 159 HG11 ILE 159 -13.585 0.674 8.623 1150 1HG2 ILE 159 HG22 ILE 159 -14.263 4.168 7.416 1151 2HG2 ILE 159 HG21 ILE 159 -12.645 3.731 6.865 1152 3HG2 ILE 159 HG23 ILE 159 -13.987 3.764 5.722 1153 1HD1 ILE 159 HD12 ILE 159 -11.432 2.421 7.418 1154 2HD1 ILE 159 HD11 ILE 159 -11.173 1.490 8.893 1155 3HD1 ILE 159 HD13 ILE 159 -11.549 0.662 7.382 1156 H TYR 160 HN TYR 160 -15.710 1.063 4.869 1157 HA TYR 160 HA TYR 160 -17.218 3.464 3.947 1158 1HB TYR 160 HB2 TYR 160 -15.813 1.227 2.472 1159 2HB TYR 160 HB1 TYR 160 -16.811 2.435 1.663 1160 HD1 TYR 160 HD2 TYR 160 -16.137 4.788 1.580 1161 HD2 TYR 160 HD1 TYR 160 -13.677 1.830 3.488 1162 HE1 TYR 160 HE2 TYR 160 -14.237 6.381 1.597 1163 HE2 TYR 160 HE1 TYR 160 -11.776 3.422 3.506 1164 HH TYR 160 HH TYR 160 -11.065 5.448 2.177 1165 H GLY 161 HN GLY 161 -17.408 -0.018 3.112 1166 1HA GLY 161 HA2 GLY 161 -19.835 -0.783 4.077 1167 2HA GLY 161 HA1 GLY 161 -20.317 0.259 2.738 1168 H ARG 162 HN ARG 162 -21.261 -1.761 1.853 1169 HA ARG 162 HA ARG 162 -19.367 -3.805 0.878 1170 1HB ARG 162 HB2 ARG 162 -22.373 -3.494 0.678 1171 2HB ARG 162 HB1 ARG 162 -21.487 -4.825 -0.066 1172 1HG ARG 162 HG2 ARG 162 -20.589 -5.460 2.140 1173 2HG ARG 162 HG1 ARG 162 -21.482 -4.140 2.889 1174 1HD ARG 162 HD2 ARG 162 -23.585 -5.173 1.885 1175 2HD ARG 162 HD1 ARG 162 -22.612 -6.589 1.505 1176 HE ARG 162 HE ARG 162 -23.752 -5.923 4.059 1177 1HH1 ARG 162 HH21 ARG 162 -20.834 -7.124 2.660 1178 2HH1 ARG 162 HH22 ARG 162 -20.226 -7.738 4.160 1179 1HH2 ARG 162 HH11 ARG 162 -22.973 -6.719 6.004 1180 2HH2 ARG 162 HH12 ARG 162 -21.435 -7.512 6.049 1181 H SER 163 HN SER 163 -19.045 -4.235 -1.378 1182 HA SER 163 HA SER 163 -19.074 -1.839 -3.038 1183 1HB SER 163 HB2 SER 163 -18.231 -4.702 -3.510 1184 2HB SER 163 HB1 SER 163 -18.202 -3.500 -4.796 1185 HG SER 163 HG SER 163 -16.426 -3.911 -2.864 1186 H GLN 164 HN GLN 164 -21.397 -1.451 -3.158 1187 HA GLN 164 HA GLN 164 -23.171 -3.434 -4.320 1188 1HB GLN 164 HB2 GLN 164 -23.443 -0.446 -3.902 1189 2HB GLN 164 HB1 GLN 164 -24.728 -1.450 -4.572 1190 1HG GLN 164 HG2 GLN 164 -24.776 -2.812 -2.548 1191 2HG GLN 164 HG1 GLN 164 -23.407 -1.920 -1.883 1192 1HE2 GLN 164 HE22 GLN 164 -26.772 -0.506 -0.714 1193 2HE2 GLN 164 HE21 GLN 164 -26.227 -2.110 -0.817 1194 H ASN 165 HN ASN 165 -23.633 -3.776 -6.463 1195 HA ASN 165 HA ASN 165 -22.955 -1.773 -8.492 1196 1HB ASN 165 HB2 ASN 165 -21.545 -4.460 -8.394 1197 2HB ASN 165 HB1 ASN 165 -21.447 -3.327 -9.738 1198 1HD2 ASN 165 HD22 ASN 165 -19.398 -2.537 -6.280 1199 2HD2 ASN 165 HD21 ASN 165 -20.577 -3.758 -6.305 1200 HA PRO 166 HA PRO 166 -26.486 -3.702 -10.380 1201 1HB PRO 166 HB2 PRO 166 -25.489 -3.601 -13.099 1202 2HB PRO 166 HB1 PRO 166 -26.658 -2.517 -12.332 1203 1HG PRO 166 HG2 PRO 166 -23.861 -1.983 -12.974 1204 2HG PRO 166 HG1 PRO 166 -25.076 -0.857 -12.352 1205 1HD PRO 166 HD2 PRO 166 -22.866 -1.928 -10.902 1206 2HD PRO 166 HD1 PRO 166 -24.216 -0.991 -10.234 1207 H VAL 167 HN VAL 167 -26.925 -5.871 -10.530 1208 HA VAL 167 HA VAL 167 -24.678 -7.743 -10.989 1209 HB VAL 167 HB VAL 167 -27.569 -8.313 -10.261 1210 1HG1 VAL 167 HG13 VAL 167 -25.035 -9.973 -10.185 1211 2HG1 VAL 167 HG12 VAL 167 -26.546 -10.453 -9.413 1212 3HG1 VAL 167 HG11 VAL 167 -26.469 -10.269 -11.166 1213 1HG2 VAL 167 HG21 VAL 167 -25.101 -7.921 -8.540 1214 2HG2 VAL 167 HG23 VAL 167 -26.560 -6.931 -8.534 1215 3HG2 VAL 167 HG22 VAL 167 -26.619 -8.593 -7.947 1216 H GLN 168 HN GLN 168 -24.309 -8.497 -13.018 1217 HA GLN 168 HA GLN 168 -26.241 -8.078 -15.143 1218 1HB GLN 168 HB2 GLN 168 -23.753 -9.789 -15.307 1219 2HB GLN 168 HB1 GLN 168 -24.530 -8.885 -16.605 1220 1HG GLN 168 HG2 GLN 168 -24.009 -6.770 -15.321 1221 2HG GLN 168 HG1 GLN 168 -23.033 -7.757 -14.230 1222 1HE2 GLN 168 HE22 GLN 168 -20.387 -8.205 -16.558 1223 2HE2 GLN 168 HE21 GLN 168 -21.064 -8.736 -15.096 1224 HA PRO 169 HA PRO 169 -28.434 -11.926 -14.813 1225 1HB PRO 169 HB2 PRO 169 -28.441 -12.530 -17.650 1226 2HB PRO 169 HB1 PRO 169 -29.759 -11.859 -16.680 1227 1HG PRO 169 HG2 PRO 169 -28.072 -10.474 -18.606 1228 2HG PRO 169 HG1 PRO 169 -29.462 -9.837 -17.714 1229 1HD PRO 169 HD2 PRO 169 -26.708 -9.192 -17.274 1230 2HD PRO 169 HD1 PRO 169 -28.093 -8.698 -16.282 No H/Q in entry = 1230 Start of MODEL 25 1 1H VAL 1 HT2 VAL 1 -7.838 9.704 13.194 2 2H VAL 1 HT1 VAL 1 -7.076 8.280 13.724 3 3H VAL 1 HT3 VAL 1 -8.768 8.387 13.732 4 HA VAL 1 HA VAL 1 -8.824 9.823 15.534 5 HB VAL 1 HB VAL 1 -6.924 8.754 17.093 6 1HG1 VAL 1 HG11 VAL 1 -9.165 7.126 15.852 7 2HG1 VAL 1 HG13 VAL 1 -8.347 6.758 17.371 8 3HG1 VAL 1 HG12 VAL 1 -9.328 8.217 17.227 9 1HG2 VAL 1 HG21 VAL 1 -5.724 7.934 14.986 10 2HG2 VAL 1 HG23 VAL 1 -6.002 6.723 16.238 11 3HG2 VAL 1 HG22 VAL 1 -7.037 6.771 14.809 12 H LEU 2 HN LEU 2 -5.767 9.880 13.826 13 HA LEU 2 HA LEU 2 -4.694 12.062 15.508 14 1HB LEU 2 HB2 LEU 2 -3.632 10.872 12.923 15 2HB LEU 2 HB1 LEU 2 -2.756 11.953 14.006 16 HG LEU 2 HG LEU 2 -3.775 9.185 14.712 17 1HD1 LEU 2 HD11 LEU 2 -0.993 10.264 14.177 18 2HD1 LEU 2 HD13 LEU 2 -1.326 8.671 14.855 19 3HD1 LEU 2 HD12 LEU 2 -1.864 9.062 13.223 20 1HD2 LEU 2 HD23 LEU 2 -2.484 11.391 16.312 21 2HD2 LEU 2 HD22 LEU 2 -3.805 10.312 16.761 22 3HD2 LEU 2 HD21 LEU 2 -2.152 9.710 16.734 23 H THR 3 HN THR 3 -6.814 11.742 12.916 24 HA THR 3 HA THR 3 -6.153 14.371 11.700 25 HB THR 3 HB THR 3 -7.929 13.796 10.087 26 HG1 THR 3 HG1 THR 3 -8.192 11.261 11.187 27 1HG2 THR 3 HG21 THR 3 -5.530 12.834 9.966 28 2HG2 THR 3 HG23 THR 3 -6.265 11.313 10.476 29 3HG2 THR 3 HG22 THR 3 -6.770 12.076 8.968 30 H GLU 4 HN GLU 4 -8.146 15.829 11.331 31 HA GLU 4 HA GLU 4 -9.338 16.373 13.916 32 1HB GLU 4 HB2 GLU 4 -8.748 18.123 12.208 33 2HB GLU 4 HB1 GLU 4 -10.093 17.544 11.225 34 1HG GLU 4 HG2 GLU 4 -11.663 18.043 13.048 35 2HG GLU 4 HG1 GLU 4 -10.327 18.582 14.064 36 H GLY 5 HN GLY 5 -10.465 14.350 14.292 37 1HA GLY 5 HA2 GLY 5 -12.320 12.919 14.230 38 2HA GLY 5 HA1 GLY 5 -13.220 14.391 13.871 39 H ASN 6 HN ASN 6 -10.744 13.113 11.687 40 HA ASN 6 HA ASN 6 -12.743 11.809 9.969 41 1HB ASN 6 HB2 ASN 6 -11.465 14.450 9.240 42 2HB ASN 6 HB1 ASN 6 -12.112 13.352 8.021 43 1HD2 ASN 6 HD22 ASN 6 -14.677 15.423 10.445 44 2HD2 ASN 6 HD21 ASN 6 -13.018 15.384 10.802 45 HA PRO 7 HA PRO 7 -8.312 10.420 9.552 46 1HB PRO 7 HB2 PRO 7 -8.863 7.762 10.331 47 2HB PRO 7 HB1 PRO 7 -8.179 9.018 11.368 48 1HG PRO 7 HG2 PRO 7 -10.889 7.869 11.433 49 2HG PRO 7 HG1 PRO 7 -10.085 8.879 12.642 50 1HD PRO 7 HD2 PRO 7 -12.125 9.694 10.770 51 2HD PRO 7 HD1 PRO 7 -11.258 10.718 11.933 52 H ARG 8 HN ARG 8 -10.118 10.823 7.464 53 HA ARG 8 HA ARG 8 -9.571 8.442 5.776 54 1HB ARG 8 HB2 ARG 8 -12.341 9.641 6.101 55 2HB ARG 8 HB1 ARG 8 -11.896 8.414 4.915 56 1HG ARG 8 HG2 ARG 8 -11.213 6.909 6.799 57 2HG ARG 8 HG1 ARG 8 -11.816 8.118 7.931 58 1HD ARG 8 HD2 ARG 8 -13.468 6.747 5.790 59 2HD ARG 8 HD1 ARG 8 -13.524 6.392 7.516 60 HE ARG 8 HE ARG 8 -14.038 9.106 7.391 61 1HH1 ARG 8 HH21 ARG 8 -15.337 6.241 5.955 62 2HH1 ARG 8 HH22 ARG 8 -16.932 6.898 5.789 63 1HH2 ARG 8 HH11 ARG 8 -16.101 9.966 7.167 64 2HH2 ARG 8 HH12 ARG 8 -17.362 9.007 6.470 65 H TRP 9 HN TRP 9 -9.746 8.926 3.487 66 HA TRP 9 HA TRP 9 -8.884 11.608 2.803 67 1HB TRP 9 HB2 TRP 9 -9.668 9.187 1.153 68 2HB TRP 9 HB1 TRP 9 -9.123 10.700 0.426 69 HD1 TRP 9 HD1 TRP 9 -7.889 7.650 2.282 70 HE1 TRP 9 HE1 TRP 9 -5.315 7.724 2.444 71 HE3 TRP 9 HE3 TRP 9 -7.029 12.380 0.564 72 HZ2 TRP 9 HZ2 TRP 9 -3.172 9.548 1.907 73 HZ3 TRP 9 HZ3 TRP 9 -4.716 13.261 0.403 74 HH2 TRP 9 HH2 TRP 9 -2.790 11.850 1.070 75 H GLU 10 HN GLU 10 -10.130 13.287 1.947 76 HA GLU 10 HA GLU 10 -12.995 13.184 2.346 77 1HB GLU 10 HB2 GLU 10 -11.196 15.228 1.022 78 2HB GLU 10 HB1 GLU 10 -12.935 15.454 1.228 79 1HG GLU 10 HG2 GLU 10 -12.685 15.178 3.666 80 2HG GLU 10 HG1 GLU 10 -10.947 14.954 3.463 81 H GLN 11 HN GLN 11 -10.897 12.898 -0.489 82 HA GLN 11 HA GLN 11 -13.208 12.879 -2.317 83 1HB GLN 11 HB2 GLN 11 -10.243 12.406 -2.745 84 2HB GLN 11 HB1 GLN 11 -11.441 12.341 -4.038 85 1HG GLN 11 HG2 GLN 11 -12.071 14.656 -3.635 86 2HG GLN 11 HG1 GLN 11 -10.996 14.739 -2.241 87 1HE2 GLN 11 HE22 GLN 11 -9.208 16.130 -5.245 88 2HE2 GLN 11 HE21 GLN 11 -10.672 16.512 -4.475 89 H THR 12 HN THR 12 -13.980 11.030 -3.389 90 HA THR 12 HA THR 12 -13.392 8.455 -2.043 91 HB THR 12 HB THR 12 -15.303 7.614 -3.394 92 HG1 THR 12 HG1 THR 12 -16.355 9.003 -4.754 93 1HG2 THR 12 HG23 THR 12 -15.695 8.696 -1.192 94 2HG2 THR 12 HG22 THR 12 -15.904 10.244 -2.013 95 3HG2 THR 12 HG21 THR 12 -17.045 8.932 -2.300 96 H HIS 13 HN HIS 13 -12.173 10.200 -4.559 97 HA HIS 13 HA HIS 13 -11.248 7.764 -6.047 98 1HB HIS 13 HB2 HIS 13 -11.704 10.580 -7.094 99 2HB HIS 13 HB1 HIS 13 -11.052 9.237 -8.031 100 HD1 HIS 13 HD1 HIS 13 -14.184 9.957 -5.962 101 HD2 HIS 13 HD2 HIS 13 -13.017 7.859 -9.367 102 HE1 HIS 13 HE1 HIS 13 -16.296 8.979 -6.960 103 H LEU 14 HN LEU 14 -9.021 7.596 -6.190 104 HA LEU 14 HA LEU 14 -7.376 9.961 -5.336 105 1HB LEU 14 HB2 LEU 14 -6.988 7.073 -4.493 106 2HB LEU 14 HB1 LEU 14 -5.936 8.419 -4.067 107 HG LEU 14 HG LEU 14 -8.881 8.261 -3.341 108 1HD1 LEU 14 HD12 LEU 14 -6.375 7.459 -1.860 109 2HD1 LEU 14 HD11 LEU 14 -7.825 7.949 -0.983 110 3HD1 LEU 14 HD13 LEU 14 -7.876 6.554 -2.062 111 1HD2 LEU 14 HD22 LEU 14 -6.663 10.236 -2.797 112 2HD2 LEU 14 HD21 LEU 14 -8.331 10.544 -3.265 113 3HD2 LEU 14 HD23 LEU 14 -7.960 10.042 -1.620 114 H THR 15 HN THR 15 -5.112 9.799 -6.058 115 HA THR 15 HA THR 15 -4.723 8.047 -8.467 116 HB THR 15 HB THR 15 -3.569 9.916 -9.557 117 HG1 THR 15 HG1 THR 15 -4.352 11.907 -7.971 118 1HG2 THR 15 HG22 THR 15 -6.078 9.648 -9.724 119 2HG2 THR 15 HG21 THR 15 -6.222 10.893 -8.484 120 3HG2 THR 15 HG23 THR 15 -5.487 11.278 -10.040 121 H TYR 16 HN TYR 16 -2.400 7.614 -8.921 122 HA TYR 16 HA TYR 16 -0.538 8.236 -6.689 123 1HB TYR 16 HB2 TYR 16 0.107 5.896 -6.372 124 2HB TYR 16 HB1 TYR 16 -1.614 6.091 -6.057 125 HD1 TYR 16 HD2 TYR 16 -3.295 5.291 -7.660 126 HD2 TYR 16 HD1 TYR 16 0.902 4.633 -8.285 127 HE1 TYR 16 HE2 TYR 16 -3.820 3.575 -9.370 128 HE2 TYR 16 HE1 TYR 16 0.379 2.913 -9.994 129 HH TYR 16 HH TYR 16 -2.468 1.437 -10.302 130 H ARG 17 HN ARG 17 1.698 7.861 -7.235 131 HA ARG 17 HA ARG 17 2.311 7.237 -10.073 132 1HB ARG 17 HB2 ARG 17 1.905 9.691 -9.995 133 2HB ARG 17 HB1 ARG 17 3.150 9.839 -8.756 134 1HG ARG 17 HG2 ARG 17 4.824 8.908 -10.320 135 2HG ARG 17 HG1 ARG 17 3.578 8.758 -11.558 136 1HD ARG 17 HD2 ARG 17 3.216 11.193 -11.491 137 2HD ARG 17 HD1 ARG 17 4.461 11.343 -10.252 138 HE ARG 17 HE ARG 17 5.769 10.055 -12.310 139 1HH1 ARG 17 HH21 ARG 17 3.826 12.877 -11.984 140 2HH1 ARG 17 HH22 ARG 17 4.642 13.747 -13.239 141 1HH2 ARG 17 HH11 ARG 17 6.851 11.167 -13.948 142 2HH2 ARG 17 HH12 ARG 17 6.354 12.775 -14.357 143 H ILE 18 HN ILE 18 4.354 6.364 -10.316 144 HA ILE 18 HA ILE 18 5.870 5.832 -7.813 145 HB ILE 18 HB ILE 18 6.181 4.681 -10.605 146 1HG1 ILE 18 HG12 ILE 18 5.033 3.397 -8.106 147 2HG1 ILE 18 HG11 ILE 18 4.040 4.134 -9.362 148 1HG2 ILE 18 HG23 ILE 18 7.456 3.972 -7.945 149 2HG2 ILE 18 HG22 ILE 18 7.559 2.967 -9.391 150 3HG2 ILE 18 HG21 ILE 18 8.280 4.575 -9.383 151 1HD1 ILE 18 HD13 ILE 18 6.076 1.991 -9.995 152 2HD1 ILE 18 HD12 ILE 18 4.419 1.600 -9.539 153 3HD1 ILE 18 HD11 ILE 18 4.732 2.547 -10.993 154 H GLU 19 HN GLU 19 7.596 7.100 -7.360 155 HA GLU 19 HA GLU 19 8.566 9.089 -9.199 156 1HB GLU 19 HB2 GLU 19 9.642 8.058 -6.569 157 2HB GLU 19 HB1 GLU 19 10.394 9.378 -7.463 158 1HG GLU 19 HG2 GLU 19 7.472 9.380 -6.671 159 2HG GLU 19 HG1 GLU 19 8.739 10.104 -5.680 160 H ASN 20 HN ASN 20 9.830 5.894 -8.229 161 HA ASN 20 HA ASN 20 11.425 5.827 -10.701 162 1HB ASN 20 HB2 ASN 20 12.723 5.895 -7.965 163 2HB ASN 20 HB1 ASN 20 13.559 5.398 -9.436 164 1HD2 ASN 20 HD22 ASN 20 13.505 9.255 -8.608 165 2HD2 ASN 20 HD21 ASN 20 13.345 7.998 -7.480 166 H TYR 21 HN TYR 21 12.552 3.705 -10.940 167 HA TYR 21 HA TYR 21 11.096 1.516 -9.483 168 1HB TYR 21 HB2 TYR 21 12.348 1.602 -12.245 169 2HB TYR 21 HB1 TYR 21 11.745 0.129 -11.489 170 HD1 TYR 21 HD1 TYR 21 9.342 -0.223 -11.135 171 HD2 TYR 21 HD2 TYR 21 10.835 3.364 -12.968 172 HE1 TYR 21 HE1 TYR 21 7.048 0.340 -11.907 173 HE2 TYR 21 HE2 TYR 21 8.549 3.924 -13.737 174 HH TYR 21 HH TYR 21 5.758 1.918 -12.846 175 H THR 22 HN THR 22 12.343 0.130 -8.271 176 HA THR 22 HA THR 22 15.160 0.659 -7.969 177 HB THR 22 HB THR 22 14.070 -0.142 -6.026 178 HG1 THR 22 HG1 THR 22 15.154 -2.118 -5.643 179 1HG2 THR 22 HG23 THR 22 12.973 -2.281 -7.849 180 2HG2 THR 22 HG22 THR 22 12.934 -2.441 -6.096 181 3HG2 THR 22 HG21 THR 22 12.084 -1.110 -6.878 182 HA PRO 23 HA PRO 23 16.463 -1.934 -11.378 183 1HB PRO 23 HB2 PRO 23 19.020 -2.615 -10.256 184 2HB PRO 23 HB1 PRO 23 18.675 -1.335 -11.429 185 1HG PRO 23 HG2 PRO 23 19.307 -1.059 -8.583 186 2HG PRO 23 HG1 PRO 23 19.169 0.211 -9.807 187 1HD PRO 23 HD2 PRO 23 17.300 -0.359 -7.713 188 2HD PRO 23 HD1 PRO 23 17.094 0.789 -9.056 189 H ASP 24 HN ASP 24 15.675 -2.933 -8.333 190 HA ASP 24 HA ASP 24 16.677 -5.622 -8.226 191 1HB ASP 24 HB2 ASP 24 14.234 -4.324 -6.994 192 2HB ASP 24 HB1 ASP 24 14.702 -5.995 -6.674 193 H LEU 25 HN LEU 25 13.715 -4.218 -9.610 194 HA LEU 25 HA LEU 25 13.357 -6.728 -11.165 195 1HB LEU 25 HB2 LEU 25 11.261 -5.326 -9.500 196 2HB LEU 25 HB1 LEU 25 10.849 -6.485 -10.753 197 HG LEU 25 HG LEU 25 12.768 -7.189 -8.522 198 1HD1 LEU 25 HD11 LEU 25 9.752 -7.213 -8.532 199 2HD1 LEU 25 HD13 LEU 25 10.669 -8.340 -7.532 200 3HD1 LEU 25 HD12 LEU 25 10.846 -6.603 -7.291 201 1HD2 LEU 25 HD21 LEU 25 11.058 -8.765 -10.472 202 2HD2 LEU 25 HD23 LEU 25 12.816 -8.773 -10.334 203 3HD2 LEU 25 HD22 LEU 25 11.832 -9.498 -9.070 204 HA PRO 26 HA PRO 26 12.690 -3.870 -14.496 205 1HB PRO 26 HB2 PRO 26 10.647 -5.386 -15.839 206 2HB PRO 26 HB1 PRO 26 12.380 -5.376 -16.197 207 1HG PRO 26 HG2 PRO 26 10.810 -7.466 -14.863 208 2HG PRO 26 HG1 PRO 26 12.479 -7.542 -15.450 209 1HD PRO 26 HD2 PRO 26 11.659 -7.396 -12.726 210 2HD PRO 26 HD1 PRO 26 13.313 -7.213 -13.352 211 H ARG 27 HN ARG 27 11.168 -2.222 -15.030 212 HA ARG 27 HA ARG 27 9.209 -1.608 -13.066 213 1HB ARG 27 HB2 ARG 27 8.531 0.206 -14.552 214 2HB ARG 27 HB1 ARG 27 10.292 0.079 -14.513 215 1HG ARG 27 HG2 ARG 27 10.138 -1.362 -16.583 216 2HG ARG 27 HG1 ARG 27 8.429 -0.932 -16.666 217 1HD ARG 27 HD2 ARG 27 9.027 1.456 -16.737 218 2HD ARG 27 HD1 ARG 27 10.739 1.027 -16.682 219 HE ARG 27 HE ARG 27 9.835 -0.376 -18.862 220 1HH1 ARG 27 HH21 ARG 27 9.587 2.864 -17.734 221 2HH1 ARG 27 HH22 ARG 27 9.557 3.560 -19.321 222 1HH2 ARG 27 HH11 ARG 27 9.796 0.503 -20.948 223 2HH2 ARG 27 HH12 ARG 27 9.669 2.218 -21.144 224 H ALA 28 HN ALA 28 9.008 -3.436 -16.043 225 HA ALA 28 HA ALA 28 6.190 -3.367 -16.447 226 1HB ALA 28 HB3 ALA 28 7.797 -4.305 -18.090 227 2HB ALA 28 HB2 ALA 28 8.095 -5.662 -17.003 228 3HB ALA 28 HB1 ALA 28 6.499 -5.440 -17.719 229 H ASP 29 HN ASP 29 8.194 -5.437 -14.373 230 HA ASP 29 HA ASP 29 5.875 -7.006 -13.492 231 1HB ASP 29 HB2 ASP 29 8.789 -6.934 -12.693 232 2HB ASP 29 HB1 ASP 29 7.612 -7.930 -11.837 233 H VAL 30 HN VAL 30 7.716 -4.239 -12.325 234 HA VAL 30 HA VAL 30 6.695 -4.326 -9.627 235 HB VAL 30 HB VAL 30 7.928 -2.118 -11.275 236 1HG1 VAL 30 HG11 VAL 30 6.798 -2.078 -8.491 237 2HG1 VAL 30 HG13 VAL 30 8.250 -1.135 -8.835 238 3HG1 VAL 30 HG12 VAL 30 6.764 -0.822 -9.728 239 1HG2 VAL 30 HG23 VAL 30 9.229 -4.221 -10.468 240 2HG2 VAL 30 HG22 VAL 30 9.930 -2.641 -10.121 241 3HG2 VAL 30 HG21 VAL 30 9.070 -3.520 -8.856 242 H ASP 31 HN ASP 31 5.694 -2.374 -12.489 243 HA ASP 31 HA ASP 31 3.625 -0.944 -11.192 244 1HB ASP 31 HB2 ASP 31 2.598 -0.689 -13.407 245 2HB ASP 31 HB1 ASP 31 4.347 -0.486 -13.525 246 H HIS 32 HN HIS 32 3.574 -4.189 -12.659 247 HA HIS 32 HA HIS 32 0.776 -4.651 -12.371 248 1HB HIS 32 HB2 HIS 32 2.302 -6.143 -13.660 249 2HB HIS 32 HB1 HIS 32 3.038 -6.668 -12.147 250 HD1 HIS 32 HD1 HIS 32 -0.523 -6.431 -13.531 251 HD2 HIS 32 HD2 HIS 32 1.847 -8.984 -11.242 252 HE1 HIS 32 HE1 HIS 32 -1.961 -8.442 -12.983 253 H ALA 33 HN ALA 33 3.502 -5.273 -10.163 254 HA ALA 33 HA ALA 33 2.063 -6.483 -8.052 255 1HB ALA 33 HB2 ALA 33 4.555 -6.277 -8.180 256 2HB ALA 33 HB1 ALA 33 4.395 -4.569 -7.770 257 3HB ALA 33 HB3 ALA 33 3.900 -5.803 -6.612 258 H ILE 34 HN ILE 34 2.856 -3.009 -8.444 259 HA ILE 34 HA ILE 34 1.275 -2.208 -6.162 260 HB ILE 34 HB ILE 34 2.238 -0.605 -8.547 261 1HG1 ILE 34 HG12 ILE 34 4.093 -1.648 -7.346 262 2HG1 ILE 34 HG11 ILE 34 4.079 0.081 -7.025 263 1HG2 ILE 34 HG21 ILE 34 1.060 0.208 -5.892 264 2HG2 ILE 34 HG23 ILE 34 2.050 1.304 -6.857 265 3HG2 ILE 34 HG22 ILE 34 0.538 0.675 -7.512 266 1HD1 ILE 34 HD13 ILE 34 2.633 -0.622 -4.920 267 2HD1 ILE 34 HD12 ILE 34 3.382 -2.194 -5.191 268 3HD1 ILE 34 HD11 ILE 34 4.388 -0.781 -4.881 269 H GLU 35 HN GLU 35 0.661 -2.209 -9.668 270 HA GLU 35 HA GLU 35 -1.902 -0.974 -9.563 271 1HB GLU 35 HB2 GLU 35 -0.633 -1.399 -11.662 272 2HB GLU 35 HB1 GLU 35 -0.931 -3.127 -11.471 273 1HG GLU 35 HG2 GLU 35 -3.366 -2.721 -11.567 274 2HG GLU 35 HG1 GLU 35 -3.068 -0.993 -11.758 275 H LYS 36 HN LYS 36 -0.922 -4.379 -9.269 276 HA LYS 36 HA LYS 36 -3.550 -5.488 -9.142 277 1HB LYS 36 HB2 LYS 36 -1.406 -6.782 -9.448 278 2HB LYS 36 HB1 LYS 36 -1.078 -6.535 -7.733 279 1HG LYS 36 HG2 LYS 36 -3.229 -7.655 -7.180 280 2HG LYS 36 HG1 LYS 36 -3.499 -7.943 -8.899 281 1HD LYS 36 HD2 LYS 36 -1.414 -9.259 -9.018 282 2HD LYS 36 HD1 LYS 36 -1.134 -8.976 -7.302 283 1HE LYS 36 HE2 LYS 36 -3.582 -10.371 -8.428 284 2HE LYS 36 HE1 LYS 36 -2.177 -11.205 -7.765 285 1HZ LYS 36 HZ3 LYS 36 -3.533 -9.141 -6.171 286 2HZ LYS 36 HZ2 LYS 36 -4.197 -10.702 -6.255 287 3HZ LYS 36 HZ1 LYS 36 -2.627 -10.475 -5.648 288 H ALA 37 HN ALA 37 -1.411 -4.206 -6.592 289 HA ALA 37 HA ALA 37 -3.027 -5.000 -4.380 290 1HB ALA 37 HB3 ALA 37 -1.203 -2.592 -4.660 291 2HB ALA 37 HB2 ALA 37 -1.829 -3.224 -3.136 292 3HB ALA 37 HB1 ALA 37 -0.724 -4.197 -4.106 293 H PHE 38 HN PHE 38 -3.020 -1.925 -6.239 294 HA PHE 38 HA PHE 38 -5.090 -0.684 -4.724 295 1HB PHE 38 HB2 PHE 38 -4.113 -0.353 -7.562 296 2HB PHE 38 HB1 PHE 38 -5.520 0.544 -6.995 297 HD1 PHE 38 HD2 PHE 38 -5.217 1.750 -4.655 298 HD2 PHE 38 HD1 PHE 38 -1.981 0.596 -7.239 299 HE1 PHE 38 HE2 PHE 38 -3.747 3.419 -3.558 300 HE2 PHE 38 HE1 PHE 38 -0.514 2.269 -6.144 301 HZ PHE 38 HZ PHE 38 -1.396 3.680 -4.304 302 H GLN 39 HN GLN 39 -5.241 -2.884 -7.526 303 HA GLN 39 HA GLN 39 -8.047 -2.705 -7.949 304 1HB GLN 39 HB2 GLN 39 -6.109 -4.977 -8.437 305 2HB GLN 39 HB1 GLN 39 -7.795 -5.022 -8.945 306 1HG GLN 39 HG2 GLN 39 -7.446 -2.967 -10.276 307 2HG GLN 39 HG1 GLN 39 -5.754 -2.940 -9.779 308 1HE2 GLN 39 HE22 GLN 39 -5.739 -6.406 -11.569 309 2HE2 GLN 39 HE21 GLN 39 -5.977 -6.095 -9.917 310 H LEU 40 HN LEU 40 -6.185 -4.836 -5.764 311 HA LEU 40 HA LEU 40 -8.384 -6.443 -4.915 312 1HB LEU 40 HB2 LEU 40 -5.862 -5.630 -3.446 313 2HB LEU 40 HB1 LEU 40 -6.994 -6.841 -2.851 314 HG LEU 40 HG LEU 40 -5.623 -6.982 -5.552 315 1HD1 LEU 40 HD12 LEU 40 -4.038 -7.123 -3.617 316 2HD1 LEU 40 HD11 LEU 40 -4.953 -8.507 -3.018 317 3HD1 LEU 40 HD13 LEU 40 -4.114 -8.606 -4.566 318 1HD2 LEU 40 HD23 LEU 40 -7.565 -8.731 -4.060 319 2HD2 LEU 40 HD22 LEU 40 -7.457 -8.389 -5.785 320 3HD2 LEU 40 HD21 LEU 40 -6.331 -9.518 -5.044 321 H TRP 41 HN TRP 41 -7.127 -3.369 -3.619 322 HA TRP 41 HA TRP 41 -8.982 -3.298 -1.411 323 1HB TRP 41 HB2 TRP 41 -7.364 -1.136 -2.781 324 2HB TRP 41 HB1 TRP 41 -8.365 -0.833 -1.364 325 HD1 TRP 41 HD1 TRP 41 -4.957 -1.821 -2.299 326 HE1 TRP 41 HE1 TRP 41 -3.677 -2.758 -0.265 327 HE3 TRP 41 HE3 TRP 41 -8.843 -2.510 0.946 328 HZ2 TRP 41 HZ2 TRP 41 -4.231 -3.685 2.381 329 HZ3 TRP 41 HZ3 TRP 41 -8.437 -3.424 3.217 330 HH2 TRP 41 HH2 TRP 41 -6.137 -4.012 3.936 331 H SER 42 HN SER 42 -9.056 -1.923 -4.695 332 HA SER 42 HA SER 42 -11.523 -0.472 -4.304 333 1HB SER 42 HB2 SER 42 -9.914 0.038 -6.124 334 2HB SER 42 HB1 SER 42 -10.305 -1.502 -6.883 335 HG SER 42 HG SER 42 -12.084 -0.653 -7.613 336 H ASN 43 HN ASN 43 -10.798 -3.723 -5.557 337 HA ASN 43 HA ASN 43 -13.289 -4.424 -6.610 338 1HB ASN 43 HB2 ASN 43 -11.332 -6.111 -5.032 339 2HB ASN 43 HB1 ASN 43 -12.717 -6.775 -5.896 340 1HD2 ASN 43 HD22 ASN 43 -11.209 -5.452 -9.091 341 2HD2 ASN 43 HD21 ASN 43 -12.627 -5.082 -8.231 342 H VAL 44 HN VAL 44 -12.383 -4.145 -3.202 343 HA VAL 44 HA VAL 44 -15.132 -5.077 -2.427 344 HB VAL 44 HB VAL 44 -14.004 -5.147 -0.082 345 1HG1 VAL 44 HG11 VAL 44 -13.262 -7.034 -2.333 346 2HG1 VAL 44 HG13 VAL 44 -13.021 -7.396 -0.624 347 3HG1 VAL 44 HG12 VAL 44 -14.651 -7.158 -1.253 348 1HG2 VAL 44 HG22 VAL 44 -11.969 -3.859 -1.064 349 2HG2 VAL 44 HG21 VAL 44 -11.640 -5.227 0.000 350 3HG2 VAL 44 HG23 VAL 44 -11.494 -5.415 -1.748 351 H THR 45 HN THR 45 -13.970 -2.262 -3.279 352 HA THR 45 HA THR 45 -15.581 -0.862 -1.250 353 HB THR 45 HB THR 45 -13.772 0.858 -0.920 354 HG1 THR 45 HG1 THR 45 -12.305 -1.145 -2.279 355 1HG2 THR 45 HG21 THR 45 -14.269 -1.093 0.650 356 2HG2 THR 45 HG23 THR 45 -12.890 -1.911 -0.087 357 3HG2 THR 45 HG22 THR 45 -12.658 -0.391 0.773 358 HA PRO 46 HA PRO 46 -16.668 1.429 -4.906 359 1HB PRO 46 HB2 PRO 46 -17.467 3.839 -3.668 360 2HB PRO 46 HB1 PRO 46 -18.498 2.422 -3.923 361 1HG PRO 46 HG2 PRO 46 -17.257 3.389 -1.409 362 2HG PRO 46 HG1 PRO 46 -18.640 2.303 -1.628 363 1HD PRO 46 HD2 PRO 46 -16.028 1.517 -0.860 364 2HD PRO 46 HD1 PRO 46 -17.332 0.445 -1.420 365 H LEU 47 HN LEU 47 -14.032 2.079 -2.993 366 HA LEU 47 HA LEU 47 -13.276 4.703 -3.978 367 1HB LEU 47 HB2 LEU 47 -11.544 2.480 -2.847 368 2HB LEU 47 HB1 LEU 47 -11.046 4.155 -3.065 369 HG LEU 47 HG LEU 47 -13.292 3.193 -1.262 370 1HD1 LEU 47 HD13 LEU 47 -10.923 2.702 -0.526 371 2HD1 LEU 47 HD12 LEU 47 -10.630 4.440 -0.525 372 3HD1 LEU 47 HD11 LEU 47 -11.825 3.747 0.569 373 1HD2 LEU 47 HD21 LEU 47 -12.300 5.929 -2.071 374 2HD2 LEU 47 HD23 LEU 47 -13.959 5.361 -1.872 375 3HD2 LEU 47 HD22 LEU 47 -12.966 5.694 -0.456 376 H THR 48 HN THR 48 -11.769 5.189 -5.638 377 HA THR 48 HA THR 48 -11.090 2.928 -7.503 378 HB THR 48 HB THR 48 -11.571 4.423 -9.396 379 HG1 THR 48 HG1 THR 48 -11.750 6.466 -9.048 380 1HG2 THR 48 HG22 THR 48 -13.854 4.275 -7.407 381 2HG2 THR 48 HG21 THR 48 -14.029 4.561 -9.138 382 3HG2 THR 48 HG23 THR 48 -13.404 3.017 -8.559 383 H PHE 49 HN PHE 49 -9.050 3.163 -8.549 384 HA PHE 49 HA PHE 49 -7.361 5.476 -7.634 385 1HB PHE 49 HB2 PHE 49 -6.567 2.556 -7.860 386 2HB PHE 49 HB1 PHE 49 -5.459 3.883 -7.495 387 HD1 PHE 49 HD2 PHE 49 -5.599 5.095 -5.360 388 HD2 PHE 49 HD1 PHE 49 -8.205 1.797 -6.237 389 HE1 PHE 49 HE2 PHE 49 -6.242 4.966 -2.967 390 HE2 PHE 49 HE1 PHE 49 -8.850 1.668 -3.846 391 HZ PHE 49 HZ PHE 49 -7.868 3.253 -2.210 392 H THR 50 HN THR 50 -6.373 6.529 -9.293 393 HA THR 50 HA THR 50 -6.182 5.157 -11.965 394 HB THR 50 HB THR 50 -6.563 8.117 -11.407 395 HG1 THR 50 HG1 THR 50 -8.564 7.566 -11.237 396 1HG2 THR 50 HG23 THR 50 -6.606 6.518 -13.981 397 2HG2 THR 50 HG22 THR 50 -6.989 8.234 -13.842 398 3HG2 THR 50 HG21 THR 50 -5.356 7.665 -13.496 399 H LYS 51 HN LYS 51 -4.124 5.017 -12.777 400 HA LYS 51 HA LYS 51 -1.909 6.203 -11.262 401 1HB LYS 51 HB2 LYS 51 -1.786 3.914 -12.329 402 2HB LYS 51 HB1 LYS 51 -1.802 4.707 -13.905 403 1HG LYS 51 HG2 LYS 51 0.267 5.841 -13.453 404 2HG LYS 51 HG1 LYS 51 0.228 5.362 -11.758 405 1HD LYS 51 HD2 LYS 51 1.816 3.956 -12.988 406 2HD LYS 51 HD1 LYS 51 0.454 2.985 -12.432 407 1HE LYS 51 HE2 LYS 51 1.215 2.615 -14.853 408 2HE LYS 51 HE1 LYS 51 -0.506 2.898 -14.609 409 1HZ LYS 51 HZ1 LYS 51 1.480 4.970 -15.373 410 2HZ LYS 51 HZ3 LYS 51 0.400 4.215 -16.438 411 3HZ LYS 51 HZ2 LYS 51 -0.191 5.208 -15.193 412 H VAL 52 HN VAL 52 -0.493 7.865 -12.076 413 HA VAL 52 HA VAL 52 -1.468 9.295 -14.542 414 HB VAL 52 HB VAL 52 -0.852 11.438 -13.421 415 1HG1 VAL 52 HG12 VAL 52 -2.882 9.744 -11.934 416 2HG1 VAL 52 HG11 VAL 52 -2.799 11.505 -11.892 417 3HG1 VAL 52 HG13 VAL 52 -3.189 10.675 -13.398 418 1HG2 VAL 52 HG21 VAL 52 -0.444 9.598 -11.046 419 2HG2 VAL 52 HG23 VAL 52 0.756 10.649 -11.796 420 3HG2 VAL 52 HG22 VAL 52 -0.596 11.351 -10.911 421 H SER 53 HN SER 53 0.126 9.717 -15.999 422 HA SER 53 HA SER 53 2.867 8.830 -15.333 423 1HB SER 53 HB2 SER 53 1.623 8.225 -17.481 424 2HB SER 53 HB1 SER 53 1.863 9.895 -17.981 425 HG SER 53 HG SER 53 4.158 8.867 -17.035 426 H GLU 54 HN GLU 54 1.186 11.719 -15.153 427 HA GLU 54 HA GLU 54 3.720 13.243 -15.020 428 1HB GLU 54 HB2 GLU 54 1.446 13.945 -16.896 429 2HB GLU 54 HB1 GLU 54 2.676 15.105 -16.397 430 1HG GLU 54 HG2 GLU 54 4.436 13.634 -17.316 431 2HG GLU 54 HG1 GLU 54 3.205 12.479 -17.822 432 H GLY 55 HN GLY 55 3.389 15.349 -13.948 433 1HA GLY 55 HA2 GLY 55 2.307 16.790 -12.424 434 2HA GLY 55 HA1 GLY 55 0.799 15.929 -12.740 435 H GLN 56 HN GLN 56 1.473 16.620 -10.127 436 HA GLN 56 HA GLN 56 2.766 14.359 -8.803 437 1HB GLN 56 HB2 GLN 56 1.301 16.797 -7.770 438 2HB GLN 56 HB1 GLN 56 1.997 15.569 -6.710 439 1HG GLN 56 HG2 GLN 56 4.216 15.947 -7.685 440 2HG GLN 56 HG1 GLN 56 3.543 17.132 -8.805 441 1HE2 GLN 56 HE21 GLN 56 5.577 17.489 -6.563 442 2HE2 GLN 56 HE22 GLN 56 4.929 18.717 -5.586 443 H ALA 57 HN ALA 57 1.612 13.103 -7.087 444 HA ALA 57 HA ALA 57 -1.299 12.679 -7.696 445 1HB ALA 57 HB3 ALA 57 0.400 10.936 -8.664 446 2HB ALA 57 HB2 ALA 57 0.533 10.385 -6.995 447 3HB ALA 57 HB1 ALA 57 -1.028 10.349 -7.814 448 H ASP 58 HN ASP 58 -2.533 11.890 -5.871 449 HA ASP 58 HA ASP 58 -1.804 13.036 -3.374 450 1HB ASP 58 HB2 ASP 58 -3.824 10.893 -4.064 451 2HB ASP 58 HB1 ASP 58 -3.673 11.593 -2.451 452 H ILE 59 HN ILE 59 -1.561 9.656 -4.500 453 HA ILE 59 HA ILE 59 0.021 9.035 -2.027 454 HB ILE 59 HB ILE 59 -1.253 7.182 -4.059 455 1HG1 ILE 59 HG12 ILE 59 -1.978 7.663 -1.159 456 2HG1 ILE 59 HG11 ILE 59 -2.788 8.477 -2.499 457 1HG2 ILE 59 HG21 ILE 59 0.354 6.717 -1.540 458 2HG2 ILE 59 HG23 ILE 59 -0.693 5.480 -2.235 459 3HG2 ILE 59 HG22 ILE 59 0.679 6.095 -3.157 460 1HD1 ILE 59 HD11 ILE 59 -3.302 6.203 -3.461 461 2HD1 ILE 59 HD13 ILE 59 -2.676 5.496 -1.972 462 3HD1 ILE 59 HD12 ILE 59 -4.101 6.533 -1.924 463 H MET 60 HN MET 60 2.119 9.513 -2.448 464 HA MET 60 HA MET 60 3.259 8.869 -5.128 465 1HB MET 60 HB2 MET 60 4.299 10.510 -2.806 466 2HB MET 60 HB1 MET 60 5.218 10.193 -4.276 467 1HG MET 60 HG2 MET 60 3.419 11.221 -5.621 468 2HG MET 60 HG1 MET 60 2.509 11.556 -4.149 469 1HE MET 60 HE1 MET 60 5.771 11.766 -5.914 470 2HE MET 60 HE3 MET 60 4.955 13.134 -6.685 471 3HE MET 60 HE2 MET 60 6.374 13.403 -5.676 472 H ILE 61 HN ILE 61 4.732 7.272 -5.376 473 HA ILE 61 HA ILE 61 5.660 5.775 -2.942 474 HB ILE 61 HB ILE 61 5.031 4.738 -5.725 475 1HG1 ILE 61 HG12 ILE 61 3.663 4.114 -3.093 476 2HG1 ILE 61 HG11 ILE 61 3.082 5.352 -4.209 477 1HG2 ILE 61 HG21 ILE 61 6.148 3.435 -3.242 478 2HG2 ILE 61 HG23 ILE 61 5.377 2.503 -4.523 479 3HG2 ILE 61 HG22 ILE 61 6.832 3.442 -4.863 480 1HD1 ILE 61 HD11 ILE 61 2.960 3.621 -6.005 481 2HD1 ILE 61 HD13 ILE 61 3.427 2.401 -4.820 482 3HD1 ILE 61 HD12 ILE 61 1.897 3.259 -4.644 483 H SER 62 HN SER 62 7.872 5.690 -2.748 484 HA SER 62 HA SER 62 9.536 5.944 -5.203 485 1HB SER 62 HB2 SER 62 10.866 7.742 -4.258 486 2HB SER 62 HB1 SER 62 9.177 8.241 -4.280 487 HG SER 62 HG SER 62 10.294 8.621 -2.262 488 H PHE 63 HN PHE 63 11.749 5.318 -4.855 489 HA PHE 63 HA PHE 63 12.136 3.490 -2.504 490 1HB PHE 63 HB2 PHE 63 13.180 3.397 -5.349 491 2HB PHE 63 HB1 PHE 63 13.780 2.350 -4.073 492 HD1 PHE 63 HD1 PHE 63 10.915 3.152 -6.222 493 HD2 PHE 63 HD2 PHE 63 12.386 0.604 -3.097 494 HE1 PHE 63 HE1 PHE 63 9.011 1.607 -6.588 495 HE2 PHE 63 HE2 PHE 63 10.484 -0.944 -3.459 496 HZ PHE 63 HZ PHE 63 8.795 -0.443 -5.206 497 H VAL 64 HN VAL 64 13.903 3.931 -1.191 498 HA VAL 64 HA VAL 64 16.009 5.811 -2.214 499 HB VAL 64 HB VAL 64 15.965 7.014 -0.065 500 1HG1 VAL 64 HG13 VAL 64 14.545 7.840 -1.924 501 2HG1 VAL 64 HG12 VAL 64 13.217 6.836 -1.344 502 3HG1 VAL 64 HG11 VAL 64 13.809 8.170 -0.356 503 1HG2 VAL 64 HG22 VAL 64 13.658 5.134 0.517 504 2HG2 VAL 64 HG21 VAL 64 15.180 5.243 1.402 505 3HG2 VAL 64 HG23 VAL 64 14.016 6.565 1.477 506 H ARG 65 HN ARG 65 17.961 5.798 -0.673 507 HA ARG 65 HA ARG 65 18.355 3.050 0.497 508 1HB ARG 65 HB2 ARG 65 20.297 4.854 -0.973 509 2HB ARG 65 HB1 ARG 65 20.789 3.418 -0.073 510 1HG ARG 65 HG2 ARG 65 19.310 2.037 -1.467 511 2HG ARG 65 HG1 ARG 65 18.830 3.464 -2.380 512 1HD ARG 65 HD2 ARG 65 21.240 3.836 -2.955 513 2HD ARG 65 HD1 ARG 65 21.628 2.296 -2.198 514 HE ARG 65 HE ARG 65 20.618 2.698 -4.860 515 1HH1 ARG 65 HH21 ARG 65 20.156 0.660 -2.112 516 2HH1 ARG 65 HH22 ARG 65 19.343 -0.574 -3.012 517 1HH2 ARG 65 HH11 ARG 65 19.585 1.090 -6.036 518 2HH2 ARG 65 HH12 ARG 65 19.033 -0.338 -5.227 519 H GLY 66 HN GLY 66 19.241 2.947 2.531 520 1HA GLY 66 HA2 GLY 66 19.728 3.712 4.697 521 2HA GLY 66 HA1 GLY 66 20.900 4.724 3.858 522 H ASP 67 HN ASP 67 20.678 6.587 5.047 523 HA ASP 67 HA ASP 67 18.250 7.682 6.024 524 1HB ASP 67 HB2 ASP 67 20.553 8.392 6.719 525 2HB ASP 67 HB1 ASP 67 20.717 9.224 5.173 526 H HIS 68 HN HIS 68 16.694 8.920 5.097 527 HA HIS 68 HA HIS 68 17.099 9.898 2.296 528 1HB HIS 68 HB2 HIS 68 14.754 9.170 1.822 529 2HB HIS 68 HB1 HIS 68 15.840 7.822 2.159 530 HD1 HIS 68 HD1 HIS 68 15.813 7.031 4.807 531 HD2 HIS 68 HD2 HIS 68 12.500 9.162 3.439 532 HE1 HIS 68 HE1 HIS 68 13.947 6.596 6.463 533 H ARG 69 HN ARG 69 17.404 11.558 4.476 534 HA ARG 69 HA ARG 69 16.613 13.548 5.419 535 1HB ARG 69 HB2 ARG 69 14.834 13.420 2.963 536 2HB ARG 69 HB1 ARG 69 14.917 14.806 4.045 537 1HG ARG 69 HG2 ARG 69 17.353 14.983 3.614 538 2HG ARG 69 HG1 ARG 69 17.240 13.621 2.498 539 1HD ARG 69 HD2 ARG 69 15.600 14.899 1.135 540 2HD ARG 69 HD1 ARG 69 15.811 16.280 2.217 541 HE ARG 69 HE ARG 69 18.382 15.772 1.421 542 1HH1 ARG 69 HH21 ARG 69 15.362 16.097 -0.202 543 2HH1 ARG 69 HH22 ARG 69 16.048 16.807 -1.626 544 1HH2 ARG 69 HH11 ARG 69 19.298 16.700 -0.433 545 2HH2 ARG 69 HH12 ARG 69 18.274 17.154 -1.753 546 H ASP 70 HN ASP 70 15.711 11.458 6.806 547 HA ASP 70 HA ASP 70 12.956 12.270 7.567 548 1HB ASP 70 HB2 ASP 70 12.902 10.312 5.912 549 2HB ASP 70 HB1 ASP 70 13.665 9.353 7.178 550 H ASN 71 HN ASN 71 12.371 11.214 9.735 551 HA ASN 71 HA ASN 71 14.751 11.316 11.490 552 1HB ASN 71 HB2 ASN 71 12.597 12.510 12.050 553 2HB ASN 71 HB1 ASN 71 11.843 10.930 12.268 554 1HD2 ASN 71 HD22 ASN 71 12.905 10.959 15.630 555 2HD2 ASN 71 HD21 ASN 71 11.626 10.756 14.530 556 H SER 72 HN SER 72 13.580 8.924 9.677 557 HA SER 72 HA SER 72 14.194 6.824 11.734 558 1HB SER 72 HB2 SER 72 12.010 6.724 9.636 559 2HB SER 72 HB1 SER 72 12.440 5.413 10.730 560 HG SER 72 HG SER 72 10.882 7.575 11.154 561 HA PRO 73 HA PRO 73 16.672 6.440 7.755 562 1HB PRO 73 HB2 PRO 73 19.057 5.999 9.316 563 2HB PRO 73 HB1 PRO 73 18.671 7.408 8.316 564 1HG PRO 73 HG2 PRO 73 18.697 7.235 11.222 565 2HG PRO 73 HG1 PRO 73 18.419 8.664 10.215 566 1HD PRO 73 HD2 PRO 73 16.463 7.196 11.745 567 2HD PRO 73 HD1 PRO 73 16.176 8.590 10.683 568 H PHE 74 HN PHE 74 17.343 4.376 6.937 569 HA PHE 74 HA PHE 74 16.383 2.075 8.425 570 1HB PHE 74 HB2 PHE 74 17.987 2.274 5.854 571 2HB PHE 74 HB1 PHE 74 17.327 0.771 6.497 572 HD1 PHE 74 HD1 PHE 74 14.816 0.556 6.805 573 HD2 PHE 74 HD2 PHE 74 16.620 3.804 4.650 574 HE1 PHE 74 HE1 PHE 74 12.634 1.066 5.743 575 HE2 PHE 74 HE2 PHE 74 14.438 4.316 3.593 576 HZ PHE 74 HZ PHE 74 12.444 2.946 4.139 577 H ASP 75 HN ASP 75 17.568 0.621 9.633 578 HA ASP 75 HA ASP 75 20.468 1.238 10.049 579 1HB ASP 75 HB2 ASP 75 18.884 1.271 12.021 580 2HB ASP 75 HB1 ASP 75 18.636 -0.458 11.769 581 H GLY 76 HN GLY 76 20.538 -0.025 7.820 582 1HA GLY 76 HA2 GLY 76 21.491 -1.962 6.846 583 2HA GLY 76 HA1 GLY 76 21.478 -2.715 8.445 584 HA PRO 77 HA PRO 77 18.073 -4.461 5.677 585 1HB PRO 77 HB2 PRO 77 18.919 -7.124 6.407 586 2HB PRO 77 HB1 PRO 77 19.024 -6.356 4.817 587 1HG PRO 77 HG2 PRO 77 21.187 -6.898 6.689 588 2HG PRO 77 HG1 PRO 77 21.301 -6.240 5.051 589 1HD PRO 77 HD2 PRO 77 21.680 -4.818 7.520 590 2HD PRO 77 HD1 PRO 77 21.677 -4.133 5.882 591 H GLY 78 HN GLY 78 18.909 -4.203 8.877 592 1HA GLY 78 HA2 GLY 78 16.666 -5.895 9.890 593 2HA GLY 78 HA1 GLY 78 17.923 -5.154 10.884 594 H GLY 79 HN GLY 79 15.584 -4.643 11.903 595 1HA GLY 79 HA2 GLY 79 14.335 -2.772 12.637 596 2HA GLY 79 HA1 GLY 79 15.210 -1.782 11.464 597 H ASN 80 HN ASN 80 13.081 -0.839 10.902 598 HA ASN 80 HA ASN 80 11.017 -2.527 9.771 599 1HB ASN 80 HB2 ASN 80 11.506 0.459 9.557 600 2HB ASN 80 HB1 ASN 80 10.069 -0.356 8.943 601 1HD2 ASN 80 HD22 ASN 80 9.160 -1.357 12.420 602 2HD2 ASN 80 HD21 ASN 80 9.484 -2.181 10.973 603 H LEU 81 HN LEU 81 10.466 -2.710 7.510 604 HA LEU 81 HA LEU 81 12.847 -2.561 5.724 605 1HB LEU 81 HB2 LEU 81 10.148 -3.803 5.137 606 2HB LEU 81 HB1 LEU 81 11.670 -4.099 4.300 607 HG LEU 81 HG LEU 81 10.925 -4.913 7.120 608 1HD1 LEU 81 HD13 LEU 81 11.721 -6.430 4.621 609 2HD1 LEU 81 HD12 LEU 81 11.525 -7.172 6.209 610 3HD1 LEU 81 HD11 LEU 81 10.141 -6.434 5.404 611 1HD2 LEU 81 HD21 LEU 81 13.613 -4.793 5.748 612 2HD2 LEU 81 HD23 LEU 81 13.180 -4.227 7.360 613 3HD2 LEU 81 HD22 LEU 81 13.302 -5.955 7.038 614 H ALA 82 HN ALA 82 10.074 -0.794 6.475 615 HA ALA 82 HA ALA 82 10.487 1.144 4.391 616 1HB ALA 82 HB3 ALA 82 8.103 -0.713 4.078 617 2HB ALA 82 HB2 ALA 82 8.321 0.794 3.190 618 3HB ALA 82 HB1 ALA 82 9.444 -0.542 2.947 619 H HIS 83 HN HIS 83 8.484 2.718 4.401 620 HA HIS 83 HA HIS 83 6.764 2.610 6.743 621 1HB HIS 83 HB2 HIS 83 7.705 4.607 7.865 622 2HB HIS 83 HB1 HIS 83 8.865 3.279 7.843 623 HD1 HIS 83 HD1 HIS 83 10.812 3.441 6.038 624 HD2 HIS 83 HD2 HIS 83 8.514 6.896 6.454 625 HE1 HIS 83 HE1 HIS 83 12.114 5.307 4.927 626 H ALA 84 HN ALA 84 5.536 4.759 6.925 627 HA ALA 84 HA ALA 84 5.532 6.371 4.441 628 1HB ALA 84 HB3 ALA 84 3.138 4.767 5.398 629 2HB ALA 84 HB2 ALA 84 3.075 6.010 4.148 630 3HB ALA 84 HB1 ALA 84 4.012 4.539 3.883 631 H PHE 85 HN PHE 85 3.942 8.210 4.678 632 HA PHE 85 HA PHE 85 4.043 9.213 7.476 633 1HB PHE 85 HB2 PHE 85 3.579 10.533 4.794 634 2HB PHE 85 HB1 PHE 85 3.334 11.383 6.322 635 HD1 PHE 85 HD2 PHE 85 5.803 9.811 4.088 636 HD2 PHE 85 HD1 PHE 85 5.215 11.910 7.797 637 HE1 PHE 85 HE2 PHE 85 8.242 10.204 4.257 638 HE2 PHE 85 HE1 PHE 85 7.662 12.300 7.961 639 HZ PHE 85 HZ PHE 85 9.171 11.445 6.188 640 H GLN 86 HN GLN 86 2.034 10.602 8.075 641 HA GLN 86 HA GLN 86 -0.223 8.845 8.065 642 1HB GLN 86 HB2 GLN 86 0.100 11.737 8.899 643 2HB GLN 86 HB1 GLN 86 -1.395 10.834 9.136 644 1HG GLN 86 HG2 GLN 86 -0.060 10.720 11.178 645 2HG GLN 86 HG1 GLN 86 -0.118 9.126 10.429 646 1HE2 GLN 86 HE22 GLN 86 3.437 11.197 10.411 647 2HE2 GLN 86 HE21 GLN 86 1.985 12.045 10.650 648 HA PRO 87 HA PRO 87 -2.138 10.010 4.231 649 1HB PRO 87 HB2 PRO 87 -4.855 10.033 5.177 650 2HB PRO 87 HB1 PRO 87 -4.020 8.707 4.358 651 1HG PRO 87 HG2 PRO 87 -4.709 8.945 7.200 652 2HG PRO 87 HG1 PRO 87 -4.112 7.528 6.324 653 1HD PRO 87 HD2 PRO 87 -2.631 9.105 8.174 654 2HD PRO 87 HD1 PRO 87 -1.985 7.856 7.089 655 H GLY 88 HN GLY 88 -1.393 12.220 4.132 656 1HA GLY 88 HA2 GLY 88 -3.500 14.204 4.630 657 2HA GLY 88 HA1 GLY 88 -2.040 14.434 5.590 658 HA PRO 89 HA PRO 89 -1.713 16.277 1.202 659 1HB PRO 89 HB2 PRO 89 -1.395 18.920 2.294 660 2HB PRO 89 HB1 PRO 89 -2.758 18.313 1.344 661 1HG PRO 89 HG2 PRO 89 -2.653 18.856 4.220 662 2HG PRO 89 HG1 PRO 89 -4.063 18.461 3.224 663 1HD PRO 89 HD2 PRO 89 -2.776 16.738 5.111 664 2HD PRO 89 HD1 PRO 89 -4.053 16.295 3.958 665 H GLY 90 HN GLY 90 0.245 18.054 0.790 666 1HA GLY 90 HA2 GLY 90 2.565 18.375 0.886 667 2HA GLY 90 HA1 GLY 90 2.419 18.122 2.625 668 H ILE 91 HN ILE 91 3.938 16.622 3.149 669 HA ILE 91 HA ILE 91 4.651 14.470 1.310 670 HB ILE 91 HB ILE 91 6.279 15.588 2.877 671 1HG1 ILE 91 HG12 ILE 91 6.027 12.619 3.433 672 2HG1 ILE 91 HG11 ILE 91 6.556 13.250 1.875 673 1HG2 ILE 91 HG23 ILE 91 4.510 15.529 4.785 674 2HG2 ILE 91 HG22 ILE 91 5.076 13.881 5.054 675 3HG2 ILE 91 HG21 ILE 91 6.196 15.234 5.201 676 1HD1 ILE 91 HD12 ILE 91 7.883 13.883 4.522 677 2HD1 ILE 91 HD11 ILE 91 8.468 12.696 3.358 678 3HD1 ILE 91 HD13 ILE 91 8.426 14.404 2.928 679 H GLY 92 HN GLY 92 2.157 14.943 3.514 680 1HA GLY 92 HA2 GLY 92 1.917 12.389 4.755 681 2HA GLY 92 HA1 GLY 92 0.579 13.497 4.472 682 H GLY 93 HN GLY 93 0.970 10.489 4.107 683 1HA GLY 93 HA2 GLY 93 -0.295 9.032 2.706 684 2HA GLY 93 HA1 GLY 93 -0.455 10.331 1.525 685 H ASP 94 HN ASP 94 2.653 10.641 2.027 686 HA ASP 94 HA ASP 94 3.432 9.164 -0.326 687 1HB ASP 94 HB2 ASP 94 5.063 10.578 1.804 688 2HB ASP 94 HB1 ASP 94 5.771 9.835 0.369 689 H ALA 95 HN ALA 95 5.098 7.428 -0.363 690 HA ALA 95 HA ALA 95 5.345 5.865 2.162 691 1HB ALA 95 HB2 ALA 95 3.357 4.975 0.970 692 2HB ALA 95 HB1 ALA 95 4.357 4.687 -0.454 693 3HB ALA 95 HB3 ALA 95 4.667 3.795 1.035 694 H HIS 96 HN HIS 96 7.462 5.447 2.389 695 HA HIS 96 HA HIS 96 9.208 5.343 -0.039 696 1HB HIS 96 HB2 HIS 96 9.874 5.731 2.893 697 2HB HIS 96 HB1 HIS 96 11.046 5.739 1.575 698 HD2 HIS 96 HD2 HIS 96 8.177 7.750 0.084 699 HE1 HIS 96 HE1 HIS 96 10.497 10.414 2.448 700 HE2 HIS 96 HE2 HIS 96 8.718 10.247 0.653 701 H PHE 97 HN PHE 97 10.578 3.567 -0.373 702 HA PHE 97 HA PHE 97 10.135 1.177 1.397 703 1HB PHE 97 HB2 PHE 97 10.413 1.375 -1.610 704 2HB PHE 97 HB1 PHE 97 10.562 -0.148 -0.732 705 HD1 PHE 97 HD1 PHE 97 8.285 2.776 -1.209 706 HD2 PHE 97 HD2 PHE 97 8.629 -1.368 -0.130 707 HE1 PHE 97 HE1 PHE 97 5.814 2.589 -1.124 708 HE2 PHE 97 HE2 PHE 97 6.158 -1.554 -0.051 709 HZ PHE 97 HZ PHE 97 4.749 0.428 -0.551 710 H ASP 98 HN ASP 98 11.957 0.075 2.046 711 HA ASP 98 HA ASP 98 14.504 1.391 1.913 712 1HB ASP 98 HB2 ASP 98 13.685 -0.286 3.681 713 2HB ASP 98 HB1 ASP 98 14.099 -1.551 2.521 714 H GLU 99 HN GLU 99 15.332 1.676 -0.097 715 HA GLU 99 HA GLU 99 15.194 -0.355 -2.171 716 1HB GLU 99 HB2 GLU 99 15.325 2.210 -2.438 717 2HB GLU 99 HB1 GLU 99 17.046 2.025 -2.150 718 1HG GLU 99 HG2 GLU 99 17.239 0.479 -4.039 719 2HG GLU 99 HG1 GLU 99 15.502 0.564 -4.309 720 H ASP 100 HN ASP 100 17.097 -0.125 0.571 721 HA ASP 100 HA ASP 100 19.632 -0.956 -0.603 722 1HB ASP 100 HB2 ASP 100 18.608 -0.941 2.245 723 2HB ASP 100 HB1 ASP 100 20.231 -1.464 1.803 724 H GLU 101 HN GLU 101 16.803 -2.601 0.707 725 HA GLU 101 HA GLU 101 18.173 -5.213 0.685 726 1HB GLU 101 HB2 GLU 101 15.307 -4.400 1.243 727 2HB GLU 101 HB1 GLU 101 15.877 -6.071 1.288 728 1HG GLU 101 HG2 GLU 101 17.492 -5.525 3.028 729 2HG GLU 101 HG1 GLU 101 17.069 -3.817 2.927 730 H ARG 102 HN ARG 102 17.377 -7.001 -0.672 731 HA ARG 102 HA ARG 102 16.753 -6.042 -3.402 732 1HB ARG 102 HB2 ARG 102 18.531 -7.770 -2.951 733 2HB ARG 102 HB1 ARG 102 17.250 -8.879 -2.460 734 1HG ARG 102 HG2 ARG 102 16.189 -8.640 -4.675 735 2HG ARG 102 HG1 ARG 102 17.468 -7.534 -5.171 736 1HD ARG 102 HD2 ARG 102 17.900 -10.388 -4.279 737 2HD ARG 102 HD1 ARG 102 17.853 -9.879 -5.960 738 HE ARG 102 HE ARG 102 20.089 -9.711 -4.126 739 1HH1 ARG 102 HH21 ARG 102 18.527 -7.882 -6.618 740 2HH1 ARG 102 HH22 ARG 102 19.924 -6.905 -6.927 741 1HH2 ARG 102 HH11 ARG 102 21.880 -8.464 -4.534 742 2HH2 ARG 102 HH12 ARG 102 21.816 -7.234 -5.751 743 H TRP 103 HN TRP 103 14.703 -5.938 -4.074 744 HA TRP 103 HA TRP 103 12.563 -7.320 -2.587 745 1HB TRP 103 HB2 TRP 103 12.587 -5.323 -4.863 746 2HB TRP 103 HB1 TRP 103 11.105 -6.034 -4.225 747 HD1 TRP 103 HD1 TRP 103 13.334 -3.163 -3.705 748 HE1 TRP 103 HE1 TRP 103 12.877 -2.047 -1.426 749 HE3 TRP 103 HE3 TRP 103 10.479 -6.779 -1.523 750 HZ2 TRP 103 HZ2 TRP 103 11.476 -2.618 1.010 751 HZ3 TRP 103 HZ3 TRP 103 9.599 -6.474 0.772 752 HH2 TRP 103 HH2 TRP 103 10.094 -4.402 2.040 753 H THR 104 HN THR 104 11.221 -8.929 -3.492 754 HA THR 104 HA THR 104 11.862 -9.903 -6.239 755 HB THR 104 HB THR 104 12.037 -12.211 -5.455 756 HG1 THR 104 HG1 THR 104 12.325 -11.940 -2.878 757 1HG2 THR 104 HG21 THR 104 14.034 -10.537 -5.374 758 2HG2 THR 104 HG23 THR 104 13.830 -10.635 -3.623 759 3HG2 THR 104 HG22 THR 104 14.199 -12.089 -4.551 760 H ASN 105 HN ASN 105 10.180 -11.429 -7.032 761 HA ASN 105 HA ASN 105 7.496 -10.806 -5.841 762 1HB ASN 105 HB2 ASN 105 8.205 -11.666 -8.665 763 2HB ASN 105 HB1 ASN 105 6.600 -11.218 -8.086 764 1HD2 ASN 105 HD22 ASN 105 7.628 -7.701 -7.673 765 2HD2 ASN 105 HD21 ASN 105 6.840 -8.898 -6.761 766 H ASN 106 HN ASN 106 9.328 -12.968 -4.965 767 HA ASN 106 HA ASN 106 7.428 -15.218 -5.333 768 1HB ASN 106 HB2 ASN 106 9.530 -16.709 -5.746 769 2HB ASN 106 HB1 ASN 106 8.882 -15.770 -7.092 770 1HD2 ASN 106 HD22 ASN 106 12.118 -14.438 -7.528 771 2HD2 ASN 106 HD21 ASN 106 10.837 -15.315 -8.212 772 H PHE 107 HN PHE 107 8.925 -17.194 -4.117 773 HA PHE 107 HA PHE 107 8.645 -16.498 -1.339 774 1HB PHE 107 HB2 PHE 107 8.236 -18.764 -2.206 775 2HB PHE 107 HB1 PHE 107 9.939 -18.912 -2.635 776 HD1 PHE 107 HD2 PHE 107 7.579 -18.507 0.201 777 HD2 PHE 107 HD1 PHE 107 11.593 -19.453 -0.994 778 HE1 PHE 107 HE2 PHE 107 8.080 -19.275 2.503 779 HE2 PHE 107 HE1 PHE 107 12.099 -20.221 1.312 780 HZ PHE 107 HZ PHE 107 10.341 -20.134 3.060 781 H ARG 108 HN ARG 108 11.067 -15.573 -3.374 782 HA ARG 108 HA ARG 108 13.448 -16.254 -1.986 783 1HB ARG 108 HB2 ARG 108 12.747 -13.860 -3.688 784 2HB ARG 108 HB1 ARG 108 14.359 -14.109 -3.032 785 1HG ARG 108 HG2 ARG 108 14.481 -16.313 -4.126 786 2HG ARG 108 HG1 ARG 108 12.870 -16.075 -4.799 787 1HD ARG 108 HD2 ARG 108 13.708 -14.038 -5.962 788 2HD ARG 108 HD1 ARG 108 15.326 -14.376 -5.358 789 HE ARG 108 HE ARG 108 14.014 -15.575 -7.649 790 1HH1 ARG 108 HH21 ARG 108 16.088 -16.357 -5.003 791 2HH1 ARG 108 HH22 ARG 108 16.637 -17.836 -5.715 792 1HH2 ARG 108 HH11 ARG 108 14.712 -17.493 -8.574 793 2HH2 ARG 108 HH12 ARG 108 15.858 -18.481 -7.730 794 H GLU 109 HN GLU 109 14.562 -13.680 -1.367 795 HA GLU 109 HA GLU 109 14.284 -13.534 1.357 796 1HB GLU 109 HB2 GLU 109 14.793 -11.253 -0.565 797 2HB GLU 109 HB1 GLU 109 15.050 -11.154 1.176 798 1HG GLU 109 HG2 GLU 109 16.670 -12.980 1.079 799 2HG GLU 109 HG1 GLU 109 16.368 -13.191 -0.643 800 H TYR 110 HN TYR 110 12.521 -11.183 -0.772 801 HA TYR 110 HA TYR 110 10.294 -11.238 1.229 802 1HB TYR 110 HB2 TYR 110 11.696 -8.723 0.286 803 2HB TYR 110 HB1 TYR 110 10.235 -8.767 1.273 804 HD1 TYR 110 HD2 TYR 110 10.302 -9.867 3.531 805 HD2 TYR 110 HD1 TYR 110 13.852 -9.033 1.262 806 HE1 TYR 110 HE2 TYR 110 11.670 -10.129 5.580 807 HE2 TYR 110 HE1 TYR 110 15.226 -9.292 3.313 808 HH TYR 110 HH TYR 110 13.951 -10.636 6.204 809 H ASN 111 HN ASN 111 8.308 -10.362 0.468 810 HA ASN 111 HA ASN 111 8.011 -10.424 -2.506 811 1HB ASN 111 HB2 ASN 111 6.092 -10.827 -0.199 812 2HB ASN 111 HB1 ASN 111 5.520 -10.564 -1.847 813 1HD2 ASN 111 HD22 ASN 111 6.120 -14.276 -1.079 814 2HD2 ASN 111 HD21 ASN 111 5.349 -13.075 -0.158 815 H LEU 112 HN LEU 112 7.962 -8.401 -3.433 816 HA LEU 112 HA LEU 112 7.766 -5.977 -1.961 817 1HB LEU 112 HB2 LEU 112 8.749 -6.062 -4.210 818 2HB LEU 112 HB1 LEU 112 7.176 -6.459 -4.899 819 HG LEU 112 HG LEU 112 6.280 -4.282 -4.126 820 1HD1 LEU 112 HD12 LEU 112 9.030 -4.059 -2.916 821 2HD1 LEU 112 HD11 LEU 112 8.168 -2.600 -3.402 822 3HD1 LEU 112 HD13 LEU 112 7.465 -3.678 -2.200 823 1HD2 LEU 112 HD21 LEU 112 7.356 -4.491 -6.363 824 2HD2 LEU 112 HD23 LEU 112 7.520 -2.868 -5.692 825 3HD2 LEU 112 HD22 LEU 112 8.887 -3.982 -5.649 826 H HIS 113 HN HIS 113 5.229 -7.656 -3.866 827 HA HIS 113 HA HIS 113 3.201 -5.726 -3.389 828 1HB HIS 113 HB2 HIS 113 3.028 -7.623 -5.020 829 2HB HIS 113 HB1 HIS 113 2.788 -8.716 -3.658 830 HD1 HIS 113 HD1 HIS 113 0.774 -7.567 -1.913 831 HD2 HIS 113 HD2 HIS 113 0.584 -6.880 -6.020 832 HE1 HIS 113 HE1 HIS 113 -1.616 -6.899 -2.419 833 H ARG 114 HN ARG 114 4.191 -8.544 -1.450 834 HA ARG 114 HA ARG 114 2.094 -8.484 0.454 835 1HB ARG 114 HB2 ARG 114 3.884 -10.243 0.240 836 2HB ARG 114 HB1 ARG 114 5.013 -9.117 0.983 837 1HG ARG 114 HG2 ARG 114 4.298 -10.394 2.818 838 2HG ARG 114 HG1 ARG 114 3.245 -8.987 2.910 839 1HD ARG 114 HD2 ARG 114 1.430 -10.203 1.856 840 2HD ARG 114 HD1 ARG 114 2.483 -11.574 1.521 841 HE ARG 114 HE ARG 114 2.591 -11.227 4.294 842 1HH1 ARG 114 HH21 ARG 114 0.238 -11.805 1.842 843 2HH1 ARG 114 HH22 ARG 114 -0.882 -12.581 2.911 844 1HH2 ARG 114 HH11 ARG 114 1.133 -12.229 5.710 845 2HH2 ARG 114 HH12 ARG 114 -0.378 -12.814 5.100 846 H VAL 115 HN VAL 115 5.287 -6.865 0.592 847 HA VAL 115 HA VAL 115 4.640 -5.452 3.024 848 HB VAL 115 HB VAL 115 6.736 -4.912 0.896 849 1HG1 VAL 115 HG12 VAL 115 6.225 -3.668 3.605 850 2HG1 VAL 115 HG11 VAL 115 7.803 -3.602 2.821 851 3HG1 VAL 115 HG13 VAL 115 6.405 -2.851 2.053 852 1HG2 VAL 115 HG22 VAL 115 6.786 -6.333 3.575 853 2HG2 VAL 115 HG21 VAL 115 7.135 -7.025 1.990 854 3HG2 VAL 115 HG23 VAL 115 8.244 -5.854 2.705 855 H ALA 116 HN ALA 116 4.588 -4.580 -0.431 856 HA ALA 116 HA ALA 116 3.857 -1.866 -0.161 857 1HB ALA 116 HB2 ALA 116 4.413 -3.159 -2.306 858 2HB ALA 116 HB1 ALA 116 2.731 -3.688 -2.294 859 3HB ALA 116 HB3 ALA 116 3.115 -1.972 -2.423 860 H ALA 117 HN ALA 117 1.778 -4.768 -0.168 861 HA ALA 117 HA ALA 117 -0.700 -3.363 -0.052 862 1HB ALA 117 HB3 ALA 117 0.093 -6.064 1.079 863 2HB ALA 117 HB2 ALA 117 -1.565 -5.462 1.057 864 3HB ALA 117 HB1 ALA 117 -0.710 -5.747 -0.458 865 H HIS 118 HN HIS 118 1.595 -4.322 2.496 866 HA HIS 118 HA HIS 118 -0.006 -3.628 4.741 867 1HB HIS 118 HB2 HIS 118 2.161 -4.837 4.882 868 2HB HIS 118 HB1 HIS 118 2.998 -3.336 4.480 869 HD1 HIS 118 HD1 HIS 118 0.228 -4.206 6.970 870 HD2 HIS 118 HD2 HIS 118 3.873 -2.189 6.830 871 HE1 HIS 118 HE1 HIS 118 0.626 -3.291 9.297 872 H GLU 119 HN GLU 119 2.404 -1.534 3.036 873 HA GLU 119 HA GLU 119 1.817 0.775 4.635 874 1HB GLU 119 HB2 GLU 119 3.091 0.416 1.924 875 2HB GLU 119 HB1 GLU 119 2.737 2.031 2.530 876 1HG GLU 119 HG2 GLU 119 5.009 1.491 3.149 877 2HG GLU 119 HG1 GLU 119 4.035 1.458 4.613 878 H LEU 120 HN LEU 120 0.422 -0.423 1.601 879 HA LEU 120 HA LEU 120 -1.247 1.837 1.094 880 1HB LEU 120 HB2 LEU 120 -1.624 -1.105 0.450 881 2HB LEU 120 HB1 LEU 120 -2.679 0.169 -0.159 882 HG LEU 120 HG LEU 120 0.324 0.094 -0.588 883 1HD1 LEU 120 HD13 LEU 120 -1.967 -0.809 -2.345 884 2HD1 LEU 120 HD12 LEU 120 -0.352 -0.474 -2.969 885 3HD1 LEU 120 HD11 LEU 120 -0.590 -1.761 -1.788 886 1HD2 LEU 120 HD22 LEU 120 -1.886 1.972 -1.388 887 2HD2 LEU 120 HD21 LEU 120 -0.228 2.328 -0.908 888 3HD2 LEU 120 HD23 LEU 120 -0.561 1.716 -2.524 889 H GLY 121 HN GLY 121 -1.678 -1.045 3.115 890 1HA GLY 121 HA2 GLY 121 -4.391 -0.606 3.826 891 2HA GLY 121 HA1 GLY 121 -3.220 -1.448 4.841 892 H HIS 122 HN HIS 122 -1.380 0.728 5.253 893 HA HIS 122 HA HIS 122 -2.714 2.088 7.408 894 1HB HIS 122 HB2 HIS 122 -0.077 2.575 6.001 895 2HB HIS 122 HB1 HIS 122 -0.637 3.603 7.324 896 HD1 HIS 122 HD1 HIS 122 -1.329 2.186 9.584 897 HD2 HIS 122 HD2 HIS 122 1.238 0.309 6.887 898 HE1 HIS 122 HE1 HIS 122 -0.234 0.282 10.843 899 H SER 123 HN SER 123 -1.915 3.029 4.088 900 HA SER 123 HA SER 123 -2.708 5.745 4.251 901 1HB SER 123 HB2 SER 123 -1.562 4.796 2.285 902 2HB SER 123 HB1 SER 123 -2.984 3.827 1.915 903 HG SER 123 HG SER 123 -4.135 5.866 1.794 904 H LEU 124 HN LEU 124 -4.599 2.781 4.027 905 HA LEU 124 HA LEU 124 -7.107 4.230 3.519 906 1HB LEU 124 HB2 LEU 124 -6.628 1.339 4.314 907 2HB LEU 124 HB1 LEU 124 -8.171 2.012 3.789 908 HG LEU 124 HG LEU 124 -5.635 1.909 2.125 909 1HD1 LEU 124 HD12 LEU 124 -6.693 -0.302 2.438 910 2HD1 LEU 124 HD11 LEU 124 -8.237 0.361 1.906 911 3HD1 LEU 124 HD13 LEU 124 -6.887 0.261 0.777 912 1HD2 LEU 124 HD21 LEU 124 -8.373 3.099 1.679 913 2HD2 LEU 124 HD23 LEU 124 -6.792 3.790 1.311 914 3HD2 LEU 124 HD22 LEU 124 -7.442 2.502 0.306 915 H GLY 125 HN GLY 125 -5.181 3.747 6.224 916 1HA GLY 125 HA2 GLY 125 -5.710 4.642 8.389 917 2HA GLY 125 HA1 GLY 125 -7.423 4.570 7.982 918 H LEU 126 HN LEU 126 -5.790 1.707 7.134 919 HA LEU 126 HA LEU 126 -7.195 0.233 9.238 920 1HB LEU 126 HB2 LEU 126 -5.233 -0.714 7.129 921 2HB LEU 126 HB1 LEU 126 -6.183 -1.768 8.176 922 HG LEU 126 HG LEU 126 -7.353 0.262 6.252 923 1HD1 LEU 126 HD12 LEU 126 -6.849 -2.710 6.040 924 2HD1 LEU 126 HD11 LEU 126 -8.084 -1.908 5.069 925 3HD1 LEU 126 HD13 LEU 126 -6.392 -1.437 4.906 926 1HD2 LEU 126 HD21 LEU 126 -8.522 -1.719 8.207 927 2HD2 LEU 126 HD23 LEU 126 -9.009 -0.053 7.887 928 3HD2 LEU 126 HD22 LEU 126 -9.413 -1.322 6.738 929 H SER 127 HN SER 127 -6.274 -0.810 10.975 930 HA SER 127 HA SER 127 -3.460 -0.020 11.643 931 1HB SER 127 HB2 SER 127 -5.847 -0.681 13.378 932 2HB SER 127 HB1 SER 127 -4.214 -0.491 14.007 933 HG SER 127 HG SER 127 -5.624 1.432 13.985 934 H HIS 128 HN HIS 128 -2.203 -1.610 12.854 935 HA HIS 128 HA HIS 128 -2.019 -4.137 11.666 936 1HB HIS 128 HB2 HIS 128 -1.238 -3.276 14.466 937 2HB HIS 128 HB1 HIS 128 -0.723 -4.788 13.715 938 HD1 HIS 128 HD1 HIS 128 1.715 -3.515 14.110 939 HD2 HIS 128 HD2 HIS 128 -0.735 -2.049 11.069 940 HE1 HIS 128 HE1 HIS 128 3.203 -2.142 12.585 941 H SER 129 HN SER 129 -2.322 -6.276 12.969 942 HA SER 129 HA SER 129 -4.725 -6.304 14.701 943 1HB SER 129 HB2 SER 129 -5.575 -6.429 12.344 944 2HB SER 129 HB1 SER 129 -4.600 -7.874 12.104 945 HG SER 129 HG SER 129 -6.135 -7.958 14.367 946 H THR 130 HN THR 130 -5.042 -8.538 15.638 947 HA THR 130 HA THR 130 -2.394 -9.849 15.999 948 HB THR 130 HB THR 130 -3.485 -11.007 17.895 949 HG1 THR 130 HG1 THR 130 -5.592 -10.574 18.380 950 1HG2 THR 130 HG23 THR 130 -3.601 -8.005 17.695 951 2HG2 THR 130 HG22 THR 130 -4.140 -8.817 19.165 952 3HG2 THR 130 HG21 THR 130 -2.480 -9.018 18.607 953 H ASP 131 HN ASP 131 -4.974 -10.219 13.949 954 HA ASP 131 HA ASP 131 -5.164 -13.151 14.084 955 1HB ASP 131 HB2 ASP 131 -7.075 -11.675 13.339 956 2HB ASP 131 HB1 ASP 131 -6.151 -11.314 11.883 957 H ILE 132 HN ILE 132 -3.594 -14.392 13.273 958 HA ILE 132 HA ILE 132 -1.396 -13.500 11.739 959 HB ILE 132 HB ILE 132 -1.535 -15.650 13.027 960 1HG1 ILE 132 HG12 ILE 132 -0.819 -16.067 10.113 961 2HG1 ILE 132 HG11 ILE 132 0.192 -15.160 11.238 962 1HG2 ILE 132 HG21 ILE 132 -3.831 -16.216 12.064 963 2HG2 ILE 132 HG23 ILE 132 -2.993 -16.702 10.591 964 3HG2 ILE 132 HG22 ILE 132 -2.674 -17.546 12.104 965 1HD1 ILE 132 HD11 ILE 132 -0.667 -18.048 11.581 966 2HD1 ILE 132 HD13 ILE 132 0.935 -17.509 11.079 967 3HD1 ILE 132 HD12 ILE 132 0.349 -17.139 12.700 968 H GLY 133 HN GLY 133 -4.570 -14.634 10.742 969 1HA GLY 133 HA2 GLY 133 -3.870 -14.987 7.956 970 2HA GLY 133 HA1 GLY 133 -5.508 -14.897 8.602 971 H ALA 134 HN ALA 134 -3.742 -12.236 9.658 972 HA ALA 134 HA ALA 134 -5.105 -10.505 7.653 973 1HB ALA 134 HB2 ALA 134 -3.690 -9.813 10.246 974 2HB ALA 134 HB1 ALA 134 -4.524 -8.661 9.204 975 3HB ALA 134 HB3 ALA 134 -5.435 -9.933 10.017 976 H LEU 135 HN LEU 135 -3.972 -9.142 6.284 977 HA LEU 135 HA LEU 135 -1.268 -9.869 5.587 978 1HB LEU 135 HB2 LEU 135 -2.896 -7.417 4.833 979 2HB LEU 135 HB1 LEU 135 -1.407 -7.932 4.040 980 HG LEU 135 HG LEU 135 -3.945 -9.594 4.192 981 1HD1 LEU 135 HD13 LEU 135 -2.771 -7.856 2.007 982 2HD1 LEU 135 HD12 LEU 135 -4.007 -9.077 1.706 983 3HD1 LEU 135 HD11 LEU 135 -4.359 -7.708 2.760 984 1HD2 LEU 135 HD21 LEU 135 -1.201 -10.023 3.006 985 2HD2 LEU 135 HD23 LEU 135 -2.215 -11.154 3.903 986 3HD2 LEU 135 HD22 LEU 135 -2.603 -10.761 2.231 987 H MET 136 HN MET 136 -2.707 -7.178 7.376 988 HA MET 136 HA MET 136 -0.239 -5.724 7.734 989 1HB MET 136 HB2 MET 136 -2.798 -5.598 9.346 990 2HB MET 136 HB1 MET 136 -1.527 -4.374 9.313 991 1HG MET 136 HG2 MET 136 -1.897 -4.225 6.802 992 2HG MET 136 HG1 MET 136 -3.335 -5.218 7.040 993 1HE MET 136 HE3 MET 136 -1.821 -1.881 6.886 994 2HE MET 136 HE2 MET 136 -2.580 -0.874 8.115 995 3HE MET 136 HE1 MET 136 -1.465 -2.150 8.597 996 H TYR 137 HN TYR 137 -0.251 -8.612 8.600 997 HA TYR 137 HA TYR 137 -0.203 -8.702 11.449 998 1HB TYR 137 HB2 TYR 137 -0.212 -10.627 9.704 999 2HB TYR 137 HB1 TYR 137 1.540 -10.431 9.691 1000 HD1 TYR 137 HD2 TYR 137 -1.290 -10.678 12.135 1001 HD2 TYR 137 HD1 TYR 137 2.777 -11.704 11.226 1002 HE1 TYR 137 HE2 TYR 137 -1.157 -12.011 14.221 1003 HE2 TYR 137 HE1 TYR 137 2.912 -13.035 13.310 1004 HH TYR 137 HH TYR 137 0.783 -14.271 14.825 1005 HA PRO 138 HA PRO 138 3.515 -6.304 12.111 1006 1HB PRO 138 HB2 PRO 138 4.384 -7.747 14.449 1007 2HB PRO 138 HB1 PRO 138 3.505 -6.213 14.398 1008 1HG PRO 138 HG2 PRO 138 2.487 -8.871 15.092 1009 2HG PRO 138 HG1 PRO 138 1.682 -7.304 15.263 1010 1HD PRO 138 HD2 PRO 138 1.070 -9.306 13.345 1011 2HD PRO 138 HD1 PRO 138 0.453 -7.646 13.360 1012 H SER 139 HN SER 139 3.860 -9.839 12.650 1013 HA SER 139 HA SER 139 6.667 -9.735 11.774 1014 1HB SER 139 HB2 SER 139 4.896 -12.107 12.422 1015 2HB SER 139 HB1 SER 139 6.642 -12.156 12.197 1016 HG SER 139 HG SER 139 5.905 -10.228 13.949 1017 H TYR 140 HN TYR 140 7.451 -10.504 9.798 1018 HA TYR 140 HA TYR 140 5.608 -10.464 7.564 1019 1HB TYR 140 HB2 TYR 140 7.984 -9.775 7.329 1020 2HB TYR 140 HB1 TYR 140 8.485 -11.434 7.665 1021 HD1 TYR 140 HD1 TYR 140 8.104 -13.231 6.039 1022 HD2 TYR 140 HD2 TYR 140 6.879 -9.193 5.216 1023 HE1 TYR 140 HE1 TYR 140 7.777 -13.817 3.651 1024 HE2 TYR 140 HE2 TYR 140 6.552 -9.782 2.825 1025 HH TYR 140 HH TYR 140 7.810 -12.200 1.330 1026 H THR 141 HN THR 141 4.634 -12.220 6.532 1027 HA THR 141 HA THR 141 5.572 -14.957 7.173 1028 HB THR 141 HB THR 141 3.242 -15.647 7.820 1029 HG1 THR 141 HG1 THR 141 2.480 -13.196 8.620 1030 1HG2 THR 141 HG22 THR 141 5.081 -15.101 9.477 1031 2HG2 THR 141 HG21 THR 141 4.352 -13.504 9.643 1032 3HG2 THR 141 HG23 THR 141 3.440 -14.941 10.100 1033 H PHE 142 HN PHE 142 5.452 -16.156 5.353 1034 HA PHE 142 HA PHE 142 4.017 -15.116 3.006 1035 1HB PHE 142 HB2 PHE 142 6.276 -16.192 2.821 1036 2HB PHE 142 HB1 PHE 142 5.551 -17.714 3.336 1037 HD1 PHE 142 HD1 PHE 142 5.730 -15.210 0.640 1038 HD2 PHE 142 HD2 PHE 142 4.049 -18.963 1.876 1039 HE1 PHE 142 HE1 PHE 142 5.036 -15.667 -1.696 1040 HE2 PHE 142 HE2 PHE 142 3.348 -19.419 -0.460 1041 HZ PHE 142 HZ PHE 142 3.847 -17.770 -2.246 1042 H SER 143 HN SER 143 2.010 -15.857 2.336 1043 HA SER 143 HA SER 143 0.992 -18.425 3.464 1044 1HB SER 143 HB2 SER 143 -0.535 -15.806 3.563 1045 2HB SER 143 HB1 SER 143 -1.133 -17.377 4.091 1046 HG SER 143 HG SER 143 -0.291 -16.122 5.825 1047 H GLY 144 HN GLY 144 1.234 -19.239 1.315 1048 1HA GLY 144 HA2 GLY 144 0.604 -19.610 -0.920 1049 2HA GLY 144 HA1 GLY 144 -1.017 -19.266 -0.314 1050 H ASP 145 HN ASP 145 -1.851 -17.961 -1.899 1051 HA ASP 145 HA ASP 145 -0.252 -15.872 -3.173 1052 1HB ASP 145 HB2 ASP 145 -3.193 -16.592 -3.293 1053 2HB ASP 145 HB1 ASP 145 -2.488 -15.261 -4.211 1054 H VAL 146 HN VAL 146 -1.203 -13.557 -3.176 1055 HA VAL 146 HA VAL 146 -1.636 -12.767 -0.344 1056 HB VAL 146 HB VAL 146 -1.145 -11.062 -2.804 1057 1HG1 VAL 146 HG11 VAL 146 -1.305 -10.484 0.157 1058 2HG1 VAL 146 HG13 VAL 146 -0.437 -9.419 -0.948 1059 3HG1 VAL 146 HG12 VAL 146 -2.165 -9.691 -1.163 1060 1HG2 VAL 146 HG23 VAL 146 0.724 -12.137 -0.670 1061 2HG2 VAL 146 HG22 VAL 146 0.784 -12.470 -2.403 1062 3HG2 VAL 146 HG21 VAL 146 1.163 -10.854 -1.800 1063 H GLN 147 HN GLN 147 -3.721 -12.663 0.280 1064 HA GLN 147 HA GLN 147 -5.718 -11.375 -1.540 1065 1HB GLN 147 HB2 GLN 147 -6.037 -13.960 0.016 1066 2HB GLN 147 HB1 GLN 147 -7.383 -13.077 -0.705 1067 1HG GLN 147 HG2 GLN 147 -6.472 -13.358 -2.924 1068 2HG GLN 147 HG1 GLN 147 -4.973 -14.024 -2.277 1069 1HE2 GLN 147 HE22 GLN 147 -7.340 -16.802 -3.335 1070 2HE2 GLN 147 HE21 GLN 147 -6.790 -15.411 -4.138 1071 H LEU 148 HN LEU 148 -7.576 -10.490 -0.305 1072 HA LEU 148 HA LEU 148 -6.690 -9.296 2.205 1073 1HB LEU 148 HB2 LEU 148 -9.403 -9.238 0.843 1074 2HB LEU 148 HB1 LEU 148 -8.930 -8.227 2.208 1075 HG LEU 148 HG LEU 148 -7.581 -8.240 -0.512 1076 1HD1 LEU 148 HD11 LEU 148 -9.933 -7.282 -0.368 1077 2HD1 LEU 148 HD13 LEU 148 -9.286 -6.076 0.743 1078 3HD1 LEU 148 HD12 LEU 148 -8.694 -6.155 -0.916 1079 1HD2 LEU 148 HD23 LEU 148 -7.053 -6.798 2.086 1080 2HD2 LEU 148 HD22 LEU 148 -5.901 -7.523 0.963 1081 3HD2 LEU 148 HD21 LEU 148 -6.677 -5.996 0.560 1082 H ALA 149 HN ALA 149 -7.847 -9.556 4.250 1083 HA ALA 149 HA ALA 149 -8.857 -12.348 4.606 1084 1HB ALA 149 HB1 ALA 149 -6.898 -11.540 5.966 1085 2HB ALA 149 HB3 ALA 149 -7.972 -10.363 6.717 1086 3HB ALA 149 HB2 ALA 149 -8.264 -12.089 6.933 1087 H GLN 150 HN GLN 150 -10.686 -12.611 6.121 1088 HA GLN 150 HA GLN 150 -12.914 -10.988 5.435 1089 1HB GLN 150 HB2 GLN 150 -13.128 -13.306 6.244 1090 2HB GLN 150 HB1 GLN 150 -12.545 -12.814 7.832 1091 1HG GLN 150 HG2 GLN 150 -14.476 -11.329 8.108 1092 2HG GLN 150 HG1 GLN 150 -15.045 -11.743 6.491 1093 1HE2 GLN 150 HE22 GLN 150 -16.931 -14.372 7.894 1094 2HE2 GLN 150 HE21 GLN 150 -16.902 -13.008 6.884 1095 H ASP 151 HN ASP 151 -10.742 -10.892 8.242 1096 HA ASP 151 HA ASP 151 -12.144 -8.958 9.786 1097 1HB ASP 151 HB2 ASP 151 -10.223 -10.247 10.629 1098 2HB ASP 151 HB1 ASP 151 -9.156 -9.410 9.504 1099 H ASP 152 HN ASP 152 -9.788 -8.564 7.143 1100 HA ASP 152 HA ASP 152 -9.806 -5.660 7.366 1101 1HB ASP 152 HB2 ASP 152 -8.747 -7.557 5.257 1102 2HB ASP 152 HB1 ASP 152 -8.584 -5.803 5.150 1103 H ILE 153 HN ILE 153 -11.348 -8.031 5.167 1104 HA ILE 153 HA ILE 153 -12.536 -6.103 3.431 1105 HB ILE 153 HB ILE 153 -13.476 -8.869 4.247 1106 1HG1 ILE 153 HG12 ILE 153 -12.178 -7.922 1.679 1107 2HG1 ILE 153 HG11 ILE 153 -11.257 -8.577 3.034 1108 1HG2 ILE 153 HG22 ILE 153 -14.490 -6.935 2.150 1109 2HG2 ILE 153 HG21 ILE 153 -14.779 -8.671 2.047 1110 3HG2 ILE 153 HG23 ILE 153 -15.415 -7.752 3.410 1111 1HD1 ILE 153 HD11 ILE 153 -13.535 -10.032 1.665 1112 2HD1 ILE 153 HD13 ILE 153 -11.829 -10.298 1.305 1113 3HD1 ILE 153 HD12 ILE 153 -12.460 -10.680 2.905 1114 H ASP 154 HN ASP 154 -13.879 -7.722 6.317 1115 HA ASP 154 HA ASP 154 -16.338 -6.261 6.332 1116 1HB ASP 154 HB2 ASP 154 -14.786 -7.624 8.548 1117 2HB ASP 154 HB1 ASP 154 -16.388 -6.922 8.778 1118 H GLY 155 HN GLY 155 -13.189 -5.637 7.835 1119 1HA GLY 155 HA2 GLY 155 -14.002 -3.366 9.371 1120 2HA GLY 155 HA1 GLY 155 -12.347 -3.730 8.899 1121 H ILE 156 HN ILE 156 -12.365 -3.498 6.171 1122 HA ILE 156 HA ILE 156 -12.479 -0.638 5.855 1123 HB ILE 156 HB ILE 156 -10.888 -2.193 4.643 1124 1HG1 ILE 156 HG12 ILE 156 -11.103 -0.931 2.443 1125 2HG1 ILE 156 HG11 ILE 156 -12.592 -0.236 3.077 1126 1HG2 ILE 156 HG22 ILE 156 -12.786 -3.794 4.021 1127 2HG2 ILE 156 HG21 ILE 156 -13.205 -2.638 2.757 1128 3HG2 ILE 156 HG23 ILE 156 -11.625 -3.422 2.748 1129 1HD1 ILE 156 HD12 ILE 156 -10.096 -0.030 4.737 1130 2HD1 ILE 156 HD11 ILE 156 -10.294 1.040 3.353 1131 3HD1 ILE 156 HD13 ILE 156 -11.481 1.060 4.653 1132 H GLN 157 HN GLN 157 -14.617 -3.275 4.807 1133 HA GLN 157 HA GLN 157 -16.329 -1.615 3.188 1134 1HB GLN 157 HB2 GLN 157 -16.781 -4.255 4.595 1135 2HB GLN 157 HB1 GLN 157 -18.010 -3.488 3.589 1136 1HG GLN 157 HG2 GLN 157 -16.499 -3.519 1.668 1137 2HG GLN 157 HG1 GLN 157 -15.218 -4.216 2.663 1138 1HE2 GLN 157 HE22 GLN 157 -16.985 -7.014 0.898 1139 2HE2 GLN 157 HE21 GLN 157 -16.128 -5.640 0.390 1140 H ALA 158 HN ALA 158 -16.388 -2.585 6.595 1141 HA ALA 158 HA ALA 158 -18.925 -1.500 7.252 1142 1HB ALA 158 HB3 ALA 158 -16.415 -2.077 8.804 1143 2HB ALA 158 HB2 ALA 158 -17.754 -1.243 9.595 1144 3HB ALA 158 HB1 ALA 158 -17.992 -2.854 8.918 1145 H ILE 159 HN ILE 159 -15.702 0.039 7.189 1146 HA ILE 159 HA ILE 159 -16.565 2.558 8.265 1147 HB ILE 159 HB ILE 159 -14.303 1.922 6.348 1148 1HG1 ILE 159 HG12 ILE 159 -14.215 2.360 9.346 1149 2HG1 ILE 159 HG11 ILE 159 -14.319 0.761 8.609 1150 1HG2 ILE 159 HG22 ILE 159 -15.033 4.397 7.915 1151 2HG2 ILE 159 HG21 ILE 159 -13.368 4.075 7.430 1152 3HG2 ILE 159 HG23 ILE 159 -14.622 4.257 6.204 1153 1HD1 ILE 159 HD11 ILE 159 -12.247 1.324 7.284 1154 2HD1 ILE 159 HD13 ILE 159 -12.108 2.799 8.242 1155 3HD1 ILE 159 HD12 ILE 159 -11.983 1.223 9.025 1156 H TYR 160 HN TYR 160 -16.060 1.519 4.873 1157 HA TYR 160 HA TYR 160 -17.495 3.942 3.933 1158 1HB TYR 160 HB2 TYR 160 -15.950 1.757 2.522 1159 2HB TYR 160 HB1 TYR 160 -16.881 2.974 1.651 1160 HD1 TYR 160 HD2 TYR 160 -16.282 5.368 1.801 1161 HD2 TYR 160 HD1 TYR 160 -13.868 2.320 3.630 1162 HE1 TYR 160 HE2 TYR 160 -14.408 6.979 2.017 1163 HE2 TYR 160 HE1 TYR 160 -11.996 3.931 3.846 1164 HH TYR 160 HH TYR 160 -12.379 7.332 2.862 1165 H GLY 161 HN GLY 161 -17.625 0.540 2.851 1166 1HA GLY 161 HA2 GLY 161 -20.161 -0.232 3.557 1167 2HA GLY 161 HA1 GLY 161 -20.464 0.844 2.195 1168 H ARG 162 HN ARG 162 -21.323 -1.331 1.348 1169 HA ARG 162 HA ARG 162 -19.241 -3.209 0.425 1170 1HB ARG 162 HB2 ARG 162 -22.226 -3.158 -0.120 1171 2HB ARG 162 HB1 ARG 162 -21.136 -4.499 -0.463 1172 1HG ARG 162 HG2 ARG 162 -21.507 -3.366 2.319 1173 2HG ARG 162 HG1 ARG 162 -22.501 -4.673 1.702 1174 1HD ARG 162 HD2 ARG 162 -19.505 -4.686 2.137 1175 2HD ARG 162 HD1 ARG 162 -20.696 -5.669 2.963 1176 HE ARG 162 HE ARG 162 -19.372 -6.305 0.495 1177 1HH1 ARG 162 HH21 ARG 162 -22.509 -6.374 1.933 1178 2HH1 ARG 162 HH22 ARG 162 -23.139 -7.510 0.792 1179 1HH2 ARG 162 HH11 ARG 162 -20.173 -7.808 -0.964 1180 2HH2 ARG 162 HH12 ARG 162 -21.819 -8.330 -0.834 1181 H SER 163 HN SER 163 -18.725 -3.518 -1.791 1182 HA SER 163 HA SER 163 -18.962 -1.103 -3.404 1183 1HB SER 163 HB2 SER 163 -17.963 -3.818 -4.305 1184 2HB SER 163 HB1 SER 163 -17.583 -2.249 -5.009 1185 HG SER 163 HG SER 163 -15.926 -2.425 -3.699 1186 H GLN 164 HN GLN 164 -21.268 -0.941 -3.654 1187 HA GLN 164 HA GLN 164 -22.814 -3.086 -4.842 1188 1HB GLN 164 HB2 GLN 164 -23.364 -0.135 -4.439 1189 2HB GLN 164 HB1 GLN 164 -24.537 -1.243 -5.156 1190 1HG GLN 164 HG2 GLN 164 -24.442 -2.656 -3.138 1191 2HG GLN 164 HG1 GLN 164 -23.270 -1.553 -2.418 1192 1HE2 GLN 164 HE22 GLN 164 -26.824 0.351 -3.073 1193 2HE2 GLN 164 HE21 GLN 164 -25.986 -0.359 -4.366 1194 H ASN 165 HN ASN 165 -23.174 -3.507 -6.974 1195 HA ASN 165 HA ASN 165 -22.605 -1.477 -9.037 1196 1HB ASN 165 HB2 ASN 165 -21.103 -4.114 -8.946 1197 2HB ASN 165 HB1 ASN 165 -21.018 -2.926 -10.246 1198 1HD2 ASN 165 HD22 ASN 165 -18.942 -2.294 -6.786 1199 2HD2 ASN 165 HD21 ASN 165 -20.041 -3.582 -6.901 1200 HA PRO 166 HA PRO 166 -26.034 -4.589 -9.775 1201 1HB PRO 166 HB2 PRO 166 -27.720 -2.364 -10.595 1202 2HB PRO 166 HB1 PRO 166 -27.927 -3.433 -9.199 1203 1HG PRO 166 HG2 PRO 166 -27.108 -0.677 -9.159 1204 2HG PRO 166 HG1 PRO 166 -27.217 -1.781 -7.779 1205 1HD PRO 166 HD2 PRO 166 -24.814 -0.792 -9.109 1206 2HD PRO 166 HD1 PRO 166 -24.926 -1.784 -7.641 1207 H VAL 167 HN VAL 167 -24.436 -5.054 -11.516 1208 HA VAL 167 HA VAL 167 -24.626 -3.453 -13.981 1209 HB VAL 167 HB VAL 167 -22.462 -4.407 -13.313 1210 1HG1 VAL 167 HG13 VAL 167 -23.420 -6.431 -12.187 1211 2HG1 VAL 167 HG12 VAL 167 -23.771 -7.105 -13.779 1212 3HG1 VAL 167 HG11 VAL 167 -22.101 -6.815 -13.294 1213 1HG2 VAL 167 HG23 VAL 167 -23.152 -4.129 -15.748 1214 2HG2 VAL 167 HG22 VAL 167 -21.850 -5.283 -15.462 1215 3HG2 VAL 167 HG21 VAL 167 -23.489 -5.860 -15.762 1216 H GLN 168 HN GLN 168 -25.619 -4.162 -15.903 1217 HA GLN 168 HA GLN 168 -27.809 -6.030 -15.533 1218 1HB GLN 168 HB2 GLN 168 -26.805 -4.664 -18.049 1219 2HB GLN 168 HB1 GLN 168 -28.354 -5.481 -17.890 1220 1HG GLN 168 HG2 GLN 168 -27.456 -3.039 -16.329 1221 2HG GLN 168 HG1 GLN 168 -28.650 -3.060 -17.626 1222 1HE2 GLN 168 HE22 GLN 168 -30.038 -3.565 -13.995 1223 2HE2 GLN 168 HE21 GLN 168 -28.658 -2.682 -14.439 1224 HA PRO 169 HA PRO 169 -25.759 -9.745 -16.844 1225 1HB PRO 169 HB2 PRO 169 -27.913 -10.655 -18.567 1226 2HB PRO 169 HB1 PRO 169 -27.507 -11.221 -16.942 1227 1HG PRO 169 HG2 PRO 169 -29.732 -9.524 -17.734 1228 2HG PRO 169 HG1 PRO 169 -29.371 -10.170 -16.127 1229 1HD PRO 169 HD2 PRO 169 -29.107 -7.448 -16.969 1230 2HD PRO 169 HD1 PRO 169 -28.585 -8.146 -15.424 No H/Q in entry = 1230 Start of MODEL 26 1 1H VAL 1 HT2 VAL 1 -8.048 16.660 11.995 2 2H VAL 1 HT1 VAL 1 -7.098 17.757 11.110 3 3H VAL 1 HT3 VAL 1 -7.993 18.298 12.444 4 HA VAL 1 HA VAL 1 -9.230 18.994 10.608 5 HB VAL 1 HB VAL 1 -9.870 17.068 8.905 6 1HG1 VAL 1 HG12 VAL 1 -7.171 18.440 9.039 7 2HG1 VAL 1 HG11 VAL 1 -7.752 17.579 7.615 8 3HG1 VAL 1 HG13 VAL 1 -8.615 19.003 8.196 9 1HG2 VAL 1 HG23 VAL 1 -8.666 15.377 10.432 10 2HG2 VAL 1 HG22 VAL 1 -8.292 15.295 8.710 11 3HG2 VAL 1 HG21 VAL 1 -7.163 16.071 9.822 12 H LEU 2 HN LEU 2 -10.452 15.784 10.233 13 HA LEU 2 HA LEU 2 -12.799 16.495 11.884 14 1HB LEU 2 HB2 LEU 2 -12.277 13.919 10.371 15 2HB LEU 2 HB1 LEU 2 -13.833 14.540 10.922 16 HG LEU 2 HG LEU 2 -12.051 15.863 8.851 17 1HD1 LEU 2 HD12 LEU 2 -13.128 13.776 8.060 18 2HD1 LEU 2 HD11 LEU 2 -14.696 14.405 8.569 19 3HD1 LEU 2 HD13 LEU 2 -13.810 15.197 7.268 20 1HD2 LEU 2 HD22 LEU 2 -14.712 16.589 10.088 21 2HD2 LEU 2 HD21 LEU 2 -13.278 17.602 9.908 22 3HD2 LEU 2 HD23 LEU 2 -14.249 17.187 8.497 23 H THR 3 HN THR 3 -11.095 13.377 11.637 24 HA THR 3 HA THR 3 -11.322 13.098 14.603 25 HB THR 3 HB THR 3 -10.940 10.712 14.207 26 HG1 THR 3 HG1 THR 3 -10.207 11.706 11.726 27 1HG2 THR 3 HG22 THR 3 -12.977 12.038 12.408 28 2HG2 THR 3 HG21 THR 3 -12.899 10.289 12.626 29 3HG2 THR 3 HG23 THR 3 -13.233 11.336 14.006 30 H GLU 4 HN GLU 4 -9.504 13.430 15.801 31 HA GLU 4 HA GLU 4 -6.934 13.921 14.547 32 1HB GLU 4 HB2 GLU 4 -7.664 14.999 16.689 33 2HB GLU 4 HB1 GLU 4 -7.564 13.426 17.477 34 1HG GLU 4 HG2 GLU 4 -5.500 14.617 17.918 35 2HG GLU 4 HG1 GLU 4 -5.141 13.313 16.789 36 H GLY 5 HN GLY 5 -5.235 12.493 14.276 37 1HA GLY 5 HA2 GLY 5 -3.991 10.508 15.135 38 2HA GLY 5 HA1 GLY 5 -5.542 9.714 15.389 39 H ASN 6 HN ASN 6 -6.907 9.766 13.158 40 HA ASN 6 HA ASN 6 -5.183 9.377 10.794 41 1HB ASN 6 HB2 ASN 6 -6.656 7.112 12.149 42 2HB ASN 6 HB1 ASN 6 -6.127 7.040 10.467 43 1HD2 ASN 6 HD22 ASN 6 -2.609 7.032 11.360 44 2HD2 ASN 6 HD21 ASN 6 -3.669 7.643 10.183 45 HA PRO 7 HA PRO 7 -9.494 10.985 10.056 46 1HB PRO 7 HB2 PRO 7 -8.311 12.763 8.071 47 2HB PRO 7 HB1 PRO 7 -9.116 13.195 9.586 48 1HG PRO 7 HG2 PRO 7 -6.313 13.375 9.036 49 2HG PRO 7 HG1 PRO 7 -7.105 13.631 10.598 50 1HD PRO 7 HD2 PRO 7 -5.486 11.354 9.731 51 2HD PRO 7 HD1 PRO 7 -6.095 11.716 11.361 52 H ARG 8 HN ARG 8 -10.765 10.628 8.119 53 HA ARG 8 HA ARG 8 -9.550 8.668 6.250 54 1HB ARG 8 HB2 ARG 8 -12.401 9.566 6.756 55 2HB ARG 8 HB1 ARG 8 -11.958 8.432 5.480 56 1HG ARG 8 HG2 ARG 8 -10.982 6.915 7.145 57 2HG ARG 8 HG1 ARG 8 -11.386 8.043 8.431 58 1HD ARG 8 HD2 ARG 8 -13.363 6.708 6.572 59 2HD ARG 8 HD1 ARG 8 -13.076 6.227 8.240 60 HE ARG 8 HE ARG 8 -14.808 8.340 7.325 61 1HH1 ARG 8 HH21 ARG 8 -12.480 7.677 9.792 62 2HH1 ARG 8 HH22 ARG 8 -12.987 8.999 10.789 63 1HH2 ARG 8 HH11 ARG 8 -15.474 10.039 8.620 64 2HH2 ARG 8 HH12 ARG 8 -14.681 10.317 10.135 65 H TRP 9 HN TRP 9 -9.763 8.953 3.922 66 HA TRP 9 HA TRP 9 -9.225 11.652 3.051 67 1HB TRP 9 HB2 TRP 9 -9.841 9.109 1.521 68 2HB TRP 9 HB1 TRP 9 -9.428 10.632 0.738 69 HD1 TRP 9 HD1 TRP 9 -7.920 7.654 2.387 70 HE1 TRP 9 HE1 TRP 9 -5.361 7.923 2.534 71 HE3 TRP 9 HE3 TRP 9 -7.470 12.592 1.131 72 HZ2 TRP 9 HZ2 TRP 9 -3.379 9.959 2.167 73 HZ3 TRP 9 HZ3 TRP 9 -5.237 13.665 1.040 74 HH2 TRP 9 HH2 TRP 9 -3.194 12.355 1.555 75 H GLU 10 HN GLU 10 -10.604 13.155 2.138 76 HA GLU 10 HA GLU 10 -13.462 12.801 2.526 77 1HB GLU 10 HB2 GLU 10 -11.812 15.015 1.285 78 2HB GLU 10 HB1 GLU 10 -13.569 15.089 1.422 79 1HG GLU 10 HG2 GLU 10 -13.397 14.817 3.868 80 2HG GLU 10 HG1 GLU 10 -11.639 14.732 3.740 81 H GLN 11 HN GLN 11 -11.301 12.722 -0.296 82 HA GLN 11 HA GLN 11 -13.530 12.609 -2.189 83 1HB GLN 11 HB2 GLN 11 -10.568 12.042 -2.518 84 2HB GLN 11 HB1 GLN 11 -11.728 12.020 -3.843 85 1HG GLN 11 HG2 GLN 11 -12.240 14.368 -3.507 86 2HG GLN 11 HG1 GLN 11 -11.238 14.417 -2.056 87 1HE2 GLN 11 HE22 GLN 11 -9.330 15.551 -5.188 88 2HE2 GLN 11 HE21 GLN 11 -10.888 15.948 -4.642 89 H THR 12 HN THR 12 -14.113 10.722 -3.440 90 HA THR 12 HA THR 12 -13.730 8.172 -1.953 91 HB THR 12 HB THR 12 -15.471 7.304 -3.491 92 HG1 THR 12 HG1 THR 12 -16.041 9.797 -4.489 93 1HG2 THR 12 HG22 THR 12 -16.002 9.895 -2.041 94 2HG2 THR 12 HG21 THR 12 -17.292 8.983 -2.820 95 3HG2 THR 12 HG23 THR 12 -16.363 8.250 -1.513 96 H HIS 13 HN HIS 13 -12.367 9.874 -4.512 97 HA HIS 13 HA HIS 13 -11.151 7.381 -5.659 98 1HB HIS 13 HB2 HIS 13 -11.616 9.986 -7.141 99 2HB HIS 13 HB1 HIS 13 -11.086 8.445 -7.816 100 HD1 HIS 13 HD1 HIS 13 -13.046 6.489 -6.622 101 HD2 HIS 13 HD2 HIS 13 -14.219 10.226 -8.046 102 HE1 HIS 13 HE1 HIS 13 -15.521 6.319 -7.122 103 H LEU 14 HN LEU 14 -8.969 7.337 -5.513 104 HA LEU 14 HA LEU 14 -7.541 9.862 -4.730 105 1HB LEU 14 HB2 LEU 14 -6.756 6.991 -4.162 106 2HB LEU 14 HB1 LEU 14 -5.942 8.437 -3.568 107 HG LEU 14 HG LEU 14 -8.790 7.616 -2.924 108 1HD1 LEU 14 HD12 LEU 14 -6.957 6.261 -1.862 109 2HD1 LEU 14 HD11 LEU 14 -6.348 7.746 -1.133 110 3HD1 LEU 14 HD13 LEU 14 -7.949 7.143 -0.701 111 1HD2 LEU 14 HD23 LEU 14 -7.142 10.068 -2.305 112 2HD2 LEU 14 HD22 LEU 14 -8.830 9.963 -2.803 113 3HD2 LEU 14 HD21 LEU 14 -8.370 9.531 -1.158 114 H THR 15 HN THR 15 -5.284 9.963 -5.474 115 HA THR 15 HA THR 15 -4.829 8.553 -8.084 116 HB THR 15 HB THR 15 -3.916 10.597 -8.984 117 HG1 THR 15 HG1 THR 15 -4.230 11.493 -6.327 118 1HG2 THR 15 HG21 THR 15 -6.453 10.305 -8.851 119 2HG2 THR 15 HG23 THR 15 -6.410 11.429 -7.494 120 3HG2 THR 15 HG22 THR 15 -5.876 11.954 -9.089 121 H TYR 16 HN TYR 16 -2.482 8.318 -8.589 122 HA TYR 16 HA TYR 16 -0.646 8.739 -6.286 123 1HB TYR 16 HB2 TYR 16 0.054 6.428 -6.188 124 2HB TYR 16 HB1 TYR 16 -1.697 6.475 -5.998 125 HD1 TYR 16 HD2 TYR 16 -3.186 5.705 -7.786 126 HD2 TYR 16 HD1 TYR 16 1.085 5.570 -8.235 127 HE1 TYR 16 HE2 TYR 16 -3.439 4.208 -9.745 128 HE2 TYR 16 HE1 TYR 16 0.830 4.073 -10.193 129 HH TYR 16 HH TYR 16 -1.137 3.672 -11.955 130 H ARG 17 HN ARG 17 1.608 8.561 -6.880 131 HA ARG 17 HA ARG 17 2.200 8.331 -9.794 132 1HB ARG 17 HB2 ARG 17 1.781 10.765 -9.220 133 2HB ARG 17 HB1 ARG 17 3.153 10.670 -8.115 134 1HG ARG 17 HG2 ARG 17 4.616 9.997 -9.977 135 2HG ARG 17 HG1 ARG 17 3.256 10.091 -11.091 136 1HD ARG 17 HD2 ARG 17 2.983 12.495 -10.492 137 2HD ARG 17 HD1 ARG 17 4.415 12.391 -9.476 138 HE ARG 17 HE ARG 17 4.335 12.769 -12.337 139 1HH1 ARG 17 HH21 ARG 17 6.065 11.037 -9.901 140 2HH1 ARG 17 HH22 ARG 17 7.420 10.707 -10.927 141 1HH2 ARG 17 HH11 ARG 17 6.096 12.359 -13.666 142 2HH2 ARG 17 HH12 ARG 17 7.437 11.450 -13.052 143 H ILE 18 HN ILE 18 4.085 7.228 -10.109 144 HA ILE 18 HA ILE 18 5.724 6.547 -7.729 145 HB ILE 18 HB ILE 18 5.816 5.535 -10.590 146 1HG1 ILE 18 HG12 ILE 18 4.894 4.133 -8.065 147 2HG1 ILE 18 HG11 ILE 18 3.789 4.954 -9.169 148 1HG2 ILE 18 HG21 ILE 18 7.368 4.809 -8.098 149 2HG2 ILE 18 HG23 ILE 18 7.225 3.709 -9.470 150 3HG2 ILE 18 HG22 ILE 18 8.008 5.276 -9.673 151 1HD1 ILE 18 HD13 ILE 18 5.666 2.691 -9.926 152 2HD1 ILE 18 HD12 ILE 18 3.926 2.538 -9.677 153 3HD1 ILE 18 HD11 ILE 18 4.541 3.510 -11.011 154 H GLU 19 HN GLU 19 7.433 7.843 -7.289 155 HA GLU 19 HA GLU 19 8.402 9.816 -9.143 156 1HB GLU 19 HB2 GLU 19 9.416 8.799 -6.485 157 2HB GLU 19 HB1 GLU 19 10.280 10.033 -7.402 158 1HG GLU 19 HG2 GLU 19 8.810 11.149 -5.826 159 2HG GLU 19 HG1 GLU 19 8.160 11.396 -7.446 160 H ASN 20 HN ASN 20 9.672 6.617 -8.166 161 HA ASN 20 HA ASN 20 11.159 6.483 -10.681 162 1HB ASN 20 HB2 ASN 20 13.382 6.356 -9.740 163 2HB ASN 20 HB1 ASN 20 12.646 7.857 -9.179 164 1HD2 ASN 20 HD22 ASN 20 14.155 5.814 -6.308 165 2HD2 ASN 20 HD21 ASN 20 14.783 6.198 -7.837 166 H TYR 21 HN TYR 21 12.399 4.386 -10.811 167 HA TYR 21 HA TYR 21 11.029 2.241 -9.210 168 1HB TYR 21 HB2 TYR 21 12.093 2.232 -12.052 169 2HB TYR 21 HB1 TYR 21 11.532 0.792 -11.205 170 HD1 TYR 21 HD1 TYR 21 9.173 0.473 -10.676 171 HD2 TYR 21 HD2 TYR 21 10.541 3.984 -12.732 172 HE1 TYR 21 HE1 TYR 21 6.837 1.017 -11.295 173 HE2 TYR 21 HE2 TYR 21 8.204 4.533 -13.355 174 HH TYR 21 HH TYR 21 5.572 2.293 -12.738 175 H THR 22 HN THR 22 12.378 0.721 -8.211 176 HA THR 22 HA THR 22 15.176 1.427 -7.982 177 HB THR 22 HB THR 22 14.253 0.516 -6.012 178 HG1 THR 22 HG1 THR 22 15.420 -1.420 -5.753 179 1HG2 THR 22 HG22 THR 22 13.064 -1.550 -7.859 180 2HG2 THR 22 HG21 THR 22 13.197 -1.843 -6.127 181 3HG2 THR 22 HG23 THR 22 12.243 -0.484 -6.721 182 HA PRO 23 HA PRO 23 16.482 -0.994 -11.516 183 1HB PRO 23 HB2 PRO 23 19.119 -1.539 -10.521 184 2HB PRO 23 HB1 PRO 23 18.648 -0.258 -11.647 185 1HG PRO 23 HG2 PRO 23 19.363 -0.018 -8.812 186 2HG PRO 23 HG1 PRO 23 19.144 1.267 -10.009 187 1HD PRO 23 HD2 PRO 23 17.360 0.624 -7.879 188 2HD PRO 23 HD1 PRO 23 17.043 1.733 -9.232 189 H ASP 24 HN ASP 24 15.918 -2.091 -8.438 190 HA ASP 24 HA ASP 24 17.118 -4.687 -8.422 191 1HB ASP 24 HB2 ASP 24 14.574 -3.643 -7.146 192 2HB ASP 24 HB1 ASP 24 15.218 -5.257 -6.846 193 H LEU 25 HN LEU 25 14.013 -3.496 -9.682 194 HA LEU 25 HA LEU 25 13.851 -5.918 -11.403 195 1HB LEU 25 HB2 LEU 25 11.572 -4.830 -9.719 196 2HB LEU 25 HB1 LEU 25 11.413 -6.117 -10.901 197 HG LEU 25 HG LEU 25 13.273 -6.271 -8.513 198 1HD1 LEU 25 HD12 LEU 25 10.902 -6.079 -7.815 199 2HD1 LEU 25 HD11 LEU 25 10.508 -7.455 -8.848 200 3HD1 LEU 25 HD13 LEU 25 11.575 -7.671 -7.461 201 1HD2 LEU 25 HD22 LEU 25 12.320 -8.244 -10.602 202 2HD2 LEU 25 HD21 LEU 25 13.979 -7.846 -10.163 203 3HD2 LEU 25 HD23 LEU 25 12.976 -8.778 -9.057 204 HA PRO 26 HA PRO 26 12.904 -2.855 -14.481 205 1HB PRO 26 HB2 PRO 26 10.896 -4.377 -15.897 206 2HB PRO 26 HB1 PRO 26 12.603 -4.185 -16.316 207 1HG PRO 26 HG2 PRO 26 11.284 -6.533 -15.210 208 2HG PRO 26 HG1 PRO 26 12.960 -6.374 -15.751 209 1HD PRO 26 HD2 PRO 26 12.034 -6.562 -13.042 210 2HD PRO 26 HD1 PRO 26 13.696 -6.274 -13.591 211 H ARG 27 HN ARG 27 11.256 -1.290 -14.987 212 HA ARG 27 HA ARG 27 9.340 -0.795 -12.944 213 1HB ARG 27 HB2 ARG 27 8.526 1.001 -14.373 214 2HB ARG 27 HB1 ARG 27 10.284 0.943 -14.470 215 1HG ARG 27 HG2 ARG 27 10.074 -0.420 -16.560 216 2HG ARG 27 HG1 ARG 27 8.328 -0.190 -16.497 217 1HD ARG 27 HD2 ARG 27 8.771 2.304 -16.442 218 2HD ARG 27 HD1 ARG 27 10.455 1.950 -16.802 219 HE ARG 27 HE ARG 27 8.267 2.044 -18.675 220 1HH1 ARG 27 HH21 ARG 27 11.045 0.134 -17.905 221 2HH1 ARG 27 HH22 ARG 27 11.114 -0.605 -19.468 222 1HH2 ARG 27 HH11 ARG 27 8.364 1.106 -20.698 223 2HH2 ARG 27 HH12 ARG 27 9.602 -0.054 -21.050 224 H ALA 28 HN ALA 28 9.052 -2.465 -16.037 225 HA ALA 28 HA ALA 28 6.230 -2.586 -16.247 226 1HB ALA 28 HB1 ALA 28 8.377 -4.558 -17.066 227 2HB ALA 28 HB3 ALA 28 6.676 -4.757 -17.486 228 3HB ALA 28 HB2 ALA 28 7.574 -3.361 -18.083 229 H ASP 29 HN ASP 29 8.483 -4.646 -14.435 230 HA ASP 29 HA ASP 29 6.397 -6.472 -13.556 231 1HB ASP 29 HB2 ASP 29 9.255 -6.013 -12.662 232 2HB ASP 29 HB1 ASP 29 8.213 -7.265 -11.981 233 H VAL 30 HN VAL 30 7.986 -3.609 -12.192 234 HA VAL 30 HA VAL 30 6.794 -3.897 -9.571 235 HB VAL 30 HB VAL 30 7.940 -1.492 -11.013 236 1HG1 VAL 30 HG11 VAL 30 6.943 -1.845 -8.178 237 2HG1 VAL 30 HG13 VAL 30 8.086 -0.579 -8.627 238 3HG1 VAL 30 HG12 VAL 30 6.477 -0.609 -9.348 239 1HG2 VAL 30 HG22 VAL 30 9.024 -3.411 -8.929 240 2HG2 VAL 30 HG21 VAL 30 9.616 -3.185 -10.575 241 3HG2 VAL 30 HG23 VAL 30 9.824 -1.905 -9.378 242 H ASP 31 HN ASP 31 5.901 -2.055 -12.503 243 HA ASP 31 HA ASP 31 3.668 -0.697 -11.390 244 1HB ASP 31 HB2 ASP 31 4.206 -1.670 -14.208 245 2HB ASP 31 HB1 ASP 31 2.814 -0.673 -13.784 246 H HIS 32 HN HIS 32 3.895 -3.938 -12.864 247 HA HIS 32 HA HIS 32 1.104 -4.554 -12.748 248 1HB HIS 32 HB2 HIS 32 2.716 -5.964 -13.978 249 2HB HIS 32 HB1 HIS 32 3.468 -6.431 -12.452 250 HD1 HIS 32 HD1 HIS 32 -0.096 -6.446 -13.877 251 HD2 HIS 32 HD2 HIS 32 2.413 -8.796 -11.517 252 HE1 HIS 32 HE1 HIS 32 -1.403 -8.541 -13.303 253 H ALA 33 HN ALA 33 3.723 -5.163 -10.414 254 HA ALA 33 HA ALA 33 2.152 -6.425 -8.422 255 1HB ALA 33 HB2 ALA 33 4.595 -4.657 -8.116 256 2HB ALA 33 HB1 ALA 33 3.945 -5.704 -6.855 257 3HB ALA 33 HB3 ALA 33 4.596 -6.407 -8.335 258 H ILE 34 HN ILE 34 2.987 -2.963 -8.786 259 HA ILE 34 HA ILE 34 1.422 -2.157 -6.498 260 HB ILE 34 HB ILE 34 2.302 -0.536 -8.916 261 1HG1 ILE 34 HG12 ILE 34 4.262 -1.466 -7.841 262 2HG1 ILE 34 HG11 ILE 34 4.142 0.225 -7.379 263 1HG2 ILE 34 HG21 ILE 34 1.421 0.314 -6.147 264 2HG2 ILE 34 HG23 ILE 34 2.065 1.395 -7.381 265 3HG2 ILE 34 HG22 ILE 34 0.530 0.571 -7.648 266 1HD1 ILE 34 HD13 ILE 34 2.828 -0.715 -5.307 267 2HD1 ILE 34 HD12 ILE 34 3.627 -2.231 -5.725 268 3HD1 ILE 34 HD11 ILE 34 4.589 -0.807 -5.331 269 H GLU 35 HN GLU 35 0.782 -2.162 -10.006 270 HA GLU 35 HA GLU 35 -1.804 -0.989 -9.876 271 1HB GLU 35 HB2 GLU 35 -0.557 -1.300 -11.984 272 2HB GLU 35 HB1 GLU 35 -0.733 -3.048 -11.835 273 1HG GLU 35 HG2 GLU 35 -3.182 -2.825 -11.961 274 2HG GLU 35 HG1 GLU 35 -3.020 -1.071 -12.076 275 H LYS 36 HN LYS 36 -0.801 -4.401 -9.701 276 HA LYS 36 HA LYS 36 -3.418 -5.518 -9.581 277 1HB LYS 36 HB2 LYS 36 -1.286 -6.786 -9.987 278 2HB LYS 36 HB1 LYS 36 -0.924 -6.624 -8.268 279 1HG LYS 36 HG2 LYS 36 -2.922 -7.846 -7.667 280 2HG LYS 36 HG1 LYS 36 -3.464 -7.875 -9.345 281 1HD LYS 36 HD2 LYS 36 -1.423 -9.173 -9.943 282 2HD LYS 36 HD1 LYS 36 -0.986 -9.222 -8.234 283 1HE LYS 36 HE2 LYS 36 -3.658 -10.212 -9.250 284 2HE LYS 36 HE1 LYS 36 -2.245 -11.261 -9.129 285 1HZ LYS 36 HZ3 LYS 36 -2.418 -9.889 -6.734 286 2HZ LYS 36 HZ2 LYS 36 -3.999 -10.400 -7.090 287 3HZ LYS 36 HZ1 LYS 36 -2.737 -11.534 -7.001 288 H ALA 37 HN ALA 37 -1.271 -4.363 -6.983 289 HA ALA 37 HA ALA 37 -2.846 -5.303 -4.805 290 1HB ALA 37 HB2 ALA 37 -0.553 -4.423 -4.542 291 2HB ALA 37 HB1 ALA 37 -1.130 -2.806 -4.945 292 3HB ALA 37 HB3 ALA 37 -1.682 -3.597 -3.469 293 H PHE 38 HN PHE 38 -2.917 -2.122 -6.461 294 HA PHE 38 HA PHE 38 -5.015 -1.006 -4.891 295 1HB PHE 38 HB2 PHE 38 -4.051 -0.516 -7.711 296 2HB PHE 38 HB1 PHE 38 -5.459 0.336 -7.083 297 HD1 PHE 38 HD2 PHE 38 -5.174 1.481 -4.749 298 HD2 PHE 38 HD1 PHE 38 -1.903 0.369 -7.300 299 HE1 PHE 38 HE2 PHE 38 -3.713 3.106 -3.581 300 HE2 PHE 38 HE1 PHE 38 -0.441 2.002 -6.127 301 HZ PHE 38 HZ PHE 38 -1.348 3.364 -4.273 302 H GLN 39 HN GLN 39 -5.124 -2.973 -7.862 303 HA GLN 39 HA GLN 39 -7.932 -2.799 -8.278 304 1HB GLN 39 HB2 GLN 39 -5.938 -4.965 -8.975 305 2HB GLN 39 HB1 GLN 39 -7.624 -5.014 -9.492 306 1HG GLN 39 HG2 GLN 39 -7.345 -2.819 -10.597 307 2HG GLN 39 HG1 GLN 39 -5.653 -2.786 -10.102 308 1HE2 GLN 39 HE22 GLN 39 -4.612 -5.137 -12.574 309 2HE2 GLN 39 HE21 GLN 39 -4.184 -4.387 -11.113 310 H LEU 40 HN LEU 40 -6.053 -5.072 -6.263 311 HA LEU 40 HA LEU 40 -8.228 -6.780 -5.573 312 1HB LEU 40 HB2 LEU 40 -5.753 -5.987 -4.014 313 2HB LEU 40 HB1 LEU 40 -6.869 -7.247 -3.491 314 HG LEU 40 HG LEU 40 -5.487 -7.232 -6.189 315 1HD1 LEU 40 HD12 LEU 40 -3.942 -7.438 -4.172 316 2HD1 LEU 40 HD11 LEU 40 -4.772 -8.949 -3.801 317 3HD1 LEU 40 HD13 LEU 40 -3.886 -8.778 -5.316 318 1HD2 LEU 40 HD22 LEU 40 -7.422 -9.061 -4.806 319 2HD2 LEU 40 HD21 LEU 40 -7.251 -8.685 -6.519 320 3HD2 LEU 40 HD23 LEU 40 -6.143 -9.819 -5.753 321 H TRP 41 HN TRP 41 -7.067 -3.763 -4.040 322 HA TRP 41 HA TRP 41 -9.070 -3.840 -1.934 323 1HB TRP 41 HB2 TRP 41 -7.389 -1.561 -3.029 324 2HB TRP 41 HB1 TRP 41 -8.414 -1.437 -1.604 325 HD1 TRP 41 HD1 TRP 41 -4.996 -2.286 -2.625 326 HE1 TRP 41 HE1 TRP 41 -3.700 -3.384 -0.686 327 HE3 TRP 41 HE3 TRP 41 -8.867 -3.312 0.545 328 HZ2 TRP 41 HZ2 TRP 41 -4.241 -4.558 1.863 329 HZ3 TRP 41 HZ3 TRP 41 -8.449 -4.424 2.719 330 HH2 TRP 41 HH2 TRP 41 -6.138 -5.045 3.384 331 H SER 42 HN SER 42 -8.805 -2.156 -5.062 332 HA SER 42 HA SER 42 -11.279 -0.696 -4.787 333 1HB SER 42 HB2 SER 42 -9.441 -0.052 -6.340 334 2HB SER 42 HB1 SER 42 -9.804 -1.471 -7.320 335 HG SER 42 HG SER 42 -10.954 0.183 -8.199 336 H ASN 43 HN ASN 43 -10.487 -3.897 -5.968 337 HA ASN 43 HA ASN 43 -12.823 -4.416 -7.489 338 1HB ASN 43 HB2 ASN 43 -10.977 -6.204 -5.903 339 2HB ASN 43 HB1 ASN 43 -12.345 -6.856 -6.806 340 1HD2 ASN 43 HD22 ASN 43 -9.228 -6.686 -8.980 341 2HD2 ASN 43 HD21 ASN 43 -9.496 -7.328 -7.432 342 H VAL 44 HN VAL 44 -12.266 -4.706 -3.979 343 HA VAL 44 HA VAL 44 -15.143 -5.459 -3.639 344 HB VAL 44 HB VAL 44 -14.515 -6.180 -1.389 345 1HG1 VAL 44 HG12 VAL 44 -12.684 -7.183 -3.590 346 2HG1 VAL 44 HG11 VAL 44 -12.923 -8.005 -2.048 347 3HG1 VAL 44 HG13 VAL 44 -14.274 -7.820 -3.167 348 1HG2 VAL 44 HG22 VAL 44 -11.895 -4.893 -2.149 349 2HG2 VAL 44 HG21 VAL 44 -12.806 -4.769 -0.644 350 3HG2 VAL 44 HG23 VAL 44 -11.903 -6.236 -1.005 351 H THR 45 HN THR 45 -13.835 -2.645 -4.040 352 HA THR 45 HA THR 45 -15.467 -1.381 -1.912 353 HB THR 45 HB THR 45 -13.697 0.261 -1.391 354 HG1 THR 45 HG1 THR 45 -12.659 -0.269 -3.536 355 1HG2 THR 45 HG23 THR 45 -13.957 -1.953 -0.145 356 2HG2 THR 45 HG22 THR 45 -12.570 -2.513 -1.077 357 3HG2 THR 45 HG21 THR 45 -12.396 -1.142 0.015 358 HA PRO 46 HA PRO 46 -16.567 1.141 -5.439 359 1HB PRO 46 HB2 PRO 46 -17.391 3.462 -4.059 360 2HB PRO 46 HB1 PRO 46 -18.410 2.058 -4.408 361 1HG PRO 46 HG2 PRO 46 -17.188 2.873 -1.831 362 2HG PRO 46 HG1 PRO 46 -18.568 1.802 -2.122 363 1HD PRO 46 HD2 PRO 46 -15.960 0.971 -1.386 364 2HD PRO 46 HD1 PRO 46 -17.253 -0.070 -2.024 365 H LEU 47 HN LEU 47 -13.921 1.625 -3.542 366 HA LEU 47 HA LEU 47 -13.191 4.336 -4.273 367 1HB LEU 47 HB2 LEU 47 -11.473 2.029 -3.320 368 2HB LEU 47 HB1 LEU 47 -10.938 3.701 -3.448 369 HG LEU 47 HG LEU 47 -13.242 2.759 -1.714 370 1HD1 LEU 47 HD12 LEU 47 -11.022 1.928 -0.952 371 2HD1 LEU 47 HD11 LEU 47 -10.419 3.585 -0.954 372 3HD1 LEU 47 HD13 LEU 47 -11.699 3.112 0.164 373 1HD2 LEU 47 HD21 LEU 47 -11.939 5.436 -2.241 374 2HD2 LEU 47 HD23 LEU 47 -13.656 5.040 -2.152 375 3HD2 LEU 47 HD22 LEU 47 -12.696 5.117 -0.681 376 H THR 48 HN THR 48 -11.744 5.013 -5.854 377 HA THR 48 HA THR 48 -10.935 2.997 -7.921 378 HB THR 48 HB THR 48 -11.552 4.561 -9.670 379 HG1 THR 48 HG1 THR 48 -11.924 6.592 -9.253 380 1HG2 THR 48 HG21 THR 48 -13.331 3.098 -8.559 381 2HG2 THR 48 HG23 THR 48 -13.855 4.555 -7.714 382 3HG2 THR 48 HG22 THR 48 -13.926 4.482 -9.476 383 H PHE 49 HN PHE 49 -8.905 3.438 -8.881 384 HA PHE 49 HA PHE 49 -7.359 5.708 -7.655 385 1HB PHE 49 HB2 PHE 49 -6.456 2.905 -8.367 386 2HB PHE 49 HB1 PHE 49 -5.357 4.211 -7.926 387 HD1 PHE 49 HD2 PHE 49 -5.295 5.101 -5.642 388 HD2 PHE 49 HD1 PHE 49 -7.966 1.914 -6.718 389 HE1 PHE 49 HE2 PHE 49 -5.698 4.627 -3.241 390 HE2 PHE 49 HE1 PHE 49 -8.373 1.439 -4.319 391 HZ PHE 49 HZ PHE 49 -7.234 2.796 -2.576 392 H THR 50 HN THR 50 -6.411 7.075 -9.079 393 HA THR 50 HA THR 50 -6.259 6.277 -11.973 394 HB THR 50 HB THR 50 -6.716 9.032 -10.790 395 HG1 THR 50 HG1 THR 50 -8.416 7.335 -12.293 396 1HG2 THR 50 HG22 THR 50 -6.445 8.044 -13.636 397 2HG2 THR 50 HG21 THR 50 -7.116 9.620 -13.217 398 3HG2 THR 50 HG23 THR 50 -5.443 9.238 -12.812 399 H LYS 51 HN LYS 51 -4.232 6.303 -12.792 400 HA LYS 51 HA LYS 51 -2.006 7.218 -11.130 401 1HB LYS 51 HB2 LYS 51 -1.892 5.178 -12.601 402 2HB LYS 51 HB1 LYS 51 -1.948 6.252 -14.000 403 1HG LYS 51 HG2 LYS 51 0.095 7.389 -13.217 404 2HG LYS 51 HG1 LYS 51 0.153 6.321 -11.814 405 1HD LYS 51 HD2 LYS 51 0.314 4.364 -13.345 406 2HD LYS 51 HD1 LYS 51 0.351 5.471 -14.718 407 1HE LYS 51 HE2 LYS 51 2.391 6.530 -13.796 408 2HE LYS 51 HE1 LYS 51 2.364 5.391 -12.450 409 1HZ LYS 51 HZ1 LYS 51 2.258 4.281 -15.149 410 2HZ LYS 51 HZ3 LYS 51 3.737 4.940 -14.646 411 3HZ LYS 51 HZ2 LYS 51 3.024 3.682 -13.755 412 H VAL 52 HN VAL 52 -0.784 9.075 -11.456 413 HA VAL 52 HA VAL 52 -1.616 10.899 -13.694 414 HB VAL 52 HB VAL 52 -1.285 12.798 -12.180 415 1HG1 VAL 52 HG11 VAL 52 -3.126 10.625 -11.162 416 2HG1 VAL 52 HG13 VAL 52 -3.176 12.289 -10.580 417 3HG1 VAL 52 HG12 VAL 52 -3.527 11.935 -12.272 418 1HG2 VAL 52 HG21 VAL 52 -0.571 10.609 -10.221 419 2HG2 VAL 52 HG23 VAL 52 0.390 12.019 -10.669 420 3HG2 VAL 52 HG22 VAL 52 -1.060 12.216 -9.686 421 H SER 53 HN SER 53 0.080 11.547 -14.932 422 HA SER 53 HA SER 53 2.811 10.759 -14.071 423 1HB SER 53 HB2 SER 53 2.146 10.110 -16.321 424 2HB SER 53 HB1 SER 53 1.724 11.775 -16.713 425 HG SER 53 HG SER 53 4.145 11.922 -15.831 426 H GLU 54 HN GLU 54 0.846 13.511 -13.996 427 HA GLU 54 HA GLU 54 3.216 15.231 -13.471 428 1HB GLU 54 HB2 GLU 54 1.038 15.833 -15.490 429 2HB GLU 54 HB1 GLU 54 2.103 17.073 -14.831 430 1HG GLU 54 HG2 GLU 54 3.084 14.580 -16.256 431 2HG GLU 54 HG1 GLU 54 2.880 16.146 -17.032 432 H GLY 55 HN GLY 55 2.610 17.217 -12.307 433 1HA GLY 55 HA2 GLY 55 1.231 18.493 -10.858 434 2HA GLY 55 HA1 GLY 55 -0.117 17.420 -11.242 435 H GLN 56 HN GLN 56 -0.008 17.942 -8.655 436 HA GLN 56 HA GLN 56 1.778 16.142 -7.200 437 1HB GLN 56 HB2 GLN 56 -0.579 17.838 -6.337 438 2HB GLN 56 HB1 GLN 56 0.367 16.848 -5.223 439 1HG GLN 56 HG2 GLN 56 2.378 18.085 -5.716 440 2HG GLN 56 HG1 GLN 56 1.582 18.950 -7.033 441 1HE2 GLN 56 HE22 GLN 56 1.527 21.119 -3.961 442 2HE2 GLN 56 HE21 GLN 56 2.768 20.379 -4.852 443 H ALA 57 HN ALA 57 0.941 14.397 -5.803 444 HA ALA 57 HA ALA 57 -1.586 13.137 -6.824 445 1HB ALA 57 HB1 ALA 57 0.549 12.089 -7.730 446 2HB ALA 57 HB3 ALA 57 0.933 11.638 -6.068 447 3HB ALA 57 HB2 ALA 57 -0.512 10.993 -6.846 448 H ASP 58 HN ASP 58 -2.834 12.128 -5.235 449 HA ASP 58 HA ASP 58 -2.572 13.028 -2.550 450 1HB ASP 58 HB2 ASP 58 -4.114 10.700 -3.726 451 2HB ASP 58 HB1 ASP 58 -4.252 11.199 -2.039 452 H ILE 59 HN ILE 59 -1.562 9.964 -4.078 453 HA ILE 59 HA ILE 59 -0.047 9.321 -1.554 454 HB ILE 59 HB ILE 59 -1.197 7.403 -3.609 455 1HG1 ILE 59 HG12 ILE 59 -2.001 7.858 -0.720 456 2HG1 ILE 59 HG11 ILE 59 -2.854 8.570 -2.088 457 1HG2 ILE 59 HG23 ILE 59 0.332 7.010 -1.022 458 2HG2 ILE 59 HG22 ILE 59 -0.531 5.715 -1.852 459 3HG2 ILE 59 HG21 ILE 59 0.833 6.511 -2.638 460 1HD1 ILE 59 HD12 ILE 59 -2.436 5.597 -1.654 461 2HD1 ILE 59 HD11 ILE 59 -3.933 6.471 -1.332 462 3HD1 ILE 59 HD13 ILE 59 -3.329 6.336 -2.984 463 H MET 60 HN MET 60 2.102 9.578 -1.872 464 HA MET 60 HA MET 60 3.217 9.344 -4.634 465 1HB MET 60 HB2 MET 60 4.584 10.402 -2.141 466 2HB MET 60 HB1 MET 60 5.107 10.599 -3.815 467 1HG MET 60 HG2 MET 60 2.925 11.814 -4.251 468 2HG MET 60 HG1 MET 60 2.647 11.792 -2.510 469 1HE MET 60 HE1 MET 60 4.116 13.407 -5.460 470 2HE MET 60 HE3 MET 60 5.521 14.347 -4.941 471 3HE MET 60 HE2 MET 60 5.631 12.595 -5.078 472 H ILE 61 HN ILE 61 4.623 7.695 -5.141 473 HA ILE 61 HA ILE 61 5.479 5.844 -2.924 474 HB ILE 61 HB ILE 61 4.779 5.221 -5.810 475 1HG1 ILE 61 HG12 ILE 61 3.571 4.185 -3.228 476 2HG1 ILE 61 HG11 ILE 61 2.901 5.537 -4.143 477 1HG2 ILE 61 HG23 ILE 61 6.092 3.574 -3.648 478 2HG2 ILE 61 HG22 ILE 61 5.200 2.815 -4.963 479 3HG2 ILE 61 HG21 ILE 61 6.615 3.807 -5.313 480 1HD1 ILE 61 HD12 ILE 61 2.690 4.065 -6.132 481 2HD1 ILE 61 HD11 ILE 61 3.304 2.714 -5.179 482 3HD1 ILE 61 HD13 ILE 61 1.759 3.455 -4.764 483 H SER 62 HN SER 62 7.650 5.875 -2.628 484 HA SER 62 HA SER 62 9.419 6.155 -5.008 485 1HB SER 62 HB2 SER 62 10.721 7.928 -3.931 486 2HB SER 62 HB1 SER 62 9.045 8.440 -4.109 487 HG SER 62 HG SER 62 9.625 7.062 -1.792 488 H PHE 63 HN PHE 63 11.739 5.785 -4.358 489 HA PHE 63 HA PHE 63 11.920 3.772 -2.137 490 1HB PHE 63 HB2 PHE 63 13.287 3.906 -4.841 491 2HB PHE 63 HB1 PHE 63 13.818 2.831 -3.550 492 HD1 PHE 63 HD1 PHE 63 11.026 3.631 -5.854 493 HD2 PHE 63 HD2 PHE 63 12.535 0.887 -2.909 494 HE1 PHE 63 HE1 PHE 63 9.251 2.006 -6.453 495 HE2 PHE 63 HE2 PHE 63 10.758 -0.735 -3.514 496 HZ PHE 63 HZ PHE 63 9.118 -0.177 -5.285 497 H VAL 64 HN VAL 64 13.587 4.055 -0.665 498 HA VAL 64 HA VAL 64 15.488 6.337 -1.130 499 HB VAL 64 HB VAL 64 15.165 6.904 1.290 500 1HG1 VAL 64 HG11 VAL 64 13.959 8.104 -0.530 501 2HG1 VAL 64 HG13 VAL 64 12.629 6.957 -0.368 502 3HG1 VAL 64 HG12 VAL 64 13.026 8.042 0.964 503 1HG2 VAL 64 HG23 VAL 64 14.292 4.667 1.964 504 2HG2 VAL 64 HG22 VAL 64 13.224 5.979 2.459 505 3HG2 VAL 64 HG21 VAL 64 12.820 4.997 1.051 506 H ARG 65 HN ARG 65 17.360 6.268 0.416 507 HA ARG 65 HA ARG 65 18.067 3.472 1.259 508 1HB ARG 65 HB2 ARG 65 19.772 5.502 -0.212 509 2HB ARG 65 HB1 ARG 65 20.437 4.081 0.592 510 1HG ARG 65 HG2 ARG 65 19.144 2.603 -0.812 511 2HG ARG 65 HG1 ARG 65 18.283 3.959 -1.535 512 1HD ARG 65 HD2 ARG 65 20.341 4.794 -2.521 513 2HD ARG 65 HD1 ARG 65 21.290 3.558 -1.708 514 HE ARG 65 HE ARG 65 19.882 3.311 -4.223 515 1HH1 ARG 65 HH21 ARG 65 20.533 1.542 -1.324 516 2HH1 ARG 65 HH22 ARG 65 20.151 0.011 -2.037 517 1HH2 ARG 65 HH11 ARG 65 19.391 1.330 -5.143 518 2HH2 ARG 65 HH12 ARG 65 19.498 -0.107 -4.182 519 H GLY 66 HN GLY 66 18.777 3.362 3.344 520 1HA GLY 66 HA2 GLY 66 19.249 4.112 5.521 521 2HA GLY 66 HA1 GLY 66 20.483 5.069 4.708 522 H ASP 67 HN ASP 67 20.317 6.978 5.826 523 HA ASP 67 HA ASP 67 17.826 8.175 6.637 524 1HB ASP 67 HB2 ASP 67 20.045 8.672 7.687 525 2HB ASP 67 HB1 ASP 67 20.510 9.517 6.212 526 H HIS 68 HN HIS 68 16.432 9.358 5.464 527 HA HIS 68 HA HIS 68 17.367 10.640 2.927 528 1HB HIS 68 HB2 HIS 68 15.022 9.931 2.045 529 2HB HIS 68 HB1 HIS 68 16.296 8.715 2.114 530 HD1 HIS 68 HD1 HIS 68 16.344 7.606 4.784 531 HD2 HIS 68 HD2 HIS 68 12.723 8.849 3.137 532 HE1 HIS 68 HE1 HIS 68 14.522 6.446 6.105 533 H ARG 69 HN ARG 69 17.320 12.338 4.811 534 HA ARG 69 HA ARG 69 16.328 14.237 5.730 535 1HB ARG 69 HB2 ARG 69 14.610 13.847 3.266 536 2HB ARG 69 HB1 ARG 69 14.486 15.256 4.321 537 1HG ARG 69 HG2 ARG 69 16.885 15.719 3.970 538 2HG ARG 69 HG1 ARG 69 16.993 14.328 2.896 539 1HD ARG 69 HD2 ARG 69 15.125 15.425 1.533 540 2HD ARG 69 HD1 ARG 69 15.421 16.881 2.475 541 HE ARG 69 HE ARG 69 16.956 15.949 0.230 542 1HH1 ARG 69 HH21 ARG 69 17.386 17.268 3.391 543 2HH1 ARG 69 HH22 ARG 69 19.018 17.759 3.096 544 1HH2 ARG 69 HH11 ARG 69 19.067 16.604 -0.167 545 2HH2 ARG 69 HH12 ARG 69 19.958 17.405 1.085 546 H ASP 70 HN ASP 70 15.631 11.990 7.057 547 HA ASP 70 HA ASP 70 12.819 12.568 7.872 548 1HB ASP 70 HB2 ASP 70 14.004 9.849 7.243 549 2HB ASP 70 HB1 ASP 70 12.554 10.056 8.227 550 H ASN 71 HN ASN 71 12.408 11.898 10.112 551 HA ASN 71 HA ASN 71 14.857 12.131 11.773 552 1HB ASN 71 HB2 ASN 71 13.266 12.474 13.621 553 2HB ASN 71 HB1 ASN 71 12.886 13.554 12.276 554 1HD2 ASN 71 HD22 ASN 71 10.401 10.568 11.566 555 2HD2 ASN 71 HD21 ASN 71 12.023 10.641 11.070 556 H SER 72 HN SER 72 13.436 9.650 10.309 557 HA SER 72 HA SER 72 14.020 7.749 12.550 558 1HB SER 72 HB2 SER 72 11.676 7.671 10.635 559 2HB SER 72 HB1 SER 72 12.117 6.363 11.729 560 HG SER 72 HG SER 72 12.014 8.734 13.018 561 HA PRO 73 HA PRO 73 16.189 6.809 8.503 562 1HB PRO 73 HB2 PRO 73 18.643 6.357 9.945 563 2HB PRO 73 HB1 PRO 73 18.273 7.692 8.851 564 1HG PRO 73 HG2 PRO 73 18.493 7.777 11.746 565 2HG PRO 73 HG1 PRO 73 18.226 9.125 10.631 566 1HD PRO 73 HD2 PRO 73 16.304 7.916 12.414 567 2HD PRO 73 HD1 PRO 73 16.031 9.236 11.259 568 H PHE 74 HN PHE 74 16.936 4.646 7.893 569 HA PHE 74 HA PHE 74 15.795 2.540 9.547 570 1HB PHE 74 HB2 PHE 74 17.406 2.496 6.986 571 2HB PHE 74 HB1 PHE 74 16.775 1.039 7.755 572 HD1 PHE 74 HD2 PHE 74 15.874 4.205 6.062 573 HD2 PHE 74 HD1 PHE 74 14.405 0.535 7.743 574 HE1 PHE 74 HE2 PHE 74 13.667 4.591 4.991 575 HE2 PHE 74 HE1 PHE 74 12.201 0.924 6.675 576 HZ PHE 74 HZ PHE 74 11.834 2.956 5.298 577 H ASP 75 HN ASP 75 16.907 0.950 10.708 578 HA ASP 75 HA ASP 75 19.740 1.614 11.381 579 1HB ASP 75 HB2 ASP 75 17.937 1.411 13.173 580 2HB ASP 75 HB1 ASP 75 17.889 -0.315 12.811 581 H GLY 76 HN GLY 76 19.883 0.510 9.008 582 1HA GLY 76 HA2 GLY 76 21.132 -1.256 8.014 583 2HA GLY 76 HA1 GLY 76 20.988 -2.168 9.517 584 HA PRO 77 HA PRO 77 18.032 -3.817 6.263 585 1HB PRO 77 HB2 PRO 77 19.025 -6.480 6.722 586 2HB PRO 77 HB1 PRO 77 19.256 -5.486 5.277 587 1HG PRO 77 HG2 PRO 77 21.225 -6.161 7.313 588 2HG PRO 77 HG1 PRO 77 21.473 -5.263 5.809 589 1HD PRO 77 HD2 PRO 77 21.406 -4.204 8.496 590 2HD PRO 77 HD1 PRO 77 21.619 -3.296 6.985 591 H GLY 78 HN GLY 78 18.630 -3.866 9.507 592 1HA GLY 78 HA2 GLY 78 16.559 -5.876 10.214 593 2HA GLY 78 HA1 GLY 78 17.604 -5.024 11.351 594 H GLY 79 HN GLY 79 15.064 -5.005 12.103 595 1HA GLY 79 HA2 GLY 79 13.473 -3.425 12.846 596 2HA GLY 79 HA1 GLY 79 14.322 -2.190 11.914 597 H ASN 80 HN ASN 80 12.209 -1.451 11.170 598 HA ASN 80 HA ASN 80 10.467 -3.178 9.643 599 1HB ASN 80 HB2 ASN 80 10.717 -0.158 9.762 600 2HB ASN 80 HB1 ASN 80 9.433 -1.010 8.902 601 1HD2 ASN 80 HD22 ASN 80 8.058 -2.341 12.036 602 2HD2 ASN 80 HD21 ASN 80 8.494 -2.916 10.500 603 H LEU 81 HN LEU 81 10.280 -3.324 7.362 604 HA LEU 81 HA LEU 81 12.789 -2.713 5.906 605 1HB LEU 81 HB2 LEU 81 10.331 -4.199 4.934 606 2HB LEU 81 HB1 LEU 81 11.940 -4.213 4.210 607 HG LEU 81 HG LEU 81 11.210 -5.283 6.954 608 1HD1 LEU 81 HD13 LEU 81 10.497 -6.670 5.002 609 2HD1 LEU 81 HD12 LEU 81 12.177 -6.724 4.466 610 3HD1 LEU 81 HD11 LEU 81 11.716 -7.463 6.000 611 1HD2 LEU 81 HD21 LEU 81 13.843 -4.851 5.546 612 2HD2 LEU 81 HD23 LEU 81 13.417 -4.528 7.225 613 3HD2 LEU 81 HD22 LEU 81 13.669 -6.186 6.686 614 H ALA 82 HN ALA 82 10.004 -1.097 6.577 615 HA ALA 82 HA ALA 82 10.449 0.953 4.648 616 1HB ALA 82 HB2 ALA 82 8.194 -0.973 4.020 617 2HB ALA 82 HB1 ALA 82 8.295 0.655 3.348 618 3HB ALA 82 HB3 ALA 82 9.543 -0.531 2.976 619 H HIS 83 HN HIS 83 8.369 2.469 4.632 620 HA HIS 83 HA HIS 83 6.542 2.176 6.853 621 1HB HIS 83 HB2 HIS 83 7.382 3.912 8.313 622 2HB HIS 83 HB1 HIS 83 8.686 2.755 8.049 623 HD1 HIS 83 HD1 HIS 83 8.806 5.997 8.648 624 HD2 HIS 83 HD2 HIS 83 9.686 4.004 5.091 625 HE1 HIS 83 HE1 HIS 83 10.349 7.518 7.336 626 H ALA 84 HN ALA 84 5.269 4.283 7.148 627 HA ALA 84 HA ALA 84 5.387 6.080 4.779 628 1HB ALA 84 HB3 ALA 84 2.966 4.425 5.566 629 2HB ALA 84 HB2 ALA 84 2.919 5.771 4.426 630 3HB ALA 84 HB1 ALA 84 3.863 4.329 4.051 631 H PHE 85 HN PHE 85 3.989 8.015 5.125 632 HA PHE 85 HA PHE 85 3.938 8.742 8.006 633 1HB PHE 85 HB2 PHE 85 3.554 10.380 5.480 634 2HB PHE 85 HB1 PHE 85 3.492 11.045 7.111 635 HD1 PHE 85 HD1 PHE 85 5.509 11.158 8.513 636 HD2 PHE 85 HD2 PHE 85 5.659 9.639 4.498 637 HE1 PHE 85 HE1 PHE 85 7.980 11.363 8.528 638 HE2 PHE 85 HE2 PHE 85 8.130 9.841 4.512 639 HZ PHE 85 HZ PHE 85 9.291 10.704 6.527 640 H GLN 86 HN GLN 86 1.963 9.911 8.830 641 HA GLN 86 HA GLN 86 -0.376 8.381 8.436 642 1HB GLN 86 HB2 GLN 86 -0.120 11.215 9.489 643 2HB GLN 86 HB1 GLN 86 -1.554 10.203 9.664 644 1HG GLN 86 HG2 GLN 86 -0.170 8.512 10.865 645 2HG GLN 86 HG1 GLN 86 1.205 9.613 10.770 646 1HE2 GLN 86 HE22 GLN 86 -1.949 11.100 12.952 647 2HE2 GLN 86 HE21 GLN 86 -2.239 10.426 11.421 648 HA PRO 87 HA PRO 87 -1.975 10.028 4.620 649 1HB PRO 87 HB2 PRO 87 -4.754 9.943 5.325 650 2HB PRO 87 HB1 PRO 87 -3.838 8.705 4.454 651 1HG PRO 87 HG2 PRO 87 -4.767 8.665 7.245 652 2HG PRO 87 HG1 PRO 87 -4.126 7.331 6.273 653 1HD PRO 87 HD2 PRO 87 -2.769 8.664 8.384 654 2HD PRO 87 HD1 PRO 87 -2.056 7.534 7.214 655 H GLY 88 HN GLY 88 -1.577 12.218 4.398 656 1HA GLY 88 HA2 GLY 88 -3.595 14.133 5.140 657 2HA GLY 88 HA1 GLY 88 -2.193 14.283 6.201 658 HA PRO 89 HA PRO 89 -1.607 16.560 2.069 659 1HB PRO 89 HB2 PRO 89 -1.207 19.045 3.469 660 2HB PRO 89 HB1 PRO 89 -2.546 18.619 2.395 661 1HG PRO 89 HG2 PRO 89 -2.591 18.869 5.296 662 2HG PRO 89 HG1 PRO 89 -3.947 18.551 4.205 663 1HD PRO 89 HD2 PRO 89 -2.672 16.679 5.993 664 2HD PRO 89 HD1 PRO 89 -3.984 16.354 4.840 665 H GLY 90 HN GLY 90 0.414 18.136 1.740 666 1HA GLY 90 HA2 GLY 90 2.737 18.370 1.859 667 2HA GLY 90 HA1 GLY 90 2.572 18.110 3.593 668 H ILE 91 HN ILE 91 3.916 16.506 4.197 669 HA ILE 91 HA ILE 91 4.743 14.422 2.332 670 HB ILE 91 HB ILE 91 6.251 15.454 4.066 671 1HG1 ILE 91 HG12 ILE 91 5.971 12.477 4.539 672 2HG1 ILE 91 HG11 ILE 91 6.543 13.116 2.999 673 1HG2 ILE 91 HG22 ILE 91 4.491 15.469 5.869 674 2HG2 ILE 91 HG21 ILE 91 4.688 13.721 6.007 675 3HG2 ILE 91 HG23 ILE 91 6.036 14.793 6.381 676 1HD1 ILE 91 HD13 ILE 91 8.326 14.365 4.211 677 2HD1 ILE 91 HD12 ILE 91 7.788 13.620 5.717 678 3HD1 ILE 91 HD11 ILE 91 8.459 12.619 4.429 679 H GLY 92 HN GLY 92 2.070 14.775 4.365 680 1HA GLY 92 HA2 GLY 92 1.800 12.138 5.421 681 2HA GLY 92 HA1 GLY 92 0.462 13.249 5.140 682 H GLY 93 HN GLY 93 1.050 10.252 4.544 683 1HA GLY 93 HA2 GLY 93 -0.130 8.878 2.981 684 2HA GLY 93 HA1 GLY 93 -0.298 10.268 1.909 685 H ASP 94 HN ASP 94 2.758 10.688 2.521 686 HA ASP 94 HA ASP 94 3.706 9.467 0.105 687 1HB ASP 94 HB2 ASP 94 5.085 10.766 2.457 688 2HB ASP 94 HB1 ASP 94 6.014 10.046 1.142 689 H ALA 95 HN ALA 95 4.524 7.473 -0.254 690 HA ALA 95 HA ALA 95 4.885 5.635 2.092 691 1HB ALA 95 HB1 ALA 95 4.318 5.097 -0.840 692 2HB ALA 95 HB3 ALA 95 4.699 3.832 0.327 693 3HB ALA 95 HB2 ALA 95 3.239 4.802 0.524 694 H HIS 96 HN HIS 96 6.953 4.979 2.537 695 HA HIS 96 HA HIS 96 9.076 5.450 0.458 696 1HB HIS 96 HB2 HIS 96 9.144 5.627 3.476 697 2HB HIS 96 HB1 HIS 96 10.605 5.545 2.495 698 HD2 HIS 96 HD2 HIS 96 8.013 7.832 0.664 699 HE1 HIS 96 HE1 HIS 96 10.585 10.209 3.073 700 HE2 HIS 96 HE2 HIS 96 8.824 10.247 1.252 701 H PHE 97 HN PHE 97 10.238 3.702 -0.176 702 HA PHE 97 HA PHE 97 9.869 1.119 1.316 703 1HB PHE 97 HB2 PHE 97 10.373 1.765 -1.594 704 2HB PHE 97 HB1 PHE 97 10.632 0.147 -0.944 705 HD1 PHE 97 HD1 PHE 97 8.104 2.784 -1.566 706 HD2 PHE 97 HD2 PHE 97 8.798 -1.264 -0.313 707 HE1 PHE 97 HE1 PHE 97 5.675 2.312 -1.742 708 HE2 PHE 97 HE2 PHE 97 6.371 -1.736 -0.492 709 HZ PHE 97 HZ PHE 97 4.810 0.050 -1.208 710 H ASP 98 HN ASP 98 11.670 0.150 2.154 711 HA ASP 98 HA ASP 98 14.206 1.555 2.165 712 1HB ASP 98 HB2 ASP 98 13.326 0.025 3.998 713 2HB ASP 98 HB1 ASP 98 13.712 -1.335 2.944 714 H GLU 99 HN GLU 99 15.296 1.666 0.233 715 HA GLU 99 HA GLU 99 15.181 -0.476 -1.733 716 1HB GLU 99 HB2 GLU 99 15.482 2.032 -2.173 717 2HB GLU 99 HB1 GLU 99 17.161 1.797 -1.712 718 1HG GLU 99 HG2 GLU 99 17.448 0.123 -3.479 719 2HG GLU 99 HG1 GLU 99 15.747 0.258 -3.910 720 H ASP 100 HN ASP 100 16.846 -0.296 1.129 721 HA ASP 100 HA ASP 100 19.437 -1.246 0.236 722 1HB ASP 100 HB2 ASP 100 18.082 -1.283 2.944 723 2HB ASP 100 HB1 ASP 100 19.725 -1.864 2.672 724 H GLU 101 HN GLU 101 16.423 -2.820 1.216 725 HA GLU 101 HA GLU 101 17.668 -5.479 1.246 726 1HB GLU 101 HB2 GLU 101 14.788 -4.546 1.409 727 2HB GLU 101 HB1 GLU 101 15.261 -6.242 1.459 728 1HG GLU 101 HG2 GLU 101 15.095 -5.604 3.736 729 2HG GLU 101 HG1 GLU 101 16.824 -5.575 3.400 730 H ARG 102 HN ARG 102 17.078 -7.175 -0.268 731 HA ARG 102 HA ARG 102 16.809 -6.146 -3.032 732 1HB ARG 102 HB2 ARG 102 18.567 -7.829 -2.455 733 2HB ARG 102 HB1 ARG 102 17.292 -8.977 -2.048 734 1HG ARG 102 HG2 ARG 102 16.417 -8.830 -4.346 735 2HG ARG 102 HG1 ARG 102 17.681 -7.677 -4.757 736 1HD ARG 102 HD2 ARG 102 18.185 -10.489 -3.761 737 2HD ARG 102 HD1 ARG 102 18.215 -10.036 -5.459 738 HE ARG 102 HE ARG 102 20.341 -9.721 -3.530 739 1HH1 ARG 102 HH21 ARG 102 18.809 -8.033 -6.126 740 2HH1 ARG 102 HH22 ARG 102 20.142 -6.952 -6.365 741 1HH2 ARG 102 HH11 ARG 102 22.067 -8.337 -3.842 742 2HH2 ARG 102 HH12 ARG 102 21.981 -7.122 -5.074 743 H TRP 103 HN TRP 103 14.815 -6.054 -3.944 744 HA TRP 103 HA TRP 103 12.577 -7.534 -2.719 745 1HB TRP 103 HB2 TRP 103 12.710 -5.494 -4.955 746 2HB TRP 103 HB1 TRP 103 11.213 -6.227 -4.381 747 HD1 TRP 103 HD1 TRP 103 13.229 -3.275 -3.861 748 HE1 TRP 103 HE1 TRP 103 12.751 -2.168 -1.582 749 HE3 TRP 103 HE3 TRP 103 10.657 -7.048 -1.555 750 HZ2 TRP 103 HZ2 TRP 103 11.463 -2.798 0.887 751 HZ3 TRP 103 HZ3 TRP 103 9.830 -6.767 0.755 752 HH2 TRP 103 HH2 TRP 103 10.222 -4.647 1.981 753 H THR 104 HN THR 104 11.306 -9.087 -3.803 754 HA THR 104 HA THR 104 12.277 -10.043 -6.465 755 HB THR 104 HB THR 104 12.116 -12.387 -5.652 756 HG1 THR 104 HG1 THR 104 10.989 -12.537 -3.888 757 1HG2 THR 104 HG22 THR 104 14.270 -11.105 -5.654 758 2HG2 THR 104 HG21 THR 104 13.977 -10.695 -3.965 759 3HG2 THR 104 HG23 THR 104 14.215 -12.377 -4.436 760 H ASN 105 HN ASN 105 10.685 -11.489 -7.514 761 HA ASN 105 HA ASN 105 7.878 -10.731 -6.783 762 1HB ASN 105 HB2 ASN 105 9.170 -11.469 -9.423 763 2HB ASN 105 HB1 ASN 105 7.428 -11.283 -9.209 764 1HD2 ASN 105 HD22 ASN 105 8.966 -7.992 -10.271 765 2HD2 ASN 105 HD21 ASN 105 9.026 -9.557 -10.926 766 H ASN 106 HN ASN 106 9.507 -13.037 -5.736 767 HA ASN 106 HA ASN 106 7.539 -15.175 -6.366 768 1HB ASN 106 HB2 ASN 106 9.623 -16.750 -6.487 769 2HB ASN 106 HB1 ASN 106 9.198 -15.795 -7.908 770 1HD2 ASN 106 HD22 ASN 106 12.463 -14.474 -7.916 771 2HD2 ASN 106 HD21 ASN 106 11.234 -15.260 -8.785 772 H PHE 107 HN PHE 107 8.780 -17.226 -4.917 773 HA PHE 107 HA PHE 107 8.160 -16.420 -2.216 774 1HB PHE 107 HB2 PHE 107 8.825 -18.715 -1.606 775 2HB PHE 107 HB1 PHE 107 7.761 -18.711 -3.012 776 HD1 PHE 107 HD1 PHE 107 8.640 -19.164 -5.263 777 HD2 PHE 107 HD2 PHE 107 11.173 -19.311 -1.797 778 HE1 PHE 107 HE1 PHE 107 10.366 -20.364 -6.575 779 HE2 PHE 107 HE2 PHE 107 12.901 -20.508 -3.110 780 HZ PHE 107 HZ PHE 107 12.500 -21.034 -5.503 781 H ARG 108 HN ARG 108 10.940 -15.857 -3.979 782 HA ARG 108 HA ARG 108 13.034 -16.507 -2.198 783 1HB ARG 108 HB2 ARG 108 12.749 -14.140 -4.056 784 2HB ARG 108 HB1 ARG 108 14.236 -14.533 -3.203 785 1HG ARG 108 HG2 ARG 108 14.269 -16.761 -4.258 786 2HG ARG 108 HG1 ARG 108 12.778 -16.374 -5.119 787 1HD ARG 108 HD2 ARG 108 15.403 -14.877 -5.390 788 2HD ARG 108 HD1 ARG 108 14.750 -16.020 -6.563 789 HE ARG 108 HE ARG 108 12.726 -14.132 -6.222 790 1HH1 ARG 108 HH21 ARG 108 16.073 -14.152 -7.067 791 2HH1 ARG 108 HH22 ARG 108 15.969 -12.734 -8.056 792 1HH2 ARG 108 HH11 ARG 108 12.568 -12.283 -7.499 793 2HH2 ARG 108 HH12 ARG 108 13.976 -11.668 -8.298 794 H GLU 109 HN GLU 109 14.323 -14.769 -1.007 795 HA GLU 109 HA GLU 109 13.843 -14.017 1.365 796 1HB GLU 109 HB2 GLU 109 14.369 -11.878 -0.703 797 2HB GLU 109 HB1 GLU 109 14.525 -11.622 1.034 798 1HG GLU 109 HG2 GLU 109 16.182 -13.436 1.169 799 2HG GLU 109 HG1 GLU 109 16.028 -13.712 -0.567 800 H TYR 110 HN TYR 110 12.385 -11.455 -0.674 801 HA TYR 110 HA TYR 110 9.867 -11.693 0.943 802 1HB TYR 110 HB2 TYR 110 11.302 -9.076 0.427 803 2HB TYR 110 HB1 TYR 110 9.841 -9.317 1.378 804 HD1 TYR 110 HD2 TYR 110 9.962 -10.708 3.494 805 HD2 TYR 110 HD1 TYR 110 13.449 -9.361 1.383 806 HE1 TYR 110 HE2 TYR 110 11.340 -11.098 5.520 807 HE2 TYR 110 HE1 TYR 110 14.830 -9.747 3.407 808 HH TYR 110 HH TYR 110 13.982 -11.611 5.878 809 H ASN 111 HN ASN 111 8.029 -10.676 -0.028 810 HA ASN 111 HA ASN 111 8.259 -10.338 -2.998 811 1HB ASN 111 HB2 ASN 111 5.758 -10.742 -1.330 812 2HB ASN 111 HB1 ASN 111 5.893 -10.838 -3.084 813 1HD2 ASN 111 HD22 ASN 111 6.024 -14.330 -1.780 814 2HD2 ASN 111 HD21 ASN 111 4.875 -13.081 -1.769 815 H LEU 112 HN LEU 112 8.161 -8.230 -3.690 816 HA LEU 112 HA LEU 112 7.764 -6.029 -1.948 817 1HB LEU 112 HB2 LEU 112 8.941 -5.838 -4.095 818 2HB LEU 112 HB1 LEU 112 7.438 -6.148 -4.959 819 HG LEU 112 HG LEU 112 6.458 -4.093 -4.019 820 1HD1 LEU 112 HD13 LEU 112 9.057 -4.044 -2.496 821 2HD1 LEU 112 HD12 LEU 112 8.262 -2.522 -2.897 822 3HD1 LEU 112 HD11 LEU 112 7.420 -3.722 -1.921 823 1HD2 LEU 112 HD23 LEU 112 7.801 -4.048 -6.139 824 2HD2 LEU 112 HD22 LEU 112 7.794 -2.506 -5.285 825 3HD2 LEU 112 HD21 LEU 112 9.205 -3.560 -5.190 826 H HIS 113 HN HIS 113 5.458 -7.698 -4.090 827 HA HIS 113 HA HIS 113 3.312 -5.856 -3.802 828 1HB HIS 113 HB2 HIS 113 3.338 -7.730 -5.441 829 2HB HIS 113 HB1 HIS 113 3.110 -8.866 -4.112 830 HD1 HIS 113 HD1 HIS 113 0.907 -8.034 -2.495 831 HD2 HIS 113 HD2 HIS 113 0.918 -7.050 -6.544 832 HE1 HIS 113 HE1 HIS 113 -1.495 -7.510 -3.114 833 H ARG 114 HN ARG 114 4.132 -8.715 -1.777 834 HA ARG 114 HA ARG 114 1.868 -8.518 -0.059 835 1HB ARG 114 HB2 ARG 114 4.666 -9.538 0.481 836 2HB ARG 114 HB1 ARG 114 3.341 -9.680 1.634 837 1HG ARG 114 HG2 ARG 114 2.024 -10.929 -0.030 838 2HG ARG 114 HG1 ARG 114 3.349 -10.798 -1.182 839 1HD ARG 114 HD2 ARG 114 4.817 -12.035 0.342 840 2HD ARG 114 HD1 ARG 114 3.538 -12.133 1.542 841 HE ARG 114 HE ARG 114 3.935 -13.848 -0.769 842 1HH1 ARG 114 HH21 ARG 114 1.482 -12.292 1.088 843 2HH1 ARG 114 HH22 ARG 114 0.212 -13.309 0.494 844 1HH2 ARG 114 HH11 ARG 114 2.302 -15.174 -1.547 845 2HH2 ARG 114 HH12 ARG 114 0.675 -14.938 -1.002 846 H VAL 115 HN VAL 115 5.077 -6.978 0.180 847 HA VAL 115 HA VAL 115 4.468 -5.668 2.689 848 HB VAL 115 HB VAL 115 6.541 -5.020 0.570 849 1HG1 VAL 115 HG13 VAL 115 6.006 -3.923 3.324 850 2HG1 VAL 115 HG12 VAL 115 7.665 -4.017 2.737 851 3HG1 VAL 115 HG11 VAL 115 6.472 -3.065 1.854 852 1HG2 VAL 115 HG21 VAL 115 6.576 -6.728 3.071 853 2HG2 VAL 115 HG23 VAL 115 6.903 -7.234 1.414 854 3HG2 VAL 115 HG22 VAL 115 8.046 -6.190 2.258 855 H ALA 116 HN ALA 116 4.308 -4.723 -0.729 856 HA ALA 116 HA ALA 116 3.615 -1.989 -0.330 857 1HB ALA 116 HB2 ALA 116 2.868 -3.930 -2.540 858 2HB ALA 116 HB1 ALA 116 2.532 -2.199 -2.603 859 3HB ALA 116 HB3 ALA 116 4.198 -2.772 -2.546 860 H ALA 117 HN ALA 117 1.599 -4.923 -0.524 861 HA ALA 117 HA ALA 117 -0.932 -3.646 -0.358 862 1HB ALA 117 HB3 ALA 117 -0.401 -6.146 -0.743 863 2HB ALA 117 HB2 ALA 117 -0.310 -6.269 1.014 864 3HB ALA 117 HB1 ALA 117 -1.814 -5.766 0.240 865 H HIS 118 HN HIS 118 1.242 -4.797 2.223 866 HA HIS 118 HA HIS 118 -0.405 -4.063 4.423 867 1HB HIS 118 HB2 HIS 118 1.603 -5.474 4.653 868 2HB HIS 118 HB1 HIS 118 2.623 -4.093 4.243 869 HD1 HIS 118 HD1 HIS 118 -0.212 -4.706 6.745 870 HD2 HIS 118 HD2 HIS 118 3.534 -2.886 6.535 871 HE1 HIS 118 HE1 HIS 118 0.238 -3.727 9.036 872 H GLU 119 HN GLU 119 2.150 -2.211 2.734 873 HA GLU 119 HA GLU 119 1.936 0.138 4.350 874 1HB GLU 119 HB2 GLU 119 2.789 -0.237 1.467 875 2HB GLU 119 HB1 GLU 119 2.919 1.297 2.328 876 1HG GLU 119 HG2 GLU 119 4.349 0.239 4.024 877 2HG GLU 119 HG1 GLU 119 4.211 -1.308 3.185 878 H LEU 120 HN LEU 120 0.221 -0.854 1.385 879 HA LEU 120 HA LEU 120 -1.187 1.607 1.015 880 1HB LEU 120 HB2 LEU 120 -1.890 -1.243 0.262 881 2HB LEU 120 HB1 LEU 120 -2.848 0.149 -0.235 882 HG LEU 120 HG LEU 120 0.114 -0.150 -0.818 883 1HD1 LEU 120 HD11 LEU 120 -2.325 -0.883 -2.452 884 2HD1 LEU 120 HD13 LEU 120 -0.740 -0.621 -3.180 885 3HD1 LEU 120 HD12 LEU 120 -0.967 -1.915 -2.004 886 1HD2 LEU 120 HD23 LEU 120 -2.005 1.875 -1.514 887 2HD2 LEU 120 HD22 LEU 120 -0.318 2.129 -1.069 888 3HD2 LEU 120 HD21 LEU 120 -0.724 1.559 -2.683 889 H GLY 121 HN GLY 121 -1.837 -1.258 2.981 890 1HA GLY 121 HA2 GLY 121 -4.492 -0.599 3.761 891 2HA GLY 121 HA1 GLY 121 -3.382 -1.582 4.717 892 H HIS 122 HN HIS 122 -1.347 0.359 5.136 893 HA HIS 122 HA HIS 122 -2.409 1.758 7.396 894 1HB HIS 122 HB2 HIS 122 0.165 2.055 5.825 895 2HB HIS 122 HB1 HIS 122 -0.191 3.042 7.242 896 HD1 HIS 122 HD1 HIS 122 -1.275 1.220 9.272 897 HD2 HIS 122 HD2 HIS 122 1.721 -0.068 6.672 898 HE1 HIS 122 HE1 HIS 122 -0.157 -0.759 10.390 899 H SER 123 HN SER 123 -1.727 2.770 4.065 900 HA SER 123 HA SER 123 -2.306 5.546 4.384 901 1HB SER 123 HB2 SER 123 -2.639 3.705 1.996 902 2HB SER 123 HB1 SER 123 -2.850 5.452 1.917 903 HG SER 123 HG SER 123 -0.712 4.755 1.379 904 H LEU 124 HN LEU 124 -4.372 2.733 3.837 905 HA LEU 124 HA LEU 124 -6.796 4.339 3.562 906 1HB LEU 124 HB2 LEU 124 -6.382 1.356 3.911 907 2HB LEU 124 HB1 LEU 124 -7.933 2.115 3.568 908 HG LEU 124 HG LEU 124 -5.488 2.430 1.797 909 1HD1 LEU 124 HD13 LEU 124 -7.794 0.473 1.665 910 2HD1 LEU 124 HD12 LEU 124 -6.756 0.830 0.285 911 3HD1 LEU 124 HD11 LEU 124 -6.073 0.102 1.740 912 1HD2 LEU 124 HD22 LEU 124 -8.391 3.248 1.606 913 2HD2 LEU 124 HD21 LEU 124 -6.947 4.202 1.269 914 3HD2 LEU 124 HD23 LEU 124 -7.462 2.954 0.139 915 H GLY 125 HN GLY 125 -4.924 3.664 6.190 916 1HA GLY 125 HA2 GLY 125 -5.476 4.265 8.433 917 2HA GLY 125 HA1 GLY 125 -7.185 4.202 8.010 918 H LEU 126 HN LEU 126 -5.726 1.405 6.839 919 HA LEU 126 HA LEU 126 -7.044 -0.195 8.886 920 1HB LEU 126 HB2 LEU 126 -5.132 -1.084 6.699 921 2HB LEU 126 HB1 LEU 126 -6.216 -2.124 7.622 922 HG LEU 126 HG LEU 126 -7.082 0.135 5.789 923 1HD1 LEU 126 HD13 LEU 126 -6.158 -1.939 4.691 924 2HD1 LEU 126 HD12 LEU 126 -7.446 -2.856 5.471 925 3HD1 LEU 126 HD11 LEU 126 -7.844 -1.601 4.297 926 1HD2 LEU 126 HD22 LEU 126 -8.560 -1.708 7.669 927 2HD2 LEU 126 HD21 LEU 126 -8.795 0.018 7.391 928 3HD2 LEU 126 HD23 LEU 126 -9.355 -1.150 6.197 929 H SER 127 HN SER 127 -6.090 -1.394 10.523 930 HA SER 127 HA SER 127 -3.285 -0.625 11.213 931 1HB SER 127 HB2 SER 127 -5.481 -1.814 12.929 932 2HB SER 127 HB1 SER 127 -3.900 -1.288 13.497 933 HG SER 127 HG SER 127 -4.455 0.816 12.728 934 H HIS 128 HN HIS 128 -2.216 -2.455 12.603 935 HA HIS 128 HA HIS 128 -1.740 -4.705 10.909 936 1HB HIS 128 HB2 HIS 128 -1.181 -4.335 13.869 937 2HB HIS 128 HB1 HIS 128 -0.510 -5.625 12.871 938 HD1 HIS 128 HD1 HIS 128 -0.143 -2.012 13.662 939 HD2 HIS 128 HD2 HIS 128 1.367 -4.709 10.862 940 HE1 HIS 128 HE1 HIS 128 1.838 -0.876 12.567 941 H SER 129 HN SER 129 -1.892 -7.010 12.250 942 HA SER 129 HA SER 129 -4.524 -7.307 13.541 943 1HB SER 129 HB2 SER 129 -5.080 -7.383 11.129 944 2HB SER 129 HB1 SER 129 -3.905 -8.675 10.900 945 HG SER 129 HG SER 129 -6.414 -8.918 11.579 946 H THR 130 HN THR 130 -4.761 -9.403 14.529 947 HA THR 130 HA THR 130 -2.145 -10.720 15.066 948 HB THR 130 HB THR 130 -3.182 -11.606 17.035 949 HG1 THR 130 HG1 THR 130 -5.679 -10.583 16.633 950 1HG2 THR 130 HG23 THR 130 -2.738 -9.064 16.882 951 2HG2 THR 130 HG22 THR 130 -4.490 -8.905 16.748 952 3HG2 THR 130 HG21 THR 130 -3.777 -9.630 18.189 953 H ASP 131 HN ASP 131 -4.539 -11.101 12.864 954 HA ASP 131 HA ASP 131 -4.865 -14.020 13.081 955 1HB ASP 131 HB2 ASP 131 -6.708 -12.541 12.268 956 2HB ASP 131 HB1 ASP 131 -5.720 -12.143 10.862 957 H ILE 132 HN ILE 132 -3.433 -15.420 12.214 958 HA ILE 132 HA ILE 132 -1.111 -14.598 10.787 959 HB ILE 132 HB ILE 132 -2.431 -17.315 11.030 960 1HG1 ILE 132 HG12 ILE 132 0.060 -16.191 12.345 961 2HG1 ILE 132 HG11 ILE 132 -1.535 -16.140 13.095 962 1HG2 ILE 132 HG21 ILE 132 0.143 -16.432 9.709 963 2HG2 ILE 132 HG23 ILE 132 -0.013 -18.053 10.389 964 3HG2 ILE 132 HG22 ILE 132 -1.091 -17.534 9.098 965 1HD1 ILE 132 HD11 ILE 132 -1.672 -18.628 12.862 966 2HD1 ILE 132 HD13 ILE 132 -0.017 -18.626 12.253 967 3HD1 ILE 132 HD12 ILE 132 -0.348 -18.107 13.906 968 H GLY 133 HN GLY 133 -4.221 -15.884 9.614 969 1HA GLY 133 HA2 GLY 133 -3.358 -16.054 6.862 970 2HA GLY 133 HA1 GLY 133 -5.030 -16.099 7.417 971 H ALA 134 HN ALA 134 -3.693 -13.337 8.713 972 HA ALA 134 HA ALA 134 -4.917 -11.677 6.561 973 1HB ALA 134 HB2 ALA 134 -4.111 -11.082 9.418 974 2HB ALA 134 HB1 ALA 134 -4.607 -9.829 8.285 975 3HB ALA 134 HB3 ALA 134 -5.737 -11.104 8.736 976 H LEU 135 HN LEU 135 -3.723 -10.268 5.337 977 HA LEU 135 HA LEU 135 -0.857 -10.633 5.179 978 1HB LEU 135 HB2 LEU 135 -2.662 -8.503 3.984 979 2HB LEU 135 HB1 LEU 135 -0.975 -8.748 3.540 980 HG LEU 135 HG LEU 135 -3.071 -10.925 3.317 981 1HD1 LEU 135 HD13 LEU 135 -2.107 -8.911 1.267 982 2HD1 LEU 135 HD12 LEU 135 -3.019 -10.365 0.866 983 3HD1 LEU 135 HD11 LEU 135 -3.755 -9.113 1.865 984 1HD2 LEU 135 HD23 LEU 135 -0.223 -10.575 2.342 985 2HD2 LEU 135 HD22 LEU 135 -0.898 -11.902 3.287 986 3HD2 LEU 135 HD21 LEU 135 -1.320 -11.730 1.589 987 H MET 136 HN MET 136 -2.964 -8.359 6.783 988 HA MET 136 HA MET 136 -0.966 -6.348 7.284 989 1HB MET 136 HB2 MET 136 -3.486 -6.966 8.859 990 2HB MET 136 HB1 MET 136 -2.590 -5.447 8.869 991 1HG MET 136 HG2 MET 136 -3.874 -6.662 6.408 992 2HG MET 136 HG1 MET 136 -4.593 -5.375 7.371 993 1HE MET 136 HE1 MET 136 -3.631 -3.366 7.956 994 2HE MET 136 HE3 MET 136 -1.864 -3.333 7.983 995 3HE MET 136 HE2 MET 136 -2.751 -2.317 6.851 996 H TYR 137 HN TYR 137 -0.612 -9.381 8.128 997 HA TYR 137 HA TYR 137 -0.329 -9.378 10.972 998 1HB TYR 137 HB2 TYR 137 -0.335 -11.404 9.401 999 2HB TYR 137 HB1 TYR 137 1.355 -11.027 9.070 1000 HD1 TYR 137 HD2 TYR 137 -1.058 -12.055 11.698 1001 HD2 TYR 137 HD1 TYR 137 3.078 -11.424 10.720 1002 HE1 TYR 137 HE2 TYR 137 -0.383 -13.226 13.779 1003 HE2 TYR 137 HE1 TYR 137 3.748 -12.592 12.803 1004 HH TYR 137 HH TYR 137 2.498 -12.997 15.171 1005 HA PRO 138 HA PRO 138 3.185 -6.627 11.283 1006 1HB PRO 138 HB2 PRO 138 4.337 -8.008 13.562 1007 2HB PRO 138 HB1 PRO 138 3.440 -6.483 13.546 1008 1HG PRO 138 HG2 PRO 138 2.517 -9.088 14.451 1009 2HG PRO 138 HG1 PRO 138 1.659 -7.542 14.519 1010 1HD PRO 138 HD2 PRO 138 1.077 -9.745 12.789 1011 2HD PRO 138 HD1 PRO 138 0.339 -8.130 12.748 1012 H SER 139 HN SER 139 3.911 -10.126 11.729 1013 HA SER 139 HA SER 139 6.642 -9.734 10.732 1014 1HB SER 139 HB2 SER 139 7.001 -12.008 11.195 1015 2HB SER 139 HB1 SER 139 5.848 -11.518 12.434 1016 HG SER 139 HG SER 139 5.465 -13.513 11.052 1017 H TYR 140 HN TYR 140 7.453 -10.952 8.857 1018 HA TYR 140 HA TYR 140 5.625 -10.679 6.561 1019 1HB TYR 140 HB2 TYR 140 7.921 -9.805 6.396 1020 2HB TYR 140 HB1 TYR 140 8.560 -11.418 6.713 1021 HD1 TYR 140 HD2 TYR 140 6.815 -9.283 4.278 1022 HD2 TYR 140 HD1 TYR 140 8.431 -13.189 5.033 1023 HE1 TYR 140 HE2 TYR 140 6.624 -9.827 1.866 1024 HE2 TYR 140 HE1 TYR 140 8.241 -13.735 2.623 1025 HH TYR 140 HH TYR 140 6.850 -11.409 0.308 1026 H THR 141 HN THR 141 4.629 -12.406 5.607 1027 HA THR 141 HA THR 141 5.828 -15.083 5.724 1028 HB THR 141 HB THR 141 3.728 -16.099 6.687 1029 HG1 THR 141 HG1 THR 141 2.365 -14.683 7.814 1030 1HG2 THR 141 HG21 THR 141 5.855 -15.553 8.014 1031 2HG2 THR 141 HG23 THR 141 4.974 -14.156 8.632 1032 3HG2 THR 141 HG22 THR 141 4.379 -15.786 8.946 1033 H PHE 142 HN PHE 142 5.693 -15.494 3.563 1034 HA PHE 142 HA PHE 142 3.407 -14.524 1.996 1035 1HB PHE 142 HB2 PHE 142 4.592 -15.296 0.076 1036 2HB PHE 142 HB1 PHE 142 5.822 -14.638 1.150 1037 HD1 PHE 142 HD1 PHE 142 7.254 -16.182 2.503 1038 HD2 PHE 142 HD2 PHE 142 4.507 -17.623 -0.464 1039 HE1 PHE 142 HE1 PHE 142 8.415 -18.374 2.491 1040 HE2 PHE 142 HE2 PHE 142 5.662 -19.812 -0.478 1041 HZ PHE 142 HZ PHE 142 7.615 -20.188 0.997 1042 H SER 143 HN SER 143 1.642 -15.710 1.472 1043 HA SER 143 HA SER 143 1.457 -18.489 2.503 1044 1HB SER 143 HB2 SER 143 -0.928 -18.242 2.162 1045 2HB SER 143 HB1 SER 143 -0.342 -16.781 2.953 1046 HG SER 143 HG SER 143 -1.473 -17.112 0.500 1047 H GLY 144 HN GLY 144 2.553 -17.106 -0.244 1048 1HA GLY 144 HA2 GLY 144 3.098 -18.202 -2.287 1049 2HA GLY 144 HA1 GLY 144 2.014 -19.524 -1.839 1050 H ASP 145 HN ASP 145 -0.183 -17.694 -1.162 1051 HA ASP 145 HA ASP 145 -0.984 -16.771 -3.910 1052 1HB ASP 145 HB2 ASP 145 -2.649 -18.081 -1.734 1053 2HB ASP 145 HB1 ASP 145 -3.331 -17.321 -3.172 1054 H VAL 146 HN VAL 146 -1.550 -14.621 -3.979 1055 HA VAL 146 HA VAL 146 -1.706 -13.160 -1.383 1056 HB VAL 146 HB VAL 146 -1.494 -12.149 -4.231 1057 1HG1 VAL 146 HG11 VAL 146 -1.566 -10.774 -1.539 1058 2HG1 VAL 146 HG13 VAL 146 -0.841 -10.010 -2.955 1059 3HG1 VAL 146 HG12 VAL 146 -2.551 -10.439 -2.964 1060 1HG2 VAL 146 HG23 VAL 146 0.488 -13.408 -3.219 1061 2HG2 VAL 146 HG22 VAL 146 0.818 -11.759 -3.748 1062 3HG2 VAL 146 HG21 VAL 146 0.591 -12.104 -2.034 1063 H GLN 147 HN GLN 147 -3.756 -13.203 -0.595 1064 HA GLN 147 HA GLN 147 -5.924 -12.116 -2.326 1065 1HB GLN 147 HB2 GLN 147 -6.056 -14.671 -0.688 1066 2HB GLN 147 HB1 GLN 147 -7.483 -13.839 -1.304 1067 1HG GLN 147 HG2 GLN 147 -5.202 -14.799 -3.055 1068 2HG GLN 147 HG1 GLN 147 -6.690 -15.706 -2.790 1069 1HE2 GLN 147 HE22 GLN 147 -6.683 -12.858 -5.581 1070 2HE2 GLN 147 HE21 GLN 147 -5.275 -13.522 -4.902 1071 H LEU 148 HN LEU 148 -7.545 -10.985 -1.081 1072 HA LEU 148 HA LEU 148 -6.534 -9.911 1.432 1073 1HB LEU 148 HB2 LEU 148 -9.275 -9.599 0.165 1074 2HB LEU 148 HB1 LEU 148 -8.652 -8.640 1.506 1075 HG LEU 148 HG LEU 148 -7.328 -8.780 -1.224 1076 1HD1 LEU 148 HD13 LEU 148 -9.589 -7.787 -1.366 1077 2HD1 LEU 148 HD12 LEU 148 -9.166 -6.656 -0.081 1078 3HD1 LEU 148 HD11 LEU 148 -8.335 -6.575 -1.634 1079 1HD2 LEU 148 HD23 LEU 148 -6.896 -7.133 1.278 1080 2HD2 LEU 148 HD22 LEU 148 -5.708 -8.050 0.350 1081 3HD2 LEU 148 HD21 LEU 148 -6.364 -6.550 -0.298 1082 H ALA 149 HN ALA 149 -7.707 -10.066 3.486 1083 HA ALA 149 HA ALA 149 -8.930 -12.770 3.842 1084 1HB ALA 149 HB3 ALA 149 -6.916 -12.161 5.206 1085 2HB ALA 149 HB2 ALA 149 -7.851 -10.859 5.939 1086 3HB ALA 149 HB1 ALA 149 -8.329 -12.539 6.190 1087 H GLN 150 HN GLN 150 -10.837 -12.916 5.236 1088 HA GLN 150 HA GLN 150 -12.873 -11.042 4.586 1089 1HB GLN 150 HB2 GLN 150 -13.289 -13.393 5.322 1090 2HB GLN 150 HB1 GLN 150 -12.787 -12.940 6.950 1091 1HG GLN 150 HG2 GLN 150 -14.609 -11.317 7.105 1092 2HG GLN 150 HG1 GLN 150 -15.086 -11.662 5.441 1093 1HE2 GLN 150 HE22 GLN 150 -17.250 -13.751 7.638 1094 2HE2 GLN 150 HE21 GLN 150 -17.020 -12.088 7.391 1095 H ASP 151 HN ASP 151 -10.814 -11.342 7.466 1096 HA ASP 151 HA ASP 151 -12.088 -9.354 9.047 1097 1HB ASP 151 HB2 ASP 151 -10.346 -10.874 9.930 1098 2HB ASP 151 HB1 ASP 151 -9.136 -10.061 8.937 1099 H ASP 152 HN ASP 152 -9.565 -9.069 6.528 1100 HA ASP 152 HA ASP 152 -9.282 -6.201 6.926 1101 1HB ASP 152 HB2 ASP 152 -8.415 -8.078 4.714 1102 2HB ASP 152 HB1 ASP 152 -8.075 -6.347 4.689 1103 H ILE 153 HN ILE 153 -11.077 -8.268 4.655 1104 HA ILE 153 HA ILE 153 -12.051 -6.163 2.984 1105 HB ILE 153 HB ILE 153 -13.244 -8.860 3.689 1106 1HG1 ILE 153 HG12 ILE 153 -11.834 -7.923 1.174 1107 2HG1 ILE 153 HG11 ILE 153 -11.012 -8.753 2.496 1108 1HG2 ILE 153 HG22 ILE 153 -14.082 -6.767 1.668 1109 2HG2 ILE 153 HG21 ILE 153 -14.531 -8.465 1.513 1110 3HG2 ILE 153 HG23 ILE 153 -15.072 -7.536 2.910 1111 1HD1 ILE 153 HD12 ILE 153 -12.670 -10.634 2.248 1112 2HD1 ILE 153 HD11 ILE 153 -13.282 -9.828 0.804 1113 3HD1 ILE 153 HD13 ILE 153 -11.621 -10.414 0.847 1114 H ASP 154 HN ASP 154 -13.563 -7.737 5.827 1115 HA ASP 154 HA ASP 154 -15.895 -6.109 5.872 1116 1HB ASP 154 HB2 ASP 154 -14.400 -7.521 8.097 1117 2HB ASP 154 HB1 ASP 154 -15.954 -6.720 8.331 1118 H GLY 155 HN GLY 155 -12.688 -5.623 7.322 1119 1HA GLY 155 HA2 GLY 155 -13.309 -3.326 8.867 1120 2HA GLY 155 HA1 GLY 155 -11.706 -3.712 8.253 1121 H ILE 156 HN ILE 156 -11.788 -3.384 5.602 1122 HA ILE 156 HA ILE 156 -12.028 -0.537 5.301 1123 HB ILE 156 HB ILE 156 -10.411 -1.965 4.027 1124 1HG1 ILE 156 HG12 ILE 156 -10.752 -0.788 1.834 1125 2HG1 ILE 156 HG11 ILE 156 -12.334 -0.263 2.404 1126 1HG2 ILE 156 HG23 ILE 156 -12.183 -3.743 3.569 1127 2HG2 ILE 156 HG22 ILE 156 -12.783 -2.679 2.296 1128 3HG2 ILE 156 HG21 ILE 156 -11.141 -3.317 2.210 1129 1HD1 ILE 156 HD12 ILE 156 -9.954 0.313 4.139 1130 2HD1 ILE 156 HD11 ILE 156 -10.188 1.286 2.690 1131 3HD1 ILE 156 HD13 ILE 156 -11.440 1.239 3.926 1132 H GLN 157 HN GLN 157 -14.128 -3.241 4.380 1133 HA GLN 157 HA GLN 157 -15.945 -1.658 2.794 1134 1HB GLN 157 HB2 GLN 157 -16.403 -4.227 4.341 1135 2HB GLN 157 HB1 GLN 157 -17.543 -3.545 3.184 1136 1HG GLN 157 HG2 GLN 157 -14.699 -4.045 2.331 1137 2HG GLN 157 HG1 GLN 157 -15.832 -5.388 2.402 1138 1HE2 GLN 157 HE22 GLN 157 -16.554 -2.410 -0.339 1139 2HE2 GLN 157 HE21 GLN 157 -15.720 -2.022 1.083 1140 H ALA 158 HN ALA 158 -15.827 -2.529 6.241 1141 HA ALA 158 HA ALA 158 -18.349 -1.441 6.983 1142 1HB ALA 158 HB3 ALA 158 -15.762 -1.783 8.509 1143 2HB ALA 158 HB2 ALA 158 -17.227 -1.160 9.265 1144 3HB ALA 158 HB1 ALA 158 -17.208 -2.788 8.587 1145 H ILE 159 HN ILE 159 -15.151 0.106 6.715 1146 HA ILE 159 HA ILE 159 -15.951 2.653 7.778 1147 HB ILE 159 HB ILE 159 -13.765 1.925 5.809 1148 1HG1 ILE 159 HG12 ILE 159 -13.567 2.555 8.765 1149 2HG1 ILE 159 HG11 ILE 159 -13.741 0.910 8.154 1150 1HG2 ILE 159 HG21 ILE 159 -14.405 4.481 7.293 1151 2HG2 ILE 159 HG23 ILE 159 -12.785 4.128 6.694 1152 3HG2 ILE 159 HG22 ILE 159 -14.133 4.264 5.565 1153 1HD1 ILE 159 HD12 ILE 159 -11.704 1.310 6.724 1154 2HD1 ILE 159 HD11 ILE 159 -11.491 2.849 7.557 1155 3HD1 ILE 159 HD13 ILE 159 -11.383 1.335 8.457 1156 H TYR 160 HN TYR 160 -15.629 1.527 4.392 1157 HA TYR 160 HA TYR 160 -17.079 3.963 3.483 1158 1HB TYR 160 HB2 TYR 160 -15.575 1.785 2.010 1159 2HB TYR 160 HB1 TYR 160 -16.473 3.065 1.192 1160 HD1 TYR 160 HD2 TYR 160 -15.737 5.395 1.313 1161 HD2 TYR 160 HD1 TYR 160 -13.530 2.268 3.259 1162 HE1 TYR 160 HE2 TYR 160 -13.816 6.934 1.597 1163 HE2 TYR 160 HE1 TYR 160 -11.604 3.810 3.547 1164 HH TYR 160 HH TYR 160 -10.720 5.809 2.820 1165 H GLY 161 HN GLY 161 -17.218 0.456 2.778 1166 1HA GLY 161 HA2 GLY 161 -19.652 -0.388 3.418 1167 2HA GLY 161 HA1 GLY 161 -20.109 0.741 2.141 1168 H ARG 162 HN ARG 162 -20.775 -1.814 1.644 1169 HA ARG 162 HA ARG 162 -18.642 -3.184 0.186 1170 1HB ARG 162 HB2 ARG 162 -21.578 -3.787 0.566 1171 2HB ARG 162 HB1 ARG 162 -20.495 -4.794 -0.395 1172 1HG ARG 162 HG2 ARG 162 -19.025 -5.063 1.599 1173 2HG ARG 162 HG1 ARG 162 -20.191 -4.152 2.549 1174 1HD ARG 162 HD2 ARG 162 -20.734 -6.747 1.089 1175 2HD ARG 162 HD1 ARG 162 -20.535 -6.586 2.829 1176 HE ARG 162 HE ARG 162 -22.947 -6.155 1.312 1177 1HH1 ARG 162 HH21 ARG 162 -21.144 -4.792 3.922 1178 2HH1 ARG 162 HH22 ARG 162 -22.475 -3.852 4.509 1179 1HH2 ARG 162 HH11 ARG 162 -24.670 -4.940 2.069 1180 2HH2 ARG 162 HH12 ARG 162 -24.458 -3.922 3.453 1181 H SER 163 HN SER 163 -18.644 -3.529 -2.080 1182 HA SER 163 HA SER 163 -19.612 -1.273 -3.614 1183 1HB SER 163 HB2 SER 163 -18.644 -3.952 -4.672 1184 2HB SER 163 HB1 SER 163 -18.647 -2.410 -5.524 1185 HG SER 163 HG SER 163 -16.900 -1.828 -4.476 1186 H GLN 164 HN GLN 164 -21.877 -1.265 -3.294 1187 HA GLN 164 HA GLN 164 -23.555 -3.560 -3.578 1188 1HB GLN 164 HB2 GLN 164 -24.148 -0.606 -3.873 1189 2HB GLN 164 HB1 GLN 164 -25.395 -1.852 -3.935 1190 1HG GLN 164 HG2 GLN 164 -24.845 -2.592 -1.688 1191 2HG GLN 164 HG1 GLN 164 -23.467 -1.491 -1.622 1192 1HE2 GLN 164 HE22 GLN 164 -26.381 0.162 0.078 1193 2HE2 GLN 164 HE21 GLN 164 -25.524 -1.282 0.329 1194 H ASN 165 HN ASN 165 -24.446 -4.520 -5.309 1195 HA ASN 165 HA ASN 165 -24.500 -3.224 -7.954 1196 1HB ASN 165 HB2 ASN 165 -22.945 -5.776 -7.447 1197 2HB ASN 165 HB1 ASN 165 -23.232 -5.046 -9.027 1198 1HD2 ASN 165 HD22 ASN 165 -21.057 -2.200 -8.257 1199 2HD2 ASN 165 HD21 ASN 165 -22.577 -2.503 -8.947 1200 HA PRO 166 HA PRO 166 -28.102 -5.973 -7.019 1201 1HB PRO 166 HB2 PRO 166 -29.609 -4.491 -9.029 1202 2HB PRO 166 HB1 PRO 166 -29.859 -4.527 -7.279 1203 1HG PRO 166 HG2 PRO 166 -28.816 -2.342 -8.793 1204 2HG PRO 166 HG1 PRO 166 -28.868 -2.475 -7.030 1205 1HD PRO 166 HD2 PRO 166 -26.550 -2.714 -8.811 1206 2HD PRO 166 HD1 PRO 166 -26.573 -2.585 -7.038 1207 H VAL 167 HN VAL 167 -25.994 -6.783 -8.676 1208 HA VAL 167 HA VAL 167 -27.133 -7.562 -11.288 1209 HB VAL 167 HB VAL 167 -24.726 -6.858 -11.002 1210 1HG1 VAL 167 HG12 VAL 167 -24.546 -8.095 -8.766 1211 2HG1 VAL 167 HG11 VAL 167 -24.362 -9.568 -9.717 1212 3HG1 VAL 167 HG13 VAL 167 -23.180 -8.269 -9.867 1213 1HG2 VAL 167 HG23 VAL 167 -25.567 -8.345 -12.874 1214 2HG2 VAL 167 HG22 VAL 167 -23.857 -8.539 -12.493 1215 3HG2 VAL 167 HG21 VAL 167 -25.025 -9.730 -11.924 1216 H GLN 168 HN GLN 168 -27.574 -9.778 -11.824 1217 HA GLN 168 HA GLN 168 -28.438 -11.387 -9.563 1218 1HB GLN 168 HB2 GLN 168 -28.396 -11.944 -12.536 1219 2HB GLN 168 HB1 GLN 168 -29.165 -12.993 -11.350 1220 1HG GLN 168 HG2 GLN 168 -30.677 -11.216 -10.681 1221 2HG GLN 168 HG1 GLN 168 -29.845 -10.069 -11.732 1222 1HE2 GLN 168 HE22 GLN 168 -32.343 -10.898 -14.115 1223 2HE2 GLN 168 HE21 GLN 168 -31.765 -9.710 -13.050 1224 HA PRO 169 HA PRO 169 -24.792 -13.852 -8.983 1225 1HB PRO 169 HB2 PRO 169 -26.250 -16.392 -8.962 1226 2HB PRO 169 HB1 PRO 169 -25.503 -15.542 -7.602 1227 1HG PRO 169 HG2 PRO 169 -28.316 -15.746 -8.193 1228 2HG PRO 169 HG1 PRO 169 -27.559 -14.841 -6.874 1229 1HD PRO 169 HD2 PRO 169 -28.834 -13.765 -9.220 1230 2HD PRO 169 HD1 PRO 169 -28.018 -12.869 -7.922 No H/Q in entry = 1230 Start of MODEL 27 1 1H VAL 1 HT2 VAL 1 -2.558 10.238 19.113 2 2H VAL 1 HT1 VAL 1 -1.830 8.879 18.402 3 3H VAL 1 HT3 VAL 1 -0.917 9.905 19.398 4 HA VAL 1 HA VAL 1 -0.973 11.659 17.836 5 HB VAL 1 HB VAL 1 -0.172 10.338 15.711 6 1HG1 VAL 1 HG11 VAL 1 1.083 10.157 18.456 7 2HG1 VAL 1 HG13 VAL 1 1.911 9.601 17.001 8 3HG1 VAL 1 HG12 VAL 1 1.455 11.297 17.163 9 1HG2 VAL 1 HG23 VAL 1 -1.474 8.276 16.521 10 2HG2 VAL 1 HG22 VAL 1 0.189 7.998 16.002 11 3HG2 VAL 1 HG21 VAL 1 -0.197 8.078 17.722 12 H LEU 2 HN LEU 2 -3.661 11.503 18.109 13 HA LEU 2 HA LEU 2 -5.038 10.584 15.738 14 1HB LEU 2 HB2 LEU 2 -5.882 12.639 17.805 15 2HB LEU 2 HB1 LEU 2 -6.948 11.881 16.624 16 HG LEU 2 HG LEU 2 -5.344 10.348 18.692 17 1HD1 LEU 2 HD12 LEU 2 -8.254 11.202 18.700 18 2HD1 LEU 2 HD11 LEU 2 -7.540 10.060 19.839 19 3HD1 LEU 2 HD13 LEU 2 -7.001 11.740 19.819 20 1HD2 LEU 2 HD21 LEU 2 -7.367 9.602 16.578 21 2HD2 LEU 2 HD23 LEU 2 -5.843 8.813 16.987 22 3HD2 LEU 2 HD22 LEU 2 -7.239 8.629 18.042 23 H THR 3 HN THR 3 -5.560 11.699 13.874 24 HA THR 3 HA THR 3 -4.121 14.261 13.412 25 HB THR 3 HB THR 3 -4.719 13.857 11.026 26 HG1 THR 3 HG1 THR 3 -6.454 12.201 12.159 27 1HG2 THR 3 HG23 THR 3 -2.649 12.895 12.122 28 2HG2 THR 3 HG22 THR 3 -3.531 11.377 12.287 29 3HG2 THR 3 HG21 THR 3 -3.198 12.034 10.685 30 H GLU 4 HN GLU 4 -5.346 15.964 12.146 31 HA GLU 4 HA GLU 4 -7.824 16.590 13.508 32 1HB GLU 4 HB2 GLU 4 -6.248 18.337 12.685 33 2HB GLU 4 HB1 GLU 4 -6.635 17.871 11.028 34 1HG GLU 4 HG2 GLU 4 -8.999 18.440 11.399 35 2HG GLU 4 HG1 GLU 4 -8.643 18.870 13.072 36 H GLY 5 HN GLY 5 -9.905 16.189 12.842 37 1HA GLY 5 HA2 GLY 5 -11.672 15.564 11.398 38 2HA GLY 5 HA1 GLY 5 -10.530 15.594 10.051 39 H ASN 6 HN ASN 6 -11.986 13.505 9.733 40 HA ASN 6 HA ASN 6 -11.210 11.222 11.353 41 1HB ASN 6 HB2 ASN 6 -12.732 11.453 8.754 42 2HB ASN 6 HB1 ASN 6 -12.477 9.930 9.606 43 1HD2 ASN 6 HD22 ASN 6 -14.642 10.855 12.354 44 2HD2 ASN 6 HD21 ASN 6 -13.230 9.977 12.009 45 HA PRO 7 HA PRO 7 -7.463 10.682 8.860 46 1HB PRO 7 HB2 PRO 7 -6.876 8.078 9.877 47 2HB PRO 7 HB1 PRO 7 -6.224 9.610 10.468 48 1HG PRO 7 HG2 PRO 7 -8.244 7.878 11.718 49 2HG PRO 7 HG1 PRO 7 -7.368 9.246 12.421 50 1HD PRO 7 HD2 PRO 7 -10.107 9.214 11.600 51 2HD PRO 7 HD1 PRO 7 -9.164 10.629 12.122 52 H ARG 8 HN ARG 8 -9.794 10.296 7.483 53 HA ARG 8 HA ARG 8 -9.227 7.824 5.905 54 1HB ARG 8 HB2 ARG 8 -11.983 8.701 6.842 55 2HB ARG 8 HB1 ARG 8 -11.648 7.353 5.754 56 1HG ARG 8 HG2 ARG 8 -10.322 6.249 7.517 57 2HG ARG 8 HG1 ARG 8 -10.654 7.592 8.610 58 1HD ARG 8 HD2 ARG 8 -13.073 7.131 8.446 59 2HD ARG 8 HD1 ARG 8 -12.739 5.778 7.364 60 HE ARG 8 HE ARG 8 -11.220 5.212 9.609 61 1HH1 ARG 8 HH21 ARG 8 -14.512 6.011 8.958 62 2HH1 ARG 8 HH22 ARG 8 -15.137 5.093 10.286 63 1HH2 ARG 8 HH11 ARG 8 -12.017 4.017 11.352 64 2HH2 ARG 8 HH12 ARG 8 -13.723 3.966 11.642 65 H TRP 9 HN TRP 9 -9.528 8.132 3.694 66 HA TRP 9 HA TRP 9 -9.634 10.855 2.736 67 1HB TRP 9 HB2 TRP 9 -9.863 8.217 1.259 68 2HB TRP 9 HB1 TRP 9 -9.666 9.786 0.479 69 HD1 TRP 9 HD1 TRP 9 -7.793 7.166 2.476 70 HE1 TRP 9 HE1 TRP 9 -5.281 7.737 2.479 71 HE3 TRP 9 HE3 TRP 9 -7.941 11.803 0.343 72 HZ2 TRP 9 HZ2 TRP 9 -3.560 9.877 1.682 73 HZ3 TRP 9 HZ3 TRP 9 -5.852 13.084 -0.023 74 HH2 TRP 9 HH2 TRP 9 -3.661 12.128 0.643 75 H GLU 10 HN GLU 10 -11.421 12.041 2.258 76 HA GLU 10 HA GLU 10 -14.076 10.825 2.532 77 1HB GLU 10 HB2 GLU 10 -13.171 13.644 1.869 78 2HB GLU 10 HB1 GLU 10 -14.854 13.172 2.106 79 1HG GLU 10 HG2 GLU 10 -14.355 12.432 4.388 80 2HG GLU 10 HG1 GLU 10 -12.651 12.824 4.164 81 H GLN 11 HN GLN 11 -11.862 11.304 -0.004 82 HA GLN 11 HA GLN 11 -13.909 11.574 -2.117 83 1HB GLN 11 HB2 GLN 11 -10.894 11.245 -2.192 84 2HB GLN 11 HB1 GLN 11 -11.898 11.381 -3.635 85 1HG GLN 11 HG2 GLN 11 -12.723 13.574 -2.855 86 2HG GLN 11 HG1 GLN 11 -11.712 13.440 -1.416 87 1HE2 GLN 11 HE22 GLN 11 -9.162 15.094 -3.212 88 2HE2 GLN 11 HE21 GLN 11 -10.165 15.086 -1.843 89 H THR 12 HN THR 12 -14.475 9.877 -3.556 90 HA THR 12 HA THR 12 -13.879 7.146 -2.559 91 HB THR 12 HB THR 12 -15.616 6.418 -4.107 92 HG1 THR 12 HG1 THR 12 -15.912 9.094 -4.931 93 1HG2 THR 12 HG23 THR 12 -16.283 7.483 -1.938 94 2HG2 THR 12 HG22 THR 12 -16.483 9.008 -2.801 95 3HG2 THR 12 HG21 THR 12 -17.507 7.628 -3.199 96 H HIS 13 HN HIS 13 -12.555 9.333 -4.675 97 HA HIS 13 HA HIS 13 -11.304 7.176 -6.347 98 1HB HIS 13 HB2 HIS 13 -11.981 10.035 -7.120 99 2HB HIS 13 HB1 HIS 13 -11.091 8.895 -8.130 100 HD1 HIS 13 HD1 HIS 13 -14.446 9.019 -6.303 101 HD2 HIS 13 HD2 HIS 13 -12.749 7.413 -9.756 102 HE1 HIS 13 HE1 HIS 13 -16.323 7.870 -7.557 103 H LEU 14 HN LEU 14 -9.090 7.203 -6.392 104 HA LEU 14 HA LEU 14 -7.655 9.531 -5.168 105 1HB LEU 14 HB2 LEU 14 -7.099 6.593 -4.637 106 2HB LEU 14 HB1 LEU 14 -6.158 7.946 -4.010 107 HG LEU 14 HG LEU 14 -9.117 7.552 -3.470 108 1HD1 LEU 14 HD12 LEU 14 -6.663 6.730 -1.904 109 2HD1 LEU 14 HD11 LEU 14 -8.237 6.945 -1.139 110 3HD1 LEU 14 HD13 LEU 14 -8.027 5.727 -2.396 111 1HD2 LEU 14 HD21 LEU 14 -7.012 9.510 -2.535 112 2HD2 LEU 14 HD23 LEU 14 -8.649 9.832 -3.103 113 3HD2 LEU 14 HD22 LEU 14 -8.394 9.140 -1.506 114 H THR 15 HN THR 15 -5.358 9.592 -5.811 115 HA THR 15 HA THR 15 -4.807 8.171 -8.398 116 HB THR 15 HB THR 15 -3.811 10.225 -9.261 117 HG1 THR 15 HG1 THR 15 -4.128 12.145 -7.943 118 1HG2 THR 15 HG21 THR 15 -6.332 9.795 -9.392 119 2HG2 THR 15 HG23 THR 15 -6.493 10.966 -8.083 120 3HG2 THR 15 HG22 THR 15 -5.814 11.464 -9.631 121 H TYR 16 HN TYR 16 -2.554 7.724 -8.767 122 HA TYR 16 HA TYR 16 -0.678 8.359 -6.545 123 1HB TYR 16 HB2 TYR 16 -0.053 6.050 -6.201 124 2HB TYR 16 HB1 TYR 16 -1.799 6.180 -5.999 125 HD1 TYR 16 HD2 TYR 16 -3.312 5.561 -7.929 126 HD2 TYR 16 HD1 TYR 16 0.890 4.664 -7.899 127 HE1 TYR 16 HE2 TYR 16 -3.659 3.878 -9.717 128 HE2 TYR 16 HE1 TYR 16 0.542 2.982 -9.688 129 HH TYR 16 HH TYR 16 -2.293 1.663 -10.443 130 H ARG 17 HN ARG 17 1.543 8.138 -7.153 131 HA ARG 17 HA ARG 17 2.115 7.471 -9.997 132 1HB ARG 17 HB2 ARG 17 1.609 9.887 -9.972 133 2HB ARG 17 HB1 ARG 17 2.818 10.132 -8.715 134 1HG ARG 17 HG2 ARG 17 4.576 9.324 -10.234 135 2HG ARG 17 HG1 ARG 17 3.378 9.041 -11.492 136 1HD ARG 17 HD2 ARG 17 2.803 11.449 -11.457 137 2HD ARG 17 HD1 ARG 17 4.037 11.732 -10.235 138 HE ARG 17 HE ARG 17 4.421 11.538 -13.094 139 1HH1 ARG 17 HH21 ARG 17 5.870 10.562 -10.112 140 2HH1 ARG 17 HH22 ARG 17 7.416 10.252 -10.830 141 1HH2 ARG 17 HH11 ARG 17 6.415 11.140 -14.024 142 2HH2 ARG 17 HH12 ARG 17 7.721 10.573 -13.038 143 H ILE 18 HN ILE 18 4.100 6.508 -10.208 144 HA ILE 18 HA ILE 18 5.710 6.152 -7.749 145 HB ILE 18 HB ILE 18 6.068 4.988 -10.532 146 1HG1 ILE 18 HG12 ILE 18 5.005 3.656 -8.021 147 2HG1 ILE 18 HG11 ILE 18 3.964 4.322 -9.281 148 1HG2 ILE 18 HG21 ILE 18 7.423 4.490 -7.875 149 2HG2 ILE 18 HG23 ILE 18 7.500 3.342 -9.211 150 3HG2 ILE 18 HG22 ILE 18 8.170 4.960 -9.401 151 1HD1 ILE 18 HD11 ILE 18 6.118 2.264 -9.824 152 2HD1 ILE 18 HD13 ILE 18 4.435 1.846 -9.511 153 3HD1 ILE 18 HD12 ILE 18 4.854 2.807 -10.928 154 H GLU 19 HN GLU 19 7.348 7.551 -7.342 155 HA GLU 19 HA GLU 19 8.185 9.547 -9.241 156 1HB GLU 19 HB2 GLU 19 9.349 8.641 -6.599 157 2HB GLU 19 HB1 GLU 19 9.988 9.998 -7.526 158 1HG GLU 19 HG2 GLU 19 7.791 11.107 -7.431 159 2HG GLU 19 HG1 GLU 19 7.144 9.751 -6.504 160 H ASN 20 HN ASN 20 9.552 6.436 -8.237 161 HA ASN 20 HA ASN 20 11.228 6.423 -10.651 162 1HB ASN 20 HB2 ASN 20 12.424 6.507 -7.869 163 2HB ASN 20 HB1 ASN 20 13.316 5.987 -9.297 164 1HD2 ASN 20 HD22 ASN 20 13.334 9.828 -8.534 165 2HD2 ASN 20 HD21 ASN 20 13.183 8.572 -7.403 166 H TYR 21 HN TYR 21 12.442 4.332 -10.805 167 HA TYR 21 HA TYR 21 10.952 2.124 -9.419 168 1HB TYR 21 HB2 TYR 21 12.185 2.265 -12.184 169 2HB TYR 21 HB1 TYR 21 11.613 0.767 -11.446 170 HD1 TYR 21 HD1 TYR 21 9.242 0.392 -11.027 171 HD2 TYR 21 HD2 TYR 21 10.623 4.022 -12.854 172 HE1 TYR 21 HE1 TYR 21 6.923 0.919 -11.723 173 HE2 TYR 21 HE2 TYR 21 8.303 4.554 -13.547 174 HH TYR 21 HH TYR 21 5.769 3.595 -12.371 175 H THR 22 HN THR 22 12.167 0.564 -8.407 176 HA THR 22 HA THR 22 14.917 1.186 -7.824 177 HB THR 22 HB THR 22 13.607 0.134 -6.111 178 HG1 THR 22 HG1 THR 22 15.128 -1.202 -5.522 179 1HG2 THR 22 HG21 THR 22 12.004 -1.011 -7.644 180 2HG2 THR 22 HG23 THR 22 13.246 -2.207 -8.003 181 3HG2 THR 22 HG22 THR 22 12.601 -2.071 -6.372 182 HA PRO 23 HA PRO 23 16.511 -0.993 -11.436 183 1HB PRO 23 HB2 PRO 23 19.150 -1.351 -10.369 184 2HB PRO 23 HB1 PRO 23 18.612 -0.070 -11.465 185 1HG PRO 23 HG2 PRO 23 19.243 0.135 -8.614 186 2HG PRO 23 HG1 PRO 23 18.911 1.438 -9.766 187 1HD PRO 23 HD2 PRO 23 17.165 0.493 -7.692 188 2HD PRO 23 HD1 PRO 23 16.791 1.686 -8.955 189 H ASP 24 HN ASP 24 16.075 -2.141 -8.339 190 HA ASP 24 HA ASP 24 17.367 -4.697 -8.424 191 1HB ASP 24 HB2 ASP 24 14.925 -3.710 -6.932 192 2HB ASP 24 HB1 ASP 24 15.612 -5.318 -6.701 193 H LEU 25 HN LEU 25 14.174 -3.581 -9.500 194 HA LEU 25 HA LEU 25 13.910 -6.108 -11.070 195 1HB LEU 25 HB2 LEU 25 11.816 -4.756 -9.346 196 2HB LEU 25 HB1 LEU 25 11.418 -5.976 -10.551 197 HG LEU 25 HG LEU 25 13.505 -6.547 -8.440 198 1HD1 LEU 25 HD13 LEU 25 10.495 -6.765 -8.157 199 2HD1 LEU 25 HD12 LEU 25 11.633 -7.632 -7.125 200 3HD1 LEU 25 HD11 LEU 25 11.608 -5.868 -7.121 201 1HD2 LEU 25 HD21 LEU 25 11.610 -8.226 -10.114 202 2HD2 LEU 25 HD23 LEU 25 13.369 -8.184 -10.212 203 3HD2 LEU 25 HD22 LEU 25 12.582 -8.883 -8.801 204 HA PRO 26 HA PRO 26 13.116 -3.302 -14.423 205 1HB PRO 26 HB2 PRO 26 10.969 -4.851 -15.599 206 2HB PRO 26 HB1 PRO 26 12.658 -4.771 -16.118 207 1HG PRO 26 HG2 PRO 26 11.313 -6.941 -14.706 208 2HG PRO 26 HG1 PRO 26 12.956 -6.915 -15.360 209 1HD PRO 26 HD2 PRO 26 12.227 -6.825 -12.598 210 2HD PRO 26 HD1 PRO 26 13.848 -6.579 -13.283 211 H ARG 27 HN ARG 27 11.631 -1.605 -14.849 212 HA ARG 27 HA ARG 27 9.701 -1.016 -12.829 213 1HB ARG 27 HB2 ARG 27 9.078 0.880 -14.219 214 2HB ARG 27 HB1 ARG 27 10.828 0.688 -14.279 215 1HG ARG 27 HG2 ARG 27 10.551 -0.612 -16.410 216 2HG ARG 27 HG1 ARG 27 8.834 -0.206 -16.380 217 1HD ARG 27 HD2 ARG 27 9.496 2.226 -16.270 218 2HD ARG 27 HD1 ARG 27 11.163 1.725 -16.540 219 HE ARG 27 HE ARG 27 9.728 0.547 -18.619 220 1HH1 ARG 27 HH21 ARG 27 10.189 3.713 -17.325 221 2HH1 ARG 27 HH22 ARG 27 9.953 4.511 -18.844 222 1HH2 ARG 27 HH11 ARG 27 9.399 1.580 -20.606 223 2HH2 ARG 27 HH12 ARG 27 9.495 3.307 -20.695 224 H ALA 28 HN ALA 28 9.463 -2.623 -15.943 225 HA ALA 28 HA ALA 28 6.644 -2.553 -16.278 226 1HB ALA 28 HB1 ALA 28 8.397 -3.372 -17.937 227 2HB ALA 28 HB3 ALA 28 8.415 -4.884 -17.031 228 3HB ALA 28 HB2 ALA 28 6.934 -4.351 -17.827 229 H ASP 29 HN ASP 29 8.692 -4.836 -14.448 230 HA ASP 29 HA ASP 29 6.393 -6.479 -13.701 231 1HB ASP 29 HB2 ASP 29 9.274 -6.434 -12.769 232 2HB ASP 29 HB1 ASP 29 8.075 -7.568 -12.147 233 H VAL 30 HN VAL 30 8.125 -3.755 -12.309 234 HA VAL 30 HA VAL 30 7.074 -4.071 -9.634 235 HB VAL 30 HB VAL 30 8.145 -1.657 -11.117 236 1HG1 VAL 30 HG11 VAL 30 7.303 -2.005 -8.226 237 2HG1 VAL 30 HG13 VAL 30 8.373 -0.711 -8.765 238 3HG1 VAL 30 HG12 VAL 30 6.724 -0.799 -9.375 239 1HG2 VAL 30 HG21 VAL 30 9.656 -3.650 -10.569 240 2HG2 VAL 30 HG23 VAL 30 10.180 -2.089 -9.938 241 3HG2 VAL 30 HG22 VAL 30 9.396 -3.252 -8.870 242 H ASP 31 HN ASP 31 6.014 -2.232 -12.500 243 HA ASP 31 HA ASP 31 3.841 -0.867 -11.289 244 1HB ASP 31 HB2 ASP 31 4.713 -0.528 -13.646 245 2HB ASP 31 HB1 ASP 31 3.852 -2.000 -14.102 246 H HIS 32 HN HIS 32 4.034 -4.121 -12.708 247 HA HIS 32 HA HIS 32 1.279 -4.798 -12.439 248 1HB HIS 32 HB2 HIS 32 2.881 -6.168 -13.720 249 2HB HIS 32 HB1 HIS 32 3.707 -6.604 -12.225 250 HD1 HIS 32 HD1 HIS 32 0.194 -6.824 -13.702 251 HD2 HIS 32 HD2 HIS 32 2.666 -8.866 -11.038 252 HE1 HIS 32 HE1 HIS 32 -1.073 -8.904 -13.001 253 H ALA 33 HN ALA 33 4.009 -5.258 -10.179 254 HA ALA 33 HA ALA 33 2.538 -6.558 -8.121 255 1HB ALA 33 HB1 ALA 33 5.076 -6.239 -8.300 256 2HB ALA 33 HB3 ALA 33 4.814 -4.631 -7.628 257 3HB ALA 33 HB2 ALA 33 4.378 -6.058 -6.689 258 H ILE 34 HN ILE 34 3.216 -3.071 -8.585 259 HA ILE 34 HA ILE 34 1.676 -2.264 -6.274 260 HB ILE 34 HB ILE 34 2.419 -0.697 -8.766 261 1HG1 ILE 34 HG12 ILE 34 4.422 -1.538 -7.665 262 2HG1 ILE 34 HG11 ILE 34 4.274 0.186 -7.340 263 1HG2 ILE 34 HG21 ILE 34 1.528 0.218 -6.017 264 2HG2 ILE 34 HG23 ILE 34 2.120 1.283 -7.290 265 3HG2 ILE 34 HG22 ILE 34 0.618 0.391 -7.520 266 1HD1 ILE 34 HD11 ILE 34 3.008 -0.623 -5.167 267 2HD1 ILE 34 HD13 ILE 34 3.862 -2.135 -5.475 268 3HD1 ILE 34 HD12 ILE 34 4.769 -0.647 -5.218 269 H GLU 35 HN GLU 35 0.945 -2.461 -9.755 270 HA GLU 35 HA GLU 35 -1.694 -1.403 -9.598 271 1HB GLU 35 HB2 GLU 35 -0.458 -1.798 -11.728 272 2HB GLU 35 HB1 GLU 35 -0.669 -3.533 -11.499 273 1HG GLU 35 HG2 GLU 35 -3.113 -3.257 -11.528 274 2HG GLU 35 HG1 GLU 35 -2.922 -1.514 -11.717 275 H LYS 36 HN LYS 36 -0.464 -4.704 -9.179 276 HA LYS 36 HA LYS 36 -2.973 -6.028 -9.017 277 1HB LYS 36 HB2 LYS 36 -0.733 -7.138 -9.212 278 2HB LYS 36 HB1 LYS 36 -0.440 -6.743 -7.519 279 1HG LYS 36 HG2 LYS 36 -2.437 -8.030 -6.862 280 2HG LYS 36 HG1 LYS 36 -2.738 -8.433 -8.556 281 1HD LYS 36 HD2 LYS 36 -0.486 -9.504 -8.660 282 2HD LYS 36 HD1 LYS 36 -0.290 -9.194 -6.935 283 1HE LYS 36 HE2 LYS 36 -2.676 -10.712 -7.999 284 2HE LYS 36 HE1 LYS 36 -1.157 -11.525 -7.623 285 1HZ LYS 36 HZ1 LYS 36 -1.383 -10.243 -5.402 286 2HZ LYS 36 HZ3 LYS 36 -3.025 -10.158 -5.815 287 3HZ LYS 36 HZ2 LYS 36 -2.271 -11.672 -5.644 288 H ALA 37 HN ALA 37 -1.030 -4.474 -6.453 289 HA ALA 37 HA ALA 37 -2.699 -5.308 -4.284 290 1HB ALA 37 HB1 ALA 37 -0.355 -4.201 -4.233 291 2HB ALA 37 HB3 ALA 37 -1.231 -2.674 -4.309 292 3HB ALA 37 HB2 ALA 37 -1.496 -3.778 -2.959 293 H PHE 38 HN PHE 38 -2.728 -2.245 -6.155 294 HA PHE 38 HA PHE 38 -4.917 -1.083 -4.750 295 1HB PHE 38 HB2 PHE 38 -3.818 -0.714 -7.539 296 2HB PHE 38 HB1 PHE 38 -5.270 0.146 -7.027 297 HD1 PHE 38 HD2 PHE 38 -5.130 1.445 -4.771 298 HD2 PHE 38 HD1 PHE 38 -1.695 0.170 -7.015 299 HE1 PHE 38 HE2 PHE 38 -3.735 3.117 -3.587 300 HE2 PHE 38 HE1 PHE 38 -0.301 1.842 -5.830 301 HZ PHE 38 HZ PHE 38 -1.321 3.316 -4.114 302 H GLN 39 HN GLN 39 -4.849 -3.255 -7.567 303 HA GLN 39 HA GLN 39 -7.633 -3.169 -8.152 304 1HB GLN 39 HB2 GLN 39 -5.579 -5.364 -8.530 305 2HB GLN 39 HB1 GLN 39 -7.226 -5.465 -9.155 306 1HG GLN 39 HG2 GLN 39 -5.368 -3.156 -9.780 307 2HG GLN 39 HG1 GLN 39 -5.502 -4.586 -10.804 308 1HE2 GLN 39 HE22 GLN 39 -9.072 -3.773 -11.471 309 2HE2 GLN 39 HE21 GLN 39 -8.227 -5.100 -10.835 310 H LEU 40 HN LEU 40 -5.797 -5.214 -5.879 311 HA LEU 40 HA LEU 40 -7.942 -6.927 -5.128 312 1HB LEU 40 HB2 LEU 40 -5.553 -5.942 -3.551 313 2HB LEU 40 HB1 LEU 40 -6.662 -7.172 -2.955 314 HG LEU 40 HG LEU 40 -5.125 -7.383 -5.562 315 1HD1 LEU 40 HD12 LEU 40 -4.561 -8.488 -2.800 316 2HD1 LEU 40 HD11 LEU 40 -3.794 -9.104 -4.262 317 3HD1 LEU 40 HD13 LEU 40 -3.528 -7.434 -3.764 318 1HD2 LEU 40 HD22 LEU 40 -7.061 -9.163 -4.093 319 2HD2 LEU 40 HD21 LEU 40 -6.909 -8.864 -5.823 320 3HD2 LEU 40 HD23 LEU 40 -5.753 -9.912 -5.008 321 H TRP 41 HN TRP 41 -6.944 -3.776 -3.764 322 HA TRP 41 HA TRP 41 -8.983 -3.801 -1.709 323 1HB TRP 41 HB2 TRP 41 -7.398 -1.539 -2.952 324 2HB TRP 41 HB1 TRP 41 -8.466 -1.345 -1.564 325 HD1 TRP 41 HD1 TRP 41 -4.990 -2.065 -2.399 326 HE1 TRP 41 HE1 TRP 41 -3.722 -3.033 -0.370 327 HE3 TRP 41 HE3 TRP 41 -8.931 -3.192 0.644 328 HZ2 TRP 41 HZ2 TRP 41 -4.306 -4.143 2.199 329 HZ3 TRP 41 HZ3 TRP 41 -8.548 -4.205 2.874 330 HH2 TRP 41 HH2 TRP 41 -6.244 -4.682 3.655 331 H SER 42 HN SER 42 -8.800 -2.382 -4.959 332 HA SER 42 HA SER 42 -11.323 -1.005 -4.801 333 1HB SER 42 HB2 SER 42 -9.663 -0.348 -6.450 334 2HB SER 42 HB1 SER 42 -9.703 -1.949 -7.182 335 HG SER 42 HG SER 42 -11.159 0.078 -7.851 336 H ASN 43 HN ASN 43 -10.401 -4.263 -5.795 337 HA ASN 43 HA ASN 43 -12.759 -5.033 -7.143 338 1HB ASN 43 HB2 ASN 43 -10.912 -6.649 -5.368 339 2HB ASN 43 HB1 ASN 43 -12.184 -7.360 -6.358 340 1HD2 ASN 43 HD22 ASN 43 -10.378 -5.918 -9.369 341 2HD2 ASN 43 HD21 ASN 43 -11.857 -5.528 -8.632 342 H VAL 44 HN VAL 44 -12.128 -4.764 -3.675 343 HA VAL 44 HA VAL 44 -14.875 -5.799 -3.099 344 HB VAL 44 HB VAL 44 -13.973 -5.814 -0.708 345 1HG1 VAL 44 HG11 VAL 44 -14.140 -7.837 -2.129 346 2HG1 VAL 44 HG13 VAL 44 -12.544 -7.489 -2.797 347 3HG1 VAL 44 HG12 VAL 44 -12.716 -7.897 -1.090 348 1HG2 VAL 44 HG21 VAL 44 -12.084 -4.211 -1.303 349 2HG2 VAL 44 HG23 VAL 44 -11.594 -5.642 -0.399 350 3HG2 VAL 44 HG22 VAL 44 -11.313 -5.557 -2.138 351 H THR 45 HN THR 45 -13.702 -2.858 -3.824 352 HA THR 45 HA THR 45 -15.658 -1.562 -2.020 353 HB THR 45 HB THR 45 -13.966 0.282 -1.549 354 HG1 THR 45 HG1 THR 45 -11.929 -1.533 -1.849 355 1HG2 THR 45 HG22 THR 45 -14.651 -1.397 0.132 356 2HG2 THR 45 HG21 THR 45 -13.372 -2.468 -0.435 357 3HG2 THR 45 HG23 THR 45 -12.960 -0.931 0.320 358 HA PRO 46 HA PRO 46 -16.440 0.730 -5.768 359 1HB PRO 46 HB2 PRO 46 -17.357 3.141 -4.554 360 2HB PRO 46 HB1 PRO 46 -18.357 1.766 -5.040 361 1HG PRO 46 HG2 PRO 46 -17.564 2.591 -2.325 362 2HG PRO 46 HG1 PRO 46 -18.823 1.447 -2.815 363 1HD PRO 46 HD2 PRO 46 -16.294 0.782 -1.680 364 2HD PRO 46 HD1 PRO 46 -17.460 -0.342 -2.416 365 H LEU 47 HN LEU 47 -13.947 1.243 -3.753 366 HA LEU 47 HA LEU 47 -13.101 3.927 -4.446 367 1HB LEU 47 HB2 LEU 47 -11.548 1.530 -3.421 368 2HB LEU 47 HB1 LEU 47 -10.888 3.157 -3.555 369 HG LEU 47 HG LEU 47 -13.365 2.484 -1.941 370 1HD1 LEU 47 HD11 LEU 47 -10.464 2.721 -1.086 371 2HD1 LEU 47 HD13 LEU 47 -11.821 2.722 0.039 372 3HD1 LEU 47 HD12 LEU 47 -11.497 1.298 -0.951 373 1HD2 LEU 47 HD21 LEU 47 -11.677 4.954 -2.344 374 2HD2 LEU 47 HD23 LEU 47 -13.432 4.797 -2.333 375 3HD2 LEU 47 HD22 LEU 47 -12.533 4.724 -0.822 376 H THR 48 HN THR 48 -11.632 4.557 -6.049 377 HA THR 48 HA THR 48 -10.731 2.465 -7.998 378 HB THR 48 HB THR 48 -11.334 3.985 -9.848 379 HG1 THR 48 HG1 THR 48 -12.890 5.538 -8.157 380 1HG2 THR 48 HG21 THR 48 -12.959 2.272 -8.816 381 2HG2 THR 48 HG23 THR 48 -13.760 3.662 -8.081 382 3HG2 THR 48 HG22 THR 48 -13.660 3.526 -9.838 383 H PHE 49 HN PHE 49 -8.692 2.866 -8.874 384 HA PHE 49 HA PHE 49 -7.272 5.331 -7.890 385 1HB PHE 49 HB2 PHE 49 -6.186 2.527 -8.277 386 2HB PHE 49 HB1 PHE 49 -5.220 3.936 -7.834 387 HD1 PHE 49 HD2 PHE 49 -5.501 5.024 -5.648 388 HD2 PHE 49 HD1 PHE 49 -7.697 1.483 -6.691 389 HE1 PHE 49 HE2 PHE 49 -6.096 4.691 -3.263 390 HE2 PHE 49 HE1 PHE 49 -8.293 1.149 -4.306 391 HZ PHE 49 HZ PHE 49 -7.490 2.753 -2.592 392 H THR 50 HN THR 50 -6.221 6.502 -9.422 393 HA THR 50 HA THR 50 -6.031 5.371 -12.198 394 HB THR 50 HB THR 50 -6.495 8.246 -11.341 395 HG1 THR 50 HG1 THR 50 -8.441 7.490 -12.804 396 1HG2 THR 50 HG21 THR 50 -6.169 6.916 -14.033 397 2HG2 THR 50 HG23 THR 50 -6.927 8.496 -13.840 398 3HG2 THR 50 HG22 THR 50 -5.243 8.262 -13.369 399 H LYS 51 HN LYS 51 -4.010 5.327 -13.029 400 HA LYS 51 HA LYS 51 -1.754 6.320 -11.463 401 1HB LYS 51 HB2 LYS 51 -1.559 4.199 -12.665 402 2HB LYS 51 HB1 LYS 51 -1.931 4.990 -14.191 403 1HG LYS 51 HG2 LYS 51 0.450 4.657 -14.115 404 2HG LYS 51 HG1 LYS 51 0.176 6.376 -13.879 405 1HD LYS 51 HD2 LYS 51 0.536 6.177 -11.501 406 2HD LYS 51 HD1 LYS 51 0.538 4.417 -11.603 407 1HE LYS 51 HE2 LYS 51 2.836 5.200 -11.457 408 2HE LYS 51 HE1 LYS 51 2.551 4.551 -13.071 409 1HZ LYS 51 HZ2 LYS 51 1.864 7.293 -12.984 410 2HZ LYS 51 HZ1 LYS 51 3.454 7.081 -12.421 411 3HZ LYS 51 HZ3 LYS 51 3.016 6.510 -13.956 412 H VAL 52 HN VAL 52 -0.741 8.281 -11.766 413 HA VAL 52 HA VAL 52 -1.381 9.828 -14.270 414 HB VAL 52 HB VAL 52 -1.257 11.881 -12.899 415 1HG1 VAL 52 HG12 VAL 52 -3.417 10.586 -13.274 416 2HG1 VAL 52 HG11 VAL 52 -3.202 9.923 -11.654 417 3HG1 VAL 52 HG13 VAL 52 -3.416 11.659 -11.875 418 1HG2 VAL 52 HG23 VAL 52 -0.752 9.865 -10.702 419 2HG2 VAL 52 HG22 VAL 52 0.162 11.321 -11.095 420 3HG2 VAL 52 HG21 VAL 52 -1.426 11.455 -10.343 421 H SER 53 HN SER 53 0.403 10.417 -15.399 422 HA SER 53 HA SER 53 3.065 9.881 -14.206 423 1HB SER 53 HB2 SER 53 2.451 9.039 -16.491 424 2HB SER 53 HB1 SER 53 2.378 10.713 -17.037 425 HG SER 53 HG SER 53 4.643 10.427 -15.725 426 H GLU 54 HN GLU 54 1.026 12.535 -14.433 427 HA GLU 54 HA GLU 54 3.330 14.379 -14.019 428 1HB GLU 54 HB2 GLU 54 1.100 14.857 -16.018 429 2HB GLU 54 HB1 GLU 54 2.259 16.080 -15.499 430 1HG GLU 54 HG2 GLU 54 4.113 14.688 -16.341 431 2HG GLU 54 HG1 GLU 54 2.953 13.465 -16.864 432 H GLY 55 HN GLY 55 2.652 16.411 -13.008 433 1HA GLY 55 HA2 GLY 55 1.239 17.736 -11.643 434 2HA GLY 55 HA1 GLY 55 -0.083 16.618 -11.981 435 H GLN 56 HN GLN 56 -0.004 17.291 -9.415 436 HA GLN 56 HA GLN 56 1.771 15.506 -7.885 437 1HB GLN 56 HB2 GLN 56 -0.471 17.378 -7.072 438 2HB GLN 56 HB1 GLN 56 0.442 16.396 -5.925 439 1HG GLN 56 HG2 GLN 56 2.536 17.467 -6.671 440 2HG GLN 56 HG1 GLN 56 1.620 18.456 -7.810 441 1HE2 GLN 56 HE22 GLN 56 1.329 20.886 -5.269 442 2HE2 GLN 56 HE21 GLN 56 1.866 20.524 -6.838 443 H ALA 57 HN ALA 57 1.053 13.661 -6.742 444 HA ALA 57 HA ALA 57 -1.646 12.614 -7.546 445 1HB ALA 57 HB3 ALA 57 0.546 11.413 -8.273 446 2HB ALA 57 HB2 ALA 57 0.644 10.899 -6.589 447 3HB ALA 57 HB1 ALA 57 -0.747 10.444 -7.575 448 H ASP 58 HN ASP 58 -2.907 11.621 -5.887 449 HA ASP 58 HA ASP 58 -2.762 12.816 -3.312 450 1HB ASP 58 HB2 ASP 58 -4.131 10.268 -4.221 451 2HB ASP 58 HB1 ASP 58 -4.399 11.031 -2.654 452 H ILE 59 HN ILE 59 -1.611 9.671 -4.489 453 HA ILE 59 HA ILE 59 -0.124 9.300 -1.900 454 HB ILE 59 HB ILE 59 -1.223 7.200 -3.799 455 1HG1 ILE 59 HG12 ILE 59 -2.064 7.847 -0.958 456 2HG1 ILE 59 HG11 ILE 59 -2.897 8.479 -2.378 457 1HG2 ILE 59 HG21 ILE 59 0.346 7.046 -1.215 458 2HG2 ILE 59 HG23 ILE 59 -0.580 5.686 -1.849 459 3HG2 ILE 59 HG22 ILE 59 0.768 6.346 -2.777 460 1HD1 ILE 59 HD11 ILE 59 -3.203 6.104 -3.162 461 2HD1 ILE 59 HD13 ILE 59 -2.554 5.567 -1.613 462 3HD1 ILE 59 HD12 ILE 59 -4.062 6.481 -1.669 463 H MET 60 HN MET 60 2.018 9.597 -2.215 464 HA MET 60 HA MET 60 3.170 9.130 -4.934 465 1HB MET 60 HB2 MET 60 4.287 10.595 -2.528 466 2HB MET 60 HB1 MET 60 5.100 10.432 -4.083 467 1HG MET 60 HG2 MET 60 3.071 11.510 -5.145 468 2HG MET 60 HG1 MET 60 2.493 11.862 -3.517 469 1HE MET 60 HE3 MET 60 5.701 12.003 -5.730 470 2HE MET 60 HE2 MET 60 4.445 13.003 -6.455 471 3HE MET 60 HE1 MET 60 5.917 13.755 -5.847 472 H ILE 61 HN ILE 61 4.419 7.384 -5.266 473 HA ILE 61 HA ILE 61 5.473 5.869 -2.896 474 HB ILE 61 HB ILE 61 4.766 4.936 -5.695 475 1HG1 ILE 61 HG12 ILE 61 3.626 4.117 -3.008 476 2HG1 ILE 61 HG11 ILE 61 2.900 5.360 -4.029 477 1HG2 ILE 61 HG21 ILE 61 6.159 3.581 -3.381 478 2HG2 ILE 61 HG23 ILE 61 5.287 2.652 -4.600 479 3HG2 ILE 61 HG22 ILE 61 6.658 3.654 -5.070 480 1HD1 ILE 61 HD13 ILE 61 2.726 3.699 -5.877 481 2HD1 ILE 61 HD12 ILE 61 3.364 2.462 -4.793 482 3HD1 ILE 61 HD11 ILE 61 1.806 3.213 -4.452 483 H SER 62 HN SER 62 7.698 5.758 -2.739 484 HA SER 62 HA SER 62 9.320 6.114 -5.199 485 1HB SER 62 HB2 SER 62 10.546 7.991 -4.365 486 2HB SER 62 HB1 SER 62 8.844 8.392 -4.167 487 HG SER 62 HG SER 62 10.482 8.612 -2.316 488 H PHE 63 HN PHE 63 11.567 5.567 -4.871 489 HA PHE 63 HA PHE 63 12.017 3.724 -2.545 490 1HB PHE 63 HB2 PHE 63 13.197 3.741 -5.348 491 2HB PHE 63 HB1 PHE 63 13.655 2.615 -4.074 492 HD1 PHE 63 HD1 PHE 63 10.996 3.620 -6.401 493 HD2 PHE 63 HD2 PHE 63 12.125 0.866 -3.305 494 HE1 PHE 63 HE1 PHE 63 9.066 2.175 -6.983 495 HE2 PHE 63 HE2 PHE 63 10.194 -0.579 -3.885 496 HZ PHE 63 HZ PHE 63 8.665 0.076 -5.726 497 H VAL 64 HN VAL 64 13.687 4.290 -1.157 498 HA VAL 64 HA VAL 64 15.694 6.316 -2.119 499 HB VAL 64 HB VAL 64 15.518 7.466 0.035 500 1HG1 VAL 64 HG13 VAL 64 14.044 8.107 -1.883 501 2HG1 VAL 64 HG12 VAL 64 12.787 7.066 -1.214 502 3HG1 VAL 64 HG11 VAL 64 13.332 8.478 -0.311 503 1HG2 VAL 64 HG21 VAL 64 13.400 5.365 0.573 504 2HG2 VAL 64 HG23 VAL 64 14.872 5.656 1.497 505 3HG2 VAL 64 HG22 VAL 64 13.565 6.839 1.528 506 H ARG 65 HN ARG 65 17.628 6.432 -0.652 507 HA ARG 65 HA ARG 65 18.238 3.776 0.616 508 1HB ARG 65 HB2 ARG 65 20.004 5.522 -1.128 509 2HB ARG 65 HB1 ARG 65 20.614 4.182 -0.156 510 1HG ARG 65 HG2 ARG 65 19.103 2.640 -1.329 511 2HG ARG 65 HG1 ARG 65 18.498 3.977 -2.309 512 1HD ARG 65 HD2 ARG 65 21.379 3.045 -2.232 513 2HD ARG 65 HD1 ARG 65 20.226 2.645 -3.500 514 HE ARG 65 HE ARG 65 20.199 5.430 -3.374 515 1HH1 ARG 65 HH21 ARG 65 22.531 2.924 -3.765 516 2HH1 ARG 65 HH22 ARG 65 23.592 3.877 -4.749 517 1HH2 ARG 65 HH11 ARG 65 21.564 6.690 -4.669 518 2HH2 ARG 65 HH12 ARG 65 23.043 6.010 -5.260 519 H GLY 66 HN GLY 66 19.495 3.843 2.491 520 1HA GLY 66 HA2 GLY 66 20.061 4.779 4.576 521 2HA GLY 66 HA1 GLY 66 21.057 5.830 3.573 522 H ASP 67 HN ASP 67 20.771 7.704 4.777 523 HA ASP 67 HA ASP 67 18.252 8.638 5.780 524 1HB ASP 67 HB2 ASP 67 20.451 9.423 6.625 525 2HB ASP 67 HB1 ASP 67 20.721 10.255 5.093 526 H HIS 68 HN HIS 68 16.669 9.829 4.830 527 HA HIS 68 HA HIS 68 17.167 11.062 2.153 528 1HB HIS 68 HB2 HIS 68 15.027 10.169 1.334 529 2HB HIS 68 HB1 HIS 68 16.099 8.850 1.804 530 HD1 HIS 68 HD1 HIS 68 15.678 7.907 4.332 531 HD2 HIS 68 HD2 HIS 68 12.572 10.112 2.638 532 HE1 HIS 68 HE1 HIS 68 13.602 7.368 5.677 533 H ARG 69 HN ARG 69 17.219 12.707 4.226 534 HA ARG 69 HA ARG 69 16.151 14.504 5.292 535 1HB ARG 69 HB2 ARG 69 14.418 14.187 2.821 536 2HB ARG 69 HB1 ARG 69 14.249 15.527 3.957 537 1HG ARG 69 HG2 ARG 69 16.631 16.112 3.594 538 2HG ARG 69 HG1 ARG 69 16.759 14.814 2.417 539 1HD ARG 69 HD2 ARG 69 14.893 17.189 2.228 540 2HD ARG 69 HD1 ARG 69 16.385 17.009 1.318 541 HE ARG 69 HE ARG 69 13.804 15.940 0.633 542 1HH1 ARG 69 HH21 ARG 69 17.133 14.980 0.710 543 2HH1 ARG 69 HH22 ARG 69 16.897 13.679 -0.405 544 1HH2 ARG 69 HH11 ARG 69 13.523 14.271 -0.826 545 2HH2 ARG 69 HH12 ARG 69 14.874 13.286 -1.277 546 H ASP 70 HN ASP 70 15.568 12.199 6.558 547 HA ASP 70 HA ASP 70 12.721 12.575 7.356 548 1HB ASP 70 HB2 ASP 70 12.916 10.704 5.646 549 2HB ASP 70 HB1 ASP 70 13.900 9.835 6.822 550 H ASN 71 HN ASN 71 12.292 11.647 9.509 551 HA ASN 71 HA ASN 71 14.721 11.754 11.206 552 1HB ASN 71 HB2 ASN 71 13.206 12.014 13.062 553 2HB ASN 71 HB1 ASN 71 12.641 13.070 11.768 554 1HD2 ASN 71 HD22 ASN 71 9.612 11.314 12.896 555 2HD2 ASN 71 HD21 ASN 71 10.651 12.532 13.462 556 H SER 72 HN SER 72 13.434 9.359 9.491 557 HA SER 72 HA SER 72 14.050 7.304 11.586 558 1HB SER 72 HB2 SER 72 11.714 7.324 9.664 559 2HB SER 72 HB1 SER 72 12.237 5.889 10.541 560 HG SER 72 HG SER 72 11.126 8.290 11.496 561 HA PRO 73 HA PRO 73 16.347 6.735 7.527 562 1HB PRO 73 HB2 PRO 73 18.789 6.343 9.011 563 2HB PRO 73 HB1 PRO 73 18.376 7.705 7.959 564 1HG PRO 73 HG2 PRO 73 18.539 7.690 10.857 565 2HG PRO 73 HG1 PRO 73 18.176 9.059 9.795 566 1HD PRO 73 HD2 PRO 73 16.335 7.606 11.493 567 2HD PRO 73 HD1 PRO 73 15.984 8.980 10.430 568 H PHE 74 HN PHE 74 17.155 4.654 6.801 569 HA PHE 74 HA PHE 74 16.179 2.403 8.370 570 1HB PHE 74 HB2 PHE 74 17.683 2.587 5.747 571 2HB PHE 74 HB1 PHE 74 17.161 1.059 6.459 572 HD1 PHE 74 HD1 PHE 74 14.647 0.886 7.130 573 HD2 PHE 74 HD2 PHE 74 16.192 3.792 4.371 574 HE1 PHE 74 HE1 PHE 74 12.381 1.180 6.174 575 HE2 PHE 74 HE2 PHE 74 13.921 4.092 3.418 576 HZ PHE 74 HZ PHE 74 12.017 2.784 4.319 577 H ASP 75 HN ASP 75 17.346 1.072 9.680 578 HA ASP 75 HA ASP 75 20.238 1.677 10.073 579 1HB ASP 75 HB2 ASP 75 18.763 1.656 12.066 580 2HB ASP 75 HB1 ASP 75 18.324 -0.015 11.715 581 H GLY 76 HN GLY 76 20.306 0.471 7.805 582 1HA GLY 76 HA2 GLY 76 21.308 -1.400 6.770 583 2HA GLY 76 HA1 GLY 76 21.374 -2.186 8.350 584 HA PRO 77 HA PRO 77 17.977 -4.008 5.628 585 1HB PRO 77 HB2 PRO 77 19.037 -6.647 6.044 586 2HB PRO 77 HB1 PRO 77 19.051 -5.711 4.543 587 1HG PRO 77 HG2 PRO 77 21.291 -6.286 6.332 588 2HG PRO 77 HG1 PRO 77 21.326 -5.513 4.742 589 1HD PRO 77 HD2 PRO 77 21.684 -4.237 7.290 590 2HD PRO 77 HD1 PRO 77 21.585 -3.448 5.703 591 H GLY 78 HN GLY 78 18.720 -3.668 8.737 592 1HA GLY 78 HA2 GLY 78 16.924 -5.804 9.797 593 2HA GLY 78 HA1 GLY 78 18.002 -4.799 10.766 594 H GLY 79 HN GLY 79 15.405 -4.982 11.596 595 1HA GLY 79 HA2 GLY 79 13.785 -3.451 12.387 596 2HA GLY 79 HA1 GLY 79 14.531 -2.198 11.395 597 H ASN 80 HN ASN 80 12.343 -1.584 10.736 598 HA ASN 80 HA ASN 80 10.642 -3.444 9.313 599 1HB ASN 80 HB2 ASN 80 10.693 -0.420 9.476 600 2HB ASN 80 HB1 ASN 80 9.446 -1.323 8.611 601 1HD2 ASN 80 HD22 ASN 80 8.315 -0.764 12.165 602 2HD2 ASN 80 HD21 ASN 80 8.801 0.279 10.917 603 H LEU 81 HN LEU 81 10.234 -3.462 7.006 604 HA LEU 81 HA LEU 81 12.670 -2.904 5.415 605 1HB LEU 81 HB2 LEU 81 10.073 -4.085 4.403 606 2HB LEU 81 HB1 LEU 81 11.689 -4.273 3.725 607 HG LEU 81 HG LEU 81 10.639 -5.449 6.315 608 1HD1 LEU 81 HD12 LEU 81 10.094 -6.535 4.095 609 2HD1 LEU 81 HD11 LEU 81 11.826 -6.779 3.869 610 3HD1 LEU 81 HD13 LEU 81 10.993 -7.557 5.215 611 1HD2 LEU 81 HD23 LEU 81 13.446 -5.416 5.169 612 2HD2 LEU 81 HD22 LEU 81 12.935 -4.770 6.729 613 3HD2 LEU 81 HD21 LEU 81 12.924 -6.509 6.445 614 H ALA 82 HN ALA 82 9.792 -1.309 6.195 615 HA ALA 82 HA ALA 82 10.324 0.871 4.392 616 1HB ALA 82 HB1 ALA 82 9.382 -0.730 2.735 617 2HB ALA 82 HB3 ALA 82 7.920 -0.855 3.712 618 3HB ALA 82 HB2 ALA 82 8.343 0.676 2.947 619 H HIS 83 HN HIS 83 8.278 2.397 4.400 620 HA HIS 83 HA HIS 83 6.432 2.059 6.622 621 1HB HIS 83 HB2 HIS 83 7.286 3.945 7.975 622 2HB HIS 83 HB1 HIS 83 8.473 2.644 7.880 623 HD1 HIS 83 HD1 HIS 83 10.640 3.087 6.578 624 HD2 HIS 83 HD2 HIS 83 7.968 6.283 6.440 625 HE1 HIS 83 HE1 HIS 83 11.909 5.038 5.579 626 H ALA 84 HN ALA 84 5.068 4.070 6.858 627 HA ALA 84 HA ALA 84 5.228 5.947 4.562 628 1HB ALA 84 HB3 ALA 84 2.923 4.070 5.127 629 2HB ALA 84 HB2 ALA 84 2.724 5.548 4.187 630 3HB ALA 84 HB1 ALA 84 3.807 4.280 3.615 631 H PHE 85 HN PHE 85 3.642 7.757 4.860 632 HA PHE 85 HA PHE 85 3.471 8.459 7.740 633 1HB PHE 85 HB2 PHE 85 3.157 10.042 5.180 634 2HB PHE 85 HB1 PHE 85 2.805 10.722 6.770 635 HD1 PHE 85 HD1 PHE 85 4.572 11.079 8.415 636 HD2 PHE 85 HD2 PHE 85 5.448 9.485 4.525 637 HE1 PHE 85 HE1 PHE 85 6.983 11.531 8.775 638 HE2 PHE 85 HE2 PHE 85 7.863 9.937 4.884 639 HZ PHE 85 HZ PHE 85 8.627 10.961 7.010 640 H GLN 86 HN GLN 86 1.378 9.668 8.389 641 HA GLN 86 HA GLN 86 -0.831 7.899 7.940 642 1HB GLN 86 HB2 GLN 86 -0.742 10.673 9.167 643 2HB GLN 86 HB1 GLN 86 -2.144 9.607 9.229 644 1HG GLN 86 HG2 GLN 86 -1.008 9.232 11.284 645 2HG GLN 86 HG1 GLN 86 -0.562 7.861 10.267 646 1HE2 GLN 86 HE22 GLN 86 2.787 8.656 11.120 647 2HE2 GLN 86 HE21 GLN 86 1.517 7.544 11.303 648 HA PRO 87 HA PRO 87 -2.500 9.542 4.172 649 1HB PRO 87 HB2 PRO 87 -5.267 9.505 5.050 650 2HB PRO 87 HB1 PRO 87 -4.447 8.357 3.984 651 1HG PRO 87 HG2 PRO 87 -5.217 7.982 6.770 652 2HG PRO 87 HG1 PRO 87 -4.520 6.795 5.658 653 1HD PRO 87 HD2 PRO 87 -3.199 8.020 7.875 654 2HD PRO 87 HD1 PRO 87 -2.455 7.007 6.618 655 H GLY 88 HN GLY 88 -1.931 11.726 4.073 656 1HA GLY 88 HA2 GLY 88 -3.945 13.665 4.877 657 2HA GLY 88 HA1 GLY 88 -2.462 13.799 5.821 658 HA PRO 89 HA PRO 89 -2.180 15.977 1.565 659 1HB PRO 89 HB2 PRO 89 -1.977 18.555 2.799 660 2HB PRO 89 HB1 PRO 89 -3.326 17.943 1.831 661 1HG PRO 89 HG2 PRO 89 -3.187 18.309 4.745 662 2HG PRO 89 HG1 PRO 89 -4.605 17.980 3.739 663 1HD PRO 89 HD2 PRO 89 -3.317 16.132 5.483 664 2HD PRO 89 HD1 PRO 89 -4.560 15.755 4.272 665 H GLY 90 HN GLY 90 -0.332 17.973 1.424 666 1HA GLY 90 HA2 GLY 90 1.977 18.353 1.524 667 2HA GLY 90 HA1 GLY 90 1.824 17.989 3.241 668 H ILE 91 HN ILE 91 3.320 16.488 3.767 669 HA ILE 91 HA ILE 91 4.313 14.551 1.816 670 HB ILE 91 HB ILE 91 5.790 15.575 3.511 671 1HG1 ILE 91 HG12 ILE 91 5.463 12.614 4.069 672 2HG1 ILE 91 HG11 ILE 91 6.206 13.246 2.600 673 1HG2 ILE 91 HG21 ILE 91 3.898 15.599 5.259 674 2HG2 ILE 91 HG23 ILE 91 4.344 13.924 5.587 675 3HG2 ILE 91 HG22 ILE 91 5.518 15.217 5.837 676 1HD1 ILE 91 HD13 ILE 91 7.139 13.890 5.408 677 2HD1 ILE 91 HD12 ILE 91 7.878 12.679 4.359 678 3HD1 ILE 91 HD11 ILE 91 7.918 14.382 3.904 679 H GLY 92 HN GLY 92 1.666 14.646 3.943 680 1HA GLY 92 HA2 GLY 92 1.544 11.960 4.877 681 2HA GLY 92 HA1 GLY 92 0.139 12.991 4.612 682 H GLY 93 HN GLY 93 0.806 10.079 3.941 683 1HA GLY 93 HA2 GLY 93 -0.303 8.752 2.262 684 2HA GLY 93 HA1 GLY 93 -0.313 10.152 1.187 685 H ASP 94 HN ASP 94 2.591 10.631 2.000 686 HA ASP 94 HA ASP 94 3.805 9.298 -0.223 687 1HB ASP 94 HB2 ASP 94 4.982 10.718 2.176 688 2HB ASP 94 HB1 ASP 94 5.961 10.106 0.841 689 H ALA 95 HN ALA 95 5.066 7.432 -0.322 690 HA ALA 95 HA ALA 95 5.373 5.837 2.206 691 1HB ALA 95 HB2 ALA 95 3.502 5.035 0.649 692 2HB ALA 95 HB1 ALA 95 4.773 4.633 -0.506 693 3HB ALA 95 HB3 ALA 95 4.727 3.838 1.068 694 H HIS 96 HN HIS 96 7.459 5.253 2.535 695 HA HIS 96 HA HIS 96 9.388 5.481 0.250 696 1HB HIS 96 HB2 HIS 96 9.926 5.509 3.239 697 2HB HIS 96 HB1 HIS 96 11.114 5.771 1.965 698 HD2 HIS 96 HD2 HIS 96 8.212 7.876 0.708 699 HE1 HIS 96 HE1 HIS 96 10.319 10.224 3.556 700 HE2 HIS 96 HE2 HIS 96 8.591 10.264 1.707 701 H PHE 97 HN PHE 97 10.543 3.701 -0.369 702 HA PHE 97 HA PHE 97 10.152 1.163 1.203 703 1HB PHE 97 HB2 PHE 97 10.489 1.679 -1.756 704 2HB PHE 97 HB1 PHE 97 10.709 0.078 -1.052 705 HD1 PHE 97 HD1 PHE 97 8.262 2.902 -1.279 706 HD2 PHE 97 HD2 PHE 97 8.846 -1.303 -0.626 707 HE1 PHE 97 HE1 PHE 97 5.807 2.555 -1.305 708 HE2 PHE 97 HE2 PHE 97 6.393 -1.649 -0.650 709 HZ PHE 97 HZ PHE 97 4.873 0.278 -0.992 710 H ASP 98 HN ASP 98 11.982 0.067 1.850 711 HA ASP 98 HA ASP 98 14.526 1.416 1.817 712 1HB ASP 98 HB2 ASP 98 13.725 -0.297 3.533 713 2HB ASP 98 HB1 ASP 98 14.090 -1.542 2.335 714 H GLU 99 HN GLU 99 15.405 1.756 -0.199 715 HA GLU 99 HA GLU 99 15.272 -0.251 -2.303 716 1HB GLU 99 HB2 GLU 99 15.365 2.288 -2.587 717 2HB GLU 99 HB1 GLU 99 17.074 2.160 -2.229 718 1HG GLU 99 HG2 GLU 99 17.418 0.661 -4.118 719 2HG GLU 99 HG1 GLU 99 15.685 0.651 -4.453 720 H ASP 100 HN ASP 100 17.253 0.090 0.418 721 HA ASP 100 HA ASP 100 19.727 -0.899 -0.790 722 1HB ASP 100 HB2 ASP 100 18.822 -0.588 2.083 723 2HB ASP 100 HB1 ASP 100 20.410 -1.210 1.631 724 H GLU 101 HN GLU 101 16.822 -2.306 0.437 725 HA GLU 101 HA GLU 101 18.045 -4.930 0.955 726 1HB GLU 101 HB2 GLU 101 15.152 -4.025 0.859 727 2HB GLU 101 HB1 GLU 101 15.687 -5.638 1.337 728 1HG GLU 101 HG2 GLU 101 16.940 -4.741 3.202 729 2HG GLU 101 HG1 GLU 101 16.617 -3.087 2.678 730 H ARG 102 HN ARG 102 17.334 -6.861 -0.248 731 HA ARG 102 HA ARG 102 17.222 -6.298 -3.151 732 1HB ARG 102 HB2 ARG 102 18.796 -8.002 -2.164 733 2HB ARG 102 HB1 ARG 102 17.387 -8.962 -1.717 734 1HG ARG 102 HG2 ARG 102 16.694 -9.079 -4.068 735 2HG ARG 102 HG1 ARG 102 18.085 -8.107 -4.537 736 1HD ARG 102 HD2 ARG 102 18.263 -10.765 -3.105 737 2HD ARG 102 HD1 ARG 102 18.431 -10.587 -4.846 738 HE ARG 102 HE ARG 102 20.466 -10.146 -2.845 739 1HH1 ARG 102 HH21 ARG 102 19.245 -8.767 -5.769 740 2HH1 ARG 102 HH22 ARG 102 20.679 -7.841 -6.068 741 1HH2 ARG 102 HH11 ARG 102 22.329 -8.971 -3.242 742 2HH2 ARG 102 HH12 ARG 102 22.418 -7.954 -4.642 743 H TRP 103 HN TRP 103 15.178 -5.929 -3.898 744 HA TRP 103 HA TRP 103 12.876 -7.325 -2.680 745 1HB TRP 103 HB2 TRP 103 13.103 -5.218 -4.844 746 2HB TRP 103 HB1 TRP 103 11.570 -5.924 -4.331 747 HD1 TRP 103 HD1 TRP 103 13.882 -3.180 -3.541 748 HE1 TRP 103 HE1 TRP 103 13.295 -2.110 -1.269 749 HE3 TRP 103 HE3 TRP 103 10.662 -6.698 -1.716 750 HZ2 TRP 103 HZ2 TRP 103 11.675 -2.675 1.022 751 HZ3 TRP 103 HZ3 TRP 103 9.615 -6.409 0.511 752 HH2 TRP 103 HH2 TRP 103 10.115 -4.404 1.881 753 H THR 104 HN THR 104 11.581 -8.819 -3.788 754 HA THR 104 HA THR 104 12.503 -9.721 -6.490 755 HB THR 104 HB THR 104 12.407 -12.039 -5.812 756 HG1 THR 104 HG1 THR 104 10.684 -11.450 -4.196 757 1HG2 THR 104 HG23 THR 104 14.442 -10.555 -5.200 758 2HG2 THR 104 HG22 THR 104 13.855 -10.695 -3.543 759 3HG2 THR 104 HG21 THR 104 14.312 -12.139 -4.443 760 H ASN 105 HN ASN 105 10.833 -10.971 -7.624 761 HA ASN 105 HA ASN 105 8.054 -10.278 -6.714 762 1HB ASN 105 HB2 ASN 105 9.294 -10.374 -9.470 763 2HB ASN 105 HB1 ASN 105 7.546 -10.401 -9.226 764 1HD2 ASN 105 HD22 ASN 105 8.775 -6.832 -9.565 765 2HD2 ASN 105 HD21 ASN 105 8.994 -8.215 -10.526 766 H ASN 106 HN ASN 106 9.631 -12.752 -6.122 767 HA ASN 106 HA ASN 106 7.619 -14.669 -7.194 768 1HB ASN 106 HB2 ASN 106 9.386 -16.302 -7.783 769 2HB ASN 106 HB1 ASN 106 9.509 -14.833 -8.749 770 1HD2 ASN 106 HD22 ASN 106 12.165 -14.021 -5.987 771 2HD2 ASN 106 HD21 ASN 106 10.508 -13.672 -5.916 772 H PHE 107 HN PHE 107 9.109 -16.958 -6.142 773 HA PHE 107 HA PHE 107 8.224 -16.748 -3.371 774 1HB PHE 107 HB2 PHE 107 9.712 -19.000 -4.750 775 2HB PHE 107 HB1 PHE 107 8.815 -19.109 -3.236 776 HD1 PHE 107 HD1 PHE 107 6.363 -19.040 -3.209 777 HD2 PHE 107 HD2 PHE 107 8.562 -18.823 -6.891 778 HE1 PHE 107 HE1 PHE 107 4.283 -19.508 -4.479 779 HE2 PHE 107 HE2 PHE 107 6.484 -19.288 -8.162 780 HZ PHE 107 HZ PHE 107 4.346 -19.631 -6.955 781 H ARG 108 HN ARG 108 10.899 -15.487 -4.657 782 HA ARG 108 HA ARG 108 13.078 -16.590 -3.228 783 1HB ARG 108 HB2 ARG 108 12.535 -13.808 -4.253 784 2HB ARG 108 HB1 ARG 108 14.035 -14.202 -3.421 785 1HG ARG 108 HG2 ARG 108 13.121 -15.944 -5.705 786 2HG ARG 108 HG1 ARG 108 13.902 -14.403 -6.053 787 1HD ARG 108 HD2 ARG 108 15.184 -16.313 -4.106 788 2HD ARG 108 HD1 ARG 108 15.384 -16.549 -5.841 789 HE ARG 108 HE ARG 108 16.001 -13.873 -5.454 790 1HH1 ARG 108 HH21 ARG 108 17.003 -16.889 -4.108 791 2HH1 ARG 108 HH22 ARG 108 18.618 -16.350 -3.778 792 1HH2 ARG 108 HH11 ARG 108 18.093 -13.157 -5.016 793 2HH2 ARG 108 HH12 ARG 108 19.236 -14.241 -4.296 794 H GLU 109 HN GLU 109 14.181 -14.589 -1.690 795 HA GLU 109 HA GLU 109 13.224 -15.126 0.881 796 1HB GLU 109 HB2 GLU 109 14.802 -12.770 -0.158 797 2HB GLU 109 HB1 GLU 109 14.552 -13.095 1.557 798 1HG GLU 109 HG2 GLU 109 15.615 -15.284 1.328 799 2HG GLU 109 HG1 GLU 109 15.810 -15.029 -0.406 800 H TYR 110 HN TYR 110 12.783 -11.938 -0.772 801 HA TYR 110 HA TYR 110 10.344 -11.550 0.957 802 1HB TYR 110 HB2 TYR 110 12.306 -9.476 -0.057 803 2HB TYR 110 HB1 TYR 110 10.859 -9.137 0.886 804 HD1 TYR 110 HD2 TYR 110 10.651 -10.682 3.101 805 HD2 TYR 110 HD1 TYR 110 14.321 -9.617 1.130 806 HE1 TYR 110 HE2 TYR 110 11.899 -11.105 5.196 807 HE2 TYR 110 HE1 TYR 110 15.569 -10.038 3.230 808 HH TYR 110 HH TYR 110 13.879 -11.074 6.200 809 H ASN 111 HN ASN 111 8.481 -11.021 -0.033 810 HA ASN 111 HA ASN 111 8.495 -10.706 -2.996 811 1HB ASN 111 HB2 ASN 111 6.980 -12.395 -1.970 812 2HB ASN 111 HB1 ASN 111 6.182 -11.102 -1.075 813 1HD2 ASN 111 HD21 ASN 111 4.709 -12.676 -2.916 814 2HD2 ASN 111 HD22 ASN 111 4.277 -11.709 -4.243 815 H LEU 112 HN LEU 112 8.427 -8.644 -3.754 816 HA LEU 112 HA LEU 112 8.157 -6.350 -2.108 817 1HB LEU 112 HB2 LEU 112 9.230 -6.307 -4.335 818 2HB LEU 112 HB1 LEU 112 7.670 -6.608 -5.095 819 HG LEU 112 HG LEU 112 6.814 -4.471 -4.132 820 1HD1 LEU 112 HD13 LEU 112 9.600 -4.420 -2.984 821 2HD1 LEU 112 HD12 LEU 112 8.781 -2.903 -3.346 822 3HD1 LEU 112 HD11 LEU 112 8.071 -4.034 -2.199 823 1HD2 LEU 112 HD21 LEU 112 7.865 -4.604 -6.404 824 2HD2 LEU 112 HD23 LEU 112 8.026 -3.015 -5.657 825 3HD2 LEU 112 HD22 LEU 112 9.399 -4.123 -5.679 826 H HIS 113 HN HIS 113 5.734 -8.061 -4.078 827 HA HIS 113 HA HIS 113 3.628 -6.181 -3.809 828 1HB HIS 113 HB2 HIS 113 3.574 -8.115 -5.355 829 2HB HIS 113 HB1 HIS 113 3.378 -9.198 -3.975 830 HD1 HIS 113 HD1 HIS 113 0.963 -9.905 -4.011 831 HD2 HIS 113 HD2 HIS 113 1.402 -5.820 -4.721 832 HE1 HIS 113 HE1 HIS 113 -1.377 -8.939 -4.137 833 H ARG 114 HN ARG 114 4.520 -8.879 -1.632 834 HA ARG 114 HA ARG 114 2.278 -8.685 0.101 835 1HB ARG 114 HB2 ARG 114 5.147 -9.481 0.666 836 2HB ARG 114 HB1 ARG 114 3.855 -9.639 1.850 837 1HG ARG 114 HG2 ARG 114 3.570 -10.861 -0.894 838 2HG ARG 114 HG1 ARG 114 4.461 -11.705 0.371 839 1HD ARG 114 HD2 ARG 114 2.433 -11.484 1.852 840 2HD ARG 114 HD1 ARG 114 1.555 -10.840 0.467 841 HE ARG 114 HE ARG 114 2.607 -13.226 -0.468 842 1HH1 ARG 114 HH21 ARG 114 0.724 -12.221 2.242 843 2HH1 ARG 114 HH22 ARG 114 -0.156 -13.711 2.352 844 1HH2 ARG 114 HH11 ARG 114 1.482 -15.180 -0.331 845 2HH2 ARG 114 HH12 ARG 114 0.288 -15.392 0.906 846 H VAL 115 HN VAL 115 5.419 -6.990 0.259 847 HA VAL 115 HA VAL 115 4.740 -5.552 2.667 848 HB VAL 115 HB VAL 115 6.820 -5.078 0.515 849 1HG1 VAL 115 HG12 VAL 115 6.311 -3.600 3.109 850 2HG1 VAL 115 HG11 VAL 115 7.863 -3.563 2.272 851 3HG1 VAL 115 HG13 VAL 115 6.423 -2.918 1.484 852 1HG2 VAL 115 HG21 VAL 115 6.847 -6.278 3.295 853 2HG2 VAL 115 HG23 VAL 115 7.302 -7.050 1.778 854 3HG2 VAL 115 HG22 VAL 115 8.318 -5.783 2.462 855 H ALA 116 HN ALA 116 4.529 -4.730 -0.800 856 HA ALA 116 HA ALA 116 3.778 -2.016 -0.487 857 1HB ALA 116 HB2 ALA 116 4.292 -3.221 -2.670 858 2HB ALA 116 HB1 ALA 116 2.655 -3.875 -2.598 859 3HB ALA 116 HB3 ALA 116 2.903 -2.134 -2.720 860 H ALA 117 HN ALA 117 1.740 -4.946 -0.561 861 HA ALA 117 HA ALA 117 -0.764 -3.627 -0.293 862 1HB ALA 117 HB2 ALA 117 0.145 -6.345 0.707 863 2HB ALA 117 HB1 ALA 117 -1.536 -5.807 0.698 864 3HB ALA 117 HB3 ALA 117 -0.663 -5.999 -0.823 865 H HIS 118 HN HIS 118 1.598 -4.687 2.159 866 HA HIS 118 HA HIS 118 0.012 -4.082 4.454 867 1HB HIS 118 HB2 HIS 118 2.227 -5.329 4.418 868 2HB HIS 118 HB1 HIS 118 3.016 -3.760 4.265 869 HD1 HIS 118 HD1 HIS 118 0.678 -5.626 6.615 870 HD2 HIS 118 HD2 HIS 118 3.295 -2.380 6.668 871 HE1 HIS 118 HE1 HIS 118 0.835 -4.870 9.029 872 H GLU 119 HN GLU 119 2.442 -2.044 2.759 873 HA GLU 119 HA GLU 119 2.025 0.272 4.382 874 1HB GLU 119 HB2 GLU 119 3.005 -0.044 1.533 875 2HB GLU 119 HB1 GLU 119 2.955 1.514 2.359 876 1HG GLU 119 HG2 GLU 119 4.432 0.692 4.107 877 2HG GLU 119 HG1 GLU 119 4.406 -0.931 3.415 878 H LEU 120 HN LEU 120 0.440 -0.839 1.406 879 HA LEU 120 HA LEU 120 -1.194 1.506 1.071 880 1HB LEU 120 HB2 LEU 120 -1.579 -1.357 0.146 881 2HB LEU 120 HB1 LEU 120 -2.610 -0.020 -0.357 882 HG LEU 120 HG LEU 120 0.400 -0.054 -0.738 883 1HD1 LEU 120 HD13 LEU 120 -1.835 -0.846 -2.623 884 2HD1 LEU 120 HD12 LEU 120 -0.194 -0.487 -3.160 885 3HD1 LEU 120 HD11 LEU 120 -0.488 -1.847 -2.078 886 1HD2 LEU 120 HD22 LEU 120 -1.833 1.807 -1.543 887 2HD2 LEU 120 HD21 LEU 120 -0.242 2.193 -0.891 888 3HD2 LEU 120 HD23 LEU 120 -0.404 1.680 -2.566 889 H GLY 121 HN GLY 121 -1.597 -1.505 2.887 890 1HA GLY 121 HA2 GLY 121 -4.351 -1.230 3.517 891 2HA GLY 121 HA1 GLY 121 -3.177 -2.069 4.532 892 H HIS 122 HN HIS 122 -1.467 0.138 5.085 893 HA HIS 122 HA HIS 122 -2.927 1.376 7.248 894 1HB HIS 122 HB2 HIS 122 -0.207 1.908 6.033 895 2HB HIS 122 HB1 HIS 122 -0.829 2.829 7.403 896 HD1 HIS 122 HD1 HIS 122 -2.034 0.878 9.227 897 HD2 HIS 122 HD2 HIS 122 1.397 -0.090 7.065 898 HE1 HIS 122 HE1 HIS 122 -0.927 -1.033 10.461 899 H SER 123 HN SER 123 -1.908 2.476 4.027 900 HA SER 123 HA SER 123 -2.609 5.206 4.261 901 1HB SER 123 HB2 SER 123 -2.718 5.241 1.861 902 2HB SER 123 HB1 SER 123 -1.473 4.071 2.289 903 HG SER 123 HG SER 123 -4.166 3.575 1.538 904 H LEU 124 HN LEU 124 -4.627 2.357 3.840 905 HA LEU 124 HA LEU 124 -7.038 3.932 3.270 906 1HB LEU 124 HB2 LEU 124 -6.697 1.004 3.973 907 2HB LEU 124 HB1 LEU 124 -8.192 1.744 3.406 908 HG LEU 124 HG LEU 124 -5.588 1.758 1.848 909 1HD1 LEU 124 HD11 LEU 124 -8.029 -0.026 1.586 910 2HD1 LEU 124 HD13 LEU 124 -6.701 0.041 0.427 911 3HD1 LEU 124 HD12 LEU 124 -6.410 -0.533 2.069 912 1HD2 LEU 124 HD23 LEU 124 -8.398 2.725 1.311 913 2HD2 LEU 124 HD22 LEU 124 -6.867 3.543 1.008 914 3HD2 LEU 124 HD21 LEU 124 -7.374 2.218 -0.032 915 H GLY 125 HN GLY 125 -5.255 3.272 6.027 916 1HA GLY 125 HA2 GLY 125 -5.788 4.085 8.206 917 2HA GLY 125 HA1 GLY 125 -7.484 4.187 7.738 918 H LEU 126 HN LEU 126 -5.879 1.211 6.990 919 HA LEU 126 HA LEU 126 -7.628 -0.210 8.861 920 1HB LEU 126 HB2 LEU 126 -5.394 -1.245 7.085 921 2HB LEU 126 HB1 LEU 126 -6.549 -2.249 7.956 922 HG LEU 126 HG LEU 126 -7.327 -0.168 5.891 923 1HD1 LEU 126 HD12 LEU 126 -5.991 -2.073 4.956 924 2HD1 LEU 126 HD11 LEU 126 -7.205 -3.183 5.592 925 3HD1 LEU 126 HD13 LEU 126 -7.644 -2.014 4.346 926 1HD2 LEU 126 HD23 LEU 126 -8.834 -2.213 7.527 927 2HD2 LEU 126 HD22 LEU 126 -9.227 -0.519 7.233 928 3HD2 LEU 126 HD21 LEU 126 -9.457 -1.708 5.957 929 H SER 127 HN SER 127 -6.893 -1.471 10.655 930 HA SER 127 HA SER 127 -4.325 -0.487 11.834 931 1HB SER 127 HB2 SER 127 -6.787 -1.735 13.078 932 2HB SER 127 HB1 SER 127 -5.311 -1.381 13.972 933 HG SER 127 HG SER 127 -5.720 0.812 12.798 934 H HIS 128 HN HIS 128 -3.156 -2.135 13.199 935 HA HIS 128 HA HIS 128 -2.500 -4.449 11.629 936 1HB HIS 128 HB2 HIS 128 -1.863 -3.717 14.500 937 2HB HIS 128 HB1 HIS 128 -1.180 -5.118 13.673 938 HD1 HIS 128 HD1 HIS 128 -0.957 -1.415 13.896 939 HD2 HIS 128 HD2 HIS 128 0.617 -4.440 11.498 940 HE1 HIS 128 HE1 HIS 128 0.942 -0.374 12.585 941 H SER 129 HN SER 129 -2.533 -6.715 12.759 942 HA SER 129 HA SER 129 -4.907 -7.168 14.451 943 1HB SER 129 HB2 SER 129 -5.766 -7.104 12.091 944 2HB SER 129 HB1 SER 129 -4.695 -8.449 11.710 945 HG SER 129 HG SER 129 -7.090 -8.427 12.995 946 H THR 130 HN THR 130 -4.990 -9.421 15.209 947 HA THR 130 HA THR 130 -2.257 -10.605 15.330 948 HB THR 130 HB THR 130 -3.138 -11.866 17.254 949 HG1 THR 130 HG1 THR 130 -5.512 -10.386 17.061 950 1HG2 THR 130 HG22 THR 130 -3.827 -8.915 17.342 951 2HG2 THR 130 HG21 THR 130 -3.553 -9.944 18.748 952 3HG2 THR 130 HG23 THR 130 -2.231 -9.607 17.630 953 H ASP 131 HN ASP 131 -4.761 -10.925 13.302 954 HA ASP 131 HA ASP 131 -5.043 -13.851 13.358 955 1HB ASP 131 HB2 ASP 131 -6.921 -12.377 12.657 956 2HB ASP 131 HB1 ASP 131 -5.963 -11.852 11.273 957 H ILE 132 HN ILE 132 -3.410 -15.073 12.601 958 HA ILE 132 HA ILE 132 -1.208 -14.189 11.077 959 HB ILE 132 HB ILE 132 -1.369 -16.324 12.387 960 1HG1 ILE 132 HG12 ILE 132 -0.560 -16.801 9.508 961 2HG1 ILE 132 HG11 ILE 132 0.402 -15.832 10.626 962 1HG2 ILE 132 HG23 ILE 132 -3.637 -16.892 11.318 963 2HG2 ILE 132 HG22 ILE 132 -2.709 -17.468 9.934 964 3HG2 ILE 132 HG21 ILE 132 -2.494 -18.220 11.515 965 1HD1 ILE 132 HD13 ILE 132 -0.440 -18.696 11.152 966 2HD1 ILE 132 HD12 ILE 132 1.138 -18.226 10.515 967 3HD1 ILE 132 HD11 ILE 132 0.652 -17.718 12.133 968 H GLY 133 HN GLY 133 -4.389 -15.220 10.016 969 1HA GLY 133 HA2 GLY 133 -3.578 -15.564 7.231 970 2HA GLY 133 HA1 GLY 133 -5.235 -15.565 7.833 971 H ALA 134 HN ALA 134 -3.765 -12.855 9.076 972 HA ALA 134 HA ALA 134 -5.029 -11.144 6.990 973 1HB ALA 134 HB1 ALA 134 -3.995 -10.513 9.772 974 2HB ALA 134 HB3 ALA 134 -4.708 -9.327 8.679 975 3HB ALA 134 HB2 ALA 134 -5.684 -10.665 9.285 976 H LEU 135 HN LEU 135 -3.834 -9.741 5.741 977 HA LEU 135 HA LEU 135 -0.996 -10.206 5.469 978 1HB LEU 135 HB2 LEU 135 -2.726 -7.979 4.344 979 2HB LEU 135 HB1 LEU 135 -1.099 -8.384 3.801 980 HG LEU 135 HG LEU 135 -3.497 -10.241 3.696 981 1HD1 LEU 135 HD13 LEU 135 -2.063 -8.629 1.570 982 2HD1 LEU 135 HD12 LEU 135 -3.177 -9.946 1.203 983 3HD1 LEU 135 HD11 LEU 135 -3.758 -8.509 2.044 984 1HD2 LEU 135 HD23 LEU 135 -0.569 -10.576 3.065 985 2HD2 LEU 135 HD22 LEU 135 -1.680 -11.703 3.844 986 3HD2 LEU 135 HD21 LEU 135 -1.757 -11.457 2.102 987 H MET 136 HN MET 136 -2.962 -7.869 7.177 988 HA MET 136 HA MET 136 -0.821 -5.986 7.689 989 1HB MET 136 HB2 MET 136 -3.379 -6.410 9.263 990 2HB MET 136 HB1 MET 136 -2.362 -4.970 9.277 991 1HG MET 136 HG2 MET 136 -3.842 -6.054 6.863 992 2HG MET 136 HG1 MET 136 -4.328 -4.651 7.812 993 1HE MET 136 HE2 MET 136 -3.015 -2.816 8.343 994 2HE MET 136 HE1 MET 136 -1.269 -3.026 8.248 995 3HE MET 136 HE3 MET 136 -2.091 -1.908 7.152 996 H TYR 137 HN TYR 137 -0.505 -8.960 8.405 997 HA TYR 137 HA TYR 137 -0.441 -9.170 11.238 998 1HB TYR 137 HB2 TYR 137 -0.257 -11.035 9.461 999 2HB TYR 137 HB1 TYR 137 1.462 -10.640 9.415 1000 HD1 TYR 137 HD2 TYR 137 -1.306 -11.559 11.748 1001 HD2 TYR 137 HD1 TYR 137 2.924 -11.499 11.052 1002 HE1 TYR 137 HE2 TYR 137 -0.953 -12.900 13.804 1003 HE2 TYR 137 HE1 TYR 137 3.288 -12.839 13.109 1004 HH TYR 137 HH TYR 137 1.985 -14.423 14.519 1005 HA PRO 138 HA PRO 138 3.016 -6.436 12.013 1006 1HB PRO 138 HB2 PRO 138 3.866 -7.699 14.439 1007 2HB PRO 138 HB1 PRO 138 2.798 -6.296 14.281 1008 1HG PRO 138 HG2 PRO 138 2.090 -9.071 14.957 1009 2HG PRO 138 HG1 PRO 138 1.105 -7.608 15.103 1010 1HD PRO 138 HD2 PRO 138 0.786 -9.651 13.157 1011 2HD PRO 138 HD1 PRO 138 0.012 -8.050 13.142 1012 H SER 139 HN SER 139 3.335 -9.486 10.888 1013 HA SER 139 HA SER 139 6.267 -9.196 10.680 1014 1HB SER 139 HB2 SER 139 5.946 -10.513 12.773 1015 2HB SER 139 HB1 SER 139 5.060 -11.722 11.855 1016 HG SER 139 HG SER 139 7.423 -11.084 10.685 1017 H TYR 140 HN TYR 140 7.163 -10.476 8.983 1018 HA TYR 140 HA TYR 140 5.432 -10.879 6.738 1019 1HB TYR 140 HB2 TYR 140 7.847 -10.408 6.500 1020 2HB TYR 140 HB1 TYR 140 8.223 -11.965 7.238 1021 HD1 TYR 140 HD1 TYR 140 7.729 -14.074 6.068 1022 HD2 TYR 140 HD2 TYR 140 7.002 -10.263 4.222 1023 HE1 TYR 140 HE1 TYR 140 7.523 -15.182 3.859 1024 HE2 TYR 140 HE2 TYR 140 6.791 -11.375 2.012 1025 HH TYR 140 HH TYR 140 6.800 -14.891 1.721 1026 H THR 141 HN THR 141 4.466 -12.747 5.959 1027 HA THR 141 HA THR 141 5.069 -15.347 7.241 1028 HB THR 141 HB THR 141 2.655 -15.757 7.714 1029 HG1 THR 141 HG1 THR 141 2.003 -14.052 6.199 1030 1HG2 THR 141 HG23 THR 141 4.344 -14.745 9.399 1031 2HG2 THR 141 HG22 THR 141 3.479 -13.231 9.134 1032 3HG2 THR 141 HG21 THR 141 2.629 -14.631 9.784 1033 H PHE 142 HN PHE 142 4.980 -16.929 5.714 1034 HA PHE 142 HA PHE 142 4.201 -16.221 2.986 1035 1HB PHE 142 HB2 PHE 142 6.169 -17.680 3.559 1036 2HB PHE 142 HB1 PHE 142 5.032 -18.921 4.085 1037 HD1 PHE 142 HD2 PHE 142 3.595 -20.084 2.475 1038 HD2 PHE 142 HD1 PHE 142 6.408 -17.096 1.214 1039 HE1 PHE 142 HE2 PHE 142 3.344 -20.843 0.128 1040 HE2 PHE 142 HE1 PHE 142 6.159 -17.851 -1.134 1041 HZ PHE 142 HZ PHE 142 4.628 -19.724 -1.678 1042 H SER 143 HN SER 143 2.172 -16.472 2.204 1043 HA SER 143 HA SER 143 0.372 -18.529 3.459 1044 1HB SER 143 HB2 SER 143 -1.439 -17.039 3.376 1045 2HB SER 143 HB1 SER 143 -0.110 -15.999 3.884 1046 HG SER 143 HG SER 143 -0.965 -16.387 1.201 1047 H GLY 144 HN GLY 144 2.140 -18.062 0.823 1048 1HA GLY 144 HA2 GLY 144 1.998 -19.126 -1.282 1049 2HA GLY 144 HA1 GLY 144 0.385 -19.687 -0.844 1050 H ASP 145 HN ASP 145 -1.314 -18.698 -1.851 1051 HA ASP 145 HA ASP 145 -0.796 -16.587 -3.776 1052 1HB ASP 145 HB2 ASP 145 -3.346 -17.897 -2.804 1053 2HB ASP 145 HB1 ASP 145 -3.317 -16.653 -4.054 1054 H VAL 146 HN VAL 146 -1.863 -14.471 -3.754 1055 HA VAL 146 HA VAL 146 -1.976 -13.352 -0.992 1056 HB VAL 146 HB VAL 146 -1.840 -11.947 -3.678 1057 1HG1 VAL 146 HG12 VAL 146 -1.738 -11.015 -0.806 1058 2HG1 VAL 146 HG11 VAL 146 -1.020 -10.064 -2.106 1059 3HG1 VAL 146 HG13 VAL 146 -2.748 -10.410 -2.120 1060 1HG2 VAL 146 HG22 VAL 146 0.155 -13.389 -3.029 1061 2HG2 VAL 146 HG21 VAL 146 0.511 -11.678 -3.257 1062 3HG2 VAL 146 HG23 VAL 146 0.359 -12.336 -1.628 1063 H GLN 147 HN GLN 147 -3.981 -13.233 -0.137 1064 HA GLN 147 HA GLN 147 -6.202 -12.179 -1.829 1065 1HB GLN 147 HB2 GLN 147 -6.287 -14.687 -0.120 1066 2HB GLN 147 HB1 GLN 147 -7.731 -13.865 -0.717 1067 1HG GLN 147 HG2 GLN 147 -7.018 -14.187 -3.025 1068 2HG GLN 147 HG1 GLN 147 -5.493 -14.891 -2.486 1069 1HE2 GLN 147 HE22 GLN 147 -7.920 -17.661 -3.252 1070 2HE2 GLN 147 HE21 GLN 147 -7.294 -16.363 -4.151 1071 H LEU 148 HN LEU 148 -7.830 -11.063 -0.540 1072 HA LEU 148 HA LEU 148 -6.732 -9.834 1.860 1073 1HB LEU 148 HB2 LEU 148 -9.543 -9.684 0.722 1074 2HB LEU 148 HB1 LEU 148 -8.881 -8.631 1.971 1075 HG LEU 148 HG LEU 148 -7.812 -8.879 -0.859 1076 1HD1 LEU 148 HD12 LEU 148 -10.032 -7.754 -0.669 1077 2HD1 LEU 148 HD11 LEU 148 -9.328 -6.615 0.478 1078 3HD1 LEU 148 HD13 LEU 148 -8.758 -6.651 -1.192 1079 1HD2 LEU 148 HD23 LEU 148 -6.924 -7.360 1.594 1080 2HD2 LEU 148 HD22 LEU 148 -5.947 -8.224 0.404 1081 3HD2 LEU 148 HD21 LEU 148 -6.649 -6.663 -0.005 1082 H ALA 149 HN ALA 149 -7.782 -9.928 3.991 1083 HA ALA 149 HA ALA 149 -8.897 -12.651 4.534 1084 1HB ALA 149 HB2 ALA 149 -7.595 -10.589 6.337 1085 2HB ALA 149 HB1 ALA 149 -8.308 -12.094 6.918 1086 3HB ALA 149 HB3 ALA 149 -6.919 -12.137 5.832 1087 H GLN 150 HN GLN 150 -10.678 -12.780 6.101 1088 HA GLN 150 HA GLN 150 -12.856 -11.067 5.475 1089 1HB GLN 150 HB2 GLN 150 -13.111 -13.355 6.384 1090 2HB GLN 150 HB1 GLN 150 -12.468 -12.803 7.930 1091 1HG GLN 150 HG2 GLN 150 -14.333 -11.257 8.203 1092 2HG GLN 150 HG1 GLN 150 -14.952 -11.678 6.604 1093 1HE2 GLN 150 HE22 GLN 150 -16.937 -14.149 8.149 1094 2HE2 GLN 150 HE21 GLN 150 -16.889 -12.765 7.167 1095 H ASP 151 HN ASP 151 -10.573 -11.037 8.194 1096 HA ASP 151 HA ASP 151 -11.837 -9.015 9.738 1097 1HB ASP 151 HB2 ASP 151 -9.944 -10.374 10.564 1098 2HB ASP 151 HB1 ASP 151 -8.872 -9.575 9.416 1099 H ASP 152 HN ASP 152 -9.554 -8.783 7.011 1100 HA ASP 152 HA ASP 152 -9.405 -5.884 7.189 1101 1HB ASP 152 HB2 ASP 152 -8.616 -7.855 5.031 1102 2HB ASP 152 HB1 ASP 152 -8.351 -6.117 4.898 1103 H ILE 153 HN ILE 153 -11.251 -8.202 5.209 1104 HA ILE 153 HA ILE 153 -12.463 -6.237 3.514 1105 HB ILE 153 HB ILE 153 -13.416 -8.980 4.381 1106 1HG1 ILE 153 HG12 ILE 153 -12.228 -8.033 1.753 1107 2HG1 ILE 153 HG11 ILE 153 -11.271 -8.759 3.042 1108 1HG2 ILE 153 HG23 ILE 153 -14.510 -7.040 2.332 1109 2HG2 ILE 153 HG22 ILE 153 -14.863 -8.767 2.290 1110 3HG2 ILE 153 HG21 ILE 153 -15.373 -7.795 3.671 1111 1HD1 ILE 153 HD13 ILE 153 -13.024 -10.707 2.901 1112 2HD1 ILE 153 HD12 ILE 153 -13.383 -10.029 1.314 1113 3HD1 ILE 153 HD11 ILE 153 -11.757 -10.603 1.681 1114 H ASP 154 HN ASP 154 -13.614 -7.759 6.537 1115 HA ASP 154 HA ASP 154 -16.077 -6.342 6.685 1116 1HB ASP 154 HB2 ASP 154 -14.294 -7.497 8.840 1117 2HB ASP 154 HB1 ASP 154 -15.872 -6.787 9.181 1118 H GLY 155 HN GLY 155 -12.831 -5.458 7.847 1119 1HA GLY 155 HA2 GLY 155 -13.659 -3.082 9.227 1120 2HA GLY 155 HA1 GLY 155 -12.021 -3.417 8.676 1121 H ILE 156 HN ILE 156 -12.221 -3.454 5.942 1122 HA ILE 156 HA ILE 156 -12.549 -0.648 5.349 1123 HB ILE 156 HB ILE 156 -10.971 -2.323 4.188 1124 1HG1 ILE 156 HG12 ILE 156 -11.270 -1.141 1.958 1125 2HG1 ILE 156 HG11 ILE 156 -12.729 -0.410 2.618 1126 1HG2 ILE 156 HG23 ILE 156 -12.962 -3.899 3.723 1127 2HG2 ILE 156 HG22 ILE 156 -13.337 -2.819 2.385 1128 3HG2 ILE 156 HG21 ILE 156 -11.789 -3.662 2.431 1129 1HD1 ILE 156 HD13 ILE 156 -10.238 -0.149 4.258 1130 2HD1 ILE 156 HD12 ILE 156 -10.326 0.791 2.773 1131 3HD1 ILE 156 HD11 ILE 156 -11.558 0.996 4.015 1132 H GLN 157 HN GLN 157 -14.612 -3.468 5.029 1133 HA GLN 157 HA GLN 157 -16.551 -2.266 3.261 1134 1HB GLN 157 HB2 GLN 157 -16.604 -4.584 5.196 1135 2HB GLN 157 HB1 GLN 157 -18.077 -4.062 4.379 1136 1HG GLN 157 HG2 GLN 157 -15.533 -4.649 2.856 1137 2HG GLN 157 HG1 GLN 157 -16.719 -5.906 3.214 1138 1HE2 GLN 157 HE22 GLN 157 -17.382 -3.781 -0.001 1139 2HE2 GLN 157 HE21 GLN 157 -15.868 -4.153 0.674 1140 H ALA 158 HN ALA 158 -16.235 -2.454 6.795 1141 HA ALA 158 HA ALA 158 -18.726 -1.213 7.417 1142 1HB ALA 158 HB2 ALA 158 -16.084 -1.272 8.900 1143 2HB ALA 158 HB1 ALA 158 -17.557 -0.581 9.581 1144 3HB ALA 158 HB3 ALA 158 -17.491 -2.297 9.180 1145 H ILE 159 HN ILE 159 -15.521 0.120 6.721 1146 HA ILE 159 HA ILE 159 -16.252 2.852 7.266 1147 HB ILE 159 HB ILE 159 -14.026 1.625 5.625 1148 1HG1 ILE 159 HG12 ILE 159 -14.014 2.957 8.352 1149 2HG1 ILE 159 HG11 ILE 159 -14.118 1.214 8.113 1150 1HG2 ILE 159 HG23 ILE 159 -14.613 4.499 6.368 1151 2HG2 ILE 159 HG22 ILE 159 -12.997 3.947 5.928 1152 3HG2 ILE 159 HG21 ILE 159 -14.314 3.836 4.762 1153 1HD1 ILE 159 HD11 ILE 159 -11.879 2.913 6.988 1154 2HD1 ILE 159 HD13 ILE 159 -11.780 2.077 8.536 1155 3HD1 ILE 159 HD12 ILE 159 -11.959 1.152 7.046 1156 H TYR 160 HN TYR 160 -16.119 0.942 4.239 1157 HA TYR 160 HA TYR 160 -17.501 3.209 2.839 1158 1HB TYR 160 HB2 TYR 160 -15.846 0.901 1.794 1159 2HB TYR 160 HB1 TYR 160 -16.811 1.945 0.748 1160 HD1 TYR 160 HD2 TYR 160 -16.277 4.325 0.494 1161 HD2 TYR 160 HD1 TYR 160 -13.844 1.737 2.908 1162 HE1 TYR 160 HE2 TYR 160 -14.487 6.040 0.525 1163 HE2 TYR 160 HE1 TYR 160 -12.055 3.452 2.942 1164 HH TYR 160 HH TYR 160 -11.386 5.425 2.170 1165 H GLY 161 HN GLY 161 -17.487 -0.372 2.570 1166 1HA GLY 161 HA2 GLY 161 -19.812 -1.351 3.261 1167 2HA GLY 161 HA1 GLY 161 -20.433 -0.241 2.042 1168 H ARG 162 HN ARG 162 -21.213 -2.361 1.106 1169 HA ARG 162 HA ARG 162 -19.166 -4.046 -0.180 1170 1HB ARG 162 HB2 ARG 162 -22.190 -4.116 -0.167 1171 2HB ARG 162 HB1 ARG 162 -21.196 -5.255 -1.076 1172 1HG ARG 162 HG2 ARG 162 -20.074 -5.936 1.011 1173 2HG ARG 162 HG1 ARG 162 -21.077 -4.811 1.921 1174 1HD ARG 162 HD2 ARG 162 -23.100 -6.012 1.054 1175 2HD ARG 162 HD1 ARG 162 -22.037 -7.211 0.326 1176 HE ARG 162 HE ARG 162 -22.893 -7.103 3.074 1177 1HH1 ARG 162 HH21 ARG 162 -20.072 -7.692 1.169 1178 2HH1 ARG 162 HH22 ARG 162 -19.221 -8.477 2.456 1179 1HH2 ARG 162 HH11 ARG 162 -21.803 -8.135 4.736 1180 2HH2 ARG 162 HH12 ARG 162 -20.200 -8.732 4.469 1181 H SER 163 HN SER 163 -18.782 -4.149 -2.365 1182 HA SER 163 HA SER 163 -19.319 -1.743 -3.897 1183 1HB SER 163 HB2 SER 163 -18.305 -4.380 -4.981 1184 2HB SER 163 HB1 SER 163 -18.004 -2.765 -5.616 1185 HG SER 163 HG SER 163 -16.487 -4.056 -3.990 1186 H GLN 164 HN GLN 164 -21.667 -1.742 -3.881 1187 HA GLN 164 HA GLN 164 -23.198 -3.922 -5.005 1188 1HB GLN 164 HB2 GLN 164 -23.846 -1.000 -4.531 1189 2HB GLN 164 HB1 GLN 164 -25.027 -2.178 -5.106 1190 1HG GLN 164 HG2 GLN 164 -24.663 -3.550 -3.098 1191 2HG GLN 164 HG1 GLN 164 -23.448 -2.404 -2.527 1192 1HE2 GLN 164 HE22 GLN 164 -26.885 -1.626 -1.076 1193 2HE2 GLN 164 HE21 GLN 164 -26.015 -3.081 -1.184 1194 H ASN 165 HN ASN 165 -23.747 -4.284 -7.145 1195 HA ASN 165 HA ASN 165 -23.368 -2.158 -9.145 1196 1HB ASN 165 HB2 ASN 165 -21.912 -4.741 -9.641 1197 2HB ASN 165 HB1 ASN 165 -21.703 -3.184 -10.428 1198 1HD2 ASN 165 HD22 ASN 165 -19.507 -4.016 -7.166 1199 2HD2 ASN 165 HD21 ASN 165 -20.458 -5.183 -7.950 1200 HA PRO 166 HA PRO 166 -25.558 -5.907 -11.189 1201 1HB PRO 166 HB2 PRO 166 -26.895 -7.469 -9.140 1202 2HB PRO 166 HB1 PRO 166 -25.644 -8.002 -10.270 1203 1HG PRO 166 HG2 PRO 166 -25.326 -7.645 -7.459 1204 2HG PRO 166 HG1 PRO 166 -24.039 -7.950 -8.635 1205 1HD PRO 166 HD2 PRO 166 -24.763 -5.428 -7.292 1206 2HD PRO 166 HD1 PRO 166 -23.257 -5.840 -8.137 1207 H VAL 167 HN VAL 167 -26.582 -3.715 -11.316 1208 HA VAL 167 HA VAL 167 -29.024 -3.304 -9.703 1209 HB VAL 167 HB VAL 167 -27.767 -1.627 -11.899 1210 1HG1 VAL 167 HG13 VAL 167 -29.904 -0.972 -9.850 1211 2HG1 VAL 167 HG12 VAL 167 -29.197 0.168 -10.993 1212 3HG1 VAL 167 HG11 VAL 167 -30.174 -1.175 -11.582 1213 1HG2 VAL 167 HG23 VAL 167 -26.393 -1.993 -9.802 1214 2HG2 VAL 167 HG22 VAL 167 -26.815 -0.310 -10.109 1215 3HG2 VAL 167 HG21 VAL 167 -27.697 -1.234 -8.893 1216 H GLN 168 HN GLN 168 -30.928 -4.152 -10.392 1217 HA GLN 168 HA GLN 168 -31.263 -4.810 -13.286 1218 1HB GLN 168 HB2 GLN 168 -33.097 -5.741 -11.085 1219 2HB GLN 168 HB1 GLN 168 -32.780 -6.479 -12.653 1220 1HG GLN 168 HG2 GLN 168 -30.440 -6.940 -11.923 1221 2HG GLN 168 HG1 GLN 168 -30.845 -6.306 -10.327 1222 1HE2 GLN 168 HE22 GLN 168 -32.584 -9.857 -11.485 1223 2HE2 GLN 168 HE21 GLN 168 -32.164 -8.722 -12.675 1224 HA PRO 169 HA PRO 169 -35.238 -2.341 -12.069 1225 1HB PRO 169 HB2 PRO 169 -34.467 -0.226 -10.249 1226 2HB PRO 169 HB1 PRO 169 -35.621 -1.535 -9.961 1227 1HG PRO 169 HG2 PRO 169 -33.028 -1.249 -8.773 1228 2HG PRO 169 HG1 PRO 169 -34.127 -2.626 -8.610 1229 1HD PRO 169 HD2 PRO 169 -31.674 -2.421 -10.196 1230 2HD PRO 169 HD1 PRO 169 -32.616 -3.873 -9.811 No H/Q in entry = 1230 Start of MODEL 28 1 1H VAL 1 HT3 VAL 1 -10.793 17.030 15.402 2 2H VAL 1 HT2 VAL 1 -11.116 17.602 16.968 3 3H VAL 1 HT1 VAL 1 -11.095 15.931 16.658 4 HA VAL 1 HA VAL 1 -13.270 16.014 16.342 5 HB VAL 1 HB VAL 1 -13.173 18.168 17.651 6 1HG1 VAL 1 HG12 VAL 1 -11.835 19.368 15.849 7 2HG1 VAL 1 HG11 VAL 1 -13.337 19.492 14.933 8 3HG1 VAL 1 HG13 VAL 1 -13.197 20.274 16.507 9 1HG2 VAL 1 HG23 VAL 1 -15.307 17.127 16.828 10 2HG2 VAL 1 HG22 VAL 1 -15.405 18.879 17.007 11 3HG2 VAL 1 HG21 VAL 1 -15.212 18.164 15.405 12 H LEU 2 HN LEU 2 -11.283 17.954 14.182 13 HA LEU 2 HA LEU 2 -13.116 18.124 12.009 14 1HB LEU 2 HB2 LEU 2 -11.039 19.455 12.123 15 2HB LEU 2 HB1 LEU 2 -10.078 17.993 11.973 16 HG LEU 2 HG LEU 2 -10.360 19.362 9.845 17 1HD1 LEU 2 HD12 LEU 2 -10.105 16.656 10.118 18 2HD1 LEU 2 HD11 LEU 2 -11.554 16.743 9.127 19 3HD1 LEU 2 HD13 LEU 2 -10.065 17.504 8.581 20 1HD2 LEU 2 HD22 LEU 2 -12.857 19.766 10.388 21 2HD2 LEU 2 HD21 LEU 2 -12.417 19.455 8.711 22 3HD2 LEU 2 HD23 LEU 2 -13.123 18.168 9.687 23 H THR 3 HN THR 3 -10.753 15.626 12.909 24 HA THR 3 HA THR 3 -11.683 13.919 10.646 25 HB THR 3 HB THR 3 -9.857 12.393 11.401 26 HG1 THR 3 HG1 THR 3 -8.597 14.165 12.967 27 1HG2 THR 3 HG22 THR 3 -9.543 14.428 9.807 28 2HG2 THR 3 HG21 THR 3 -8.690 15.156 11.171 29 3HG2 THR 3 HG23 THR 3 -8.109 13.648 10.470 30 H GLU 4 HN GLU 4 -13.274 12.431 11.038 31 HA GLU 4 HA GLU 4 -14.225 11.950 13.750 32 1HB GLU 4 HB2 GLU 4 -15.748 11.913 11.777 33 2HB GLU 4 HB1 GLU 4 -14.902 10.486 11.177 34 1HG GLU 4 HG2 GLU 4 -15.516 9.253 13.227 35 2HG GLU 4 HG1 GLU 4 -16.363 10.679 13.828 36 H GLY 5 HN GLY 5 -13.436 10.383 15.123 37 1HA GLY 5 HA2 GLY 5 -12.035 8.631 15.853 38 2HA GLY 5 HA1 GLY 5 -12.692 7.766 14.460 39 H ASN 6 HN ASN 6 -11.035 6.947 13.275 40 HA ASN 6 HA ASN 6 -8.405 8.203 13.266 41 1HB ASN 6 HB2 ASN 6 -9.592 5.829 11.811 42 2HB ASN 6 HB1 ASN 6 -7.936 6.367 11.536 43 1HD2 ASN 6 HD22 ASN 6 -8.604 3.993 14.637 44 2HD2 ASN 6 HD21 ASN 6 -9.614 4.128 13.280 45 HA PRO 7 HA PRO 7 -9.140 10.861 9.780 46 1HB PRO 7 HB2 PRO 7 -6.643 10.450 8.428 47 2HB PRO 7 HB1 PRO 7 -7.044 11.757 9.552 48 1HG PRO 7 HG2 PRO 7 -5.344 9.411 10.021 49 2HG PRO 7 HG1 PRO 7 -5.548 10.847 11.035 50 1HD PRO 7 HD2 PRO 7 -6.579 8.242 11.571 51 2HD PRO 7 HD1 PRO 7 -6.974 9.738 12.441 52 H ARG 8 HN ARG 8 -9.940 10.599 7.666 53 HA ARG 8 HA ARG 8 -9.360 8.065 6.217 54 1HB ARG 8 HB2 ARG 8 -12.112 8.996 7.092 55 2HB ARG 8 HB1 ARG 8 -11.853 7.781 5.840 56 1HG ARG 8 HG2 ARG 8 -10.615 6.380 7.450 57 2HG ARG 8 HG1 ARG 8 -10.872 7.591 8.705 58 1HD ARG 8 HD2 ARG 8 -13.084 6.144 7.224 59 2HD ARG 8 HD1 ARG 8 -12.520 5.737 8.844 60 HE ARG 8 HE ARG 8 -13.153 8.439 9.000 61 1HH1 ARG 8 HH21 ARG 8 -14.731 5.540 8.011 62 2HH1 ARG 8 HH22 ARG 8 -16.308 6.083 8.477 63 1HH2 ARG 8 HH11 ARG 8 -15.198 9.166 9.612 64 2HH2 ARG 8 HH12 ARG 8 -16.573 8.138 9.381 65 H TRP 9 HN TRP 9 -9.724 8.260 3.957 66 HA TRP 9 HA TRP 9 -9.500 10.943 2.920 67 1HB TRP 9 HB2 TRP 9 -10.034 8.292 1.541 68 2HB TRP 9 HB1 TRP 9 -9.731 9.806 0.687 69 HD1 TRP 9 HD1 TRP 9 -7.996 6.951 2.315 70 HE1 TRP 9 HE1 TRP 9 -5.451 7.364 2.379 71 HE3 TRP 9 HE3 TRP 9 -7.867 11.883 0.991 72 HZ2 TRP 9 HZ2 TRP 9 -3.603 9.503 1.924 73 HZ3 TRP 9 HZ3 TRP 9 -5.705 13.081 0.815 74 HH2 TRP 9 HH2 TRP 9 -3.575 11.899 1.280 75 H GLU 10 HN GLU 10 -11.107 12.306 2.272 76 HA GLU 10 HA GLU 10 -13.867 11.642 2.845 77 1HB GLU 10 HB2 GLU 10 -12.561 14.006 1.479 78 2HB GLU 10 HB1 GLU 10 -14.296 13.904 1.780 79 1HG GLU 10 HG2 GLU 10 -13.864 13.642 4.197 80 2HG GLU 10 HG1 GLU 10 -12.129 13.748 3.897 81 H GLN 11 HN GLN 11 -11.897 11.790 -0.086 82 HA GLN 11 HA GLN 11 -14.220 11.426 -1.838 83 1HB GLN 11 HB2 GLN 11 -11.236 11.341 -2.363 84 2HB GLN 11 HB1 GLN 11 -12.464 11.163 -3.618 85 1HG GLN 11 HG2 GLN 11 -13.389 13.374 -3.034 86 2HG GLN 11 HG1 GLN 11 -12.164 13.556 -1.779 87 1HE2 GLN 11 HE22 GLN 11 -11.145 15.009 -5.221 88 2HE2 GLN 11 HE21 GLN 11 -12.665 15.032 -4.467 89 H THR 12 HN THR 12 -14.794 9.517 -2.905 90 HA THR 12 HA THR 12 -13.841 7.019 -1.628 91 HB THR 12 HB THR 12 -15.708 5.970 -2.861 92 HG1 THR 12 HG1 THR 12 -16.577 8.453 -3.762 93 1HG2 THR 12 HG21 THR 12 -16.461 8.573 -1.501 94 2HG2 THR 12 HG23 THR 12 -17.565 7.232 -1.806 95 3HG2 THR 12 HG22 THR 12 -16.205 7.022 -0.703 96 H HIS 13 HN HIS 13 -12.987 8.951 -4.183 97 HA HIS 13 HA HIS 13 -11.815 6.659 -5.729 98 1HB HIS 13 HB2 HIS 13 -12.631 9.393 -6.767 99 2HB HIS 13 HB1 HIS 13 -11.982 8.063 -7.727 100 HD1 HIS 13 HD1 HIS 13 -13.518 5.705 -7.299 101 HD2 HIS 13 HD2 HIS 13 -15.381 9.409 -6.864 102 HE1 HIS 13 HE1 HIS 13 -16.009 5.282 -7.487 103 H LEU 14 HN LEU 14 -9.604 6.749 -5.969 104 HA LEU 14 HA LEU 14 -8.189 9.296 -5.263 105 1HB LEU 14 HB2 LEU 14 -7.473 6.510 -4.302 106 2HB LEU 14 HB1 LEU 14 -6.533 7.968 -3.998 107 HG LEU 14 HG LEU 14 -9.424 7.620 -3.141 108 1HD1 LEU 14 HD11 LEU 14 -6.840 7.190 -1.620 109 2HD1 LEU 14 HD13 LEU 14 -8.417 7.346 -0.846 110 3HD1 LEU 14 HD12 LEU 14 -8.100 5.997 -1.937 111 1HD2 LEU 14 HD21 LEU 14 -7.303 9.731 -2.711 112 2HD2 LEU 14 HD23 LEU 14 -8.987 9.938 -3.185 113 3HD2 LEU 14 HD22 LEU 14 -8.588 9.512 -1.525 114 H THR 15 HN THR 15 -5.930 9.292 -6.030 115 HA THR 15 HA THR 15 -5.504 7.569 -8.452 116 HB THR 15 HB THR 15 -4.470 9.533 -9.531 117 HG1 THR 15 HG1 THR 15 -5.351 10.859 -7.184 118 1HG2 THR 15 HG23 THR 15 -7.278 9.932 -8.477 119 2HG2 THR 15 HG22 THR 15 -6.563 10.929 -9.744 120 3HG2 THR 15 HG21 THR 15 -6.805 9.203 -10.012 121 H TYR 16 HN TYR 16 -3.115 7.470 -9.040 122 HA TYR 16 HA TYR 16 -1.300 8.070 -6.764 123 1HB TYR 16 HB2 TYR 16 -0.355 5.777 -6.800 124 2HB TYR 16 HB1 TYR 16 -2.032 5.805 -6.267 125 HD1 TYR 16 HD1 TYR 16 0.260 4.883 -9.010 126 HD2 TYR 16 HD2 TYR 16 -3.812 4.877 -7.640 127 HE1 TYR 16 HE1 TYR 16 -0.335 3.245 -10.778 128 HE2 TYR 16 HE2 TYR 16 -4.405 3.247 -9.409 129 HH TYR 16 HH TYR 16 -2.953 1.396 -10.756 130 H ARG 17 HN ARG 17 0.971 7.933 -7.344 131 HA ARG 17 HA ARG 17 1.548 7.831 -10.265 132 1HB ARG 17 HB2 ARG 17 1.074 10.171 -9.864 133 2HB ARG 17 HB1 ARG 17 2.051 10.177 -8.404 134 1HG ARG 17 HG2 ARG 17 3.278 11.276 -10.194 135 2HG ARG 17 HG1 ARG 17 4.090 9.766 -9.811 136 1HD ARG 17 HD2 ARG 17 3.033 8.687 -11.739 137 2HD ARG 17 HD1 ARG 17 2.128 10.160 -12.084 138 HE ARG 17 HE ARG 17 4.786 10.966 -12.084 139 1HH1 ARG 17 HH21 ARG 17 2.869 8.566 -13.631 140 2HH1 ARG 17 HH22 ARG 17 3.834 8.521 -15.069 141 1HH2 ARG 17 HH11 ARG 17 6.069 10.933 -13.954 142 2HH2 ARG 17 HH12 ARG 17 5.649 9.868 -15.254 143 H ILE 18 HN ILE 18 3.493 6.787 -10.625 144 HA ILE 18 HA ILE 18 5.185 6.138 -8.266 145 HB ILE 18 HB ILE 18 5.406 5.204 -11.153 146 1HG1 ILE 18 HG12 ILE 18 4.358 3.699 -8.737 147 2HG1 ILE 18 HG11 ILE 18 3.308 4.518 -9.895 148 1HG2 ILE 18 HG22 ILE 18 6.804 4.446 -8.578 149 2HG2 ILE 18 HG21 ILE 18 6.782 3.379 -9.981 150 3HG2 ILE 18 HG23 ILE 18 7.534 4.968 -10.095 151 1HD1 ILE 18 HD13 ILE 18 5.335 2.387 -10.628 152 2HD1 ILE 18 HD12 ILE 18 3.609 2.094 -10.417 153 3HD1 ILE 18 HD11 ILE 18 4.172 3.148 -11.714 154 H GLU 19 HN GLU 19 6.848 7.526 -7.821 155 HA GLU 19 HA GLU 19 7.641 9.591 -9.670 156 1HB GLU 19 HB2 GLU 19 8.862 8.602 -7.086 157 2HB GLU 19 HB1 GLU 19 9.492 9.983 -7.986 158 1HG GLU 19 HG2 GLU 19 7.300 11.099 -7.822 159 2HG GLU 19 HG1 GLU 19 6.660 9.722 -6.925 160 H ASN 20 HN ASN 20 9.145 6.487 -8.741 161 HA ASN 20 HA ASN 20 10.623 6.479 -11.277 162 1HB ASN 20 HB2 ASN 20 12.162 6.517 -8.660 163 2HB ASN 20 HB1 ASN 20 12.852 6.342 -10.273 164 1HD2 ASN 20 HD22 ASN 20 12.206 10.019 -8.832 165 2HD2 ASN 20 HD21 ASN 20 12.143 8.618 -7.876 166 H TYR 21 HN TYR 21 11.800 4.411 -11.559 167 HA TYR 21 HA TYR 21 10.555 2.205 -9.953 168 1HB TYR 21 HB2 TYR 21 11.748 2.248 -12.742 169 2HB TYR 21 HB1 TYR 21 11.218 0.780 -11.922 170 HD1 TYR 21 HD1 TYR 21 8.839 0.368 -11.479 171 HD2 TYR 21 HD2 TYR 21 10.158 3.911 -13.513 172 HE1 TYR 21 HE1 TYR 21 6.514 0.812 -12.211 173 HE2 TYR 21 HE2 TYR 21 7.832 4.360 -14.245 174 HH TYR 21 HH TYR 21 5.743 3.611 -14.284 175 H THR 22 HN THR 22 11.897 0.903 -8.757 176 HA THR 22 HA THR 22 14.655 1.632 -8.425 177 HB THR 22 HB THR 22 13.518 0.679 -6.539 178 HG1 THR 22 HG1 THR 22 14.862 -1.196 -6.175 179 1HG2 THR 22 HG21 THR 22 11.841 -0.612 -7.863 180 2HG2 THR 22 HG23 THR 22 13.084 -1.810 -8.212 181 3HG2 THR 22 HG22 THR 22 12.549 -1.554 -6.554 182 HA PRO 23 HA PRO 23 16.101 -0.773 -11.946 183 1HB PRO 23 HB2 PRO 23 18.812 -0.968 -11.054 184 2HB PRO 23 HB1 PRO 23 18.148 0.237 -12.168 185 1HG PRO 23 HG2 PRO 23 18.947 0.590 -9.365 186 2HG PRO 23 HG1 PRO 23 18.546 1.828 -10.565 187 1HD PRO 23 HD2 PRO 23 16.916 1.003 -8.365 188 2HD PRO 23 HD1 PRO 23 16.449 2.086 -9.693 189 H ASP 24 HN ASP 24 15.814 -1.763 -8.787 190 HA ASP 24 HA ASP 24 17.273 -4.225 -8.731 191 1HB ASP 24 HB2 ASP 24 14.727 -3.361 -7.332 192 2HB ASP 24 HB1 ASP 24 15.543 -4.889 -7.000 193 H LEU 25 HN LEU 25 14.028 -3.383 -9.873 194 HA LEU 25 HA LEU 25 13.942 -5.959 -11.381 195 1HB LEU 25 HB2 LEU 25 11.650 -4.746 -9.795 196 2HB LEU 25 HB1 LEU 25 11.538 -6.187 -10.792 197 HG LEU 25 HG LEU 25 13.456 -5.959 -8.459 198 1HD1 LEU 25 HD11 LEU 25 10.637 -7.064 -8.537 199 2HD1 LEU 25 HD13 LEU 25 11.770 -7.308 -7.207 200 3HD1 LEU 25 HD12 LEU 25 11.199 -5.684 -7.593 201 1HD2 LEU 25 HD22 LEU 25 12.426 -8.234 -10.179 202 2HD2 LEU 25 HD21 LEU 25 14.100 -7.750 -9.913 203 3HD2 LEU 25 HD23 LEU 25 13.187 -8.514 -8.614 204 HA PRO 26 HA PRO 26 12.860 -3.229 -14.719 205 1HB PRO 26 HB2 PRO 26 10.845 -4.902 -15.920 206 2HB PRO 26 HB1 PRO 26 12.543 -4.756 -16.396 207 1HG PRO 26 HG2 PRO 26 11.240 -6.949 -14.947 208 2HG PRO 26 HG1 PRO 26 12.864 -6.902 -15.648 209 1HD PRO 26 HD2 PRO 26 12.239 -6.809 -12.880 210 2HD PRO 26 HD1 PRO 26 13.819 -6.468 -13.609 211 H ARG 27 HN ARG 27 11.071 -1.821 -15.380 212 HA ARG 27 HA ARG 27 9.237 -1.223 -13.244 213 1HB ARG 27 HB2 ARG 27 8.330 0.472 -14.769 214 2HB ARG 27 HB1 ARG 27 10.093 0.493 -14.816 215 1HG ARG 27 HG2 ARG 27 9.972 -1.029 -16.829 216 2HG ARG 27 HG1 ARG 27 8.227 -0.779 -16.836 217 1HD ARG 27 HD2 ARG 27 8.632 1.688 -16.995 218 2HD ARG 27 HD1 ARG 27 10.357 1.360 -17.138 219 HE ARG 27 HE ARG 27 9.203 -0.182 -19.143 220 1HH1 ARG 27 HH21 ARG 27 9.133 3.114 -18.145 221 2HH1 ARG 27 HH22 ARG 27 8.887 3.736 -19.742 222 1HH2 ARG 27 HH11 ARG 27 8.878 0.614 -21.249 223 2HH2 ARG 27 HH12 ARG 27 8.755 2.324 -21.498 224 H ALA 28 HN ALA 28 8.959 -3.091 -16.213 225 HA ALA 28 HA ALA 28 6.130 -3.212 -16.406 226 1HB ALA 28 HB1 ALA 28 7.782 -4.074 -18.108 227 2HB ALA 28 HB3 ALA 28 8.045 -5.467 -17.058 228 3HB ALA 28 HB2 ALA 28 6.453 -5.181 -17.762 229 H ASP 29 HN ASP 29 8.388 -5.177 -14.483 230 HA ASP 29 HA ASP 29 6.260 -6.900 -13.476 231 1HB ASP 29 HB2 ASP 29 9.127 -6.482 -12.574 232 2HB ASP 29 HB1 ASP 29 8.047 -7.716 -11.921 233 H VAL 30 HN VAL 30 7.863 -3.944 -12.418 234 HA VAL 30 HA VAL 30 6.844 -4.017 -9.713 235 HB VAL 30 HB VAL 30 7.836 -1.748 -11.454 236 1HG1 VAL 30 HG12 VAL 30 6.952 -1.786 -8.561 237 2HG1 VAL 30 HG11 VAL 30 8.022 -0.543 -9.208 238 3HG1 VAL 30 HG13 VAL 30 6.389 -0.721 -9.849 239 1HG2 VAL 30 HG22 VAL 30 9.046 -3.329 -9.165 240 2HG2 VAL 30 HG21 VAL 30 9.552 -3.372 -10.853 241 3HG2 VAL 30 HG23 VAL 30 9.797 -1.911 -9.897 242 H ASP 31 HN ASP 31 5.705 -2.537 -12.749 243 HA ASP 31 HA ASP 31 3.467 -1.159 -11.652 244 1HB ASP 31 HB2 ASP 31 3.932 -2.415 -14.368 245 2HB ASP 31 HB1 ASP 31 2.483 -1.485 -13.986 246 H HIS 32 HN HIS 32 3.800 -4.486 -12.868 247 HA HIS 32 HA HIS 32 1.072 -5.244 -12.496 248 1HB HIS 32 HB2 HIS 32 2.698 -6.606 -13.778 249 2HB HIS 32 HB1 HIS 32 3.552 -6.978 -12.278 250 HD1 HIS 32 HD1 HIS 32 -0.035 -7.217 -13.572 251 HD2 HIS 32 HD2 HIS 32 2.621 -9.305 -11.131 252 HE1 HIS 32 HE1 HIS 32 -1.246 -9.312 -12.825 253 H ALA 33 HN ALA 33 3.890 -5.474 -10.330 254 HA ALA 33 HA ALA 33 2.587 -6.757 -8.153 255 1HB ALA 33 HB1 ALA 33 4.879 -4.770 -8.163 256 2HB ALA 33 HB3 ALA 33 4.412 -5.749 -6.772 257 3HB ALA 33 HB2 ALA 33 5.013 -6.527 -8.235 258 H ILE 34 HN ILE 34 3.117 -3.262 -8.734 259 HA ILE 34 HA ILE 34 1.579 -2.461 -6.423 260 HB ILE 34 HB ILE 34 2.244 -0.897 -8.942 261 1HG1 ILE 34 HG12 ILE 34 4.300 -1.688 -7.915 262 2HG1 ILE 34 HG11 ILE 34 4.118 0.022 -7.540 263 1HG2 ILE 34 HG22 ILE 34 1.329 -0.058 -6.182 264 2HG2 ILE 34 HG21 ILE 34 2.019 1.061 -7.357 265 3HG2 ILE 34 HG23 ILE 34 0.508 0.227 -7.717 266 1HD1 ILE 34 HD11 ILE 34 2.938 -0.861 -5.360 267 2HD1 ILE 34 HD13 ILE 34 3.795 -2.357 -5.731 268 3HD1 ILE 34 HD12 ILE 34 4.697 -0.869 -5.458 269 H GLU 35 HN GLU 35 0.800 -2.752 -9.893 270 HA GLU 35 HA GLU 35 -1.852 -1.732 -9.738 271 1HB GLU 35 HB2 GLU 35 -0.628 -2.168 -11.866 272 2HB GLU 35 HB1 GLU 35 -0.809 -3.900 -11.588 273 1HG GLU 35 HG2 GLU 35 -3.265 -3.647 -11.595 274 2HG GLU 35 HG1 GLU 35 -3.085 -1.915 -11.878 275 H LYS 36 HN LYS 36 -0.626 -5.057 -9.331 276 HA LYS 36 HA LYS 36 -3.159 -6.323 -9.048 277 1HB LYS 36 HB2 LYS 36 -1.048 -7.559 -9.388 278 2HB LYS 36 HB1 LYS 36 -0.507 -7.068 -7.784 279 1HG LYS 36 HG2 LYS 36 -2.407 -8.260 -6.761 280 2HG LYS 36 HG1 LYS 36 -2.974 -8.738 -8.361 281 1HD LYS 36 HD2 LYS 36 -0.887 -9.975 -8.745 282 2HD LYS 36 HD1 LYS 36 -0.281 -9.466 -7.169 283 1HE LYS 36 HE2 LYS 36 -1.335 -11.803 -7.283 284 2HE LYS 36 HE1 LYS 36 -1.930 -10.737 -6.010 285 1HZ LYS 36 HZ1 LYS 36 -3.215 -11.093 -8.663 286 2HZ LYS 36 HZ3 LYS 36 -3.725 -11.847 -7.232 287 3HZ LYS 36 HZ2 LYS 36 -3.804 -10.156 -7.374 288 H ALA 37 HN ALA 37 -1.056 -4.789 -6.602 289 HA ALA 37 HA ALA 37 -2.565 -5.623 -4.338 290 1HB ALA 37 HB1 ALA 37 -0.914 -3.117 -4.754 291 2HB ALA 37 HB3 ALA 37 -1.523 -3.666 -3.192 292 3HB ALA 37 HB2 ALA 37 -0.355 -4.647 -4.077 293 H PHE 38 HN PHE 38 -2.791 -2.512 -6.145 294 HA PHE 38 HA PHE 38 -4.975 -1.504 -4.624 295 1HB PHE 38 HB2 PHE 38 -3.987 -0.963 -7.420 296 2HB PHE 38 HB1 PHE 38 -5.477 -0.213 -6.851 297 HD1 PHE 38 HD2 PHE 38 -5.431 1.178 -4.749 298 HD2 PHE 38 HD1 PHE 38 -1.855 -0.146 -6.722 299 HE1 PHE 38 HE2 PHE 38 -4.129 2.901 -3.533 300 HE2 PHE 38 HE1 PHE 38 -0.546 1.577 -5.506 301 HZ PHE 38 HZ PHE 38 -1.685 3.101 -3.910 302 H GLN 39 HN GLN 39 -4.976 -3.585 -7.518 303 HA GLN 39 HA GLN 39 -7.781 -3.523 -7.982 304 1HB GLN 39 HB2 GLN 39 -5.730 -5.698 -8.469 305 2HB GLN 39 HB1 GLN 39 -7.398 -5.795 -9.034 306 1HG GLN 39 HG2 GLN 39 -5.551 -3.488 -9.694 307 2HG GLN 39 HG1 GLN 39 -5.758 -4.894 -10.739 308 1HE2 GLN 39 HE22 GLN 39 -8.331 -1.958 -11.217 309 2HE2 GLN 39 HE21 GLN 39 -6.736 -1.816 -10.652 310 H LEU 40 HN LEU 40 -5.839 -5.604 -5.832 311 HA LEU 40 HA LEU 40 -7.958 -7.323 -5.009 312 1HB LEU 40 HB2 LEU 40 -5.490 -6.384 -3.523 313 2HB LEU 40 HB1 LEU 40 -6.554 -7.660 -2.940 314 HG LEU 40 HG LEU 40 -5.176 -7.729 -5.641 315 1HD1 LEU 40 HD11 LEU 40 -3.555 -7.711 -3.746 316 2HD1 LEU 40 HD13 LEU 40 -4.378 -9.115 -3.066 317 3HD1 LEU 40 HD12 LEU 40 -3.556 -9.242 -4.621 318 1HD2 LEU 40 HD22 LEU 40 -6.842 -9.675 -4.041 319 2HD2 LEU 40 HD21 LEU 40 -6.975 -9.248 -5.745 320 3HD2 LEU 40 HD23 LEU 40 -5.653 -10.270 -5.196 321 H TRP 41 HN TRP 41 -6.892 -4.167 -3.723 322 HA TRP 41 HA TRP 41 -8.775 -4.212 -1.520 323 1HB TRP 41 HB2 TRP 41 -7.244 -1.966 -2.853 324 2HB TRP 41 HB1 TRP 41 -8.263 -1.733 -1.433 325 HD1 TRP 41 HD1 TRP 41 -4.816 -2.427 -2.327 326 HE1 TRP 41 HE1 TRP 41 -3.497 -3.406 -0.338 327 HE3 TRP 41 HE3 TRP 41 -8.686 -3.669 0.768 328 HZ2 TRP 41 HZ2 TRP 41 -4.020 -4.565 2.226 329 HZ3 TRP 41 HZ3 TRP 41 -8.246 -4.709 2.974 330 HH2 TRP 41 HH2 TRP 41 -5.919 -5.158 3.707 331 H SER 42 HN SER 42 -8.841 -2.801 -4.788 332 HA SER 42 HA SER 42 -11.397 -1.490 -4.449 333 1HB SER 42 HB2 SER 42 -9.819 -0.854 -6.244 334 2HB SER 42 HB1 SER 42 -10.010 -2.444 -6.978 335 HG SER 42 HG SER 42 -12.243 -0.807 -6.433 336 H ASN 43 HN ASN 43 -10.382 -4.718 -5.330 337 HA ASN 43 HA ASN 43 -12.756 -5.665 -6.547 338 1HB ASN 43 HB2 ASN 43 -10.636 -7.062 -4.905 339 2HB ASN 43 HB1 ASN 43 -11.968 -7.932 -5.669 340 1HD2 ASN 43 HD22 ASN 43 -10.741 -6.621 -8.990 341 2HD2 ASN 43 HD21 ASN 43 -12.150 -6.356 -8.082 342 H VAL 44 HN VAL 44 -11.915 -5.396 -3.100 343 HA VAL 44 HA VAL 44 -14.672 -6.365 -2.424 344 HB VAL 44 HB VAL 44 -13.834 -6.961 -0.264 345 1HG1 VAL 44 HG13 VAL 44 -13.297 -8.465 -2.198 346 2HG1 VAL 44 HG12 VAL 44 -11.715 -7.694 -2.305 347 3HG1 VAL 44 HG11 VAL 44 -12.154 -8.610 -0.863 348 1HG2 VAL 44 HG22 VAL 44 -11.425 -5.339 -1.103 349 2HG2 VAL 44 HG21 VAL 44 -12.390 -5.199 0.368 350 3HG2 VAL 44 HG23 VAL 44 -11.296 -6.564 0.159 351 H THR 45 HN THR 45 -13.686 -3.522 -3.217 352 HA THR 45 HA THR 45 -15.198 -2.184 -1.052 353 HB THR 45 HB THR 45 -13.522 -0.419 -0.777 354 HG1 THR 45 HG1 THR 45 -12.486 -0.376 -2.689 355 1HG2 THR 45 HG21 THR 45 -13.432 -2.594 0.561 356 2HG2 THR 45 HG23 THR 45 -12.119 -3.075 -0.511 357 3HG2 THR 45 HG22 THR 45 -11.946 -1.649 0.505 358 HA PRO 46 HA PRO 46 -16.725 -0.041 -4.677 359 1HB PRO 46 HB2 PRO 46 -17.725 2.262 -3.413 360 2HB PRO 46 HB1 PRO 46 -18.599 0.732 -3.578 361 1HG PRO 46 HG2 PRO 46 -17.290 1.882 -1.171 362 2HG PRO 46 HG1 PRO 46 -18.591 0.682 -1.272 363 1HD PRO 46 HD2 PRO 46 -15.885 0.119 -0.664 364 2HD PRO 46 HD1 PRO 46 -17.118 -1.067 -1.150 365 H LEU 47 HN LEU 47 -14.062 0.850 -2.920 366 HA LEU 47 HA LEU 47 -13.658 3.558 -3.904 367 1HB LEU 47 HB2 LEU 47 -11.585 1.588 -2.892 368 2HB LEU 47 HB1 LEU 47 -11.404 3.339 -3.010 369 HG LEU 47 HG LEU 47 -13.396 1.876 -1.253 370 1HD1 LEU 47 HD11 LEU 47 -10.806 3.339 -0.692 371 2HD1 LEU 47 HD13 LEU 47 -11.989 2.977 0.565 372 3HD1 LEU 47 HD12 LEU 47 -11.203 1.664 -0.311 373 1HD2 LEU 47 HD23 LEU 47 -12.947 4.790 -1.904 374 2HD2 LEU 47 HD22 LEU 47 -14.467 3.907 -1.752 375 3HD2 LEU 47 HD21 LEU 47 -13.552 4.335 -0.311 376 H THR 48 HN THR 48 -12.207 4.204 -5.595 377 HA THR 48 HA THR 48 -11.404 2.033 -7.513 378 HB THR 48 HB THR 48 -12.179 3.305 -9.360 379 HG1 THR 48 HG1 THR 48 -11.777 5.348 -7.642 380 1HG2 THR 48 HG22 THR 48 -13.998 2.227 -8.060 381 2HG2 THR 48 HG21 THR 48 -14.211 3.723 -7.150 382 3HG2 THR 48 HG23 THR 48 -14.548 3.688 -8.881 383 H PHE 49 HN PHE 49 -9.380 2.318 -8.447 384 HA PHE 49 HA PHE 49 -7.834 4.770 -7.641 385 1HB PHE 49 HB2 PHE 49 -6.898 1.894 -7.856 386 2HB PHE 49 HB1 PHE 49 -5.841 3.274 -7.558 387 HD1 PHE 49 HD1 PHE 49 -8.487 1.131 -6.167 388 HD2 PHE 49 HD2 PHE 49 -5.892 4.471 -5.420 389 HE1 PHE 49 HE1 PHE 49 -9.006 0.991 -3.748 390 HE2 PHE 49 HE2 PHE 49 -6.414 4.333 -2.998 391 HZ PHE 49 HZ PHE 49 -7.972 2.592 -2.162 392 H THR 50 HN THR 50 -6.914 5.851 -9.317 393 HA THR 50 HA THR 50 -6.628 4.452 -11.961 394 HB THR 50 HB THR 50 -7.465 7.332 -11.499 395 HG1 THR 50 HG1 THR 50 -8.924 5.306 -11.197 396 1HG2 THR 50 HG23 THR 50 -7.183 5.661 -14.013 397 2HG2 THR 50 HG22 THR 50 -7.877 7.281 -13.952 398 3HG2 THR 50 HG21 THR 50 -6.176 7.036 -13.560 399 H LYS 51 HN LYS 51 -4.678 4.706 -12.944 400 HA LYS 51 HA LYS 51 -2.517 6.046 -11.495 401 1HB LYS 51 HB2 LYS 51 -2.239 3.882 -12.769 402 2HB LYS 51 HB1 LYS 51 -2.460 4.795 -14.260 403 1HG LYS 51 HG2 LYS 51 -0.523 6.214 -13.674 404 2HG LYS 51 HG1 LYS 51 -0.292 5.278 -12.196 405 1HD LYS 51 HD2 LYS 51 -0.010 3.222 -13.587 406 2HD LYS 51 HD1 LYS 51 -0.121 4.223 -15.034 407 1HE LYS 51 HE2 LYS 51 1.879 5.425 -14.458 408 2HE LYS 51 HE1 LYS 51 1.921 4.696 -12.851 409 1HZ LYS 51 HZ3 LYS 51 2.031 2.498 -14.114 410 2HZ LYS 51 HZ2 LYS 51 2.464 3.435 -15.463 411 3HZ LYS 51 HZ1 LYS 51 3.432 3.452 -14.067 412 H VAL 52 HN VAL 52 -1.562 8.027 -12.061 413 HA VAL 52 HA VAL 52 -2.764 9.467 -14.425 414 HB VAL 52 HB VAL 52 -2.229 11.570 -13.148 415 1HG1 VAL 52 HG13 VAL 52 -4.129 9.599 -11.850 416 2HG1 VAL 52 HG12 VAL 52 -4.157 11.345 -11.603 417 3HG1 VAL 52 HG11 VAL 52 -4.505 10.674 -13.196 418 1HG2 VAL 52 HG22 VAL 52 -1.743 9.567 -10.922 419 2HG2 VAL 52 HG21 VAL 52 -0.562 10.688 -11.600 420 3HG2 VAL 52 HG23 VAL 52 -1.933 11.303 -10.679 421 H SER 53 HN SER 53 -1.334 10.168 -15.932 422 HA SER 53 HA SER 53 1.537 9.611 -15.482 423 1HB SER 53 HB2 SER 53 0.766 8.852 -17.590 424 2HB SER 53 HB1 SER 53 -0.117 10.345 -17.897 425 HG SER 53 HG SER 53 2.551 9.739 -18.236 426 H GLU 54 HN GLU 54 -0.507 12.244 -15.036 427 HA GLU 54 HA GLU 54 1.824 14.087 -14.982 428 1HB GLU 54 HB2 GLU 54 -0.714 14.575 -16.567 429 2HB GLU 54 HB1 GLU 54 0.422 15.853 -16.137 430 1HG GLU 54 HG2 GLU 54 2.228 14.638 -17.316 431 2HG GLU 54 HG1 GLU 54 1.080 13.376 -17.759 432 H GLY 55 HN GLY 55 1.405 15.981 -13.644 433 1HA GLY 55 HA2 GLY 55 0.264 17.205 -11.966 434 2HA GLY 55 HA1 GLY 55 -1.143 16.172 -12.213 435 H GLN 56 HN GLN 56 -0.304 16.831 -9.626 436 HA GLN 56 HA GLN 56 1.302 14.599 -8.574 437 1HB GLN 56 HB2 GLN 56 -0.244 16.779 -7.128 438 2HB GLN 56 HB1 GLN 56 0.881 15.649 -6.376 439 1HG GLN 56 HG2 GLN 56 2.159 17.618 -6.748 440 2HG GLN 56 HG1 GLN 56 2.625 16.524 -8.050 441 1HE2 GLN 56 HE22 GLN 56 1.886 19.134 -10.308 442 2HE2 GLN 56 HE21 GLN 56 3.059 18.070 -9.696 443 H ALA 57 HN ALA 57 0.454 12.845 -7.397 444 HA ALA 57 HA ALA 57 -2.509 12.458 -7.627 445 1HB ALA 57 HB2 ALA 57 -0.844 10.792 -8.655 446 2HB ALA 57 HB1 ALA 57 -0.451 10.332 -6.998 447 3HB ALA 57 HB3 ALA 57 -2.092 10.116 -7.609 448 H ASP 58 HN ASP 58 -3.605 11.464 -5.781 449 HA ASP 58 HA ASP 58 -3.009 12.710 -3.296 450 1HB ASP 58 HB2 ASP 58 -4.723 10.299 -3.955 451 2HB ASP 58 HB1 ASP 58 -4.649 11.023 -2.348 452 H ILE 59 HN ILE 59 -2.243 9.447 -4.500 453 HA ILE 59 HA ILE 59 -0.528 9.020 -2.064 454 HB ILE 59 HB ILE 59 -1.765 6.982 -3.942 455 1HG1 ILE 59 HG12 ILE 59 -2.408 7.567 -1.038 456 2HG1 ILE 59 HG11 ILE 59 -3.337 8.224 -2.386 457 1HG2 ILE 59 HG23 ILE 59 -0.071 6.744 -1.440 458 2HG2 ILE 59 HG22 ILE 59 -0.985 5.399 -2.124 459 3HG2 ILE 59 HG21 ILE 59 0.317 6.144 -3.053 460 1HD1 ILE 59 HD12 ILE 59 -3.768 5.908 -3.187 461 2HD1 ILE 59 HD11 ILE 59 -2.903 5.284 -1.783 462 3HD1 ILE 59 HD13 ILE 59 -4.407 6.178 -1.565 463 H MET 60 HN MET 60 1.582 9.347 -2.538 464 HA MET 60 HA MET 60 2.559 8.799 -5.317 465 1HB MET 60 HB2 MET 60 3.795 10.431 -3.084 466 2HB MET 60 HB1 MET 60 4.491 10.205 -4.684 467 1HG MET 60 HG2 MET 60 2.258 11.135 -5.588 468 2HG MET 60 HG1 MET 60 1.962 11.673 -3.934 469 1HE MET 60 HE2 MET 60 3.478 12.323 -7.253 470 2HE MET 60 HE1 MET 60 4.972 13.218 -6.990 471 3HE MET 60 HE3 MET 60 4.881 11.501 -6.578 472 H ILE 61 HN ILE 61 4.030 7.207 -5.663 473 HA ILE 61 HA ILE 61 5.149 5.762 -3.280 474 HB ILE 61 HB ILE 61 4.607 4.759 -6.093 475 1HG1 ILE 61 HG12 ILE 61 3.410 3.887 -3.446 476 2HG1 ILE 61 HG11 ILE 61 2.636 5.052 -4.518 477 1HG2 ILE 61 HG23 ILE 61 5.946 3.515 -3.682 478 2HG2 ILE 61 HG22 ILE 61 5.267 2.540 -4.985 479 3HG2 ILE 61 HG21 ILE 61 6.584 3.665 -5.318 480 1HD1 ILE 61 HD13 ILE 61 3.497 2.342 -5.530 481 2HD1 ILE 61 HD12 ILE 61 1.939 2.568 -4.736 482 3HD1 ILE 61 HD11 ILE 61 2.307 3.448 -6.220 483 H SER 62 HN SER 62 7.359 5.774 -3.086 484 HA SER 62 HA SER 62 9.024 6.291 -5.490 485 1HB SER 62 HB2 SER 62 10.164 8.177 -4.501 486 2HB SER 62 HB1 SER 62 8.435 8.515 -4.461 487 HG SER 62 HG SER 62 8.570 7.510 -2.276 488 H PHE 63 HN PHE 63 11.319 5.898 -5.060 489 HA PHE 63 HA PHE 63 11.750 3.989 -2.780 490 1HB PHE 63 HB2 PHE 63 12.971 4.088 -5.558 491 2HB PHE 63 HB1 PHE 63 13.496 2.992 -4.283 492 HD1 PHE 63 HD2 PHE 63 12.024 1.201 -3.461 493 HD2 PHE 63 HD1 PHE 63 10.834 3.780 -6.683 494 HE1 PHE 63 HE2 PHE 63 10.191 -0.367 -4.038 495 HE2 PHE 63 HE1 PHE 63 8.998 2.211 -7.260 496 HZ PHE 63 HZ PHE 63 8.678 0.138 -5.939 497 H VAL 64 HN VAL 64 13.538 4.380 -1.447 498 HA VAL 64 HA VAL 64 15.440 6.549 -2.254 499 HB VAL 64 HB VAL 64 15.322 7.425 0.094 500 1HG1 VAL 64 HG11 VAL 64 14.141 8.515 -1.778 501 2HG1 VAL 64 HG13 VAL 64 12.742 7.478 -1.499 502 3HG1 VAL 64 HG12 VAL 64 13.222 8.659 -0.280 503 1HG2 VAL 64 HG23 VAL 64 14.264 5.295 1.001 504 2HG2 VAL 64 HG22 VAL 64 13.493 6.793 1.521 505 3HG2 VAL 64 HG21 VAL 64 12.756 5.818 0.250 506 H ARG 65 HN ARG 65 17.318 6.632 -0.598 507 HA ARG 65 HA ARG 65 18.037 3.852 0.294 508 1HB ARG 65 HB2 ARG 65 19.727 5.902 -1.165 509 2HB ARG 65 HB1 ARG 65 20.396 4.472 -0.379 510 1HG ARG 65 HG2 ARG 65 19.154 3.002 -1.819 511 2HG ARG 65 HG1 ARG 65 18.218 4.346 -2.477 512 1HD ARG 65 HD2 ARG 65 19.972 3.717 -4.059 513 2HD ARG 65 HD1 ARG 65 20.316 5.314 -3.399 514 HE ARG 65 HE ARG 65 21.686 3.586 -1.717 515 1HH1 ARG 65 HH21 ARG 65 21.484 4.158 -5.108 516 2HH1 ARG 65 HH22 ARG 65 23.122 3.689 -5.421 517 1HH2 ARG 65 HH11 ARG 65 23.828 2.972 -2.102 518 2HH2 ARG 65 HH12 ARG 65 24.450 3.020 -3.717 519 H GLY 66 HN GLY 66 18.951 3.730 2.315 520 1HA GLY 66 HA2 GLY 66 19.523 4.426 4.477 521 2HA GLY 66 HA1 GLY 66 20.544 5.588 3.640 522 H ASP 67 HN ASP 67 20.219 7.357 4.931 523 HA ASP 67 HA ASP 67 17.677 8.145 6.008 524 1HB ASP 67 HB2 ASP 67 19.875 8.863 6.937 525 2HB ASP 67 HB1 ASP 67 20.119 9.867 5.507 526 H HIS 68 HN HIS 68 16.094 9.387 5.161 527 HA HIS 68 HA HIS 68 16.585 10.790 2.558 528 1HB HIS 68 HB2 HIS 68 14.160 10.168 2.028 529 2HB HIS 68 HB1 HIS 68 15.338 8.862 1.939 530 HD1 HIS 68 HD1 HIS 68 15.597 7.579 4.451 531 HD2 HIS 68 HD2 HIS 68 11.968 9.403 3.509 532 HE1 HIS 68 HE1 HIS 68 13.855 6.533 5.964 533 H ARG 69 HN ARG 69 16.745 11.979 5.121 534 HA ARG 69 HA ARG 69 15.921 13.795 6.338 535 1HB ARG 69 HB2 ARG 69 14.552 14.247 3.674 536 2HB ARG 69 HB1 ARG 69 14.484 15.399 5.007 537 1HG ARG 69 HG2 ARG 69 16.943 15.523 5.032 538 2HG ARG 69 HG1 ARG 69 17.021 14.376 3.696 539 1HD ARG 69 HD2 ARG 69 15.561 16.001 2.391 540 2HD ARG 69 HD1 ARG 69 15.852 17.173 3.670 541 HE ARG 69 HE ARG 69 17.630 16.514 1.506 542 1HH1 ARG 69 HH21 ARG 69 17.672 17.130 4.907 543 2HH1 ARG 69 HH22 ARG 69 19.378 17.418 4.952 544 1HH2 ARG 69 HH11 ARG 69 19.836 16.897 1.563 545 2HH2 ARG 69 HH12 ARG 69 20.597 17.292 3.068 546 H ASP 70 HN ASP 70 14.735 11.640 7.238 547 HA ASP 70 HA ASP 70 11.917 12.499 7.678 548 1HB ASP 70 HB2 ASP 70 11.055 10.262 7.375 549 2HB ASP 70 HB1 ASP 70 11.967 10.673 5.923 550 H ASN 71 HN ASN 71 11.047 10.928 9.565 551 HA ASN 71 HA ASN 71 13.094 11.138 11.706 552 1HB ASN 71 HB2 ASN 71 10.109 10.609 11.743 553 2HB ASN 71 HB1 ASN 71 11.118 10.598 13.190 554 1HD2 ASN 71 HD22 ASN 71 9.694 14.061 12.580 555 2HD2 ASN 71 HD21 ASN 71 8.970 12.528 12.665 556 H SER 72 HN SER 72 12.488 8.883 9.485 557 HA SER 72 HA SER 72 13.100 6.627 11.360 558 1HB SER 72 HB2 SER 72 11.126 6.586 9.065 559 2HB SER 72 HB1 SER 72 11.656 5.163 9.958 560 HG SER 72 HG SER 72 10.787 6.087 11.829 561 HA PRO 73 HA PRO 73 15.968 6.910 7.677 562 1HB PRO 73 HB2 PRO 73 18.268 6.755 9.358 563 2HB PRO 73 HB1 PRO 73 17.662 8.200 8.537 564 1HG PRO 73 HG2 PRO 73 17.556 7.562 11.392 565 2HG PRO 73 HG1 PRO 73 17.156 9.087 10.589 566 1HD PRO 73 HD2 PRO 73 15.316 7.163 11.691 567 2HD PRO 73 HD1 PRO 73 14.916 8.650 10.810 568 H PHE 74 HN PHE 74 16.898 5.001 6.795 569 HA PHE 74 HA PHE 74 16.341 2.526 8.232 570 1HB PHE 74 HB2 PHE 74 17.776 3.062 5.612 571 2HB PHE 74 HB1 PHE 74 17.399 1.453 6.229 572 HD1 PHE 74 HD1 PHE 74 14.872 1.120 6.991 573 HD2 PHE 74 HD2 PHE 74 16.216 4.081 4.184 574 HE1 PHE 74 HE1 PHE 74 12.580 1.278 6.059 575 HE2 PHE 74 HE2 PHE 74 13.922 4.238 3.253 576 HZ PHE 74 HZ PHE 74 12.106 2.836 4.190 577 H ASP 75 HN ASP 75 17.851 1.148 9.202 578 HA ASP 75 HA ASP 75 20.638 2.229 9.511 579 1HB ASP 75 HB2 ASP 75 19.265 2.234 11.598 580 2HB ASP 75 HB1 ASP 75 19.061 0.490 11.434 581 H GLY 76 HN GLY 76 20.984 0.945 7.451 582 1HA GLY 76 HA2 GLY 76 22.186 -0.900 6.578 583 2HA GLY 76 HA1 GLY 76 22.066 -1.675 8.158 584 HA PRO 77 HA PRO 77 19.120 -3.648 5.076 585 1HB PRO 77 HB2 PRO 77 20.158 -6.247 5.735 586 2HB PRO 77 HB1 PRO 77 20.374 -5.365 4.217 587 1HG PRO 77 HG2 PRO 77 22.348 -5.839 6.313 588 2HG PRO 77 HG1 PRO 77 22.591 -5.087 4.729 589 1HD PRO 77 HD2 PRO 77 22.527 -3.770 7.292 590 2HD PRO 77 HD1 PRO 77 22.690 -3.009 5.696 591 H GLY 78 HN GLY 78 19.761 -3.434 8.309 592 1HA GLY 78 HA2 GLY 78 17.617 -5.333 9.164 593 2HA GLY 78 HA1 GLY 78 18.794 -4.568 10.233 594 H GLY 79 HN GLY 79 16.479 -4.165 11.286 595 1HA GLY 79 HA2 GLY 79 15.146 -2.359 12.046 596 2HA GLY 79 HA1 GLY 79 15.918 -1.333 10.835 597 H ASN 80 HN ASN 80 13.723 -0.527 10.378 598 HA ASN 80 HA ASN 80 11.700 -2.312 9.331 599 1HB ASN 80 HB2 ASN 80 12.053 0.692 9.138 600 2HB ASN 80 HB1 ASN 80 10.623 -0.172 8.573 601 1HD2 ASN 80 HD22 ASN 80 10.341 0.959 12.240 602 2HD2 ASN 80 HD21 ASN 80 10.935 1.792 10.885 603 H LEU 81 HN LEU 81 11.142 -2.677 7.140 604 HA LEU 81 HA LEU 81 13.365 -2.242 5.209 605 1HB LEU 81 HB2 LEU 81 10.824 -3.842 4.801 606 2HB LEU 81 HB1 LEU 81 12.307 -3.928 3.855 607 HG LEU 81 HG LEU 81 11.916 -4.802 6.728 608 1HD1 LEU 81 HD11 LEU 81 11.169 -6.321 4.864 609 2HD1 LEU 81 HD13 LEU 81 12.832 -6.336 4.279 610 3HD1 LEU 81 HD12 LEU 81 12.450 -7.001 5.867 611 1HD2 LEU 81 HD21 LEU 81 14.420 -4.388 5.084 612 2HD2 LEU 81 HD23 LEU 81 14.087 -3.852 6.731 613 3HD2 LEU 81 HD22 LEU 81 14.377 -5.559 6.402 614 H ALA 82 HN ALA 82 10.427 -0.792 6.073 615 HA ALA 82 HA ALA 82 10.535 1.080 3.890 616 1HB ALA 82 HB3 ALA 82 8.425 -1.096 3.755 617 2HB ALA 82 HB2 ALA 82 8.321 0.417 2.856 618 3HB ALA 82 HB1 ALA 82 9.637 -0.711 2.533 619 H HIS 83 HN HIS 83 8.431 2.497 3.948 620 HA HIS 83 HA HIS 83 6.778 2.294 6.321 621 1HB HIS 83 HB2 HIS 83 7.628 4.307 7.469 622 2HB HIS 83 HB1 HIS 83 8.872 3.060 7.377 623 HD1 HIS 83 HD1 HIS 83 10.620 3.349 5.321 624 HD2 HIS 83 HD2 HIS 83 8.375 6.720 6.307 625 HE1 HIS 83 HE1 HIS 83 11.803 5.328 4.274 626 H ALA 84 HN ALA 84 5.430 4.355 6.556 627 HA ALA 84 HA ALA 84 5.283 6.008 4.105 628 1HB ALA 84 HB3 ALA 84 3.884 3.976 3.656 629 2HB ALA 84 HB2 ALA 84 2.907 4.383 5.068 630 3HB ALA 84 HB1 ALA 84 2.947 5.470 3.680 631 H PHE 85 HN PHE 85 3.700 7.808 4.412 632 HA PHE 85 HA PHE 85 3.715 8.695 7.251 633 1HB PHE 85 HB2 PHE 85 3.120 10.147 4.652 634 2HB PHE 85 HB1 PHE 85 3.067 10.900 6.247 635 HD1 PHE 85 HD2 PHE 85 5.247 9.378 3.691 636 HD2 PHE 85 HD1 PHE 85 5.098 11.335 7.511 637 HE1 PHE 85 HE2 PHE 85 7.702 9.713 3.613 638 HE2 PHE 85 HE1 PHE 85 7.554 11.671 7.434 639 HZ PHE 85 HZ PHE 85 8.856 10.860 5.484 640 H GLN 86 HN GLN 86 1.681 9.772 8.062 641 HA GLN 86 HA GLN 86 -0.571 8.033 7.691 642 1HB GLN 86 HB2 GLN 86 -0.237 10.705 9.070 643 2HB GLN 86 HB1 GLN 86 -1.768 9.833 9.073 644 1HG GLN 86 HG2 GLN 86 -0.693 7.896 10.124 645 2HG GLN 86 HG1 GLN 86 0.869 8.713 10.067 646 1HE2 GLN 86 HE22 GLN 86 -0.483 9.330 13.464 647 2HE2 GLN 86 HE21 GLN 86 0.061 7.985 12.583 648 HA PRO 87 HA PRO 87 -2.520 9.850 4.143 649 1HB PRO 87 HB2 PRO 87 -5.206 9.887 5.241 650 2HB PRO 87 HB1 PRO 87 -4.519 8.735 4.088 651 1HG PRO 87 HG2 PRO 87 -5.082 8.318 6.916 652 2HG PRO 87 HG1 PRO 87 -4.506 7.136 5.730 653 1HD PRO 87 HD2 PRO 87 -2.987 8.284 7.865 654 2HD PRO 87 HD1 PRO 87 -2.376 7.256 6.553 655 H GLY 88 HN GLY 88 -2.032 12.000 3.911 656 1HA GLY 88 HA2 GLY 88 -3.823 14.013 4.917 657 2HA GLY 88 HA1 GLY 88 -2.296 14.056 5.799 658 HA PRO 89 HA PRO 89 -2.104 16.270 1.565 659 1HB PRO 89 HB2 PRO 89 -1.643 18.809 2.822 660 2HB PRO 89 HB1 PRO 89 -3.081 18.314 1.918 661 1HG PRO 89 HG2 PRO 89 -2.773 18.627 4.821 662 2HG PRO 89 HG1 PRO 89 -4.258 18.390 3.887 663 1HD PRO 89 HD2 PRO 89 -2.975 16.452 5.546 664 2HD PRO 89 HD1 PRO 89 -4.320 16.165 4.422 665 H GLY 90 HN GLY 90 -0.087 17.919 1.137 666 1HA GLY 90 HA2 GLY 90 2.244 18.183 1.196 667 2HA GLY 90 HA1 GLY 90 2.153 17.795 2.913 668 H ILE 91 HN ILE 91 3.678 16.237 3.220 669 HA ILE 91 HA ILE 91 4.226 14.194 1.206 670 HB ILE 91 HB ILE 91 5.984 15.160 2.708 671 1HG1 ILE 91 HG12 ILE 91 5.635 12.188 3.184 672 2HG1 ILE 91 HG11 ILE 91 6.142 12.858 1.634 673 1HG2 ILE 91 HG23 ILE 91 4.451 15.213 4.729 674 2HG2 ILE 91 HG22 ILE 91 4.694 13.471 4.865 675 3HG2 ILE 91 HG21 ILE 91 6.064 14.569 5.035 676 1HD1 ILE 91 HD13 ILE 91 8.029 14.009 2.816 677 2HD1 ILE 91 HD12 ILE 91 7.564 13.160 4.291 678 3HD1 ILE 91 HD11 ILE 91 8.125 12.250 2.889 679 H GLY 92 HN GLY 92 1.874 14.546 3.583 680 1HA GLY 92 HA2 GLY 92 1.639 11.992 4.749 681 2HA GLY 92 HA1 GLY 92 0.271 13.049 4.412 682 H GLY 93 HN GLY 93 0.715 10.048 4.085 683 1HA GLY 93 HA2 GLY 93 -0.405 8.535 2.641 684 2HA GLY 93 HA1 GLY 93 -0.650 9.848 1.492 685 H ASP 94 HN ASP 94 2.366 10.451 1.750 686 HA ASP 94 HA ASP 94 3.177 9.004 -0.573 687 1HB ASP 94 HB2 ASP 94 4.783 10.509 1.503 688 2HB ASP 94 HB1 ASP 94 5.502 9.808 0.051 689 H ALA 95 HN ALA 95 4.031 7.012 -0.827 690 HA ALA 95 HA ALA 95 4.667 5.419 1.622 691 1HB ALA 95 HB3 ALA 95 2.987 4.607 -0.146 692 2HB ALA 95 HB2 ALA 95 4.381 4.371 -1.202 693 3HB ALA 95 HB1 ALA 95 4.258 3.474 0.312 694 H HIS 96 HN HIS 96 6.802 5.097 2.085 695 HA HIS 96 HA HIS 96 8.810 5.480 -0.119 696 1HB HIS 96 HB2 HIS 96 8.995 5.877 2.877 697 2HB HIS 96 HB1 HIS 96 10.412 5.830 1.829 698 HD2 HIS 96 HD2 HIS 96 7.479 7.794 0.089 699 HE1 HIS 96 HE1 HIS 96 10.159 10.507 1.973 700 HE2 HIS 96 HE2 HIS 96 8.206 10.292 0.371 701 H PHE 97 HN PHE 97 10.049 3.763 -0.674 702 HA PHE 97 HA PHE 97 9.929 1.297 1.045 703 1HB PHE 97 HB2 PHE 97 10.126 1.644 -1.957 704 2HB PHE 97 HB1 PHE 97 10.429 0.107 -1.147 705 HD1 PHE 97 HD1 PHE 97 7.869 2.675 -1.904 706 HD2 PHE 97 HD2 PHE 97 8.644 -1.167 -0.149 707 HE1 PHE 97 HE1 PHE 97 5.428 2.229 -1.799 708 HE2 PHE 97 HE2 PHE 97 6.212 -1.611 -0.046 709 HZ PHE 97 HZ PHE 97 4.600 0.084 -0.868 710 H ASP 98 HN ASP 98 11.873 0.417 1.682 711 HA ASP 98 HA ASP 98 14.282 1.970 1.359 712 1HB ASP 98 HB2 ASP 98 13.766 0.455 3.322 713 2HB ASP 98 HB1 ASP 98 14.105 -0.918 2.264 714 H GLU 99 HN GLU 99 15.344 2.072 -0.546 715 HA GLU 99 HA GLU 99 15.153 -0.038 -2.552 716 1HB GLU 99 HB2 GLU 99 15.366 2.432 -3.049 717 2HB GLU 99 HB1 GLU 99 17.030 2.334 -2.496 718 1HG GLU 99 HG2 GLU 99 17.599 0.765 -4.234 719 2HG GLU 99 HG1 GLU 99 15.907 0.598 -4.707 720 H ASP 100 HN ASP 100 17.088 0.423 0.202 721 HA ASP 100 HA ASP 100 19.553 -0.720 -0.845 722 1HB ASP 100 HB2 ASP 100 18.536 -0.288 1.977 723 2HB ASP 100 HB1 ASP 100 20.129 -0.950 1.606 724 H GLU 101 HN GLU 101 16.550 -2.006 0.271 725 HA GLU 101 HA GLU 101 17.654 -4.644 0.953 726 1HB GLU 101 HB2 GLU 101 14.780 -3.765 0.508 727 2HB GLU 101 HB1 GLU 101 15.293 -5.297 1.215 728 1HG GLU 101 HG2 GLU 101 16.070 -2.616 2.383 729 2HG GLU 101 HG1 GLU 101 14.627 -3.496 2.887 730 H ARG 102 HN ARG 102 17.303 -6.550 -0.356 731 HA ARG 102 HA ARG 102 17.165 -5.950 -3.257 732 1HB ARG 102 HB2 ARG 102 18.931 -7.473 -2.287 733 2HB ARG 102 HB1 ARG 102 17.648 -8.613 -1.881 734 1HG ARG 102 HG2 ARG 102 17.001 -8.734 -4.260 735 2HG ARG 102 HG1 ARG 102 18.289 -7.600 -4.666 736 1HD ARG 102 HD2 ARG 102 18.833 -10.198 -3.219 737 2HD ARG 102 HD1 ARG 102 18.831 -10.086 -4.978 738 HE ARG 102 HE ARG 102 20.548 -8.062 -4.217 739 1HH1 ARG 102 HH21 ARG 102 20.198 -11.405 -3.470 740 2HH1 ARG 102 HH22 ARG 102 21.898 -11.684 -3.295 741 1HH2 ARG 102 HH11 ARG 102 22.779 -8.403 -3.977 742 2HH2 ARG 102 HH12 ARG 102 23.359 -9.987 -3.583 743 H TRP 103 HN TRP 103 15.128 -5.861 -4.070 744 HA TRP 103 HA TRP 103 12.949 -7.435 -2.853 745 1HB TRP 103 HB2 TRP 103 12.977 -5.477 -5.169 746 2HB TRP 103 HB1 TRP 103 11.528 -6.218 -4.495 747 HD1 TRP 103 HD1 TRP 103 13.574 -3.221 -4.192 748 HE1 TRP 103 HE1 TRP 103 13.078 -1.960 -1.999 749 HE3 TRP 103 HE3 TRP 103 10.949 -6.813 -1.681 750 HZ2 TRP 103 HZ2 TRP 103 11.749 -2.414 0.490 751 HZ3 TRP 103 HZ3 TRP 103 10.083 -6.371 0.599 752 HH2 TRP 103 HH2 TRP 103 10.479 -4.177 1.686 753 H THR 104 HN THR 104 11.810 -9.080 -3.911 754 HA THR 104 HA THR 104 12.787 -9.970 -6.594 755 HB THR 104 HB THR 104 12.778 -12.306 -5.836 756 HG1 THR 104 HG1 THR 104 12.460 -12.747 -3.656 757 1HG2 THR 104 HG21 THR 104 14.435 -10.438 -4.122 758 2HG2 THR 104 HG23 THR 104 14.724 -12.172 -4.267 759 3HG2 THR 104 HG22 THR 104 14.893 -11.129 -5.679 760 H ASN 105 HN ASN 105 11.183 -11.586 -7.546 761 HA ASN 105 HA ASN 105 8.391 -10.790 -6.779 762 1HB ASN 105 HB2 ASN 105 9.572 -11.698 -9.419 763 2HB ASN 105 HB1 ASN 105 7.844 -11.478 -9.139 764 1HD2 ASN 105 HD22 ASN 105 9.534 -8.285 -10.421 765 2HD2 ASN 105 HD21 ASN 105 9.687 -9.894 -10.940 766 H ASN 106 HN ASN 106 10.135 -13.081 -5.710 767 HA ASN 106 HA ASN 106 8.040 -15.157 -6.026 768 1HB ASN 106 HB2 ASN 106 9.763 -16.917 -6.437 769 2HB ASN 106 HB1 ASN 106 9.626 -15.759 -7.758 770 1HD2 ASN 106 HD22 ASN 106 12.722 -14.273 -5.839 771 2HD2 ASN 106 HD21 ASN 106 11.097 -13.925 -5.502 772 H PHE 107 HN PHE 107 9.361 -17.208 -4.647 773 HA PHE 107 HA PHE 107 9.002 -16.319 -1.934 774 1HB PHE 107 HB2 PHE 107 9.693 -18.620 -1.338 775 2HB PHE 107 HB1 PHE 107 8.489 -18.610 -2.626 776 HD1 PHE 107 HD1 PHE 107 9.100 -19.140 -4.936 777 HD2 PHE 107 HD2 PHE 107 12.016 -19.240 -1.783 778 HE1 PHE 107 HE1 PHE 107 10.649 -20.390 -6.412 779 HE2 PHE 107 HE2 PHE 107 13.566 -20.494 -3.261 780 HZ PHE 107 HZ PHE 107 12.882 -21.068 -5.576 781 H ARG 108 HN ARG 108 11.693 -15.976 -3.946 782 HA ARG 108 HA ARG 108 13.841 -16.542 -2.161 783 1HB ARG 108 HB2 ARG 108 13.632 -14.448 -4.338 784 2HB ARG 108 HB1 ARG 108 15.134 -14.918 -3.541 785 1HG ARG 108 HG2 ARG 108 14.799 -17.243 -4.270 786 2HG ARG 108 HG1 ARG 108 13.307 -16.781 -5.080 787 1HD ARG 108 HD2 ARG 108 14.653 -15.126 -6.421 788 2HD ARG 108 HD1 ARG 108 16.113 -15.835 -5.743 789 HE ARG 108 HE ARG 108 14.561 -16.855 -7.942 790 1HH1 ARG 108 HH21 ARG 108 16.188 -17.939 -5.092 791 2HH1 ARG 108 HH22 ARG 108 16.235 -19.592 -5.605 792 1HH2 ARG 108 HH11 ARG 108 14.630 -18.997 -8.610 793 2HH2 ARG 108 HH12 ARG 108 15.366 -20.187 -7.589 794 H GLU 109 HN GLU 109 15.303 -14.346 -1.703 795 HA GLU 109 HA GLU 109 15.248 -13.211 0.549 796 1HB GLU 109 HB2 GLU 109 14.785 -11.374 -1.810 797 2HB GLU 109 HB1 GLU 109 15.435 -10.876 -0.248 798 1HG GLU 109 HG2 GLU 109 16.685 -13.031 -1.971 799 2HG GLU 109 HG1 GLU 109 17.195 -11.343 -1.990 800 H TYR 110 HN TYR 110 13.192 -10.917 -1.080 801 HA TYR 110 HA TYR 110 10.955 -11.492 0.837 802 1HB TYR 110 HB2 TYR 110 12.195 -8.787 0.241 803 2HB TYR 110 HB1 TYR 110 10.714 -9.031 1.166 804 HD1 TYR 110 HD2 TYR 110 10.772 -10.113 3.383 805 HD2 TYR 110 HD1 TYR 110 14.364 -9.331 1.161 806 HE1 TYR 110 HE2 TYR 110 12.118 -10.481 5.432 807 HE2 TYR 110 HE1 TYR 110 15.712 -9.697 3.209 808 HH TYR 110 HH TYR 110 15.541 -10.806 5.346 809 H ASN 111 HN ASN 111 8.876 -10.814 0.078 810 HA ASN 111 HA ASN 111 8.744 -10.449 -2.881 811 1HB ASN 111 HB2 ASN 111 6.222 -10.883 -2.364 812 2HB ASN 111 HB1 ASN 111 7.346 -12.238 -2.260 813 1HD2 ASN 111 HD22 ASN 111 5.639 -12.597 0.910 814 2HD2 ASN 111 HD21 ASN 111 5.517 -13.050 -0.721 815 H LEU 112 HN LEU 112 8.613 -8.375 -3.518 816 HA LEU 112 HA LEU 112 8.099 -6.160 -1.830 817 1HB LEU 112 HB2 LEU 112 9.258 -5.967 -3.992 818 2HB LEU 112 HB1 LEU 112 7.768 -6.376 -4.837 819 HG LEU 112 HG LEU 112 6.686 -4.351 -3.946 820 1HD1 LEU 112 HD11 LEU 112 9.256 -4.165 -2.399 821 2HD1 LEU 112 HD13 LEU 112 8.466 -2.666 -2.892 822 3HD1 LEU 112 HD12 LEU 112 7.607 -3.823 -1.880 823 1HD2 LEU 112 HD23 LEU 112 9.378 -3.925 -5.273 824 2HD2 LEU 112 HD22 LEU 112 7.821 -4.138 -6.073 825 3HD2 LEU 112 HD21 LEU 112 8.140 -2.677 -5.139 826 H HIS 113 HN HIS 113 5.874 -7.980 -3.938 827 HA HIS 113 HA HIS 113 3.669 -6.225 -3.700 828 1HB HIS 113 HB2 HIS 113 3.736 -8.147 -5.262 829 2HB HIS 113 HB1 HIS 113 3.585 -9.249 -3.892 830 HD1 HIS 113 HD1 HIS 113 1.349 -8.819 -2.360 831 HD2 HIS 113 HD2 HIS 113 1.300 -7.234 -6.216 832 HE1 HIS 113 HE1 HIS 113 -1.072 -8.284 -2.890 833 H ARG 114 HN ARG 114 4.605 -8.957 -1.550 834 HA ARG 114 HA ARG 114 2.338 -8.748 0.161 835 1HB ARG 114 HB2 ARG 114 3.971 -10.632 0.220 836 2HB ARG 114 HB1 ARG 114 5.154 -9.548 0.953 837 1HG ARG 114 HG2 ARG 114 3.630 -9.153 2.843 838 2HG ARG 114 HG1 ARG 114 2.434 -10.221 2.118 839 1HD ARG 114 HD2 ARG 114 4.148 -12.054 2.175 840 2HD ARG 114 HD1 ARG 114 5.209 -10.984 3.082 841 HE ARG 114 HE ARG 114 3.033 -12.543 4.132 842 1HH1 ARG 114 HH21 ARG 114 4.444 -9.399 4.399 843 2HH1 ARG 114 HH22 ARG 114 3.623 -9.028 5.877 844 1HH2 ARG 114 HH11 ARG 114 1.977 -12.068 6.045 845 2HH2 ARG 114 HH12 ARG 114 2.240 -10.538 6.813 846 H VAL 115 HN VAL 115 5.524 -7.144 0.359 847 HA VAL 115 HA VAL 115 4.867 -5.684 2.766 848 HB VAL 115 HB VAL 115 6.961 -5.213 0.623 849 1HG1 VAL 115 HG13 VAL 115 6.499 -3.856 3.290 850 2HG1 VAL 115 HG12 VAL 115 8.036 -3.789 2.428 851 3HG1 VAL 115 HG11 VAL 115 6.587 -3.097 1.702 852 1HG2 VAL 115 HG23 VAL 115 6.961 -6.545 3.342 853 2HG2 VAL 115 HG22 VAL 115 7.405 -7.253 1.789 854 3HG2 VAL 115 HG21 VAL 115 8.447 -6.042 2.536 855 H ALA 116 HN ALA 116 4.689 -4.914 -0.706 856 HA ALA 116 HA ALA 116 3.992 -2.172 -0.467 857 1HB ALA 116 HB2 ALA 116 3.051 -4.200 -2.521 858 2HB ALA 116 HB1 ALA 116 2.926 -2.449 -2.692 859 3HB ALA 116 HB3 ALA 116 4.512 -3.220 -2.635 860 H ALA 117 HN ALA 117 1.909 -5.063 -0.564 861 HA ALA 117 HA ALA 117 -0.578 -3.713 -0.279 862 1HB ALA 117 HB2 ALA 117 -0.318 -6.140 -0.835 863 2HB ALA 117 HB1 ALA 117 0.183 -6.435 0.830 864 3HB ALA 117 HB3 ALA 117 -1.451 -5.864 0.488 865 H HIS 118 HN HIS 118 1.754 -4.876 2.135 866 HA HIS 118 HA HIS 118 0.216 -4.302 4.460 867 1HB HIS 118 HB2 HIS 118 2.321 -5.605 4.508 868 2HB HIS 118 HB1 HIS 118 3.227 -4.154 4.082 869 HD1 HIS 118 HD1 HIS 118 1.514 -5.848 6.921 870 HD2 HIS 118 HD2 HIS 118 3.365 -2.186 6.188 871 HE1 HIS 118 HE1 HIS 118 1.889 -4.770 9.181 872 H GLU 119 HN GLU 119 2.611 -2.289 2.717 873 HA GLU 119 HA GLU 119 2.304 0.028 4.367 874 1HB GLU 119 HB2 GLU 119 3.124 -0.238 1.457 875 2HB GLU 119 HB1 GLU 119 3.254 1.253 2.389 876 1HG GLU 119 HG2 GLU 119 4.555 -1.360 3.200 877 2HG GLU 119 HG1 GLU 119 5.384 -0.081 2.313 878 H LEU 120 HN LEU 120 0.632 -1.052 1.427 879 HA LEU 120 HA LEU 120 -0.958 1.305 1.075 880 1HB LEU 120 HB2 LEU 120 -1.396 -1.582 0.271 881 2HB LEU 120 HB1 LEU 120 -2.478 -0.278 -0.211 882 HG LEU 120 HG LEU 120 0.507 -0.226 -0.739 883 1HD1 LEU 120 HD13 LEU 120 -1.752 -1.407 -2.353 884 2HD1 LEU 120 HD12 LEU 120 -0.319 -0.764 -3.156 885 3HD1 LEU 120 HD11 LEU 120 -0.163 -2.088 -2.003 886 1HD2 LEU 120 HD21 LEU 120 -1.853 1.480 -1.527 887 2HD2 LEU 120 HD23 LEU 120 -0.236 1.969 -1.023 888 3HD2 LEU 120 HD22 LEU 120 -0.499 1.339 -2.644 889 H GLY 121 HN GLY 121 -1.448 -1.683 2.928 890 1HA GLY 121 HA2 GLY 121 -4.128 -1.270 3.710 891 2HA GLY 121 HA1 GLY 121 -2.931 -2.106 4.703 892 H HIS 122 HN HIS 122 -1.117 0.021 5.125 893 HA HIS 122 HA HIS 122 -2.441 1.419 7.274 894 1HB HIS 122 HB2 HIS 122 0.249 1.814 5.940 895 2HB HIS 122 HB1 HIS 122 -0.288 2.766 7.325 896 HD1 HIS 122 HD1 HIS 122 -1.406 0.959 9.276 897 HD2 HIS 122 HD2 HIS 122 1.749 -0.309 6.865 898 HE1 HIS 122 HE1 HIS 122 -0.326 -0.987 10.479 899 H SER 123 HN SER 123 -1.476 2.342 3.979 900 HA SER 123 HA SER 123 -2.162 5.105 4.174 901 1HB SER 123 HB2 SER 123 -2.104 5.130 1.783 902 2HB SER 123 HB1 SER 123 -0.908 3.936 2.275 903 HG SER 123 HG SER 123 -2.317 3.187 0.607 904 H LEU 124 HN LEU 124 -4.119 2.237 3.952 905 HA LEU 124 HA LEU 124 -6.533 3.720 3.129 906 1HB LEU 124 HB2 LEU 124 -6.130 0.846 3.998 907 2HB LEU 124 HB1 LEU 124 -7.661 1.513 3.436 908 HG LEU 124 HG LEU 124 -5.103 1.555 1.808 909 1HD1 LEU 124 HD11 LEU 124 -5.990 -0.762 2.302 910 2HD1 LEU 124 HD13 LEU 124 -7.478 -0.297 1.476 911 3HD1 LEU 124 HD12 LEU 124 -5.954 -0.343 0.589 912 1HD2 LEU 124 HD21 LEU 124 -7.958 2.401 1.320 913 2HD2 LEU 124 HD23 LEU 124 -6.461 3.224 0.882 914 3HD2 LEU 124 HD22 LEU 124 -6.992 1.819 -0.034 915 H GLY 125 HN GLY 125 -4.841 3.312 5.978 916 1HA GLY 125 HA2 GLY 125 -5.512 4.292 8.063 917 2HA GLY 125 HA1 GLY 125 -7.196 4.199 7.551 918 H LEU 126 HN LEU 126 -5.573 1.292 6.905 919 HA LEU 126 HA LEU 126 -7.088 -0.075 8.996 920 1HB LEU 126 HB2 LEU 126 -4.984 -1.145 7.084 921 2HB LEU 126 HB1 LEU 126 -6.052 -2.127 8.085 922 HG LEU 126 HG LEU 126 -6.984 -0.168 5.963 923 1HD1 LEU 126 HD13 LEU 126 -5.785 -2.193 5.083 924 2HD1 LEU 126 HD12 LEU 126 -6.982 -3.200 5.895 925 3HD1 LEU 126 HD11 LEU 126 -7.479 -2.110 4.600 926 1HD2 LEU 126 HD23 LEU 126 -8.385 -1.975 7.929 927 2HD2 LEU 126 HD22 LEU 126 -8.791 -0.331 7.437 928 3HD2 LEU 126 HD21 LEU 126 -9.130 -1.678 6.357 929 H SER 127 HN SER 127 -6.171 -1.196 10.796 930 HA SER 127 HA SER 127 -3.477 -0.167 11.624 931 1HB SER 127 HB2 SER 127 -5.822 -1.154 13.269 932 2HB SER 127 HB1 SER 127 -4.261 -0.686 13.936 933 HG SER 127 HG SER 127 -5.900 0.998 13.892 934 H HIS 128 HN HIS 128 -2.228 -1.696 13.033 935 HA HIS 128 HA HIS 128 -1.776 -4.178 11.701 936 1HB HIS 128 HB2 HIS 128 -0.966 -3.192 14.447 937 2HB HIS 128 HB1 HIS 128 -0.412 -4.723 13.767 938 HD1 HIS 128 HD1 HIS 128 0.990 -1.647 14.252 939 HD2 HIS 128 HD2 HIS 128 0.401 -3.836 10.753 940 HE1 HIS 128 HE1 HIS 128 2.640 -0.746 12.556 941 H SER 129 HN SER 129 -1.892 -6.340 12.911 942 HA SER 129 HA SER 129 -4.152 -6.562 14.806 943 1HB SER 129 HB2 SER 129 -5.218 -6.672 12.573 944 2HB SER 129 HB1 SER 129 -4.133 -7.984 12.123 945 HG SER 129 HG SER 129 -5.315 -9.311 13.242 946 H THR 130 HN THR 130 -4.270 -8.779 15.710 947 HA THR 130 HA THR 130 -1.554 -9.981 15.852 948 HB THR 130 HB THR 130 -2.349 -11.071 17.863 949 HG1 THR 130 HG1 THR 130 -4.877 -9.902 17.440 950 1HG2 THR 130 HG22 THR 130 -1.793 -8.576 17.866 951 2HG2 THR 130 HG21 THR 130 -3.534 -8.293 17.890 952 3HG2 THR 130 HG23 THR 130 -2.764 -9.158 19.220 953 H ASP 131 HN ASP 131 -3.984 -10.368 13.806 954 HA ASP 131 HA ASP 131 -4.367 -13.275 13.978 955 1HB ASP 131 HB2 ASP 131 -6.162 -11.811 13.110 956 2HB ASP 131 HB1 ASP 131 -5.107 -11.308 11.790 957 H ILE 132 HN ILE 132 -2.713 -14.584 13.359 958 HA ILE 132 HA ILE 132 -0.478 -13.755 11.811 959 HB ILE 132 HB ILE 132 -0.525 -15.784 13.268 960 1HG1 ILE 132 HG12 ILE 132 0.147 -16.515 10.407 961 2HG1 ILE 132 HG11 ILE 132 1.131 -15.399 11.352 962 1HG2 ILE 132 HG22 ILE 132 -2.831 -16.483 12.357 963 2HG2 ILE 132 HG21 ILE 132 -1.952 -17.151 10.982 964 3HG2 ILE 132 HG23 ILE 132 -1.649 -17.767 12.606 965 1HD1 ILE 132 HD12 ILE 132 1.346 -17.185 13.110 966 2HD1 ILE 132 HD11 ILE 132 0.520 -18.292 12.012 967 3HD1 ILE 132 HD13 ILE 132 2.086 -17.615 11.568 968 H GLY 133 HN GLY 133 -3.615 -15.036 10.867 969 1HA GLY 133 HA2 GLY 133 -2.840 -15.541 8.109 970 2HA GLY 133 HA1 GLY 133 -4.490 -15.516 8.729 971 H ALA 134 HN ALA 134 -3.011 -12.685 9.713 972 HA ALA 134 HA ALA 134 -4.312 -11.177 7.485 973 1HB ALA 134 HB3 ALA 134 -3.430 -10.372 10.265 974 2HB ALA 134 HB2 ALA 134 -3.930 -9.201 9.051 975 3HB ALA 134 HB1 ALA 134 -5.069 -10.421 9.620 976 H LEU 135 HN LEU 135 -3.132 -9.861 6.137 977 HA LEU 135 HA LEU 135 -0.278 -10.288 5.935 978 1HB LEU 135 HB2 LEU 135 -2.028 -8.172 4.629 979 2HB LEU 135 HB1 LEU 135 -0.394 -8.608 4.128 980 HG LEU 135 HG LEU 135 -2.781 -10.483 4.145 981 1HD1 LEU 135 HD11 LEU 135 -2.847 -8.705 2.395 982 2HD1 LEU 135 HD13 LEU 135 -1.274 -9.256 1.817 983 3HD1 LEU 135 HD12 LEU 135 -2.675 -10.323 1.716 984 1HD2 LEU 135 HD23 LEU 135 0.155 -10.845 3.557 985 2HD2 LEU 135 HD22 LEU 135 -0.947 -11.911 4.430 986 3HD2 LEU 135 HD21 LEU 135 -1.027 -11.814 2.674 987 H MET 136 HN MET 136 -2.310 -7.970 7.529 988 HA MET 136 HA MET 136 -0.289 -5.922 7.856 989 1HB MET 136 HB2 MET 136 -2.797 -6.441 9.483 990 2HB MET 136 HB1 MET 136 -1.866 -4.944 9.460 991 1HG MET 136 HG2 MET 136 -3.263 -6.172 7.063 992 2HG MET 136 HG1 MET 136 -3.855 -4.795 7.991 993 1HE MET 136 HE3 MET 136 -2.668 -2.862 8.505 994 2HE MET 136 HE2 MET 136 -0.915 -3.023 8.460 995 3HE MET 136 HE1 MET 136 -1.720 -1.926 7.341 996 H TYR 137 HN TYR 137 0.020 -8.915 8.856 997 HA TYR 137 HA TYR 137 0.330 -8.752 11.687 998 1HB TYR 137 HB2 TYR 137 0.278 -10.841 10.129 999 2HB TYR 137 HB1 TYR 137 2.011 -10.569 9.959 1000 HD1 TYR 137 HD2 TYR 137 -0.658 -10.880 12.571 1001 HD2 TYR 137 HD1 TYR 137 3.480 -11.456 11.574 1002 HE1 TYR 137 HE2 TYR 137 -0.288 -11.992 14.756 1003 HE2 TYR 137 HE1 TYR 137 3.849 -12.570 13.763 1004 HH TYR 137 HH TYR 137 2.436 -12.335 16.203 1005 HA PRO 138 HA PRO 138 3.999 -6.181 11.788 1006 1HB PRO 138 HB2 PRO 138 5.034 -7.280 14.241 1007 2HB PRO 138 HB1 PRO 138 4.112 -5.785 14.033 1008 1HG PRO 138 HG2 PRO 138 3.206 -8.324 15.160 1009 2HG PRO 138 HG1 PRO 138 2.354 -6.774 15.116 1010 1HD PRO 138 HD2 PRO 138 1.762 -9.091 13.542 1011 2HD PRO 138 HD1 PRO 138 1.042 -7.474 13.384 1012 H SER 139 HN SER 139 4.446 -9.660 12.597 1013 HA SER 139 HA SER 139 7.254 -9.540 11.732 1014 1HB SER 139 HB2 SER 139 5.614 -12.001 12.356 1015 2HB SER 139 HB1 SER 139 7.368 -11.866 12.330 1016 HG SER 139 HG SER 139 6.414 -11.736 14.452 1017 H TYR 140 HN TYR 140 8.066 -10.206 9.799 1018 HA TYR 140 HA TYR 140 6.223 -10.554 7.562 1019 1HB TYR 140 HB2 TYR 140 8.296 -9.295 7.247 1020 2HB TYR 140 HB1 TYR 140 9.250 -10.694 7.734 1021 HD1 TYR 140 HD1 TYR 140 9.402 -12.682 6.293 1022 HD2 TYR 140 HD2 TYR 140 7.278 -9.167 5.040 1023 HE1 TYR 140 HE1 TYR 140 9.426 -13.503 3.956 1024 HE2 TYR 140 HE2 TYR 140 7.294 -9.990 2.697 1025 HH TYR 140 HH TYR 140 8.432 -13.221 1.901 1026 H THR 141 HN THR 141 5.654 -12.479 6.604 1027 HA THR 141 HA THR 141 7.220 -14.931 7.164 1028 HB THR 141 HB THR 141 5.134 -16.157 7.841 1029 HG1 THR 141 HG1 THR 141 3.419 -14.754 8.577 1030 1HG2 THR 141 HG22 THR 141 6.823 -15.112 9.468 1031 2HG2 THR 141 HG21 THR 141 5.632 -13.831 9.701 1032 3HG2 THR 141 HG23 THR 141 5.230 -15.497 10.119 1033 H PHE 142 HN PHE 142 7.212 -16.242 5.375 1034 HA PHE 142 HA PHE 142 5.813 -15.312 2.992 1035 1HB PHE 142 HB2 PHE 142 8.056 -16.263 2.776 1036 2HB PHE 142 HB1 PHE 142 7.502 -17.787 3.473 1037 HD1 PHE 142 HD2 PHE 142 6.049 -19.299 2.222 1038 HD2 PHE 142 HD1 PHE 142 7.403 -15.599 0.509 1039 HE1 PHE 142 HE2 PHE 142 5.321 -20.070 -0.020 1040 HE2 PHE 142 HE1 PHE 142 6.671 -16.370 -1.732 1041 HZ PHE 142 HZ PHE 142 5.634 -18.606 -1.997 1042 H SER 143 HN SER 143 3.884 -16.015 2.260 1043 HA SER 143 HA SER 143 2.596 -18.361 3.618 1044 1HB SER 143 HB2 SER 143 1.373 -15.980 2.196 1045 2HB SER 143 HB1 SER 143 0.463 -17.314 2.900 1046 HG SER 143 HG SER 143 2.351 -16.053 4.514 1047 H GLY 144 HN GLY 144 1.513 -19.905 2.291 1048 1HA GLY 144 HA2 GLY 144 2.730 -20.494 -0.215 1049 2HA GLY 144 HA1 GLY 144 1.226 -21.214 0.364 1050 H ASP 145 HN ASP 145 -0.409 -18.977 0.551 1051 HA ASP 145 HA ASP 145 -0.504 -17.915 -2.261 1052 1HB ASP 145 HB2 ASP 145 -2.772 -18.896 -0.501 1053 2HB ASP 145 HB1 ASP 145 -3.007 -18.000 -2.002 1054 H VAL 146 HN VAL 146 -0.741 -15.713 -2.379 1055 HA VAL 146 HA VAL 146 -1.023 -14.223 0.190 1056 HB VAL 146 HB VAL 146 -0.188 -13.292 -2.576 1057 1HG1 VAL 146 HG12 VAL 146 -0.367 -11.924 0.113 1058 2HG1 VAL 146 HG11 VAL 146 0.650 -11.308 -1.189 1059 3HG1 VAL 146 HG13 VAL 146 -1.096 -11.421 -1.412 1060 1HG2 VAL 146 HG23 VAL 146 1.346 -14.095 -0.092 1061 2HG2 VAL 146 HG22 VAL 146 1.534 -14.712 -1.733 1062 3HG2 VAL 146 HG21 VAL 146 2.059 -13.075 -1.343 1063 H GLN 147 HN GLN 147 -3.152 -13.859 0.633 1064 HA GLN 147 HA GLN 147 -4.781 -12.454 -1.422 1065 1HB GLN 147 HB2 GLN 147 -5.606 -14.970 0.056 1066 2HB GLN 147 HB1 GLN 147 -6.754 -13.909 -0.761 1067 1HG GLN 147 HG2 GLN 147 -5.555 -14.242 -2.889 1068 2HG GLN 147 HG1 GLN 147 -4.393 -15.288 -2.074 1069 1HE2 GLN 147 HE22 GLN 147 -7.165 -17.358 -3.624 1070 2HE2 GLN 147 HE21 GLN 147 -6.142 -16.158 -4.254 1071 H LEU 148 HN LEU 148 -6.824 -11.548 -0.326 1072 HA LEU 148 HA LEU 148 -6.032 -10.168 2.105 1073 1HB LEU 148 HB2 LEU 148 -8.755 -10.337 0.772 1074 2HB LEU 148 HB1 LEU 148 -8.289 -9.180 2.019 1075 HG LEU 148 HG LEU 148 -7.036 -9.415 -0.736 1076 1HD1 LEU 148 HD13 LEU 148 -9.390 -8.450 -0.546 1077 2HD1 LEU 148 HD12 LEU 148 -8.680 -7.149 0.412 1078 3HD1 LEU 148 HD11 LEU 148 -8.183 -7.382 -1.264 1079 1HD2 LEU 148 HD23 LEU 148 -6.395 -7.759 1.701 1080 2HD2 LEU 148 HD22 LEU 148 -5.295 -8.576 0.591 1081 3HD2 LEU 148 HD21 LEU 148 -6.097 -7.090 0.097 1082 H ALA 149 HN ALA 149 -7.007 -10.395 4.182 1083 HA ALA 149 HA ALA 149 -8.057 -13.143 4.711 1084 1HB ALA 149 HB2 ALA 149 -6.015 -12.324 5.930 1085 2HB ALA 149 HB1 ALA 149 -7.020 -11.081 6.675 1086 3HB ALA 149 HB3 ALA 149 -7.343 -12.785 6.995 1087 H GLN 150 HN GLN 150 -9.805 -13.296 6.355 1088 HA GLN 150 HA GLN 150 -12.050 -11.684 5.695 1089 1HB GLN 150 HB2 GLN 150 -12.194 -13.949 6.723 1090 2HB GLN 150 HB1 GLN 150 -11.579 -13.281 8.235 1091 1HG GLN 150 HG2 GLN 150 -13.520 -11.746 8.338 1092 2HG GLN 150 HG1 GLN 150 -14.136 -12.438 6.837 1093 1HE2 GLN 150 HE22 GLN 150 -15.862 -14.300 9.511 1094 2HE2 GLN 150 HE21 GLN 150 -15.893 -12.735 8.857 1095 H ASP 151 HN ASP 151 -9.717 -11.477 8.372 1096 HA ASP 151 HA ASP 151 -11.005 -9.406 9.834 1097 1HB ASP 151 HB2 ASP 151 -9.067 -10.698 10.696 1098 2HB ASP 151 HB1 ASP 151 -8.025 -9.889 9.525 1099 H ASP 152 HN ASP 152 -8.745 -9.241 7.073 1100 HA ASP 152 HA ASP 152 -8.614 -6.336 7.131 1101 1HB ASP 152 HB2 ASP 152 -7.859 -8.390 5.036 1102 2HB ASP 152 HB1 ASP 152 -7.601 -6.658 4.826 1103 H ILE 153 HN ILE 153 -10.423 -8.719 5.181 1104 HA ILE 153 HA ILE 153 -11.680 -6.818 3.461 1105 HB ILE 153 HB ILE 153 -12.596 -9.547 4.421 1106 1HG1 ILE 153 HG12 ILE 153 -11.423 -8.694 1.760 1107 2HG1 ILE 153 HG11 ILE 153 -10.448 -9.329 3.085 1108 1HG2 ILE 153 HG22 ILE 153 -13.730 -7.649 2.356 1109 2HG2 ILE 153 HG21 ILE 153 -14.005 -9.388 2.261 1110 3HG2 ILE 153 HG23 ILE 153 -14.579 -8.481 3.659 1111 1HD1 ILE 153 HD13 ILE 153 -11.897 -11.372 3.105 1112 2HD1 ILE 153 HD12 ILE 153 -12.723 -10.752 1.675 1113 3HD1 ILE 153 HD11 ILE 153 -11.010 -11.165 1.595 1114 H ASP 154 HN ASP 154 -12.868 -8.320 6.484 1115 HA ASP 154 HA ASP 154 -15.314 -6.849 6.581 1116 1HB ASP 154 HB2 ASP 154 -13.646 -8.123 8.764 1117 2HB ASP 154 HB1 ASP 154 -15.234 -7.409 9.050 1118 H GLY 155 HN GLY 155 -12.095 -6.147 7.889 1119 1HA GLY 155 HA2 GLY 155 -12.838 -3.838 9.393 1120 2HA GLY 155 HA1 GLY 155 -11.211 -4.197 8.830 1121 H ILE 156 HN ILE 156 -11.425 -4.041 6.092 1122 HA ILE 156 HA ILE 156 -11.581 -1.189 5.715 1123 HB ILE 156 HB ILE 156 -10.043 -2.692 4.439 1124 1HG1 ILE 156 HG12 ILE 156 -10.412 -1.597 2.226 1125 2HG1 ILE 156 HG11 ILE 156 -11.976 -1.022 2.797 1126 1HG2 ILE 156 HG21 ILE 156 -11.867 -4.446 4.090 1127 2HG2 ILE 156 HG23 ILE 156 -12.478 -3.411 2.800 1128 3HG2 ILE 156 HG22 ILE 156 -10.854 -4.091 2.692 1129 1HD1 ILE 156 HD12 ILE 156 -9.527 -0.409 4.428 1130 2HD1 ILE 156 HD11 ILE 156 -9.830 0.518 2.961 1131 3HD1 ILE 156 HD13 ILE 156 -11.020 0.517 4.259 1132 H GLN 157 HN GLN 157 -13.763 -3.868 4.918 1133 HA GLN 157 HA GLN 157 -15.599 -2.257 3.383 1134 1HB GLN 157 HB2 GLN 157 -15.938 -4.874 4.867 1135 2HB GLN 157 HB1 GLN 157 -17.222 -4.142 3.901 1136 1HG GLN 157 HG2 GLN 157 -15.892 -4.280 1.896 1137 2HG GLN 157 HG1 GLN 157 -14.463 -4.763 2.812 1138 1HE2 GLN 157 HE22 GLN 157 -16.127 -7.834 1.387 1139 2HE2 GLN 157 HE21 GLN 157 -15.529 -6.403 0.698 1140 H ALA 158 HN ALA 158 -15.427 -3.141 6.826 1141 HA ALA 158 HA ALA 158 -17.930 -2.032 7.605 1142 1HB ALA 158 HB3 ALA 158 -15.343 -2.235 9.175 1143 2HB ALA 158 HB2 ALA 158 -16.928 -1.908 9.875 1144 3HB ALA 158 HB1 ALA 158 -16.610 -3.459 9.099 1145 H ILE 159 HN ILE 159 -14.714 -0.539 7.310 1146 HA ILE 159 HA ILE 159 -15.496 2.016 8.370 1147 HB ILE 159 HB ILE 159 -13.273 1.229 6.463 1148 1HG1 ILE 159 HG12 ILE 159 -13.155 1.947 9.405 1149 2HG1 ILE 159 HG11 ILE 159 -13.324 0.287 8.834 1150 1HG2 ILE 159 HG23 ILE 159 -13.910 3.838 7.857 1151 2HG2 ILE 159 HG22 ILE 159 -12.286 3.443 7.293 1152 3HG2 ILE 159 HG21 ILE 159 -13.614 3.570 6.139 1153 1HD1 ILE 159 HD12 ILE 159 -11.060 2.174 8.119 1154 2HD1 ILE 159 HD11 ILE 159 -10.958 0.836 9.262 1155 3HD1 ILE 159 HD13 ILE 159 -11.229 0.513 7.549 1156 H TYR 160 HN TYR 160 -15.193 0.833 5.010 1157 HA TYR 160 HA TYR 160 -16.609 3.270 4.049 1158 1HB TYR 160 HB2 TYR 160 -15.132 1.023 2.658 1159 2HB TYR 160 HB1 TYR 160 -16.106 2.199 1.772 1160 HD1 TYR 160 HD2 TYR 160 -15.491 4.580 1.737 1161 HD2 TYR 160 HD1 TYR 160 -13.045 1.664 3.731 1162 HE1 TYR 160 HE2 TYR 160 -13.628 6.213 1.841 1163 HE2 TYR 160 HE1 TYR 160 -11.184 3.299 3.837 1164 HH TYR 160 HH TYR 160 -11.280 6.199 3.755 1165 H GLY 161 HN GLY 161 -16.816 -0.198 3.200 1166 1HA GLY 161 HA2 GLY 161 -19.289 -0.955 4.014 1167 2HA GLY 161 HA1 GLY 161 -19.701 0.121 2.677 1168 H ARG 162 HN ARG 162 -20.606 -2.007 1.838 1169 HA ARG 162 HA ARG 162 -18.620 -3.935 0.827 1170 1HB ARG 162 HB2 ARG 162 -21.628 -3.723 0.587 1171 2HB ARG 162 HB1 ARG 162 -20.693 -4.987 -0.209 1172 1HG ARG 162 HG2 ARG 162 -19.811 -5.705 1.978 1173 2HG ARG 162 HG1 ARG 162 -20.750 -4.440 2.773 1174 1HD ARG 162 HD2 ARG 162 -22.835 -5.446 1.902 1175 2HD ARG 162 HD1 ARG 162 -21.891 -6.720 1.128 1176 HE ARG 162 HE ARG 162 -21.115 -6.861 3.773 1177 1HH1 ARG 162 HH21 ARG 162 -24.099 -6.834 2.045 1178 2HH1 ARG 162 HH22 ARG 162 -24.933 -7.815 3.203 1179 1HH2 ARG 162 HH11 ARG 162 -22.182 -8.147 5.293 1180 2HH2 ARG 162 HH12 ARG 162 -23.846 -8.559 5.046 1181 H SER 163 HN SER 163 -18.524 -4.435 -1.519 1182 HA SER 163 HA SER 163 -18.293 -1.999 -3.091 1183 1HB SER 163 HB2 SER 163 -18.091 -4.896 -3.967 1184 2HB SER 163 HB1 SER 163 -17.556 -3.497 -4.894 1185 HG SER 163 HG SER 163 -15.769 -4.155 -3.842 1186 H GLN 164 HN GLN 164 -20.828 -1.826 -2.461 1187 HA GLN 164 HA GLN 164 -22.654 -3.283 -4.177 1188 1HB GLN 164 HB2 GLN 164 -22.953 -0.739 -2.557 1189 2HB GLN 164 HB1 GLN 164 -24.280 -1.483 -3.448 1190 1HG GLN 164 HG2 GLN 164 -24.006 -3.558 -2.160 1191 2HG GLN 164 HG1 GLN 164 -22.646 -2.847 -1.295 1192 1HE2 GLN 164 HE22 GLN 164 -25.952 -2.388 0.584 1193 2HE2 GLN 164 HE21 GLN 164 -25.301 -3.754 -0.186 1194 H ASN 165 HN ASN 165 -23.379 -2.719 -6.216 1195 HA ASN 165 HA ASN 165 -22.804 -0.013 -7.271 1196 1HB ASN 165 HB2 ASN 165 -21.680 -2.550 -8.485 1197 2HB ASN 165 HB1 ASN 165 -21.692 -0.981 -9.291 1198 1HD2 ASN 165 HD22 ASN 165 -18.766 -1.782 -6.672 1199 2HD2 ASN 165 HD21 ASN 165 -19.821 -2.967 -7.277 1200 HA PRO 166 HA PRO 166 -26.751 -2.076 -8.699 1201 1HB PRO 166 HB2 PRO 166 -28.180 0.347 -8.029 1202 2HB PRO 166 HB1 PRO 166 -28.310 -1.234 -7.245 1203 1HG PRO 166 HG2 PRO 166 -27.085 1.150 -6.173 1204 2HG PRO 166 HG1 PRO 166 -27.181 -0.445 -5.413 1205 1HD PRO 166 HD2 PRO 166 -24.855 0.837 -6.614 1206 2HD PRO 166 HD1 PRO 166 -24.928 -0.709 -5.743 1207 H VAL 167 HN VAL 167 -27.603 -1.645 -10.782 1208 HA VAL 167 HA VAL 167 -26.243 0.504 -12.296 1209 HB VAL 167 HB VAL 167 -28.169 -1.615 -13.289 1210 1HG1 VAL 167 HG13 VAL 167 -26.157 0.185 -14.672 1211 2HG1 VAL 167 HG12 VAL 167 -27.036 -1.125 -15.461 1212 3HG1 VAL 167 HG11 VAL 167 -27.913 0.264 -14.820 1213 1HG2 VAL 167 HG23 VAL 167 -25.179 -1.616 -12.842 1214 2HG2 VAL 167 HG22 VAL 167 -26.362 -2.842 -12.387 1215 3HG2 VAL 167 HG21 VAL 167 -25.909 -2.641 -14.078 1216 H GLN 168 HN GLN 168 -27.192 2.437 -12.593 1217 HA GLN 168 HA GLN 168 -30.003 2.839 -11.897 1218 1HB GLN 168 HB2 GLN 168 -28.080 4.842 -13.112 1219 2HB GLN 168 HB1 GLN 168 -29.527 5.194 -12.171 1220 1HG GLN 168 HG2 GLN 168 -27.046 3.793 -11.140 1221 2HG GLN 168 HG1 GLN 168 -27.521 5.451 -10.776 1222 1HE2 GLN 168 HE22 GLN 168 -29.897 4.509 -8.324 1223 2HE2 GLN 168 HE21 GLN 168 -29.210 5.783 -9.210 1224 HA PRO 169 HA PRO 169 -31.682 2.324 -15.978 1225 1HB PRO 169 HB2 PRO 169 -33.276 4.767 -15.928 1226 2HB PRO 169 HB1 PRO 169 -33.828 3.095 -15.761 1227 1HG PRO 169 HG2 PRO 169 -33.604 5.089 -13.678 1228 2HG PRO 169 HG1 PRO 169 -34.151 3.414 -13.515 1229 1HD PRO 169 HD2 PRO 169 -31.672 4.528 -12.576 1230 2HD PRO 169 HD1 PRO 169 -32.186 2.832 -12.503 No H/Q in entry = 1230 Start of MODEL 29 1 1H VAL 1 HT1 VAL 1 -5.231 21.348 10.709 2 2H VAL 1 HT3 VAL 1 -4.080 22.498 11.186 3 3H VAL 1 HT2 VAL 1 -3.574 21.001 10.560 4 HA VAL 1 HA VAL 1 -3.292 20.954 12.922 5 HB VAL 1 HB VAL 1 -5.387 21.193 14.339 6 1HG1 VAL 1 HG13 VAL 1 -4.440 23.586 12.734 7 2HG1 VAL 1 HG12 VAL 1 -5.358 23.686 14.237 8 3HG1 VAL 1 HG11 VAL 1 -3.737 22.992 14.237 9 1HG2 VAL 1 HG22 VAL 1 -6.921 20.905 12.331 10 2HG2 VAL 1 HG21 VAL 1 -7.319 22.264 13.383 11 3HG2 VAL 1 HG23 VAL 1 -6.480 22.546 11.858 12 H LEU 2 HN LEU 2 -3.928 19.045 14.217 13 HA LEU 2 HA LEU 2 -4.506 16.761 12.588 14 1HB LEU 2 HB2 LEU 2 -4.635 17.084 15.602 15 2HB LEU 2 HB1 LEU 2 -4.655 15.541 14.753 16 HG LEU 2 HG LEU 2 -2.419 17.578 14.518 17 1HD1 LEU 2 HD12 LEU 2 -2.733 15.136 16.278 18 2HD1 LEU 2 HD11 LEU 2 -1.166 15.863 15.925 19 3HD1 LEU 2 HD13 LEU 2 -2.397 16.793 16.780 20 1HD2 LEU 2 HD22 LEU 2 -2.900 14.803 13.428 21 2HD2 LEU 2 HD21 LEU 2 -2.255 16.224 12.608 22 3HD2 LEU 2 HD23 LEU 2 -1.250 15.334 13.748 23 H THR 3 HN THR 3 -6.426 15.653 12.240 24 HA THR 3 HA THR 3 -8.917 17.094 12.952 25 HB THR 3 HB THR 3 -9.981 15.771 11.295 26 HG1 THR 3 HG1 THR 3 -9.489 13.737 11.463 27 1HG2 THR 3 HG22 THR 3 -8.219 17.387 10.458 28 2HG2 THR 3 HG21 THR 3 -7.136 16.005 10.296 29 3HG2 THR 3 HG23 THR 3 -8.617 16.080 9.342 30 H GLU 4 HN GLU 4 -10.502 14.616 12.831 31 HA GLU 4 HA GLU 4 -10.564 13.997 15.631 32 1HB GLU 4 HB2 GLU 4 -12.524 13.787 14.104 33 2HB GLU 4 HB1 GLU 4 -11.731 12.426 13.311 34 1HG GLU 4 HG2 GLU 4 -11.701 11.191 15.447 35 2HG GLU 4 HG1 GLU 4 -12.497 12.549 16.243 36 H GLY 5 HN GLY 5 -9.990 11.965 16.653 37 1HA GLY 5 HA2 GLY 5 -7.424 10.962 15.929 38 2HA GLY 5 HA1 GLY 5 -8.501 10.214 17.104 39 H ASN 6 HN ASN 6 -9.452 10.675 13.743 40 HA ASN 6 HA ASN 6 -8.771 7.916 13.009 41 1HB ASN 6 HB2 ASN 6 -11.663 8.822 13.180 42 2HB ASN 6 HB1 ASN 6 -11.101 7.273 12.549 43 1HD2 ASN 6 HD22 ASN 6 -10.842 5.807 15.740 44 2HD2 ASN 6 HD21 ASN 6 -10.798 5.598 14.056 45 HA PRO 7 HA PRO 7 -9.039 11.238 9.695 46 1HB PRO 7 HB2 PRO 7 -6.396 10.600 8.789 47 2HB PRO 7 HB1 PRO 7 -6.899 12.050 9.670 48 1HG PRO 7 HG2 PRO 7 -5.343 9.782 10.666 49 2HG PRO 7 HG1 PRO 7 -5.688 11.318 11.474 50 1HD PRO 7 HD2 PRO 7 -6.844 8.752 12.061 51 2HD PRO 7 HD1 PRO 7 -7.265 10.312 12.794 52 H ARG 8 HN ARG 8 -9.977 10.533 7.816 53 HA ARG 8 HA ARG 8 -8.985 8.055 6.503 54 1HB ARG 8 HB2 ARG 8 -11.892 8.509 7.269 55 2HB ARG 8 HB1 ARG 8 -11.291 7.174 6.285 56 1HG ARG 8 HG2 ARG 8 -9.805 6.519 8.202 57 2HG ARG 8 HG1 ARG 8 -10.605 7.742 9.181 58 1HD ARG 8 HD2 ARG 8 -11.893 5.346 7.869 59 2HD ARG 8 HD1 ARG 8 -11.659 5.578 9.594 60 HE ARG 8 HE ARG 8 -13.855 6.546 7.985 61 1HH1 ARG 8 HH21 ARG 8 -11.746 7.528 10.528 62 2HH1 ARG 8 HH22 ARG 8 -12.771 8.826 11.041 63 1HH2 ARG 8 HH11 ARG 8 -15.197 8.214 8.650 64 2HH2 ARG 8 HH12 ARG 8 -14.722 9.212 9.983 65 H TRP 9 HN TRP 9 -9.485 8.031 4.226 66 HA TRP 9 HA TRP 9 -9.733 10.641 3.029 67 1HB TRP 9 HB2 TRP 9 -9.922 7.853 1.864 68 2HB TRP 9 HB1 TRP 9 -9.975 9.316 0.883 69 HD1 TRP 9 HD1 TRP 9 -7.633 6.974 2.568 70 HE1 TRP 9 HE1 TRP 9 -5.207 7.810 2.329 71 HE3 TRP 9 HE3 TRP 9 -8.490 11.696 0.803 72 HZ2 TRP 9 HZ2 TRP 9 -3.812 10.161 1.501 73 HZ3 TRP 9 HZ3 TRP 9 -6.592 13.209 0.299 74 HH2 TRP 9 HH2 TRP 9 -4.257 12.448 0.646 75 H GLU 10 HN GLU 10 -11.572 11.754 2.555 76 HA GLU 10 HA GLU 10 -14.182 10.492 3.062 77 1HB GLU 10 HB2 GLU 10 -13.420 13.311 2.238 78 2HB GLU 10 HB1 GLU 10 -15.063 12.785 2.606 79 1HG GLU 10 HG2 GLU 10 -14.250 13.735 4.630 80 2HG GLU 10 HG1 GLU 10 -14.143 11.989 4.863 81 H GLN 11 HN GLN 11 -12.143 10.943 0.369 82 HA GLN 11 HA GLN 11 -14.324 11.121 -1.606 83 1HB GLN 11 HB2 GLN 11 -11.319 10.832 -1.892 84 2HB GLN 11 HB1 GLN 11 -12.435 11.003 -3.249 85 1HG GLN 11 HG2 GLN 11 -13.213 13.156 -2.366 86 2HG GLN 11 HG1 GLN 11 -12.144 12.988 -0.975 87 1HE2 GLN 11 HE22 GLN 11 -10.537 15.020 -3.778 88 2HE2 GLN 11 HE21 GLN 11 -12.084 15.105 -3.086 89 H THR 12 HN THR 12 -14.868 9.448 -3.086 90 HA THR 12 HA THR 12 -14.294 6.709 -2.099 91 HB THR 12 HB THR 12 -16.024 6.019 -3.719 92 HG1 THR 12 HG1 THR 12 -17.006 8.335 -4.449 93 1HG2 THR 12 HG23 THR 12 -16.725 8.388 -1.970 94 2HG2 THR 12 HG22 THR 12 -17.928 7.361 -2.750 95 3HG2 THR 12 HG21 THR 12 -16.832 6.678 -1.549 96 H HIS 13 HN HIS 13 -12.943 8.873 -4.230 97 HA HIS 13 HA HIS 13 -11.719 6.684 -5.882 98 1HB HIS 13 HB2 HIS 13 -12.331 9.536 -6.740 99 2HB HIS 13 HB1 HIS 13 -11.562 8.298 -7.732 100 HD1 HIS 13 HD1 HIS 13 -13.064 6.333 -8.580 101 HD2 HIS 13 HD2 HIS 13 -15.136 9.250 -6.445 102 HE1 HIS 13 HE1 HIS 13 -15.528 5.900 -8.980 103 H LEU 14 HN LEU 14 -9.463 6.838 -6.093 104 HA LEU 14 HA LEU 14 -8.108 9.181 -4.816 105 1HB LEU 14 HB2 LEU 14 -7.502 6.255 -4.280 106 2HB LEU 14 HB1 LEU 14 -6.536 7.608 -3.700 107 HG LEU 14 HG LEU 14 -9.483 7.260 -3.065 108 1HD1 LEU 14 HD13 LEU 14 -7.016 6.410 -1.537 109 2HD1 LEU 14 HD12 LEU 14 -8.594 6.608 -0.773 110 3HD1 LEU 14 HD11 LEU 14 -8.373 5.405 -2.044 111 1HD2 LEU 14 HD21 LEU 14 -7.316 9.175 -2.188 112 2HD2 LEU 14 HD23 LEU 14 -8.966 9.531 -2.699 113 3HD2 LEU 14 HD22 LEU 14 -8.669 8.825 -1.114 114 H THR 15 HN THR 15 -5.806 9.325 -5.458 115 HA THR 15 HA THR 15 -5.219 7.965 -8.071 116 HB THR 15 HB THR 15 -4.297 10.047 -8.922 117 HG1 THR 15 HG1 THR 15 -4.236 11.864 -7.678 118 1HG2 THR 15 HG21 THR 15 -6.734 9.693 -9.189 119 2HG2 THR 15 HG23 THR 15 -7.012 10.546 -7.671 120 3HG2 THR 15 HG22 THR 15 -6.334 11.405 -9.054 121 H TYR 16 HN TYR 16 -2.918 7.755 -8.512 122 HA TYR 16 HA TYR 16 -1.081 8.328 -6.253 123 1HB TYR 16 HB2 TYR 16 -0.272 6.026 -6.139 124 2HB TYR 16 HB1 TYR 16 -2.006 6.054 -5.820 125 HD1 TYR 16 HD1 TYR 16 0.612 5.139 -8.236 126 HD2 TYR 16 HD2 TYR 16 -3.610 5.196 -7.453 127 HE1 TYR 16 HE1 TYR 16 0.241 3.584 -10.131 128 HE2 TYR 16 HE2 TYR 16 -3.982 3.640 -9.350 129 HH TYR 16 HH TYR 16 -1.406 2.799 -11.565 130 H ARG 17 HN ARG 17 1.174 8.224 -6.907 131 HA ARG 17 HA ARG 17 1.689 7.851 -9.818 132 1HB ARG 17 HB2 ARG 17 1.099 10.269 -9.426 133 2HB ARG 17 HB1 ARG 17 2.490 10.376 -8.345 134 1HG ARG 17 HG2 ARG 17 3.975 9.674 -10.196 135 2HG ARG 17 HG1 ARG 17 2.583 9.598 -11.276 136 1HD ARG 17 HD2 ARG 17 3.628 11.728 -11.641 137 2HD ARG 17 HD1 ARG 17 2.154 12.035 -10.719 138 HE ARG 17 HE ARG 17 4.091 11.742 -8.765 139 1HH1 ARG 17 HH21 ARG 17 3.699 13.631 -11.625 140 2HH1 ARG 17 HH22 ARG 17 4.644 14.957 -11.036 141 1HH2 ARG 17 HH11 ARG 17 5.326 13.464 -7.983 142 2HH2 ARG 17 HH12 ARG 17 5.565 14.864 -8.977 143 H ILE 18 HN ILE 18 3.655 6.896 -10.129 144 HA ILE 18 HA ILE 18 5.406 6.510 -7.765 145 HB ILE 18 HB ILE 18 5.570 5.357 -10.571 146 1HG1 ILE 18 HG12 ILE 18 4.739 4.025 -7.975 147 2HG1 ILE 18 HG11 ILE 18 3.583 4.688 -9.131 148 1HG2 ILE 18 HG21 ILE 18 7.098 4.762 -8.017 149 2HG2 ILE 18 HG23 ILE 18 7.157 3.757 -9.465 150 3HG2 ILE 18 HG22 ILE 18 7.764 5.411 -9.515 151 1HD1 ILE 18 HD12 ILE 18 5.691 2.716 -10.018 152 2HD1 ILE 18 HD11 ILE 18 4.176 2.162 -9.305 153 3HD1 ILE 18 HD13 ILE 18 4.155 3.113 -10.789 154 H GLU 19 HN GLU 19 7.090 7.869 -7.444 155 HA GLU 19 HA GLU 19 7.741 9.963 -9.287 156 1HB GLU 19 HB2 GLU 19 9.204 8.891 -6.865 157 2HB GLU 19 HB1 GLU 19 9.712 10.329 -7.752 158 1HG GLU 19 HG2 GLU 19 7.506 11.364 -7.342 159 2HG GLU 19 HG1 GLU 19 7.003 9.929 -6.449 160 H ASN 20 HN ASN 20 9.334 6.841 -8.599 161 HA ASN 20 HA ASN 20 10.528 6.874 -11.255 162 1HB ASN 20 HB2 ASN 20 12.860 6.932 -10.586 163 2HB ASN 20 HB1 ASN 20 12.065 8.382 -9.972 164 1HD2 ASN 20 HD22 ASN 20 14.067 6.613 -7.250 165 2HD2 ASN 20 HD21 ASN 20 14.475 7.038 -8.841 166 H TYR 21 HN TYR 21 11.810 4.884 -11.649 167 HA TYR 21 HA TYR 21 10.894 2.628 -9.892 168 1HB TYR 21 HB2 TYR 21 11.594 2.749 -12.839 169 2HB TYR 21 HB1 TYR 21 11.309 1.243 -11.968 170 HD1 TYR 21 HD1 TYR 21 9.083 0.664 -11.140 171 HD2 TYR 21 HD2 TYR 21 9.782 4.313 -13.289 172 HE1 TYR 21 HE1 TYR 21 6.639 0.948 -11.458 173 HE2 TYR 21 HE2 TYR 21 7.342 4.600 -13.604 174 HH TYR 21 HH TYR 21 5.210 2.413 -13.479 175 H THR 22 HN THR 22 12.468 1.290 -9.017 176 HA THR 22 HA THR 22 15.232 2.167 -9.209 177 HB THR 22 HB THR 22 14.517 1.359 -7.070 178 HG1 THR 22 HG1 THR 22 15.861 -0.717 -7.054 179 1HG2 THR 22 HG21 THR 22 13.717 -1.181 -8.520 180 2HG2 THR 22 HG23 THR 22 13.689 -0.965 -6.771 181 3HG2 THR 22 HG22 THR 22 12.621 -0.006 -7.793 182 HA PRO 23 HA PRO 23 16.206 -0.495 -12.686 183 1HB PRO 23 HB2 PRO 23 18.973 -0.837 -12.081 184 2HB PRO 23 HB1 PRO 23 18.273 0.394 -13.141 185 1HG PRO 23 HG2 PRO 23 19.362 0.715 -10.422 186 2HG PRO 23 HG1 PRO 23 18.975 1.963 -11.617 187 1HD PRO 23 HD2 PRO 23 17.474 1.364 -9.271 188 2HD PRO 23 HD1 PRO 23 16.964 2.407 -10.617 189 H ASP 24 HN ASP 24 16.204 -1.369 -9.476 190 HA ASP 24 HA ASP 24 17.530 -3.901 -9.476 191 1HB ASP 24 HB2 ASP 24 15.196 -2.868 -7.846 192 2HB ASP 24 HB1 ASP 24 15.972 -4.425 -7.554 193 H LEU 25 HN LEU 25 14.204 -2.969 -10.310 194 HA LEU 25 HA LEU 25 13.875 -5.618 -11.649 195 1HB LEU 25 HB2 LEU 25 11.695 -4.270 -10.021 196 2HB LEU 25 HB1 LEU 25 11.626 -5.862 -10.759 197 HG LEU 25 HG LEU 25 13.653 -5.161 -8.623 198 1HD1 LEU 25 HD11 LEU 25 11.380 -4.831 -7.727 199 2HD1 LEU 25 HD13 LEU 25 10.932 -6.445 -8.283 200 3HD1 LEU 25 HD12 LEU 25 12.147 -6.252 -7.020 201 1HD2 LEU 25 HD23 LEU 25 12.561 -7.754 -9.757 202 2HD2 LEU 25 HD22 LEU 25 14.207 -7.147 -9.911 203 3HD2 LEU 25 HD21 LEU 25 13.604 -7.664 -8.339 204 HA PRO 26 HA PRO 26 12.438 -2.994 -14.957 205 1HB PRO 26 HB2 PRO 26 10.366 -4.744 -15.918 206 2HB PRO 26 HB1 PRO 26 12.014 -4.593 -16.545 207 1HG PRO 26 HG2 PRO 26 10.878 -6.761 -14.937 208 2HG PRO 26 HG1 PRO 26 12.449 -6.700 -15.751 209 1HD PRO 26 HD2 PRO 26 11.987 -6.509 -12.940 210 2HD PRO 26 HD1 PRO 26 13.522 -6.232 -13.787 211 H ARG 27 HN ARG 27 10.610 -1.578 -15.392 212 HA ARG 27 HA ARG 27 8.928 -1.103 -13.101 213 1HB ARG 27 HB2 ARG 27 7.933 0.685 -14.417 214 2HB ARG 27 HB1 ARG 27 9.678 0.692 -14.663 215 1HG ARG 27 HG2 ARG 27 9.319 -0.673 -16.746 216 2HG ARG 27 HG1 ARG 27 7.583 -0.446 -16.531 217 1HD ARG 27 HD2 ARG 27 9.601 1.800 -16.793 218 2HD ARG 27 HD1 ARG 27 8.557 1.225 -18.093 219 HE ARG 27 HE ARG 27 6.789 1.834 -16.048 220 1HH1 ARG 27 HH21 ARG 27 9.347 3.446 -17.709 221 2HH1 ARG 27 HH22 ARG 27 8.647 5.020 -17.534 222 1HH2 ARG 27 HH11 ARG 27 5.861 3.886 -15.812 223 2HH2 ARG 27 HH12 ARG 27 6.676 5.269 -16.462 224 H ALA 28 HN ALA 28 8.498 -2.883 -16.089 225 HA ALA 28 HA ALA 28 5.661 -3.047 -16.125 226 1HB ALA 28 HB3 ALA 28 7.790 -5.010 -17.017 227 2HB ALA 28 HB2 ALA 28 6.068 -5.268 -17.299 228 3HB ALA 28 HB1 ALA 28 6.880 -3.880 -18.020 229 H ASP 29 HN ASP 29 8.076 -4.967 -14.362 230 HA ASP 29 HA ASP 29 6.072 -6.739 -13.207 231 1HB ASP 29 HB2 ASP 29 8.987 -6.233 -12.563 232 2HB ASP 29 HB1 ASP 29 7.999 -7.413 -11.701 233 H VAL 30 HN VAL 30 7.852 -3.864 -12.107 234 HA VAL 30 HA VAL 30 6.793 -3.945 -9.421 235 HB VAL 30 HB VAL 30 7.971 -1.690 -11.064 236 1HG1 VAL 30 HG13 VAL 30 7.227 -1.808 -8.129 237 2HG1 VAL 30 HG12 VAL 30 8.276 -0.576 -8.828 238 3HG1 VAL 30 HG11 VAL 30 6.595 -0.691 -9.339 239 1HG2 VAL 30 HG22 VAL 30 9.434 -3.658 -10.485 240 2HG2 VAL 30 HG21 VAL 30 9.989 -2.132 -9.797 241 3HG2 VAL 30 HG23 VAL 30 9.145 -3.303 -8.782 242 H ASP 31 HN ASP 31 5.848 -2.163 -12.369 243 HA ASP 31 HA ASP 31 3.725 -0.676 -11.209 244 1HB ASP 31 HB2 ASP 31 4.590 -0.265 -13.493 245 2HB ASP 31 HB1 ASP 31 3.925 -1.810 -14.020 246 H HIS 32 HN HIS 32 3.716 -3.903 -12.734 247 HA HIS 32 HA HIS 32 0.930 -4.404 -12.402 248 1HB HIS 32 HB2 HIS 32 2.407 -5.812 -13.805 249 2HB HIS 32 HB1 HIS 32 3.213 -6.403 -12.351 250 HD1 HIS 32 HD1 HIS 32 -0.479 -5.953 -13.201 251 HD2 HIS 32 HD2 HIS 32 2.136 -8.898 -11.837 252 HE1 HIS 32 HE1 HIS 32 -1.885 -8.013 -12.771 253 H ALA 33 HN ALA 33 3.691 -5.062 -10.246 254 HA ALA 33 HA ALA 33 2.254 -6.423 -8.206 255 1HB ALA 33 HB3 ALA 33 4.734 -6.272 -8.303 256 2HB ALA 33 HB2 ALA 33 4.631 -4.564 -7.877 257 3HB ALA 33 HB1 ALA 33 4.106 -5.793 -6.726 258 H ILE 34 HN ILE 34 2.957 -2.942 -8.576 259 HA ILE 34 HA ILE 34 1.495 -2.171 -6.208 260 HB ILE 34 HB ILE 34 2.211 -0.572 -8.683 261 1HG1 ILE 34 HG12 ILE 34 4.201 -1.499 -7.612 262 2HG1 ILE 34 HG11 ILE 34 4.122 0.231 -7.305 263 1HG2 ILE 34 HG22 ILE 34 1.264 0.261 -5.935 264 2HG2 ILE 34 HG21 ILE 34 2.015 1.372 -7.080 265 3HG2 ILE 34 HG23 ILE 34 0.491 0.583 -7.487 266 1HD1 ILE 34 HD13 ILE 34 2.866 -0.533 -5.097 267 2HD1 ILE 34 HD12 ILE 34 3.692 -2.057 -5.411 268 3HD1 ILE 34 HD11 ILE 34 4.625 -0.579 -5.183 269 H GLU 35 HN GLU 35 0.676 -2.148 -9.686 270 HA GLU 35 HA GLU 35 -1.941 -1.079 -9.397 271 1HB GLU 35 HB2 GLU 35 -0.733 -1.357 -11.573 272 2HB GLU 35 HB1 GLU 35 -1.010 -3.095 -11.464 273 1HG GLU 35 HG2 GLU 35 -2.740 -2.126 -12.867 274 2HG GLU 35 HG1 GLU 35 -3.479 -2.633 -11.349 275 H LYS 36 HN LYS 36 -0.800 -4.454 -9.303 276 HA LYS 36 HA LYS 36 -3.363 -5.683 -9.136 277 1HB LYS 36 HB2 LYS 36 -1.274 -6.924 -9.568 278 2HB LYS 36 HB1 LYS 36 -0.739 -6.603 -7.920 279 1HG LYS 36 HG2 LYS 36 -2.736 -7.820 -7.058 280 2HG LYS 36 HG1 LYS 36 -3.208 -8.181 -8.717 281 1HD LYS 36 HD2 LYS 36 -0.591 -9.026 -7.432 282 2HD LYS 36 HD1 LYS 36 -1.991 -10.072 -7.652 283 1HE LYS 36 HE2 LYS 36 -1.794 -9.384 -10.173 284 2HE LYS 36 HE1 LYS 36 -0.148 -8.924 -9.737 285 1HZ LYS 36 HZ2 LYS 36 -0.759 -11.448 -8.636 286 2HZ LYS 36 HZ1 LYS 36 -1.094 -11.465 -10.301 287 3HZ LYS 36 HZ3 LYS 36 0.453 -11.036 -9.753 288 H ALA 37 HN ALA 37 -1.235 -4.394 -6.591 289 HA ALA 37 HA ALA 37 -2.743 -5.333 -4.368 290 1HB ALA 37 HB3 ALA 37 -0.432 -4.181 -4.404 291 2HB ALA 37 HB2 ALA 37 -1.329 -2.663 -4.419 292 3HB ALA 37 HB1 ALA 37 -1.510 -3.782 -3.067 293 H PHE 38 HN PHE 38 -2.962 -2.232 -6.146 294 HA PHE 38 HA PHE 38 -5.097 -1.146 -4.606 295 1HB PHE 38 HB2 PHE 38 -4.161 -0.716 -7.446 296 2HB PHE 38 HB1 PHE 38 -5.599 0.107 -6.842 297 HD1 PHE 38 HD2 PHE 38 -5.368 1.389 -4.594 298 HD2 PHE 38 HD1 PHE 38 -2.025 0.185 -7.005 299 HE1 PHE 38 HE2 PHE 38 -3.945 3.072 -3.460 300 HE2 PHE 38 HE1 PHE 38 -0.599 1.865 -5.865 301 HZ PHE 38 HZ PHE 38 -1.559 3.310 -4.094 302 H GLN 39 HN GLN 39 -5.140 -3.279 -7.455 303 HA GLN 39 HA GLN 39 -7.960 -3.215 -7.865 304 1HB GLN 39 HB2 GLN 39 -5.900 -5.354 -8.455 305 2HB GLN 39 HB1 GLN 39 -7.585 -5.463 -8.970 306 1HG GLN 39 HG2 GLN 39 -7.355 -3.325 -10.184 307 2HG GLN 39 HG1 GLN 39 -5.671 -3.218 -9.672 308 1HE2 GLN 39 HE22 GLN 39 -5.511 -6.576 -11.693 309 2HE2 GLN 39 HE21 GLN 39 -5.845 -6.409 -10.038 310 H LEU 40 HN LEU 40 -5.950 -5.300 -5.784 311 HA LEU 40 HA LEU 40 -8.036 -7.051 -4.949 312 1HB LEU 40 HB2 LEU 40 -5.552 -6.108 -3.495 313 2HB LEU 40 HB1 LEU 40 -6.612 -7.376 -2.886 314 HG LEU 40 HG LEU 40 -5.252 -7.450 -5.597 315 1HD1 LEU 40 HD12 LEU 40 -4.494 -8.715 -2.949 316 2HD1 LEU 40 HD11 LEU 40 -3.795 -9.187 -4.498 317 3HD1 LEU 40 HD13 LEU 40 -3.551 -7.552 -3.880 318 1HD2 LEU 40 HD22 LEU 40 -7.075 -9.312 -4.081 319 2HD2 LEU 40 HD21 LEU 40 -7.040 -8.937 -5.803 320 3HD2 LEU 40 HD23 LEU 40 -5.828 -10.010 -5.113 321 H TRP 41 HN TRP 41 -6.997 -3.898 -3.657 322 HA TRP 41 HA TRP 41 -8.841 -3.968 -1.430 323 1HB TRP 41 HB2 TRP 41 -7.410 -1.692 -2.824 324 2HB TRP 41 HB1 TRP 41 -8.407 -1.471 -1.386 325 HD1 TRP 41 HD1 TRP 41 -4.968 -2.215 -2.403 326 HE1 TRP 41 HE1 TRP 41 -3.577 -3.081 -0.414 327 HE3 TRP 41 HE3 TRP 41 -8.711 -3.174 0.939 328 HZ2 TRP 41 HZ2 TRP 41 -3.995 -4.051 2.242 329 HZ3 TRP 41 HZ3 TRP 41 -8.184 -4.067 3.191 330 HH2 TRP 41 HH2 TRP 41 -5.832 -4.507 3.846 331 H SER 42 HN SER 42 -8.987 -2.595 -4.703 332 HA SER 42 HA SER 42 -11.582 -1.374 -4.360 333 1HB SER 42 HB2 SER 42 -10.026 -0.665 -6.134 334 2HB SER 42 HB1 SER 42 -10.153 -2.251 -6.890 335 HG SER 42 HG SER 42 -12.534 -0.935 -6.332 336 H ASN 43 HN ASN 43 -10.492 -4.504 -5.604 337 HA ASN 43 HA ASN 43 -12.850 -5.496 -6.707 338 1HB ASN 43 HB2 ASN 43 -10.705 -6.893 -5.101 339 2HB ASN 43 HB1 ASN 43 -12.012 -7.764 -5.906 340 1HD2 ASN 43 HD22 ASN 43 -10.822 -6.466 -9.198 341 2HD2 ASN 43 HD21 ASN 43 -12.265 -6.360 -8.310 342 H VAL 44 HN VAL 44 -12.095 -5.073 -3.282 343 HA VAL 44 HA VAL 44 -14.724 -6.347 -2.578 344 HB VAL 44 HB VAL 44 -13.771 -6.299 -0.223 345 1HG1 VAL 44 HG13 VAL 44 -12.398 -7.886 -2.407 346 2HG1 VAL 44 HG12 VAL 44 -12.199 -8.222 -0.688 347 3HG1 VAL 44 HG11 VAL 44 -13.788 -8.377 -1.439 348 1HG2 VAL 44 HG21 VAL 44 -11.995 -4.543 -0.971 349 2HG2 VAL 44 HG23 VAL 44 -11.491 -5.818 0.135 350 3HG2 VAL 44 HG22 VAL 44 -11.098 -5.931 -1.580 351 H THR 45 HN THR 45 -13.718 -3.348 -3.342 352 HA THR 45 HA THR 45 -15.721 -2.129 -1.538 353 HB THR 45 HB THR 45 -14.094 -0.223 -1.052 354 HG1 THR 45 HG1 THR 45 -12.147 -2.153 -1.692 355 1HG2 THR 45 HG22 THR 45 -14.699 -1.969 0.613 356 2HG2 THR 45 HG21 THR 45 -13.347 -2.945 0.042 357 3HG2 THR 45 HG23 THR 45 -13.046 -1.391 0.805 358 HA PRO 46 HA PRO 46 -16.537 0.134 -5.296 359 1HB PRO 46 HB2 PRO 46 -17.525 2.530 -4.155 360 2HB PRO 46 HB1 PRO 46 -18.486 1.094 -4.536 361 1HG PRO 46 HG2 PRO 46 -17.587 2.073 -1.892 362 2HG PRO 46 HG1 PRO 46 -18.884 0.931 -2.275 363 1HD PRO 46 HD2 PRO 46 -16.348 0.258 -1.203 364 2HD PRO 46 HD1 PRO 46 -17.525 -0.873 -1.903 365 H LEU 47 HN LEU 47 -14.017 0.718 -3.340 366 HA LEU 47 HA LEU 47 -13.307 3.438 -4.069 367 1HB LEU 47 HB2 LEU 47 -11.658 1.150 -2.962 368 2HB LEU 47 HB1 LEU 47 -11.036 2.781 -3.195 369 HG LEU 47 HG LEU 47 -13.448 2.095 -1.485 370 1HD1 LEU 47 HD12 LEU 47 -11.274 1.176 -0.630 371 2HD1 LEU 47 HD11 LEU 47 -10.637 2.821 -0.612 372 3HD1 LEU 47 HD13 LEU 47 -11.990 2.388 0.433 373 1HD2 LEU 47 HD22 LEU 47 -12.012 4.647 -2.198 374 2HD2 LEU 47 HD21 LEU 47 -13.739 4.355 -1.994 375 3HD2 LEU 47 HD23 LEU 47 -12.697 4.494 -0.582 376 H THR 48 HN THR 48 -11.876 4.129 -5.672 377 HA THR 48 HA THR 48 -10.944 2.073 -7.656 378 HB THR 48 HB THR 48 -11.612 3.488 -9.477 379 HG1 THR 48 HG1 THR 48 -12.430 5.376 -7.531 380 1HG2 THR 48 HG21 THR 48 -13.807 3.471 -7.385 381 2HG2 THR 48 HG23 THR 48 -14.053 3.728 -9.111 382 3HG2 THR 48 HG22 THR 48 -13.454 2.174 -8.528 383 H PHE 49 HN PHE 49 -8.956 2.647 -8.716 384 HA PHE 49 HA PHE 49 -7.529 5.034 -7.579 385 1HB PHE 49 HB2 PHE 49 -6.415 2.244 -7.985 386 2HB PHE 49 HB1 PHE 49 -5.474 3.655 -7.493 387 HD1 PHE 49 HD2 PHE 49 -5.762 4.665 -5.282 388 HD2 PHE 49 HD1 PHE 49 -8.043 1.226 -6.478 389 HE1 PHE 49 HE2 PHE 49 -6.455 4.305 -2.930 390 HE2 PHE 49 HE1 PHE 49 -8.736 0.866 -4.125 391 HZ PHE 49 HZ PHE 49 -7.942 2.405 -2.350 392 H THR 50 HN THR 50 -6.679 6.306 -9.109 393 HA THR 50 HA THR 50 -6.226 5.184 -11.858 394 HB THR 50 HB THR 50 -7.162 7.969 -11.092 395 HG1 THR 50 HG1 THR 50 -9.049 7.208 -12.253 396 1HG2 THR 50 HG23 THR 50 -6.609 6.647 -13.761 397 2HG2 THR 50 HG22 THR 50 -7.480 8.169 -13.582 398 3HG2 THR 50 HG21 THR 50 -5.792 8.056 -13.083 399 H LYS 51 HN LYS 51 -4.183 5.438 -12.607 400 HA LYS 51 HA LYS 51 -2.188 6.778 -10.949 401 1HB LYS 51 HB2 LYS 51 -1.652 4.700 -12.177 402 2HB LYS 51 HB1 LYS 51 -1.950 5.527 -13.706 403 1HG LYS 51 HG2 LYS 51 -0.101 7.020 -13.354 404 2HG LYS 51 HG1 LYS 51 0.102 6.471 -11.690 405 1HD LYS 51 HD2 LYS 51 1.787 5.429 -13.158 406 2HD LYS 51 HD1 LYS 51 0.688 4.215 -12.506 407 1HE LYS 51 HE2 LYS 51 0.064 5.489 -15.162 408 2HE LYS 51 HE1 LYS 51 1.257 4.193 -15.074 409 1HZ LYS 51 HZ3 LYS 51 -1.016 3.518 -13.545 410 2HZ LYS 51 HZ2 LYS 51 -1.497 3.943 -15.117 411 3HZ LYS 51 HZ1 LYS 51 -0.352 2.710 -14.881 412 H VAL 52 HN VAL 52 -1.160 8.755 -11.413 413 HA VAL 52 HA VAL 52 -2.282 10.326 -13.726 414 HB VAL 52 HB VAL 52 -1.980 12.340 -12.321 415 1HG1 VAL 52 HG13 VAL 52 -3.665 10.091 -11.198 416 2HG1 VAL 52 HG12 VAL 52 -3.770 11.749 -10.608 417 3HG1 VAL 52 HG11 VAL 52 -4.175 11.383 -12.285 418 1HG2 VAL 52 HG22 VAL 52 -1.093 10.274 -10.295 419 2HG2 VAL 52 HG21 VAL 52 -0.202 11.689 -10.858 420 3HG2 VAL 52 HG23 VAL 52 -1.622 11.891 -9.831 421 H SER 53 HN SER 53 -0.805 11.215 -15.085 422 HA SER 53 HA SER 53 2.065 10.705 -14.555 423 1HB SER 53 HB2 SER 53 1.199 10.087 -16.753 424 2HB SER 53 HB1 SER 53 0.605 11.726 -17.009 425 HG SER 53 HG SER 53 2.758 12.444 -16.919 426 H GLU 54 HN GLU 54 -0.035 13.179 -13.846 427 HA GLU 54 HA GLU 54 2.191 15.105 -13.670 428 1HB GLU 54 HB2 GLU 54 0.673 16.873 -14.668 429 2HB GLU 54 HB1 GLU 54 1.337 15.715 -15.806 430 1HG GLU 54 HG2 GLU 54 -1.360 15.295 -14.510 431 2HG GLU 54 HG1 GLU 54 -1.186 16.245 -15.986 432 H GLY 55 HN GLY 55 1.624 16.959 -12.342 433 1HA GLY 55 HA2 GLY 55 0.602 17.989 -10.493 434 2HA GLY 55 HA1 GLY 55 -0.859 17.075 -10.869 435 H GLN 56 HN GLN 56 -0.280 17.337 -8.233 436 HA GLN 56 HA GLN 56 1.334 15.072 -7.296 437 1HB GLN 56 HB2 GLN 56 0.741 15.806 -5.066 438 2HB GLN 56 HB1 GLN 56 1.121 17.240 -6.017 439 1HG GLN 56 HG2 GLN 56 -1.355 17.488 -6.473 440 2HG GLN 56 HG1 GLN 56 -1.636 16.195 -5.306 441 1HE2 GLN 56 HE22 GLN 56 -1.754 18.664 -2.792 442 2HE2 GLN 56 HE21 GLN 56 -2.562 17.400 -3.586 443 H ALA 57 HN ALA 57 0.465 13.212 -6.253 444 HA ALA 57 HA ALA 57 -2.380 12.608 -6.994 445 1HB ALA 57 HB2 ALA 57 -0.412 11.205 -7.910 446 2HB ALA 57 HB1 ALA 57 -0.283 10.560 -6.273 447 3HB ALA 57 HB3 ALA 57 -1.771 10.342 -7.195 448 H ASP 58 HN ASP 58 -3.561 11.248 -5.427 449 HA ASP 58 HA ASP 58 -3.498 12.315 -2.793 450 1HB ASP 58 HB2 ASP 58 -4.685 9.745 -3.878 451 2HB ASP 58 HB1 ASP 58 -4.966 10.332 -2.238 452 H ILE 59 HN ILE 59 -2.103 9.352 -4.163 453 HA ILE 59 HA ILE 59 -0.557 8.964 -1.611 454 HB ILE 59 HB ILE 59 -1.457 6.893 -3.641 455 1HG1 ILE 59 HG12 ILE 59 -2.330 7.171 -0.756 456 2HG1 ILE 59 HG11 ILE 59 -3.212 7.944 -2.074 457 1HG2 ILE 59 HG23 ILE 59 0.134 6.730 -1.071 458 2HG2 ILE 59 HG22 ILE 59 -0.644 5.327 -1.804 459 3HG2 ILE 59 HG21 ILE 59 0.621 6.190 -2.678 460 1HD1 ILE 59 HD12 ILE 59 -2.562 4.989 -2.055 461 2HD1 ILE 59 HD11 ILE 59 -4.059 5.641 -1.388 462 3HD1 ILE 59 HD13 ILE 59 -3.699 5.839 -3.103 463 H MET 60 HN MET 60 1.543 9.480 -1.926 464 HA MET 60 HA MET 60 2.702 9.327 -4.671 465 1HB MET 60 HB2 MET 60 3.807 10.581 -2.137 466 2HB MET 60 HB1 MET 60 4.540 10.678 -3.737 467 1HG MET 60 HG2 MET 60 1.791 11.729 -3.008 468 2HG MET 60 HG1 MET 60 3.234 12.718 -3.209 469 1HE MET 60 HE2 MET 60 4.591 12.904 -5.089 470 2HE MET 60 HE1 MET 60 4.672 11.385 -5.977 471 3HE MET 60 HE3 MET 60 4.074 12.848 -6.770 472 H ILE 61 HN ILE 61 4.227 7.831 -5.174 473 HA ILE 61 HA ILE 61 5.269 6.075 -2.967 474 HB ILE 61 HB ILE 61 4.615 5.395 -5.850 475 1HG1 ILE 61 HG12 ILE 61 3.451 4.283 -3.282 476 2HG1 ILE 61 HG11 ILE 61 2.719 5.625 -4.163 477 1HG2 ILE 61 HG23 ILE 61 6.009 3.868 -3.646 478 2HG2 ILE 61 HG22 ILE 61 5.167 3.030 -4.949 479 3HG2 ILE 61 HG21 ILE 61 6.521 4.096 -5.319 480 1HD1 ILE 61 HD11 ILE 61 2.606 4.174 -6.196 481 2HD1 ILE 61 HD13 ILE 61 3.222 2.831 -5.234 482 3HD1 ILE 61 HD12 ILE 61 1.653 3.541 -4.855 483 H SER 62 HN SER 62 7.459 6.055 -2.772 484 HA SER 62 HA SER 62 9.149 6.613 -5.140 485 1HB SER 62 HB2 SER 62 10.327 8.447 -4.125 486 2HB SER 62 HB1 SER 62 8.610 8.828 -4.032 487 HG SER 62 HG SER 62 8.741 8.739 -1.937 488 H PHE 63 HN PHE 63 11.406 6.112 -4.732 489 HA PHE 63 HA PHE 63 11.778 4.135 -2.506 490 1HB PHE 63 HB2 PHE 63 13.021 4.363 -5.261 491 2HB PHE 63 HB1 PHE 63 13.612 3.259 -4.022 492 HD1 PHE 63 HD1 PHE 63 10.802 4.049 -6.275 493 HD2 PHE 63 HD2 PHE 63 12.309 1.313 -3.328 494 HE1 PHE 63 HE1 PHE 63 9.035 2.417 -6.884 495 HE2 PHE 63 HE2 PHE 63 10.543 -0.317 -3.939 496 HZ PHE 63 HZ PHE 63 8.906 0.236 -5.717 497 H VAL 64 HN VAL 64 13.311 4.631 -0.985 498 HA VAL 64 HA VAL 64 15.316 6.778 -1.628 499 HB VAL 64 HB VAL 64 14.984 7.680 0.634 500 1HG1 VAL 64 HG12 VAL 64 12.505 7.408 -1.080 501 2HG1 VAL 64 HG11 VAL 64 12.620 8.519 0.286 502 3HG1 VAL 64 HG13 VAL 64 13.685 8.718 -1.106 503 1HG2 VAL 64 HG23 VAL 64 12.900 5.489 0.773 504 2HG2 VAL 64 HG22 VAL 64 14.276 5.737 1.850 505 3HG2 VAL 64 HG21 VAL 64 12.919 6.863 1.879 506 H ARG 65 HN ARG 65 17.190 6.769 -0.167 507 HA ARG 65 HA ARG 65 17.796 4.058 0.979 508 1HB ARG 65 HB2 ARG 65 19.571 5.916 -0.626 509 2HB ARG 65 HB1 ARG 65 20.185 4.541 0.289 510 1HG ARG 65 HG2 ARG 65 18.745 3.030 -1.019 511 2HG ARG 65 HG1 ARG 65 18.139 4.407 -1.944 512 1HD ARG 65 HD2 ARG 65 20.565 4.900 -2.556 513 2HD ARG 65 HD1 ARG 65 20.965 3.326 -1.869 514 HE ARG 65 HE ARG 65 18.936 2.760 -3.666 515 1HH1 ARG 65 HH21 ARG 65 21.976 4.388 -3.733 516 2HH1 ARG 65 HH22 ARG 65 22.284 4.028 -5.399 517 1HH2 ARG 65 HH11 ARG 65 19.325 2.282 -5.848 518 2HH2 ARG 65 HH12 ARG 65 20.785 2.839 -6.595 519 H GLY 66 HN GLY 66 19.089 4.059 2.858 520 1HA GLY 66 HA2 GLY 66 19.637 4.901 4.988 521 2HA GLY 66 HA1 GLY 66 20.559 6.064 4.040 522 H ASP 67 HN ASP 67 20.136 7.680 5.639 523 HA ASP 67 HA ASP 67 17.558 8.459 6.547 524 1HB ASP 67 HB2 ASP 67 19.764 9.206 7.510 525 2HB ASP 67 HB1 ASP 67 19.939 10.285 6.125 526 H HIS 68 HN HIS 68 15.968 9.670 5.634 527 HA HIS 68 HA HIS 68 16.544 11.203 3.138 528 1HB HIS 68 HB2 HIS 68 14.370 10.290 2.213 529 2HB HIS 68 HB1 HIS 68 15.680 9.114 2.328 530 HD1 HIS 68 HD1 HIS 68 15.617 7.507 4.476 531 HD2 HIS 68 HD2 HIS 68 12.107 9.620 3.711 532 HE1 HIS 68 HE1 HIS 68 13.800 6.393 5.843 533 H ARG 69 HN ARG 69 16.316 12.508 5.486 534 HA ARG 69 HA ARG 69 15.100 14.156 6.615 535 1HB ARG 69 HB2 ARG 69 13.452 14.101 4.066 536 2HB ARG 69 HB1 ARG 69 13.375 15.353 5.300 537 1HG ARG 69 HG2 ARG 69 15.770 15.841 4.943 538 2HG ARG 69 HG1 ARG 69 15.826 14.622 3.672 539 1HD ARG 69 HD2 ARG 69 13.946 15.888 2.529 540 2HD ARG 69 HD1 ARG 69 14.196 17.183 3.691 541 HE ARG 69 HE ARG 69 15.723 16.706 1.308 542 1HH1 ARG 69 HH21 ARG 69 16.180 17.492 4.642 543 2HH1 ARG 69 HH22 ARG 69 17.786 18.088 4.403 544 1HH2 ARG 69 HH11 ARG 69 17.794 17.504 0.993 545 2HH2 ARG 69 HH12 ARG 69 18.695 18.103 2.346 546 H ASP 70 HN ASP 70 14.467 11.679 7.534 547 HA ASP 70 HA ASP 70 11.551 11.948 8.121 548 1HB ASP 70 HB2 ASP 70 11.218 9.535 7.862 549 2HB ASP 70 HB1 ASP 70 11.813 10.217 6.347 550 H ASN 71 HN ASN 71 10.961 10.760 10.133 551 HA ASN 71 HA ASN 71 13.168 10.944 12.097 552 1HB ASN 71 HB2 ASN 71 11.419 10.770 13.779 553 2HB ASN 71 HB1 ASN 71 10.910 11.942 12.562 554 1HD2 ASN 71 HD22 ASN 71 8.146 9.426 13.226 555 2HD2 ASN 71 HD21 ASN 71 9.073 10.401 14.261 556 H SER 72 HN SER 72 12.354 8.630 10.022 557 HA SER 72 HA SER 72 13.026 6.431 11.941 558 1HB SER 72 HB2 SER 72 10.948 6.288 9.740 559 2HB SER 72 HB1 SER 72 11.462 4.943 10.755 560 HG SER 72 HG SER 72 9.503 6.296 11.348 561 HA PRO 73 HA PRO 73 15.716 6.594 8.111 562 1HB PRO 73 HB2 PRO 73 18.033 6.219 9.797 563 2HB PRO 73 HB1 PRO 73 17.599 7.661 8.867 564 1HG PRO 73 HG2 PRO 73 17.492 7.324 11.739 565 2HG PRO 73 HG1 PRO 73 17.060 8.761 10.801 566 1HD PRO 73 HD2 PRO 73 15.271 6.898 12.131 567 2HD PRO 73 HD1 PRO 73 14.847 8.373 11.241 568 H PHE 74 HN PHE 74 16.644 4.687 7.186 569 HA PHE 74 HA PHE 74 15.815 2.204 8.450 570 1HB PHE 74 HB2 PHE 74 17.435 2.737 5.944 571 2HB PHE 74 HB1 PHE 74 16.855 1.147 6.441 572 HD1 PHE 74 HD1 PHE 74 14.418 0.682 6.576 573 HD2 PHE 74 HD2 PHE 74 15.940 4.377 5.003 574 HE1 PHE 74 HE1 PHE 74 12.213 1.155 5.556 575 HE2 PHE 74 HE2 PHE 74 13.731 4.851 3.979 576 HZ PHE 74 HZ PHE 74 11.866 3.239 4.255 577 H ASP 75 HN ASP 75 17.051 0.783 9.587 578 HA ASP 75 HA ASP 75 19.894 1.543 10.122 579 1HB ASP 75 HB2 ASP 75 18.308 1.342 12.054 580 2HB ASP 75 HB1 ASP 75 18.096 -0.361 11.650 581 H GLY 76 HN GLY 76 20.017 0.436 7.772 582 1HA GLY 76 HA2 GLY 76 21.168 -1.337 6.700 583 2HA GLY 76 HA1 GLY 76 21.208 -2.188 8.243 584 HA PRO 77 HA PRO 77 18.106 -4.213 5.417 585 1HB PRO 77 HB2 PRO 77 19.160 -6.793 6.163 586 2HB PRO 77 HB1 PRO 77 19.303 -5.985 4.596 587 1HG PRO 77 HG2 PRO 77 21.393 -6.404 6.552 588 2HG PRO 77 HG1 PRO 77 21.525 -5.590 4.986 589 1HD PRO 77 HD2 PRO 77 21.489 -4.386 7.637 590 2HD PRO 77 HD1 PRO 77 21.734 -3.580 6.074 591 H GLY 78 HN GLY 78 18.787 -3.969 8.673 592 1HA GLY 78 HA2 GLY 78 16.616 -5.831 9.539 593 2HA GLY 78 HA1 GLY 78 17.791 -5.062 10.604 594 H GLY 79 HN GLY 79 15.401 -4.740 11.571 595 1HA GLY 79 HA2 GLY 79 14.006 -3.009 12.360 596 2HA GLY 79 HA1 GLY 79 14.862 -1.891 11.298 597 H ASN 80 HN ASN 80 12.717 -1.018 10.766 598 HA ASN 80 HA ASN 80 10.714 -2.646 9.472 599 1HB ASN 80 HB2 ASN 80 11.194 0.347 9.469 600 2HB ASN 80 HB1 ASN 80 9.764 -0.426 8.785 601 1HD2 ASN 80 HD22 ASN 80 9.643 0.419 12.627 602 2HD2 ASN 80 HD21 ASN 80 10.570 1.227 11.458 603 H LEU 81 HN LEU 81 10.315 -2.907 7.244 604 HA LEU 81 HA LEU 81 12.670 -2.480 5.498 605 1HB LEU 81 HB2 LEU 81 10.050 -3.813 4.783 606 2HB LEU 81 HB1 LEU 81 11.609 -4.001 3.983 607 HG LEU 81 HG LEU 81 10.815 -4.981 6.735 608 1HD1 LEU 81 HD12 LEU 81 11.756 -6.323 4.185 609 2HD1 LEU 81 HD11 LEU 81 11.583 -7.159 5.727 610 3HD1 LEU 81 HD13 LEU 81 10.167 -6.463 4.938 611 1HD2 LEU 81 HD22 LEU 81 13.537 -4.678 5.463 612 2HD2 LEU 81 HD21 LEU 81 13.025 -4.181 7.072 613 3HD2 LEU 81 HD23 LEU 81 13.238 -5.892 6.704 614 H ALA 82 HN ALA 82 9.877 -0.816 6.301 615 HA ALA 82 HA ALA 82 10.260 1.194 4.297 616 1HB ALA 82 HB3 ALA 82 7.987 -0.756 3.839 617 2HB ALA 82 HB2 ALA 82 8.058 0.847 3.106 618 3HB ALA 82 HB1 ALA 82 9.290 -0.353 2.720 619 H HIS 83 HN HIS 83 8.125 2.665 4.294 620 HA HIS 83 HA HIS 83 6.439 2.454 6.641 621 1HB HIS 83 HB2 HIS 83 7.333 4.398 7.863 622 2HB HIS 83 HB1 HIS 83 8.549 3.126 7.743 623 HD1 HIS 83 HD1 HIS 83 10.507 3.503 6.026 624 HD2 HIS 83 HD2 HIS 83 7.973 6.781 6.491 625 HE1 HIS 83 HE1 HIS 83 11.701 5.483 4.994 626 H ALA 84 HN ALA 84 5.033 4.406 6.836 627 HA ALA 84 HA ALA 84 5.028 6.186 4.453 628 1HB ALA 84 HB2 ALA 84 3.598 4.241 3.869 629 2HB ALA 84 HB1 ALA 84 2.635 4.529 5.319 630 3HB ALA 84 HB3 ALA 84 2.652 5.723 4.022 631 H PHE 85 HN PHE 85 3.492 8.022 4.784 632 HA PHE 85 HA PHE 85 3.457 8.800 7.654 633 1HB PHE 85 HB2 PHE 85 3.043 10.381 5.099 634 2HB PHE 85 HB1 PHE 85 2.945 11.072 6.721 635 HD1 PHE 85 HD2 PHE 85 5.181 9.587 4.197 636 HD2 PHE 85 HD1 PHE 85 4.920 11.296 8.125 637 HE1 PHE 85 HE2 PHE 85 7.653 9.792 4.272 638 HE2 PHE 85 HE1 PHE 85 7.389 11.499 8.203 639 HZ PHE 85 HZ PHE 85 8.756 10.748 6.275 640 H GLN 86 HN GLN 86 1.523 9.629 8.632 641 HA GLN 86 HA GLN 86 -0.828 8.168 8.065 642 1HB GLN 86 HB2 GLN 86 -0.410 10.740 9.611 643 2HB GLN 86 HB1 GLN 86 -1.934 9.852 9.607 644 1HG GLN 86 HG2 GLN 86 -0.780 7.853 10.476 645 2HG GLN 86 HG1 GLN 86 0.750 8.730 10.471 646 1HE2 GLN 86 HE22 GLN 86 0.148 10.017 13.681 647 2HE2 GLN 86 HE21 GLN 86 1.268 9.494 12.517 648 HA PRO 87 HA PRO 87 -2.596 10.324 4.611 649 1HB PRO 87 HB2 PRO 87 -5.310 10.387 5.637 650 2HB PRO 87 HB1 PRO 87 -4.631 9.298 4.419 651 1HG PRO 87 HG2 PRO 87 -5.297 8.693 7.187 652 2HG PRO 87 HG1 PRO 87 -4.720 7.583 5.936 653 1HD PRO 87 HD2 PRO 87 -3.237 8.528 8.198 654 2HD PRO 87 HD1 PRO 87 -2.622 7.561 6.841 655 H GLY 88 HN GLY 88 -2.101 12.480 4.482 656 1HA GLY 88 HA2 GLY 88 -3.835 14.443 5.710 657 2HA GLY 88 HA1 GLY 88 -2.242 14.429 6.468 658 HA PRO 89 HA PRO 89 -2.293 16.962 2.455 659 1HB PRO 89 HB2 PRO 89 -1.598 19.367 3.843 660 2HB PRO 89 HB1 PRO 89 -3.157 18.989 3.096 661 1HG PRO 89 HG2 PRO 89 -2.478 19.066 5.950 662 2HG PRO 89 HG1 PRO 89 -4.076 18.939 5.199 663 1HD PRO 89 HD2 PRO 89 -2.633 16.841 6.520 664 2HD PRO 89 HD1 PRO 89 -4.151 16.690 5.611 665 H GLY 90 HN GLY 90 -0.287 18.314 1.752 666 1HA GLY 90 HA2 GLY 90 2.038 18.563 1.590 667 2HA GLY 90 HA1 GLY 90 2.126 18.191 3.309 668 H ILE 91 HN ILE 91 3.449 16.509 3.630 669 HA ILE 91 HA ILE 91 3.951 14.532 1.539 670 HB ILE 91 HB ILE 91 5.798 15.314 2.908 671 1HG1 ILE 91 HG12 ILE 91 5.268 12.494 3.856 672 2HG1 ILE 91 HG11 ILE 91 5.600 12.836 2.161 673 1HG2 ILE 91 HG21 ILE 91 4.432 15.826 4.936 674 2HG2 ILE 91 HG23 ILE 91 4.334 14.097 5.267 675 3HG2 ILE 91 HG22 ILE 91 5.895 14.917 5.308 676 1HD1 ILE 91 HD11 ILE 91 7.406 13.800 4.383 677 2HD1 ILE 91 HD13 ILE 91 7.624 12.235 3.600 678 3HD1 ILE 91 HD12 ILE 91 7.759 13.718 2.657 679 H GLY 92 HN GLY 92 1.536 14.806 3.836 680 1HA GLY 92 HA2 GLY 92 1.343 12.190 4.924 681 2HA GLY 92 HA1 GLY 92 -0.035 13.251 4.642 682 H GLY 93 HN GLY 93 0.476 10.281 4.152 683 1HA GLY 93 HA2 GLY 93 -0.686 8.852 2.630 684 2HA GLY 93 HA1 GLY 93 -0.811 10.193 1.492 685 H ASP 94 HN ASP 94 2.239 10.580 2.158 686 HA ASP 94 HA ASP 94 3.210 9.233 -0.188 687 1HB ASP 94 HB2 ASP 94 4.618 10.597 2.114 688 2HB ASP 94 HB1 ASP 94 5.493 9.878 0.761 689 H ALA 95 HN ALA 95 4.770 7.488 -0.295 690 HA ALA 95 HA ALA 95 5.009 5.782 2.143 691 1HB ALA 95 HB2 ALA 95 3.042 5.071 0.623 692 2HB ALA 95 HB1 ALA 95 4.277 4.592 -0.542 693 3HB ALA 95 HB3 ALA 95 4.219 3.827 1.047 694 H HIS 96 HN HIS 96 7.162 5.478 2.379 695 HA HIS 96 HA HIS 96 8.914 5.515 -0.045 696 1HB HIS 96 HB2 HIS 96 9.640 5.778 2.887 697 2HB HIS 96 HB1 HIS 96 10.729 5.997 1.518 698 HD2 HIS 96 HD2 HIS 96 7.705 7.852 0.241 699 HE1 HIS 96 HE1 HIS 96 9.780 10.522 2.819 700 HE2 HIS 96 HE2 HIS 96 8.013 10.333 1.014 701 H PHE 97 HN PHE 97 10.248 3.791 -0.528 702 HA PHE 97 HA PHE 97 9.925 1.305 1.137 703 1HB PHE 97 HB2 PHE 97 10.320 1.697 -1.838 704 2HB PHE 97 HB1 PHE 97 10.546 0.139 -1.049 705 HD1 PHE 97 HD1 PHE 97 8.078 2.849 -1.692 706 HD2 PHE 97 HD2 PHE 97 8.680 -1.213 -0.427 707 HE1 PHE 97 HE1 PHE 97 5.634 2.446 -1.818 708 HE2 PHE 97 HE2 PHE 97 6.235 -1.614 -0.549 709 HZ PHE 97 HZ PHE 97 4.713 0.213 -1.247 710 H ASP 98 HN ASP 98 11.789 0.246 1.778 711 HA ASP 98 HA ASP 98 14.276 1.714 1.759 712 1HB ASP 98 HB2 ASP 98 13.493 0.059 3.533 713 2HB ASP 98 HB1 ASP 98 13.942 -1.226 2.409 714 H GLU 99 HN GLU 99 15.222 1.981 -0.252 715 HA GLU 99 HA GLU 99 15.272 -0.187 -2.209 716 1HB GLU 99 HB2 GLU 99 15.257 2.355 -2.682 717 2HB GLU 99 HB1 GLU 99 16.969 2.309 -2.303 718 1HG GLU 99 HG2 GLU 99 16.676 2.090 -4.715 719 2HG GLU 99 HG1 GLU 99 17.288 0.572 -4.069 720 H ASP 100 HN ASP 100 16.994 0.299 0.593 721 HA ASP 100 HA ASP 100 19.659 -0.381 -0.349 722 1HB ASP 100 HB2 ASP 100 18.389 -0.521 2.402 723 2HB ASP 100 HB1 ASP 100 20.078 -0.910 2.088 724 H GLU 101 HN GLU 101 16.882 -2.191 0.881 725 HA GLU 101 HA GLU 101 18.343 -4.739 0.791 726 1HB GLU 101 HB2 GLU 101 15.399 -4.127 1.203 727 2HB GLU 101 HB1 GLU 101 16.137 -5.722 1.371 728 1HG GLU 101 HG2 GLU 101 17.618 -4.856 3.142 729 2HG GLU 101 HG1 GLU 101 16.885 -3.260 2.974 730 H ARG 102 HN ARG 102 17.584 -6.520 -0.629 731 HA ARG 102 HA ARG 102 17.066 -5.490 -3.354 732 1HB ARG 102 HB2 ARG 102 18.832 -7.205 -2.922 733 2HB ARG 102 HB1 ARG 102 17.575 -8.327 -2.403 734 1HG ARG 102 HG2 ARG 102 16.510 -8.170 -4.620 735 2HG ARG 102 HG1 ARG 102 17.758 -7.046 -5.145 736 1HD ARG 102 HD2 ARG 102 18.228 -9.889 -4.222 737 2HD ARG 102 HD1 ARG 102 18.243 -9.360 -5.899 738 HE ARG 102 HE ARG 102 20.410 -9.185 -3.991 739 1HH1 ARG 102 HH21 ARG 102 18.889 -7.409 -6.524 740 2HH1 ARG 102 HH22 ARG 102 20.230 -6.335 -6.743 741 1HH2 ARG 102 HH11 ARG 102 22.152 -7.800 -4.262 742 2HH2 ARG 102 HH12 ARG 102 22.074 -6.556 -5.463 743 H TRP 103 HN TRP 103 14.990 -5.312 -4.027 744 HA TRP 103 HA TRP 103 12.855 -6.850 -2.675 745 1HB TRP 103 HB2 TRP 103 12.750 -4.741 -4.857 746 2HB TRP 103 HB1 TRP 103 11.340 -5.461 -4.081 747 HD1 TRP 103 HD1 TRP 103 14.054 -2.901 -3.573 748 HE1 TRP 103 HE1 TRP 103 13.671 -1.671 -1.339 749 HE3 TRP 103 HE3 TRP 103 10.353 -5.807 -1.591 750 HZ2 TRP 103 HZ2 TRP 103 12.012 -1.891 0.982 751 HZ3 TRP 103 HZ3 TRP 103 9.390 -5.276 0.630 752 HH2 TRP 103 HH2 TRP 103 10.213 -3.323 1.918 753 H THR 104 HN THR 104 11.521 -8.351 -3.773 754 HA THR 104 HA THR 104 12.389 -9.157 -6.527 755 HB THR 104 HB THR 104 12.218 -11.501 -5.887 756 HG1 THR 104 HG1 THR 104 11.554 -10.408 -3.368 757 1HG2 THR 104 HG22 THR 104 13.958 -9.845 -4.054 758 2HG2 THR 104 HG21 THR 104 14.115 -11.591 -4.244 759 3HG2 THR 104 HG23 THR 104 14.405 -10.523 -5.619 760 H ASN 105 HN ASN 105 10.720 -10.435 -7.649 761 HA ASN 105 HA ASN 105 7.955 -9.642 -6.795 762 1HB ASN 105 HB2 ASN 105 9.026 -10.288 -9.561 763 2HB ASN 105 HB1 ASN 105 7.372 -9.803 -9.184 764 1HD2 ASN 105 HD22 ASN 105 8.648 -6.462 -8.087 765 2HD2 ASN 105 HD21 ASN 105 7.811 -7.730 -7.331 766 H ASN 106 HN ASN 106 9.456 -12.042 -5.904 767 HA ASN 106 HA ASN 106 7.444 -14.063 -6.739 768 1HB ASN 106 HB2 ASN 106 9.469 -15.696 -6.986 769 2HB ASN 106 HB1 ASN 106 9.102 -14.597 -8.316 770 1HD2 ASN 106 HD22 ASN 106 12.471 -13.547 -8.133 771 2HD2 ASN 106 HD21 ASN 106 11.272 -14.298 -9.071 772 H PHE 107 HN PHE 107 8.659 -16.271 -5.490 773 HA PHE 107 HA PHE 107 8.091 -15.664 -2.692 774 1HB PHE 107 HB2 PHE 107 9.152 -18.240 -3.887 775 2HB PHE 107 HB1 PHE 107 8.338 -18.047 -2.336 776 HD1 PHE 107 HD2 PHE 107 5.924 -17.306 -2.284 777 HD2 PHE 107 HD1 PHE 107 7.914 -18.475 -5.906 778 HE1 PHE 107 HE2 PHE 107 3.727 -17.619 -3.390 779 HE2 PHE 107 HE1 PHE 107 5.718 -18.789 -7.013 780 HZ PHE 107 HZ PHE 107 3.624 -18.361 -5.756 781 H ARG 108 HN ARG 108 10.731 -14.876 -4.313 782 HA ARG 108 HA ARG 108 12.917 -16.131 -3.025 783 1HB ARG 108 HB2 ARG 108 12.577 -13.384 -4.227 784 2HB ARG 108 HB1 ARG 108 14.112 -13.913 -3.547 785 1HG ARG 108 HG2 ARG 108 14.128 -15.864 -5.052 786 2HG ARG 108 HG1 ARG 108 12.592 -15.352 -5.745 787 1HD ARG 108 HD2 ARG 108 13.641 -13.238 -6.490 788 2HD ARG 108 HD1 ARG 108 15.175 -13.761 -5.802 789 HE ARG 108 HE ARG 108 14.502 -15.812 -7.535 790 1HH1 ARG 108 HH21 ARG 108 14.779 -12.375 -7.732 791 2HH1 ARG 108 HH22 ARG 108 15.274 -12.380 -9.392 792 1HH2 ARG 108 HH11 ARG 108 15.147 -15.829 -9.703 793 2HH2 ARG 108 HH12 ARG 108 15.482 -14.330 -10.505 794 H GLU 109 HN GLU 109 14.368 -14.040 -1.811 795 HA GLU 109 HA GLU 109 13.851 -14.357 0.877 796 1HB GLU 109 HB2 GLU 109 15.028 -11.960 -0.541 797 2HB GLU 109 HB1 GLU 109 15.061 -12.162 1.210 798 1HG GLU 109 HG2 GLU 109 16.281 -14.285 0.957 799 2HG GLU 109 HG1 GLU 109 16.233 -14.112 -0.798 800 H TYR 110 HN TYR 110 12.861 -11.358 -0.877 801 HA TYR 110 HA TYR 110 10.605 -11.112 1.107 802 1HB TYR 110 HB2 TYR 110 12.289 -8.898 -0.098 803 2HB TYR 110 HB1 TYR 110 10.890 -8.658 0.947 804 HD1 TYR 110 HD2 TYR 110 10.948 -9.460 3.323 805 HD2 TYR 110 HD1 TYR 110 14.420 -9.533 0.795 806 HE1 TYR 110 HE2 TYR 110 12.397 -9.721 5.320 807 HE2 TYR 110 HE1 TYR 110 15.868 -9.791 2.790 808 HH TYR 110 HH TYR 110 14.487 -10.223 6.021 809 H ASN 111 HN ASN 111 8.615 -10.662 0.273 810 HA ASN 111 HA ASN 111 8.364 -10.577 -2.690 811 1HB ASN 111 HB2 ASN 111 6.972 -12.213 -1.530 812 2HB ASN 111 HB1 ASN 111 6.312 -10.955 -0.489 813 1HD2 ASN 111 HD22 ASN 111 3.817 -11.375 -3.174 814 2HD2 ASN 111 HD21 ASN 111 4.378 -12.262 -1.839 815 H LEU 112 HN LEU 112 8.296 -8.589 -3.581 816 HA LEU 112 HA LEU 112 7.983 -6.168 -2.144 817 1HB LEU 112 HB2 LEU 112 9.050 -6.267 -4.344 818 2HB LEU 112 HB1 LEU 112 7.525 -6.740 -5.088 819 HG LEU 112 HG LEU 112 6.526 -4.576 -4.432 820 1HD1 LEU 112 HD11 LEU 112 9.219 -4.218 -3.113 821 2HD1 LEU 112 HD13 LEU 112 8.301 -2.812 -3.651 822 3HD1 LEU 112 HD12 LEU 112 7.614 -3.905 -2.452 823 1HD2 LEU 112 HD23 LEU 112 7.850 -4.908 -6.583 824 2HD2 LEU 112 HD22 LEU 112 7.689 -3.236 -6.045 825 3HD2 LEU 112 HD21 LEU 112 9.198 -4.108 -5.774 826 H HIS 113 HN HIS 113 5.583 -7.944 -4.111 827 HA HIS 113 HA HIS 113 3.478 -6.081 -3.793 828 1HB HIS 113 HB2 HIS 113 3.414 -7.940 -5.410 829 2HB HIS 113 HB1 HIS 113 3.279 -9.090 -4.080 830 HD1 HIS 113 HD1 HIS 113 0.905 -9.821 -4.931 831 HD2 HIS 113 HD2 HIS 113 1.164 -5.813 -3.813 832 HE1 HIS 113 HE1 HIS 113 -1.473 -8.966 -4.765 833 H ARG 114 HN ARG 114 4.364 -8.858 -1.710 834 HA ARG 114 HA ARG 114 2.117 -8.682 0.025 835 1HB ARG 114 HB2 ARG 114 3.695 -10.579 0.055 836 2HB ARG 114 HB1 ARG 114 4.944 -9.520 0.709 837 1HG ARG 114 HG2 ARG 114 3.640 -9.131 2.716 838 2HG ARG 114 HG1 ARG 114 2.282 -10.039 2.060 839 1HD ARG 114 HD2 ARG 114 3.613 -12.076 2.021 840 2HD ARG 114 HD1 ARG 114 5.042 -11.207 2.562 841 HE ARG 114 HE ARG 114 2.930 -12.298 4.206 842 1HH1 ARG 114 HH21 ARG 114 4.951 -9.510 3.925 843 2HH1 ARG 114 HH22 ARG 114 4.679 -9.003 5.559 844 1HH2 ARG 114 HH11 ARG 114 2.579 -11.649 6.316 845 2HH2 ARG 114 HH12 ARG 114 3.340 -10.210 6.908 846 H VAL 115 HN VAL 115 5.303 -7.069 0.249 847 HA VAL 115 HA VAL 115 4.639 -5.680 2.698 848 HB VAL 115 HB VAL 115 6.742 -5.179 0.570 849 1HG1 VAL 115 HG12 VAL 115 6.188 -3.755 3.178 850 2HG1 VAL 115 HG11 VAL 115 7.779 -3.736 2.417 851 3HG1 VAL 115 HG13 VAL 115 6.390 -3.048 1.576 852 1HG2 VAL 115 HG21 VAL 115 6.709 -6.513 3.286 853 2HG2 VAL 115 HG23 VAL 115 7.259 -7.175 1.747 854 3HG2 VAL 115 HG22 VAL 115 8.208 -5.934 2.565 855 H ALA 116 HN ALA 116 4.434 -4.798 -0.755 856 HA ALA 116 HA ALA 116 3.732 -2.072 -0.436 857 1HB ALA 116 HB1 ALA 116 2.702 -4.038 -2.508 858 2HB ALA 116 HB3 ALA 116 2.620 -2.281 -2.635 859 3HB ALA 116 HB2 ALA 116 4.186 -3.094 -2.639 860 H ALA 117 HN ALA 117 1.628 -4.960 -0.509 861 HA ALA 117 HA ALA 117 -0.836 -3.584 -0.152 862 1HB ALA 117 HB1 ALA 117 0.019 -6.343 0.781 863 2HB ALA 117 HB3 ALA 117 -1.645 -5.756 0.813 864 3HB ALA 117 HB2 ALA 117 -0.808 -5.952 -0.727 865 H HIS 118 HN HIS 118 1.523 -4.826 2.209 866 HA HIS 118 HA HIS 118 0.045 -4.195 4.560 867 1HB HIS 118 HB2 HIS 118 2.132 -5.562 4.540 868 2HB HIS 118 HB1 HIS 118 3.057 -4.106 4.170 869 HD1 HIS 118 HD1 HIS 118 0.948 -5.646 6.896 870 HD2 HIS 118 HD2 HIS 118 3.551 -2.434 6.383 871 HE1 HIS 118 HE1 HIS 118 1.358 -4.684 9.204 872 H GLU 119 HN GLU 119 2.443 -2.260 2.739 873 HA GLU 119 HA GLU 119 2.305 0.060 4.401 874 1HB GLU 119 HB2 GLU 119 2.945 -0.270 1.457 875 2HB GLU 119 HB1 GLU 119 3.131 1.254 2.328 876 1HG GLU 119 HG2 GLU 119 4.676 0.167 3.911 877 2HG GLU 119 HG1 GLU 119 4.491 -1.359 3.044 878 H LEU 120 HN LEU 120 0.407 -0.939 1.564 879 HA LEU 120 HA LEU 120 -1.125 1.486 1.370 880 1HB LEU 120 HB2 LEU 120 -1.720 -1.350 0.484 881 2HB LEU 120 HB1 LEU 120 -2.778 0.010 0.127 882 HG LEU 120 HG LEU 120 0.160 -0.062 -0.622 883 1HD1 LEU 120 HD11 LEU 120 -1.091 -1.877 -1.757 884 2HD1 LEU 120 HD13 LEU 120 -2.265 -0.695 -2.335 885 3HD1 LEU 120 HD12 LEU 120 -0.595 -0.625 -2.896 886 1HD2 LEU 120 HD23 LEU 120 -2.141 1.826 -1.120 887 2HD2 LEU 120 HD22 LEU 120 -0.459 2.191 -0.736 888 3HD2 LEU 120 HD21 LEU 120 -0.895 1.665 -2.357 889 H GLY 121 HN GLY 121 -1.597 -1.552 3.151 890 1HA GLY 121 HA2 GLY 121 -4.215 -1.120 4.077 891 2HA GLY 121 HA1 GLY 121 -2.980 -1.972 5.010 892 H HIS 122 HN HIS 122 -1.135 0.135 5.356 893 HA HIS 122 HA HIS 122 -2.344 1.533 7.569 894 1HB HIS 122 HB2 HIS 122 0.295 1.816 6.123 895 2HB HIS 122 HB1 HIS 122 -0.158 2.901 7.438 896 HD1 HIS 122 HD1 HIS 122 -0.997 1.529 9.703 897 HD2 HIS 122 HD2 HIS 122 1.502 -0.498 7.053 898 HE1 HIS 122 HE1 HIS 122 -0.045 -0.435 10.981 899 H SER 123 HN SER 123 -1.566 2.485 4.228 900 HA SER 123 HA SER 123 -2.212 5.248 4.492 901 1HB SER 123 HB2 SER 123 -2.375 5.287 2.101 902 2HB SER 123 HB1 SER 123 -1.140 4.090 2.482 903 HG SER 123 HG SER 123 -3.068 2.590 2.462 904 H LEU 124 HN LEU 124 -4.201 2.385 4.275 905 HA LEU 124 HA LEU 124 -6.670 3.901 3.763 906 1HB LEU 124 HB2 LEU 124 -6.250 1.002 4.552 907 2HB LEU 124 HB1 LEU 124 -7.784 1.710 4.051 908 HG LEU 124 HG LEU 124 -5.276 1.576 2.350 909 1HD1 LEU 124 HD12 LEU 124 -6.528 -0.602 2.841 910 2HD1 LEU 124 HD11 LEU 124 -7.883 0.095 1.953 911 3HD1 LEU 124 HD13 LEU 124 -6.344 -0.181 1.138 912 1HD2 LEU 124 HD23 LEU 124 -8.000 2.809 1.970 913 2HD2 LEU 124 HD22 LEU 124 -6.418 3.439 1.513 914 3HD2 LEU 124 HD21 LEU 124 -7.154 2.150 0.568 915 H GLY 125 HN GLY 125 -4.707 3.489 6.403 916 1HA GLY 125 HA2 GLY 125 -5.136 4.316 8.592 917 2HA GLY 125 HA1 GLY 125 -6.858 4.349 8.222 918 H LEU 126 HN LEU 126 -5.433 1.376 7.349 919 HA LEU 126 HA LEU 126 -6.908 -0.005 9.453 920 1HB LEU 126 HB2 LEU 126 -4.914 -1.047 7.416 921 2HB LEU 126 HB1 LEU 126 -5.903 -2.061 8.462 922 HG LEU 126 HG LEU 126 -7.016 -0.057 6.477 923 1HD1 LEU 126 HD11 LEU 126 -5.768 -2.087 5.517 924 2HD1 LEU 126 HD13 LEU 126 -7.039 -3.073 6.236 925 3HD1 LEU 126 HD12 LEU 126 -7.439 -1.883 4.998 926 1HD2 LEU 126 HD22 LEU 126 -8.234 -2.041 8.399 927 2HD2 LEU 126 HD21 LEU 126 -8.709 -0.373 8.079 928 3HD2 LEU 126 HD23 LEU 126 -9.084 -1.634 6.909 929 H SER 127 HN SER 127 -6.022 -1.130 11.220 930 HA SER 127 HA SER 127 -3.265 -0.271 11.999 931 1HB SER 127 HB2 SER 127 -5.643 -1.250 13.593 932 2HB SER 127 HB1 SER 127 -4.038 -1.057 14.292 933 HG SER 127 HG SER 127 -5.617 0.787 14.368 934 H HIS 128 HN HIS 128 -2.080 -1.986 13.347 935 HA HIS 128 HA HIS 128 -1.757 -4.359 11.756 936 1HB HIS 128 HB2 HIS 128 -0.780 -3.734 14.557 937 2HB HIS 128 HB1 HIS 128 -0.231 -5.091 13.576 938 HD1 HIS 128 HD1 HIS 128 1.371 -2.376 14.561 939 HD2 HIS 128 HD2 HIS 128 0.110 -3.369 10.713 940 HE1 HIS 128 HE1 HIS 128 2.846 -1.074 12.966 941 H SER 129 HN SER 129 -1.736 -6.586 13.052 942 HA SER 129 HA SER 129 -4.028 -6.866 14.891 943 1HB SER 129 HB2 SER 129 -4.969 -6.932 12.544 944 2HB SER 129 HB1 SER 129 -3.989 -8.367 12.258 945 HG SER 129 HG SER 129 -6.352 -8.155 13.490 946 H THR 130 HN THR 130 -4.157 -9.103 15.740 947 HA THR 130 HA THR 130 -1.450 -10.331 15.889 948 HB THR 130 HB THR 130 -2.366 -11.518 17.850 949 HG1 THR 130 HG1 THR 130 -4.451 -11.436 18.311 950 1HG2 THR 130 HG21 THR 130 -1.454 -9.178 18.034 951 2HG2 THR 130 HG23 THR 130 -3.112 -8.585 17.930 952 3HG2 THR 130 HG22 THR 130 -2.621 -9.595 19.290 953 H ASP 131 HN ASP 131 -3.878 -10.670 13.820 954 HA ASP 131 HA ASP 131 -4.277 -13.584 13.975 955 1HB ASP 131 HB2 ASP 131 -6.087 -12.052 13.208 956 2HB ASP 131 HB1 ASP 131 -5.096 -11.623 11.813 957 H ILE 132 HN ILE 132 -2.813 -14.966 13.148 958 HA ILE 132 HA ILE 132 -0.516 -14.202 11.661 959 HB ILE 132 HB ILE 132 -1.888 -16.900 11.858 960 1HG1 ILE 132 HG12 ILE 132 0.485 -15.799 13.390 961 2HG1 ILE 132 HG11 ILE 132 -1.167 -15.757 14.004 962 1HG2 ILE 132 HG23 ILE 132 0.904 -16.113 10.964 963 2HG2 ILE 132 HG22 ILE 132 0.406 -17.767 11.319 964 3HG2 ILE 132 HG21 ILE 132 -0.335 -16.894 9.980 965 1HD1 ILE 132 HD11 ILE 132 0.121 -18.331 13.079 966 2HD1 ILE 132 HD13 ILE 132 0.286 -17.749 14.736 967 3HD1 ILE 132 HD12 ILE 132 -1.310 -18.129 14.089 968 H GLY 133 HN GLY 133 -3.656 -15.473 10.552 969 1HA GLY 133 HA2 GLY 133 -2.837 -15.657 7.781 970 2HA GLY 133 HA1 GLY 133 -4.492 -15.753 8.370 971 H ALA 134 HN ALA 134 -3.023 -12.918 9.513 972 HA ALA 134 HA ALA 134 -4.483 -11.329 7.444 973 1HB ALA 134 HB1 ALA 134 -3.464 -10.661 10.212 974 2HB ALA 134 HB3 ALA 134 -4.057 -9.432 9.095 975 3HB ALA 134 HB2 ALA 134 -5.136 -10.711 9.653 976 H LEU 135 HN LEU 135 -3.416 -9.922 6.098 977 HA LEU 135 HA LEU 135 -0.567 -10.249 5.717 978 1HB LEU 135 HB2 LEU 135 -2.408 -8.096 4.625 979 2HB LEU 135 HB1 LEU 135 -0.817 -8.524 3.995 980 HG LEU 135 HG LEU 135 -3.171 -10.433 4.127 981 1HD1 LEU 135 HD11 LEU 135 -2.026 -8.815 1.835 982 2HD1 LEU 135 HD13 LEU 135 -3.203 -10.115 1.643 983 3HD1 LEU 135 HD12 LEU 135 -3.636 -8.658 2.536 984 1HD2 LEU 135 HD23 LEU 135 -0.345 -10.618 3.068 985 2HD2 LEU 135 HD22 LEU 135 -1.209 -11.756 4.102 986 3HD2 LEU 135 HD21 LEU 135 -1.625 -11.629 2.397 987 H MET 136 HN MET 136 -2.583 -7.955 7.420 988 HA MET 136 HA MET 136 -0.559 -5.933 7.759 989 1HB MET 136 HB2 MET 136 -3.025 -6.506 9.425 990 2HB MET 136 HB1 MET 136 -2.069 -5.027 9.488 991 1HG MET 136 HG2 MET 136 -3.533 -6.071 7.042 992 2HG MET 136 HG1 MET 136 -4.071 -4.739 8.061 993 1HE MET 136 HE3 MET 136 -2.888 -2.800 8.592 994 2HE MET 136 HE2 MET 136 -1.146 -3.068 8.606 995 3HE MET 136 HE1 MET 136 -1.840 -1.882 7.504 996 H TYR 137 HN TYR 137 0.010 -8.862 8.580 997 HA TYR 137 HA TYR 137 0.327 -8.894 11.412 998 1HB TYR 137 HB2 TYR 137 0.507 -10.844 9.705 999 2HB TYR 137 HB1 TYR 137 2.186 -10.341 9.520 1000 HD1 TYR 137 HD2 TYR 137 -0.313 -11.771 11.812 1001 HD2 TYR 137 HD1 TYR 137 3.785 -10.579 11.367 1002 HE1 TYR 137 HE2 TYR 137 0.268 -12.999 13.886 1003 HE2 TYR 137 HE1 TYR 137 4.371 -11.808 13.437 1004 HH TYR 137 HH TYR 137 3.506 -12.812 15.285 1005 HA PRO 138 HA PRO 138 3.605 -5.871 11.762 1006 1HB PRO 138 HB2 PRO 138 4.898 -7.158 14.007 1007 2HB PRO 138 HB1 PRO 138 3.820 -5.756 14.032 1008 1HG PRO 138 HG2 PRO 138 3.230 -8.499 14.843 1009 2HG PRO 138 HG1 PRO 138 2.217 -7.058 15.024 1010 1HD PRO 138 HD2 PRO 138 1.790 -9.207 13.202 1011 2HD PRO 138 HD1 PRO 138 0.923 -7.660 13.235 1012 H SER 139 HN SER 139 4.793 -9.194 12.473 1013 HA SER 139 HA SER 139 7.352 -8.599 11.175 1014 1HB SER 139 HB2 SER 139 7.138 -10.109 13.164 1015 2HB SER 139 HB1 SER 139 6.279 -11.261 12.147 1016 HG SER 139 HG SER 139 8.566 -10.413 10.974 1017 H TYR 140 HN TYR 140 8.178 -9.811 9.342 1018 HA TYR 140 HA TYR 140 6.261 -10.073 7.192 1019 1HB TYR 140 HB2 TYR 140 8.666 -9.424 6.872 1020 2HB TYR 140 HB1 TYR 140 9.128 -11.069 7.309 1021 HD1 TYR 140 HD1 TYR 140 8.647 -12.952 5.837 1022 HD2 TYR 140 HD2 TYR 140 7.522 -8.952 4.752 1023 HE1 TYR 140 HE1 TYR 140 8.251 -13.696 3.506 1024 HE2 TYR 140 HE2 TYR 140 7.124 -9.697 2.417 1025 HH TYR 140 HH TYR 140 7.434 -13.122 1.512 1026 H THR 141 HN THR 141 5.604 -12.065 6.153 1027 HA THR 141 HA THR 141 6.274 -14.598 7.576 1028 HB THR 141 HB THR 141 3.894 -15.216 7.721 1029 HG1 THR 141 HG1 THR 141 2.994 -14.046 6.096 1030 1HG2 THR 141 HG21 THR 141 5.121 -13.849 9.542 1031 2HG2 THR 141 HG23 THR 141 4.169 -12.481 8.964 1032 3HG2 THR 141 HG22 THR 141 3.360 -13.906 9.616 1033 H PHE 142 HN PHE 142 6.222 -16.382 6.229 1034 HA PHE 142 HA PHE 142 6.217 -15.831 3.359 1035 1HB PHE 142 HB2 PHE 142 7.818 -17.415 4.482 1036 2HB PHE 142 HB1 PHE 142 6.458 -18.499 4.776 1037 HD1 PHE 142 HD2 PHE 142 8.650 -17.017 2.226 1038 HD2 PHE 142 HD1 PHE 142 5.346 -19.666 2.935 1039 HE1 PHE 142 HE2 PHE 142 8.878 -17.912 -0.073 1040 HE2 PHE 142 HE1 PHE 142 5.570 -20.563 0.634 1041 HZ PHE 142 HZ PHE 142 7.336 -19.686 -0.872 1042 H SER 143 HN SER 143 4.528 -16.200 1.968 1043 HA SER 143 HA SER 143 2.381 -18.092 2.750 1044 1HB SER 143 HB2 SER 143 0.602 -16.499 2.467 1045 2HB SER 143 HB1 SER 143 1.745 -15.790 3.603 1046 HG SER 143 HG SER 143 1.247 -15.168 0.907 1047 H GLY 144 HN GLY 144 1.332 -18.973 0.942 1048 1HA GLY 144 HA2 GLY 144 2.743 -19.036 -1.510 1049 2HA GLY 144 HA1 GLY 144 1.069 -19.555 -1.317 1050 H ASP 145 HN ASP 145 -0.519 -18.285 -2.197 1051 HA ASP 145 HA ASP 145 0.293 -15.999 -3.825 1052 1HB ASP 145 HB2 ASP 145 -2.064 -15.933 -4.503 1053 2HB ASP 145 HB1 ASP 145 -1.466 -17.593 -4.564 1054 H VAL 146 HN VAL 146 -0.850 -13.877 -3.643 1055 HA VAL 146 HA VAL 146 -1.080 -13.075 -0.782 1056 HB VAL 146 HB VAL 146 -0.908 -11.391 -3.304 1057 1HG1 VAL 146 HG12 VAL 146 -0.903 -10.710 -0.354 1058 2HG1 VAL 146 HG11 VAL 146 -0.355 -9.589 -1.602 1059 3HG1 VAL 146 HG13 VAL 146 -2.030 -10.141 -1.586 1060 1HG2 VAL 146 HG23 VAL 146 1.153 -12.681 -2.822 1061 2HG2 VAL 146 HG22 VAL 146 1.401 -10.955 -2.563 1062 3HG2 VAL 146 HG21 VAL 146 1.168 -12.030 -1.184 1063 H GLN 147 HN GLN 147 -3.113 -13.083 0.024 1064 HA GLN 147 HA GLN 147 -5.349 -12.071 -1.685 1065 1HB GLN 147 HB2 GLN 147 -5.331 -14.625 -0.048 1066 2HB GLN 147 HB1 GLN 147 -6.787 -13.895 -0.727 1067 1HG GLN 147 HG2 GLN 147 -5.832 -14.072 -2.990 1068 2HG GLN 147 HG1 GLN 147 -4.369 -14.795 -2.320 1069 1HE2 GLN 147 HE22 GLN 147 -7.257 -17.278 -3.282 1070 2HE2 GLN 147 HE21 GLN 147 -6.949 -15.768 -3.994 1071 H LEU 148 HN LEU 148 -7.105 -11.184 -0.436 1072 HA LEU 148 HA LEU 148 -6.225 -9.981 2.073 1073 1HB LEU 148 HB2 LEU 148 -8.921 -9.898 0.683 1074 2HB LEU 148 HB1 LEU 148 -8.444 -8.885 2.044 1075 HG LEU 148 HG LEU 148 -7.006 -8.952 -0.628 1076 1HD1 LEU 148 HD13 LEU 148 -9.074 -7.044 0.498 1077 2HD1 LEU 148 HD12 LEU 148 -8.052 -6.661 -0.887 1078 3HD1 LEU 148 HD11 LEU 148 -9.193 -8.003 -0.978 1079 1HD2 LEU 148 HD22 LEU 148 -6.634 -7.424 1.949 1080 2HD2 LEU 148 HD21 LEU 148 -5.419 -8.155 0.900 1081 3HD2 LEU 148 HD23 LEU 148 -6.205 -6.653 0.423 1082 H ALA 149 HN ALA 149 -7.442 -10.186 4.087 1083 HA ALA 149 HA ALA 149 -8.518 -12.954 4.468 1084 1HB ALA 149 HB3 ALA 149 -7.339 -10.958 6.424 1085 2HB ALA 149 HB2 ALA 149 -8.036 -12.511 6.889 1086 3HB ALA 149 HB1 ALA 149 -6.596 -12.459 5.872 1087 H GLN 150 HN GLN 150 -10.358 -13.123 6.015 1088 HA GLN 150 HA GLN 150 -12.514 -11.408 5.305 1089 1HB GLN 150 HB2 GLN 150 -12.847 -13.692 6.182 1090 2HB GLN 150 HB1 GLN 150 -12.234 -13.181 7.753 1091 1HG GLN 150 HG2 GLN 150 -14.080 -11.570 7.972 1092 2HG GLN 150 HG1 GLN 150 -14.681 -12.028 6.378 1093 1HE2 GLN 150 HE22 GLN 150 -16.703 -14.449 7.951 1094 2HE2 GLN 150 HE21 GLN 150 -16.623 -13.108 6.913 1095 H ASP 151 HN ASP 151 -10.340 -11.392 8.114 1096 HA ASP 151 HA ASP 151 -11.658 -9.353 9.595 1097 1HB ASP 151 HB2 ASP 151 -9.821 -10.722 10.514 1098 2HB ASP 151 HB1 ASP 151 -8.686 -9.946 9.409 1099 H ASP 152 HN ASP 152 -9.248 -9.151 6.979 1100 HA ASP 152 HA ASP 152 -9.055 -6.256 7.136 1101 1HB ASP 152 HB2 ASP 152 -8.245 -8.258 5.013 1102 2HB ASP 152 HB1 ASP 152 -7.939 -6.526 4.874 1103 H ILE 153 HN ILE 153 -10.891 -8.532 5.097 1104 HA ILE 153 HA ILE 153 -11.999 -6.545 3.361 1105 HB ILE 153 HB ILE 153 -13.037 -9.265 4.205 1106 1HG1 ILE 153 HG12 ILE 153 -11.727 -8.355 1.625 1107 2HG1 ILE 153 HG11 ILE 153 -10.835 -9.086 2.960 1108 1HG2 ILE 153 HG22 ILE 153 -14.012 -7.290 2.126 1109 2HG2 ILE 153 HG21 ILE 153 -14.383 -9.012 2.036 1110 3HG2 ILE 153 HG23 ILE 153 -14.945 -8.061 3.409 1111 1HD1 ILE 153 HD11 ILE 153 -13.170 -10.377 1.522 1112 2HD1 ILE 153 HD13 ILE 153 -11.472 -10.764 1.245 1113 3HD1 ILE 153 HD12 ILE 153 -12.211 -11.107 2.809 1114 H ASP 154 HN ASP 154 -13.356 -8.069 6.308 1115 HA ASP 154 HA ASP 154 -15.755 -6.533 6.346 1116 1HB ASP 154 HB2 ASP 154 -14.180 -7.844 8.573 1117 2HB ASP 154 HB1 ASP 154 -15.737 -7.057 8.834 1118 H GLY 155 HN GLY 155 -12.551 -5.884 7.731 1119 1HA GLY 155 HA2 GLY 155 -13.258 -3.562 9.215 1120 2HA GLY 155 HA1 GLY 155 -11.640 -3.917 8.621 1121 H ILE 156 HN ILE 156 -11.855 -3.730 5.898 1122 HA ILE 156 HA ILE 156 -12.092 -0.877 5.550 1123 HB ILE 156 HB ILE 156 -10.539 -2.397 4.242 1124 1HG1 ILE 156 HG12 ILE 156 -10.988 -1.160 2.045 1125 2HG1 ILE 156 HG11 ILE 156 -12.418 -0.488 2.825 1126 1HG2 ILE 156 HG21 ILE 156 -12.352 -4.094 3.772 1127 2HG2 ILE 156 HG23 ILE 156 -13.012 -2.964 2.592 1128 3HG2 ILE 156 HG22 ILE 156 -11.393 -3.628 2.371 1129 1HD1 ILE 156 HD13 ILE 156 -9.787 -0.237 4.253 1130 2HD1 ILE 156 HD12 ILE 156 -10.108 0.817 2.879 1131 3HD1 ILE 156 HD11 ILE 156 -11.186 0.837 4.271 1132 H GLN 157 HN GLN 157 -14.163 -3.623 4.654 1133 HA GLN 157 HA GLN 157 -16.078 -2.041 3.197 1134 1HB GLN 157 HB2 GLN 157 -16.307 -4.716 4.602 1135 2HB GLN 157 HB1 GLN 157 -17.611 -4.005 3.646 1136 1HG GLN 157 HG2 GLN 157 -16.125 -3.904 1.682 1137 2HG GLN 157 HG1 GLN 157 -14.821 -4.616 2.632 1138 1HE2 GLN 157 HE22 GLN 157 -17.442 -7.515 2.895 1139 2HE2 GLN 157 HE21 GLN 157 -17.267 -6.207 3.963 1140 H ALA 158 HN ALA 158 -15.813 -3.024 6.606 1141 HA ALA 158 HA ALA 158 -18.330 -2.001 7.468 1142 1HB ALA 158 HB3 ALA 158 -15.698 -2.146 8.977 1143 2HB ALA 158 HB2 ALA 158 -17.275 -1.870 9.715 1144 3HB ALA 158 HB1 ALA 158 -16.931 -3.407 8.922 1145 H ILE 159 HN ILE 159 -15.159 -0.454 7.066 1146 HA ILE 159 HA ILE 159 -15.886 2.093 8.162 1147 HB ILE 159 HB ILE 159 -13.795 1.260 6.135 1148 1HG1 ILE 159 HG12 ILE 159 -13.511 2.160 9.016 1149 2HG1 ILE 159 HG11 ILE 159 -13.641 0.468 8.538 1150 1HG2 ILE 159 HG22 ILE 159 -14.363 3.964 7.357 1151 2HG2 ILE 159 HG21 ILE 159 -12.773 3.530 6.733 1152 3HG2 ILE 159 HG23 ILE 159 -14.165 3.556 5.653 1153 1HD1 ILE 159 HD13 ILE 159 -11.651 0.923 6.972 1154 2HD1 ILE 159 HD12 ILE 159 -11.442 2.431 7.860 1155 3HD1 ILE 159 HD11 ILE 159 -11.301 0.886 8.699 1156 H TYR 160 HN TYR 160 -15.756 0.969 4.760 1157 HA TYR 160 HA TYR 160 -17.319 3.368 3.944 1158 1HB TYR 160 HB2 TYR 160 -15.899 1.203 2.368 1159 2HB TYR 160 HB1 TYR 160 -16.871 2.473 1.622 1160 HD1 TYR 160 HD2 TYR 160 -16.148 4.811 1.662 1161 HD2 TYR 160 HD1 TYR 160 -13.770 1.722 3.469 1162 HE1 TYR 160 HE2 TYR 160 -14.225 6.371 1.798 1163 HE2 TYR 160 HE1 TYR 160 -11.847 3.284 3.605 1164 HH TYR 160 HH TYR 160 -11.642 5.940 3.715 1165 H GLY 161 HN GLY 161 -17.435 -0.072 2.965 1166 1HA GLY 161 HA2 GLY 161 -19.871 -0.881 3.932 1167 2HA GLY 161 HA1 GLY 161 -20.325 0.115 2.548 1168 H ARG 162 HN ARG 162 -21.167 -2.160 1.923 1169 HA ARG 162 HA ARG 162 -19.087 -3.981 0.884 1170 1HB ARG 162 HB2 ARG 162 -22.112 -4.089 0.915 1171 2HB ARG 162 HB1 ARG 162 -21.099 -5.309 0.138 1172 1HG ARG 162 HG2 ARG 162 -20.044 -5.877 2.220 1173 2HG ARG 162 HG1 ARG 162 -20.779 -4.500 3.035 1174 1HD ARG 162 HD2 ARG 162 -21.966 -6.546 3.625 1175 2HD ARG 162 HD1 ARG 162 -23.026 -5.497 2.705 1176 HE ARG 162 HE ARG 162 -21.861 -8.156 1.975 1177 1HH1 ARG 162 HH21 ARG 162 -23.390 -5.296 0.828 1178 2HH1 ARG 162 HH22 ARG 162 -23.784 -5.979 -0.713 1179 1HH2 ARG 162 HH11 ARG 162 -22.376 -9.064 -0.002 1180 2HH2 ARG 162 HH12 ARG 162 -23.217 -8.114 -1.180 1181 H SER 163 HN SER 163 -18.815 -4.432 -1.337 1182 HA SER 163 HA SER 163 -19.413 -2.186 -3.110 1183 1HB SER 163 HB2 SER 163 -18.044 -4.852 -3.548 1184 2HB SER 163 HB1 SER 163 -18.255 -3.654 -4.822 1185 HG SER 163 HG SER 163 -16.286 -3.275 -3.882 1186 H GLN 164 HN GLN 164 -21.761 -2.316 -3.067 1187 HA GLN 164 HA GLN 164 -23.140 -4.700 -3.981 1188 1HB GLN 164 HB2 GLN 164 -24.011 -1.813 -3.690 1189 2HB GLN 164 HB1 GLN 164 -25.100 -3.110 -4.186 1190 1HG GLN 164 HG2 GLN 164 -24.717 -4.301 -2.103 1191 2HG GLN 164 HG1 GLN 164 -23.487 -3.131 -1.620 1192 1HE2 GLN 164 HE22 GLN 164 -26.791 -2.205 -0.051 1193 2HE2 GLN 164 HE21 GLN 164 -25.854 -3.620 -0.038 1194 H ASN 165 HN ASN 165 -23.696 -5.261 -6.065 1195 HA ASN 165 HA ASN 165 -23.578 -3.269 -8.229 1196 1HB ASN 165 HB2 ASN 165 -21.705 -5.648 -8.166 1197 2HB ASN 165 HB1 ASN 165 -21.943 -4.580 -9.550 1198 1HD2 ASN 165 HD22 ASN 165 -19.436 -3.457 -6.613 1199 2HD2 ASN 165 HD21 ASN 165 -20.117 -5.008 -6.690 1200 HA PRO 166 HA PRO 166 -26.578 -6.808 -8.708 1201 1HB PRO 166 HB2 PRO 166 -28.733 -4.975 -9.164 1202 2HB PRO 166 HB1 PRO 166 -28.457 -5.947 -7.713 1203 1HG PRO 166 HG2 PRO 166 -28.127 -3.068 -8.025 1204 2HG PRO 166 HG1 PRO 166 -27.972 -4.033 -6.550 1205 1HD PRO 166 HD2 PRO 166 -25.845 -2.855 -8.126 1206 2HD PRO 166 HD1 PRO 166 -25.690 -3.810 -6.637 1207 H VAL 167 HN VAL 167 -25.286 -7.020 -10.728 1208 HA VAL 167 HA VAL 167 -25.918 -5.255 -12.982 1209 HB VAL 167 HB VAL 167 -24.406 -6.725 -14.238 1210 1HG1 VAL 167 HG13 VAL 167 -23.476 -4.956 -12.734 1211 2HG1 VAL 167 HG12 VAL 167 -23.311 -6.172 -11.470 1212 3HG1 VAL 167 HG11 VAL 167 -22.380 -6.319 -12.959 1213 1HG2 VAL 167 HG22 VAL 167 -24.633 -8.419 -11.746 1214 2HG2 VAL 167 HG21 VAL 167 -24.943 -8.891 -13.418 1215 3HG2 VAL 167 HG23 VAL 167 -23.291 -8.596 -12.877 1216 H GLN 168 HN GLN 168 -27.282 -5.744 -14.686 1217 HA GLN 168 HA GLN 168 -29.223 -7.882 -14.264 1218 1HB GLN 168 HB2 GLN 168 -28.889 -5.990 -16.617 1219 2HB GLN 168 HB1 GLN 168 -30.314 -6.966 -16.273 1220 1HG GLN 168 HG2 GLN 168 -30.875 -5.699 -14.358 1221 2HG GLN 168 HG1 GLN 168 -29.266 -4.991 -14.243 1222 1HE2 GLN 168 HE22 GLN 168 -30.176 -2.215 -16.185 1223 2HE2 GLN 168 HE21 GLN 168 -29.150 -2.886 -15.011 1224 HA PRO 169 HA PRO 169 -27.108 -10.975 -16.669 1225 1HB PRO 169 HB2 PRO 169 -29.429 -11.930 -18.094 1226 2HB PRO 169 HB1 PRO 169 -28.681 -12.640 -16.656 1227 1HG PRO 169 HG2 PRO 169 -31.168 -11.095 -16.838 1228 2HG PRO 169 HG1 PRO 169 -30.537 -12.012 -15.461 1229 1HD PRO 169 HD2 PRO 169 -30.627 -9.181 -15.680 1230 2HD PRO 169 HD1 PRO 169 -29.734 -10.111 -14.460 No H/Q in entry = 1230 Start of MODEL 30 1 1H VAL 1 HT3 VAL 1 -9.636 18.969 12.185 2 2H VAL 1 HT2 VAL 1 -7.970 18.776 11.915 3 3H VAL 1 HT1 VAL 1 -9.071 17.633 11.308 4 HA VAL 1 HA VAL 1 -8.319 16.529 13.148 5 HB VAL 1 HB VAL 1 -7.892 17.758 15.310 6 1HG1 VAL 1 HG12 VAL 1 -6.403 18.557 12.796 7 2HG1 VAL 1 HG11 VAL 1 -5.822 18.932 14.418 8 3HG1 VAL 1 HG13 VAL 1 -6.003 17.252 13.913 9 1HG2 VAL 1 HG21 VAL 1 -9.392 19.691 14.752 10 2HG2 VAL 1 HG23 VAL 1 -7.777 20.192 15.254 11 3HG2 VAL 1 HG22 VAL 1 -8.215 20.206 13.545 12 H LEU 2 HN LEU 2 -11.027 17.981 12.331 13 HA LEU 2 HA LEU 2 -12.620 17.958 14.735 14 1HB LEU 2 HB2 LEU 2 -13.287 17.849 11.788 15 2HB LEU 2 HB1 LEU 2 -14.541 17.773 13.024 16 HG LEU 2 HG LEU 2 -13.803 19.926 13.941 17 1HD1 LEU 2 HD13 LEU 2 -11.660 19.637 11.831 18 2HD1 LEU 2 HD12 LEU 2 -12.112 21.220 12.465 19 3HD1 LEU 2 HD11 LEU 2 -11.470 19.989 13.549 20 1HD2 LEU 2 HD23 LEU 2 -15.402 19.733 11.936 21 2HD2 LEU 2 HD22 LEU 2 -14.644 21.306 12.186 22 3HD2 LEU 2 HD21 LEU 2 -14.031 20.221 10.938 23 H THR 3 HN THR 3 -11.629 15.512 12.435 24 HA THR 3 HA THR 3 -13.534 13.527 13.534 25 HB THR 3 HB THR 3 -12.594 12.033 11.828 26 HG1 THR 3 HG1 THR 3 -10.693 12.414 11.059 27 1HG2 THR 3 HG21 THR 3 -13.199 14.843 10.878 28 2HG2 THR 3 HG23 THR 3 -13.091 13.451 9.801 29 3HG2 THR 3 HG22 THR 3 -14.336 13.506 11.048 30 H GLU 4 HN GLU 4 -12.710 11.480 14.418 31 HA GLU 4 HA GLU 4 -10.603 11.892 16.353 32 1HB GLU 4 HB2 GLU 4 -12.521 10.378 16.758 33 2HB GLU 4 HB1 GLU 4 -11.958 9.325 15.461 34 1HG GLU 4 HG2 GLU 4 -9.865 8.910 16.683 35 2HG GLU 4 HG1 GLU 4 -10.393 9.993 17.972 36 H GLY 5 HN GLY 5 -8.453 11.219 16.267 37 1HA GLY 5 HA2 GLY 5 -6.462 10.376 15.330 38 2HA GLY 5 HA1 GLY 5 -7.458 9.367 14.278 39 H ASN 6 HN ASN 6 -5.979 9.938 12.501 40 HA ASN 6 HA ASN 6 -5.778 12.716 11.682 41 1HB ASN 6 HB2 ASN 6 -5.062 10.110 10.319 42 2HB ASN 6 HB1 ASN 6 -4.791 11.685 9.572 43 1HD2 ASN 6 HD22 ASN 6 -2.136 12.576 11.814 44 2HD2 ASN 6 HD21 ASN 6 -3.343 13.221 10.811 45 HA PRO 7 HA PRO 7 -9.628 12.957 9.480 46 1HB PRO 7 HB2 PRO 7 -8.625 14.388 7.187 47 2HB PRO 7 HB1 PRO 7 -9.446 15.064 8.601 48 1HG PRO 7 HG2 PRO 7 -6.600 15.191 7.925 49 2HG PRO 7 HG1 PRO 7 -7.465 16.041 9.215 50 1HD PRO 7 HD2 PRO 7 -5.657 13.859 9.548 51 2HD PRO 7 HD1 PRO 7 -6.716 14.562 10.790 52 H ARG 8 HN ARG 8 -10.659 11.656 7.947 53 HA ARG 8 HA ARG 8 -8.963 9.747 6.460 54 1HB ARG 8 HB2 ARG 8 -11.967 9.988 6.825 55 2HB ARG 8 HB1 ARG 8 -11.199 8.730 5.856 56 1HG ARG 8 HG2 ARG 8 -9.929 7.986 7.839 57 2HG ARG 8 HG1 ARG 8 -10.712 9.230 8.809 58 1HD ARG 8 HD2 ARG 8 -12.926 8.226 8.191 59 2HD ARG 8 HD1 ARG 8 -12.072 6.906 7.403 60 HE ARG 8 HE ARG 8 -12.626 7.175 10.218 61 1HH1 ARG 8 HH21 ARG 8 -10.071 6.253 8.077 62 2HH1 ARG 8 HH22 ARG 8 -9.207 5.381 9.297 63 1HH2 ARG 8 HH11 ARG 8 -11.516 6.033 11.790 64 2HH2 ARG 8 HH12 ARG 8 -10.025 5.249 11.388 65 H TRP 9 HN TRP 9 -9.600 9.344 4.076 66 HA TRP 9 HA TRP 9 -9.381 11.827 2.636 67 1HB TRP 9 HB2 TRP 9 -10.105 9.043 1.665 68 2HB TRP 9 HB1 TRP 9 -9.725 10.405 0.610 69 HD1 TRP 9 HD1 TRP 9 -8.136 7.940 3.027 70 HE1 TRP 9 HE1 TRP 9 -5.570 8.100 2.831 71 HE3 TRP 9 HE3 TRP 9 -7.733 12.033 -0.002 72 HZ2 TRP 9 HZ2 TRP 9 -3.602 9.746 1.560 73 HZ3 TRP 9 HZ3 TRP 9 -5.506 12.874 -0.690 74 HH2 TRP 9 HH2 TRP 9 -3.443 11.738 0.086 75 H GLU 10 HN GLU 10 -10.994 13.233 2.199 76 HA GLU 10 HA GLU 10 -13.747 12.617 2.838 77 1HB GLU 10 HB2 GLU 10 -12.480 14.966 1.401 78 2HB GLU 10 HB1 GLU 10 -14.187 14.884 1.840 79 1HG GLU 10 HG2 GLU 10 -11.931 14.578 3.839 80 2HG GLU 10 HG1 GLU 10 -12.746 16.108 3.514 81 H GLN 11 HN GLN 11 -11.893 12.824 -0.173 82 HA GLN 11 HA GLN 11 -14.291 12.412 -1.814 83 1HB GLN 11 HB2 GLN 11 -12.698 12.355 -3.698 84 2HB GLN 11 HB1 GLN 11 -12.412 13.759 -2.669 85 1HG GLN 11 HG2 GLN 11 -10.642 12.423 -1.471 86 2HG GLN 11 HG1 GLN 11 -10.846 11.166 -2.692 87 1HE2 GLN 11 HE22 GLN 11 -8.439 12.832 -4.664 88 2HE2 GLN 11 HE21 GLN 11 -8.924 11.387 -3.918 89 H THR 12 HN THR 12 -14.734 10.500 -3.014 90 HA THR 12 HA THR 12 -13.786 8.025 -1.698 91 HB THR 12 HB THR 12 -15.560 6.935 -3.018 92 HG1 THR 12 HG1 THR 12 -16.829 8.239 -4.381 93 1HG2 THR 12 HG21 THR 12 -16.065 8.178 -0.871 94 2HG2 THR 12 HG23 THR 12 -16.601 9.531 -1.867 95 3HG2 THR 12 HG22 THR 12 -17.442 7.983 -1.956 96 H HIS 13 HN HIS 13 -12.782 9.937 -4.217 97 HA HIS 13 HA HIS 13 -11.653 7.615 -5.754 98 1HB HIS 13 HB2 HIS 13 -12.091 10.463 -6.699 99 2HB HIS 13 HB1 HIS 13 -11.577 9.090 -7.681 100 HD1 HIS 13 HD1 HIS 13 -13.428 6.934 -7.359 101 HD2 HIS 13 HD2 HIS 13 -14.807 10.846 -6.954 102 HE1 HIS 13 HE1 HIS 13 -15.941 6.844 -7.666 103 H LEU 14 HN LEU 14 -9.454 7.482 -5.884 104 HA LEU 14 HA LEU 14 -7.806 9.789 -4.901 105 1HB LEU 14 HB2 LEU 14 -7.381 6.846 -4.294 106 2HB LEU 14 HB1 LEU 14 -6.323 8.159 -3.786 107 HG LEU 14 HG LEU 14 -9.259 8.101 -3.054 108 1HD1 LEU 14 HD12 LEU 14 -6.901 6.851 -1.626 109 2HD1 LEU 14 HD11 LEU 14 -8.421 7.230 -0.815 110 3HD1 LEU 14 HD13 LEU 14 -8.393 6.063 -2.137 111 1HD2 LEU 14 HD23 LEU 14 -6.806 9.565 -2.028 112 2HD2 LEU 14 HD22 LEU 14 -8.286 10.259 -2.687 113 3HD2 LEU 14 HD21 LEU 14 -8.307 9.481 -1.110 114 H THR 15 HN THR 15 -5.572 9.726 -5.736 115 HA THR 15 HA THR 15 -5.285 8.151 -8.280 116 HB THR 15 HB THR 15 -4.231 10.111 -9.306 117 HG1 THR 15 HG1 THR 15 -3.539 10.903 -7.153 118 1HG2 THR 15 HG23 THR 15 -6.897 10.741 -8.009 119 2HG2 THR 15 HG22 THR 15 -6.212 11.614 -9.380 120 3HG2 THR 15 HG21 THR 15 -6.655 9.915 -9.548 121 H TYR 16 HN TYR 16 -3.040 7.657 -8.826 122 HA TYR 16 HA TYR 16 -1.034 8.218 -6.697 123 1HB TYR 16 HB2 TYR 16 -0.437 5.893 -6.417 124 2HB TYR 16 HB1 TYR 16 -2.171 6.042 -6.137 125 HD1 TYR 16 HD1 TYR 16 0.432 4.821 -8.439 126 HD2 TYR 16 HD2 TYR 16 -3.794 5.171 -7.746 127 HE1 TYR 16 HE1 TYR 16 0.000 3.160 -10.229 128 HE2 TYR 16 HE2 TYR 16 -4.225 3.511 -9.538 129 HH TYR 16 HH TYR 16 -3.222 1.881 -10.810 130 H ARG 17 HN ARG 17 1.158 7.889 -7.400 131 HA ARG 17 HA ARG 17 1.565 7.325 -10.296 132 1HB ARG 17 HB2 ARG 17 1.215 9.767 -10.124 133 2HB ARG 17 HB1 ARG 17 2.492 9.866 -8.915 134 1HG ARG 17 HG2 ARG 17 4.126 9.014 -10.569 135 2HG ARG 17 HG1 ARG 17 2.845 8.917 -11.777 136 1HD ARG 17 HD2 ARG 17 4.019 10.989 -12.141 137 2HD ARG 17 HD1 ARG 17 2.459 11.393 -11.424 138 HE ARG 17 HE ARG 17 4.143 11.163 -9.240 139 1HH1 ARG 17 HH21 ARG 17 4.171 12.870 -12.236 140 2HH1 ARG 17 HH22 ARG 17 5.053 14.223 -11.609 141 1HH2 ARG 17 HH11 ARG 17 5.289 12.920 -8.402 142 2HH2 ARG 17 HH12 ARG 17 5.684 14.252 -9.436 143 H ILE 18 HN ILE 18 3.505 6.303 -10.661 144 HA ILE 18 HA ILE 18 5.212 5.729 -8.300 145 HB ILE 18 HB ILE 18 5.298 4.631 -11.130 146 1HG1 ILE 18 HG12 ILE 18 4.315 3.312 -8.582 147 2HG1 ILE 18 HG11 ILE 18 3.243 4.096 -9.743 148 1HG2 ILE 18 HG23 ILE 18 6.817 3.982 -8.596 149 2HG2 ILE 18 HG22 ILE 18 6.673 2.827 -9.920 150 3HG2 ILE 18 HG21 ILE 18 7.470 4.377 -10.186 151 1HD1 ILE 18 HD12 ILE 18 5.129 1.807 -10.376 152 2HD1 ILE 18 HD11 ILE 18 3.386 1.659 -10.152 153 3HD1 ILE 18 HD13 ILE 18 4.025 2.580 -11.514 154 H GLU 19 HN GLU 19 6.957 7.022 -7.961 155 HA GLU 19 HA GLU 19 7.786 9.007 -9.865 156 1HB GLU 19 HB2 GLU 19 9.026 7.971 -7.310 157 2HB GLU 19 HB1 GLU 19 9.775 9.245 -8.269 158 1HG GLU 19 HG2 GLU 19 8.458 10.352 -6.604 159 2HG GLU 19 HG1 GLU 19 7.560 10.502 -8.111 160 H ASN 20 HN ASN 20 9.142 5.823 -8.989 161 HA ASN 20 HA ASN 20 10.427 5.651 -11.598 162 1HB ASN 20 HB2 ASN 20 12.735 5.595 -10.829 163 2HB ASN 20 HB1 ASN 20 12.007 7.127 -10.345 164 1HD2 ASN 20 HD22 ASN 20 13.768 5.628 -7.381 165 2HD2 ASN 20 HD21 ASN 20 14.263 6.070 -8.943 166 H TYR 21 HN TYR 21 11.590 3.565 -11.852 167 HA TYR 21 HA TYR 21 10.439 1.463 -10.051 168 1HB TYR 21 HB2 TYR 21 11.429 1.357 -12.916 169 2HB TYR 21 HB1 TYR 21 10.959 -0.066 -11.987 170 HD1 TYR 21 HD1 TYR 21 8.621 -0.428 -11.324 171 HD2 TYR 21 HD2 TYR 21 9.778 2.967 -13.685 172 HE1 TYR 21 HE1 TYR 21 6.244 -0.026 -11.910 173 HE2 TYR 21 HE2 TYR 21 7.402 3.371 -14.269 174 HH TYR 21 HH TYR 21 4.953 1.082 -13.692 175 H THR 22 HN THR 22 11.845 0.130 -8.940 176 HA THR 22 HA THR 22 14.662 0.848 -8.926 177 HB THR 22 HB THR 22 13.785 0.240 -6.808 178 HG1 THR 22 HG1 THR 22 14.792 -2.185 -6.922 179 1HG2 THR 22 HG21 THR 22 12.652 -2.162 -8.254 180 2HG2 THR 22 HG23 THR 22 12.703 -2.041 -6.496 181 3HG2 THR 22 HG22 THR 22 11.765 -0.879 -7.433 182 HA PRO 23 HA PRO 23 15.822 -2.135 -12.056 183 1HB PRO 23 HB2 PRO 23 18.442 -2.678 -11.076 184 2HB PRO 23 HB1 PRO 23 18.004 -1.451 -12.272 185 1HG PRO 23 HG2 PRO 23 18.749 -1.080 -9.442 186 2HG PRO 23 HG1 PRO 23 18.669 0.125 -10.736 187 1HD PRO 23 HD2 PRO 23 16.805 -0.162 -8.609 188 2HD PRO 23 HD1 PRO 23 16.590 0.819 -10.076 189 H ASP 24 HN ASP 24 15.244 -2.780 -8.872 190 HA ASP 24 HA ASP 24 16.347 -5.383 -8.474 191 1HB ASP 24 HB2 ASP 24 13.865 -4.050 -7.361 192 2HB ASP 24 HB1 ASP 24 14.447 -5.624 -6.815 193 H LEU 25 HN LEU 25 13.300 -4.306 -9.954 194 HA LEU 25 HA LEU 25 13.068 -6.970 -11.250 195 1HB LEU 25 HB2 LEU 25 10.916 -5.578 -9.636 196 2HB LEU 25 HB1 LEU 25 10.543 -6.840 -10.800 197 HG LEU 25 HG LEU 25 12.543 -7.264 -8.566 198 1HD1 LEU 25 HD11 LEU 25 9.536 -7.544 -8.543 199 2HD1 LEU 25 HD13 LEU 25 10.559 -8.494 -7.464 200 3HD1 LEU 25 HD12 LEU 25 10.572 -6.734 -7.368 201 1HD2 LEU 25 HD22 LEU 25 11.000 -9.060 -10.458 202 2HD2 LEU 25 HD21 LEU 25 12.741 -8.988 -10.196 203 3HD2 LEU 25 HD23 LEU 25 11.693 -9.681 -8.963 204 HA PRO 26 HA PRO 26 12.242 -4.451 -14.806 205 1HB PRO 26 HB2 PRO 26 10.108 -6.092 -15.874 206 2HB PRO 26 HB1 PRO 26 11.800 -6.049 -16.388 207 1HG PRO 26 HG2 PRO 26 10.447 -8.107 -14.820 208 2HG PRO 26 HG1 PRO 26 12.093 -8.130 -15.473 209 1HD PRO 26 HD2 PRO 26 11.363 -7.835 -12.728 210 2HD PRO 26 HD1 PRO 26 12.984 -7.633 -13.424 211 H ARG 27 HN ARG 27 10.750 -2.805 -15.358 212 HA ARG 27 HA ARG 27 8.847 -2.019 -13.395 213 1HB ARG 27 HB2 ARG 27 8.165 -0.306 -14.990 214 2HB ARG 27 HB1 ARG 27 9.919 -0.481 -15.052 215 1HG ARG 27 HG2 ARG 27 9.605 -2.067 -16.996 216 2HG ARG 27 HG1 ARG 27 7.897 -1.624 -17.001 217 1HD ARG 27 HD2 ARG 27 8.523 0.751 -17.309 218 2HD ARG 27 HD1 ARG 27 10.224 0.286 -17.354 219 HE ARG 27 HE ARG 27 9.078 -1.272 -19.330 220 1HH1 ARG 27 HH21 ARG 27 9.126 2.074 -18.505 221 2HH1 ARG 27 HH22 ARG 27 8.979 2.618 -20.143 222 1HH2 ARG 27 HH11 ARG 27 8.883 -0.583 -21.475 223 2HH2 ARG 27 HH12 ARG 27 8.840 1.113 -21.825 224 H ALA 28 HN ALA 28 8.516 -3.942 -16.327 225 HA ALA 28 HA ALA 28 5.690 -3.881 -16.582 226 1HB ALA 28 HB2 ALA 28 7.252 -4.853 -18.266 227 2HB ALA 28 HB1 ALA 28 7.536 -6.211 -17.177 228 3HB ALA 28 HB3 ALA 28 5.930 -5.947 -17.857 229 H ASP 29 HN ASP 29 7.770 -5.991 -14.601 230 HA ASP 29 HA ASP 29 5.478 -7.532 -13.640 231 1HB ASP 29 HB2 ASP 29 8.385 -7.428 -12.800 232 2HB ASP 29 HB1 ASP 29 7.195 -8.491 -12.048 233 H VAL 30 HN VAL 30 7.272 -4.709 -12.581 234 HA VAL 30 HA VAL 30 6.337 -4.756 -9.845 235 HB VAL 30 HB VAL 30 7.354 -2.511 -11.609 236 1HG1 VAL 30 HG11 VAL 30 6.587 -2.544 -8.682 237 2HG1 VAL 30 HG13 VAL 30 7.682 -1.339 -9.361 238 3HG1 VAL 30 HG12 VAL 30 6.019 -1.444 -9.938 239 1HG2 VAL 30 HG23 VAL 30 8.901 -4.418 -10.932 240 2HG2 VAL 30 HG22 VAL 30 9.429 -2.810 -10.437 241 3HG2 VAL 30 HG21 VAL 30 8.682 -3.893 -9.263 242 H ASP 31 HN ASP 31 5.160 -3.233 -12.838 243 HA ASP 31 HA ASP 31 3.036 -1.736 -11.677 244 1HB ASP 31 HB2 ASP 31 3.313 -3.030 -14.406 245 2HB ASP 31 HB1 ASP 31 1.982 -1.957 -13.971 246 H HIS 32 HN HIS 32 3.165 -5.101 -12.838 247 HA HIS 32 HA HIS 32 0.408 -5.713 -12.456 248 1HB HIS 32 HB2 HIS 32 1.954 -7.216 -13.657 249 2HB HIS 32 HB1 HIS 32 2.805 -7.547 -12.148 250 HD1 HIS 32 HD1 HIS 32 -0.755 -7.788 -13.510 251 HD2 HIS 32 HD2 HIS 32 1.745 -9.704 -10.779 252 HE1 HIS 32 HE1 HIS 32 -2.055 -9.770 -12.619 253 H ALA 33 HN ALA 33 3.176 -6.085 -10.232 254 HA ALA 33 HA ALA 33 1.738 -7.176 -8.045 255 1HB ALA 33 HB1 ALA 33 4.244 -6.975 -8.238 256 2HB ALA 33 HB3 ALA 33 4.078 -5.260 -7.861 257 3HB ALA 33 HB2 ALA 33 3.601 -6.474 -6.674 258 H ILE 34 HN ILE 34 2.497 -3.745 -8.752 259 HA ILE 34 HA ILE 34 0.996 -2.744 -6.495 260 HB ILE 34 HB ILE 34 1.794 -1.360 -9.076 261 1HG1 ILE 34 HG12 ILE 34 3.761 -2.211 -7.914 262 2HG1 ILE 34 HG11 ILE 34 3.680 -0.467 -7.697 263 1HG2 ILE 34 HG22 ILE 34 0.805 -0.315 -6.415 264 2HG2 ILE 34 HG21 ILE 34 1.621 0.701 -7.603 265 3HG2 ILE 34 HG23 ILE 34 0.086 -0.068 -8.007 266 1HD1 ILE 34 HD13 ILE 34 2.372 -1.107 -5.485 267 2HD1 ILE 34 HD12 ILE 34 3.194 -2.651 -5.698 268 3HD1 ILE 34 HD11 ILE 34 4.133 -1.170 -5.526 269 H GLU 35 HN GLU 35 0.228 -3.133 -9.956 270 HA GLU 35 HA GLU 35 -2.348 -1.927 -9.867 271 1HB GLU 35 HB2 GLU 35 -1.203 -2.514 -11.977 272 2HB GLU 35 HB1 GLU 35 -1.400 -4.226 -11.606 273 1HG GLU 35 HG2 GLU 35 -3.851 -3.966 -11.634 274 2HG GLU 35 HG1 GLU 35 -3.670 -2.244 -11.967 275 H LYS 36 HN LYS 36 -1.331 -5.272 -9.219 276 HA LYS 36 HA LYS 36 -3.958 -6.356 -8.941 277 1HB LYS 36 HB2 LYS 36 -1.811 -7.661 -9.178 278 2HB LYS 36 HB1 LYS 36 -1.476 -7.289 -7.486 279 1HG LYS 36 HG2 LYS 36 -3.596 -8.362 -6.824 280 2HG LYS 36 HG1 LYS 36 -3.933 -8.739 -8.514 281 1HD LYS 36 HD2 LYS 36 -1.753 -10.010 -8.578 282 2HD LYS 36 HD1 LYS 36 -1.638 -9.779 -6.833 283 1HE LYS 36 HE2 LYS 36 -3.964 -11.119 -8.244 284 2HE LYS 36 HE1 LYS 36 -2.651 -11.976 -7.436 285 1HZ LYS 36 HZ1 LYS 36 -3.488 -10.177 -5.581 286 2HZ LYS 36 HZ3 LYS 36 -4.938 -10.664 -6.313 287 3HZ LYS 36 HZ2 LYS 36 -3.905 -11.823 -5.623 288 H ALA 37 HN ALA 37 -1.778 -4.893 -6.526 289 HA ALA 37 HA ALA 37 -3.418 -5.517 -4.264 290 1HB ALA 37 HB2 ALA 37 -1.067 -4.793 -4.063 291 2HB ALA 37 HB1 ALA 37 -1.516 -3.187 -4.638 292 3HB ALA 37 HB3 ALA 37 -2.136 -3.777 -3.095 293 H PHE 38 HN PHE 38 -3.238 -2.517 -6.220 294 HA PHE 38 HA PHE 38 -5.225 -1.093 -4.769 295 1HB PHE 38 HB2 PHE 38 -4.209 -0.941 -7.606 296 2HB PHE 38 HB1 PHE 38 -5.541 0.089 -7.083 297 HD1 PHE 38 HD1 PHE 38 -2.218 -1.049 -5.736 298 HD2 PHE 38 HD2 PHE 38 -4.932 2.223 -6.339 299 HE1 PHE 38 HE1 PHE 38 -0.591 0.491 -4.684 300 HE2 PHE 38 HE2 PHE 38 -3.303 3.766 -5.284 301 HZ PHE 38 HZ PHE 38 -1.132 2.899 -4.455 302 H GLN 39 HN GLN 39 -5.550 -3.351 -7.510 303 HA GLN 39 HA GLN 39 -8.350 -2.944 -7.916 304 1HB GLN 39 HB2 GLN 39 -6.572 -5.335 -8.441 305 2HB GLN 39 HB1 GLN 39 -8.263 -5.265 -8.934 306 1HG GLN 39 HG2 GLN 39 -7.826 -3.291 -10.300 307 2HG GLN 39 HG1 GLN 39 -6.156 -3.237 -9.739 308 1HE2 GLN 39 HE22 GLN 39 -6.421 -5.077 -13.056 309 2HE2 GLN 39 HE21 GLN 39 -7.013 -3.570 -12.545 310 H LEU 40 HN LEU 40 -6.594 -5.177 -5.762 311 HA LEU 40 HA LEU 40 -8.853 -6.666 -4.888 312 1HB LEU 40 HB2 LEU 40 -6.274 -5.965 -3.474 313 2HB LEU 40 HB1 LEU 40 -7.467 -7.070 -2.801 314 HG LEU 40 HG LEU 40 -6.189 -7.429 -5.529 315 1HD1 LEU 40 HD11 LEU 40 -5.476 -8.645 -2.843 316 2HD1 LEU 40 HD13 LEU 40 -4.834 -9.198 -4.390 317 3HD1 LEU 40 HD12 LEU 40 -4.464 -7.573 -3.812 318 1HD2 LEU 40 HD23 LEU 40 -8.096 -9.039 -3.831 319 2HD2 LEU 40 HD22 LEU 40 -8.133 -8.739 -5.568 320 3HD2 LEU 40 HD21 LEU 40 -6.977 -9.884 -4.900 321 H TRP 41 HN TRP 41 -7.491 -3.619 -3.619 322 HA TRP 41 HA TRP 41 -9.342 -3.500 -1.399 323 1HB TRP 41 HB2 TRP 41 -7.675 -1.373 -2.765 324 2HB TRP 41 HB1 TRP 41 -8.638 -1.074 -1.318 325 HD1 TRP 41 HD1 TRP 41 -5.294 -2.115 -2.346 326 HE1 TRP 41 HE1 TRP 41 -4.002 -3.177 -0.386 327 HE3 TRP 41 HE3 TRP 41 -9.130 -2.847 0.947 328 HZ2 TRP 41 HZ2 TRP 41 -4.524 -4.203 2.230 329 HZ3 TRP 41 HZ3 TRP 41 -8.703 -3.870 3.163 330 HH2 TRP 41 HH2 TRP 41 -6.407 -4.548 3.809 331 H SER 42 HN SER 42 -9.343 -2.047 -4.646 332 HA SER 42 HA SER 42 -11.772 -0.543 -4.247 333 1HB SER 42 HB2 SER 42 -10.145 -0.012 -6.034 334 2HB SER 42 HB1 SER 42 -10.517 -1.541 -6.824 335 HG SER 42 HG SER 42 -12.606 0.210 -6.167 336 H ASN 43 HN ASN 43 -11.077 -3.788 -5.455 337 HA ASN 43 HA ASN 43 -13.570 -4.453 -6.563 338 1HB ASN 43 HB2 ASN 43 -11.580 -6.152 -5.044 339 2HB ASN 43 HB1 ASN 43 -12.983 -6.821 -5.879 340 1HD2 ASN 43 HD22 ASN 43 -9.986 -6.728 -8.201 341 2HD2 ASN 43 HD21 ASN 43 -10.204 -7.357 -6.639 342 H VAL 44 HN VAL 44 -12.685 -4.213 -3.145 343 HA VAL 44 HA VAL 44 -15.421 -5.208 -2.405 344 HB VAL 44 HB VAL 44 -14.410 -5.426 -0.102 345 1HG1 VAL 44 HG13 VAL 44 -13.230 -6.953 -2.437 346 2HG1 VAL 44 HG12 VAL 44 -13.026 -7.442 -0.755 347 3HG1 VAL 44 HG11 VAL 44 -14.637 -7.397 -1.470 348 1HG2 VAL 44 HG21 VAL 44 -12.506 -3.789 -0.726 349 2HG2 VAL 44 HG23 VAL 44 -12.065 -5.220 0.203 350 3HG2 VAL 44 HG22 VAL 44 -11.759 -5.165 -1.532 351 H THR 45 HN THR 45 -14.156 -2.310 -3.097 352 HA THR 45 HA THR 45 -15.874 -0.973 -1.075 353 HB THR 45 HB THR 45 -14.062 0.818 -0.845 354 HG1 THR 45 HG1 THR 45 -12.837 -0.028 -2.631 355 1HG2 THR 45 HG23 THR 45 -13.602 -1.971 0.237 356 2HG2 THR 45 HG22 THR 45 -12.806 -0.525 0.852 357 3HG2 THR 45 HG21 THR 45 -14.556 -0.693 0.986 358 HA PRO 46 HA PRO 46 -17.020 1.313 -4.732 359 1HB PRO 46 HB2 PRO 46 -17.836 3.722 -3.521 360 2HB PRO 46 HB1 PRO 46 -18.850 2.285 -3.724 361 1HG PRO 46 HG2 PRO 46 -17.561 3.318 -1.259 362 2HG PRO 46 HG1 PRO 46 -18.945 2.225 -1.422 363 1HD PRO 46 HD2 PRO 46 -16.314 1.459 -0.694 364 2HD PRO 46 HD1 PRO 46 -17.623 0.370 -1.207 365 H LEU 47 HN LEU 47 -14.321 1.863 -3.000 366 HA LEU 47 HA LEU 47 -13.603 4.543 -3.844 367 1HB LEU 47 HB2 LEU 47 -11.887 2.240 -2.873 368 2HB LEU 47 HB1 LEU 47 -11.327 3.899 -3.075 369 HG LEU 47 HG LEU 47 -13.617 3.067 -1.266 370 1HD1 LEU 47 HD13 LEU 47 -10.709 3.678 -0.680 371 2HD1 LEU 47 HD12 LEU 47 -11.962 3.624 0.560 372 3HD1 LEU 47 HD11 LEU 47 -11.571 2.173 -0.362 373 1HD2 LEU 47 HD21 LEU 47 -12.316 5.695 -1.963 374 2HD2 LEU 47 HD23 LEU 47 -14.021 5.324 -1.709 375 3HD2 LEU 47 HD22 LEU 47 -12.938 5.464 -0.330 376 H THR 48 HN THR 48 -12.186 5.138 -5.520 377 HA THR 48 HA THR 48 -11.593 3.034 -7.581 378 HB THR 48 HB THR 48 -12.234 4.545 -9.325 379 HG1 THR 48 HG1 THR 48 -11.549 6.489 -8.696 380 1HG2 THR 48 HG21 THR 48 -14.092 3.436 -7.965 381 2HG2 THR 48 HG23 THR 48 -14.317 5.001 -7.184 382 3HG2 THR 48 HG22 THR 48 -14.566 4.839 -8.922 383 H PHE 49 HN PHE 49 -9.564 3.240 -8.555 384 HA PHE 49 HA PHE 49 -7.829 5.500 -7.600 385 1HB PHE 49 HB2 PHE 49 -7.114 2.581 -7.975 386 2HB PHE 49 HB1 PHE 49 -5.945 3.865 -7.660 387 HD1 PHE 49 HD2 PHE 49 -5.851 4.990 -5.491 388 HD2 PHE 49 HD1 PHE 49 -8.698 1.866 -6.255 389 HE1 PHE 49 HE2 PHE 49 -6.318 4.822 -3.062 390 HE2 PHE 49 HE1 PHE 49 -9.166 1.698 -3.825 391 HZ PHE 49 HZ PHE 49 -7.976 3.177 -2.228 392 H THR 50 HN THR 50 -6.965 6.650 -9.226 393 HA THR 50 HA THR 50 -6.791 5.402 -11.955 394 HB THR 50 HB THR 50 -7.304 8.307 -11.241 395 HG1 THR 50 HG1 THR 50 -9.163 7.054 -12.731 396 1HG2 THR 50 HG23 THR 50 -7.071 6.831 -13.874 397 2HG2 THR 50 HG22 THR 50 -7.748 8.452 -13.722 398 3HG2 THR 50 HG21 THR 50 -6.060 8.159 -13.303 399 H LYS 51 HN LYS 51 -4.782 5.368 -12.817 400 HA LYS 51 HA LYS 51 -2.541 6.469 -11.305 401 1HB LYS 51 HB2 LYS 51 -2.459 4.305 -12.598 402 2HB LYS 51 HB1 LYS 51 -2.524 5.255 -14.083 403 1HG LYS 51 HG2 LYS 51 -0.467 6.445 -13.413 404 2HG LYS 51 HG1 LYS 51 -0.399 5.488 -11.932 405 1HD LYS 51 HD2 LYS 51 -0.242 3.420 -13.279 406 2HD LYS 51 HD1 LYS 51 -0.280 4.387 -14.754 407 1HE LYS 51 HE2 LYS 51 1.784 5.552 -14.031 408 2HE LYS 51 HE1 LYS 51 1.834 4.542 -12.585 409 1HZ LYS 51 HZ2 LYS 51 1.564 3.098 -15.077 410 2HZ LYS 51 HZ1 LYS 51 3.037 3.926 -14.895 411 3HZ LYS 51 HZ3 LYS 51 2.561 2.781 -13.738 412 H VAL 52 HN VAL 52 -1.358 8.321 -11.823 413 HA VAL 52 HA VAL 52 -2.305 9.927 -14.186 414 HB VAL 52 HB VAL 52 -1.822 11.947 -12.852 415 1HG1 VAL 52 HG11 VAL 52 -3.685 9.919 -11.588 416 2HG1 VAL 52 HG13 VAL 52 -3.668 11.629 -11.158 417 3HG1 VAL 52 HG12 VAL 52 -4.096 11.136 -12.796 418 1HG2 VAL 52 HG21 VAL 52 -1.084 9.882 -10.768 419 2HG2 VAL 52 HG23 VAL 52 -0.117 11.236 -11.352 420 3HG2 VAL 52 HG22 VAL 52 -1.521 11.534 -10.329 421 H SER 53 HN SER 53 -0.726 10.458 -15.598 422 HA SER 53 HA SER 53 2.060 9.693 -14.967 423 1HB SER 53 HB2 SER 53 0.806 9.196 -17.177 424 2HB SER 53 HB1 SER 53 1.078 10.895 -17.560 425 HG SER 53 HG SER 53 3.264 9.484 -16.602 426 H GLU 54 HN GLU 54 0.201 12.441 -14.590 427 HA GLU 54 HA GLU 54 2.623 14.119 -14.369 428 1HB GLU 54 HB2 GLU 54 1.758 14.310 -16.755 429 2HB GLU 54 HB1 GLU 54 0.298 15.028 -16.079 430 1HG GLU 54 HG2 GLU 54 1.637 16.808 -15.041 431 2HG GLU 54 HG1 GLU 54 3.108 16.088 -15.692 432 H GLY 55 HN GLY 55 2.156 16.131 -13.207 433 1HA GLY 55 HA2 GLY 55 0.907 17.495 -11.722 434 2HA GLY 55 HA1 GLY 55 -0.506 16.482 -12.027 435 H GLN 56 HN GLN 56 -0.148 17.123 -9.447 436 HA GLN 56 HA GLN 56 1.517 15.126 -8.080 437 1HB GLN 56 HB2 GLN 56 -0.444 17.213 -7.087 438 2HB GLN 56 HB1 GLN 56 0.433 16.119 -6.018 439 1HG GLN 56 HG2 GLN 56 2.573 16.964 -6.857 440 2HG GLN 56 HG1 GLN 56 1.731 18.016 -7.995 441 1HE2 GLN 56 HE22 GLN 56 2.568 19.728 -4.641 442 2HE2 GLN 56 HE21 GLN 56 3.507 18.660 -5.567 443 H ALA 57 HN ALA 57 0.742 13.301 -7.009 444 HA ALA 57 HA ALA 57 -2.103 12.538 -7.594 445 1HB ALA 57 HB3 ALA 57 -0.083 11.162 -8.501 446 2HB ALA 57 HB2 ALA 57 0.084 10.598 -6.839 447 3HB ALA 57 HB1 ALA 57 -1.409 10.294 -7.728 448 H ASP 58 HN ASP 58 -3.264 11.442 -5.881 449 HA ASP 58 HA ASP 58 -2.927 12.599 -3.305 450 1HB ASP 58 HB2 ASP 58 -4.447 10.137 -4.198 451 2HB ASP 58 HB1 ASP 58 -4.531 10.785 -2.559 452 H ILE 59 HN ILE 59 -1.872 9.453 -4.598 453 HA ILE 59 HA ILE 59 -0.247 9.064 -2.090 454 HB ILE 59 HB ILE 59 -1.378 6.971 -3.977 455 1HG1 ILE 59 HG12 ILE 59 -2.115 7.502 -1.088 456 2HG1 ILE 59 HG11 ILE 59 -3.011 8.199 -2.439 457 1HG2 ILE 59 HG22 ILE 59 0.305 6.831 -1.466 458 2HG2 ILE 59 HG21 ILE 59 -0.615 5.452 -2.067 459 3HG2 ILE 59 HG23 ILE 59 0.670 6.152 -3.052 460 1HD1 ILE 59 HD11 ILE 59 -3.372 5.893 -3.333 461 2HD1 ILE 59 HD13 ILE 59 -2.586 5.247 -1.892 462 3HD1 ILE 59 HD12 ILE 59 -4.104 6.133 -1.746 463 H MET 60 HN MET 60 1.888 9.344 -2.495 464 HA MET 60 HA MET 60 2.905 8.950 -5.280 465 1HB MET 60 HB2 MET 60 4.124 10.341 -2.879 466 2HB MET 60 HB1 MET 60 4.908 10.179 -4.447 467 1HG MET 60 HG2 MET 60 2.895 11.324 -5.469 468 2HG MET 60 HG1 MET 60 2.338 11.657 -3.830 469 1HE MET 60 HE1 MET 60 5.151 11.668 -6.221 470 2HE MET 60 HE3 MET 60 4.477 13.217 -6.744 471 3HE MET 60 HE2 MET 60 6.061 13.156 -5.976 472 H ILE 61 HN ILE 61 4.146 7.201 -5.718 473 HA ILE 61 HA ILE 61 5.201 5.578 -3.421 474 HB ILE 61 HB ILE 61 4.518 4.769 -6.266 475 1HG1 ILE 61 HG12 ILE 61 3.263 3.908 -3.643 476 2HG1 ILE 61 HG11 ILE 61 2.610 5.198 -4.653 477 1HG2 ILE 61 HG22 ILE 61 5.854 3.323 -3.983 478 2HG2 ILE 61 HG21 ILE 61 4.915 2.426 -5.174 479 3HG2 ILE 61 HG23 ILE 61 6.313 3.370 -5.683 480 1HD1 ILE 61 HD12 ILE 61 2.546 3.536 -6.564 481 2HD1 ILE 61 HD11 ILE 61 2.946 2.280 -5.392 482 3HD1 ILE 61 HD13 ILE 61 1.436 3.179 -5.241 483 H SER 62 HN SER 62 7.405 5.464 -3.242 484 HA SER 62 HA SER 62 9.078 5.893 -5.661 485 1HB SER 62 HB2 SER 62 10.369 7.672 -4.644 486 2HB SER 62 HB1 SER 62 8.673 8.141 -4.610 487 HG SER 62 HG SER 62 9.261 8.466 -2.568 488 H PHE 63 HN PHE 63 11.313 5.302 -5.309 489 HA PHE 63 HA PHE 63 11.690 3.368 -3.045 490 1HB PHE 63 HB2 PHE 63 12.811 3.437 -5.864 491 2HB PHE 63 HB1 PHE 63 13.412 2.354 -4.614 492 HD1 PHE 63 HD1 PHE 63 10.556 3.153 -6.802 493 HD2 PHE 63 HD2 PHE 63 12.049 0.522 -3.751 494 HE1 PHE 63 HE1 PHE 63 8.703 1.564 -7.262 495 HE2 PHE 63 HE2 PHE 63 10.199 -1.062 -4.211 496 HZ PHE 63 HZ PHE 63 8.526 -0.541 -5.965 497 H VAL 64 HN VAL 64 13.359 3.820 -1.641 498 HA VAL 64 HA VAL 64 15.376 5.895 -2.455 499 HB VAL 64 HB VAL 64 15.246 6.818 -0.185 500 1HG1 VAL 64 HG13 VAL 64 13.757 7.637 -2.059 501 2HG1 VAL 64 HG12 VAL 64 12.477 6.625 -1.392 502 3HG1 VAL 64 HG11 VAL 64 13.138 7.954 -0.439 503 1HG2 VAL 64 HG23 VAL 64 13.143 4.669 0.137 504 2HG2 VAL 64 HG22 VAL 64 14.580 4.935 1.124 505 3HG2 VAL 64 HG21 VAL 64 13.232 6.069 1.206 506 H ARG 65 HN ARG 65 17.375 5.827 -1.197 507 HA ARG 65 HA ARG 65 17.988 3.109 -0.066 508 1HB ARG 65 HB2 ARG 65 19.670 4.920 -1.818 509 2HB ARG 65 HB1 ARG 65 20.334 3.550 -0.930 510 1HG ARG 65 HG2 ARG 65 18.813 2.030 -2.082 511 2HG ARG 65 HG1 ARG 65 18.086 3.377 -2.950 512 1HD ARG 65 HD2 ARG 65 20.995 2.556 -3.101 513 2HD ARG 65 HD1 ARG 65 19.790 2.179 -4.325 514 HE ARG 65 HE ARG 65 21.269 4.641 -4.042 515 1HH1 ARG 65 HH21 ARG 65 18.085 3.494 -4.741 516 2HH1 ARG 65 HH22 ARG 65 17.576 4.988 -5.453 517 1HH2 ARG 65 HH11 ARG 65 20.615 6.570 -4.974 518 2HH2 ARG 65 HH12 ARG 65 19.003 6.720 -5.589 519 H GLY 66 HN GLY 66 19.072 3.092 1.865 520 1HA GLY 66 HA2 GLY 66 19.790 3.940 3.934 521 2HA GLY 66 HA1 GLY 66 20.844 4.935 2.933 522 H ASP 67 HN ASP 67 20.710 6.802 4.165 523 HA ASP 67 HA ASP 67 18.245 7.899 5.173 524 1HB ASP 67 HB2 ASP 67 20.515 8.426 6.088 525 2HB ASP 67 HB1 ASP 67 20.852 9.341 4.618 526 H HIS 68 HN HIS 68 16.757 9.136 4.146 527 HA HIS 68 HA HIS 68 17.510 10.505 1.597 528 1HB HIS 68 HB2 HIS 68 15.276 9.787 0.674 529 2HB HIS 68 HB1 HIS 68 16.443 8.483 0.878 530 HD1 HIS 68 HD1 HIS 68 16.207 7.432 3.550 531 HD2 HIS 68 HD2 HIS 68 12.837 8.989 1.654 532 HE1 HIS 68 HE1 HIS 68 14.197 6.437 4.729 533 H ARG 69 HN ARG 69 17.535 12.147 3.508 534 HA ARG 69 HA ARG 69 16.565 14.017 4.513 535 1HB ARG 69 HB2 ARG 69 14.533 13.642 2.288 536 2HB ARG 69 HB1 ARG 69 14.733 15.099 3.259 537 1HG ARG 69 HG2 ARG 69 17.050 15.317 2.461 538 2HG ARG 69 HG1 ARG 69 16.858 13.868 1.479 539 1HD ARG 69 HD2 ARG 69 14.872 15.052 0.386 540 2HD ARG 69 HD1 ARG 69 15.437 16.527 1.163 541 HE ARG 69 HE ARG 69 16.474 15.372 -1.247 542 1HH1 ARG 69 HH21 ARG 69 17.584 16.775 1.711 543 2HH1 ARG 69 HH22 ARG 69 19.182 17.059 1.114 544 1HH2 ARG 69 HH11 ARG 69 18.543 15.755 -2.024 545 2HH2 ARG 69 HH12 ARG 69 19.722 16.491 -0.990 546 H ASP 70 HN ASP 70 15.988 11.669 5.818 547 HA ASP 70 HA ASP 70 13.286 12.269 6.914 548 1HB ASP 70 HB2 ASP 70 14.237 9.564 5.943 549 2HB ASP 70 HB1 ASP 70 12.900 9.751 7.079 550 H ASN 71 HN ASN 71 13.031 11.490 9.109 551 HA ASN 71 HA ASN 71 15.605 11.472 10.560 552 1HB ASN 71 HB2 ASN 71 12.716 11.649 11.452 553 2HB ASN 71 HB1 ASN 71 14.076 11.597 12.576 554 1HD2 ASN 71 HD22 ASN 71 13.190 15.182 11.639 555 2HD2 ASN 71 HD21 ASN 71 12.229 13.885 12.162 556 H SER 72 HN SER 72 14.042 9.123 9.032 557 HA SER 72 HA SER 72 14.690 7.076 11.128 558 1HB SER 72 HB2 SER 72 12.302 7.060 9.264 559 2HB SER 72 HB1 SER 72 12.750 5.757 10.362 560 HG SER 72 HG SER 72 11.359 6.931 11.534 561 HA PRO 73 HA PRO 73 16.743 6.241 6.993 562 1HB PRO 73 HB2 PRO 73 19.231 5.750 8.363 563 2HB PRO 73 HB1 PRO 73 18.844 7.108 7.298 564 1HG PRO 73 HG2 PRO 73 19.156 7.151 10.182 565 2HG PRO 73 HG1 PRO 73 18.827 8.515 9.104 566 1HD PRO 73 HD2 PRO 73 16.987 7.219 10.930 567 2HD PRO 73 HD1 PRO 73 16.670 8.592 9.853 568 H PHE 74 HN PHE 74 17.392 4.072 6.328 569 HA PHE 74 HA PHE 74 16.347 1.969 8.047 570 1HB PHE 74 HB2 PHE 74 17.800 1.900 5.388 571 2HB PHE 74 HB1 PHE 74 17.182 0.459 6.198 572 HD1 PHE 74 HD1 PHE 74 14.711 0.291 6.710 573 HD2 PHE 74 HD2 PHE 74 16.346 3.353 4.180 574 HE1 PHE 74 HE1 PHE 74 12.453 0.733 5.787 575 HE2 PHE 74 HE2 PHE 74 14.087 3.796 3.258 576 HZ PHE 74 HZ PHE 74 12.140 2.487 4.061 577 H ASP 75 HN ASP 75 17.531 0.371 9.145 578 HA ASP 75 HA ASP 75 20.403 1.032 9.635 579 1HB ASP 75 HB2 ASP 75 18.832 0.896 11.584 580 2HB ASP 75 HB1 ASP 75 18.562 -0.804 11.198 581 H GLY 76 HN GLY 76 20.584 -0.061 7.343 582 1HA GLY 76 HA2 GLY 76 21.575 -1.874 6.207 583 2HA GLY 76 HA1 GLY 76 21.730 -2.682 7.769 584 HA PRO 77 HA PRO 77 18.449 -4.791 5.188 585 1HB PRO 77 HB2 PRO 77 19.550 -7.324 6.089 586 2HB PRO 77 HB1 PRO 77 19.513 -6.678 4.443 587 1HG PRO 77 HG2 PRO 77 21.815 -6.930 6.152 588 2HG PRO 77 HG1 PRO 77 21.753 -6.203 4.540 589 1HD PRO 77 HD2 PRO 77 22.014 -4.855 7.108 590 2HD PRO 77 HD1 PRO 77 22.065 -4.135 5.486 591 H GLY 78 HN GLY 78 19.298 -4.287 8.343 592 1HA GLY 78 HA2 GLY 78 17.187 -6.055 9.500 593 2HA GLY 78 HA1 GLY 78 18.416 -5.185 10.421 594 H GLY 79 HN GLY 79 15.859 -4.879 11.285 595 1HA GLY 79 HA2 GLY 79 14.598 -2.991 12.010 596 2HA GLY 79 HA1 GLY 79 15.395 -2.013 10.778 597 H ASN 80 HN ASN 80 13.099 -1.271 10.420 598 HA ASN 80 HA ASN 80 11.152 -3.087 9.300 599 1HB ASN 80 HB2 ASN 80 11.422 -0.069 9.202 600 2HB ASN 80 HB1 ASN 80 10.039 -0.945 8.542 601 1HD2 ASN 80 HD22 ASN 80 9.416 0.027 12.161 602 2HD2 ASN 80 HD21 ASN 80 9.928 0.924 10.814 603 H LEU 81 HN LEU 81 10.568 -3.324 7.069 604 HA LEU 81 HA LEU 81 12.849 -2.963 5.218 605 1HB LEU 81 HB2 LEU 81 10.153 -4.287 4.786 606 2HB LEU 81 HB1 LEU 81 11.530 -4.365 3.689 607 HG LEU 81 HG LEU 81 11.462 -5.419 6.532 608 1HD1 LEU 81 HD11 LEU 81 10.158 -6.697 4.794 609 2HD1 LEU 81 HD13 LEU 81 11.667 -6.924 3.911 610 3HD1 LEU 81 HD12 LEU 81 11.477 -7.612 5.524 611 1HD2 LEU 81 HD22 LEU 81 13.660 -5.103 4.498 612 2HD2 LEU 81 HD21 LEU 81 13.713 -4.885 6.247 613 3HD2 LEU 81 HD23 LEU 81 13.689 -6.509 5.562 614 H ALA 82 HN ALA 82 10.100 -1.218 6.109 615 HA ALA 82 HA ALA 82 10.486 0.758 4.062 616 1HB ALA 82 HB3 ALA 82 8.203 -1.194 3.698 617 2HB ALA 82 HB2 ALA 82 8.200 0.412 2.970 618 3HB ALA 82 HB1 ALA 82 9.446 -0.754 2.527 619 H HIS 83 HN HIS 83 8.400 2.285 4.070 620 HA HIS 83 HA HIS 83 6.753 2.199 6.455 621 1HB HIS 83 HB2 HIS 83 7.729 4.191 7.555 622 2HB HIS 83 HB1 HIS 83 8.885 2.860 7.498 623 HD1 HIS 83 HD1 HIS 83 10.955 3.132 5.993 624 HD2 HIS 83 HD2 HIS 83 8.326 6.359 5.765 625 HE1 HIS 83 HE1 HIS 83 12.173 4.960 4.732 626 H ALA 84 HN ALA 84 5.516 4.347 6.661 627 HA ALA 84 HA ALA 84 5.473 5.973 4.188 628 1HB ALA 84 HB2 ALA 84 3.964 4.068 3.697 629 2HB ALA 84 HB1 ALA 84 3.041 4.435 5.154 630 3HB ALA 84 HB3 ALA 84 3.072 5.584 3.817 631 H PHE 85 HN PHE 85 3.780 7.773 4.457 632 HA PHE 85 HA PHE 85 3.942 8.778 7.257 633 1HB PHE 85 HB2 PHE 85 3.336 10.111 4.607 634 2HB PHE 85 HB1 PHE 85 3.149 10.932 6.156 635 HD1 PHE 85 HD2 PHE 85 5.595 9.275 3.904 636 HD2 PHE 85 HD1 PHE 85 5.037 11.695 7.409 637 HE1 PHE 85 HE2 PHE 85 8.025 9.773 3.948 638 HE2 PHE 85 HE1 PHE 85 7.466 12.191 7.454 639 HZ PHE 85 HZ PHE 85 8.960 11.231 5.723 640 H GLN 86 HN GLN 86 1.994 9.810 8.183 641 HA GLN 86 HA GLN 86 -0.289 8.119 8.034 642 1HB GLN 86 HB2 GLN 86 -0.008 10.932 9.129 643 2HB GLN 86 HB1 GLN 86 -1.376 9.870 9.450 644 1HG GLN 86 HG2 GLN 86 0.171 8.201 10.439 645 2HG GLN 86 HG1 GLN 86 1.515 9.311 10.166 646 1HE2 GLN 86 HE22 GLN 86 -0.310 11.700 12.510 647 2HE2 GLN 86 HE21 GLN 86 -0.086 11.731 10.827 648 HA PRO 87 HA PRO 87 -2.451 9.717 4.495 649 1HB PRO 87 HB2 PRO 87 -5.082 9.720 5.695 650 2HB PRO 87 HB1 PRO 87 -4.391 8.506 4.609 651 1HG PRO 87 HG2 PRO 87 -4.818 8.316 7.496 652 2HG PRO 87 HG1 PRO 87 -4.309 7.045 6.374 653 1HD PRO 87 HD2 PRO 87 -2.671 8.335 8.317 654 2HD PRO 87 HD1 PRO 87 -2.125 7.245 7.027 655 H GLY 88 HN GLY 88 -2.044 11.881 4.156 656 1HA GLY 88 HA2 GLY 88 -3.863 13.865 5.157 657 2HA GLY 88 HA1 GLY 88 -2.318 13.986 5.998 658 HA PRO 89 HA PRO 89 -2.262 16.153 1.760 659 1HB PRO 89 HB2 PRO 89 -1.825 18.712 2.965 660 2HB PRO 89 HB1 PRO 89 -3.294 18.165 2.146 661 1HG PRO 89 HG2 PRO 89 -2.838 18.526 5.025 662 2HG PRO 89 HG1 PRO 89 -4.365 18.248 4.174 663 1HD PRO 89 HD2 PRO 89 -2.946 16.354 5.779 664 2HD PRO 89 HD1 PRO 89 -4.355 16.033 4.746 665 H GLY 90 HN GLY 90 -0.313 17.736 1.175 666 1HA GLY 90 HA2 GLY 90 1.998 18.119 1.164 667 2HA GLY 90 HA1 GLY 90 1.981 17.792 2.895 668 H ILE 91 HN ILE 91 3.457 16.253 3.307 669 HA ILE 91 HA ILE 91 4.203 14.237 1.334 670 HB ILE 91 HB ILE 91 5.787 15.326 2.965 671 1HG1 ILE 91 HG12 ILE 91 5.652 12.313 3.266 672 2HG1 ILE 91 HG11 ILE 91 6.234 13.122 1.812 673 1HG2 ILE 91 HG21 ILE 91 4.121 15.139 4.887 674 2HG2 ILE 91 HG23 ILE 91 4.572 13.437 4.989 675 3HG2 ILE 91 HG22 ILE 91 5.784 14.688 5.265 676 1HD1 ILE 91 HD11 ILE 91 7.380 13.488 4.593 677 2HD1 ILE 91 HD13 ILE 91 8.106 12.522 3.308 678 3HD1 ILE 91 HD12 ILE 91 7.966 14.270 3.125 679 H GLY 92 HN GLY 92 1.709 14.451 3.600 680 1HA GLY 92 HA2 GLY 92 1.582 11.853 4.706 681 2HA GLY 92 HA1 GLY 92 0.174 12.856 4.377 682 H GLY 93 HN GLY 93 0.875 9.887 3.939 683 1HA GLY 93 HA2 GLY 93 -0.199 8.372 2.443 684 2HA GLY 93 HA1 GLY 93 -0.443 9.696 1.305 685 H ASP 94 HN ASP 94 2.580 10.325 1.824 686 HA ASP 94 HA ASP 94 3.534 8.978 -0.526 687 1HB ASP 94 HB2 ASP 94 4.969 10.492 1.666 688 2HB ASP 94 HB1 ASP 94 5.784 9.868 0.230 689 H ALA 95 HN ALA 95 4.378 6.968 -0.733 690 HA ALA 95 HA ALA 95 5.065 5.440 1.756 691 1HB ALA 95 HB1 ALA 95 4.170 4.552 -0.997 692 2HB ALA 95 HB3 ALA 95 4.778 3.436 0.226 693 3HB ALA 95 HB2 ALA 95 3.306 4.360 0.527 694 H HIS 96 HN HIS 96 7.166 4.899 2.064 695 HA HIS 96 HA HIS 96 9.080 5.183 -0.234 696 1HB HIS 96 HB2 HIS 96 9.507 5.424 2.760 697 2HB HIS 96 HB1 HIS 96 10.808 5.444 1.570 698 HD2 HIS 96 HD2 HIS 96 7.955 7.551 0.030 699 HE1 HIS 96 HE1 HIS 96 10.453 10.107 2.333 700 HE2 HIS 96 HE2 HIS 96 8.595 10.020 0.612 701 H PHE 97 HN PHE 97 10.122 3.347 -0.887 702 HA PHE 97 HA PHE 97 9.810 0.870 0.784 703 1HB PHE 97 HB2 PHE 97 10.158 1.322 -2.187 704 2HB PHE 97 HB1 PHE 97 10.404 -0.260 -1.449 705 HD1 PHE 97 HD1 PHE 97 7.918 2.434 -2.049 706 HD2 PHE 97 HD2 PHE 97 8.562 -1.593 -0.699 707 HE1 PHE 97 HE1 PHE 97 5.471 2.024 -2.092 708 HE2 PHE 97 HE2 PHE 97 6.117 -1.999 -0.748 709 HZ PHE 97 HZ PHE 97 4.572 -0.191 -1.444 710 H ASP 98 HN ASP 98 11.650 -0.117 1.559 711 HA ASP 98 HA ASP 98 14.200 1.222 1.344 712 1HB ASP 98 HB2 ASP 98 13.408 -0.270 3.263 713 2HB ASP 98 HB1 ASP 98 13.774 -1.646 2.219 714 H GLU 99 HN GLU 99 15.007 1.314 -0.729 715 HA GLU 99 HA GLU 99 14.829 -0.904 -2.592 716 1HB GLU 99 HB2 GLU 99 14.982 1.593 -3.128 717 2HB GLU 99 HB1 GLU 99 16.696 1.459 -2.779 718 1HG GLU 99 HG2 GLU 99 17.016 -0.147 -4.545 719 2HG GLU 99 HG1 GLU 99 15.277 -0.295 -4.796 720 H ASP 100 HN ASP 100 16.721 -0.541 0.110 721 HA ASP 100 HA ASP 100 19.277 -1.428 -0.945 722 1HB ASP 100 HB2 ASP 100 18.131 -1.362 1.857 723 2HB ASP 100 HB1 ASP 100 19.773 -1.893 1.495 724 H GLU 101 HN GLU 101 16.451 -3.065 0.435 725 HA GLU 101 HA GLU 101 17.807 -5.671 0.437 726 1HB GLU 101 HB2 GLU 101 14.935 -4.839 0.942 727 2HB GLU 101 HB1 GLU 101 15.489 -6.511 1.017 728 1HG GLU 101 HG2 GLU 101 15.594 -5.721 3.261 729 2HG GLU 101 HG1 GLU 101 17.260 -5.695 2.687 730 H ARG 102 HN ARG 102 16.904 -7.518 -0.833 731 HA ARG 102 HA ARG 102 16.447 -6.672 -3.624 732 1HB ARG 102 HB2 ARG 102 18.007 -8.568 -2.976 733 2HB ARG 102 HB1 ARG 102 16.573 -9.496 -2.530 734 1HG ARG 102 HG2 ARG 102 15.685 -9.222 -4.807 735 2HG ARG 102 HG1 ARG 102 17.116 -8.307 -5.268 736 1HD ARG 102 HD2 ARG 102 18.492 -10.319 -4.563 737 2HD ARG 102 HD1 ARG 102 16.987 -11.221 -4.431 738 HE ARG 102 HE ARG 102 18.445 -10.706 -6.839 739 1HH1 ARG 102 HH21 ARG 102 15.192 -10.633 -5.661 740 2HH1 ARG 102 HH22 ARG 102 14.498 -10.627 -7.245 741 1HH2 ARG 102 HH11 ARG 102 17.542 -10.722 -8.882 742 2HH2 ARG 102 HH12 ARG 102 15.819 -10.685 -9.060 743 H TRP 103 HN TRP 103 14.453 -6.565 -4.514 744 HA TRP 103 HA TRP 103 12.136 -7.567 -2.953 745 1HB TRP 103 HB2 TRP 103 12.367 -5.769 -5.380 746 2HB TRP 103 HB1 TRP 103 10.832 -6.265 -4.672 747 HD1 TRP 103 HD1 TRP 103 13.302 -3.605 -4.465 748 HE1 TRP 103 HE1 TRP 103 13.042 -2.240 -2.295 749 HE3 TRP 103 HE3 TRP 103 10.219 -6.711 -1.845 750 HZ2 TRP 103 HZ2 TRP 103 11.703 -2.442 0.223 751 HZ3 TRP 103 HZ3 TRP 103 9.467 -6.103 0.435 752 HH2 TRP 103 HH2 TRP 103 10.203 -3.975 1.473 753 H THR 104 HN THR 104 10.881 -9.255 -3.619 754 HA THR 104 HA THR 104 11.379 -10.438 -6.331 755 HB THR 104 HB THR 104 11.258 -12.669 -5.378 756 HG1 THR 104 HG1 THR 104 9.950 -12.554 -3.685 757 1HG2 THR 104 HG23 THR 104 13.439 -11.320 -5.296 758 2HG2 THR 104 HG22 THR 104 13.115 -11.112 -3.576 759 3HG2 THR 104 HG21 THR 104 13.344 -12.729 -4.241 760 H ASN 105 HN ASN 105 9.517 -11.840 -7.004 761 HA ASN 105 HA ASN 105 6.923 -10.727 -5.977 762 1HB ASN 105 HB2 ASN 105 7.609 -11.874 -8.702 763 2HB ASN 105 HB1 ASN 105 6.040 -11.223 -8.224 764 1HD2 ASN 105 HD22 ASN 105 8.617 -8.662 -9.735 765 2HD2 ASN 105 HD21 ASN 105 8.556 -10.327 -10.060 766 H ASN 106 HN ASN 106 8.496 -13.128 -4.999 767 HA ASN 106 HA ASN 106 6.230 -15.048 -5.145 768 1HB ASN 106 HB2 ASN 106 7.900 -16.915 -5.542 769 2HB ASN 106 HB1 ASN 106 7.639 -15.842 -6.918 770 1HD2 ASN 106 HD22 ASN 106 10.926 -14.445 -5.092 771 2HD2 ASN 106 HD21 ASN 106 9.367 -14.249 -4.453 772 H PHE 107 HN PHE 107 7.484 -17.158 -3.804 773 HA PHE 107 HA PHE 107 7.422 -16.160 -1.084 774 1HB PHE 107 HB2 PHE 107 7.796 -18.517 -0.464 775 2HB PHE 107 HB1 PHE 107 6.529 -18.373 -1.681 776 HD1 PHE 107 HD1 PHE 107 7.020 -18.895 -4.073 777 HD2 PHE 107 HD2 PHE 107 9.874 -19.625 -0.947 778 HE1 PHE 107 HE1 PHE 107 8.296 -20.388 -5.587 779 HE2 PHE 107 HE2 PHE 107 11.150 -21.118 -2.461 780 HZ PHE 107 HZ PHE 107 10.361 -21.500 -4.781 781 H ARG 108 HN ARG 108 9.817 -15.669 -3.149 782 HA ARG 108 HA ARG 108 12.153 -16.777 -1.970 783 1HB ARG 108 HB2 ARG 108 11.700 -14.191 -3.466 784 2HB ARG 108 HB1 ARG 108 13.300 -14.738 -2.987 785 1HG ARG 108 HG2 ARG 108 11.466 -16.546 -4.554 786 2HG ARG 108 HG1 ARG 108 12.451 -15.338 -5.375 787 1HD ARG 108 HD2 ARG 108 14.472 -16.323 -4.222 788 2HD ARG 108 HD1 ARG 108 13.435 -17.622 -3.637 789 HE ARG 108 HE ARG 108 12.983 -17.616 -6.360 790 1HH1 ARG 108 HH21 ARG 108 15.739 -17.726 -4.289 791 2HH1 ARG 108 HH22 ARG 108 16.687 -18.675 -5.385 792 1HH2 ARG 108 HH11 ARG 108 14.200 -18.862 -7.793 793 2HH2 ARG 108 HH12 ARG 108 15.816 -19.317 -7.369 794 H GLU 109 HN GLU 109 13.685 -14.452 -1.309 795 HA GLU 109 HA GLU 109 13.488 -14.359 1.446 796 1HB GLU 109 HB2 GLU 109 14.379 -12.170 -0.447 797 2HB GLU 109 HB1 GLU 109 14.667 -12.143 1.293 798 1HG GLU 109 HG2 GLU 109 15.924 -14.239 1.150 799 2HG GLU 109 HG1 GLU 109 15.583 -14.347 -0.577 800 H TYR 110 HN TYR 110 12.164 -11.736 -0.657 801 HA TYR 110 HA TYR 110 9.964 -11.391 1.354 802 1HB TYR 110 HB2 TYR 110 11.679 -9.190 0.168 803 2HB TYR 110 HB1 TYR 110 10.202 -8.919 1.092 804 HD1 TYR 110 HD2 TYR 110 10.087 -10.119 3.437 805 HD2 TYR 110 HD1 TYR 110 13.724 -9.275 1.311 806 HE1 TYR 110 HE2 TYR 110 11.363 -10.285 5.555 807 HE2 TYR 110 HE1 TYR 110 15.002 -9.440 3.427 808 HH TYR 110 HH TYR 110 14.329 -10.856 5.873 809 H ASN 111 HN ASN 111 7.983 -11.020 0.435 810 HA ASN 111 HA ASN 111 7.841 -11.001 -2.533 811 1HB ASN 111 HB2 ASN 111 6.410 -12.565 -1.180 812 2HB ASN 111 HB1 ASN 111 5.596 -11.158 -0.502 813 1HD2 ASN 111 HD22 ASN 111 3.778 -12.423 -3.592 814 2HD2 ASN 111 HD21 ASN 111 4.335 -13.220 -2.201 815 H LEU 112 HN LEU 112 7.820 -9.029 -3.481 816 HA LEU 112 HA LEU 112 7.504 -6.568 -2.112 817 1HB LEU 112 HB2 LEU 112 8.603 -6.783 -4.310 818 2HB LEU 112 HB1 LEU 112 7.060 -7.188 -5.049 819 HG LEU 112 HG LEU 112 6.177 -4.954 -4.363 820 1HD1 LEU 112 HD13 LEU 112 8.967 -4.720 -3.237 821 2HD1 LEU 112 HD12 LEU 112 8.099 -3.278 -3.763 822 3HD1 LEU 112 HD11 LEU 112 7.430 -4.288 -2.486 823 1HD2 LEU 112 HD22 LEU 112 7.342 -5.439 -6.584 824 2HD2 LEU 112 HD21 LEU 112 7.288 -3.743 -6.102 825 3HD2 LEU 112 HD23 LEU 112 8.772 -4.672 -5.895 826 H HIS 113 HN HIS 113 5.131 -8.501 -3.932 827 HA HIS 113 HA HIS 113 3.020 -6.612 -3.869 828 1HB HIS 113 HB2 HIS 113 3.007 -8.688 -5.231 829 2HB HIS 113 HB1 HIS 113 2.773 -9.628 -3.758 830 HD1 HIS 113 HD1 HIS 113 0.378 -10.400 -4.122 831 HD2 HIS 113 HD2 HIS 113 0.808 -6.275 -4.541 832 HE1 HIS 113 HE1 HIS 113 -1.962 -9.447 -4.315 833 H ARG 114 HN ARG 114 3.775 -9.204 -1.489 834 HA ARG 114 HA ARG 114 1.546 -8.692 0.204 835 1HB ARG 114 HB2 ARG 114 4.305 -9.757 0.854 836 2HB ARG 114 HB1 ARG 114 2.990 -9.693 2.025 837 1HG ARG 114 HG2 ARG 114 1.598 -11.081 0.532 838 2HG ARG 114 HG1 ARG 114 2.926 -11.171 -0.622 839 1HD ARG 114 HD2 ARG 114 4.347 -12.186 1.163 840 2HD ARG 114 HD1 ARG 114 2.959 -12.202 2.238 841 HE ARG 114 HE ARG 114 3.600 -14.140 0.204 842 1HH1 ARG 114 HH21 ARG 114 0.909 -12.398 1.488 843 2HH1 ARG 114 HH22 ARG 114 -0.264 -13.480 0.818 844 1HH2 ARG 114 HH11 ARG 114 2.087 -15.552 -0.651 845 2HH2 ARG 114 HH12 ARG 114 0.400 -15.262 -0.386 846 H VAL 115 HN VAL 115 4.824 -7.273 0.241 847 HA VAL 115 HA VAL 115 4.319 -5.655 2.575 848 HB VAL 115 HB VAL 115 6.381 -5.446 0.365 849 1HG1 VAL 115 HG11 VAL 115 6.012 -3.814 2.888 850 2HG1 VAL 115 HG13 VAL 115 7.558 -3.930 2.048 851 3HG1 VAL 115 HG12 VAL 115 6.164 -3.223 1.234 852 1HG2 VAL 115 HG23 VAL 115 6.515 -6.365 3.255 853 2HG2 VAL 115 HG22 VAL 115 6.564 -7.413 1.837 854 3HG2 VAL 115 HG21 VAL 115 7.884 -6.287 2.147 855 H ALA 116 HN ALA 116 4.074 -5.031 -0.923 856 HA ALA 116 HA ALA 116 3.534 -2.246 -0.762 857 1HB ALA 116 HB3 ALA 116 2.539 -4.322 -2.735 858 2HB ALA 116 HB2 ALA 116 2.349 -2.582 -2.952 859 3HB ALA 116 HB1 ALA 116 3.962 -3.295 -2.908 860 H ALA 117 HN ALA 117 1.274 -5.014 -0.743 861 HA ALA 117 HA ALA 117 -1.116 -3.492 -0.502 862 1HB ALA 117 HB2 ALA 117 -0.872 -6.005 -0.946 863 2HB ALA 117 HB1 ALA 117 -0.667 -6.186 0.796 864 3HB ALA 117 HB3 ALA 117 -2.171 -5.530 0.149 865 H HIS 118 HN HIS 118 1.111 -4.743 1.962 866 HA HIS 118 HA HIS 118 -0.418 -4.041 4.250 867 1HB HIS 118 HB2 HIS 118 1.637 -5.453 4.298 868 2HB HIS 118 HB1 HIS 118 2.601 -4.014 3.966 869 HD1 HIS 118 HD1 HIS 118 -0.053 -5.061 6.501 870 HD2 HIS 118 HD2 HIS 118 3.436 -2.792 6.296 871 HE1 HIS 118 HE1 HIS 118 0.404 -4.240 8.851 872 H GLU 119 HN GLU 119 2.011 -2.144 2.431 873 HA GLU 119 HA GLU 119 1.945 0.153 4.113 874 1HB GLU 119 HB2 GLU 119 2.496 -0.121 1.148 875 2HB GLU 119 HB1 GLU 119 2.701 1.390 2.036 876 1HG GLU 119 HG2 GLU 119 4.284 0.267 3.570 877 2HG GLU 119 HG1 GLU 119 4.099 -1.229 2.653 878 H LEU 120 HN LEU 120 -0.088 -0.767 1.342 879 HA LEU 120 HA LEU 120 -1.555 1.681 1.193 880 1HB LEU 120 HB2 LEU 120 -2.477 -1.145 0.568 881 2HB LEU 120 HB1 LEU 120 -3.310 0.326 0.072 882 HG LEU 120 HG LEU 120 -0.468 -0.397 -0.707 883 1HD1 LEU 120 HD12 LEU 120 -2.291 -1.854 -1.686 884 2HD1 LEU 120 HD11 LEU 120 -2.966 -0.402 -2.423 885 3HD1 LEU 120 HD13 LEU 120 -1.355 -0.955 -2.880 886 1HD2 LEU 120 HD21 LEU 120 -2.273 1.959 -1.250 887 2HD2 LEU 120 HD23 LEU 120 -0.551 1.940 -0.872 888 3HD2 LEU 120 HD22 LEU 120 -1.102 1.471 -2.476 889 H GLY 121 HN GLY 121 -2.001 -1.255 3.139 890 1HA GLY 121 HA2 GLY 121 -4.501 -0.628 4.285 891 2HA GLY 121 HA1 GLY 121 -3.250 -1.565 5.106 892 H HIS 122 HN HIS 122 -1.226 0.388 5.280 893 HA HIS 122 HA HIS 122 -2.107 1.883 7.574 894 1HB HIS 122 HB2 HIS 122 0.366 2.041 5.836 895 2HB HIS 122 HB1 HIS 122 0.112 3.135 7.196 896 HD1 HIS 122 HD1 HIS 122 -0.469 1.810 9.553 897 HD2 HIS 122 HD2 HIS 122 1.531 -0.356 6.605 898 HE1 HIS 122 HE1 HIS 122 0.573 -0.183 10.713 899 H SER 123 HN SER 123 -1.637 2.722 4.161 900 HA SER 123 HA SER 123 -2.130 5.524 4.402 901 1HB SER 123 HB2 SER 123 -2.444 5.511 2.032 902 2HB SER 123 HB1 SER 123 -1.252 4.256 2.361 903 HG SER 123 HG SER 123 -3.616 3.135 2.594 904 H LEU 124 HN LEU 124 -4.297 2.745 4.157 905 HA LEU 124 HA LEU 124 -6.678 4.445 3.901 906 1HB LEU 124 HB2 LEU 124 -6.425 1.468 4.440 907 2HB LEU 124 HB1 LEU 124 -7.916 2.314 4.029 908 HG LEU 124 HG LEU 124 -5.452 2.224 2.261 909 1HD1 LEU 124 HD13 LEU 124 -6.707 0.027 2.612 910 2HD1 LEU 124 HD12 LEU 124 -8.083 0.800 1.826 911 3HD1 LEU 124 HD11 LEU 124 -6.573 0.580 0.943 912 1HD2 LEU 124 HD21 LEU 124 -8.188 3.472 2.010 913 2HD2 LEU 124 HD23 LEU 124 -6.612 4.167 1.626 914 3HD2 LEU 124 HD22 LEU 124 -7.321 2.958 0.563 915 H GLY 125 HN GLY 125 -4.636 3.735 6.404 916 1HA GLY 125 HA2 GLY 125 -4.916 4.418 8.663 917 2HA GLY 125 HA1 GLY 125 -6.646 4.581 8.378 918 H LEU 126 HN LEU 126 -5.472 1.576 7.265 919 HA LEU 126 HA LEU 126 -6.928 0.196 9.388 920 1HB LEU 126 HB2 LEU 126 -5.209 -0.871 7.128 921 2HB LEU 126 HB1 LEU 126 -6.184 -1.873 8.201 922 HG LEU 126 HG LEU 126 -7.294 0.350 6.455 923 1HD1 LEU 126 HD13 LEU 126 -6.335 -1.668 5.238 924 2HD1 LEU 126 HD12 LEU 126 -7.558 -2.638 6.051 925 3HD1 LEU 126 HD11 LEU 126 -8.043 -1.354 4.944 926 1HD2 LEU 126 HD21 LEU 126 -8.493 -1.623 8.395 927 2HD2 LEU 126 HD23 LEU 126 -8.876 0.082 8.160 928 3HD2 LEU 126 HD22 LEU 126 -9.440 -1.113 6.998 929 H SER 127 HN SER 127 -6.054 -0.990 11.090 930 HA SER 127 HA SER 127 -3.137 -0.551 11.626 931 1HB SER 127 HB2 SER 127 -5.485 -1.057 13.470 932 2HB SER 127 HB1 SER 127 -3.809 -1.035 14.010 933 HG SER 127 HG SER 127 -5.108 1.072 12.613 934 H HIS 128 HN HIS 128 -1.978 -2.329 12.681 935 HA HIS 128 HA HIS 128 -2.137 -4.796 11.370 936 1HB HIS 128 HB2 HIS 128 -1.187 -4.375 14.220 937 2HB HIS 128 HB1 HIS 128 -0.721 -5.691 13.144 938 HD1 HIS 128 HD1 HIS 128 1.498 -3.904 14.211 939 HD2 HIS 128 HD2 HIS 128 -0.531 -3.093 10.661 940 HE1 HIS 128 HE1 HIS 128 3.017 -2.407 12.844 941 H SER 129 HN SER 129 -2.552 -6.960 12.705 942 HA SER 129 HA SER 129 -4.888 -6.767 14.501 943 1HB SER 129 HB2 SER 129 -5.906 -6.721 12.254 944 2HB SER 129 HB1 SER 129 -5.037 -8.192 11.827 945 HG SER 129 HG SER 129 -6.375 -9.330 13.018 946 H THR 130 HN THR 130 -5.492 -8.976 15.320 947 HA THR 130 HA THR 130 -3.030 -10.591 15.697 948 HB THR 130 HB THR 130 -4.265 -11.655 17.521 949 HG1 THR 130 HG1 THR 130 -6.341 -10.885 16.091 950 1HG2 THR 130 HG21 THR 130 -3.205 -9.399 17.862 951 2HG2 THR 130 HG23 THR 130 -4.784 -8.672 17.563 952 3HG2 THR 130 HG22 THR 130 -4.549 -9.729 18.955 953 H ASP 131 HN ASP 131 -5.514 -10.571 13.519 954 HA ASP 131 HA ASP 131 -6.070 -13.452 13.483 955 1HB ASP 131 HB2 ASP 131 -7.779 -11.825 12.747 956 2HB ASP 131 HB1 ASP 131 -6.709 -11.290 11.454 957 H ILE 132 HN ILE 132 -4.626 -14.855 12.675 958 HA ILE 132 HA ILE 132 -2.254 -14.145 11.285 959 HB ILE 132 HB ILE 132 -3.743 -16.786 11.377 960 1HG1 ILE 132 HG12 ILE 132 -1.297 -15.879 12.918 961 2HG1 ILE 132 HG11 ILE 132 -2.936 -15.721 13.550 962 1HG2 ILE 132 HG23 ILE 132 -0.988 -16.025 10.387 963 2HG2 ILE 132 HG22 ILE 132 -1.394 -17.673 10.865 964 3HG2 ILE 132 HG21 ILE 132 -2.244 -16.910 9.522 965 1HD1 ILE 132 HD12 ILE 132 -1.711 -18.336 12.625 966 2HD1 ILE 132 HD11 ILE 132 -1.785 -17.813 14.308 967 3HD1 ILE 132 HD13 ILE 132 -3.273 -18.125 13.416 968 H GLY 133 HN GLY 133 -5.416 -15.228 10.060 969 1HA GLY 133 HA2 GLY 133 -4.593 -15.440 7.318 970 2HA GLY 133 HA1 GLY 133 -6.258 -15.268 7.869 971 H ALA 134 HN ALA 134 -4.502 -12.732 9.163 972 HA ALA 134 HA ALA 134 -5.559 -10.890 7.076 973 1HB ALA 134 HB1 ALA 134 -4.376 -10.319 9.811 974 2HB ALA 134 HB3 ALA 134 -5.055 -9.112 8.723 975 3HB ALA 134 HB2 ALA 134 -6.093 -10.357 9.414 976 H LEU 135 HN LEU 135 -4.225 -9.706 5.768 977 HA LEU 135 HA LEU 135 -1.491 -10.534 5.424 978 1HB LEU 135 HB2 LEU 135 -2.910 -8.054 4.394 979 2HB LEU 135 HB1 LEU 135 -1.382 -8.689 3.785 980 HG LEU 135 HG LEU 135 -4.030 -10.171 3.745 981 1HD1 LEU 135 HD11 LEU 135 -2.469 -8.681 1.624 982 2HD1 LEU 135 HD13 LEU 135 -3.718 -9.863 1.232 983 3HD1 LEU 135 HD12 LEU 135 -4.134 -8.406 2.136 984 1HD2 LEU 135 HD21 LEU 135 -1.210 -10.902 2.966 985 2HD2 LEU 135 HD23 LEU 135 -2.427 -11.878 3.790 986 3HD2 LEU 135 HD22 LEU 135 -2.558 -11.586 2.058 987 H MET 136 HN MET 136 -3.035 -7.833 7.076 988 HA MET 136 HA MET 136 -0.589 -6.381 7.565 989 1HB MET 136 HB2 MET 136 -3.162 -6.220 9.149 990 2HB MET 136 HB1 MET 136 -1.918 -4.980 8.999 991 1HG MET 136 HG2 MET 136 -2.376 -5.034 6.478 992 2HG MET 136 HG1 MET 136 -3.810 -5.979 6.863 993 1HE MET 136 HE3 MET 136 -2.019 -2.765 6.708 994 2HE MET 136 HE2 MET 136 -2.975 -1.563 7.567 995 3HE MET 136 HE1 MET 136 -2.005 -2.715 8.476 996 H TYR 137 HN TYR 137 -0.783 -9.325 8.433 997 HA TYR 137 HA TYR 137 -0.790 -9.433 11.272 998 1HB TYR 137 HB2 TYR 137 -0.764 -11.371 9.547 999 2HB TYR 137 HB1 TYR 137 0.987 -11.175 9.554 1000 HD1 TYR 137 HD2 TYR 137 -1.927 -11.626 11.869 1001 HD2 TYR 137 HD1 TYR 137 2.274 -12.245 11.212 1002 HE1 TYR 137 HE2 TYR 137 -1.794 -12.951 13.962 1003 HE2 TYR 137 HE1 TYR 137 2.405 -13.569 13.304 1004 HH TYR 137 HH TYR 137 -0.505 -14.252 15.235 1005 HA PRO 138 HA PRO 138 2.894 -7.040 12.126 1006 1HB PRO 138 HB2 PRO 138 3.663 -8.671 14.411 1007 2HB PRO 138 HB1 PRO 138 2.944 -7.055 14.410 1008 1HG PRO 138 HG2 PRO 138 1.653 -9.570 15.060 1009 2HG PRO 138 HG1 PRO 138 0.953 -7.946 15.108 1010 1HD PRO 138 HD2 PRO 138 0.365 -10.012 13.212 1011 2HD PRO 138 HD1 PRO 138 -0.213 -8.334 13.180 1012 H SER 139 HN SER 139 3.336 -10.578 12.615 1013 HA SER 139 HA SER 139 6.127 -10.388 11.728 1014 1HB SER 139 HB2 SER 139 4.408 -12.803 12.355 1015 2HB SER 139 HB1 SER 139 6.144 -12.837 12.061 1016 HG SER 139 HG SER 139 6.433 -11.545 13.877 1017 H TYR 140 HN TYR 140 6.964 -11.193 9.800 1018 HA TYR 140 HA TYR 140 5.144 -11.206 7.513 1019 1HB TYR 140 HB2 TYR 140 7.402 -10.204 7.362 1020 2HB TYR 140 HB1 TYR 140 8.122 -11.780 7.688 1021 HD1 TYR 140 HD1 TYR 140 8.025 -13.583 6.028 1022 HD2 TYR 140 HD2 TYR 140 6.370 -9.705 5.211 1023 HE1 TYR 140 HE1 TYR 140 7.923 -14.136 3.614 1024 HE2 TYR 140 HE2 TYR 140 6.262 -10.259 2.792 1025 HH TYR 140 HH TYR 140 6.294 -13.140 1.566 1026 H THR 141 HN THR 141 4.317 -13.029 6.524 1027 HA THR 141 HA THR 141 5.622 -15.650 6.940 1028 HB THR 141 HB THR 141 3.417 -16.658 7.675 1029 HG1 THR 141 HG1 THR 141 2.759 -13.999 8.352 1030 1HG2 THR 141 HG21 THR 141 5.345 -16.032 9.227 1031 2HG2 THR 141 HG23 THR 141 4.432 -14.575 9.616 1032 3HG2 THR 141 HG22 THR 141 3.758 -16.162 9.984 1033 H PHE 142 HN PHE 142 5.111 -17.116 5.302 1034 HA PHE 142 HA PHE 142 3.909 -15.971 2.896 1035 1HB PHE 142 HB2 PHE 142 5.897 -17.533 2.904 1036 2HB PHE 142 HB1 PHE 142 4.803 -18.828 3.388 1037 HD1 PHE 142 HD2 PHE 142 5.081 -16.114 0.810 1038 HD2 PHE 142 HD1 PHE 142 3.802 -20.117 1.705 1039 HE1 PHE 142 HE2 PHE 142 4.437 -16.440 -1.563 1040 HE2 PHE 142 HE1 PHE 142 3.159 -20.441 -0.666 1041 HZ PHE 142 HZ PHE 142 3.476 -18.604 -2.301 1042 H SER 143 HN SER 143 1.771 -16.098 2.419 1043 HA SER 143 HA SER 143 0.093 -18.140 3.849 1044 1HB SER 143 HB2 SER 143 -1.746 -16.570 3.668 1045 2HB SER 143 HB1 SER 143 -0.368 -15.734 4.380 1046 HG SER 143 HG SER 143 0.024 -15.354 1.913 1047 H GLY 144 HN GLY 144 1.564 -18.185 1.102 1048 1HA GLY 144 HA2 GLY 144 1.041 -19.355 -0.892 1049 2HA GLY 144 HA1 GLY 144 -0.608 -19.544 -0.297 1050 H ASP 145 HN ASP 145 -2.101 -18.447 -1.460 1051 HA ASP 145 HA ASP 145 -1.264 -16.383 -3.359 1052 1HB ASP 145 HB2 ASP 145 -3.130 -18.106 -3.728 1053 2HB ASP 145 HB1 ASP 145 -4.109 -17.118 -2.643 1054 H VAL 146 HN VAL 146 -2.340 -14.215 -3.365 1055 HA VAL 146 HA VAL 146 -2.456 -13.129 -0.593 1056 HB VAL 146 HB VAL 146 -2.323 -11.719 -3.277 1057 1HG1 VAL 146 HG11 VAL 146 -1.989 -10.709 -0.435 1058 2HG1 VAL 146 HG13 VAL 146 -1.681 -9.757 -1.887 1059 3HG1 VAL 146 HG12 VAL 146 -3.315 -10.313 -1.529 1060 1HG2 VAL 146 HG21 VAL 146 -0.198 -12.402 -1.224 1061 2HG2 VAL 146 HG23 VAL 146 -0.289 -12.984 -2.886 1062 3HG2 VAL 146 HG22 VAL 146 0.050 -11.284 -2.565 1063 H GLN 147 HN GLN 147 -4.490 -13.081 0.261 1064 HA GLN 147 HA GLN 147 -6.708 -11.989 -1.423 1065 1HB GLN 147 HB2 GLN 147 -6.789 -14.517 0.251 1066 2HB GLN 147 HB1 GLN 147 -8.233 -13.693 -0.340 1067 1HG GLN 147 HG2 GLN 147 -7.453 -13.952 -2.658 1068 2HG GLN 147 HG1 GLN 147 -5.987 -14.747 -2.085 1069 1HE2 GLN 147 HE22 GLN 147 -8.617 -17.323 -2.982 1070 2HE2 GLN 147 HE21 GLN 147 -7.960 -16.011 -3.835 1071 H LEU 148 HN LEU 148 -8.350 -10.916 -0.170 1072 HA LEU 148 HA LEU 148 -7.338 -9.718 2.286 1073 1HB LEU 148 HB2 LEU 148 -10.089 -9.507 1.018 1074 2HB LEU 148 HB1 LEU 148 -9.459 -8.469 2.294 1075 HG LEU 148 HG LEU 148 -8.206 -8.759 -0.454 1076 1HD1 LEU 148 HD13 LEU 148 -10.464 -7.652 -0.449 1077 2HD1 LEU 148 HD12 LEU 148 -9.819 -6.447 0.666 1078 3HD1 LEU 148 HD11 LEU 148 -9.156 -6.586 -0.963 1079 1HD2 LEU 148 HD21 LEU 148 -7.554 -7.150 2.015 1080 2HD2 LEU 148 HD23 LEU 148 -6.468 -8.048 0.954 1081 3HD2 LEU 148 HD22 LEU 148 -7.141 -6.510 0.425 1082 H ALA 149 HN ALA 149 -8.499 -9.800 4.349 1083 HA ALA 149 HA ALA 149 -9.776 -12.473 4.826 1084 1HB ALA 149 HB1 ALA 149 -8.145 -10.610 6.553 1085 2HB ALA 149 HB3 ALA 149 -9.187 -11.835 7.280 1086 3HB ALA 149 HB2 ALA 149 -7.871 -12.317 6.211 1087 H GLN 150 HN GLN 150 -11.730 -12.528 6.054 1088 HA GLN 150 HA GLN 150 -13.611 -10.500 5.563 1089 1HB GLN 150 HB2 GLN 150 -14.182 -12.817 6.310 1090 2HB GLN 150 HB1 GLN 150 -13.605 -12.412 7.926 1091 1HG GLN 150 HG2 GLN 150 -16.031 -12.162 7.857 1092 2HG GLN 150 HG1 GLN 150 -15.296 -10.570 8.025 1093 1HE2 GLN 150 HE22 GLN 150 -16.821 -9.386 5.092 1094 2HE2 GLN 150 HE21 GLN 150 -16.123 -9.040 6.600 1095 H ASP 151 HN ASP 151 -11.441 -10.927 8.342 1096 HA ASP 151 HA ASP 151 -12.513 -8.900 10.010 1097 1HB ASP 151 HB2 ASP 151 -10.712 -10.457 10.718 1098 2HB ASP 151 HB1 ASP 151 -9.594 -9.646 9.622 1099 H ASP 152 HN ASP 152 -10.234 -8.713 7.283 1100 HA ASP 152 HA ASP 152 -9.855 -5.842 7.571 1101 1HB ASP 152 HB2 ASP 152 -9.240 -7.788 5.332 1102 2HB ASP 152 HB1 ASP 152 -8.840 -6.072 5.257 1103 H ILE 153 HN ILE 153 -11.895 -7.942 5.533 1104 HA ILE 153 HA ILE 153 -12.988 -5.892 3.877 1105 HB ILE 153 HB ILE 153 -14.359 -8.401 4.905 1106 1HG1 ILE 153 HG12 ILE 153 -12.324 -9.054 3.769 1107 2HG1 ILE 153 HG11 ILE 153 -13.663 -9.352 2.673 1108 1HG2 ILE 153 HG21 ILE 153 -14.969 -6.458 2.681 1109 2HG2 ILE 153 HG23 ILE 153 -15.581 -8.113 2.649 1110 3HG2 ILE 153 HG22 ILE 153 -16.031 -7.033 3.967 1111 1HD1 ILE 153 HD11 ILE 153 -13.145 -6.955 1.781 1112 2HD1 ILE 153 HD13 ILE 153 -11.582 -7.187 2.566 1113 3HD1 ILE 153 HD12 ILE 153 -12.102 -8.291 1.296 1114 H ASP 154 HN ASP 154 -14.211 -7.258 6.940 1115 HA ASP 154 HA ASP 154 -16.479 -5.561 7.179 1116 1HB ASP 154 HB2 ASP 154 -14.770 -6.932 9.266 1117 2HB ASP 154 HB1 ASP 154 -16.266 -6.082 9.653 1118 H GLY 155 HN GLY 155 -13.134 -5.106 8.270 1119 1HA GLY 155 HA2 GLY 155 -13.623 -2.696 9.740 1120 2HA GLY 155 HA1 GLY 155 -12.051 -3.231 9.158 1121 H ILE 156 HN ILE 156 -12.342 -3.141 6.404 1122 HA ILE 156 HA ILE 156 -12.185 -0.300 5.949 1123 HB ILE 156 HB ILE 156 -10.957 -2.134 4.651 1124 1HG1 ILE 156 HG12 ILE 156 -11.136 -0.845 2.484 1125 2HG1 ILE 156 HG11 ILE 156 -12.470 0.057 3.194 1126 1HG2 ILE 156 HG23 ILE 156 -13.109 -3.427 4.227 1127 2HG2 ILE 156 HG22 ILE 156 -13.505 -2.201 3.025 1128 3HG2 ILE 156 HG21 ILE 156 -12.066 -3.200 2.826 1129 1HD1 ILE 156 HD11 ILE 156 -9.982 -0.048 4.834 1130 2HD1 ILE 156 HD13 ILE 156 -9.883 0.870 3.333 1131 3HD1 ILE 156 HD12 ILE 156 -11.091 1.290 4.543 1132 H GLN 157 HN GLN 157 -14.690 -2.723 5.329 1133 HA GLN 157 HA GLN 157 -16.416 -0.960 3.846 1134 1HB GLN 157 HB2 GLN 157 -16.985 -3.449 5.478 1135 2HB GLN 157 HB1 GLN 157 -18.216 -2.606 4.537 1136 1HG GLN 157 HG2 GLN 157 -16.965 -2.966 2.483 1137 2HG GLN 157 HG1 GLN 157 -15.626 -3.680 3.382 1138 1HE2 GLN 157 HE22 GLN 157 -17.907 -6.400 2.062 1139 2HE2 GLN 157 HE21 GLN 157 -17.119 -5.096 1.313 1140 H ALA 158 HN ALA 158 -16.028 -1.695 7.284 1141 HA ALA 158 HA ALA 158 -18.307 -0.304 8.258 1142 1HB ALA 158 HB3 ALA 158 -15.585 -0.809 9.483 1143 2HB ALA 158 HB2 ALA 158 -16.915 -0.066 10.371 1144 3HB ALA 158 HB1 ALA 158 -17.073 -1.714 9.762 1145 H ILE 159 HN ILE 159 -15.027 0.855 7.488 1146 HA ILE 159 HA ILE 159 -15.427 3.517 8.486 1147 HB ILE 159 HB ILE 159 -13.560 2.446 6.348 1148 1HG1 ILE 159 HG12 ILE 159 -12.964 3.301 9.193 1149 2HG1 ILE 159 HG11 ILE 159 -13.357 1.635 8.763 1150 1HG2 ILE 159 HG21 ILE 159 -13.767 5.166 7.661 1151 2HG2 ILE 159 HG23 ILE 159 -12.287 4.597 6.890 1152 3HG2 ILE 159 HG22 ILE 159 -13.757 4.795 5.937 1153 1HD1 ILE 159 HD12 ILE 159 -11.119 3.214 7.467 1154 2HD1 ILE 159 HD11 ILE 159 -10.881 2.127 8.835 1155 3HD1 ILE 159 HD13 ILE 159 -11.448 1.491 7.291 1156 H TYR 160 HN TYR 160 -15.735 2.170 5.175 1157 HA TYR 160 HA TYR 160 -17.084 4.705 4.336 1158 1HB TYR 160 HB2 TYR 160 -15.904 2.411 2.749 1159 2HB TYR 160 HB1 TYR 160 -16.783 3.759 2.025 1160 HD1 TYR 160 HD2 TYR 160 -15.861 6.029 2.040 1161 HD2 TYR 160 HD1 TYR 160 -13.707 2.738 3.765 1162 HE1 TYR 160 HE2 TYR 160 -13.805 7.415 2.119 1163 HE2 TYR 160 HE1 TYR 160 -11.652 4.127 3.849 1164 HH TYR 160 HH TYR 160 -11.291 6.974 2.152 1165 H GLY 161 HN GLY 161 -17.511 1.225 3.567 1166 1HA GLY 161 HA2 GLY 161 -20.052 0.800 4.571 1167 2HA GLY 161 HA1 GLY 161 -20.346 1.643 3.049 1168 H ARG 162 HN ARG 162 -21.418 -0.605 2.712 1169 HA ARG 162 HA ARG 162 -19.472 -2.714 1.943 1170 1HB ARG 162 HB2 ARG 162 -22.499 -2.646 2.097 1171 2HB ARG 162 HB1 ARG 162 -21.577 -4.045 1.545 1172 1HG ARG 162 HG2 ARG 162 -20.383 -4.114 3.704 1173 2HG ARG 162 HG1 ARG 162 -21.306 -2.717 4.259 1174 1HD ARG 162 HD2 ARG 162 -22.516 -5.367 3.417 1175 2HD ARG 162 HD1 ARG 162 -22.265 -4.858 5.086 1176 HE ARG 162 HE ARG 162 -23.744 -2.793 3.955 1177 1HH1 ARG 162 HH21 ARG 162 -24.029 -6.217 4.268 1178 2HH1 ARG 162 HH22 ARG 162 -25.761 -6.200 4.302 1179 1HH2 ARG 162 HH11 ARG 162 -25.999 -2.755 3.996 1180 2HH2 ARG 162 HH12 ARG 162 -26.876 -4.241 4.143 1181 H SER 163 HN SER 163 -19.049 -3.228 -0.193 1182 HA SER 163 HA SER 163 -19.972 -1.358 -2.245 1183 1HB SER 163 HB2 SER 163 -18.149 -3.764 -2.250 1184 2HB SER 163 HB1 SER 163 -18.653 -3.005 -3.757 1185 HG SER 163 HG SER 163 -16.817 -1.971 -3.166 1186 H GLN 164 HN GLN 164 -22.292 -1.864 -2.084 1187 HA GLN 164 HA GLN 164 -23.205 -4.552 -2.755 1188 1HB GLN 164 HB2 GLN 164 -24.662 -1.893 -2.637 1189 2HB GLN 164 HB1 GLN 164 -25.449 -3.452 -2.890 1190 1HG GLN 164 HG2 GLN 164 -24.572 -4.257 -0.734 1191 2HG GLN 164 HG1 GLN 164 -23.771 -2.707 -0.476 1192 1HE2 GLN 164 HE22 GLN 164 -27.138 -2.687 1.225 1193 2HE2 GLN 164 HE21 GLN 164 -25.793 -3.718 1.320 1194 H ASN 165 HN ASN 165 -21.360 -3.297 -4.665 1195 HA ASN 165 HA ASN 165 -22.958 -3.739 -7.095 1196 1HB ASN 165 HB2 ASN 165 -21.736 -1.061 -6.411 1197 2HB ASN 165 HB1 ASN 165 -22.130 -1.529 -8.066 1198 1HD2 ASN 165 HD22 ASN 165 -25.054 -0.130 -5.740 1199 2HD2 ASN 165 HD21 ASN 165 -23.402 0.048 -5.392 1200 HA PRO 166 HA PRO 166 -18.482 -5.035 -7.166 1201 1HB PRO 166 HB2 PRO 166 -19.348 -7.519 -8.404 1202 2HB PRO 166 HB1 PRO 166 -18.602 -7.297 -6.816 1203 1HG PRO 166 HG2 PRO 166 -21.337 -7.985 -7.344 1204 2HG PRO 166 HG1 PRO 166 -20.615 -7.625 -5.769 1205 1HD PRO 166 HD2 PRO 166 -22.413 -5.955 -7.362 1206 2HD PRO 166 HD1 PRO 166 -21.840 -5.683 -5.702 1207 H VAL 167 HN VAL 167 -18.318 -3.374 -8.821 1208 HA VAL 167 HA VAL 167 -19.330 -3.933 -11.522 1209 HB VAL 167 HB VAL 167 -19.272 -1.616 -10.678 1210 1HG1 VAL 167 HG12 VAL 167 -17.222 -1.966 -9.257 1211 2HG1 VAL 167 HG11 VAL 167 -16.256 -1.921 -10.732 1212 3HG1 VAL 167 HG13 VAL 167 -17.169 -0.497 -10.232 1213 1HG2 VAL 167 HG22 VAL 167 -18.922 -2.184 -13.141 1214 2HG2 VAL 167 HG21 VAL 167 -18.325 -0.602 -12.638 1215 3HG2 VAL 167 HG23 VAL 167 -17.198 -1.940 -12.862 1216 H GLN 168 HN GLN 168 -18.032 -4.470 -13.316 1217 HA GLN 168 HA GLN 168 -15.582 -5.905 -12.671 1218 1HB GLN 168 HB2 GLN 168 -16.742 -5.279 -15.402 1219 2HB GLN 168 HB1 GLN 168 -15.586 -6.553 -15.014 1220 1HG GLN 168 HG2 GLN 168 -18.425 -6.364 -13.963 1221 2HG GLN 168 HG1 GLN 168 -17.861 -7.477 -15.210 1222 1HE2 GLN 168 HE22 GLN 168 -15.728 -9.216 -12.706 1223 2HE2 GLN 168 HE21 GLN 168 -15.471 -8.435 -14.191 1224 HA PRO 169 HA PRO 169 -12.740 -2.546 -13.321 1225 1HB PRO 169 HB2 PRO 169 -10.883 -4.110 -14.936 1226 2HB PRO 169 HB1 PRO 169 -10.706 -3.599 -13.251 1227 1HG PRO 169 HG2 PRO 169 -11.322 -6.255 -14.238 1228 2HG PRO 169 HG1 PRO 169 -11.112 -5.744 -12.556 1229 1HD PRO 169 HD2 PRO 169 -13.575 -6.480 -13.835 1230 2HD PRO 169 HD1 PRO 169 -13.367 -5.829 -12.195 No H/Q in entry = 1230
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