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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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645720 |
6pvt ![]() ![]() |
30646 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 52.175 22.819 13.803 2 H2 MET 1 HT2 MET 1 51.048 24.006 13.351 3 H3 MET 1 HT3 MET 1 52.698 24.393 13.452 4 HA MET 1 HA MET 1 53.239 23.134 11.565 5 HB2 MET 1 HB2 MET 1 50.810 21.730 12.346 6 HB3 MET 1 HB1 MET 1 50.825 22.081 10.618 7 HG2 MET 1 HG2 MET 1 52.645 20.737 10.218 8 HG3 MET 1 HG1 MET 1 53.361 21.058 11.797 9 HE1 MET 1 HE1 MET 1 53.514 19.079 13.518 10 HE2 MET 1 HE2 MET 1 51.942 18.710 14.223 11 HE3 MET 1 HE3 MET 1 52.396 20.386 13.931 12 H PHE 2 HN PHE 2 52.686 23.695 9.322 13 HA PHE 2 HA PHE 2 51.900 26.378 9.049 14 HB2 PHE 2 HB2 PHE 2 53.326 25.360 7.393 15 HB3 PHE 2 HB1 PHE 2 52.094 24.160 6.999 16 HD1 PHE 2 HD1 PHE 2 52.767 27.836 7.012 17 HD2 PHE 2 HD2 PHE 2 50.431 24.618 5.387 18 HE1 PHE 2 HE1 PHE 2 51.777 29.391 5.353 19 HE2 PHE 2 HE2 PHE 2 49.441 26.174 3.728 20 HZ PHE 2 HZ PHE 2 50.115 28.561 3.711 21 H GLU 3 HN GLU 3 50.150 23.381 8.261 22 HA GLU 3 HA GLU 3 47.775 24.786 7.495 23 HB2 GLU 3 HB2 GLU 3 48.321 21.864 8.047 24 HB3 GLU 3 HB1 GLU 3 46.756 22.475 7.520 25 HG2 GLU 3 HG2 GLU 3 47.764 21.905 5.491 26 HG3 GLU 3 HG1 GLU 3 48.115 23.627 5.618 27 HA PRO 4 HA PRO 4 45.576 25.400 11.257 28 HB2 PRO 4 HB2 PRO 4 43.399 23.651 10.196 29 HB3 PRO 4 HB1 PRO 4 43.313 25.313 10.808 30 HG2 PRO 4 HG2 PRO 4 43.178 24.778 8.203 31 HG3 PRO 4 HG1 PRO 4 43.994 26.226 8.817 32 HD2 PRO 4 HD2 PRO 4 45.169 23.734 7.705 33 HD3 PRO 4 HD1 PRO 4 45.789 25.394 7.653 34 H PHE 5 HN PHE 5 45.542 22.075 10.021 35 HA PHE 5 HA PHE 5 46.417 21.025 12.556 36 HB2 PHE 5 HB2 PHE 5 43.609 21.155 12.067 37 HB3 PHE 5 HB1 PHE 5 44.098 19.463 11.972 38 HD1 PHE 5 HD1 PHE 5 43.957 22.455 14.125 39 HD2 PHE 5 HD2 PHE 5 45.027 18.302 13.893 40 HE1 PHE 5 HE1 PHE 5 44.134 22.362 16.597 41 HE2 PHE 5 HE2 PHE 5 45.205 18.209 16.364 42 HZ PHE 5 HZ PHE 5 44.758 20.239 17.717 43 H GLN 6 HN GLN 6 44.501 19.635 9.880 44 HA GLN 6 HA GLN 6 46.823 18.422 8.674 45 HB2 GLN 6 HB2 GLN 6 46.160 16.984 10.742 46 HB3 GLN 6 HB1 GLN 6 44.790 16.483 9.748 47 HG2 GLN 6 HG2 GLN 6 46.276 15.691 8.000 48 HG3 GLN 6 HG1 GLN 6 47.682 16.321 8.858 49 HE21 GLN 6 HE21 GLN 6 48.454 15.131 10.720 50 HE22 GLN 6 HE22 GLN 6 47.878 13.579 11.091 51 H ILE 7 HN ILE 7 46.234 17.177 6.742 52 HA ILE 7 HA ILE 7 44.269 18.473 5.193 53 HB ILE 7 HB ILE 7 45.729 15.853 4.791 54 HG12 ILE 7 HG12 ILE 7 46.074 18.544 3.439 55 HG13 ILE 7 HG11 ILE 7 47.016 18.040 4.843 56 HG21 ILE 7 HG21 ILE 7 43.698 15.736 3.487 57 HG22 ILE 7 HG22 ILE 7 45.009 16.158 2.385 58 HG23 ILE 7 HG23 ILE 7 43.892 17.403 2.944 59 HD11 ILE 7 HD11 ILE 7 48.327 17.493 2.905 60 HD12 ILE 7 HD12 ILE 7 46.945 16.738 2.110 61 HD13 ILE 7 HD13 ILE 7 47.676 15.973 3.521 62 H LEU 8 HN LEU 8 44.257 15.380 6.884 63 HA LEU 8 HA LEU 8 41.687 14.531 5.965 64 HB2 LEU 8 HB2 LEU 8 43.393 13.690 8.311 65 HB3 LEU 8 HB1 LEU 8 41.830 12.954 7.954 66 HG LEU 8 HG LEU 8 44.014 13.158 5.874 67 HD11 LEU 8 HD11 LEU 8 43.432 10.840 7.746 68 HD12 LEU 8 HD12 LEU 8 44.849 11.886 7.843 69 HD13 LEU 8 HD13 LEU 8 44.615 10.846 6.437 70 HD21 LEU 8 HD21 LEU 8 41.830 12.710 4.954 71 HD22 LEU 8 HD22 LEU 8 41.481 11.525 6.212 72 HD23 LEU 8 HD23 LEU 8 42.692 11.173 4.980 73 H SER 9 HN SER 9 42.804 16.415 8.673 74 HA SER 9 HA SER 9 40.314 16.433 10.104 75 HB2 SER 9 HB2 SER 9 42.407 16.876 11.270 76 HB3 SER 9 HB1 SER 9 42.688 18.303 10.276 77 HG SER 9 HG SER 9 40.824 19.218 11.158 78 H ILE 10 HN ILE 10 41.893 18.672 7.850 79 HA ILE 10 HA ILE 10 39.938 20.717 8.004 80 HB ILE 10 HB ILE 10 41.911 19.994 5.831 81 HG12 ILE 10 HG12 ILE 10 41.987 22.290 7.794 82 HG13 ILE 10 HG11 ILE 10 42.704 20.725 8.169 83 HG21 ILE 10 HG21 ILE 10 40.108 22.404 6.187 84 HG22 ILE 10 HG22 ILE 10 40.137 21.289 4.822 85 HG23 ILE 10 HG23 ILE 10 41.495 22.378 5.099 86 HD11 ILE 10 HD11 ILE 10 43.528 22.740 6.097 87 HD12 ILE 10 HD12 ILE 10 43.882 21.033 5.818 88 HD13 ILE 10 HD13 ILE 10 44.525 21.844 7.243 89 H CYS 11 HN CYS 11 40.392 17.994 5.752 90 HA CYS 11 HA CYS 11 38.257 18.602 4.027 91 HB2 CYS 11 HB2 CYS 11 39.547 15.974 4.768 92 HB3 CYS 11 HB1 CYS 11 38.324 16.130 3.506 93 HG CYS 11 HG CYS 11 40.159 16.840 2.011 94 H SER 12 HN SER 12 38.360 16.370 6.833 95 HA SER 12 HA SER 12 35.664 15.618 6.739 96 HB2 SER 12 HB2 SER 12 37.554 15.847 9.083 97 HB3 SER 12 HB1 SER 12 35.976 15.070 9.162 98 HG SER 12 HG SER 12 36.687 13.632 7.549 99 H PHE 13 HN PHE 13 37.243 18.379 8.262 100 HA PHE 13 HA PHE 13 35.076 19.328 9.789 101 HB2 PHE 13 HB2 PHE 13 37.300 20.222 10.110 102 HB3 PHE 13 HB1 PHE 13 37.339 20.825 8.453 103 HD1 PHE 13 HD1 PHE 13 35.738 21.226 11.773 104 HD2 PHE 13 HD2 PHE 13 36.201 22.847 7.822 105 HE1 PHE 13 HE1 PHE 13 34.642 23.327 12.506 106 HE2 PHE 13 HE2 PHE 13 35.107 24.948 8.556 107 HZ PHE 13 HZ PHE 13 34.328 25.188 10.897 108 H ILE 14 HN ILE 14 36.096 20.208 6.478 109 HA ILE 14 HA ILE 14 33.922 21.984 6.019 110 HB ILE 14 HB ILE 14 35.766 20.525 4.122 111 HG12 ILE 14 HG12 ILE 14 35.636 23.452 4.899 112 HG13 ILE 14 HG11 ILE 14 36.684 22.287 5.709 113 HG21 ILE 14 HG21 ILE 14 33.728 21.022 2.913 114 HG22 ILE 14 HG22 ILE 14 34.930 22.232 2.462 115 HG23 ILE 14 HG23 ILE 14 33.657 22.641 3.612 116 HD11 ILE 14 HD11 ILE 14 36.751 23.109 2.797 117 HD12 ILE 14 HD12 ILE 14 37.631 21.715 3.424 118 HD13 ILE 14 HD13 ILE 14 38.014 23.335 4.007 119 H LEU 15 HN LEU 15 34.455 18.578 5.276 120 HA LEU 15 HA LEU 15 32.110 18.149 3.758 121 HB2 LEU 15 HB2 LEU 15 33.798 16.250 5.408 122 HB3 LEU 15 HB1 LEU 15 32.499 15.738 4.332 123 HG LEU 15 HG LEU 15 34.740 17.494 3.336 124 HD11 LEU 15 HD11 LEU 15 35.768 15.476 4.318 125 HD12 LEU 15 HD12 LEU 15 35.867 15.434 2.558 126 HD13 LEU 15 HD13 LEU 15 34.660 14.459 3.396 127 HD21 LEU 15 HD21 LEU 15 32.652 17.209 1.982 128 HD22 LEU 15 HD22 LEU 15 32.937 15.470 1.968 129 HD23 LEU 15 HD23 LEU 15 34.077 16.556 1.176 130 H SER 16 HN SER 16 32.678 18.415 7.167 131 HA SER 16 HA SER 16 30.188 17.123 7.916 132 HB2 SER 16 HB2 SER 16 30.818 17.614 10.173 133 HB3 SER 16 HB1 SER 16 32.272 17.087 9.331 134 HG SER 16 HG SER 16 31.522 19.631 10.228 135 H ALA 17 HN ALA 17 31.484 20.424 7.703 136 HA ALA 17 HA ALA 17 29.272 21.765 8.807 137 HB1 ALA 17 HB1 ALA 17 30.259 23.728 8.005 138 HB2 ALA 17 HB2 ALA 17 30.875 22.939 6.552 139 HB3 ALA 17 HB3 ALA 17 31.644 22.639 8.111 140 H LEU 18 HN LEU 18 30.050 20.967 5.414 141 HA LEU 18 HA LEU 18 27.637 22.069 4.379 142 HB2 LEU 18 HB2 LEU 18 29.869 20.424 3.336 143 HB3 LEU 18 HB1 LEU 18 28.341 20.333 2.461 144 HG LEU 18 HG LEU 18 29.946 22.151 1.687 145 HD11 LEU 18 HD11 LEU 18 27.310 23.247 2.686 146 HD12 LEU 18 HD12 LEU 18 27.406 22.098 1.350 147 HD13 LEU 18 HD13 LEU 18 28.180 23.677 1.215 148 HD21 LEU 18 HD21 LEU 18 30.284 24.087 3.022 149 HD22 LEU 18 HD22 LEU 18 30.530 22.745 4.139 150 HD23 LEU 18 HD23 LEU 18 29.008 23.637 4.152 151 H HIS 19 HN HIS 19 28.650 18.815 5.324 152 HA HIS 19 HA HIS 19 26.480 17.372 4.427 153 HB2 HIS 19 HB2 HIS 19 28.339 16.224 5.390 154 HB3 HIS 19 HB1 HIS 19 28.126 17.051 6.932 155 HD2 HIS 19 HD2 HIS 19 24.992 15.491 5.147 156 HE1 HIS 19 HE1 HIS 19 25.840 13.177 8.576 157 HE2 HIS 19 HE2 HIS 19 24.172 13.557 6.699 158 H PHE 20 HN PHE 20 26.775 19.207 7.450 159 HA PHE 20 HA PHE 20 24.123 18.461 8.318 160 HB2 PHE 20 HB2 PHE 20 26.427 19.684 9.453 161 HB3 PHE 20 HB1 PHE 20 25.065 20.783 9.662 162 HD1 PHE 20 HD1 PHE 20 25.994 17.167 10.026 163 HD2 PHE 20 HD2 PHE 20 23.523 20.411 11.380 164 HE1 PHE 20 HE1 PHE 20 25.102 15.733 11.843 165 HE2 PHE 20 HE2 PHE 20 22.634 18.976 13.196 166 HZ PHE 20 HZ PHE 20 23.415 16.635 13.421 167 H MET 21 HN MET 21 25.533 21.016 6.402 168 HA MET 21 HA MET 21 23.392 22.888 6.728 169 HB2 MET 21 HB2 MET 21 25.644 22.555 4.776 170 HB3 MET 21 HB1 MET 21 24.407 23.788 4.536 171 HG2 MET 21 HG2 MET 21 24.907 24.831 6.630 172 HG3 MET 21 HG1 MET 21 25.932 23.492 7.135 173 HE1 MET 21 HE1 MET 21 28.156 25.377 7.579 174 HE2 MET 21 HE2 MET 21 26.613 26.219 7.474 175 HE3 MET 21 HE3 MET 21 27.999 26.817 6.565 176 H ALA 22 HN ALA 22 24.301 20.862 3.938 177 HA ALA 22 HA ALA 22 21.910 21.326 2.499 178 HB1 ALA 22 HB1 ALA 22 24.146 20.415 1.636 179 HB2 ALA 22 HB2 ALA 22 22.677 19.693 0.981 180 HB3 ALA 22 HB3 ALA 22 23.597 18.847 2.226 181 H TRP 23 HN TRP 23 22.896 18.711 4.695 182 HA TRP 23 HA TRP 23 20.615 17.084 4.326 183 HB2 TRP 23 HB2 TRP 23 22.733 16.364 5.429 184 HB3 TRP 23 HB1 TRP 23 22.290 17.338 6.830 185 HD1 TRP 23 HD1 TRP 23 20.730 14.533 4.678 186 HE1 TRP 23 HE1 TRP 23 19.363 13.003 6.237 187 HE3 TRP 23 HE3 TRP 23 21.356 16.998 9.110 188 HZ2 TRP 23 HZ2 TRP 23 18.635 12.841 8.999 189 HZ3 TRP 23 HZ3 TRP 23 20.316 16.132 11.187 190 HH2 TRP 23 HH2 TRP 23 18.957 14.059 11.137 191 H THR 24 HN THR 24 21.248 19.807 6.487 192 HA THR 24 HA THR 24 18.880 19.523 8.051 193 HB THR 24 HB THR 24 20.775 21.809 7.546 194 HG1 THR 24 HG1 THR 24 21.536 21.228 9.455 195 HG21 THR 24 HG21 THR 24 18.214 21.762 9.148 196 HG22 THR 24 HG22 THR 24 18.697 22.912 7.900 197 HG23 THR 24 HG23 THR 24 19.512 22.914 9.464 198 H ILE 25 HN ILE 25 19.672 21.431 5.155 199 HA ILE 25 HA ILE 25 17.229 22.827 4.996 200 HB ILE 25 HB ILE 25 19.201 22.012 2.851 201 HG12 ILE 25 HG12 ILE 25 18.708 24.709 4.147 202 HG13 ILE 25 HG11 ILE 25 19.927 23.575 4.727 203 HG21 ILE 25 HG21 ILE 25 18.057 23.930 1.592 204 HG22 ILE 25 HG22 ILE 25 16.750 23.789 2.768 205 HG23 ILE 25 HG23 ILE 25 17.140 22.429 1.714 206 HD11 ILE 25 HD11 ILE 25 19.800 24.963 2.044 207 HD12 ILE 25 HD12 ILE 25 20.823 23.551 2.317 208 HD13 ILE 25 HD13 ILE 25 21.093 25.028 3.243 209 H GLY 26 HN GLY 26 18.278 19.731 3.630 210 HA2 GLY 26 HA2 GLY 26 15.964 19.189 2.105 211 HA3 GLY 26 HA1 GLY 26 17.102 17.982 2.699 212 H HIS 27 HN HIS 27 16.807 18.509 5.465 213 HA HIS 27 HA HIS 27 14.495 16.933 6.048 214 HB2 HIS 27 HB2 HIS 27 16.306 16.635 7.517 215 HB3 HIS 27 HB1 HIS 27 16.516 18.370 7.754 216 HD2 HIS 27 HD2 HIS 27 15.018 19.437 9.840 217 HE1 HIS 27 HE1 HIS 27 12.668 16.023 10.645 218 HE2 HIS 27 HE2 HIS 27 13.250 18.367 11.433 219 H LEU 28 HN LEU 28 15.267 20.369 6.342 220 HA LEU 28 HA LEU 28 12.932 21.117 7.774 221 HB2 LEU 28 HB2 LEU 28 15.193 22.409 7.227 222 HB3 LEU 28 HB1 LEU 28 14.225 23.029 5.888 223 HG LEU 28 HG LEU 28 12.486 23.197 8.034 224 HD11 LEU 28 HD11 LEU 28 14.360 22.669 9.573 225 HD12 LEU 28 HD12 LEU 28 13.752 24.305 9.823 226 HD13 LEU 28 HD13 LEU 28 15.255 24.048 8.935 227 HD21 LEU 28 HD21 LEU 28 13.013 24.853 6.180 228 HD22 LEU 28 HD22 LEU 28 14.386 25.386 7.151 229 HD23 LEU 28 HD23 LEU 28 12.744 25.575 7.766 230 H ASN 29 HN ASN 29 10.959 21.842 7.088 231 HA ASN 29 HA ASN 29 10.428 21.877 4.191 232 HB2 ASN 29 HB2 ASN 29 8.762 20.414 6.253 233 HB3 ASN 29 HB1 ASN 29 8.330 20.627 4.557 234 HD21 ASN 29 HD21 ASN 29 9.128 18.139 6.252 235 HD22 ASN 29 HD22 ASN 29 10.322 17.392 5.304 236 H GLN 30 HN GLN 30 9.092 23.486 3.550 237 HA GLN 30 HA GLN 30 8.069 25.281 5.646 238 HB2 GLN 30 HB2 GLN 30 8.515 25.716 2.683 239 HB3 GLN 30 HB1 GLN 30 7.869 26.926 3.791 240 HG2 GLN 30 HG2 GLN 30 10.520 25.554 4.261 241 HG3 GLN 30 HG1 GLN 30 10.382 27.051 3.342 242 HE21 GLN 30 HE21 GLN 30 9.599 28.987 4.513 243 HE22 GLN 30 HE22 GLN 30 9.693 29.057 6.206 244 H ILE 31 HN ILE 31 5.959 25.424 6.053 245 HA ILE 31 HA ILE 31 4.037 24.613 3.973 246 HB ILE 31 HB ILE 31 2.719 23.392 5.675 247 HG12 ILE 31 HG12 ILE 31 5.171 23.746 7.428 248 HG13 ILE 31 HG11 ILE 31 3.677 24.662 7.628 249 HG21 ILE 31 HG21 ILE 31 4.217 21.435 5.827 250 HG22 ILE 31 HG22 ILE 31 5.592 22.455 5.399 251 HG23 ILE 31 HG23 ILE 31 4.304 22.174 4.228 252 HD11 ILE 31 HD11 ILE 31 2.421 22.594 8.000 253 HD12 ILE 31 HD12 ILE 31 3.767 22.687 9.136 254 HD13 ILE 31 HD13 ILE 31 3.877 21.637 7.724 255 H LYS 32 HN LYS 32 2.038 25.648 4.073 256 HA LYS 32 HA LYS 32 1.799 27.802 6.084 257 HB2 LYS 32 HB2 LYS 32 1.630 27.934 3.106 258 HB3 LYS 32 HB1 LYS 32 0.545 28.961 4.046 259 HG2 LYS 32 HG2 LYS 32 3.488 28.844 4.684 260 HG3 LYS 32 HG1 LYS 32 2.881 29.909 3.415 261 HD2 LYS 32 HD2 LYS 32 1.366 30.991 5.007 262 HD3 LYS 32 HD1 LYS 32 1.894 29.894 6.283 263 HE2 LYS 32 HE2 LYS 32 4.210 30.759 6.043 264 HE3 LYS 32 HE1 LYS 32 3.641 31.893 4.817 265 HZ1 LYS 32 HZ1 LYS 32 3.729 32.980 6.940 266 HZ2 LYS 32 HZ2 LYS 32 2.768 31.773 7.653 267 HZ3 LYS 32 HZ3 LYS 32 2.106 32.810 6.480 268 H ARG 33 HN ARG 33 0.250 26.908 7.363 269 HA ARG 33 HA ARG 33 -2.092 25.640 6.174 270 HB2 ARG 33 HB2 ARG 33 -0.717 25.300 8.570 271 HB3 ARG 33 HB1 ARG 33 -2.215 26.102 9.046 272 HG2 ARG 33 HG2 ARG 33 -2.817 23.830 9.064 273 HG3 ARG 33 HG1 ARG 33 -3.364 24.365 7.474 274 HD2 ARG 33 HD2 ARG 33 -1.402 23.465 6.413 275 HD3 ARG 33 HD1 ARG 33 -0.645 23.136 7.968 276 HE ARG 33 HE ARG 33 -3.121 21.755 7.777 277 HH11 ARG 33 HH11 ARG 33 0.154 21.750 6.565 278 HH12 ARG 33 HH12 ARG 33 0.172 20.042 6.283 279 HH21 ARG 33 HH21 ARG 33 -3.065 19.522 7.397 280 HH22 ARG 33 HH22 ARG 33 -1.634 18.790 6.749 281 H1 MET 1 HT1 MET 1 47.402 15.430 28.853 282 H2 MET 1 HT2 MET 1 45.899 15.512 29.640 283 H3 MET 1 HT3 MET 1 47.306 16.037 30.435 284 HA MET 1 HA MET 1 47.529 17.916 29.071 285 HB2 MET 1 HB2 MET 1 46.002 16.232 27.248 286 HB3 MET 1 HB1 MET 1 45.345 17.867 27.322 287 HG2 MET 1 HG2 MET 1 47.233 18.818 26.423 288 HG3 MET 1 HG1 MET 1 48.307 17.625 27.151 289 HE1 MET 1 HE1 MET 1 49.577 15.963 25.567 290 HE2 MET 1 HE2 MET 1 48.503 14.721 24.928 291 HE3 MET 1 HE3 MET 1 48.331 15.248 26.600 292 H PHE 2 HN PHE 2 46.129 19.836 29.126 293 HA PHE 2 HA PHE 2 44.565 19.959 31.456 294 HB2 PHE 2 HB2 PHE 2 45.594 21.957 30.583 295 HB3 PHE 2 HB1 PHE 2 44.699 21.815 29.070 296 HD1 PHE 2 HD1 PHE 2 44.256 22.251 32.754 297 HD2 PHE 2 HD2 PHE 2 42.540 22.743 28.847 298 HE1 PHE 2 HE1 PHE 2 42.374 23.529 33.741 299 HE2 PHE 2 HE2 PHE 2 40.657 24.020 29.835 300 HZ PHE 2 HZ PHE 2 40.574 24.413 32.282 301 H GLU 3 HN GLU 3 43.589 19.896 28.035 302 HA GLU 3 HA GLU 3 40.796 19.837 28.671 303 HB2 GLU 3 HB2 GLU 3 42.308 19.351 26.098 304 HB3 GLU 3 HB1 GLU 3 40.551 19.315 26.212 305 HG2 GLU 3 HG2 GLU 3 40.955 21.534 25.602 306 HG3 GLU 3 HG1 GLU 3 40.815 21.641 27.356 307 HA PRO 4 HA PRO 4 39.879 15.577 29.291 308 HB2 PRO 4 HB2 PRO 4 38.076 15.689 26.911 309 HB3 PRO 4 HB1 PRO 4 37.720 15.178 28.573 310 HG2 PRO 4 HG2 PRO 4 36.896 17.527 27.630 311 HG3 PRO 4 HG1 PRO 4 37.416 17.328 29.313 312 HD2 PRO 4 HD2 PRO 4 38.823 18.648 27.054 313 HD3 PRO 4 HD1 PRO 4 38.888 19.010 28.788 314 H PHE 5 HN PHE 5 40.392 16.526 25.912 315 HA PHE 5 HA PHE 5 42.318 14.422 25.516 316 HB2 PHE 5 HB2 PHE 5 39.594 13.875 24.867 317 HB3 PHE 5 HB1 PHE 5 40.488 14.044 23.356 318 HD1 PHE 5 HD1 PHE 5 40.212 12.158 26.514 319 HD2 PHE 5 HD2 PHE 5 42.289 12.520 22.773 320 HE1 PHE 5 HE1 PHE 5 41.210 9.913 26.851 321 HE2 PHE 5 HE2 PHE 5 43.287 10.275 23.109 322 HZ PHE 5 HZ PHE 5 42.746 8.970 25.148 323 H GLN 6 HN GLN 6 40.113 16.147 23.298 324 HA GLN 6 HA GLN 6 42.154 18.034 22.529 325 HB2 GLN 6 HB2 GLN 6 42.649 15.788 21.307 326 HB3 GLN 6 HB1 GLN 6 41.232 16.194 20.334 327 HG2 GLN 6 HG2 GLN 6 42.222 18.311 19.677 328 HG3 GLN 6 HG1 GLN 6 43.586 18.053 20.762 329 HE21 GLN 6 HE21 GLN 6 45.235 16.521 20.110 330 HE22 GLN 6 HE22 GLN 6 45.288 15.882 18.538 331 H ILE 7 HN ILE 7 41.346 19.552 20.895 332 HA ILE 7 HA ILE 7 38.698 20.365 21.410 333 HB ILE 7 HB ILE 7 40.627 21.114 19.204 334 HG12 ILE 7 HG12 ILE 7 39.723 22.653 21.653 335 HG13 ILE 7 HG11 ILE 7 41.176 21.653 21.623 336 HG21 ILE 7 HG21 ILE 7 38.402 21.593 18.389 337 HG22 ILE 7 HG22 ILE 7 39.103 23.114 18.944 338 HG23 ILE 7 HG23 ILE 7 37.925 22.269 19.946 339 HD11 ILE 7 HD11 ILE 7 41.873 23.899 21.126 340 HD12 ILE 7 HD12 ILE 7 40.589 24.096 19.933 341 HD13 ILE 7 HD13 ILE 7 41.933 22.999 19.610 342 H LEU 8 HN LEU 8 40.127 18.611 18.696 343 HA LEU 8 HA LEU 8 37.753 18.500 17.116 344 HB2 LEU 8 HB2 LEU 8 40.298 16.872 17.098 345 HB3 LEU 8 HB1 LEU 8 38.985 16.605 15.950 346 HG LEU 8 HG LEU 8 40.211 19.337 16.369 347 HD11 LEU 8 HD11 LEU 8 40.966 17.254 14.295 348 HD12 LEU 8 HD12 LEU 8 41.973 17.728 15.663 349 HD13 LEU 8 HD13 LEU 8 41.601 18.896 14.394 350 HD21 LEU 8 HD21 LEU 8 38.072 19.389 15.255 351 HD22 LEU 8 HD22 LEU 8 38.510 18.024 14.229 352 HD23 LEU 8 HD23 LEU 8 39.299 19.585 14.005 353 H SER 9 HN SER 9 39.119 16.465 19.606 354 HA SER 9 HA SER 9 37.336 14.255 19.229 355 HB2 SER 9 HB2 SER 9 39.475 13.944 20.355 356 HB3 SER 9 HB1 SER 9 38.990 15.054 21.634 357 HG SER 9 HG SER 9 37.348 13.616 22.190 358 H ILE 10 HN ILE 10 37.378 17.040 21.423 359 HA ILE 10 HA ILE 10 35.082 16.318 22.912 360 HB ILE 10 HB ILE 10 36.353 19.008 22.374 361 HG12 ILE 10 HG12 ILE 10 36.403 17.337 24.893 362 HG13 ILE 10 HG11 ILE 10 37.623 17.158 23.634 363 HG21 ILE 10 HG21 ILE 10 34.149 18.172 24.281 364 HG22 ILE 10 HG22 ILE 10 34.056 19.393 23.013 365 HG23 ILE 10 HG23 ILE 10 35.053 19.678 24.439 366 HD11 ILE 10 HD11 ILE 10 37.102 19.496 25.447 367 HD12 ILE 10 HD12 ILE 10 37.818 19.789 23.862 368 HD13 ILE 10 HD13 ILE 10 38.632 18.738 25.015 369 H CYS 11 HN CYS 11 35.529 18.426 20.071 370 HA CYS 11 HA CYS 11 32.866 19.301 19.863 371 HB2 CYS 11 HB2 CYS 11 35.022 18.923 17.782 372 HB3 CYS 11 HB1 CYS 11 33.462 19.670 17.434 373 HG CYS 11 HG CYS 11 34.416 21.760 18.342 374 H SER 12 HN SER 12 34.519 16.599 18.177 375 HA SER 12 HA SER 12 32.280 15.676 16.782 376 HB2 SER 12 HB2 SER 12 34.680 14.176 17.834 377 HB3 SER 12 HB1 SER 12 33.510 13.500 16.704 378 HG SER 12 HG SER 12 34.048 15.169 15.261 379 H PHE 13 HN PHE 13 33.415 14.966 20.051 380 HA PHE 13 HA PHE 13 31.689 12.832 20.650 381 HB2 PHE 13 HB2 PHE 13 33.539 13.381 22.108 382 HB3 PHE 13 HB1 PHE 13 32.855 14.973 22.438 383 HD1 PHE 13 HD1 PHE 13 32.390 11.328 22.935 384 HD2 PHE 13 HD2 PHE 13 31.048 15.268 23.995 385 HE1 PHE 13 HE1 PHE 13 31.042 10.372 24.785 386 HE2 PHE 13 HE2 PHE 13 29.702 14.313 25.845 387 HZ PHE 13 HZ PHE 13 29.699 11.864 26.241 388 H ILE 14 HN ILE 14 31.272 16.328 21.245 389 HA ILE 14 HA ILE 14 28.653 16.082 22.326 390 HB ILE 14 HB ILE 14 30.104 18.426 21.093 391 HG12 ILE 14 HG12 ILE 14 29.407 17.825 23.980 392 HG13 ILE 14 HG11 ILE 14 30.949 17.379 23.250 393 HG21 ILE 14 HG21 ILE 14 27.732 18.849 20.877 394 HG22 ILE 14 HG22 ILE 14 28.316 19.769 22.263 395 HG23 ILE 14 HG23 ILE 14 27.432 18.265 22.515 396 HD11 ILE 14 HD11 ILE 14 29.815 20.163 23.599 397 HD12 ILE 14 HD12 ILE 14 31.214 19.815 22.584 398 HD13 ILE 14 HD13 ILE 14 31.284 19.504 24.319 399 H LEU 15 HN LEU 15 29.861 16.777 19.083 400 HA LEU 15 HA LEU 15 27.375 17.323 17.860 401 HB2 LEU 15 HB2 LEU 15 29.980 16.282 16.718 402 HB3 LEU 15 HB1 LEU 15 28.605 16.786 15.738 403 HG LEU 15 HG LEU 15 29.789 18.623 17.819 404 HD11 LEU 15 HD11 LEU 15 31.616 17.960 16.297 405 HD12 LEU 15 HD12 LEU 15 31.137 19.633 16.007 406 HD13 LEU 15 HD13 LEU 15 30.608 18.360 14.907 407 HD21 LEU 15 HD21 LEU 15 27.546 19.114 16.815 408 HD22 LEU 15 HD22 LEU 15 28.300 19.133 15.221 409 HD23 LEU 15 HD23 LEU 15 28.749 20.341 16.424 410 H SER 16 HN SER 16 28.942 14.363 18.767 411 HA SER 16 HA SER 16 27.311 12.700 17.040 412 HB2 SER 16 HB2 SER 16 28.479 10.852 18.013 413 HB3 SER 16 HB1 SER 16 29.663 12.127 17.747 414 HG SER 16 HG SER 16 28.539 11.166 20.127 415 H ALA 17 HN ALA 17 27.466 13.535 20.490 416 HA ALA 17 HA ALA 17 25.449 11.800 21.388 417 HB1 ALA 17 HB1 ALA 17 25.508 13.013 23.387 418 HB2 ALA 17 HB2 ALA 17 25.811 14.543 22.563 419 HB3 ALA 17 HB3 ALA 17 27.100 13.349 22.708 420 H LEU 18 HN LEU 18 25.262 15.193 20.307 421 HA LEU 18 HA LEU 18 22.432 15.361 20.593 422 HB2 LEU 18 HB2 LEU 18 24.571 17.037 19.413 423 HB3 LEU 18 HB1 LEU 18 22.934 17.299 18.812 424 HG LEU 18 HG LEU 18 23.605 18.700 20.828 425 HD11 LEU 18 HD11 LEU 18 21.246 16.887 21.375 426 HD12 LEU 18 HD12 LEU 18 21.223 18.101 20.096 427 HD13 LEU 18 HD13 LEU 18 21.424 18.595 21.777 428 HD21 LEU 18 HD21 LEU 18 23.788 17.691 22.971 429 HD22 LEU 18 HD22 LEU 18 24.765 16.663 21.923 430 HD23 LEU 18 HD23 LEU 18 23.144 16.152 22.397 431 H HIS 19 HN HIS 19 24.587 14.656 17.882 432 HA HIS 19 HA HIS 19 22.754 14.636 15.821 433 HB2 HIS 19 HB2 HIS 19 25.072 14.336 15.333 434 HB3 HIS 19 HB1 HIS 19 25.150 12.871 16.310 435 HD2 HIS 19 HD2 HIS 19 22.189 13.323 13.763 436 HE1 HIS 19 HE1 HIS 19 24.742 10.297 12.291 437 HE2 HIS 19 HE2 HIS 19 22.516 11.470 11.951 438 H PHE 20 HN PHE 20 23.495 12.018 18.101 439 HA PHE 20 HA PHE 20 21.602 10.222 16.871 440 HB2 PHE 20 HB2 PHE 20 23.693 10.063 18.793 441 HB3 PHE 20 HB1 PHE 20 22.219 9.442 19.536 442 HD1 PHE 20 HD1 PHE 20 24.211 9.229 16.364 443 HD2 PHE 20 HD2 PHE 20 21.512 7.264 19.067 444 HE1 PHE 20 HE1 PHE 20 24.421 7.132 15.052 445 HE2 PHE 20 HE2 PHE 20 21.722 5.170 17.757 446 HZ PHE 20 HZ PHE 20 23.166 5.104 15.744 447 H MET 21 HN MET 21 21.508 12.651 19.379 448 HA MET 21 HA MET 21 19.148 11.693 20.679 449 HB2 MET 21 HB2 MET 21 20.629 14.302 20.617 450 HB3 MET 21 HB1 MET 21 19.084 14.152 21.453 451 HG2 MET 21 HG2 MET 21 19.926 12.437 22.896 452 HG3 MET 21 HG1 MET 21 21.400 12.263 21.949 453 HE1 MET 21 HE1 MET 21 23.006 12.759 24.381 454 HE2 MET 21 HE2 MET 21 21.341 12.339 24.775 455 HE3 MET 21 HE3 MET 21 22.103 13.719 25.562 456 H ALA 22 HN ALA 22 19.634 14.500 18.546 457 HA ALA 22 HA ALA 22 16.879 15.019 18.166 458 HB1 ALA 22 HB1 ALA 22 18.871 16.570 17.718 459 HB2 ALA 22 HB2 ALA 22 17.541 16.613 16.562 460 HB3 ALA 22 HB3 ALA 22 19.018 15.733 16.173 461 H TRP 23 HN TRP 23 19.232 13.169 16.255 462 HA TRP 23 HA TRP 23 17.527 12.608 14.071 463 HB2 TRP 23 HB2 TRP 23 20.001 12.292 14.081 464 HB3 TRP 23 HB1 TRP 23 19.780 10.885 15.120 465 HD1 TRP 23 HD1 TRP 23 18.475 12.172 11.719 466 HE1 TRP 23 HE1 TRP 23 18.196 10.143 10.155 467 HE3 TRP 23 HE3 TRP 23 19.790 8.408 14.913 468 HZ2 TRP 23 HZ2 TRP 23 18.495 7.299 10.246 469 HZ3 TRP 23 HZ3 TRP 23 19.786 6.052 14.146 470 HH2 TRP 23 HH2 TRP 23 19.141 5.494 11.820 471 H THR 24 HN THR 24 18.038 10.960 17.159 472 HA THR 24 HA THR 24 16.490 8.651 16.546 473 HB THR 24 HB THR 24 17.367 9.932 19.125 474 HG1 THR 24 HG1 THR 24 18.853 8.403 19.055 475 HG21 THR 24 HG21 THR 24 15.607 7.517 18.686 476 HG22 THR 24 HG22 THR 24 15.299 8.916 19.715 477 HG23 THR 24 HG23 THR 24 16.545 7.752 20.161 478 H ILE 25 HN ILE 25 15.710 11.727 18.136 479 HA ILE 25 HA ILE 25 13.054 11.095 18.831 480 HB ILE 25 HB ILE 25 14.361 13.752 18.210 481 HG12 ILE 25 HG12 ILE 25 13.565 12.522 20.866 482 HG13 ILE 25 HG11 ILE 25 15.180 12.356 20.175 483 HG21 ILE 25 HG21 ILE 25 12.368 14.630 19.559 484 HG22 ILE 25 HG22 ILE 25 11.618 13.057 19.287 485 HG23 ILE 25 HG23 ILE 25 12.012 14.094 17.917 486 HD11 ILE 25 HD11 ILE 25 13.783 14.887 21.056 487 HD12 ILE 25 HD12 ILE 25 15.199 14.920 20.005 488 HD13 ILE 25 HD13 ILE 25 15.321 14.238 21.627 489 H GLY 26 HN GLY 26 14.438 12.560 15.919 490 HA2 GLY 26 HA2 GLY 26 12.008 13.128 14.592 491 HA3 GLY 26 HA1 GLY 26 13.572 12.910 13.810 492 H HIS 27 HN HIS 27 14.072 10.258 14.651 493 HA HIS 27 HA HIS 27 12.627 8.797 12.672 494 HB2 HIS 27 HB2 HIS 27 14.825 8.059 13.064 495 HB3 HIS 27 HB1 HIS 27 14.592 8.013 14.813 496 HD2 HIS 27 HD2 HIS 27 13.620 5.596 15.782 497 HE1 HIS 27 HE1 HIS 27 12.753 3.805 12.058 498 HE2 HIS 27 HE2 HIS 27 12.859 3.415 14.566 499 H LEU 28 HN LEU 28 12.447 8.974 16.198 500 HA LEU 28 HA LEU 28 10.593 6.860 16.551 501 HB2 LEU 28 HB2 LEU 28 12.077 8.251 18.265 502 HB3 LEU 28 HB1 LEU 28 10.591 9.190 18.411 503 HG LEU 28 HG LEU 28 9.677 6.578 18.470 504 HD11 LEU 28 HD11 LEU 28 12.020 5.782 18.671 505 HD12 LEU 28 HD12 LEU 28 11.083 5.426 20.122 506 HD13 LEU 28 HD13 LEU 28 12.219 6.776 20.114 507 HD21 LEU 28 HD21 LEU 28 9.065 8.588 19.896 508 HD22 LEU 28 HD22 LEU 28 10.468 8.211 20.896 509 HD23 LEU 28 HD23 LEU 28 9.141 7.057 20.768 510 H ASN 29 HN ASN 29 8.383 6.835 16.655 511 HA ASN 29 HA ASN 29 6.944 9.346 16.108 512 HB2 ASN 29 HB2 ASN 29 6.538 6.744 14.614 513 HB3 ASN 29 HB1 ASN 29 5.534 8.183 14.449 514 HD21 ASN 29 HD21 ASN 29 7.528 6.740 12.536 515 HD22 ASN 29 HD22 ASN 29 8.504 8.008 11.968 516 H GLN 30 HN GLN 30 5.068 9.557 17.213 517 HA GLN 30 HA GLN 30 4.323 7.340 19.002 518 HB2 GLN 30 HB2 GLN 30 3.628 10.286 19.069 519 HB3 GLN 30 HB1 GLN 30 3.059 9.093 20.237 520 HG2 GLN 30 HG2 GLN 30 5.994 9.524 19.660 521 HG3 GLN 30 HG1 GLN 30 5.137 10.414 20.917 522 HE21 GLN 30 HE21 GLN 30 4.267 9.152 22.754 523 HE22 GLN 30 HE22 GLN 30 4.884 7.609 23.101 524 H ILE 31 HN ILE 31 2.517 6.212 18.676 525 HA ILE 31 HA ILE 31 0.336 7.414 17.104 526 HB ILE 31 HB ILE 31 0.059 5.285 15.872 527 HG12 ILE 31 HG12 ILE 31 2.741 4.553 17.088 528 HG13 ILE 31 HG11 ILE 31 1.201 3.881 17.625 529 HG21 ILE 31 HG21 ILE 31 2.018 5.568 14.396 530 HG22 ILE 31 HG22 ILE 31 2.822 6.520 15.644 531 HG23 ILE 31 HG23 ILE 31 1.357 7.131 14.875 532 HD11 ILE 31 HD11 ILE 31 0.784 2.969 15.390 533 HD12 ILE 31 HD12 ILE 31 2.340 2.396 15.991 534 HD13 ILE 31 HD13 ILE 31 2.280 3.691 14.797 535 H LYS 32 HN LYS 32 -1.727 6.654 17.608 536 HA LYS 32 HA LYS 32 -1.897 4.822 19.921 537 HB2 LYS 32 HB2 LYS 32 -3.064 7.544 19.548 538 HB3 LYS 32 HB1 LYS 32 -4.027 6.339 20.405 539 HG2 LYS 32 HG2 LYS 32 -1.135 6.790 21.123 540 HG3 LYS 32 HG1 LYS 32 -2.404 7.815 21.797 541 HD2 LYS 32 HD2 LYS 32 -3.554 5.847 22.695 542 HD3 LYS 32 HD1 LYS 32 -2.342 4.787 21.976 543 HE2 LYS 32 HE2 LYS 32 -0.590 5.891 23.347 544 HE3 LYS 32 HE1 LYS 32 -1.831 6.895 24.096 545 HZ1 LYS 32 HZ1 LYS 32 -1.369 5.011 25.488 546 HZ2 LYS 32 HZ2 LYS 32 -1.653 3.933 24.205 547 HZ3 LYS 32 HZ3 LYS 32 -2.931 4.850 24.848 548 H ARG 33 HN ARG 33 -2.616 3.024 18.881 549 HA ARG 33 HA ARG 33 -4.752 3.221 16.905 550 HB2 ARG 33 HB2 ARG 33 -2.629 1.461 17.288 551 HB3 ARG 33 HB1 ARG 33 -4.052 0.527 17.755 552 HG2 ARG 33 HG2 ARG 33 -3.938 0.166 15.436 553 HG3 ARG 33 HG1 ARG 33 -5.102 1.487 15.567 554 HD2 ARG 33 HD2 ARG 33 -3.421 3.121 15.032 555 HD3 ARG 33 HD1 ARG 33 -2.139 1.920 15.144 556 HE ARG 33 HE ARG 33 -4.034 1.137 13.178 557 HH11 ARG 33 HH11 ARG 33 -1.486 3.443 13.800 558 HH12 ARG 33 HH12 ARG 33 -1.075 3.618 12.129 559 HH21 ARG 33 HH21 ARG 33 -3.470 1.389 10.998 560 HH22 ARG 33 HH22 ARG 33 -2.189 2.466 10.554 561 H1 MET 1 HT1 MET 1 50.325 -1.198 21.786 562 H2 MET 1 HT2 MET 1 49.224 -2.453 21.467 563 H3 MET 1 HT3 MET 1 50.621 -2.758 22.386 564 HA MET 1 HA MET 1 49.840 -1.539 24.214 565 HB2 MET 1 HB2 MET 1 48.299 -0.222 22.121 566 HB3 MET 1 HB1 MET 1 47.289 -0.631 23.509 567 HG2 MET 1 HG2 MET 1 48.421 0.780 24.925 568 HG3 MET 1 HG1 MET 1 49.960 0.546 24.098 569 HE1 MET 1 HE1 MET 1 51.005 2.587 22.817 570 HE2 MET 1 HE2 MET 1 50.157 2.908 21.306 571 HE3 MET 1 HE3 MET 1 50.439 1.245 21.814 572 H PHE 2 HN PHE 2 48.074 -2.197 25.665 573 HA PHE 2 HA PHE 2 47.437 -4.923 25.410 574 HB2 PHE 2 HB2 PHE 2 47.515 -3.895 27.591 575 HB3 PHE 2 HB1 PHE 2 46.228 -2.769 27.159 576 HD1 PHE 2 HD1 PHE 2 46.984 -6.407 27.558 577 HD2 PHE 2 HD2 PHE 2 43.959 -3.359 27.440 578 HE1 PHE 2 HE1 PHE 2 45.285 -8.063 28.284 579 HE2 PHE 2 HE2 PHE 2 42.262 -5.015 28.167 580 HZ PHE 2 HZ PHE 2 42.925 -7.367 28.588 581 H GLU 3 HN GLU 3 45.398 -2.038 24.979 582 HA GLU 3 HA GLU 3 43.128 -3.575 24.154 583 HB2 GLU 3 HB2 GLU 3 43.730 -0.615 24.041 584 HB3 GLU 3 HB1 GLU 3 42.203 -1.313 23.513 585 HG2 GLU 3 HG2 GLU 3 41.744 -0.764 25.738 586 HG3 GLU 3 HG1 GLU 3 42.194 -2.464 25.851 587 HA PRO 4 HA PRO 4 43.685 -4.165 19.828 588 HB2 PRO 4 HB2 PRO 4 41.216 -2.551 19.358 589 HB3 PRO 4 HB1 PRO 4 41.610 -4.195 18.818 590 HG2 PRO 4 HG2 PRO 4 39.901 -3.755 20.811 591 HG3 PRO 4 HG1 PRO 4 41.001 -5.143 20.816 592 HD2 PRO 4 HD2 PRO 4 41.123 -2.639 22.410 593 HD3 PRO 4 HD1 PRO 4 41.678 -4.271 22.828 594 H PHE 5 HN PHE 5 42.728 -0.887 20.790 595 HA PHE 5 HA PHE 5 44.894 0.283 19.298 596 HB2 PHE 5 HB2 PHE 5 42.374 0.006 17.991 597 HB3 PHE 5 HB1 PHE 5 42.607 1.715 18.359 598 HD1 PHE 5 HD1 PHE 5 43.963 -1.206 16.561 599 HD2 PHE 5 HD2 PHE 5 44.442 2.981 17.388 600 HE1 PHE 5 HE1 PHE 5 45.590 -1.025 14.698 601 HE2 PHE 5 HE2 PHE 5 46.069 3.164 15.526 602 HZ PHE 5 HZ PHE 5 46.643 1.161 14.180 603 H GLN 6 HN GLN 6 41.677 1.483 20.275 604 HA GLN 6 HA GLN 6 42.726 2.771 22.632 605 HB2 GLN 6 HB2 GLN 6 43.365 4.243 20.584 606 HB3 GLN 6 HB1 GLN 6 41.646 4.646 20.540 607 HG2 GLN 6 HG2 GLN 6 41.721 5.451 22.830 608 HG3 GLN 6 HG1 GLN 6 43.391 4.916 23.004 609 HE21 GLN 6 HE21 GLN 6 45.067 6.194 21.978 610 HE22 GLN 6 HE22 GLN 6 44.747 7.730 21.332 611 H ILE 7 HN ILE 7 41.016 3.928 23.814 612 HA ILE 7 HA ILE 7 38.595 2.487 23.861 613 HB ILE 7 HB ILE 7 39.362 5.158 25.056 614 HG12 ILE 7 HG12 ILE 7 38.974 2.446 26.352 615 HG13 ILE 7 HG11 ILE 7 40.542 3.037 25.800 616 HG21 ILE 7 HG21 ILE 7 36.953 5.134 24.866 617 HG22 ILE 7 HG22 ILE 7 37.357 4.747 26.538 618 HG23 ILE 7 HG23 ILE 7 36.877 3.465 25.427 619 HD11 ILE 7 HD11 ILE 7 40.381 3.582 28.135 620 HD12 ILE 7 HD12 ILE 7 38.762 4.250 27.929 621 HD13 ILE 7 HD13 ILE 7 40.155 5.089 27.246 622 H LEU 8 HN LEU 8 39.419 5.651 22.507 623 HA LEU 8 HA LEU 8 36.776 6.328 21.684 624 HB2 LEU 8 HB2 LEU 8 39.500 7.324 20.837 625 HB3 LEU 8 HB1 LEU 8 37.998 7.974 20.178 626 HG LEU 8 HG LEU 8 38.494 7.805 23.155 627 HD11 LEU 8 HD11 LEU 8 39.033 10.153 21.308 628 HD12 LEU 8 HD12 LEU 8 40.275 9.176 22.090 629 HD13 LEU 8 HD13 LEU 8 39.184 10.159 23.065 630 HD21 LEU 8 HD21 LEU 8 36.176 8.121 22.563 631 HD22 LEU 8 HD22 LEU 8 36.595 9.336 21.355 632 HD23 LEU 8 HD23 LEU 8 36.793 9.694 23.071 633 H SER 9 HN SER 9 39.421 4.606 20.185 634 HA SER 9 HA SER 9 38.296 4.508 17.555 635 HB2 SER 9 HB2 SER 9 40.690 4.199 17.894 636 HB3 SER 9 HB1 SER 9 40.389 2.754 18.857 637 HG SER 9 HG SER 9 39.507 1.779 17.031 638 H ILE 10 HN ILE 10 38.328 2.268 20.302 639 HA ILE 10 HA ILE 10 36.979 0.142 19.007 640 HB ILE 10 HB ILE 10 37.199 0.887 21.929 641 HG12 ILE 10 HG12 ILE 10 38.567 -1.342 20.412 642 HG13 ILE 10 HG11 ILE 10 39.278 0.265 20.546 643 HG21 ILE 10 HG21 ILE 10 36.105 -1.587 20.562 644 HG22 ILE 10 HG22 ILE 10 35.251 -0.516 21.674 645 HG23 ILE 10 HG23 ILE 10 36.561 -1.540 22.264 646 HD11 ILE 10 HD11 ILE 10 38.802 -1.782 22.692 647 HD12 ILE 10 HD12 ILE 10 38.808 -0.073 23.135 648 HD13 ILE 10 HD13 ILE 10 40.230 -0.796 22.387 649 H CYS 11 HN CYS 11 35.817 2.815 21.070 650 HA CYS 11 HA CYS 11 33.119 2.038 21.152 651 HB2 CYS 11 HB2 CYS 11 34.437 4.749 21.338 652 HB3 CYS 11 HB1 CYS 11 32.712 4.493 21.603 653 HG CYS 11 HG CYS 11 33.303 3.810 23.902 654 H SER 12 HN SER 12 34.758 4.380 18.980 655 HA SER 12 HA SER 12 32.520 4.992 17.424 656 HB2 SER 12 HB2 SER 12 35.449 4.924 16.690 657 HB3 SER 12 HB1 SER 12 34.194 5.636 15.680 658 HG SER 12 HG SER 12 33.722 7.053 17.390 659 H PHE 13 HN PHE 13 34.863 2.361 17.154 660 HA PHE 13 HA PHE 13 34.105 1.365 14.639 661 HB2 PHE 13 HB2 PHE 13 36.119 0.585 15.731 662 HB3 PHE 13 HB1 PHE 13 35.181 -0.070 17.075 663 HD1 PHE 13 HD1 PHE 13 35.932 -0.434 13.461 664 HD2 PHE 13 HD2 PHE 13 34.017 -2.164 16.894 665 HE1 PHE 13 HE1 PHE 13 35.623 -2.558 12.219 666 HE2 PHE 13 HE2 PHE 13 33.709 -4.289 15.652 667 HZ PHE 13 HZ PHE 13 34.513 -4.485 13.315 668 H ILE 14 HN ILE 14 32.976 0.417 17.894 669 HA ILE 14 HA ILE 14 31.068 -1.468 16.951 670 HB ILE 14 HB ILE 14 31.301 0.014 19.572 671 HG12 ILE 14 HG12 ILE 14 31.839 -2.888 18.882 672 HG13 ILE 14 HG11 ILE 14 33.093 -1.647 18.870 673 HG21 ILE 14 HG21 ILE 14 28.981 -0.622 19.301 674 HG22 ILE 14 HG22 ILE 14 29.732 -1.784 20.391 675 HG23 ILE 14 HG23 ILE 14 29.440 -2.218 18.708 676 HD11 ILE 14 HD11 ILE 14 31.429 -2.557 21.230 677 HD12 ILE 14 HD12 ILE 14 32.434 -1.108 21.260 678 HD13 ILE 14 HD13 ILE 14 33.177 -2.691 21.034 679 H LEU 15 HN LEU 15 30.838 1.935 17.871 680 HA LEU 15 HA LEU 15 28.037 2.197 17.655 681 HB2 LEU 15 HB2 LEU 15 30.266 4.227 17.355 682 HB3 LEU 15 HB1 LEU 15 28.555 4.644 17.424 683 HG LEU 15 HG LEU 15 29.834 2.964 19.579 684 HD11 LEU 15 HD11 LEU 15 31.133 5.056 19.414 685 HD12 LEU 15 HD12 LEU 15 30.143 5.049 20.874 686 HD13 LEU 15 HD13 LEU 15 29.638 5.992 19.472 687 HD21 LEU 15 HD21 LEU 15 27.339 3.110 19.391 688 HD22 LEU 15 HD22 LEU 15 27.462 4.860 19.573 689 HD23 LEU 15 HD23 LEU 15 27.949 3.799 20.894 690 H SER 16 HN SER 16 30.571 2.101 15.284 691 HA SER 16 HA SER 16 28.967 3.281 13.178 692 HB2 SER 16 HB2 SER 16 30.856 2.893 11.763 693 HB3 SER 16 HB1 SER 16 31.479 3.451 13.313 694 HG SER 16 HG SER 16 31.555 0.910 12.139 695 H ALA 17 HN ALA 17 30.066 0.035 14.120 696 HA ALA 17 HA ALA 17 29.037 -1.366 11.916 697 HB1 ALA 17 HB1 ALA 17 29.448 -3.308 13.152 698 HB2 ALA 17 HB2 ALA 17 29.015 -2.542 14.681 699 HB3 ALA 17 HB3 ALA 17 30.551 -2.155 13.906 700 H LEU 18 HN LEU 18 27.566 -0.659 15.090 701 HA LEU 18 HA LEU 18 25.081 -1.898 14.460 702 HB2 LEU 18 HB2 LEU 18 26.135 -0.185 16.635 703 HB3 LEU 18 HB1 LEU 18 24.385 -0.194 16.409 704 HG LEU 18 HG LEU 18 25.301 -1.958 18.001 705 HD11 LEU 18 HD11 LEU 18 23.866 -3.141 15.615 706 HD12 LEU 18 HD12 LEU 18 23.073 -2.035 16.737 707 HD13 LEU 18 HD13 LEU 18 23.698 -3.579 17.314 708 HD21 LEU 18 HD21 LEU 18 26.481 -3.835 17.144 709 HD22 LEU 18 HD22 LEU 18 27.278 -2.447 16.401 710 HD23 LEU 18 HD23 LEU 18 26.124 -3.406 15.472 711 H HIS 19 HN HIS 19 26.271 1.426 14.315 712 HA HIS 19 HA HIS 19 23.923 2.741 13.721 713 HB2 HIS 19 HB2 HIS 19 25.917 4.004 14.070 714 HB3 HIS 19 HB1 HIS 19 26.724 3.218 12.713 715 HD2 HIS 19 HD2 HIS 19 23.063 4.570 12.241 716 HE1 HIS 19 HE1 HIS 19 25.673 7.035 10.017 717 HE2 HIS 19 HE2 HIS 19 23.236 6.515 10.506 718 H PHE 20 HN PHE 20 26.092 1.049 11.479 719 HA PHE 20 HA PHE 20 24.457 1.682 9.190 720 HB2 PHE 20 HB2 PHE 20 27.040 0.597 9.681 721 HB3 PHE 20 HB1 PHE 20 26.142 -0.554 8.692 722 HD1 PHE 20 HD1 PHE 20 26.900 3.110 8.960 723 HD2 PHE 20 HD2 PHE 20 25.940 -0.196 6.391 724 HE1 PHE 20 HE1 PHE 20 27.216 4.560 6.974 725 HE2 PHE 20 HE2 PHE 20 26.257 1.255 4.406 726 HZ PHE 20 HZ PHE 20 26.890 3.632 4.699 727 H MET 21 HN MET 21 24.573 -0.873 11.568 728 HA MET 21 HA MET 21 23.166 -2.827 10.023 729 HB2 MET 21 HB2 MET 21 23.762 -2.448 12.939 730 HB3 MET 21 HB1 MET 21 22.701 -3.745 12.389 731 HG2 MET 21 HG2 MET 21 24.420 -4.696 11.019 732 HG3 MET 21 HG1 MET 21 25.468 -3.298 11.241 733 HE1 MET 21 HE1 MET 21 27.612 -5.078 12.245 734 HE2 MET 21 HE2 MET 21 26.367 -5.970 11.374 735 HE3 MET 21 HE3 MET 21 26.935 -6.559 12.934 736 H ALA 22 HN ALA 22 22.095 -0.861 12.791 737 HA ALA 22 HA ALA 22 19.350 -1.477 12.501 738 HB1 ALA 22 HB1 ALA 22 20.558 -0.490 14.538 739 HB2 ALA 22 HB2 ALA 22 18.952 0.141 14.170 740 HB3 ALA 22 HB3 ALA 22 20.386 1.069 13.731 741 H TRP 23 HN TRP 23 21.310 1.246 11.333 742 HA TRP 23 HA TRP 23 19.180 2.759 10.254 743 HB2 TRP 23 HB2 TRP 23 21.492 3.608 10.645 744 HB3 TRP 23 HB1 TRP 23 22.035 2.656 9.263 745 HD1 TRP 23 HD1 TRP 23 19.336 5.309 10.028 746 HE1 TRP 23 HE1 TRP 23 19.104 6.832 7.963 747 HE3 TRP 23 HE3 TRP 23 22.652 3.034 6.883 748 HZ2 TRP 23 HZ2 TRP 23 20.183 7.055 5.325 749 HZ3 TRP 23 HZ3 TRP 23 23.029 3.922 4.600 750 HH2 TRP 23 HH2 TRP 23 21.800 5.928 3.817 751 H THR 24 HN THR 24 21.158 0.155 8.903 752 HA THR 24 HA THR 24 20.185 0.366 6.237 753 HB THR 24 HB THR 24 21.509 -1.848 7.787 754 HG1 THR 24 HG1 THR 24 23.238 -1.170 6.740 755 HG21 THR 24 HG21 THR 24 20.440 -1.858 4.962 756 HG22 THR 24 HG22 THR 24 20.132 -3.027 6.247 757 HG23 THR 24 HG23 THR 24 21.725 -2.944 5.496 758 H ILE 25 HN ILE 25 19.193 -1.613 9.013 759 HA ILE 25 HA ILE 25 17.220 -3.117 7.680 760 HB ILE 25 HB ILE 25 17.454 -2.281 10.576 761 HG12 ILE 25 HG12 ILE 25 17.987 -4.956 9.253 762 HG13 ILE 25 HG11 ILE 25 19.246 -3.751 9.523 763 HG21 ILE 25 HG21 ILE 25 15.888 -4.284 10.899 764 HG22 ILE 25 HG22 ILE 25 15.549 -4.169 9.172 765 HG23 ILE 25 HG23 ILE 25 15.151 -2.824 10.240 766 HD11 ILE 25 HD11 ILE 25 17.609 -5.229 11.588 767 HD12 ILE 25 HD12 ILE 25 18.503 -3.763 11.985 768 HD13 ILE 25 HD13 ILE 25 19.363 -5.192 11.413 769 H GLY 26 HN GLY 26 17.055 -0.020 9.394 770 HA2 GLY 26 HA2 GLY 26 14.262 0.357 9.213 771 HA3 GLY 26 HA1 GLY 26 15.453 1.638 9.419 772 H HIS 27 HN HIS 27 16.922 1.220 7.045 773 HA HIS 27 HA HIS 27 15.342 2.684 5.180 774 HB2 HIS 27 HB2 HIS 27 17.653 3.110 5.100 775 HB3 HIS 27 HB1 HIS 27 18.058 1.393 5.042 776 HD2 HIS 27 HD2 HIS 27 18.186 0.328 2.479 777 HE1 HIS 27 HE1 HIS 27 16.606 3.651 0.408 778 HE2 HIS 27 HE2 HIS 27 17.677 1.364 0.137 779 H LEU 28 HN LEU 28 16.349 -0.698 5.396 780 HA LEU 28 HA LEU 28 15.382 -1.507 2.859 781 HB2 LEU 28 HB2 LEU 28 16.922 -2.712 4.663 782 HB3 LEU 28 HB1 LEU 28 15.379 -3.417 5.148 783 HG LEU 28 HG LEU 28 15.297 -3.597 2.387 784 HD11 LEU 28 HD11 LEU 28 17.688 -2.936 2.292 785 HD12 LEU 28 HD12 LEU 28 17.444 -4.589 1.727 786 HD13 LEU 28 HD13 LEU 28 18.091 -4.295 3.341 787 HD21 LEU 28 HD21 LEU 28 14.689 -5.286 4.186 788 HD22 LEU 28 HD22 LEU 28 16.397 -5.722 4.247 789 HD23 LEU 28 HD23 LEU 28 15.476 -5.969 2.763 790 H ASN 29 HN ASN 29 13.442 -2.357 2.219 791 HA ASN 29 HA ASN 29 11.273 -2.504 4.204 792 HB2 ASN 29 HB2 ASN 29 11.110 -1.052 1.552 793 HB3 ASN 29 HB1 ASN 29 9.754 -1.345 2.639 794 HD21 ASN 29 HD21 ASN 29 11.274 1.234 1.771 795 HD22 ASN 29 HD22 ASN 29 11.601 2.004 3.248 796 H GLN 30 HN GLN 30 9.911 -4.191 3.909 797 HA GLN 30 HA GLN 30 10.466 -5.964 1.626 798 HB2 GLN 30 HB2 GLN 30 9.056 -6.473 4.257 799 HB3 GLN 30 HB1 GLN 30 9.279 -7.676 2.986 800 HG2 GLN 30 HG2 GLN 30 11.594 -6.168 4.212 801 HG3 GLN 30 HG1 GLN 30 11.014 -7.701 4.862 802 HE21 GLN 30 HE21 GLN 30 11.205 -9.629 3.457 803 HE22 GLN 30 HE22 GLN 30 12.307 -9.639 2.166 804 H ILE 31 HN ILE 31 9.041 -6.189 0.026 805 HA ILE 31 HA ILE 31 6.211 -5.537 0.521 806 HB ILE 31 HB ILE 31 6.119 -4.321 -1.631 807 HG12 ILE 31 HG12 ILE 31 9.148 -4.506 -1.553 808 HG13 ILE 31 HG11 ILE 31 8.130 -5.482 -2.612 809 HG21 ILE 31 HG21 ILE 31 7.299 -2.295 -0.852 810 HG22 ILE 31 HG22 ILE 31 8.189 -3.266 0.321 811 HG23 ILE 31 HG23 ILE 31 6.442 -3.079 0.475 812 HD11 ILE 31 HD11 ILE 31 7.236 -3.460 -3.665 813 HD12 ILE 31 HD12 ILE 31 8.997 -3.457 -3.764 814 HD13 ILE 31 HD13 ILE 31 8.178 -2.449 -2.570 815 H LYS 32 HN LYS 32 4.741 -6.661 -0.764 816 HA LYS 32 HA LYS 32 5.887 -8.753 -2.509 817 HB2 LYS 32 HB2 LYS 32 3.963 -8.995 -0.239 818 HB3 LYS 32 HB1 LYS 32 3.725 -10.037 -1.642 819 HG2 LYS 32 HG2 LYS 32 6.445 -9.765 -0.372 820 HG3 LYS 32 HG1 LYS 32 5.257 -10.898 0.273 821 HD2 LYS 32 HD2 LYS 32 5.075 -11.995 -1.909 822 HD3 LYS 32 HD1 LYS 32 6.202 -10.831 -2.609 823 HE2 LYS 32 HE2 LYS 32 7.949 -11.596 -1.020 824 HE3 LYS 32 HE1 LYS 32 6.823 -12.795 -0.382 825 HZ1 LYS 32 HZ1 LYS 32 8.234 -13.806 -2.020 826 HZ2 LYS 32 HZ2 LYS 32 7.829 -12.623 -3.171 827 HZ3 LYS 32 HZ3 LYS 32 6.655 -13.727 -2.633 828 H ARG 33 HN ARG 33 5.377 -7.893 -4.466 829 HA ARG 33 HA ARG 33 2.726 -6.772 -4.935 830 HB2 ARG 33 HB2 ARG 33 5.245 -6.292 -6.015 831 HB3 ARG 33 HB1 ARG 33 4.386 -7.145 -7.297 832 HG2 ARG 33 HG2 ARG 33 3.791 -4.903 -7.678 833 HG3 ARG 33 HG1 ARG 33 2.426 -5.515 -6.743 834 HD2 ARG 33 HD2 ARG 33 3.295 -4.563 -4.713 835 HD3 ARG 33 HD1 ARG 33 4.816 -4.146 -5.495 836 HE ARG 33 HE ARG 33 2.652 -2.889 -6.840 837 HH11 ARG 33 HH11 ARG 33 4.526 -2.772 -3.895 838 HH12 ARG 33 HH12 ARG 33 4.272 -1.077 -3.661 839 HH21 ARG 33 HH21 ARG 33 2.338 -0.669 -6.503 840 HH22 ARG 33 HH22 ARG 33 3.044 0.105 -5.125 841 H1 MET 1 HT1 MET 1 55.254 7.033 6.252 842 H2 MET 1 HT2 MET 1 54.515 6.837 4.734 843 H3 MET 1 HT3 MET 1 56.157 6.453 4.939 844 HA MET 1 HA MET 1 55.690 4.570 6.230 845 HB2 MET 1 HB2 MET 1 53.256 6.080 6.763 846 HB3 MET 1 HB1 MET 1 52.899 4.398 6.372 847 HG2 MET 1 HG2 MET 1 53.977 3.591 8.234 848 HG3 MET 1 HG1 MET 1 55.173 4.888 8.233 849 HE1 MET 1 HE1 MET 1 55.133 6.613 10.217 850 HE2 MET 1 HE2 MET 1 53.795 7.749 10.056 851 HE3 MET 1 HE3 MET 1 54.686 7.239 8.624 852 H PHE 2 HN PHE 2 54.738 2.540 5.433 853 HA PHE 2 HA PHE 2 54.852 2.333 2.634 854 HB2 PHE 2 HB2 PHE 2 55.323 0.409 4.011 855 HB3 PHE 2 HB1 PHE 2 53.702 0.451 4.706 856 HD1 PHE 2 HD1 PHE 2 55.541 0.051 1.477 857 HD2 PHE 2 HD2 PHE 2 51.905 -0.659 3.652 858 HE1 PHE 2 HE1 PHE 2 54.703 -1.358 -0.383 859 HE2 PHE 2 HE2 PHE 2 51.068 -2.068 1.790 860 HZ PHE 2 HZ PHE 2 52.466 -2.417 -0.227 861 H GLU 3 HN GLU 3 52.053 2.250 4.831 862 HA GLU 3 HA GLU 3 50.172 2.096 2.677 863 HB2 GLU 3 HB2 GLU 3 49.842 2.650 5.630 864 HB3 GLU 3 HB1 GLU 3 48.490 2.550 4.505 865 HG2 GLU 3 HG2 GLU 3 48.626 0.357 5.303 866 HG3 GLU 3 HG1 GLU 3 49.552 0.275 3.807 867 HA PRO 4 HA PRO 4 49.475 6.279 1.500 868 HB2 PRO 4 HB2 PRO 4 46.631 5.983 2.365 869 HB3 PRO 4 HB1 PRO 4 47.286 6.488 0.796 870 HG2 PRO 4 HG2 PRO 4 46.242 4.066 1.155 871 HG3 PRO 4 HG1 PRO 4 47.635 4.334 0.094 872 HD2 PRO 4 HD2 PRO 4 47.538 3.094 2.792 873 HD3 PRO 4 HD1 PRO 4 48.637 2.767 1.440 874 H PHE 5 HN PHE 5 47.985 5.308 4.569 875 HA PHE 5 HA PHE 5 49.137 7.558 5.947 876 HB2 PHE 5 HB2 PHE 5 46.522 7.867 4.852 877 HB3 PHE 5 HB1 PHE 5 46.363 7.743 6.604 878 HD1 PHE 5 HD1 PHE 5 47.849 9.664 3.828 879 HD2 PHE 5 HD2 PHE 5 47.357 9.395 8.086 880 HE1 PHE 5 HE1 PHE 5 48.679 11.988 4.071 881 HE2 PHE 5 HE2 PHE 5 48.186 11.719 8.330 882 HZ PHE 5 HZ PHE 5 48.847 13.016 6.322 883 H GLN 6 HN GLN 6 46.194 5.610 6.492 884 HA GLN 6 HA GLN 6 47.525 3.883 8.381 885 HB2 GLN 6 HB2 GLN 6 47.038 6.137 9.586 886 HB3 GLN 6 HB1 GLN 6 45.354 5.607 9.552 887 HG2 GLN 6 HG2 GLN 6 45.918 3.561 10.733 888 HG3 GLN 6 HG1 GLN 6 47.636 3.945 10.655 889 HE21 GLN 6 HE21 GLN 6 48.462 5.591 12.103 890 HE22 GLN 6 HE22 GLN 6 47.529 6.204 13.382 891 H ILE 7 HN ILE 7 46.023 2.274 9.280 892 HA ILE 7 HA ILE 7 44.255 1.263 7.332 893 HB ILE 7 HB ILE 7 44.570 0.631 10.275 894 HG12 ILE 7 HG12 ILE 7 45.401 -0.927 7.811 895 HG13 ILE 7 HG11 ILE 7 46.476 0.184 8.661 896 HG21 ILE 7 HG21 ILE 7 42.337 -0.039 9.644 897 HG22 ILE 7 HG22 ILE 7 43.341 -1.489 9.653 898 HG23 ILE 7 HG23 ILE 7 42.917 -0.719 8.124 899 HD11 ILE 7 HD11 ILE 7 46.917 -2.006 9.544 900 HD12 ILE 7 HD12 ILE 7 45.196 -2.334 9.751 901 HD13 ILE 7 HD13 ILE 7 45.995 -1.141 10.775 902 H LEU 8 HN LEU 8 43.680 3.073 10.312 903 HA LEU 8 HA LEU 8 40.831 2.967 10.194 904 HB2 LEU 8 HB2 LEU 8 42.748 4.791 11.651 905 HB3 LEU 8 HB1 LEU 8 40.996 4.931 11.800 906 HG LEU 8 HG LEU 8 42.434 2.314 12.270 907 HD11 LEU 8 HD11 LEU 8 41.667 4.414 14.324 908 HD12 LEU 8 HD12 LEU 8 43.318 4.047 13.823 909 HD13 LEU 8 HD13 LEU 8 42.362 2.830 14.669 910 HD21 LEU 8 HD21 LEU 8 40.058 2.078 11.916 911 HD22 LEU 8 HD22 LEU 8 39.709 3.450 12.967 912 HD23 LEU 8 HD23 LEU 8 40.329 1.948 13.652 913 H SER 9 HN SER 9 43.238 5.142 8.912 914 HA SER 9 HA SER 9 41.415 7.201 8.102 915 HB2 SER 9 HB2 SER 9 43.775 7.703 8.441 916 HB3 SER 9 HB1 SER 9 44.221 6.585 7.155 917 HG SER 9 HG SER 9 43.111 7.899 5.698 918 H ILE 10 HN ILE 10 42.944 4.463 6.447 919 HA ILE 10 HA ILE 10 41.919 5.033 3.868 920 HB ILE 10 HB ILE 10 42.831 2.442 5.133 921 HG12 ILE 10 HG12 ILE 10 44.226 4.160 3.073 922 HG13 ILE 10 HG11 ILE 10 44.452 4.415 4.802 923 HG21 ILE 10 HG21 ILE 10 42.118 3.138 2.270 924 HG22 ILE 10 HG22 ILE 10 41.385 1.889 3.277 925 HG23 ILE 10 HG23 ILE 10 43.050 1.711 2.721 926 HD11 ILE 10 HD11 ILE 10 45.282 2.079 3.106 927 HD12 ILE 10 HD12 ILE 10 44.944 1.811 4.817 928 HD13 ILE 10 HD13 ILE 10 46.199 2.948 4.335 929 H CYS 11 HN CYS 11 40.764 2.917 6.500 930 HA CYS 11 HA CYS 11 38.565 1.828 5.129 931 HB2 CYS 11 HB2 CYS 11 39.052 2.336 8.066 932 HB3 CYS 11 HB1 CYS 11 37.646 1.462 7.456 933 HG CYS 11 HG CYS 11 39.101 -0.530 7.343 934 H SER 12 HN SER 12 38.701 4.621 7.380 935 HA SER 12 HA SER 12 36.007 5.334 7.164 936 HB2 SER 12 HB2 SER 12 38.447 7.035 7.679 937 HB3 SER 12 HB1 SER 12 36.792 7.602 7.877 938 HG SER 12 HG SER 12 36.488 5.944 9.407 939 H PHE 13 HN PHE 13 38.786 6.185 5.163 940 HA PHE 13 HA PHE 13 37.589 8.191 3.595 941 HB2 PHE 13 HB2 PHE 13 39.977 7.821 3.522 942 HB3 PHE 13 HB1 PHE 13 39.743 6.185 2.904 943 HD1 PHE 13 HD1 PHE 13 39.382 9.789 2.112 944 HD2 PHE 13 HD2 PHE 13 39.224 5.776 0.592 945 HE1 PHE 13 HE1 PHE 13 39.311 10.670 -0.205 946 HE2 PHE 13 HE2 PHE 13 39.155 6.655 -1.725 947 HZ PHE 13 HZ PHE 13 39.199 9.102 -2.125 948 H ILE 14 HN ILE 14 37.861 4.680 2.985 949 HA ILE 14 HA ILE 14 36.374 4.742 0.562 950 HB ILE 14 HB ILE 14 36.997 2.496 2.484 951 HG12 ILE 14 HG12 ILE 14 38.087 3.098 -0.279 952 HG13 ILE 14 HG11 ILE 14 38.867 3.650 1.203 953 HG21 ILE 14 HG21 ILE 14 34.991 1.882 1.275 954 HG22 ILE 14 HG22 ILE 14 36.347 1.035 0.534 955 HG23 ILE 14 HG23 ILE 14 35.673 2.467 -0.242 956 HD11 ILE 14 HD11 ILE 14 38.370 0.791 0.339 957 HD12 ILE 14 HD12 ILE 14 38.875 1.230 1.971 958 HD13 ILE 14 HD13 ILE 14 39.927 1.580 0.598 959 H LEU 15 HN LEU 15 35.493 4.083 3.918 960 HA LEU 15 HA LEU 15 32.816 3.318 3.461 961 HB2 LEU 15 HB2 LEU 15 34.162 4.543 5.883 962 HB3 LEU 15 HB1 LEU 15 32.517 3.907 5.883 963 HG LEU 15 HG LEU 15 34.838 2.217 4.955 964 HD11 LEU 15 HD11 LEU 15 35.363 2.995 7.238 965 HD12 LEU 15 HD12 LEU 15 34.934 1.283 7.245 966 HD13 LEU 15 HD13 LEU 15 33.763 2.488 7.783 967 HD21 LEU 15 HD21 LEU 15 32.481 1.523 4.462 968 HD22 LEU 15 HD22 LEU 15 32.151 1.535 6.194 969 HD23 LEU 15 HD23 LEU 15 33.315 0.391 5.526 970 H SER 16 HN SER 16 34.385 6.410 3.554 971 HA SER 16 HA SER 16 31.929 7.904 3.944 972 HB2 SER 16 HB2 SER 16 33.302 9.857 3.780 973 HB3 SER 16 HB1 SER 16 34.192 8.677 4.737 974 HG SER 16 HG SER 16 34.627 9.594 2.128 975 H ALA 17 HN ALA 17 34.141 7.139 1.270 976 HA ALA 17 HA ALA 17 32.913 8.729 -0.697 977 HB1 ALA 17 HB1 ALA 17 34.228 7.566 -2.239 978 HB2 ALA 17 HB2 ALA 17 34.104 6.050 -1.347 979 HB3 ALA 17 HB3 ALA 17 35.138 7.344 -0.743 980 H LEU 18 HN LEU 18 32.381 5.308 0.183 981 HA LEU 18 HA LEU 18 30.288 4.925 -1.711 982 HB2 LEU 18 HB2 LEU 18 31.446 3.403 0.553 983 HB3 LEU 18 HB1 LEU 18 29.793 2.998 0.088 984 HG LEU 18 HG LEU 18 31.625 1.696 -1.107 985 HD11 LEU 18 HD11 LEU 18 29.908 3.323 -2.992 986 HD12 LEU 18 HD12 LEU 18 29.228 2.089 -1.931 987 HD13 LEU 18 HD13 LEU 18 30.415 1.643 -3.157 988 HD21 LEU 18 HD21 LEU 18 32.957 2.760 -2.762 989 HD22 LEU 18 HD22 LEU 18 33.044 3.846 -1.376 990 HD23 LEU 18 HD23 LEU 18 31.980 4.227 -2.730 991 H HIS 19 HN HIS 19 30.376 5.744 1.728 992 HA HIS 19 HA HIS 19 27.689 5.582 2.317 993 HB2 HIS 19 HB2 HIS 19 29.248 6.057 4.062 994 HB3 HIS 19 HB1 HIS 19 29.771 7.544 3.271 995 HD2 HIS 19 HD2 HIS 19 25.924 6.806 3.605 996 HE1 HIS 19 HE1 HIS 19 26.883 9.992 6.205 997 HE2 HIS 19 HE2 HIS 19 24.980 8.640 5.208 998 H PHE 20 HN PHE 20 29.425 8.292 0.821 999 HA PHE 20 HA PHE 20 27.041 9.907 0.649 1000 HB2 PHE 20 HB2 PHE 20 29.843 10.271 0.320 1001 HB3 PHE 20 HB1 PHE 20 29.046 10.787 -1.166 1002 HD1 PHE 20 HD1 PHE 20 28.778 11.096 2.562 1003 HD2 PHE 20 HD2 PHE 20 28.026 12.888 -1.270 1004 HE1 PHE 20 HE1 PHE 20 28.013 13.171 3.681 1005 HE2 PHE 20 HE2 PHE 20 27.261 14.963 -0.148 1006 HZ PHE 20 HZ PHE 20 27.243 15.094 2.328 1007 H MET 21 HN MET 21 28.620 7.520 -1.350 1008 HA MET 21 HA MET 21 27.418 8.314 -3.823 1009 HB2 MET 21 HB2 MET 21 28.774 5.835 -2.817 1010 HB3 MET 21 HB1 MET 21 28.006 5.870 -4.404 1011 HG2 MET 21 HG2 MET 21 29.398 7.674 -5.141 1012 HG3 MET 21 HG1 MET 21 30.018 7.953 -3.517 1013 HE1 MET 21 HE1 MET 21 32.775 7.634 -4.525 1014 HE2 MET 21 HE2 MET 21 31.635 7.922 -5.836 1015 HE3 MET 21 HE3 MET 21 32.818 6.624 -5.976 1016 H ALA 22 HN ALA 22 26.761 5.511 -1.721 1017 HA ALA 22 HA ALA 22 24.360 4.775 -3.023 1018 HB1 ALA 22 HB1 ALA 22 25.817 3.375 -1.443 1019 HB2 ALA 22 HB2 ALA 22 24.069 3.205 -1.288 1020 HB3 ALA 22 HB3 ALA 22 24.965 4.191 -0.132 1021 H TRP 23 HN TRP 23 24.992 6.764 -0.148 1022 HA TRP 23 HA TRP 23 22.293 7.147 0.600 1023 HB2 TRP 23 HB2 TRP 23 24.268 7.661 2.034 1024 HB3 TRP 23 HB1 TRP 23 24.593 9.064 1.018 1025 HD1 TRP 23 HD1 TRP 23 21.643 7.612 3.044 1026 HE1 TRP 23 HE1 TRP 23 20.344 9.581 4.083 1027 HE3 TRP 23 HE3 TRP 23 24.289 11.531 1.114 1028 HZ2 TRP 23 HZ2 TRP 23 20.421 12.440 4.098 1029 HZ3 TRP 23 HZ3 TRP 23 23.656 13.865 1.659 1030 HH2 TRP 23 HH2 TRP 23 21.727 14.324 3.147 1031 H THR 24 HN THR 24 24.393 8.882 -1.655 1032 HA THR 24 HA THR 24 22.612 11.052 -2.138 1033 HB THR 24 HB THR 24 24.935 9.896 -3.665 1034 HG1 THR 24 HG1 THR 24 25.969 11.545 -2.787 1035 HG21 THR 24 HG21 THR 24 23.076 12.153 -4.425 1036 HG22 THR 24 HG22 THR 24 23.536 10.751 -5.391 1037 HG23 THR 24 HG23 THR 24 24.717 12.019 -5.058 1038 H ILE 25 HN ILE 25 23.146 7.947 -3.780 1039 HA ILE 25 HA ILE 25 21.372 8.386 -5.924 1040 HB ILE 25 HB ILE 25 22.261 5.831 -4.572 1041 HG12 ILE 25 HG12 ILE 25 23.086 7.040 -7.227 1042 HG13 ILE 25 HG11 ILE 25 23.967 7.329 -5.727 1043 HG21 ILE 25 HG21 ILE 25 21.518 4.824 -6.810 1044 HG22 ILE 25 HG22 ILE 25 20.627 6.324 -7.072 1045 HG23 ILE 25 HG23 ILE 25 20.226 5.289 -5.702 1046 HD11 ILE 25 HD11 ILE 25 23.563 4.707 -7.174 1047 HD12 ILE 25 HD12 ILE 25 24.080 4.770 -5.489 1048 HD13 ILE 25 HD13 ILE 25 25.083 5.492 -6.748 1049 H GLY 26 HN GLY 26 20.885 6.973 -2.709 1050 HA2 GLY 26 HA2 GLY 26 18.193 6.195 -3.048 1051 HA3 GLY 26 HA1 GLY 26 18.975 6.520 -1.503 1052 H HIS 27 HN HIS 27 19.674 9.219 -1.974 1053 HA HIS 27 HA HIS 27 17.236 10.522 -1.265 1054 HB2 HIS 27 HB2 HIS 27 19.182 11.441 -0.317 1055 HB3 HIS 27 HB1 HIS 27 20.017 11.501 -1.868 1056 HD2 HIS 27 HD2 HIS 27 19.626 13.852 -3.296 1057 HE1 HIS 27 HE1 HIS 27 16.595 15.494 -0.857 1058 HE2 HIS 27 HE2 HIS 27 18.130 15.942 -2.831 1059 H LEU 28 HN LEU 28 19.169 10.386 -4.221 1060 HA LEU 28 HA LEU 28 17.725 12.358 -5.660 1061 HB2 LEU 28 HB2 LEU 28 20.032 11.118 -6.132 1062 HB3 LEU 28 HB1 LEU 28 18.988 10.070 -7.094 1063 HG LEU 28 HG LEU 28 18.094 12.603 -7.759 1064 HD11 LEU 28 HD11 LEU 28 20.039 13.582 -6.566 1065 HD12 LEU 28 HD12 LEU 28 20.110 13.894 -8.300 1066 HD13 LEU 28 HD13 LEU 28 21.123 12.638 -7.588 1067 HD21 LEU 28 HD21 LEU 28 18.597 10.575 -9.208 1068 HD22 LEU 28 HD22 LEU 28 20.284 11.089 -9.206 1069 HD23 LEU 28 HD23 LEU 28 19.047 12.126 -9.916 1070 H ASN 29 HN ASN 29 16.004 12.207 -7.042 1071 HA ASN 29 HA ASN 29 14.711 9.581 -7.362 1072 HB2 ASN 29 HB2 ASN 29 13.313 12.114 -6.469 1073 HB3 ASN 29 HB1 ASN 29 12.513 10.599 -6.885 1074 HD21 ASN 29 HD21 ASN 29 12.872 12.142 -4.207 1075 HD22 ASN 29 HD22 ASN 29 13.424 10.944 -3.139 1076 H GLN 30 HN GLN 30 13.869 9.242 -9.352 1077 HA GLN 30 HA GLN 30 14.148 11.426 -11.305 1078 HB2 GLN 30 HB2 GLN 30 13.847 8.436 -11.679 1079 HB3 GLN 30 HB1 GLN 30 13.991 9.605 -12.992 1080 HG2 GLN 30 HG2 GLN 30 16.044 9.394 -10.783 1081 HG3 GLN 30 HG1 GLN 30 16.161 8.457 -12.272 1082 HE21 GLN 30 HE21 GLN 30 16.435 9.680 -14.315 1083 HE22 GLN 30 HE22 GLN 30 17.032 11.268 -14.283 1084 H ILE 31 HN ILE 31 12.415 12.399 -12.138 1085 HA ILE 31 HA ILE 31 9.826 10.997 -12.106 1086 HB ILE 31 HB ILE 31 8.717 13.068 -11.334 1087 HG12 ILE 31 HG12 ILE 31 11.535 14.043 -10.774 1088 HG13 ILE 31 HG11 ILE 31 10.556 14.596 -12.132 1089 HG21 ILE 31 HG21 ILE 31 9.455 12.916 -8.984 1090 HG22 ILE 31 HG22 ILE 31 10.910 12.059 -9.496 1091 HG23 ILE 31 HG23 ILE 31 9.326 11.314 -9.710 1092 HD11 ILE 31 HD11 ILE 31 8.840 15.428 -10.595 1093 HD12 ILE 31 HD12 ILE 31 10.403 16.136 -10.186 1094 HD13 ILE 31 HD13 ILE 31 9.753 14.816 -9.215 1095 H LYS 32 HN LYS 32 8.420 11.564 -13.761 1096 HA LYS 32 HA LYS 32 9.487 13.438 -15.783 1097 HB2 LYS 32 HB2 LYS 32 8.528 10.629 -16.082 1098 HB3 LYS 32 HB1 LYS 32 8.167 11.773 -17.376 1099 HG2 LYS 32 HG2 LYS 32 10.953 11.565 -16.245 1100 HG3 LYS 32 HG1 LYS 32 10.405 10.453 -17.501 1101 HD2 LYS 32 HD2 LYS 32 9.862 12.334 -18.971 1102 HD3 LYS 32 HD1 LYS 32 10.326 13.478 -17.711 1103 HE2 LYS 32 HE2 LYS 32 12.630 12.549 -17.745 1104 HE3 LYS 32 HE1 LYS 32 12.155 11.464 -19.051 1105 HZ1 LYS 32 HZ1 LYS 32 13.201 13.407 -19.960 1106 HZ2 LYS 32 HZ2 LYS 32 12.136 14.433 -19.123 1107 HZ3 LYS 32 HZ3 LYS 32 11.555 13.432 -20.367 1108 H ARG 33 HN ARG 33 8.164 15.162 -15.419 1109 HA ARG 33 HA ARG 33 5.298 14.756 -15.060 1110 HB2 ARG 33 HB2 ARG 33 7.097 16.686 -14.182 1111 HB3 ARG 33 HB1 ARG 33 6.158 17.513 -15.424 1112 HG2 ARG 33 HG2 ARG 33 4.861 17.839 -13.491 1113 HG3 ARG 33 HG1 ARG 33 4.095 16.438 -14.244 1114 HD2 ARG 33 HD2 ARG 33 5.250 14.924 -12.776 1115 HD3 ARG 33 HD1 ARG 33 6.263 16.219 -12.147 1116 HE ARG 33 HE ARG 33 3.520 16.816 -11.697 1117 HH11 ARG 33 HH11 ARG 33 6.119 14.743 -10.626 1118 HH12 ARG 33 HH12 ARG 33 5.482 14.574 -9.026 1119 HH21 ARG 33 HH21 ARG 33 2.714 16.574 -9.593 1120 HH22 ARG 33 HH22 ARG 33 3.572 15.602 -8.444 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 49.206 32.091 9.738 2 H2 MET 1 HT2 MET 1 49.943 31.761 11.233 3 H3 MET 1 HT3 MET 1 48.637 30.816 10.700 4 HA MET 1 HA MET 1 50.250 30.418 8.665 5 HB2 MET 1 HB2 MET 1 51.969 31.905 9.749 6 HB3 MET 1 HB1 MET 1 52.098 30.719 11.048 7 HG2 MET 1 HG2 MET 1 52.317 29.650 8.287 8 HG3 MET 1 HG1 MET 1 53.659 30.655 8.836 9 HE1 MET 1 HE1 MET 1 54.991 27.042 9.227 10 HE2 MET 1 HE2 MET 1 55.461 28.687 8.809 11 HE3 MET 1 HE3 MET 1 54.128 27.915 7.955 12 H PHE 2 HN PHE 2 49.424 29.705 11.962 13 HA PHE 2 HA PHE 2 50.056 26.858 11.605 14 HB2 PHE 2 HB2 PHE 2 49.161 28.412 14.044 15 HB3 PHE 2 HB1 PHE 2 49.539 26.690 14.022 16 HD1 PHE 2 HD1 PHE 2 50.891 30.071 14.053 17 HD2 PHE 2 HD2 PHE 2 51.862 25.926 13.482 18 HE1 PHE 2 HE1 PHE 2 53.297 30.595 14.344 19 HE2 PHE 2 HE2 PHE 2 54.268 26.450 13.774 20 HZ PHE 2 HZ PHE 2 54.986 28.784 14.203 21 H GLU 3 HN GLU 3 48.520 25.551 10.881 22 HA GLU 3 HA GLU 3 45.798 26.405 10.668 23 HB2 GLU 3 HB2 GLU 3 47.169 23.777 10.095 24 HB3 GLU 3 HB1 GLU 3 45.444 24.035 9.837 25 HG2 GLU 3 HG2 GLU 3 45.969 25.947 8.351 26 HG3 GLU 3 HG1 GLU 3 47.689 25.632 8.576 27 HA PRO 4 HA PRO 4 43.883 25.012 14.381 28 HB2 PRO 4 HB2 PRO 4 42.164 23.224 12.712 29 HB3 PRO 4 HB1 PRO 4 41.692 24.444 13.910 30 HG2 PRO 4 HG2 PRO 4 41.456 24.901 11.302 31 HG3 PRO 4 HG1 PRO 4 41.920 26.183 12.432 32 HD2 PRO 4 HD2 PRO 4 43.592 24.719 10.456 33 HD3 PRO 4 HD1 PRO 4 43.749 26.380 11.067 34 H PHE 5 HN PHE 5 44.430 22.406 12.012 35 HA PHE 5 HA PHE 5 45.863 20.836 13.978 36 HB2 PHE 5 HB2 PHE 5 43.117 20.088 13.041 37 HB3 PHE 5 HB1 PHE 5 44.299 18.818 13.356 38 HD1 PHE 5 HD1 PHE 5 41.950 21.105 14.821 39 HD2 PHE 5 HD2 PHE 5 45.516 18.850 15.628 40 HE1 PHE 5 HE1 PHE 5 41.535 21.319 17.257 41 HE2 PHE 5 HE2 PHE 5 45.100 19.063 18.063 42 HZ PHE 5 HZ PHE 5 43.110 20.298 18.878 43 H GLN 6 HN GLN 6 44.150 20.447 10.864 44 HA GLN 6 HA GLN 6 46.535 20.233 9.341 45 HB2 GLN 6 HB2 GLN 6 46.549 17.876 8.833 46 HB3 GLN 6 HB1 GLN 6 46.624 18.056 10.587 47 HG2 GLN 6 HG2 GLN 6 44.020 17.902 10.463 48 HG3 GLN 6 HG1 GLN 6 44.307 17.192 8.875 49 HE21 GLN 6 HE21 GLN 6 44.929 14.997 8.815 50 HE22 GLN 6 HE22 GLN 6 45.304 14.082 10.194 51 H ILE 7 HN ILE 7 46.026 19.377 7.093 52 HA ILE 7 HA ILE 7 43.862 20.799 6.007 53 HB ILE 7 HB ILE 7 45.536 18.537 4.906 54 HG12 ILE 7 HG12 ILE 7 46.011 20.799 3.432 55 HG13 ILE 7 HG11 ILE 7 45.691 21.483 5.026 56 HG21 ILE 7 HG21 ILE 7 43.474 18.413 3.694 57 HG22 ILE 7 HG22 ILE 7 44.586 19.326 2.675 58 HG23 ILE 7 HG23 ILE 7 43.346 20.169 3.602 59 HD11 ILE 7 HD11 ILE 7 47.586 19.157 4.660 60 HD12 ILE 7 HD12 ILE 7 47.455 20.259 6.032 61 HD13 ILE 7 HD13 ILE 7 48.129 20.828 4.506 62 H LEU 8 HN LEU 8 44.188 17.401 6.918 63 HA LEU 8 HA LEU 8 41.740 16.478 5.845 64 HB2 LEU 8 HB2 LEU 8 43.725 15.116 6.781 65 HB3 LEU 8 HB1 LEU 8 42.979 15.371 8.360 66 HG LEU 8 HG LEU 8 41.039 14.536 6.341 67 HD11 LEU 8 HD11 LEU 8 43.432 12.783 6.947 68 HD12 LEU 8 HD12 LEU 8 42.819 13.261 5.363 69 HD13 LEU 8 HD13 LEU 8 41.897 12.138 6.364 70 HD21 LEU 8 HD21 LEU 8 40.610 12.814 8.161 71 HD22 LEU 8 HD22 LEU 8 40.493 14.493 8.686 72 HD23 LEU 8 HD23 LEU 8 41.934 13.550 9.064 73 H SER 9 HN SER 9 42.559 18.117 8.821 74 HA SER 9 HA SER 9 40.023 17.669 10.106 75 HB2 SER 9 HB2 SER 9 42.285 19.581 10.692 76 HB3 SER 9 HB1 SER 9 40.832 19.455 11.680 77 HG SER 9 HG SER 9 42.773 18.105 12.224 78 H ILE 10 HN ILE 10 41.468 20.256 8.188 79 HA ILE 10 HA ILE 10 39.430 22.177 8.578 80 HB ILE 10 HB ILE 10 41.411 21.763 6.332 81 HG12 ILE 10 HG12 ILE 10 41.295 23.894 8.484 82 HG13 ILE 10 HG11 ILE 10 42.187 22.384 8.684 83 HG21 ILE 10 HG21 ILE 10 40.801 24.202 5.818 84 HG22 ILE 10 HG22 ILE 10 39.356 23.936 6.795 85 HG23 ILE 10 HG23 ILE 10 39.621 22.983 5.335 86 HD11 ILE 10 HD11 ILE 10 43.385 22.940 6.510 87 HD12 ILE 10 HD12 ILE 10 43.764 23.999 7.868 88 HD13 ILE 10 HD13 ILE 10 42.652 24.541 6.611 89 H CYS 11 HN CYS 11 39.930 19.738 6.030 90 HA CYS 11 HA CYS 11 37.656 20.397 4.492 91 HB2 CYS 11 HB2 CYS 11 39.196 17.819 4.819 92 HB3 CYS 11 HB1 CYS 11 37.876 18.010 3.664 93 HG CYS 11 HG CYS 11 39.355 20.095 2.688 94 H SER 12 HN SER 12 38.123 17.854 6.975 95 HA SER 12 HA SER 12 35.533 16.853 6.987 96 HB2 SER 12 HB2 SER 12 37.329 15.780 8.226 97 HB3 SER 12 HB1 SER 12 37.469 17.176 9.290 98 HG SER 12 HG SER 12 35.503 15.191 9.155 99 H PHE 13 HN PHE 13 36.868 19.648 8.700 100 HA PHE 13 HA PHE 13 34.643 20.243 10.306 101 HB2 PHE 13 HB2 PHE 13 36.871 21.291 10.574 102 HB3 PHE 13 HB1 PHE 13 36.620 22.175 9.068 103 HD1 PHE 13 HD1 PHE 13 35.406 21.728 12.542 104 HD2 PHE 13 HD2 PHE 13 35.172 24.093 8.965 105 HE1 PHE 13 HE1 PHE 13 34.156 23.475 13.780 106 HE2 PHE 13 HE2 PHE 13 33.920 25.840 10.203 107 HZ PHE 13 HZ PHE 13 33.412 25.532 12.610 108 H ILE 14 HN ILE 14 35.507 21.409 7.047 109 HA ILE 14 HA ILE 14 33.233 23.065 6.708 110 HB ILE 14 HB ILE 14 35.025 21.701 4.683 111 HG12 ILE 14 HG12 ILE 14 34.894 24.602 5.560 112 HG13 ILE 14 HG11 ILE 14 35.996 23.430 6.282 113 HG21 ILE 14 HG21 ILE 14 32.827 23.762 4.371 114 HG22 ILE 14 HG22 ILE 14 32.954 22.196 3.568 115 HG23 ILE 14 HG23 ILE 14 34.072 23.496 3.150 116 HD11 ILE 14 HD11 ILE 14 35.933 24.420 3.428 117 HD12 ILE 14 HD12 ILE 14 36.781 22.939 3.877 118 HD13 ILE 14 HD13 ILE 14 37.271 24.483 4.576 119 H LEU 15 HN LEU 15 33.884 19.700 5.828 120 HA LEU 15 HA LEU 15 31.468 19.205 4.462 121 HB2 LEU 15 HB2 LEU 15 33.421 17.392 5.883 122 HB3 LEU 15 HB1 LEU 15 31.985 16.774 5.068 123 HG LEU 15 HG LEU 15 33.989 18.574 3.687 124 HD11 LEU 15 HD11 LEU 15 33.906 15.557 3.935 125 HD12 LEU 15 HD12 LEU 15 35.260 16.636 4.266 126 HD13 LEU 15 HD13 LEU 15 34.732 16.369 2.605 127 HD21 LEU 15 HD21 LEU 15 32.917 17.372 1.677 128 HD22 LEU 15 HD22 LEU 15 31.895 18.529 2.530 129 HD23 LEU 15 HD23 LEU 15 31.693 16.799 2.811 130 H SER 16 HN SER 16 32.286 19.329 7.833 131 HA SER 16 HA SER 16 29.957 17.942 8.772 132 HB2 SER 16 HB2 SER 16 31.908 19.791 10.149 133 HB3 SER 16 HB1 SER 16 30.602 18.945 10.974 134 HG SER 16 HG SER 16 32.561 17.769 11.045 135 H ALA 17 HN ALA 17 30.883 21.369 8.474 136 HA ALA 17 HA ALA 17 28.593 22.505 9.601 137 HB1 ALA 17 HB1 ALA 17 30.171 23.602 7.259 138 HB2 ALA 17 HB2 ALA 17 30.684 23.735 8.941 139 HB3 ALA 17 HB3 ALA 17 29.201 24.529 8.404 140 H LEU 18 HN LEU 18 29.278 21.800 6.153 141 HA LEU 18 HA LEU 18 26.700 22.547 5.237 142 HB2 LEU 18 HB2 LEU 18 28.652 20.614 3.979 143 HB3 LEU 18 HB1 LEU 18 27.329 21.454 3.169 144 HG LEU 18 HG LEU 18 29.675 22.808 4.527 145 HD11 LEU 18 HD11 LEU 18 30.451 21.753 2.513 146 HD12 LEU 18 HD12 LEU 18 30.220 23.461 2.140 147 HD13 LEU 18 HD13 LEU 18 29.023 22.274 1.619 148 HD21 LEU 18 HD21 LEU 18 27.292 23.846 2.971 149 HD22 LEU 18 HD22 LEU 18 28.734 24.813 3.276 150 HD23 LEU 18 HD23 LEU 18 27.753 24.247 4.626 151 H HIS 19 HN HIS 19 28.128 19.487 6.252 152 HA HIS 19 HA HIS 19 26.193 17.692 5.492 153 HB2 HIS 19 HB2 HIS 19 27.916 16.592 6.497 154 HB3 HIS 19 HB1 HIS 19 28.119 17.824 7.742 155 HD2 HIS 19 HD2 HIS 19 26.615 17.409 10.085 156 HE1 HIS 19 HE1 HIS 19 24.753 13.826 8.854 157 HE2 HIS 19 HE2 HIS 19 25.126 15.392 10.817 158 H PHE 20 HN PHE 20 26.258 19.483 8.574 159 HA PHE 20 HA PHE 20 23.657 18.527 9.342 160 HB2 PHE 20 HB2 PHE 20 25.819 19.992 10.536 161 HB3 PHE 20 HB1 PHE 20 24.302 20.853 10.803 162 HD1 PHE 20 HD1 PHE 20 26.372 18.181 11.917 163 HD2 PHE 20 HD2 PHE 20 22.263 19.386 11.555 164 HE1 PHE 20 HE1 PHE 20 25.730 16.529 13.655 165 HE2 PHE 20 HE2 PHE 20 21.626 17.736 13.289 166 HZ PHE 20 HZ PHE 20 23.350 16.306 14.327 167 H MET 21 HN MET 21 24.842 21.170 7.437 168 HA MET 21 HA MET 21 22.596 22.907 7.803 169 HB2 MET 21 HB2 MET 21 25.051 22.858 6.318 170 HB3 MET 21 HB1 MET 21 23.730 23.384 5.276 171 HG2 MET 21 HG2 MET 21 23.098 25.101 6.885 172 HG3 MET 21 HG1 MET 21 24.311 24.523 8.025 173 HE1 MET 21 HE1 MET 21 23.670 26.960 4.983 174 HE2 MET 21 HE2 MET 21 23.778 25.300 4.400 175 HE3 MET 21 HE3 MET 21 25.014 26.469 3.943 176 H ALA 22 HN ALA 22 23.559 20.967 4.975 177 HA ALA 22 HA ALA 22 21.075 21.230 3.645 178 HB1 ALA 22 HB1 ALA 22 23.296 20.592 2.602 179 HB2 ALA 22 HB2 ALA 22 21.906 19.638 2.083 180 HB3 ALA 22 HB3 ALA 22 23.041 18.976 3.259 181 H TRP 23 HN TRP 23 22.398 18.692 5.772 182 HA TRP 23 HA TRP 23 20.327 16.822 5.429 183 HB2 TRP 23 HB2 TRP 23 22.542 16.400 6.522 184 HB3 TRP 23 HB1 TRP 23 21.958 17.283 7.932 185 HD1 TRP 23 HD1 TRP 23 21.630 14.009 6.082 186 HE1 TRP 23 HE1 TRP 23 20.187 12.387 7.471 187 HE3 TRP 23 HE3 TRP 23 19.953 17.199 9.699 188 HZ2 TRP 23 HZ2 TRP 23 18.534 12.438 9.806 189 HZ3 TRP 23 HZ3 TRP 23 18.444 16.388 11.490 190 HH2 TRP 23 HH2 TRP 23 17.733 14.013 11.548 191 H THR 24 HN THR 24 20.719 19.504 7.731 192 HA THR 24 HA THR 24 18.388 18.958 9.245 193 HB THR 24 HB THR 24 19.971 21.487 8.786 194 HG1 THR 24 HG1 THR 24 20.972 20.875 10.543 195 HG21 THR 24 HG21 THR 24 17.858 22.349 9.335 196 HG22 THR 24 HG22 THR 24 18.662 22.221 10.899 197 HG23 THR 24 HG23 THR 24 17.480 21.005 10.414 198 H ILE 25 HN ILE 25 18.962 21.030 6.418 199 HA ILE 25 HA ILE 25 16.391 22.167 6.278 200 HB ILE 25 HB ILE 25 18.424 21.585 4.118 201 HG12 ILE 25 HG12 ILE 25 17.669 24.218 5.407 202 HG13 ILE 25 HG11 ILE 25 18.959 23.195 6.041 203 HG21 ILE 25 HG21 ILE 25 15.829 23.144 4.070 204 HG22 ILE 25 HG22 ILE 25 16.301 21.809 3.017 205 HG23 ILE 25 HG23 ILE 25 17.104 23.373 2.874 206 HD11 ILE 25 HD11 ILE 25 20.105 23.280 3.857 207 HD12 ILE 25 HD12 ILE 25 19.866 24.903 4.508 208 HD13 ILE 25 HD13 ILE 25 18.819 24.304 3.222 209 H GLY 26 HN GLY 26 17.748 19.246 4.749 210 HA2 GLY 26 HA2 GLY 26 15.479 18.515 3.263 211 HA3 GLY 26 HA1 GLY 26 16.729 17.405 3.822 212 H HIS 27 HN HIS 27 16.459 17.682 6.586 213 HA HIS 27 HA HIS 27 14.427 15.876 7.195 214 HB2 HIS 27 HB2 HIS 27 15.848 15.901 8.959 215 HB3 HIS 27 HB1 HIS 27 16.289 17.589 8.704 216 HD2 HIS 27 HD2 HIS 27 13.068 15.724 10.157 217 HE1 HIS 27 HE1 HIS 27 13.593 19.397 12.169 218 HE2 HIS 27 HE2 HIS 27 12.171 17.298 12.037 219 H LEU 28 HN LEU 28 14.475 19.418 7.414 220 HA LEU 28 HA LEU 28 11.724 19.483 8.351 221 HB2 LEU 28 HB2 LEU 28 13.375 21.133 9.170 222 HB3 LEU 28 HB1 LEU 28 13.556 21.749 7.528 223 HG LEU 28 HG LEU 28 11.105 22.262 7.498 224 HD11 LEU 28 HD11 LEU 28 11.345 21.272 10.346 225 HD12 LEU 28 HD12 LEU 28 10.208 20.752 9.103 226 HD13 LEU 28 HD13 LEU 28 10.040 22.346 9.839 227 HD21 LEU 28 HD21 LEU 28 12.730 23.502 9.739 228 HD22 LEU 28 HD22 LEU 28 11.262 24.200 9.058 229 HD23 LEU 28 HD23 LEU 28 12.702 24.025 8.055 230 H ASN 29 HN ASN 29 9.937 20.005 7.159 231 HA ASN 29 HA ASN 29 10.154 19.773 4.284 232 HB2 ASN 29 HB2 ASN 29 7.813 20.209 6.147 233 HB3 ASN 29 HB1 ASN 29 7.650 20.076 4.397 234 HD21 ASN 29 HD21 ASN 29 6.520 18.167 6.303 235 HD22 ASN 29 HD22 ASN 29 7.279 16.675 6.021 236 H GLN 30 HN GLN 30 10.600 21.436 2.997 237 HA GLN 30 HA GLN 30 9.796 24.147 3.869 238 HB2 GLN 30 HB2 GLN 30 12.250 23.790 3.684 239 HB3 GLN 30 HB1 GLN 30 12.034 23.374 1.983 240 HG2 GLN 30 HG2 GLN 30 11.036 25.598 1.571 241 HG3 GLN 30 HG1 GLN 30 11.282 26.015 3.266 242 HE21 GLN 30 HE21 GLN 30 13.114 27.288 3.521 243 HE22 GLN 30 HE22 GLN 30 14.540 27.137 2.614 244 H ILE 31 HN ILE 31 8.188 25.016 2.740 245 HA ILE 31 HA ILE 31 7.793 24.132 -0.057 246 HB ILE 31 HB ILE 31 5.695 25.028 1.939 247 HG12 ILE 31 HG12 ILE 31 6.105 22.285 0.716 248 HG13 ILE 31 HG11 ILE 31 6.758 22.732 2.292 249 HG21 ILE 31 HG21 ILE 31 4.099 24.403 0.194 250 HG22 ILE 31 HG22 ILE 31 5.413 23.888 -0.862 251 HG23 ILE 31 HG23 ILE 31 5.224 25.594 -0.459 252 HD11 ILE 31 HD11 ILE 31 4.562 23.141 3.177 253 HD12 ILE 31 HD12 ILE 31 4.504 21.577 2.365 254 HD13 ILE 31 HD13 ILE 31 3.829 23.003 1.578 255 H LYS 32 HN LYS 32 8.106 25.682 -1.514 256 HA LYS 32 HA LYS 32 7.980 28.496 -0.638 257 HB2 LYS 32 HB2 LYS 32 9.415 27.135 -2.919 258 HB3 LYS 32 HB1 LYS 32 9.255 28.888 -2.805 259 HG2 LYS 32 HG2 LYS 32 10.280 28.765 -0.512 260 HG3 LYS 32 HG1 LYS 32 10.578 27.050 -0.793 261 HD2 LYS 32 HD2 LYS 32 11.568 29.213 -2.659 262 HD3 LYS 32 HD1 LYS 32 12.532 28.591 -1.320 263 HE2 LYS 32 HE2 LYS 32 12.235 26.283 -2.266 264 HE3 LYS 32 HE1 LYS 32 11.445 27.009 -3.666 265 HZ1 LYS 32 HZ1 LYS 32 13.498 27.145 -4.496 266 HZ2 LYS 32 HZ2 LYS 32 14.239 26.896 -2.988 267 HZ3 LYS 32 HZ3 LYS 32 13.727 28.453 -3.439 268 H ARG 33 HN ARG 33 6.246 29.600 -1.189 269 HA ARG 33 HA ARG 33 4.610 28.678 -3.465 270 HB2 ARG 33 HB2 ARG 33 2.885 30.259 -2.429 271 HB3 ARG 33 HB1 ARG 33 3.273 28.805 -1.509 272 HG2 ARG 33 HG2 ARG 33 4.405 29.968 0.121 273 HG3 ARG 33 HG1 ARG 33 4.922 31.237 -0.989 274 HD2 ARG 33 HD2 ARG 33 2.560 32.055 -1.072 275 HD3 ARG 33 HD1 ARG 33 2.140 30.853 0.147 276 HE ARG 33 HE ARG 33 3.561 33.329 0.589 277 HH11 ARG 33 HH11 ARG 33 3.002 30.074 1.717 278 HH12 ARG 33 HH12 ARG 33 3.430 30.442 3.355 279 HH21 ARG 33 HH21 ARG 33 4.117 33.779 2.740 280 HH22 ARG 33 HH22 ARG 33 4.056 32.522 3.929 281 H1 MET 1 HT1 MET 1 40.852 17.415 36.642 282 H2 MET 1 HT2 MET 1 42.116 16.280 36.616 283 H3 MET 1 HT3 MET 1 41.017 16.361 35.323 284 HA MET 1 HA MET 1 41.880 18.841 35.244 285 HB2 MET 1 HB2 MET 1 43.390 18.365 37.204 286 HB3 MET 1 HB1 MET 1 44.275 17.235 36.179 287 HG2 MET 1 HG2 MET 1 43.819 19.937 35.036 288 HG3 MET 1 HG1 MET 1 44.936 19.853 36.399 289 HE1 MET 1 HE1 MET 1 47.259 20.076 33.308 290 HE2 MET 1 HE2 MET 1 47.086 20.576 34.989 291 HE3 MET 1 HE3 MET 1 45.805 20.936 33.834 292 H PHE 2 HN PHE 2 42.463 15.489 34.547 293 HA PHE 2 HA PHE 2 43.689 16.139 31.958 294 HB2 PHE 2 HB2 PHE 2 43.291 13.491 33.369 295 HB3 PHE 2 HB1 PHE 2 44.095 13.701 31.813 296 HD1 PHE 2 HD1 PHE 2 44.394 14.025 35.428 297 HD2 PHE 2 HD2 PHE 2 46.208 15.036 31.669 298 HE1 PHE 2 HE1 PHE 2 46.513 14.568 36.596 299 HE2 PHE 2 HE2 PHE 2 48.327 15.577 32.837 300 HZ PHE 2 HZ PHE 2 48.480 15.344 35.301 301 H GLU 3 HN GLU 3 42.415 16.338 30.247 302 HA GLU 3 HA GLU 3 39.663 15.565 30.317 303 HB2 GLU 3 HB2 GLU 3 41.426 16.668 28.127 304 HB3 GLU 3 HB1 GLU 3 39.717 16.299 27.890 305 HG2 GLU 3 HG2 GLU 3 39.146 17.810 29.767 306 HG3 GLU 3 HG1 GLU 3 40.854 18.207 29.950 307 HA PRO 4 HA PRO 4 39.594 11.468 28.702 308 HB2 PRO 4 HB2 PRO 4 37.973 12.502 26.414 309 HB3 PRO 4 HB1 PRO 4 37.623 11.172 27.532 310 HG2 PRO 4 HG2 PRO 4 36.393 13.522 27.742 311 HG3 PRO 4 HG1 PRO 4 36.839 12.574 29.171 312 HD2 PRO 4 HD2 PRO 4 38.072 15.059 28.103 313 HD3 PRO 4 HD1 PRO 4 37.967 14.474 29.776 314 H PHE 5 HN PHE 5 39.993 13.967 26.195 315 HA PHE 5 HA PHE 5 42.384 12.673 25.197 316 HB2 PHE 5 HB2 PHE 5 39.800 12.628 23.681 317 HB3 PHE 5 HB1 PHE 5 41.317 12.786 22.797 318 HD1 PHE 5 HD1 PHE 5 39.080 10.520 24.451 319 HD2 PHE 5 HD2 PHE 5 43.181 11.078 23.306 320 HE1 PHE 5 HE1 PHE 5 39.480 8.085 24.698 321 HE2 PHE 5 HE2 PHE 5 43.582 8.644 23.552 322 HZ PHE 5 HZ PHE 5 41.732 7.146 24.248 323 H GLN 6 HN GLN 6 39.887 15.014 24.158 324 HA GLN 6 HA GLN 6 41.570 17.275 24.500 325 HB2 GLN 6 HB2 GLN 6 42.059 17.836 22.207 326 HB3 GLN 6 HB1 GLN 6 42.675 16.212 22.513 327 HG2 GLN 6 HG2 GLN 6 40.336 15.432 21.652 328 HG3 GLN 6 HG1 GLN 6 40.246 17.044 20.947 329 HE21 GLN 6 HE21 GLN 6 41.387 17.398 19.005 330 HE22 GLN 6 HE22 GLN 6 42.448 16.268 18.312 331 H ILE 7 HN ILE 7 40.580 19.236 23.399 332 HA ILE 7 HA ILE 7 37.875 19.458 24.111 333 HB ILE 7 HB ILE 7 39.624 21.145 22.318 334 HG12 ILE 7 HG12 ILE 7 38.928 22.614 24.523 335 HG13 ILE 7 HG11 ILE 7 38.997 20.987 25.198 336 HG21 ILE 7 HG21 ILE 7 37.391 21.573 21.567 337 HG22 ILE 7 HG22 ILE 7 37.793 22.883 22.677 338 HG23 ILE 7 HG23 ILE 7 36.762 21.557 23.214 339 HD11 ILE 7 HD11 ILE 7 41.214 22.066 23.449 340 HD12 ILE 7 HD12 ILE 7 41.261 20.695 24.558 341 HD13 ILE 7 HD13 ILE 7 41.190 22.338 25.192 342 H LEU 8 HN LEU 8 39.411 18.834 20.998 343 HA LEU 8 HA LEU 8 37.100 19.026 19.376 344 HB2 LEU 8 HB2 LEU 8 39.579 18.880 18.663 345 HB3 LEU 8 HB1 LEU 8 39.375 17.134 18.807 346 HG LEU 8 HG LEU 8 37.174 18.390 17.353 347 HD11 LEU 8 HD11 LEU 8 40.014 18.703 16.352 348 HD12 LEU 8 HD12 LEU 8 38.795 19.963 16.546 349 HD13 LEU 8 HD13 LEU 8 38.611 18.746 15.283 350 HD21 LEU 8 HD21 LEU 8 37.879 16.593 15.699 351 HD22 LEU 8 HD22 LEU 8 37.490 16.002 17.315 352 HD23 LEU 8 HD23 LEU 8 39.175 16.177 16.821 353 H SER 9 HN SER 9 38.395 16.465 21.367 354 HA SER 9 HA SER 9 36.679 14.397 20.331 355 HB2 SER 9 HB2 SER 9 38.389 14.560 22.812 356 HB3 SER 9 HB1 SER 9 37.455 13.136 22.362 357 HG SER 9 HG SER 9 39.754 13.345 21.619 358 H ILE 10 HN ILE 10 36.614 16.606 23.083 359 HA ILE 10 HA ILE 10 34.387 15.469 24.406 360 HB ILE 10 HB ILE 10 35.515 18.275 24.399 361 HG12 ILE 10 HG12 ILE 10 35.565 16.142 26.551 362 HG13 ILE 10 HG11 ILE 10 36.848 16.317 25.352 363 HG21 ILE 10 HG21 ILE 10 34.124 18.460 26.547 364 HG22 ILE 10 HG22 ILE 10 33.233 17.053 25.966 365 HG23 ILE 10 HG23 ILE 10 33.232 18.546 25.028 366 HD11 ILE 10 HD11 ILE 10 37.027 18.751 26.071 367 HD12 ILE 10 HD12 ILE 10 37.547 17.570 27.274 368 HD13 ILE 10 HD13 ILE 10 35.968 18.343 27.421 369 H CYS 11 HN CYS 11 34.639 18.113 22.035 370 HA CYS 11 HA CYS 11 31.889 18.748 21.955 371 HB2 CYS 11 HB2 CYS 11 34.094 19.063 19.917 372 HB3 CYS 11 HB1 CYS 11 32.460 19.682 19.669 373 HG CYS 11 HG CYS 11 32.877 21.042 22.003 374 H SER 12 HN SER 12 33.856 16.668 19.799 375 HA SER 12 HA SER 12 31.807 15.798 18.137 376 HB2 SER 12 HB2 SER 12 34.142 15.297 17.673 377 HB3 SER 12 HB1 SER 12 34.243 14.294 19.117 378 HG SER 12 HG SER 12 32.993 13.816 16.663 379 H PHE 13 HN PHE 13 32.822 14.560 21.294 380 HA PHE 13 HA PHE 13 31.211 12.260 21.368 381 HB2 PHE 13 HB2 PHE 13 33.016 12.743 22.993 382 HB3 PHE 13 HB1 PHE 13 32.034 14.039 23.677 383 HD1 PHE 13 HD1 PHE 13 32.255 10.377 23.149 384 HD2 PHE 13 HD2 PHE 13 30.166 13.570 25.120 385 HE1 PHE 13 HE1 PHE 13 31.073 8.725 24.570 386 HE2 PHE 13 HE2 PHE 13 28.983 11.918 26.542 387 HZ PHE 13 HZ PHE 13 29.436 9.496 26.267 388 H ILE 14 HN ILE 14 30.551 15.575 22.510 389 HA ILE 14 HA ILE 14 27.937 15.049 23.468 390 HB ILE 14 HB ILE 14 29.232 17.614 22.513 391 HG12 ILE 14 HG12 ILE 14 28.612 16.649 25.319 392 HG13 ILE 14 HG11 ILE 14 30.172 16.389 24.538 393 HG21 ILE 14 HG21 ILE 14 26.583 17.078 23.879 394 HG22 ILE 14 HG22 ILE 14 26.854 17.925 22.356 395 HG23 ILE 14 HG23 ILE 14 27.359 18.662 23.876 396 HD11 ILE 14 HD11 ILE 14 28.874 19.010 25.291 397 HD12 ILE 14 HD12 ILE 14 30.192 18.934 24.121 398 HD13 ILE 14 HD13 ILE 14 30.451 18.394 25.780 399 H LEU 15 HN LEU 15 29.147 16.215 20.356 400 HA LEU 15 HA LEU 15 26.645 16.678 19.140 401 HB2 LEU 15 HB2 LEU 15 29.384 16.086 18.016 402 HB3 LEU 15 HB1 LEU 15 27.984 16.373 16.982 403 HG LEU 15 HG LEU 15 28.815 18.301 19.163 404 HD11 LEU 15 HD11 LEU 15 29.655 18.146 16.258 405 HD12 LEU 15 HD12 LEU 15 30.690 18.263 17.681 406 HD13 LEU 15 HD13 LEU 15 29.722 19.649 17.180 407 HD21 LEU 15 HD21 LEU 15 27.496 19.853 17.587 408 HD22 LEU 15 HD22 LEU 15 26.552 18.662 18.480 409 HD23 LEU 15 HD23 LEU 15 26.940 18.385 16.783 410 H SER 16 HN SER 16 28.495 13.798 19.704 411 HA SER 16 HA SER 16 27.109 12.157 17.799 412 HB2 SER 16 HB2 SER 16 28.823 11.477 20.192 413 HB3 SER 16 HB1 SER 16 28.165 10.280 19.080 414 HG SER 16 HG SER 16 30.270 10.930 18.477 415 H ALA 17 HN ALA 17 26.891 12.643 21.321 416 HA ALA 17 HA ALA 17 24.905 10.754 21.867 417 HB1 ALA 17 HB1 ALA 17 25.219 13.458 23.195 418 HB2 ALA 17 HB2 ALA 17 26.220 12.056 23.570 419 HB3 ALA 17 HB3 ALA 17 24.487 12.016 23.897 420 H LEU 18 HN LEU 18 24.538 14.250 21.153 421 HA LEU 18 HA LEU 18 21.703 14.188 21.117 422 HB2 LEU 18 HB2 LEU 18 23.558 16.113 19.706 423 HB3 LEU 18 HB1 LEU 18 21.860 16.384 20.106 424 HG LEU 18 HG LEU 18 24.063 15.872 22.126 425 HD11 LEU 18 HD11 LEU 18 24.368 18.065 21.198 426 HD12 LEU 18 HD12 LEU 18 23.556 18.278 22.748 427 HD13 LEU 18 HD13 LEU 18 22.636 18.395 21.248 428 HD21 LEU 18 HD21 LEU 18 21.104 16.479 22.383 429 HD22 LEU 18 HD22 LEU 18 22.241 16.650 23.721 430 HD23 LEU 18 HD23 LEU 18 21.970 15.068 22.994 431 H HIS 19 HN HIS 19 24.174 13.837 18.629 432 HA HIS 19 HA HIS 19 22.673 13.940 16.333 433 HB2 HIS 19 HB2 HIS 19 24.868 13.632 15.808 434 HB3 HIS 19 HB1 HIS 19 25.134 12.491 17.126 435 HD2 HIS 19 HD2 HIS 19 24.696 9.789 16.469 436 HE1 HIS 19 HE1 HIS 19 23.591 10.426 12.444 437 HE2 HIS 19 HE2 HIS 19 24.165 8.658 14.176 438 H PHE 20 HN PHE 20 23.285 11.013 18.271 439 HA PHE 20 HA PHE 20 21.476 9.428 16.696 440 HB2 PHE 20 HB2 PHE 20 23.421 9.003 18.766 441 HB3 PHE 20 HB1 PHE 20 21.911 8.198 19.197 442 HD1 PHE 20 HD1 PHE 20 24.889 7.969 17.256 443 HD2 PHE 20 HD2 PHE 20 20.745 6.835 17.289 444 HE1 PHE 20 HE1 PHE 20 25.363 6.177 15.606 445 HE2 PHE 20 HE2 PHE 20 21.220 5.047 15.640 446 HZ PHE 20 HZ PHE 20 23.520 4.724 14.790 447 H MET 21 HN MET 21 21.163 11.536 19.431 448 HA MET 21 HA MET 21 18.791 10.355 20.519 449 HB2 MET 21 HB2 MET 21 20.503 12.602 21.036 450 HB3 MET 21 HB1 MET 21 18.814 13.101 21.123 451 HG2 MET 21 HG2 MET 21 18.331 11.317 22.709 452 HG3 MET 21 HG1 MET 21 19.968 10.685 22.545 453 HE1 MET 21 HE1 MET 21 17.696 13.226 24.530 454 HE2 MET 21 HE2 MET 21 18.042 13.875 22.930 455 HE3 MET 21 HE3 MET 21 18.682 14.685 24.358 456 H ALA 22 HN ALA 22 19.223 13.409 18.736 457 HA ALA 22 HA ALA 22 16.465 13.787 18.232 458 HB1 ALA 22 HB1 ALA 22 18.283 15.554 18.147 459 HB2 ALA 22 HB2 ALA 22 17.117 15.593 16.824 460 HB3 ALA 22 HB3 ALA 22 18.720 14.904 16.567 461 H TRP 23 HN TRP 23 19.078 12.339 16.290 462 HA TRP 23 HA TRP 23 17.617 12.003 13.911 463 HB2 TRP 23 HB2 TRP 23 20.097 11.762 14.176 464 HB3 TRP 23 HB1 TRP 23 19.810 10.205 14.956 465 HD1 TRP 23 HD1 TRP 23 19.788 11.941 11.603 466 HE1 TRP 23 HE1 TRP 23 19.411 10.195 9.744 467 HE3 TRP 23 HE3 TRP 23 18.633 7.858 14.448 468 HZ2 TRP 23 HZ2 TRP 23 18.707 7.432 9.496 469 HZ3 TRP 23 HZ3 TRP 23 18.110 5.686 13.374 470 HH2 TRP 23 HH2 TRP 23 18.146 5.468 10.905 471 H THR 24 HN THR 24 18.013 9.891 16.745 472 HA THR 24 HA THR 24 16.588 7.681 15.686 473 HB THR 24 HB THR 24 17.165 8.572 18.512 474 HG1 THR 24 HG1 THR 24 18.833 7.295 18.298 475 HG21 THR 24 HG21 THR 24 15.215 7.298 18.810 476 HG22 THR 24 HG22 THR 24 16.505 6.113 19.001 477 HG23 THR 24 HG23 THR 24 15.607 6.202 17.485 478 H ILE 25 HN ILE 25 15.570 10.465 17.645 479 HA ILE 25 HA ILE 25 12.900 9.665 18.040 480 HB ILE 25 HB ILE 25 14.153 12.413 17.891 481 HG12 ILE 25 HG12 ILE 25 13.183 10.852 20.298 482 HG13 ILE 25 HG11 ILE 25 14.841 10.737 19.707 483 HG21 ILE 25 HG21 ILE 25 11.371 11.513 18.685 484 HG22 ILE 25 HG22 ILE 25 11.806 12.702 17.458 485 HG23 ILE 25 HG23 ILE 25 12.050 13.068 19.166 486 HD11 ILE 25 HD11 ILE 25 15.105 13.177 19.959 487 HD12 ILE 25 HD12 ILE 25 14.661 12.430 21.494 488 HD13 ILE 25 HD13 ILE 25 13.448 13.296 20.552 489 H GLY 26 HN GLY 26 14.398 11.669 15.501 490 HA2 GLY 26 HA2 GLY 26 12.052 12.304 14.092 491 HA3 GLY 26 HA1 GLY 26 13.671 12.251 13.397 492 H HIS 27 HN HIS 27 14.294 9.557 13.773 493 HA HIS 27 HA HIS 27 13.175 8.343 11.524 494 HB2 HIS 27 HB2 HIS 27 15.048 7.182 12.045 495 HB3 HIS 27 HB1 HIS 27 14.892 7.514 13.770 496 HD2 HIS 27 HD2 HIS 27 13.001 5.105 11.202 497 HE1 HIS 27 HE1 HIS 27 13.157 3.268 15.000 498 HE2 HIS 27 HE2 HIS 27 12.405 2.976 12.592 499 H LEU 28 HN LEU 28 12.314 8.040 14.955 500 HA LEU 28 HA LEU 28 10.145 6.204 14.334 501 HB2 LEU 28 HB2 LEU 28 11.457 5.946 16.416 502 HB3 LEU 28 HB1 LEU 28 10.890 7.528 16.954 503 HG LEU 28 HG LEU 28 8.535 6.690 16.781 504 HD11 LEU 28 HD11 LEU 28 9.999 4.135 16.084 505 HD12 LEU 28 HD12 LEU 28 8.699 4.925 15.192 506 HD13 LEU 28 HD13 LEU 28 8.356 4.124 16.726 507 HD21 LEU 28 HD21 LEU 28 10.424 5.113 18.557 508 HD22 LEU 28 HD22 LEU 28 8.678 5.215 18.788 509 HD23 LEU 28 HD23 LEU 28 9.673 6.663 18.943 510 H ASN 29 HN ASN 29 7.993 6.687 14.273 511 HA ASN 29 HA ASN 29 7.265 9.464 13.927 512 HB2 ASN 29 HB2 ASN 29 5.678 6.892 13.838 513 HB3 ASN 29 HB1 ASN 29 4.970 8.481 13.551 514 HD21 ASN 29 HD21 ASN 29 5.129 6.367 11.537 515 HD22 ASN 29 HD22 ASN 29 6.126 6.943 10.290 516 H GLN 30 HN GLN 30 6.777 10.766 15.567 517 HA GLN 30 HA GLN 30 5.605 9.578 18.011 518 HB2 GLN 30 HB2 GLN 30 7.845 10.614 18.316 519 HB3 GLN 30 HB1 GLN 30 7.185 12.148 17.748 520 HG2 GLN 30 HG2 GLN 30 5.537 12.116 19.589 521 HG3 GLN 30 HG1 GLN 30 6.218 10.596 20.165 522 HE21 GLN 30 HE21 GLN 30 7.590 10.948 21.906 523 HE22 GLN 30 HE22 GLN 30 8.612 12.291 22.087 524 H ILE 31 HN ILE 31 3.536 10.055 18.346 525 HA ILE 31 HA ILE 31 2.468 12.569 17.207 526 HB ILE 31 HB ILE 31 1.019 9.941 17.630 527 HG12 ILE 31 HG12 ILE 31 1.726 11.324 15.027 528 HG13 ILE 31 HG11 ILE 31 2.728 10.058 15.733 529 HG21 ILE 31 HG21 ILE 31 -0.840 11.044 16.489 530 HG22 ILE 31 HG22 ILE 31 0.122 12.506 16.273 531 HG23 ILE 31 HG23 ILE 31 -0.377 12.010 17.890 532 HD11 ILE 31 HD11 ILE 31 0.947 8.453 15.588 533 HD12 ILE 31 HD12 ILE 31 1.046 9.250 14.018 534 HD13 ILE 31 HD13 ILE 31 -0.222 9.701 15.159 535 H LYS 32 HN LYS 32 1.826 13.990 18.687 536 HA LYS 32 HA LYS 32 1.237 13.029 21.412 537 HB2 LYS 32 HB2 LYS 32 2.120 15.711 20.348 538 HB3 LYS 32 HB1 LYS 32 1.538 15.484 21.998 539 HG2 LYS 32 HG2 LYS 32 3.278 13.692 22.292 540 HG3 LYS 32 HG1 LYS 32 3.918 14.124 20.706 541 HD2 LYS 32 HD2 LYS 32 3.577 16.136 22.939 542 HD3 LYS 32 HD1 LYS 32 5.072 15.236 22.684 543 HE2 LYS 32 HE2 LYS 32 5.116 16.105 20.326 544 HE3 LYS 32 HE1 LYS 32 3.729 17.119 20.724 545 HZ1 LYS 32 HZ1 LYS 32 5.261 18.597 21.350 546 HZ2 LYS 32 HZ2 LYS 32 6.504 17.443 21.422 547 HZ3 LYS 32 HZ3 LYS 32 5.453 17.646 22.742 548 H ARG 33 HN ARG 33 -0.812 12.910 21.974 549 HA ARG 33 HA ARG 33 -2.807 14.513 20.502 550 HB2 ARG 33 HB2 ARG 33 -4.439 12.890 21.624 551 HB3 ARG 33 HB1 ARG 33 -3.381 12.215 20.384 552 HG2 ARG 33 HG2 ARG 33 -2.126 11.027 21.901 553 HG3 ARG 33 HG1 ARG 33 -2.377 12.202 23.192 554 HD2 ARG 33 HD2 ARG 33 -4.758 11.444 23.344 555 HD3 ARG 33 HD1 ARG 33 -4.394 10.193 22.157 556 HE ARG 33 HE ARG 33 -3.639 10.191 24.945 557 HH11 ARG 33 HH11 ARG 33 -2.871 9.044 21.738 558 HH12 ARG 33 HH12 ARG 33 -2.030 7.641 22.314 559 HH21 ARG 33 HH21 ARG 33 -2.531 8.349 25.666 560 HH22 ARG 33 HH22 ARG 33 -1.837 7.253 24.517 561 H1 MET 1 HT1 MET 1 46.138 -10.225 23.357 562 H2 MET 1 HT2 MET 1 47.596 -9.816 22.586 563 H3 MET 1 HT3 MET 1 46.168 -8.978 22.208 564 HA MET 1 HA MET 1 46.218 -8.498 24.790 565 HB2 MET 1 HB2 MET 1 48.341 -9.839 24.989 566 HB3 MET 1 HB1 MET 1 49.138 -8.625 23.986 567 HG2 MET 1 HG2 MET 1 47.596 -7.585 26.299 568 HG3 MET 1 HG1 MET 1 49.059 -8.487 26.692 569 HE1 MET 1 HE1 MET 1 50.126 -4.783 27.064 570 HE2 MET 1 HE2 MET 1 50.356 -6.397 27.732 571 HE3 MET 1 HE3 MET 1 48.731 -5.733 27.593 572 H PHE 2 HN PHE 2 47.481 -7.793 21.633 573 HA PHE 2 HA PHE 2 47.581 -4.914 22.211 574 HB2 PHE 2 HB2 PHE 2 48.422 -6.489 19.766 575 HB3 PHE 2 HB1 PHE 2 48.598 -4.744 19.960 576 HD1 PHE 2 HD1 PHE 2 49.916 -8.023 20.844 577 HD2 PHE 2 HD2 PHE 2 50.088 -3.828 21.749 578 HE1 PHE 2 HE1 PHE 2 52.048 -8.374 22.061 579 HE2 PHE 2 HE2 PHE 2 52.222 -4.178 22.964 580 HZ PHE 2 HZ PHE 2 53.202 -6.451 23.121 581 H GLU 3 HN GLU 3 45.837 -3.728 21.836 582 HA GLU 3 HA GLU 3 43.587 -4.773 20.410 583 HB2 GLU 3 HB2 GLU 3 44.174 -2.064 21.609 584 HB3 GLU 3 HB1 GLU 3 42.657 -2.444 20.792 585 HG2 GLU 3 HG2 GLU 3 42.308 -4.334 22.354 586 HG3 GLU 3 HG1 GLU 3 43.798 -3.901 23.190 587 HA PRO 4 HA PRO 4 44.183 -3.463 16.246 588 HB2 PRO 4 HB2 PRO 4 41.700 -1.821 16.508 589 HB3 PRO 4 HB1 PRO 4 42.115 -3.054 15.301 590 HG2 PRO 4 HG2 PRO 4 40.397 -3.559 17.271 591 HG3 PRO 4 HG1 PRO 4 41.518 -4.793 16.673 592 HD2 PRO 4 HD2 PRO 4 41.592 -3.258 19.218 593 HD3 PRO 4 HD1 PRO 4 42.191 -4.891 18.860 594 H PHE 5 HN PHE 5 43.040 -0.860 18.394 595 HA PHE 5 HA PHE 5 45.258 0.834 17.623 596 HB2 PHE 5 HB2 PHE 5 42.454 1.373 16.716 597 HB3 PHE 5 HB1 PHE 5 43.504 2.728 17.129 598 HD1 PHE 5 HD1 PHE 5 42.648 0.307 14.622 599 HD2 PHE 5 HD2 PHE 5 45.837 2.811 16.035 600 HE1 PHE 5 HE1 PHE 5 43.782 0.101 12.425 601 HE2 PHE 5 HE2 PHE 5 46.973 2.607 13.839 602 HZ PHE 5 HZ PHE 5 45.945 1.250 12.030 603 H GLN 6 HN GLN 6 42.005 1.059 19.089 604 HA GLN 6 HA GLN 6 42.991 1.415 21.726 605 HB2 GLN 6 HB2 GLN 6 42.541 3.761 22.071 606 HB3 GLN 6 HB1 GLN 6 43.667 3.612 20.720 607 HG2 GLN 6 HG2 GLN 6 41.511 3.583 19.248 608 HG3 GLN 6 HG1 GLN 6 40.736 4.285 20.668 609 HE21 GLN 6 HE21 GLN 6 41.053 6.515 21.033 610 HE22 GLN 6 HE22 GLN 6 42.120 7.478 20.128 611 H ILE 7 HN ILE 7 41.188 2.205 23.200 612 HA ILE 7 HA ILE 7 38.902 0.620 22.827 613 HB ILE 7 HB ILE 7 39.435 2.979 24.639 614 HG12 ILE 7 HG12 ILE 7 39.090 0.738 26.176 615 HG13 ILE 7 HG11 ILE 7 39.826 0.053 24.726 616 HG21 ILE 7 HG21 ILE 7 37.053 2.931 24.376 617 HG22 ILE 7 HG22 ILE 7 37.399 2.094 25.889 618 HG23 ILE 7 HG23 ILE 7 37.016 1.169 24.437 619 HD11 ILE 7 HD11 ILE 7 40.976 2.504 26.069 620 HD12 ILE 7 HD12 ILE 7 41.757 1.413 24.925 621 HD13 ILE 7 HD13 ILE 7 41.427 0.874 26.571 622 H LEU 8 HN LEU 8 39.487 4.042 22.186 623 HA LEU 8 HA LEU 8 36.829 4.781 21.562 624 HB2 LEU 8 HB2 LEU 8 38.887 6.291 21.952 625 HB3 LEU 8 HB1 LEU 8 39.248 6.006 20.249 626 HG LEU 8 HG LEU 8 36.438 6.675 20.685 627 HD11 LEU 8 HD11 LEU 8 38.601 8.597 21.575 628 HD12 LEU 8 HD12 LEU 8 37.193 8.060 22.491 629 HD13 LEU 8 HD13 LEU 8 36.987 9.128 21.102 630 HD21 LEU 8 HD21 LEU 8 37.070 8.386 18.916 631 HD22 LEU 8 HD22 LEU 8 37.400 6.711 18.478 632 HD23 LEU 8 HD23 LEU 8 38.716 7.760 19.006 633 H SER 9 HN SER 9 39.360 3.239 19.711 634 HA SER 9 HA SER 9 38.066 3.530 17.154 635 HB2 SER 9 HB2 SER 9 40.351 1.792 18.088 636 HB3 SER 9 HB1 SER 9 39.767 1.827 16.427 637 HG SER 9 HG SER 9 41.556 3.321 17.099 638 H ILE 10 HN ILE 10 38.247 1.024 19.635 639 HA ILE 10 HA ILE 10 36.972 -1.029 18.166 640 HB ILE 10 HB ILE 10 37.193 -0.511 21.136 641 HG12 ILE 10 HG12 ILE 10 38.525 -2.610 19.404 642 HG13 ILE 10 HG11 ILE 10 39.256 -1.038 19.727 643 HG21 ILE 10 HG21 ILE 10 36.562 -2.998 21.254 644 HG22 ILE 10 HG22 ILE 10 35.967 -2.815 19.603 645 HG23 ILE 10 HG23 ILE 10 35.250 -1.871 20.910 646 HD11 ILE 10 HD11 ILE 10 38.957 -1.539 22.203 647 HD12 ILE 10 HD12 ILE 10 40.143 -2.544 21.370 648 HD13 ILE 10 HD13 ILE 10 38.541 -3.186 21.734 649 H CYS 11 HN CYS 11 35.699 1.407 20.432 650 HA CYS 11 HA CYS 11 33.004 0.569 20.334 651 HB2 CYS 11 HB2 CYS 11 34.268 3.250 20.910 652 HB3 CYS 11 HB1 CYS 11 32.535 2.955 21.056 653 HG CYS 11 HG CYS 11 33.269 0.964 22.785 654 H SER 12 HN SER 12 34.697 3.172 18.543 655 HA SER 12 HA SER 12 32.568 3.992 16.959 656 HB2 SER 12 HB2 SER 12 34.676 5.203 17.005 657 HB3 SER 12 HB1 SER 12 35.510 3.836 16.274 658 HG SER 12 HG SER 12 33.752 5.693 15.154 659 H PHE 13 HN PHE 13 34.838 1.320 16.466 660 HA PHE 13 HA PHE 13 34.058 0.594 13.868 661 HB2 PHE 13 HB2 PHE 13 36.065 -0.293 15.014 662 HB3 PHE 13 HB1 PHE 13 35.021 -1.212 16.100 663 HD1 PHE 13 HD1 PHE 13 36.097 -0.806 12.576 664 HD2 PHE 13 HD2 PHE 13 33.924 -3.228 15.379 665 HE1 PHE 13 HE1 PHE 13 35.948 -2.619 10.892 666 HE2 PHE 13 HE2 PHE 13 33.774 -5.042 13.694 667 HZ PHE 13 HZ PHE 13 34.787 -4.738 11.451 668 H ILE 14 HN ILE 14 32.875 -0.554 17.031 669 HA ILE 14 HA ILE 14 30.961 -2.369 15.996 670 HB ILE 14 HB ILE 14 31.096 -0.914 18.648 671 HG12 ILE 14 HG12 ILE 14 31.704 -3.802 17.955 672 HG13 ILE 14 HG11 ILE 14 32.940 -2.545 17.995 673 HG21 ILE 14 HG21 ILE 14 29.290 -3.132 17.649 674 HG22 ILE 14 HG22 ILE 14 28.807 -1.574 18.318 675 HG23 ILE 14 HG23 ILE 14 29.537 -2.793 19.363 676 HD11 ILE 14 HD11 ILE 14 31.258 -3.583 20.279 677 HD12 ILE 14 HD12 ILE 14 32.096 -2.034 20.378 678 HD13 ILE 14 HD13 ILE 14 33.015 -3.523 20.157 679 H LEU 15 HN LEU 15 30.741 1.021 16.990 680 HA LEU 15 HA LEU 15 27.960 1.326 16.630 681 HB2 LEU 15 HB2 LEU 15 30.254 3.291 16.603 682 HB3 LEU 15 HB1 LEU 15 28.579 3.796 16.380 683 HG LEU 15 HG LEU 15 29.468 2.116 18.736 684 HD11 LEU 15 HD11 LEU 15 29.356 5.124 18.406 685 HD12 LEU 15 HD12 LEU 15 30.710 4.145 18.970 686 HD13 LEU 15 HD13 LEU 15 29.283 4.345 19.986 687 HD21 LEU 15 HD21 LEU 15 27.333 3.220 19.669 688 HD22 LEU 15 HD22 LEU 15 27.102 2.002 18.417 689 HD23 LEU 15 HD23 LEU 15 26.997 3.715 18.011 690 H SER 16 HN SER 16 30.636 1.303 14.416 691 HA SER 16 HA SER 16 29.244 2.541 12.233 692 HB2 SER 16 HB2 SER 16 31.744 0.849 12.344 693 HB3 SER 16 HB1 SER 16 31.138 1.618 10.880 694 HG SER 16 HG SER 16 32.676 2.921 11.965 695 H ALA 17 HN ALA 17 30.023 -0.817 13.129 696 HA ALA 17 HA ALA 17 28.936 -2.094 10.893 697 HB1 ALA 17 HB1 ALA 17 28.873 -3.112 13.746 698 HB2 ALA 17 HB2 ALA 17 30.294 -3.186 12.705 699 HB3 ALA 17 HB3 ALA 17 28.839 -4.086 12.276 700 H LEU 18 HN LEU 18 27.383 -1.393 14.051 701 HA LEU 18 HA LEU 18 24.823 -2.330 13.271 702 HB2 LEU 18 HB2 LEU 18 25.512 -0.286 15.387 703 HB3 LEU 18 HB1 LEU 18 24.023 -1.226 15.274 704 HG LEU 18 HG LEU 18 26.797 -2.400 15.618 705 HD11 LEU 18 HD11 LEU 18 26.161 -1.321 17.667 706 HD12 LEU 18 HD12 LEU 18 25.852 -3.043 17.881 707 HD13 LEU 18 HD13 LEU 18 24.514 -1.942 17.554 708 HD21 LEU 18 HD21 LEU 18 24.025 -3.617 15.490 709 HD22 LEU 18 HD22 LEU 18 25.424 -4.479 16.125 710 HD23 LEU 18 HD23 LEU 18 25.400 -3.963 14.442 711 H HIS 19 HN HIS 19 26.374 0.835 13.216 712 HA HIS 19 HA HIS 19 24.257 2.481 12.618 713 HB2 HIS 19 HB2 HIS 19 26.163 3.714 12.804 714 HB3 HIS 19 HB1 HIS 19 27.149 2.514 11.965 715 HD2 HIS 19 HD2 HIS 19 27.324 2.855 9.178 716 HE1 HIS 19 HE1 HIS 19 24.862 6.277 8.936 717 HE2 HIS 19 HE2 HIS 19 26.440 4.770 7.638 718 H PHE 20 HN PHE 20 26.261 0.740 10.239 719 HA PHE 20 HA PHE 20 24.578 1.525 8.043 720 HB2 PHE 20 HB2 PHE 20 27.112 0.226 8.418 721 HB3 PHE 20 HB1 PHE 20 26.112 -0.730 7.324 722 HD1 PHE 20 HD1 PHE 20 28.264 2.091 7.589 723 HD2 PHE 20 HD2 PHE 20 24.839 0.607 5.461 724 HE1 PHE 20 HE1 PHE 20 28.689 3.719 5.765 725 HE2 PHE 20 HE2 PHE 20 25.266 2.233 3.640 726 HZ PHE 20 HZ PHE 20 27.183 3.791 3.795 727 H MET 21 HN MET 21 24.557 -1.055 10.361 728 HA MET 21 HA MET 21 23.090 -2.939 8.782 729 HB2 MET 21 HB2 MET 21 24.167 -2.740 11.434 730 HB3 MET 21 HB1 MET 21 22.521 -3.369 11.503 731 HG2 MET 21 HG2 MET 21 23.080 -5.108 9.892 732 HG3 MET 21 HG1 MET 21 24.693 -4.430 9.672 733 HE1 MET 21 HE1 MET 21 22.540 -6.952 11.808 734 HE2 MET 21 HE2 MET 21 22.165 -5.302 12.296 735 HE3 MET 21 HE3 MET 21 22.965 -6.386 13.430 736 H ALA 22 HN ALA 22 22.049 -0.975 11.565 737 HA ALA 22 HA ALA 22 19.286 -1.428 11.159 738 HB1 ALA 22 HB1 ALA 22 20.398 -0.649 13.300 739 HB2 ALA 22 HB2 ALA 22 18.916 0.198 12.857 740 HB3 ALA 22 HB3 ALA 22 20.482 0.954 12.570 741 H TRP 23 HN TRP 23 21.450 1.222 10.163 742 HA TRP 23 HA TRP 23 19.471 2.939 9.144 743 HB2 TRP 23 HB2 TRP 23 21.869 3.528 9.579 744 HB3 TRP 23 HB1 TRP 23 22.299 2.629 8.123 745 HD1 TRP 23 HD1 TRP 23 20.726 5.846 9.317 746 HE1 TRP 23 HE1 TRP 23 20.295 7.384 7.293 747 HE3 TRP 23 HE3 TRP 23 21.741 2.598 5.508 748 HZ2 TRP 23 HZ2 TRP 23 20.365 7.251 4.436 749 HZ3 TRP 23 HZ3 TRP 23 21.547 3.328 3.147 750 HH2 TRP 23 HH2 TRP 23 20.861 5.648 2.607 751 H THR 24 HN THR 24 21.330 0.322 7.613 752 HA THR 24 HA THR 24 20.334 0.725 4.993 753 HB THR 24 HB THR 24 21.494 -1.690 6.383 754 HG1 THR 24 HG1 THR 24 23.302 -0.986 5.543 755 HG21 THR 24 HG21 THR 24 20.186 -2.694 4.713 756 HG22 THR 24 HG22 THR 24 21.752 -2.490 3.931 757 HG23 THR 24 HG23 THR 24 20.438 -1.368 3.577 758 H ILE 25 HN ILE 25 19.240 -1.336 7.669 759 HA ILE 25 HA ILE 25 17.174 -2.656 6.284 760 HB ILE 25 HB ILE 25 17.482 -1.962 9.210 761 HG12 ILE 25 HG12 ILE 25 17.795 -4.627 7.808 762 HG13 ILE 25 HG11 ILE 25 19.147 -3.516 8.025 763 HG21 ILE 25 HG21 ILE 25 15.462 -3.691 7.759 764 HG22 ILE 25 HG22 ILE 25 15.137 -2.336 8.839 765 HG23 ILE 25 HG23 ILE 25 15.789 -3.843 9.485 766 HD11 ILE 25 HD11 ILE 25 18.775 -3.540 10.468 767 HD12 ILE 25 HD12 ILE 25 19.078 -5.165 9.855 768 HD13 ILE 25 HD13 ILE 25 17.433 -4.665 10.249 769 H GLY 26 HN GLY 26 17.155 0.331 8.230 770 HA2 GLY 26 HA2 GLY 26 14.406 0.879 8.048 771 HA3 GLY 26 HA1 GLY 26 15.666 2.083 8.312 772 H HIS 27 HN HIS 27 17.119 1.825 5.943 773 HA HIS 27 HA HIS 27 15.743 3.495 4.188 774 HB2 HIS 27 HB2 HIS 27 17.933 3.594 3.621 775 HB3 HIS 27 HB1 HIS 27 18.241 1.937 4.140 776 HD2 HIS 27 HD2 HIS 27 16.411 3.593 0.997 777 HE1 HIS 27 HE1 HIS 27 18.270 -0.005 -0.192 778 HE2 HIS 27 HE2 HIS 27 16.917 1.987 -0.998 779 H LEU 28 HN LEU 28 16.136 -0.032 4.150 780 HA LEU 28 HA LEU 28 14.498 -0.273 1.758 781 HB2 LEU 28 HB2 LEU 28 16.414 -1.791 2.130 782 HB3 LEU 28 HB1 LEU 28 15.623 -2.417 3.576 783 HG LEU 28 HG LEU 28 13.674 -3.099 2.157 784 HD11 LEU 28 HD11 LEU 28 15.503 -2.062 -0.018 785 HD12 LEU 28 HD12 LEU 28 13.821 -1.632 0.288 786 HD13 LEU 28 HD13 LEU 28 14.219 -3.225 -0.352 787 HD21 LEU 28 HD21 LEU 28 16.392 -4.193 1.370 788 HD22 LEU 28 HD22 LEU 28 14.857 -5.000 1.056 789 HD23 LEU 28 HD23 LEU 28 15.393 -4.741 2.715 790 H ASN 29 HN ASN 29 12.392 -0.934 1.668 791 HA ASN 29 HA ASN 29 10.836 -0.730 4.096 792 HB2 ASN 29 HB2 ASN 29 10.101 -1.303 1.220 793 HB3 ASN 29 HB1 ASN 29 8.919 -1.205 2.522 794 HD21 ASN 29 HD21 ASN 29 9.032 0.646 0.260 795 HD22 ASN 29 HD22 ASN 29 9.376 2.183 0.893 796 H GLN 30 HN GLN 30 10.533 -2.376 5.444 797 HA GLN 30 HA GLN 30 10.584 -5.125 4.349 798 HB2 GLN 30 HB2 GLN 30 12.415 -4.598 5.948 799 HB3 GLN 30 HB1 GLN 30 11.202 -4.221 7.172 800 HG2 GLN 30 HG2 GLN 30 10.300 -6.513 6.983 801 HG3 GLN 30 HG1 GLN 30 11.529 -6.892 5.778 802 HE21 GLN 30 HE21 GLN 30 13.227 -8.035 6.700 803 HE22 GLN 30 HE22 GLN 30 13.827 -7.795 8.269 804 H ILE 31 HN ILE 31 8.680 -6.117 4.323 805 HA ILE 31 HA ILE 31 6.639 -5.304 6.308 806 HB ILE 31 HB ILE 31 6.207 -6.312 3.483 807 HG12 ILE 31 HG12 ILE 31 5.634 -3.565 4.629 808 HG13 ILE 31 HG11 ILE 31 7.125 -3.944 3.765 809 HG21 ILE 31 HG21 ILE 31 3.851 -5.824 3.912 810 HG22 ILE 31 HG22 ILE 31 4.239 -5.231 5.527 811 HG23 ILE 31 HG23 ILE 31 4.437 -6.941 5.144 812 HD11 ILE 31 HD11 ILE 31 5.921 -4.489 1.759 813 HD12 ILE 31 HD12 ILE 31 5.292 -2.944 2.330 814 HD13 ILE 31 HD13 ILE 31 4.372 -4.424 2.601 815 H LYS 32 HN LYS 32 6.122 -6.849 7.710 816 HA LYS 32 HA LYS 32 6.721 -9.651 7.014 817 HB2 LYS 32 HB2 LYS 32 6.419 -8.232 9.661 818 HB3 LYS 32 HB1 LYS 32 6.479 -9.989 9.522 819 HG2 LYS 32 HG2 LYS 32 8.658 -9.750 8.291 820 HG3 LYS 32 HG1 LYS 32 8.612 -8.023 8.646 821 HD2 LYS 32 HD2 LYS 32 8.436 -10.141 10.796 822 HD3 LYS 32 HD1 LYS 32 9.964 -9.432 10.277 823 HE2 LYS 32 HE2 LYS 32 9.012 -7.165 10.793 824 HE3 LYS 32 HE1 LYS 32 7.592 -7.965 11.465 825 HZ1 LYS 32 HZ1 LYS 32 8.751 -7.965 13.358 826 HZ2 LYS 32 HZ2 LYS 32 10.228 -7.654 12.580 827 HZ3 LYS 32 HZ3 LYS 32 9.641 -9.244 12.688 828 H ARG 33 HN ARG 33 5.077 -10.884 6.460 829 HA ARG 33 HA ARG 33 2.351 -10.111 7.285 830 HB2 ARG 33 HB2 ARG 33 1.691 -11.797 5.476 831 HB3 ARG 33 HB1 ARG 33 2.450 -10.304 4.922 832 HG2 ARG 33 HG2 ARG 33 4.405 -11.355 4.318 833 HG3 ARG 33 HG1 ARG 33 4.244 -12.600 5.558 834 HD2 ARG 33 HD2 ARG 33 2.357 -13.587 4.246 835 HD3 ARG 33 HD1 ARG 33 2.668 -12.403 2.979 836 HE ARG 33 HE ARG 33 4.232 -14.763 3.551 837 HH11 ARG 33 HH11 ARG 33 4.242 -11.543 2.204 838 HH12 ARG 33 HH12 ARG 33 5.583 -11.860 1.154 839 HH21 ARG 33 HH21 ARG 33 5.988 -15.144 2.169 840 HH22 ARG 33 HH22 ARG 33 6.565 -13.880 1.134 841 H1 MET 1 HT1 MET 1 54.710 4.507 -3.603 842 H2 MET 1 HT2 MET 1 55.624 5.715 -2.835 843 H3 MET 1 HT3 MET 1 53.979 5.522 -2.458 844 HA MET 1 HA MET 1 54.795 3.097 -1.858 845 HB2 MET 1 HB2 MET 1 57.140 3.734 -2.523 846 HB3 MET 1 HB1 MET 1 57.151 4.880 -1.182 847 HG2 MET 1 HG2 MET 1 56.295 2.117 -0.518 848 HG3 MET 1 HG1 MET 1 57.996 2.318 -0.938 849 HE1 MET 1 HE1 MET 1 58.018 2.131 2.929 850 HE2 MET 1 HE2 MET 1 58.920 1.682 1.483 851 HE3 MET 1 HE3 MET 1 57.234 1.200 1.645 852 H PHE 2 HN PHE 2 54.603 6.451 -0.977 853 HA PHE 2 HA PHE 2 54.076 5.782 1.834 854 HB2 PHE 2 HB2 PHE 2 54.417 8.452 0.449 855 HB3 PHE 2 HB1 PHE 2 54.143 8.234 2.177 856 HD1 PHE 2 HD1 PHE 2 56.568 8.059 -0.535 857 HD2 PHE 2 HD2 PHE 2 55.836 7.025 3.569 858 HE1 PHE 2 HE1 PHE 2 58.996 7.689 -0.195 859 HE2 PHE 2 HE2 PHE 2 58.265 6.655 3.909 860 HZ PHE 2 HZ PHE 2 59.845 6.986 2.026 861 H GLU 3 HN GLU 3 52.050 5.457 2.451 862 HA GLU 3 HA GLU 3 49.842 6.061 0.733 863 HB2 GLU 3 HB2 GLU 3 50.010 4.987 3.551 864 HB3 GLU 3 HB1 GLU 3 48.482 5.239 2.709 865 HG2 GLU 3 HG2 GLU 3 49.267 3.768 0.876 866 HG3 GLU 3 HG1 GLU 3 50.763 3.485 1.764 867 HA PRO 4 HA PRO 4 48.537 10.083 1.957 868 HB2 PRO 4 HB2 PRO 4 45.940 8.880 2.823 869 HB3 PRO 4 HB1 PRO 4 46.243 10.221 1.702 870 HG2 PRO 4 HG2 PRO 4 45.544 7.807 0.825 871 HG3 PRO 4 HG1 PRO 4 46.692 8.824 -0.062 872 HD2 PRO 4 HD2 PRO 4 47.205 6.389 1.562 873 HD3 PRO 4 HD1 PRO 4 48.082 7.015 0.150 874 H PHE 5 HN PHE 5 47.526 7.525 4.222 875 HA PHE 5 HA PHE 5 48.750 8.924 6.442 876 HB2 PHE 5 HB2 PHE 5 45.775 8.759 6.111 877 HB3 PHE 5 HB1 PHE 5 46.472 8.660 7.729 878 HD1 PHE 5 HD1 PHE 5 45.525 10.845 5.040 879 HD2 PHE 5 HD2 PHE 5 48.136 10.496 8.433 880 HE1 PHE 5 HE1 PHE 5 45.824 13.309 5.064 881 HE2 PHE 5 HE2 PHE 5 48.436 12.957 8.457 882 HZ PHE 5 HZ PHE 5 47.280 14.364 6.772 883 H GLN 6 HN GLN 6 46.295 6.401 5.798 884 HA GLN 6 HA GLN 6 48.002 4.260 6.547 885 HB2 GLN 6 HB2 GLN 6 47.051 3.644 8.677 886 HB3 GLN 6 HB1 GLN 6 47.623 5.309 8.793 887 HG2 GLN 6 HG2 GLN 6 45.192 5.931 8.071 888 HG3 GLN 6 HG1 GLN 6 44.800 4.294 8.592 889 HE21 GLN 6 HE21 GLN 6 44.581 3.934 10.836 890 HE22 GLN 6 HE22 GLN 6 44.935 5.100 12.018 891 H ILE 7 HN ILE 7 46.688 2.208 6.853 892 HA ILE 7 HA ILE 7 44.970 1.845 4.665 893 HB ILE 7 HB ILE 7 45.408 0.202 7.162 894 HG12 ILE 7 HG12 ILE 7 46.280 -1.225 4.992 895 HG13 ILE 7 HG11 ILE 7 46.623 0.428 4.480 896 HG21 ILE 7 HG21 ILE 7 43.207 -0.384 6.420 897 HG22 ILE 7 HG22 ILE 7 44.286 -1.628 5.789 898 HG23 ILE 7 HG23 ILE 7 43.698 -0.349 4.726 899 HD11 ILE 7 HD11 ILE 7 47.422 -0.574 7.218 900 HD12 ILE 7 HD12 ILE 7 48.026 0.836 6.347 901 HD13 ILE 7 HD13 ILE 7 48.466 -0.785 5.811 902 H LEU 8 HN LEU 8 44.293 2.456 8.071 903 HA LEU 8 HA LEU 8 41.490 2.067 7.985 904 HB2 LEU 8 HB2 LEU 8 43.029 2.331 10.041 905 HB3 LEU 8 HB1 LEU 8 42.839 4.067 9.792 906 HG LEU 8 HG LEU 8 40.293 2.640 9.643 907 HD11 LEU 8 HD11 LEU 8 41.983 2.450 12.147 908 HD12 LEU 8 HD12 LEU 8 41.201 1.134 11.271 909 HD13 LEU 8 HD13 LEU 8 40.226 2.299 12.166 910 HD21 LEU 8 HD21 LEU 8 39.746 4.416 11.374 911 HD22 LEU 8 HD22 LEU 8 40.369 5.039 9.847 912 HD23 LEU 8 HD23 LEU 8 41.425 4.942 11.257 913 H SER 9 HN SER 9 43.539 4.768 7.147 914 HA SER 9 HA SER 9 41.408 6.693 6.933 915 HB2 SER 9 HB2 SER 9 44.268 6.716 5.968 916 HB3 SER 9 HB1 SER 9 43.156 8.065 5.754 917 HG SER 9 HG SER 9 44.563 7.978 7.725 918 H ILE 10 HN ILE 10 43.153 4.582 4.706 919 HA ILE 10 HA ILE 10 42.084 5.630 2.306 920 HB ILE 10 HB ILE 10 43.179 2.898 3.007 921 HG12 ILE 10 HG12 ILE 10 44.353 5.106 1.295 922 HG13 ILE 10 HG11 ILE 10 44.672 4.971 3.024 923 HG21 ILE 10 HG21 ILE 10 43.366 2.715 0.451 924 HG22 ILE 10 HG22 ILE 10 42.197 4.034 0.379 925 HG23 ILE 10 HG23 ILE 10 41.755 2.506 1.138 926 HD11 ILE 10 HD11 ILE 10 45.424 2.583 2.582 927 HD12 ILE 10 HD12 ILE 10 46.469 3.835 1.912 928 HD13 ILE 10 HD13 ILE 10 45.349 2.965 0.863 929 H CYS 11 HN CYS 11 41.054 2.925 4.378 930 HA CYS 11 HA CYS 11 38.853 2.119 2.801 931 HB2 CYS 11 HB2 CYS 11 39.415 1.869 5.756 932 HB3 CYS 11 HB1 CYS 11 38.009 1.141 4.981 933 HG CYS 11 HG CYS 11 39.836 -0.107 3.376 934 H SER 12 HN SER 12 38.992 4.240 5.686 935 HA SER 12 HA SER 12 36.302 4.926 5.785 936 HB2 SER 12 HB2 SER 12 37.845 5.554 7.552 937 HB3 SER 12 HB1 SER 12 38.733 6.599 6.448 938 HG SER 12 HG SER 12 36.227 6.938 7.641 939 H PHE 13 HN PHE 13 38.913 6.334 3.855 940 HA PHE 13 HA PHE 13 37.513 8.534 2.812 941 HB2 PHE 13 HB2 PHE 13 39.959 8.215 2.595 942 HB3 PHE 13 HB1 PHE 13 39.671 6.889 1.468 943 HD1 PHE 13 HD1 PHE 13 39.279 10.537 1.998 944 HD2 PHE 13 HD2 PHE 13 39.012 7.298 -0.811 945 HE1 PHE 13 HE1 PHE 13 39.071 12.166 0.141 946 HE2 PHE 13 HE2 PHE 13 38.804 8.928 -2.668 947 HZ PHE 13 HZ PHE 13 38.834 11.362 -2.193 948 H ILE 14 HN ILE 14 37.898 5.229 1.524 949 HA ILE 14 HA ILE 14 36.345 5.632 -0.811 950 HB ILE 14 HB ILE 14 36.985 3.116 0.747 951 HG12 ILE 14 HG12 ILE 14 38.105 4.145 -1.875 952 HG13 ILE 14 HG11 ILE 14 38.864 4.466 -0.316 953 HG21 ILE 14 HG21 ILE 14 35.651 3.546 -1.937 954 HG22 ILE 14 HG22 ILE 14 35.016 2.658 -0.553 955 HG23 ILE 14 HG23 ILE 14 36.381 2.011 -1.465 956 HD11 ILE 14 HD11 ILE 14 38.459 1.802 -1.681 957 HD12 ILE 14 HD12 ILE 14 38.807 1.914 0.044 958 HD13 ILE 14 HD13 ILE 14 39.969 2.528 -1.132 959 H LEU 15 HN LEU 15 35.533 4.434 2.415 960 HA LEU 15 HA LEU 15 32.839 3.776 1.893 961 HB2 LEU 15 HB2 LEU 15 34.311 4.492 4.430 962 HB3 LEU 15 HB1 LEU 15 32.596 4.080 4.420 963 HG LEU 15 HG LEU 15 34.702 2.291 3.186 964 HD11 LEU 15 HD11 LEU 15 33.621 2.386 6.013 965 HD12 LEU 15 HD12 LEU 15 35.307 2.385 5.496 966 HD13 LEU 15 HD13 LEU 15 34.332 0.926 5.325 967 HD21 LEU 15 HD21 LEU 15 32.816 0.603 3.664 968 HD22 LEU 15 HD22 LEU 15 32.515 1.766 2.375 969 HD23 LEU 15 HD23 LEU 15 31.787 2.003 3.963 970 H SER 16 HN SER 16 34.454 6.782 2.526 971 HA SER 16 HA SER 16 32.091 8.265 3.210 972 HB2 SER 16 HB2 SER 16 34.840 9.139 2.314 973 HB3 SER 16 HB1 SER 16 33.566 10.246 2.816 974 HG SER 16 HG SER 16 34.933 9.702 4.556 975 H ALA 17 HN ALA 17 34.061 7.894 0.266 976 HA ALA 17 HA ALA 17 32.673 9.680 -1.376 977 HB1 ALA 17 HB1 ALA 17 33.912 7.050 -2.229 978 HB2 ALA 17 HB2 ALA 17 34.833 8.525 -1.942 979 HB3 ALA 17 HB3 ALA 17 33.643 8.467 -3.243 980 H LEU 18 HN LEU 18 32.196 6.146 -0.996 981 HA LEU 18 HA LEU 18 29.908 6.033 -2.669 982 HB2 LEU 18 HB2 LEU 18 30.679 4.178 -0.412 983 HB3 LEU 18 HB1 LEU 18 29.581 3.816 -1.745 984 HG LEU 18 HG LEU 18 32.511 4.528 -2.049 985 HD11 LEU 18 HD11 LEU 18 32.349 2.327 -1.107 986 HD12 LEU 18 HD12 LEU 18 32.642 2.119 -2.834 987 HD13 LEU 18 HD13 LEU 18 31.018 1.898 -2.181 988 HD21 LEU 18 HD21 LEU 18 30.343 3.761 -4.021 989 HD22 LEU 18 HD22 LEU 18 32.061 3.698 -4.412 990 HD23 LEU 18 HD23 LEU 18 31.308 5.238 -4.004 991 H HIS 19 HN HIS 19 30.365 6.442 0.802 992 HA HIS 19 HA HIS 19 27.796 6.166 1.738 993 HB2 HIS 19 HB2 HIS 19 29.209 6.586 3.474 994 HB3 HIS 19 HB1 HIS 19 30.137 7.785 2.572 995 HD2 HIS 19 HD2 HIS 19 29.214 10.433 2.810 996 HE1 HIS 19 HE1 HIS 19 25.962 9.599 5.370 997 HE2 HIS 19 HE2 HIS 19 27.339 11.453 4.315 998 H PHE 20 HN PHE 20 29.246 9.191 0.528 999 HA PHE 20 HA PHE 20 26.752 10.612 0.696 1000 HB2 PHE 20 HB2 PHE 20 29.514 11.222 0.202 1001 HB3 PHE 20 HB1 PHE 20 28.514 11.951 -1.055 1002 HD1 PHE 20 HD1 PHE 20 29.718 12.297 2.275 1003 HD2 PHE 20 HD2 PHE 20 26.339 13.167 -0.232 1004 HE1 PHE 20 HE1 PHE 20 28.992 14.061 3.863 1005 HE2 PHE 20 HE2 PHE 20 25.615 14.928 1.356 1006 HZ PHE 20 HZ PHE 20 26.938 15.373 3.402 1007 H MET 21 HN MET 21 28.287 8.590 -1.668 1008 HA MET 21 HA MET 21 26.961 9.666 -3.968 1009 HB2 MET 21 HB2 MET 21 28.795 7.550 -3.342 1010 HB3 MET 21 HB1 MET 21 27.531 6.947 -4.413 1011 HG2 MET 21 HG2 MET 21 27.958 8.753 -5.991 1012 HG3 MET 21 HG1 MET 21 29.130 9.478 -4.892 1013 HE1 MET 21 HE1 MET 21 28.661 6.872 -7.818 1014 HE2 MET 21 HE2 MET 21 28.035 6.191 -6.318 1015 HE3 MET 21 HE3 MET 21 29.451 5.471 -7.079 1016 H ALA 22 HN ALA 22 26.447 6.589 -2.251 1017 HA ALA 22 HA ALA 22 23.970 6.027 -3.503 1018 HB1 ALA 22 HB1 ALA 22 25.490 4.367 -2.339 1019 HB2 ALA 22 HB2 ALA 22 23.772 4.214 -1.973 1020 HB3 ALA 22 HB3 ALA 22 24.854 4.984 -0.813 1021 H TRP 23 HN TRP 23 24.792 7.554 -0.390 1022 HA TRP 23 HA TRP 23 22.178 7.714 0.634 1023 HB2 TRP 23 HB2 TRP 23 24.299 8.113 1.910 1024 HB3 TRP 23 HB1 TRP 23 24.430 9.677 1.104 1025 HD1 TRP 23 HD1 TRP 23 22.523 7.825 3.784 1026 HE1 TRP 23 HE1 TRP 23 20.989 9.477 5.033 1027 HE3 TRP 23 HE3 TRP 23 23.023 11.929 0.786 1028 HZ2 TRP 23 HZ2 TRP 23 20.088 12.182 4.788 1029 HZ3 TRP 23 HZ3 TRP 23 21.814 14.027 1.315 1030 HH2 TRP 23 HH2 TRP 23 20.348 14.158 3.310 1031 H THR 24 HN THR 24 24.045 9.943 -1.412 1032 HA THR 24 HA THR 24 22.123 12.026 -1.437 1033 HB THR 24 HB THR 24 24.332 11.271 -3.349 1034 HG1 THR 24 HG1 THR 24 25.451 12.643 -2.197 1035 HG21 THR 24 HG21 THR 24 22.865 12.438 -4.763 1036 HG22 THR 24 HG22 THR 24 23.932 13.702 -4.152 1037 HG23 THR 24 HG23 THR 24 22.316 13.509 -3.472 1038 H ILE 25 HN ILE 25 22.674 9.259 -3.596 1039 HA ILE 25 HA ILE 25 20.723 9.912 -5.517 1040 HB ILE 25 HB ILE 25 21.824 7.239 -4.628 1041 HG12 ILE 25 HG12 ILE 25 22.380 8.821 -7.149 1042 HG13 ILE 25 HG11 ILE 25 23.340 9.023 -5.683 1043 HG21 ILE 25 HG21 ILE 25 20.015 8.000 -6.936 1044 HG22 ILE 25 HG22 ILE 25 19.712 6.795 -5.685 1045 HG23 ILE 25 HG23 ILE 25 20.952 6.507 -6.905 1046 HD11 ILE 25 HD11 ILE 25 23.873 6.611 -5.700 1047 HD12 ILE 25 HD12 ILE 25 24.395 7.387 -7.196 1048 HD13 ILE 25 HD13 ILE 25 22.924 6.413 -7.173 1049 H GLY 26 HN GLY 26 20.538 7.912 -2.571 1050 HA2 GLY 26 HA2 GLY 26 17.866 7.090 -2.846 1051 HA3 GLY 26 HA1 GLY 26 18.739 7.212 -1.319 1052 H HIS 27 HN HIS 27 19.277 9.950 -1.267 1053 HA HIS 27 HA HIS 27 16.958 11.017 -0.145 1054 HB2 HIS 27 HB2 HIS 27 18.686 12.304 0.551 1055 HB3 HIS 27 HB1 HIS 27 19.615 12.024 -0.921 1056 HD2 HIS 27 HD2 HIS 27 16.407 14.227 -0.012 1057 HE1 HIS 27 HE1 HIS 27 18.674 16.198 -2.978 1058 HE2 HIS 27 HE2 HIS 27 16.617 16.364 -1.500 1059 H LEU 28 HN LEU 28 18.300 11.391 -3.411 1060 HA LEU 28 HA LEU 28 16.072 13.073 -4.224 1061 HB2 LEU 28 HB2 LEU 28 18.344 13.481 -5.110 1062 HB3 LEU 28 HB1 LEU 28 18.324 11.887 -5.865 1063 HG LEU 28 HG LEU 28 16.284 12.570 -7.148 1064 HD11 LEU 28 HD11 LEU 28 16.851 15.184 -5.733 1065 HD12 LEU 28 HD12 LEU 28 15.337 14.283 -5.794 1066 HD13 LEU 28 HD13 LEU 28 15.925 15.117 -7.233 1067 HD21 LEU 28 HD21 LEU 28 18.742 14.324 -7.449 1068 HD22 LEU 28 HD22 LEU 28 17.493 14.125 -8.679 1069 HD23 LEU 28 HD23 LEU 28 18.483 12.747 -8.196 1070 H ASN 29 HN ASN 29 14.355 12.462 -5.487 1071 HA ASN 29 HA ASN 29 13.761 9.631 -5.606 1072 HB2 ASN 29 HB2 ASN 29 12.260 12.099 -6.498 1073 HB3 ASN 29 HB1 ASN 29 11.632 10.463 -6.689 1074 HD21 ASN 29 HD21 ASN 29 10.407 12.504 -4.990 1075 HD22 ASN 29 HD22 ASN 29 10.494 11.936 -3.392 1076 H GLN 30 HN GLN 30 14.427 8.362 -7.205 1077 HA GLN 30 HA GLN 30 14.875 9.563 -9.871 1078 HB2 GLN 30 HB2 GLN 30 16.918 8.679 -8.762 1079 HB3 GLN 30 HB1 GLN 30 16.160 7.088 -8.691 1080 HG2 GLN 30 HG2 GLN 30 15.944 7.087 -11.154 1081 HG3 GLN 30 HG1 GLN 30 16.731 8.662 -11.217 1082 HE21 GLN 30 HE21 GLN 30 18.897 8.455 -11.771 1083 HE22 GLN 30 HE22 GLN 30 19.908 7.176 -11.295 1084 H ILE 31 HN ILE 31 13.446 8.981 -11.364 1085 HA ILE 31 HA ILE 31 12.096 6.363 -11.079 1086 HB ILE 31 HB ILE 31 11.007 8.911 -12.307 1087 HG12 ILE 31 HG12 ILE 31 10.110 7.477 -9.790 1088 HG13 ILE 31 HG11 ILE 31 11.242 8.830 -9.764 1089 HG21 ILE 31 HG21 ILE 31 8.919 7.655 -12.500 1090 HG22 ILE 31 HG22 ILE 31 9.663 6.247 -11.745 1091 HG23 ILE 31 HG23 ILE 31 10.195 6.775 -13.339 1092 HD11 ILE 31 HD11 ILE 31 9.619 10.314 -10.733 1093 HD12 ILE 31 HD12 ILE 31 8.817 9.471 -9.407 1094 HD13 ILE 31 HD13 ILE 31 8.517 8.979 -11.074 1095 H LYS 32 HN LYS 32 12.567 4.961 -12.639 1096 HA LYS 32 HA LYS 32 13.662 5.982 -15.180 1097 HB2 LYS 32 HB2 LYS 32 13.916 3.322 -13.776 1098 HB3 LYS 32 HB1 LYS 32 14.420 3.568 -15.450 1099 HG2 LYS 32 HG2 LYS 32 15.866 5.469 -14.666 1100 HG3 LYS 32 HG1 LYS 32 15.459 5.030 -13.006 1101 HD2 LYS 32 HD2 LYS 32 16.657 3.071 -14.976 1102 HD3 LYS 32 HD1 LYS 32 17.636 4.052 -13.885 1103 HE2 LYS 32 HE2 LYS 32 16.322 3.112 -11.963 1104 HE3 LYS 32 HE1 LYS 32 15.518 2.033 -13.100 1105 HZ1 LYS 32 HZ1 LYS 32 17.212 0.664 -12.682 1106 HZ2 LYS 32 HZ2 LYS 32 18.166 1.885 -11.988 1107 HZ3 LYS 32 HZ3 LYS 32 18.142 1.677 -13.675 1108 H ARG 33 HN ARG 33 12.347 6.005 -16.853 1109 HA ARG 33 HA ARG 33 9.986 4.236 -16.859 1110 HB2 ARG 33 HB2 ARG 33 9.246 5.792 -18.750 1111 HB3 ARG 33 HB1 ARG 33 9.307 6.492 -17.133 1112 HG2 ARG 33 HG2 ARG 33 11.145 7.792 -17.610 1113 HG3 ARG 33 HG1 ARG 33 11.782 6.647 -18.791 1114 HD2 ARG 33 HD2 ARG 33 9.920 7.280 -20.334 1115 HD3 ARG 33 HD1 ARG 33 9.418 8.503 -19.169 1116 HE ARG 33 HE ARG 33 11.685 8.653 -20.954 1117 HH11 ARG 33 HH11 ARG 33 10.308 9.724 -17.931 1118 HH12 ARG 33 HH12 ARG 33 11.228 11.192 -17.897 1119 HH21 ARG 33 HH21 ARG 33 12.875 10.580 -20.879 1120 HH22 ARG 33 HH22 ARG 33 12.670 11.672 -19.550 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 51.699 27.360 8.544 2 H2 MET 1 HT2 MET 1 50.472 28.366 7.939 3 H3 MET 1 HT3 MET 1 50.076 27.025 8.903 4 HA MET 1 HA MET 1 51.532 28.167 10.676 5 HB2 MET 1 HB2 MET 1 50.985 30.312 8.639 6 HB3 MET 1 HB1 MET 1 51.138 30.724 10.349 7 HG2 MET 1 HG2 MET 1 53.352 29.701 10.435 8 HG3 MET 1 HG1 MET 1 53.200 29.170 8.760 9 HE1 MET 1 HE1 MET 1 55.628 30.361 8.582 10 HE2 MET 1 HE2 MET 1 55.471 30.952 10.235 11 HE3 MET 1 HE3 MET 1 55.898 32.072 8.943 12 H PHE 2 HN PHE 2 48.633 28.691 8.780 13 HA PHE 2 HA PHE 2 47.097 29.290 11.216 14 HB2 PHE 2 HB2 PHE 2 46.344 29.444 8.291 15 HB3 PHE 2 HB1 PHE 2 45.252 29.806 9.628 16 HD1 PHE 2 HD1 PHE 2 47.865 31.070 7.499 17 HD2 PHE 2 HD2 PHE 2 45.936 31.620 11.296 18 HE1 PHE 2 HE1 PHE 2 48.789 33.368 7.634 19 HE2 PHE 2 HE2 PHE 2 46.858 33.919 11.432 20 HZ PHE 2 HZ PHE 2 48.285 34.792 9.602 21 H GLU 3 HN GLU 3 48.131 26.579 9.738 22 HA GLU 3 HA GLU 3 45.796 25.084 9.319 23 HB2 GLU 3 HB2 GLU 3 48.621 24.264 9.977 24 HB3 GLU 3 HB1 GLU 3 47.340 23.111 9.592 25 HG2 GLU 3 HG2 GLU 3 47.740 25.426 7.745 26 HG3 GLU 3 HG1 GLU 3 48.909 24.107 7.684 27 HA PRO 4 HA PRO 4 44.767 24.706 13.707 28 HB2 PRO 4 HB2 PRO 4 42.565 23.112 13.428 29 HB3 PRO 4 HB1 PRO 4 42.544 24.860 13.124 30 HG2 PRO 4 HG2 PRO 4 42.684 22.599 11.196 31 HG3 PRO 4 HG1 PRO 4 41.805 24.134 11.078 32 HD2 PRO 4 HD2 PRO 4 44.180 23.662 9.795 33 HD3 PRO 4 HD1 PRO 4 43.642 25.280 10.289 34 H PHE 5 HN PHE 5 44.983 21.936 11.524 35 HA PHE 5 HA PHE 5 46.437 20.425 13.533 36 HB2 PHE 5 HB2 PHE 5 43.697 19.631 12.570 37 HB3 PHE 5 HB1 PHE 5 44.863 18.419 13.098 38 HD1 PHE 5 HD1 PHE 5 42.403 20.804 14.149 39 HD2 PHE 5 HD2 PHE 5 45.961 18.757 15.413 40 HE1 PHE 5 HE1 PHE 5 41.845 21.294 16.516 41 HE2 PHE 5 HE2 PHE 5 45.404 19.248 17.779 42 HZ PHE 5 HZ PHE 5 43.345 20.516 18.331 43 H GLN 6 HN GLN 6 44.595 19.278 10.740 44 HA GLN 6 HA GLN 6 47.009 19.111 9.109 45 HB2 GLN 6 HB2 GLN 6 45.388 16.662 9.855 46 HB3 GLN 6 HB1 GLN 6 46.711 16.704 8.690 47 HG2 GLN 6 HG2 GLN 6 48.215 17.531 10.518 48 HG3 GLN 6 HG1 GLN 6 46.891 17.292 11.656 49 HE21 GLN 6 HE21 GLN 6 49.562 15.853 11.441 50 HE22 GLN 6 HE22 GLN 6 49.152 14.210 11.328 51 H ILE 7 HN ILE 7 46.478 18.278 6.905 52 HA ILE 7 HA ILE 7 44.383 19.734 5.741 53 HB ILE 7 HB ILE 7 45.977 17.384 4.716 54 HG12 ILE 7 HG12 ILE 7 46.071 20.312 3.941 55 HG13 ILE 7 HG11 ILE 7 47.082 19.635 5.217 56 HG21 ILE 7 HG21 ILE 7 45.120 18.218 2.458 57 HG22 ILE 7 HG22 ILE 7 43.898 19.117 3.358 58 HG23 ILE 7 HG23 ILE 7 43.947 17.356 3.453 59 HD11 ILE 7 HD11 ILE 7 48.221 18.199 3.704 60 HD12 ILE 7 HD12 ILE 7 48.115 19.746 2.864 61 HD13 ILE 7 HD13 ILE 7 47.012 18.437 2.441 62 H LEU 8 HN LEU 8 44.579 16.377 6.774 63 HA LEU 8 HA LEU 8 42.050 15.568 5.699 64 HB2 LEU 8 HB2 LEU 8 44.084 14.129 6.516 65 HB3 LEU 8 HB1 LEU 8 43.287 14.237 8.086 66 HG LEU 8 HG LEU 8 41.534 13.551 5.790 67 HD11 LEU 8 HD11 LEU 8 43.512 11.559 6.939 68 HD12 LEU 8 HD12 LEU 8 43.594 12.241 5.313 69 HD13 LEU 8 HD13 LEU 8 42.239 11.208 5.770 70 HD21 LEU 8 HD21 LEU 8 40.716 11.913 7.548 71 HD22 LEU 8 HD22 LEU 8 40.592 13.611 8.005 72 HD23 LEU 8 HD23 LEU 8 41.900 12.618 8.650 73 H SER 9 HN SER 9 43.108 16.920 8.746 74 HA SER 9 HA SER 9 40.684 16.490 10.205 75 HB2 SER 9 HB2 SER 9 42.829 16.957 11.328 76 HB3 SER 9 HB1 SER 9 42.828 18.575 10.634 77 HG SER 9 HG SER 9 41.958 18.378 12.817 78 H ILE 10 HN ILE 10 41.972 19.249 8.358 79 HA ILE 10 HA ILE 10 39.756 20.959 8.897 80 HB ILE 10 HB ILE 10 40.664 22.348 7.066 81 HG12 ILE 10 HG12 ILE 10 42.656 20.096 6.736 82 HG13 ILE 10 HG11 ILE 10 41.331 20.405 5.619 83 HG21 ILE 10 HG21 ILE 10 41.655 22.509 9.301 84 HG22 ILE 10 HG22 ILE 10 42.911 22.698 8.079 85 HG23 ILE 10 HG23 ILE 10 42.741 21.168 8.940 86 HD11 ILE 10 HD11 ILE 10 43.214 21.484 4.656 87 HD12 ILE 10 HD12 ILE 10 43.716 22.163 6.205 88 HD13 ILE 10 HD13 ILE 10 42.272 22.776 5.398 89 H CYS 11 HN CYS 11 40.439 18.499 6.482 90 HA CYS 11 HA CYS 11 38.431 19.201 4.618 91 HB2 CYS 11 HB2 CYS 11 40.233 17.594 4.121 92 HB3 CYS 11 HB1 CYS 11 39.548 16.469 5.294 93 HG CYS 11 HG CYS 11 38.545 15.809 2.989 94 H SER 12 HN SER 12 38.422 16.810 7.293 95 HA SER 12 HA SER 12 35.726 16.071 7.036 96 HB2 SER 12 HB2 SER 12 37.328 14.789 8.383 97 HB3 SER 12 HB1 SER 12 37.444 16.128 9.523 98 HG SER 12 HG SER 12 35.934 14.519 10.181 99 H PHE 13 HN PHE 13 37.265 18.726 8.750 100 HA PHE 13 HA PHE 13 35.076 19.584 10.307 101 HB2 PHE 13 HB2 PHE 13 37.206 20.527 10.768 102 HB3 PHE 13 HB1 PHE 13 37.412 21.062 9.101 103 HD1 PHE 13 HD1 PHE 13 35.129 21.500 12.047 104 HD2 PHE 13 HD2 PHE 13 36.811 23.236 8.496 105 HE1 PHE 13 HE1 PHE 13 34.060 23.669 12.598 106 HE2 PHE 13 HE2 PHE 13 35.740 25.404 9.047 107 HZ PHE 13 HZ PHE 13 34.364 25.621 11.098 108 H ILE 14 HN ILE 14 36.116 20.657 7.054 109 HA ILE 14 HA ILE 14 33.928 22.418 6.652 110 HB ILE 14 HB ILE 14 35.757 21.038 4.674 111 HG12 ILE 14 HG12 ILE 14 36.674 22.701 6.433 112 HG13 ILE 14 HG11 ILE 14 37.062 23.015 4.743 113 HG21 ILE 14 HG21 ILE 14 33.854 21.672 3.417 114 HG22 ILE 14 HG22 ILE 14 34.963 23.026 3.216 115 HG23 ILE 14 HG23 ILE 14 33.615 23.152 4.347 116 HD11 ILE 14 HD11 ILE 14 36.210 24.997 6.183 117 HD12 ILE 14 HD12 ILE 14 34.619 24.256 6.018 118 HD13 ILE 14 HD13 ILE 14 35.503 24.775 4.583 119 H LEU 15 HN LEU 15 34.496 19.020 5.859 120 HA LEU 15 HA LEU 15 32.221 18.594 4.264 121 HB2 LEU 15 HB2 LEU 15 33.804 16.775 6.075 122 HB3 LEU 15 HB1 LEU 15 32.421 16.192 5.148 123 HG LEU 15 HG LEU 15 34.713 17.693 3.870 124 HD11 LEU 15 HD11 LEU 15 35.671 15.561 3.248 125 HD12 LEU 15 HD12 LEU 15 34.331 14.690 3.993 126 HD13 LEU 15 HD13 LEU 15 35.476 15.576 5.000 127 HD21 LEU 15 HD21 LEU 15 32.403 16.000 2.881 128 HD22 LEU 15 HD22 LEU 15 33.786 16.392 1.860 129 HD23 LEU 15 HD23 LEU 15 32.761 17.682 2.484 130 H SER 16 HN SER 16 32.593 17.702 7.705 131 HA SER 16 HA SER 16 29.993 17.102 8.293 132 HB2 SER 16 HB2 SER 16 32.025 18.528 10.011 133 HB3 SER 16 HB1 SER 16 30.491 17.918 10.625 134 HG SER 16 HG SER 16 32.445 16.497 10.714 135 H ALA 17 HN ALA 17 31.447 20.317 8.023 136 HA ALA 17 HA ALA 17 29.313 21.824 9.062 137 HB1 ALA 17 HB1 ALA 17 31.738 22.471 8.208 138 HB2 ALA 17 HB2 ALA 17 30.434 23.659 8.229 139 HB3 ALA 17 HB3 ALA 17 30.865 22.847 6.723 140 H LEU 18 HN LEU 18 30.028 20.995 5.662 141 HA LEU 18 HA LEU 18 27.576 22.076 4.664 142 HB2 LEU 18 HB2 LEU 18 29.386 20.025 3.364 143 HB3 LEU 18 HB1 LEU 18 28.205 21.057 2.556 144 HG LEU 18 HG LEU 18 30.656 22.011 4.060 145 HD11 LEU 18 HD11 LEU 18 31.432 22.715 1.827 146 HD12 LEU 18 HD12 LEU 18 29.987 22.012 1.102 147 HD13 LEU 18 HD13 LEU 18 31.176 20.971 1.885 148 HD21 LEU 18 HD21 LEU 18 28.421 23.465 2.628 149 HD22 LEU 18 HD22 LEU 18 29.974 24.222 2.979 150 HD23 LEU 18 HD23 LEU 18 28.944 23.669 4.299 151 H HIS 19 HN HIS 19 28.441 19.113 6.150 152 HA HIS 19 HA HIS 19 26.437 17.459 5.018 153 HB2 HIS 19 HB2 HIS 19 28.300 16.400 6.068 154 HB3 HIS 19 HB1 HIS 19 28.042 17.289 7.566 155 HD2 HIS 19 HD2 HIS 19 25.925 16.332 9.184 156 HE1 HIS 19 HE1 HIS 19 25.097 12.920 6.840 157 HE2 HIS 19 HE2 HIS 19 24.614 14.075 9.049 158 H PHE 20 HN PHE 20 26.616 19.396 7.987 159 HA PHE 20 HA PHE 20 23.939 18.660 8.786 160 HB2 PHE 20 HB2 PHE 20 26.196 19.975 9.976 161 HB3 PHE 20 HB1 PHE 20 24.760 20.982 10.164 162 HD1 PHE 20 HD1 PHE 20 25.975 17.463 10.580 163 HD2 PHE 20 HD2 PHE 20 23.140 20.461 11.776 164 HE1 PHE 20 HE1 PHE 20 25.128 15.955 12.358 165 HE2 PHE 20 HE2 PHE 20 22.295 18.953 13.552 166 HZ PHE 20 HZ PHE 20 23.286 16.700 13.836 167 H MET 21 HN MET 21 25.414 21.104 6.821 168 HA MET 21 HA MET 21 23.325 23.047 7.033 169 HB2 MET 21 HB2 MET 21 25.552 22.554 5.060 170 HB3 MET 21 HB1 MET 21 24.373 23.848 4.833 171 HG2 MET 21 HG2 MET 21 25.949 23.500 7.391 172 HG3 MET 21 HG1 MET 21 26.494 24.527 6.067 173 HE1 MET 21 HE1 MET 21 26.345 25.513 8.748 174 HE2 MET 21 HE2 MET 21 25.278 26.907 8.895 175 HE3 MET 21 HE3 MET 21 26.446 26.836 7.580 176 H ALA 22 HN ALA 22 24.203 20.862 4.361 177 HA ALA 22 HA ALA 22 21.807 21.294 2.912 178 HB1 ALA 22 HB1 ALA 22 22.597 19.719 1.402 179 HB2 ALA 22 HB2 ALA 22 23.344 18.735 2.661 180 HB3 ALA 22 HB3 ALA 22 24.092 20.254 2.168 181 H TRP 23 HN TRP 23 22.775 18.755 5.195 182 HA TRP 23 HA TRP 23 20.485 17.144 4.892 183 HB2 TRP 23 HB2 TRP 23 22.641 16.535 6.061 184 HB3 TRP 23 HB1 TRP 23 22.061 17.456 7.449 185 HD1 TRP 23 HD1 TRP 23 21.615 14.215 5.581 186 HE1 TRP 23 HE1 TRP 23 19.942 12.714 6.844 187 HE3 TRP 23 HE3 TRP 23 19.864 17.546 9.045 188 HZ2 TRP 23 HZ2 TRP 23 18.108 12.895 9.025 189 HZ3 TRP 23 HZ3 TRP 23 18.152 16.850 10.699 190 HH2 TRP 23 HH2 TRP 23 17.274 14.532 10.693 191 H THR 24 HN THR 24 21.121 19.968 6.914 192 HA THR 24 HA THR 24 18.756 19.805 8.491 193 HB THR 24 HB THR 24 20.657 22.036 7.816 194 HG1 THR 24 HG1 THR 24 19.978 20.558 10.131 195 HG21 THR 24 HG21 THR 24 19.359 23.304 9.627 196 HG22 THR 24 HG22 THR 24 18.048 22.162 9.332 197 HG23 THR 24 HG23 THR 24 18.612 23.214 8.033 198 H ILE 25 HN ILE 25 19.544 21.503 5.464 199 HA ILE 25 HA ILE 25 17.099 22.876 5.186 200 HB ILE 25 HB ILE 25 19.079 21.880 3.130 201 HG12 ILE 25 HG12 ILE 25 18.522 24.691 4.113 202 HG13 ILE 25 HG11 ILE 25 19.735 23.647 4.856 203 HG21 ILE 25 HG21 ILE 25 17.909 23.634 1.676 204 HG22 ILE 25 HG22 ILE 25 16.594 23.588 2.851 205 HG23 ILE 25 HG23 ILE 25 17.021 22.136 1.945 206 HD11 ILE 25 HD11 ILE 25 20.967 23.486 2.786 207 HD12 ILE 25 HD12 ILE 25 20.647 25.195 3.081 208 HD13 ILE 25 HD13 ILE 25 19.683 24.309 1.900 209 H GLY 26 HN GLY 26 18.130 19.673 4.061 210 HA2 GLY 26 HA2 GLY 26 15.785 19.015 2.623 211 HA3 GLY 26 HA1 GLY 26 16.933 17.859 3.293 212 H HIS 27 HN HIS 27 16.708 18.534 6.009 213 HA HIS 27 HA HIS 27 14.517 16.970 6.815 214 HB2 HIS 27 HB2 HIS 27 16.381 17.144 8.288 215 HB3 HIS 27 HB1 HIS 27 16.277 18.903 8.324 216 HD2 HIS 27 HD2 HIS 27 14.724 19.869 10.391 217 HE1 HIS 27 HE1 HIS 27 12.685 16.292 11.327 218 HE2 HIS 27 HE2 HIS 27 13.028 18.714 12.007 219 H LEU 28 HN LEU 28 14.948 20.489 6.699 220 HA LEU 28 HA LEU 28 12.390 21.074 7.854 221 HB2 LEU 28 HB2 LEU 28 14.324 22.765 6.252 222 HB3 LEU 28 HB1 LEU 28 12.875 23.387 7.043 223 HG LEU 28 HG LEU 28 15.024 21.857 8.526 224 HD11 LEU 28 HD11 LEU 28 15.953 23.962 9.223 225 HD12 LEU 28 HD12 LEU 28 14.655 24.863 8.440 226 HD13 LEU 28 HD13 LEU 28 15.851 24.009 7.464 227 HD21 LEU 28 HD21 LEU 28 13.926 23.125 10.457 228 HD22 LEU 28 HD22 LEU 28 12.938 21.868 9.712 229 HD23 LEU 28 HD23 LEU 28 12.648 23.563 9.322 230 H ASN 29 HN ASN 29 10.477 21.579 6.864 231 HA ASN 29 HA ASN 29 10.260 20.826 4.032 232 HB2 ASN 29 HB2 ASN 29 8.785 19.806 5.862 233 HB3 ASN 29 HB1 ASN 29 7.976 21.371 5.925 234 HD21 ASN 29 HD21 ASN 29 5.972 20.524 5.020 235 HD22 ASN 29 HD22 ASN 29 5.865 20.052 3.394 236 H GLN 30 HN GLN 30 9.459 22.192 2.478 237 HA GLN 30 HA GLN 30 9.224 25.025 3.266 238 HB2 GLN 30 HB2 GLN 30 10.189 23.652 0.786 239 HB3 GLN 30 HB1 GLN 30 9.516 25.277 0.662 240 HG2 GLN 30 HG2 GLN 30 11.690 25.863 1.102 241 HG3 GLN 30 HG1 GLN 30 11.145 25.664 2.765 242 HE21 GLN 30 HE21 GLN 30 13.898 25.272 1.848 243 HE22 GLN 30 HE22 GLN 30 14.285 23.643 2.135 244 H ILE 31 HN ILE 31 7.329 26.019 3.098 245 HA ILE 31 HA ILE 31 5.321 25.004 1.209 246 HB ILE 31 HB ILE 31 3.566 25.136 2.942 247 HG12 ILE 31 HG12 ILE 31 5.860 25.415 4.907 248 HG13 ILE 31 HG11 ILE 31 4.866 26.776 4.385 249 HG21 ILE 31 HG21 ILE 31 4.248 23.096 4.175 250 HG22 ILE 31 HG22 ILE 31 5.911 23.341 3.640 251 HG23 ILE 31 HG23 ILE 31 4.650 22.981 2.461 252 HD11 ILE 31 HD11 ILE 31 3.722 24.254 5.615 253 HD12 ILE 31 HD12 ILE 31 2.874 25.766 5.289 254 HD13 ILE 31 HD13 ILE 31 4.110 25.701 6.545 255 H LYS 32 HN LYS 32 3.709 26.558 0.641 256 HA LYS 32 HA LYS 32 4.524 29.337 1.239 257 HB2 LYS 32 HB2 LYS 32 3.119 28.219 -1.199 258 HB3 LYS 32 HB1 LYS 32 3.448 29.929 -0.918 259 HG2 LYS 32 HG2 LYS 32 5.914 29.191 -0.613 260 HG3 LYS 32 HG1 LYS 32 5.412 27.694 -1.400 261 HD2 LYS 32 HD2 LYS 32 4.954 30.451 -2.569 262 HD3 LYS 32 HD1 LYS 32 6.318 29.418 -2.993 263 HE2 LYS 32 HE2 LYS 32 4.704 27.645 -3.694 264 HE3 LYS 32 HE1 LYS 32 3.383 28.770 -3.378 265 HZ1 LYS 32 HZ1 LYS 32 5.464 28.895 -5.457 266 HZ2 LYS 32 HZ2 LYS 32 4.708 30.321 -4.926 267 HZ3 LYS 32 HZ3 LYS 32 3.784 29.071 -5.613 268 H ARG 33 HN ARG 33 3.178 30.449 2.475 269 HA ARG 33 HA ARG 33 0.483 29.446 2.971 270 HB2 ARG 33 HB2 ARG 33 2.353 31.326 4.303 271 HB3 ARG 33 HB1 ARG 33 0.633 31.665 4.485 272 HG2 ARG 33 HG2 ARG 33 1.610 28.857 4.888 273 HG3 ARG 33 HG1 ARG 33 1.838 30.039 6.178 274 HD2 ARG 33 HD2 ARG 33 -0.644 30.594 5.908 275 HD3 ARG 33 HD1 ARG 33 -0.760 29.141 4.921 276 HE ARG 33 HE ARG 33 0.497 28.466 7.349 277 HH11 ARG 33 HH11 ARG 33 -2.591 29.530 6.131 278 HH12 ARG 33 HH12 ARG 33 -3.487 28.753 7.392 279 HH21 ARG 33 HH21 ARG 33 -0.699 27.464 8.985 280 HH22 ARG 33 HH22 ARG 33 -2.427 27.590 8.997 281 H1 MET 1 HT1 MET 1 43.939 19.911 32.714 282 H2 MET 1 HT2 MET 1 42.350 20.021 33.304 283 H3 MET 1 HT3 MET 1 42.703 19.008 31.987 284 HA MET 1 HA MET 1 44.303 17.842 33.616 285 HB2 MET 1 HB2 MET 1 42.511 19.508 35.367 286 HB3 MET 1 HB1 MET 1 43.126 17.957 35.941 287 HG2 MET 1 HG2 MET 1 45.423 18.683 35.555 288 HG3 MET 1 HG1 MET 1 44.854 20.205 34.871 289 HE1 MET 1 HE1 MET 1 46.639 21.206 36.649 290 HE2 MET 1 HE2 MET 1 46.906 19.594 37.309 291 HE3 MET 1 HE3 MET 1 46.530 20.931 38.393 292 H PHE 2 HN PHE 2 40.904 18.576 33.192 293 HA PHE 2 HA PHE 2 40.204 15.742 33.553 294 HB2 PHE 2 HB2 PHE 2 38.473 18.205 33.267 295 HB3 PHE 2 HB1 PHE 2 37.857 16.561 33.428 296 HD1 PHE 2 HD1 PHE 2 39.111 19.452 35.172 297 HD2 PHE 2 HD2 PHE 2 38.543 15.206 35.487 298 HE1 PHE 2 HE1 PHE 2 39.346 19.604 37.636 299 HE2 PHE 2 HE2 PHE 2 38.778 15.357 37.951 300 HZ PHE 2 HZ PHE 2 39.180 17.557 39.026 301 H GLU 3 HN GLU 3 41.370 17.549 31.107 302 HA GLU 3 HA GLU 3 39.550 17.142 29.015 303 HB2 GLU 3 HB2 GLU 3 42.536 17.547 29.033 304 HB3 GLU 3 HB1 GLU 3 41.575 17.476 27.555 305 HG2 GLU 3 HG2 GLU 3 40.652 19.297 29.737 306 HG3 GLU 3 HG1 GLU 3 42.046 19.794 28.778 307 HA PRO 4 HA PRO 4 40.252 12.684 28.726 308 HB2 PRO 4 HB2 PRO 4 38.626 12.197 26.585 309 HB3 PRO 4 HB1 PRO 4 38.015 12.437 28.233 310 HG2 PRO 4 HG2 PRO 4 38.102 14.337 25.946 311 HG3 PRO 4 HG1 PRO 4 36.846 14.104 27.176 312 HD2 PRO 4 HD2 PRO 4 38.663 16.156 27.255 313 HD3 PRO 4 HD1 PRO 4 37.900 15.469 28.704 314 H PHE 5 HN PHE 5 40.460 14.861 25.950 315 HA PHE 5 HA PHE 5 42.877 13.529 25.047 316 HB2 PHE 5 HB2 PHE 5 40.309 13.476 23.477 317 HB3 PHE 5 HB1 PHE 5 41.874 13.421 22.665 318 HD1 PHE 5 HD1 PHE 5 39.371 11.515 24.381 319 HD2 PHE 5 HD2 PHE 5 43.566 11.641 23.469 320 HE1 PHE 5 HE1 PHE 5 39.555 9.094 24.889 321 HE2 PHE 5 HE2 PHE 5 43.750 9.219 23.976 322 HZ PHE 5 HZ PHE 5 41.744 7.946 24.685 323 H GLN 6 HN GLN 6 40.577 15.518 23.231 324 HA GLN 6 HA GLN 6 42.225 17.896 23.587 325 HB2 GLN 6 HB2 GLN 6 41.711 16.678 20.860 326 HB3 GLN 6 HB1 GLN 6 42.482 18.235 21.161 327 HG2 GLN 6 HG2 GLN 6 44.233 17.041 22.503 328 HG3 GLN 6 HG1 GLN 6 43.507 15.512 22.009 329 HE21 GLN 6 HE21 GLN 6 46.225 16.692 21.323 330 HE22 GLN 6 HE22 GLN 6 46.275 16.687 19.626 331 H ILE 7 HN ILE 7 41.219 19.785 22.473 332 HA ILE 7 HA ILE 7 38.532 20.100 23.214 333 HB ILE 7 HB ILE 7 40.260 21.674 21.303 334 HG12 ILE 7 HG12 ILE 7 39.261 22.370 24.077 335 HG13 ILE 7 HG11 ILE 7 40.797 21.549 23.800 336 HG21 ILE 7 HG21 ILE 7 38.477 23.462 21.695 337 HG22 ILE 7 HG22 ILE 7 37.445 22.168 22.303 338 HG23 ILE 7 HG23 ILE 7 38.010 22.134 20.633 339 HD11 ILE 7 HD11 ILE 7 41.692 23.398 22.604 340 HD12 ILE 7 HD12 ILE 7 40.877 24.112 23.994 341 HD13 ILE 7 HD13 ILE 7 40.106 24.145 22.408 342 H LEU 8 HN LEU 8 39.998 19.274 20.125 343 HA LEU 8 HA LEU 8 37.586 19.402 18.588 344 HB2 LEU 8 HB2 LEU 8 40.091 19.388 17.813 345 HB3 LEU 8 HB1 LEU 8 39.887 17.637 17.830 346 HG LEU 8 HG LEU 8 37.714 19.176 16.520 347 HD11 LEU 8 HD11 LEU 8 40.437 18.844 15.226 348 HD12 LEU 8 HD12 LEU 8 39.760 20.378 15.774 349 HD13 LEU 8 HD13 LEU 8 38.990 19.495 14.456 350 HD21 LEU 8 HD21 LEU 8 38.044 17.277 14.867 351 HD22 LEU 8 HD22 LEU 8 37.620 16.770 16.503 352 HD23 LEU 8 HD23 LEU 8 39.290 16.652 15.948 353 H SER 9 HN SER 9 39.215 16.894 20.405 354 HA SER 9 HA SER 9 37.664 14.684 19.465 355 HB2 SER 9 HB2 SER 9 39.844 14.385 20.577 356 HB3 SER 9 HB1 SER 9 39.154 14.999 22.075 357 HG SER 9 HG SER 9 39.185 12.654 21.829 358 H ILE 10 HN ILE 10 37.416 16.805 22.317 359 HA ILE 10 HA ILE 10 35.139 15.483 23.408 360 HB ILE 10 HB ILE 10 34.933 17.487 24.838 361 HG12 ILE 10 HG12 ILE 10 37.228 18.551 23.180 362 HG13 ILE 10 HG11 ILE 10 35.568 19.119 23.035 363 HG21 ILE 10 HG21 ILE 10 36.551 15.748 25.435 364 HG22 ILE 10 HG22 ILE 10 37.201 17.331 25.853 365 HG23 ILE 10 HG23 ILE 10 37.770 16.497 24.407 366 HD11 ILE 10 HD11 ILE 10 36.624 20.662 24.498 367 HD12 ILE 10 HD12 ILE 10 37.420 19.377 25.407 368 HD13 ILE 10 HD13 ILE 10 35.676 19.608 25.546 369 H CYS 11 HN CYS 11 35.598 18.037 21.036 370 HA CYS 11 HA CYS 11 32.959 19.050 21.024 371 HB2 CYS 11 HB2 CYS 11 34.848 20.189 19.922 372 HB3 CYS 11 HB1 CYS 11 34.950 18.873 18.751 373 HG CYS 11 HG CYS 11 33.436 20.687 17.668 374 H SER 12 HN SER 12 34.539 16.598 18.940 375 HA SER 12 HA SER 12 32.241 15.899 17.487 376 HB2 SER 12 HB2 SER 12 34.497 15.233 16.791 377 HB3 SER 12 HB1 SER 12 34.628 14.181 18.200 378 HG SER 12 HG SER 12 33.947 13.064 16.304 379 H PHE 13 HN PHE 13 33.477 14.779 20.585 380 HA PHE 13 HA PHE 13 31.813 12.535 20.947 381 HB2 PHE 13 HB2 PHE 13 33.620 12.838 22.457 382 HB3 PHE 13 HB1 PHE 13 33.079 14.459 22.894 383 HD1 PHE 13 HD1 PHE 13 31.933 10.887 22.941 384 HD2 PHE 13 HD2 PHE 13 31.727 14.766 24.775 385 HE1 PHE 13 HE1 PHE 13 30.563 9.946 24.783 386 HE2 PHE 13 HE2 PHE 13 30.357 13.825 26.616 387 HZ PHE 13 HZ PHE 13 29.775 11.416 26.619 388 H ILE 14 HN ILE 14 31.326 15.920 22.004 389 HA ILE 14 HA ILE 14 28.734 15.484 23.074 390 HB ILE 14 HB ILE 14 30.070 18.010 22.078 391 HG12 ILE 14 HG12 ILE 14 31.040 16.658 24.060 392 HG13 ILE 14 HG11 ILE 14 30.714 18.368 24.330 393 HG21 ILE 14 HG21 ILE 14 27.755 18.501 22.080 394 HG22 ILE 14 HG22 ILE 14 28.304 19.052 23.662 395 HG23 ILE 14 HG23 ILE 14 27.449 17.514 23.510 396 HD11 ILE 14 HD11 ILE 14 29.900 16.678 26.121 397 HD12 ILE 14 HD12 ILE 14 28.624 16.282 24.972 398 HD13 ILE 14 HD13 ILE 14 28.773 17.926 25.592 399 H LEU 15 HN LEU 15 29.911 16.501 19.902 400 HA LEU 15 HA LEU 15 27.440 17.193 18.753 401 HB2 LEU 15 HB2 LEU 15 29.993 16.100 17.577 402 HB3 LEU 15 HB1 LEU 15 28.595 16.486 16.571 403 HG LEU 15 HG LEU 15 29.787 18.465 18.522 404 HD11 LEU 15 HD11 LEU 15 31.023 19.430 16.681 405 HD12 LEU 15 HD12 LEU 15 30.322 18.276 15.545 406 HD13 LEU 15 HD13 LEU 15 31.450 17.723 16.782 407 HD21 LEU 15 HD21 LEU 15 27.845 18.602 16.200 408 HD22 LEU 15 HD22 LEU 15 28.621 20.041 16.863 409 HD23 LEU 15 HD23 LEU 15 27.562 19.066 17.878 410 H SER 16 HN SER 16 29.211 14.129 18.268 411 HA SER 16 HA SER 16 27.253 12.668 17.045 412 HB2 SER 16 HB2 SER 16 29.271 11.754 19.095 413 HB3 SER 16 HB1 SER 16 28.279 10.648 18.147 414 HG SER 16 HG SER 16 30.454 11.285 17.311 415 H ALA 17 HN ALA 17 27.573 13.362 20.503 416 HA ALA 17 HA ALA 17 25.596 11.608 21.460 417 HB1 ALA 17 HB1 ALA 17 27.295 13.252 22.662 418 HB2 ALA 17 HB2 ALA 17 25.804 12.745 23.456 419 HB3 ALA 17 HB3 ALA 17 25.894 14.324 22.672 420 H LEU 18 HN LEU 18 25.295 15.054 20.589 421 HA LEU 18 HA LEU 18 22.449 15.099 20.888 422 HB2 LEU 18 HB2 LEU 18 24.191 16.999 19.300 423 HB3 LEU 18 HB1 LEU 18 22.567 17.315 19.911 424 HG LEU 18 HG LEU 18 25.019 16.755 21.602 425 HD11 LEU 18 HD11 LEU 18 24.744 19.104 22.308 426 HD12 LEU 18 HD12 LEU 18 23.393 19.284 21.189 427 HD13 LEU 18 HD13 LEU 18 25.019 18.996 20.569 428 HD21 LEU 18 HD21 LEU 18 22.114 17.270 22.288 429 HD22 LEU 18 HD22 LEU 18 23.417 17.477 23.458 430 HD23 LEU 18 HD23 LEU 18 23.105 15.889 22.755 431 H HIS 19 HN HIS 19 24.559 14.073 18.394 432 HA HIS 19 HA HIS 19 22.834 14.462 16.179 433 HB2 HIS 19 HB2 HIS 19 25.159 14.163 15.743 434 HB3 HIS 19 HB1 HIS 19 25.200 12.651 16.647 435 HD2 HIS 19 HD2 HIS 19 24.129 10.408 15.290 436 HE1 HIS 19 HE1 HIS 19 23.524 12.380 11.606 437 HE2 HIS 19 HE2 HIS 19 23.536 10.119 12.763 438 H PHE 20 HN PHE 20 23.484 11.707 18.321 439 HA PHE 20 HA PHE 20 21.565 10.029 16.963 440 HB2 PHE 20 HB2 PHE 20 23.637 9.685 18.922 441 HB3 PHE 20 HB1 PHE 20 22.135 8.980 19.522 442 HD1 PHE 20 HD1 PHE 20 24.343 9.091 16.497 443 HD2 PHE 20 HD2 PHE 20 21.386 6.911 18.718 444 HE1 PHE 20 HE1 PHE 20 24.621 7.157 14.967 445 HE2 PHE 20 HE2 PHE 20 21.661 4.977 17.192 446 HZ PHE 20 HZ PHE 20 23.271 5.096 15.309 447 H MET 21 HN MET 21 21.531 12.332 19.553 448 HA MET 21 HA MET 21 19.190 11.355 20.875 449 HB2 MET 21 HB2 MET 21 20.640 14.000 20.839 450 HB3 MET 21 HB1 MET 21 19.145 13.767 21.748 451 HG2 MET 21 HG2 MET 21 21.538 11.942 22.040 452 HG3 MET 21 HG1 MET 21 21.283 13.352 23.066 453 HE1 MET 21 HE1 MET 21 21.803 10.771 24.185 454 HE2 MET 21 HE2 MET 21 20.512 10.225 25.252 455 HE3 MET 21 HE3 MET 21 21.122 11.871 25.392 456 H ALA 22 HN ALA 22 19.660 14.207 18.805 457 HA ALA 22 HA ALA 22 16.889 14.706 18.459 458 HB1 ALA 22 HB1 ALA 22 17.512 16.430 17.037 459 HB2 ALA 22 HB2 ALA 22 18.891 15.540 16.391 460 HB3 ALA 22 HB3 ALA 22 18.969 16.236 18.011 461 H TRP 23 HN TRP 23 19.253 12.969 16.459 462 HA TRP 23 HA TRP 23 17.544 12.475 14.277 463 HB2 TRP 23 HB2 TRP 23 20.048 12.159 14.361 464 HB3 TRP 23 HB1 TRP 23 19.755 10.637 15.201 465 HD1 TRP 23 HD1 TRP 23 19.609 12.294 11.821 466 HE1 TRP 23 HE1 TRP 23 18.965 10.552 10.032 467 HE3 TRP 23 HE3 TRP 23 18.313 8.364 14.827 468 HZ2 TRP 23 HZ2 TRP 23 18.027 7.859 9.890 469 HZ3 TRP 23 HZ3 TRP 23 17.547 6.226 13.832 470 HH2 TRP 23 HH2 TRP 23 17.402 5.969 11.371 471 H THR 24 HN THR 24 18.033 10.747 17.318 472 HA THR 24 HA THR 24 16.501 8.442 16.656 473 HB THR 24 HB THR 24 17.350 9.700 19.254 474 HG1 THR 24 HG1 THR 24 17.954 7.326 17.838 475 HG21 THR 24 HG21 THR 24 16.463 7.518 20.269 476 HG22 THR 24 HG22 THR 24 15.503 7.356 18.799 477 HG23 THR 24 HG23 THR 24 15.267 8.747 19.858 478 H ILE 25 HN ILE 25 15.690 11.509 18.261 479 HA ILE 25 HA ILE 25 13.020 10.878 18.901 480 HB ILE 25 HB ILE 25 14.358 13.523 18.309 481 HG12 ILE 25 HG12 ILE 25 13.418 12.347 20.938 482 HG13 ILE 25 HG11 ILE 25 15.053 12.106 20.320 483 HG21 ILE 25 HG21 ILE 25 12.319 14.431 19.565 484 HG22 ILE 25 HG22 ILE 25 11.561 12.867 19.265 485 HG23 ILE 25 HG23 ILE 25 12.032 13.894 17.911 486 HD11 ILE 25 HD11 ILE 25 15.484 14.480 20.328 487 HD12 ILE 25 HD12 ILE 25 14.824 14.056 21.908 488 HD13 ILE 25 HD13 ILE 25 13.798 14.836 20.706 489 H GLY 26 HN GLY 26 14.445 12.358 16.012 490 HA2 GLY 26 HA2 GLY 26 12.028 12.890 14.639 491 HA3 GLY 26 HA1 GLY 26 13.610 12.696 13.887 492 H HIS 27 HN HIS 27 14.161 10.060 14.688 493 HA HIS 27 HA HIS 27 12.910 8.566 12.668 494 HB2 HIS 27 HB2 HIS 27 15.042 7.845 13.450 495 HB3 HIS 27 HB1 HIS 27 14.471 7.738 15.116 496 HD2 HIS 27 HD2 HIS 27 13.529 5.234 15.793 497 HE1 HIS 27 HE1 HIS 27 13.019 3.711 11.887 498 HE2 HIS 27 HE2 HIS 27 12.889 3.146 14.360 499 H LEU 28 HN LEU 28 12.282 8.747 16.155 500 HA LEU 28 HA LEU 28 10.224 6.752 16.125 501 HB2 LEU 28 HB2 LEU 28 10.934 8.899 18.138 502 HB3 LEU 28 HB1 LEU 28 9.735 7.633 18.412 503 HG LEU 28 HG LEU 28 12.598 7.041 17.633 504 HD11 LEU 28 HD11 LEU 28 13.088 6.675 19.959 505 HD12 LEU 28 HD12 LEU 28 11.403 6.927 20.414 506 HD13 LEU 28 HD13 LEU 28 12.374 8.281 19.836 507 HD21 LEU 28 HD21 LEU 28 11.930 4.821 18.711 508 HD22 LEU 28 HD22 LEU 28 11.138 5.192 17.180 509 HD23 LEU 28 HD23 LEU 28 10.271 5.420 18.700 510 H ASN 29 HN ASN 29 8.027 6.989 16.019 511 HA ASN 29 HA ASN 29 7.059 9.576 15.013 512 HB2 ASN 29 HB2 ASN 29 6.656 7.363 13.786 513 HB3 ASN 29 HB1 ASN 29 5.517 6.985 15.078 514 HD21 ASN 29 HD21 ASN 29 3.644 7.136 13.657 515 HD22 ASN 29 HD22 ASN 29 3.116 8.629 13.045 516 H GLN 30 HN GLN 30 5.425 10.715 15.987 517 HA GLN 30 HA GLN 30 4.700 9.834 18.709 518 HB2 GLN 30 HB2 GLN 30 5.088 12.523 17.451 519 HB3 GLN 30 HB1 GLN 30 3.990 12.367 18.821 520 HG2 GLN 30 HG2 GLN 30 5.928 12.715 19.999 521 HG3 GLN 30 HG1 GLN 30 6.071 10.971 19.795 522 HE21 GLN 30 HE21 GLN 30 8.329 12.812 20.081 523 HE22 GLN 30 HE22 GLN 30 9.228 12.716 18.644 524 H ILE 31 HN ILE 31 2.668 9.300 19.144 525 HA ILE 31 HA ILE 31 0.497 10.375 17.483 526 HB ILE 31 HB ILE 31 -0.512 8.130 17.278 527 HG12 ILE 31 HG12 ILE 31 2.146 7.099 18.315 528 HG13 ILE 31 HG11 ILE 31 0.697 7.206 19.315 529 HG21 ILE 31 HG21 ILE 31 1.091 7.263 15.600 530 HG22 ILE 31 HG22 ILE 31 2.329 8.346 16.236 531 HG23 ILE 31 HG23 ILE 31 0.891 9.009 15.459 532 HD11 ILE 31 HD11 ILE 31 0.798 5.705 16.684 533 HD12 ILE 31 HD12 ILE 31 -0.495 5.676 17.884 534 HD13 ILE 31 HD13 ILE 31 1.066 4.942 18.252 535 H LYS 32 HN LYS 32 -1.577 10.299 18.498 536 HA LYS 32 HA LYS 32 -1.411 9.971 21.432 537 HB2 LYS 32 HB2 LYS 32 -3.205 11.776 19.790 538 HB3 LYS 32 HB1 LYS 32 -3.287 11.593 21.543 539 HG2 LYS 32 HG2 LYS 32 -0.766 12.199 21.517 540 HG3 LYS 32 HG1 LYS 32 -1.072 12.787 19.883 541 HD2 LYS 32 HD2 LYS 32 -2.653 13.660 22.315 542 HD3 LYS 32 HD1 LYS 32 -1.290 14.562 21.654 543 HE2 LYS 32 HE2 LYS 32 -2.488 14.683 19.464 544 HE3 LYS 32 HE1 LYS 32 -3.875 13.894 20.216 545 HZ1 LYS 32 HZ1 LYS 32 -2.765 16.573 20.728 546 HZ2 LYS 32 HZ2 LYS 32 -3.655 15.778 21.936 547 HZ3 LYS 32 HZ3 LYS 32 -4.372 16.120 20.435 548 H ARG 33 HN ARG 33 -2.499 8.315 22.240 549 HA ARG 33 HA ARG 33 -4.463 6.918 20.597 550 HB2 ARG 33 HB2 ARG 33 -2.848 6.296 23.008 551 HB3 ARG 33 HB1 ARG 33 -4.422 5.508 22.888 552 HG2 ARG 33 HG2 ARG 33 -2.626 5.538 20.486 553 HG3 ARG 33 HG1 ARG 33 -2.304 4.387 21.784 554 HD2 ARG 33 HD2 ARG 33 -4.775 3.748 21.632 555 HD3 ARG 33 HD1 ARG 33 -4.818 4.661 20.128 556 HE ARG 33 HE ARG 33 -2.662 2.851 20.007 557 HH11 ARG 33 HH11 ARG 33 -6.148 2.871 20.108 558 HH12 ARG 33 HH12 ARG 33 -6.298 1.392 19.222 559 HH21 ARG 33 HH21 ARG 33 -2.890 0.919 18.854 560 HH22 ARG 33 HH22 ARG 33 -4.468 0.292 18.516 561 H1 MET 1 HT1 MET 1 47.210 -5.600 25.484 562 H2 MET 1 HT2 MET 1 45.940 -6.701 25.238 563 H3 MET 1 HT3 MET 1 46.101 -5.345 24.227 564 HA MET 1 HA MET 1 48.404 -6.324 23.675 565 HB2 MET 1 HB2 MET 1 46.908 -8.583 24.983 566 HB3 MET 1 HB1 MET 1 48.078 -8.913 23.705 567 HG2 MET 1 HG2 MET 1 49.827 -7.759 24.956 568 HG3 MET 1 HG1 MET 1 48.669 -7.309 26.208 569 HE1 MET 1 HE1 MET 1 50.592 -8.365 27.803 570 HE2 MET 1 HE2 MET 1 51.493 -8.892 26.383 571 HE3 MET 1 HE3 MET 1 51.146 -10.039 27.675 572 H PHE 2 HN PHE 2 44.993 -7.096 23.465 573 HA PHE 2 HA PHE 2 45.259 -7.679 20.594 574 HB2 PHE 2 HB2 PHE 2 42.925 -8.001 22.490 575 HB3 PHE 2 HB1 PHE 2 42.873 -8.368 20.765 576 HD1 PHE 2 HD1 PHE 2 43.787 -9.569 24.036 577 HD2 PHE 2 HD2 PHE 2 44.546 -10.069 19.838 578 HE1 PHE 2 HE1 PHE 2 44.772 -11.801 24.479 579 HE2 PHE 2 HE2 PHE 2 45.530 -12.300 20.281 580 HZ PHE 2 HZ PHE 2 45.643 -13.167 22.602 581 H GLU 3 HN GLU 3 45.009 -4.978 22.396 582 HA GLU 3 HA GLU 3 42.786 -3.641 21.336 583 HB2 GLU 3 HB2 GLU 3 45.378 -2.630 22.494 584 HB3 GLU 3 HB1 GLU 3 44.040 -1.572 22.037 585 HG2 GLU 3 HG2 GLU 3 43.427 -3.934 23.760 586 HG3 GLU 3 HG1 GLU 3 44.232 -2.554 24.505 587 HA PRO 4 HA PRO 4 44.549 -3.136 17.202 588 HB2 PRO 4 HB2 PRO 4 42.507 -1.685 16.110 589 HB3 PRO 4 HB1 PRO 4 42.435 -3.443 16.342 590 HG2 PRO 4 HG2 PRO 4 41.235 -1.263 17.971 591 HG3 PRO 4 HG1 PRO 4 40.572 -2.851 17.541 592 HD2 PRO 4 HD2 PRO 4 41.675 -2.296 19.989 593 HD3 PRO 4 HD1 PRO 4 41.654 -3.920 19.273 594 H PHE 5 HN PHE 5 43.222 -0.455 19.081 595 HA PHE 5 HA PHE 5 45.473 1.223 18.335 596 HB2 PHE 5 HB2 PHE 5 42.648 1.813 17.472 597 HB3 PHE 5 HB1 PHE 5 43.809 3.114 17.745 598 HD1 PHE 5 HD1 PHE 5 42.639 0.637 15.433 599 HD2 PHE 5 HD2 PHE 5 46.092 2.938 16.546 600 HE1 PHE 5 HE1 PHE 5 43.639 0.217 13.202 601 HE2 PHE 5 HE2 PHE 5 47.090 2.519 14.315 602 HZ PHE 5 HZ PHE 5 45.864 1.160 12.644 603 H GLN 6 HN GLN 6 42.252 2.142 19.479 604 HA GLN 6 HA GLN 6 43.202 2.379 22.226 605 HB2 GLN 6 HB2 GLN 6 42.171 4.759 20.658 606 HB3 GLN 6 HB1 GLN 6 42.539 4.745 22.384 607 HG2 GLN 6 HG2 GLN 6 44.891 4.086 21.815 608 HG3 GLN 6 HG1 GLN 6 44.493 4.295 20.112 609 HE21 GLN 6 HE21 GLN 6 46.397 5.876 21.878 610 HE22 GLN 6 HE22 GLN 6 45.883 7.487 21.724 611 H ILE 7 HN ILE 7 41.403 3.086 23.677 612 HA ILE 7 HA ILE 7 39.138 1.462 23.358 613 HB ILE 7 HB ILE 7 39.634 3.854 25.133 614 HG12 ILE 7 HG12 ILE 7 39.459 0.907 25.813 615 HG13 ILE 7 HG11 ILE 7 40.979 1.695 25.392 616 HG21 ILE 7 HG21 ILE 7 37.662 2.876 26.431 617 HG22 ILE 7 HG22 ILE 7 37.287 1.947 24.980 618 HG23 ILE 7 HG23 ILE 7 37.255 3.710 24.932 619 HD11 ILE 7 HD11 ILE 7 40.884 3.130 27.285 620 HD12 ILE 7 HD12 ILE 7 40.411 1.545 27.896 621 HD13 ILE 7 HD13 ILE 7 39.182 2.768 27.575 622 H LEU 8 HN LEU 8 39.667 4.867 22.646 623 HA LEU 8 HA LEU 8 36.948 5.479 22.000 624 HB2 LEU 8 HB2 LEU 8 38.958 7.067 22.555 625 HB3 LEU 8 HB1 LEU 8 39.260 6.978 20.820 626 HG LEU 8 HG LEU 8 36.443 7.465 21.615 627 HD11 LEU 8 HD11 LEU 8 38.566 9.615 21.874 628 HD12 LEU 8 HD12 LEU 8 37.713 8.871 23.226 629 HD13 LEU 8 HD13 LEU 8 36.826 9.842 22.051 630 HD21 LEU 8 HD21 LEU 8 36.718 9.126 19.715 631 HD22 LEU 8 HD22 LEU 8 37.013 7.444 19.276 632 HD23 LEU 8 HD23 LEU 8 38.372 8.538 19.539 633 H SER 9 HN SER 9 39.708 4.325 20.184 634 HA SER 9 HA SER 9 38.604 4.673 17.567 635 HB2 SER 9 HB2 SER 9 41.023 4.378 17.948 636 HB3 SER 9 HB1 SER 9 40.725 2.735 18.505 637 HG SER 9 HG SER 9 41.315 2.973 16.234 638 H ILE 10 HN ILE 10 38.735 1.917 19.819 639 HA ILE 10 HA ILE 10 37.406 0.105 18.065 640 HB ILE 10 HB ILE 10 37.141 -1.306 20.076 641 HG12 ILE 10 HG12 ILE 10 38.375 1.042 21.530 642 HG13 ILE 10 HG11 ILE 10 36.672 0.609 21.635 643 HG21 ILE 10 HG21 ILE 10 39.278 -1.314 18.877 644 HG22 ILE 10 HG22 ILE 10 39.567 -1.482 20.607 645 HG23 ILE 10 HG23 ILE 10 39.834 0.072 19.813 646 HD11 ILE 10 HD11 ILE 10 37.683 -0.399 23.532 647 HD12 ILE 10 HD12 ILE 10 39.056 -0.981 22.590 648 HD13 ILE 10 HD13 ILE 10 37.465 -1.711 22.376 649 H CYS 11 HN CYS 11 36.334 2.499 20.409 650 HA CYS 11 HA CYS 11 33.670 1.599 20.704 651 HB2 CYS 11 HB2 CYS 11 34.699 3.286 22.179 652 HB3 CYS 11 HB1 CYS 11 34.768 4.417 20.827 653 HG CYS 11 HG CYS 11 32.545 4.920 22.078 654 H SER 12 HN SER 12 35.081 4.099 18.554 655 HA SER 12 HA SER 12 32.720 4.668 17.148 656 HB2 SER 12 HB2 SER 12 34.711 6.095 17.023 657 HB3 SER 12 HB1 SER 12 35.582 4.815 16.181 658 HG SER 12 HG SER 12 34.648 6.360 14.749 659 H PHE 13 HN PHE 13 35.164 2.182 16.694 660 HA PHE 13 HA PHE 13 34.402 1.266 14.139 661 HB2 PHE 13 HB2 PHE 13 36.449 0.468 15.041 662 HB3 PHE 13 HB1 PHE 13 35.659 -0.125 16.501 663 HD1 PHE 13 HD1 PHE 13 35.620 -0.570 12.776 664 HD2 PHE 13 HD2 PHE 13 34.973 -2.355 16.630 665 HE1 PHE 13 HE1 PHE 13 35.248 -2.771 11.696 666 HE2 PHE 13 HE2 PHE 13 34.601 -4.555 15.549 667 HZ PHE 13 HZ PHE 13 34.738 -4.764 13.082 668 H ILE 14 HN ILE 14 33.373 0.116 17.370 669 HA ILE 14 HA ILE 14 31.512 -1.784 16.386 670 HB ILE 14 HB ILE 14 31.696 -0.385 19.063 671 HG12 ILE 14 HG12 ILE 14 33.597 -1.917 18.202 672 HG13 ILE 14 HG11 ILE 14 32.923 -2.278 19.790 673 HG21 ILE 14 HG21 ILE 14 29.470 -1.182 18.938 674 HG22 ILE 14 HG22 ILE 14 30.336 -2.478 19.762 675 HG23 ILE 14 HG23 ILE 14 29.938 -2.632 18.049 676 HD11 ILE 14 HD11 ILE 14 33.243 -4.245 18.128 677 HD12 ILE 14 HD12 ILE 14 31.818 -3.604 17.309 678 HD13 ILE 14 HD13 ILE 14 31.707 -4.131 18.987 679 H LEU 15 HN LEU 15 31.246 1.605 17.361 680 HA LEU 15 HA LEU 15 28.447 1.828 17.280 681 HB2 LEU 15 HB2 LEU 15 30.661 3.812 16.771 682 HB3 LEU 15 HB1 LEU 15 28.960 4.273 16.689 683 HG LEU 15 HG LEU 15 30.140 2.855 19.085 684 HD11 LEU 15 HD11 LEU 15 30.382 5.011 20.153 685 HD12 LEU 15 HD12 LEU 15 29.691 5.834 18.755 686 HD13 LEU 15 HD13 LEU 15 31.272 5.059 18.632 687 HD21 LEU 15 HD21 LEU 15 27.581 4.368 18.497 688 HD22 LEU 15 HD22 LEU 15 28.109 4.014 20.142 689 HD23 LEU 15 HD23 LEU 15 27.753 2.694 19.030 690 H SER 16 HN SER 16 30.729 2.889 14.743 691 HA SER 16 HA SER 16 28.957 3.359 12.717 692 HB2 SER 16 HB2 SER 16 31.709 2.128 12.554 693 HB3 SER 16 HB1 SER 16 30.804 2.674 11.144 694 HG SER 16 HG SER 16 32.317 4.208 12.239 695 H ALA 17 HN ALA 17 30.192 0.225 13.803 696 HA ALA 17 HA ALA 17 29.212 -1.357 11.695 697 HB1 ALA 17 HB1 ALA 17 30.689 -1.899 13.830 698 HB2 ALA 17 HB2 ALA 17 29.743 -3.158 13.035 699 HB3 ALA 17 HB3 ALA 17 29.132 -2.387 14.500 700 H LEU 18 HN LEU 18 27.698 -0.636 14.850 701 HA LEU 18 HA LEU 18 25.219 -1.895 14.187 702 HB2 LEU 18 HB2 LEU 18 25.745 0.200 16.308 703 HB3 LEU 18 HB1 LEU 18 24.394 -0.933 16.253 704 HG LEU 18 HG LEU 18 27.320 -1.676 16.510 705 HD11 LEU 18 HD11 LEU 18 26.660 -2.429 18.766 706 HD12 LEU 18 HD12 LEU 18 25.021 -1.843 18.483 707 HD13 LEU 18 HD13 LEU 18 26.365 -0.701 18.565 708 HD21 LEU 18 HD21 LEU 18 24.783 -3.319 16.325 709 HD22 LEU 18 HD22 LEU 18 26.290 -3.969 16.972 710 HD23 LEU 18 HD23 LEU 18 26.211 -3.420 15.297 711 H HIS 19 HN HIS 19 26.583 1.174 13.511 712 HA HIS 19 HA HIS 19 24.188 2.659 13.222 713 HB2 HIS 19 HB2 HIS 19 26.228 3.867 13.489 714 HB3 HIS 19 HB1 HIS 19 26.977 3.028 12.134 715 HD2 HIS 19 HD2 HIS 19 26.179 3.929 9.571 716 HE1 HIS 19 HE1 HIS 19 23.873 7.184 10.956 717 HE2 HIS 19 HE2 HIS 19 24.887 6.098 8.897 718 H PHE 20 HN PHE 20 26.238 0.866 10.945 719 HA PHE 20 HA PHE 20 24.517 1.476 8.708 720 HB2 PHE 20 HB2 PHE 20 27.126 0.346 9.104 721 HB3 PHE 20 HB1 PHE 20 26.161 -0.734 8.097 722 HD1 PHE 20 HD1 PHE 20 27.134 2.864 8.481 723 HD2 PHE 20 HD2 PHE 20 25.792 -0.246 5.836 724 HE1 PHE 20 HE1 PHE 20 27.421 4.384 6.541 725 HE2 PHE 20 HE2 PHE 20 26.081 1.275 3.901 726 HZ PHE 20 HZ PHE 20 26.902 3.579 4.256 727 H MET 21 HN MET 21 24.706 -0.960 11.166 728 HA MET 21 HA MET 21 23.302 -3.011 9.751 729 HB2 MET 21 HB2 MET 21 23.874 -2.470 12.662 730 HB3 MET 21 HB1 MET 21 22.888 -3.839 12.142 731 HG2 MET 21 HG2 MET 21 25.647 -3.294 11.031 732 HG3 MET 21 HG1 MET 21 25.366 -4.344 12.419 733 HE1 MET 21 HE1 MET 21 26.916 -5.222 10.179 734 HE2 MET 21 HE2 MET 21 26.249 -6.668 9.423 735 HE3 MET 21 HE3 MET 21 26.394 -6.586 11.176 736 H ALA 22 HN ALA 22 22.253 -0.893 12.414 737 HA ALA 22 HA ALA 22 19.505 -1.525 12.149 738 HB1 ALA 22 HB1 ALA 22 19.127 0.030 13.831 739 HB2 ALA 22 HB2 ALA 22 20.404 1.107 13.263 740 HB3 ALA 22 HB3 ALA 22 20.819 -0.384 14.108 741 H TRP 23 HN TRP 23 21.458 1.161 10.892 742 HA TRP 23 HA TRP 23 19.330 2.620 9.767 743 HB2 TRP 23 HB2 TRP 23 21.705 3.403 10.116 744 HB3 TRP 23 HB1 TRP 23 22.135 2.510 8.656 745 HD1 TRP 23 HD1 TRP 23 20.432 5.637 9.887 746 HE1 TRP 23 HE1 TRP 23 19.739 7.090 7.874 747 HE3 TRP 23 HE3 TRP 23 21.334 2.360 6.065 748 HZ2 TRP 23 HZ2 TRP 23 19.584 6.896 5.029 749 HZ3 TRP 23 HZ3 TRP 23 20.900 3.025 3.716 750 HH2 TRP 23 HH2 TRP 23 20.026 5.286 3.195 751 H THR 24 HN THR 24 21.249 -0.070 8.523 752 HA THR 24 HA THR 24 20.279 0.019 5.848 753 HB THR 24 HB THR 24 21.560 -2.126 7.527 754 HG1 THR 24 HG1 THR 24 22.289 -0.592 5.264 755 HG21 THR 24 HG21 THR 24 21.691 -3.388 5.299 756 HG22 THR 24 HG22 THR 24 20.384 -2.337 4.753 757 HG23 THR 24 HG23 THR 24 20.138 -3.410 6.132 758 H ILE 25 HN ILE 25 19.232 -1.759 8.748 759 HA ILE 25 HA ILE 25 17.208 -3.282 7.512 760 HB ILE 25 HB ILE 25 17.495 -2.261 10.342 761 HG12 ILE 25 HG12 ILE 25 17.837 -5.054 9.223 762 HG13 ILE 25 HG11 ILE 25 19.175 -3.912 9.352 763 HG21 ILE 25 HG21 ILE 25 15.820 -4.141 10.812 764 HG22 ILE 25 HG22 ILE 25 15.464 -4.120 9.084 765 HG23 ILE 25 HG23 ILE 25 15.161 -2.686 10.064 766 HD11 ILE 25 HD11 ILE 25 18.916 -3.768 11.747 767 HD12 ILE 25 HD12 ILE 25 18.959 -5.478 11.320 768 HD13 ILE 25 HD13 ILE 25 17.421 -4.701 11.692 769 H GLY 26 HN GLY 26 17.132 -0.073 9.028 770 HA2 GLY 26 HA2 GLY 26 14.353 0.383 8.780 771 HA3 GLY 26 HA1 GLY 26 15.585 1.633 8.928 772 H HIS 27 HN HIS 27 17.073 1.066 6.615 773 HA HIS 27 HA HIS 27 15.687 2.529 4.660 774 HB2 HIS 27 HB2 HIS 27 18.068 2.527 4.591 775 HB3 HIS 27 HB1 HIS 27 18.132 0.767 4.501 776 HD2 HIS 27 HD2 HIS 27 18.191 -0.199 1.917 777 HE1 HIS 27 HE1 HIS 27 16.861 3.291 -0.055 778 HE2 HIS 27 HE2 HIS 27 17.714 0.923 -0.393 779 H LEU 28 HN LEU 28 16.220 -0.960 5.010 780 HA LEU 28 HA LEU 28 14.900 -1.643 2.559 781 HB2 LEU 28 HB2 LEU 28 15.615 -3.285 4.998 782 HB3 LEU 28 HB1 LEU 28 14.972 -3.957 3.499 783 HG LEU 28 HG LEU 28 17.464 -2.244 3.592 784 HD11 LEU 28 HD11 LEU 28 18.775 -4.259 3.590 785 HD12 LEU 28 HD12 LEU 28 17.334 -5.267 3.444 786 HD13 LEU 28 HD13 LEU 28 17.647 -4.386 4.940 787 HD21 LEU 28 HD21 LEU 28 17.826 -3.490 1.389 788 HD22 LEU 28 HD22 LEU 28 16.504 -2.324 1.395 789 HD23 LEU 28 HD23 LEU 28 16.159 -4.048 1.536 790 H ASN 29 HN ASN 29 12.817 -2.301 2.210 791 HA ASN 29 HA ASN 29 10.900 -1.682 4.352 792 HB2 ASN 29 HB2 ASN 29 10.739 -0.673 2.002 793 HB3 ASN 29 HB1 ASN 29 10.241 -2.279 1.471 794 HD21 ASN 29 HD21 ASN 29 8.039 -1.590 0.998 795 HD22 ASN 29 HD22 ASN 29 6.950 -1.193 2.239 796 H GLN 30 HN GLN 30 9.433 -3.158 5.121 797 HA GLN 30 HA GLN 30 9.919 -5.965 4.350 798 HB2 GLN 30 HB2 GLN 30 9.115 -4.644 6.914 799 HB3 GLN 30 HB1 GLN 30 8.619 -6.309 6.613 800 HG2 GLN 30 HG2 GLN 30 10.662 -6.748 7.558 801 HG3 GLN 30 HG1 GLN 30 11.203 -6.511 5.899 802 HE21 GLN 30 HE21 GLN 30 12.830 -5.999 8.280 803 HE22 GLN 30 HE22 GLN 30 13.194 -4.341 8.279 804 H ILE 31 HN ILE 31 8.374 -7.072 3.352 805 HA ILE 31 HA ILE 31 5.569 -6.258 3.669 806 HB ILE 31 HB ILE 31 5.208 -6.416 1.230 807 HG12 ILE 31 HG12 ILE 31 8.234 -6.479 1.024 808 HG13 ILE 31 HG11 ILE 31 7.225 -7.915 0.850 809 HG21 ILE 31 HG21 ILE 31 6.340 -4.291 0.647 810 HG22 ILE 31 HG22 ILE 31 7.370 -4.460 2.069 811 HG23 ILE 31 HG23 ILE 31 5.633 -4.224 2.262 812 HD11 ILE 31 HD11 ILE 31 6.861 -5.414 -0.821 813 HD12 ILE 31 HD12 ILE 31 6.098 -6.985 -1.066 814 HD13 ILE 31 HD13 ILE 31 7.830 -6.795 -1.334 815 H LYS 32 HN LYS 32 4.053 -7.924 3.162 816 HA LYS 32 HA LYS 32 5.262 -10.623 3.170 817 HB2 LYS 32 HB2 LYS 32 2.605 -9.695 4.286 818 HB3 LYS 32 HB1 LYS 32 3.158 -11.369 4.258 819 HG2 LYS 32 HG2 LYS 32 5.260 -10.477 5.486 820 HG3 LYS 32 HG1 LYS 32 4.282 -9.046 5.817 821 HD2 LYS 32 HD2 LYS 32 3.417 -11.872 6.483 822 HD3 LYS 32 HD1 LYS 32 4.183 -10.781 7.637 823 HE2 LYS 32 HE2 LYS 32 2.345 -9.136 7.235 824 HE3 LYS 32 HE1 LYS 32 1.558 -10.320 6.192 825 HZ1 LYS 32 HZ1 LYS 32 1.993 -10.413 9.102 826 HZ2 LYS 32 HZ2 LYS 32 1.808 -11.857 8.226 827 HZ3 LYS 32 HZ3 LYS 32 0.569 -10.693 8.225 828 H ARG 33 HN ARG 33 5.002 -11.759 1.376 829 HA ARG 33 HA ARG 33 3.069 -10.893 -0.631 830 HB2 ARG 33 HB2 ARG 33 5.495 -12.603 -0.582 831 HB3 ARG 33 HB1 ARG 33 4.250 -13.034 -1.755 832 HG2 ARG 33 HG2 ARG 33 5.070 -10.160 -1.496 833 HG3 ARG 33 HG1 ARG 33 6.105 -11.271 -2.394 834 HD2 ARG 33 HD2 ARG 33 4.000 -11.980 -3.660 835 HD3 ARG 33 HD1 ARG 33 3.214 -10.580 -2.938 836 HE ARG 33 HE ARG 33 5.618 -9.729 -4.135 837 HH11 ARG 33 HH11 ARG 33 2.498 -11.022 -5.002 838 HH12 ARG 33 HH12 ARG 33 2.475 -10.244 -6.548 839 HH21 ARG 33 HH21 ARG 33 5.563 -8.729 -6.163 840 HH22 ARG 33 HH22 ARG 33 4.197 -8.956 -7.204 841 H1 MET 1 HT1 MET 1 55.024 2.180 1.423 842 H2 MET 1 HT2 MET 1 54.113 1.988 0.002 843 H3 MET 1 HT3 MET 1 53.536 2.977 1.257 844 HA MET 1 HA MET 1 55.704 4.296 0.893 845 HB2 MET 1 HB2 MET 1 55.434 2.578 -1.562 846 HB3 MET 1 HB1 MET 1 56.156 4.184 -1.674 847 HG2 MET 1 HG2 MET 1 57.816 3.597 0.014 848 HG3 MET 1 HG1 MET 1 57.064 2.018 0.241 849 HE1 MET 1 HE1 MET 1 59.621 1.194 -0.109 850 HE2 MET 1 HE2 MET 1 60.112 2.842 -0.497 851 HE3 MET 1 HE3 MET 1 60.554 1.521 -1.577 852 H PHE 2 HN PHE 2 52.786 3.333 -0.789 853 HA PHE 2 HA PHE 2 52.237 6.126 -1.527 854 HB2 PHE 2 HB2 PHE 2 50.859 3.548 -2.302 855 HB3 PHE 2 HB1 PHE 2 50.345 5.154 -2.819 856 HD1 PHE 2 HD1 PHE 2 52.594 2.410 -3.436 857 HD2 PHE 2 HD2 PHE 2 52.024 6.619 -4.076 858 HE1 PHE 2 HE1 PHE 2 54.261 2.357 -5.271 859 HE2 PHE 2 HE2 PHE 2 53.690 6.566 -5.912 860 HZ PHE 2 HZ PHE 2 54.810 4.436 -6.509 861 H GLU 3 HN GLU 3 51.843 4.317 1.152 862 HA GLU 3 HA GLU 3 49.111 4.533 1.739 863 HB2 GLU 3 HB2 GLU 3 51.540 4.323 3.511 864 HB3 GLU 3 HB1 GLU 3 49.884 4.282 4.124 865 HG2 GLU 3 HG2 GLU 3 50.577 2.481 1.843 866 HG3 GLU 3 HG1 GLU 3 51.156 2.041 3.450 867 HA PRO 4 HA PRO 4 49.179 9.016 2.341 868 HB2 PRO 4 HB2 PRO 4 46.568 9.324 3.083 869 HB3 PRO 4 HB1 PRO 4 47.079 9.101 1.399 870 HG2 PRO 4 HG2 PRO 4 45.922 7.134 3.306 871 HG3 PRO 4 HG1 PRO 4 45.634 7.329 1.568 872 HD2 PRO 4 HD2 PRO 4 47.281 5.402 2.612 873 HD3 PRO 4 HD1 PRO 4 47.486 6.086 0.986 874 H PHE 5 HN PHE 5 47.848 6.764 4.717 875 HA PHE 5 HA PHE 5 49.147 8.218 6.869 876 HB2 PHE 5 HB2 PHE 5 46.153 8.052 6.595 877 HB3 PHE 5 HB1 PHE 5 46.918 8.181 8.180 878 HD1 PHE 5 HD1 PHE 5 45.803 9.977 5.287 879 HD2 PHE 5 HD2 PHE 5 48.623 10.093 8.524 880 HE1 PHE 5 HE1 PHE 5 46.080 12.420 4.959 881 HE2 PHE 5 HE2 PHE 5 48.900 12.535 8.197 882 HZ PHE 5 HZ PHE 5 47.628 13.699 6.415 883 H GLN 6 HN GLN 6 46.370 6.026 6.975 884 HA GLN 6 HA GLN 6 48.069 3.770 7.699 885 HB2 GLN 6 HB2 GLN 6 45.946 4.861 9.566 886 HB3 GLN 6 HB1 GLN 6 46.854 3.367 9.803 887 HG2 GLN 6 HG2 GLN 6 48.968 4.716 9.759 888 HG3 GLN 6 HG1 GLN 6 47.984 6.177 9.703 889 HE21 GLN 6 HE21 GLN 6 49.834 5.153 11.890 890 HE22 GLN 6 HE22 GLN 6 48.862 5.103 13.280 891 H ILE 7 HN ILE 7 46.737 1.786 8.014 892 HA ILE 7 HA ILE 7 45.052 1.322 5.820 893 HB ILE 7 HB ILE 7 45.408 -0.200 8.402 894 HG12 ILE 7 HG12 ILE 7 46.312 -0.865 5.589 895 HG13 ILE 7 HG11 ILE 7 47.317 0.043 6.718 896 HG21 ILE 7 HG21 ILE 7 44.344 -2.086 7.043 897 HG22 ILE 7 HG22 ILE 7 43.788 -0.840 5.926 898 HG23 ILE 7 HG23 ILE 7 43.242 -0.828 7.603 899 HD11 ILE 7 HD11 ILE 7 47.452 -1.784 8.233 900 HD12 ILE 7 HD12 ILE 7 47.680 -2.502 6.640 901 HD13 ILE 7 HD13 ILE 7 46.121 -2.637 7.451 902 H LEU 8 HN LEU 8 44.326 2.137 9.163 903 HA LEU 8 HA LEU 8 41.489 1.801 8.960 904 HB2 LEU 8 HB2 LEU 8 43.030 1.951 11.076 905 HB3 LEU 8 HB1 LEU 8 42.751 3.685 10.922 906 HG LEU 8 HG LEU 8 40.342 1.966 10.692 907 HD11 LEU 8 HD11 LEU 8 41.726 2.428 13.352 908 HD12 LEU 8 HD12 LEU 8 41.620 0.873 12.526 909 HD13 LEU 8 HD13 LEU 8 40.156 1.660 13.113 910 HD21 LEU 8 HD21 LEU 8 39.486 3.825 12.194 911 HD22 LEU 8 HD22 LEU 8 40.083 4.358 10.623 912 HD23 LEU 8 HD23 LEU 8 41.081 4.565 12.063 913 H SER 9 HN SER 9 43.696 4.469 8.444 914 HA SER 9 HA SER 9 41.736 6.541 8.248 915 HB2 SER 9 HB2 SER 9 44.121 7.018 8.654 916 HB3 SER 9 HB1 SER 9 44.505 6.411 7.047 917 HG SER 9 HG SER 9 44.214 8.744 7.237 918 H ILE 10 HN ILE 10 43.389 4.508 5.836 919 HA ILE 10 HA ILE 10 42.121 5.716 3.588 920 HB ILE 10 HB ILE 10 42.953 3.752 2.340 921 HG12 ILE 10 HG12 ILE 10 43.878 2.783 5.052 922 HG13 ILE 10 HG11 ILE 10 42.504 2.105 4.185 923 HG21 ILE 10 HG21 ILE 10 44.478 5.612 2.806 924 HG22 ILE 10 HG22 ILE 10 45.361 4.088 2.876 925 HG23 ILE 10 HG23 ILE 10 44.895 4.907 4.367 926 HD11 ILE 10 HD11 ILE 10 44.331 0.682 3.657 927 HD12 ILE 10 HD12 ILE 10 45.417 2.045 3.389 928 HD13 ILE 10 HD13 ILE 10 44.122 1.709 2.240 929 H CYS 11 HN CYS 11 41.261 3.119 5.791 930 HA CYS 11 HA CYS 11 39.214 1.936 4.239 931 HB2 CYS 11 HB2 CYS 11 40.149 0.885 6.263 932 HB3 CYS 11 HB1 CYS 11 39.441 2.164 7.249 933 HG CYS 11 HG CYS 11 37.714 0.222 7.237 934 H SER 12 HN SER 12 39.062 4.416 6.826 935 HA SER 12 HA SER 12 36.307 4.916 6.614 936 HB2 SER 12 HB2 SER 12 37.650 5.700 8.510 937 HB3 SER 12 HB1 SER 12 38.516 6.807 7.446 938 HG SER 12 HG SER 12 36.762 7.812 8.548 939 H PHE 13 HN PHE 13 39.062 6.216 4.855 940 HA PHE 13 HA PHE 13 37.786 8.360 3.547 941 HB2 PHE 13 HB2 PHE 13 40.153 8.224 3.414 942 HB3 PHE 13 HB1 PHE 13 40.095 6.587 2.759 943 HD1 PHE 13 HD1 PHE 13 38.949 10.078 1.996 944 HD2 PHE 13 HD2 PHE 13 40.157 6.258 0.447 945 HE1 PHE 13 HE1 PHE 13 38.884 10.990 -0.310 946 HE2 PHE 13 HE2 PHE 13 40.090 7.170 -1.858 947 HZ PHE 13 HZ PHE 13 39.453 9.536 -2.237 948 H ILE 14 HN ILE 14 38.267 4.989 2.445 949 HA ILE 14 HA ILE 14 36.800 5.296 0.039 950 HB ILE 14 HB ILE 14 37.457 2.824 1.660 951 HG12 ILE 14 HG12 ILE 14 39.317 4.305 0.631 952 HG13 ILE 14 HG11 ILE 14 39.342 2.587 0.241 953 HG21 ILE 14 HG21 ILE 14 35.641 2.189 0.282 954 HG22 ILE 14 HG22 ILE 14 37.061 1.727 -0.653 955 HG23 ILE 14 HG23 ILE 14 36.180 3.202 -1.057 956 HD11 ILE 14 HD11 ILE 14 39.634 4.280 -1.703 957 HD12 ILE 14 HD12 ILE 14 37.900 4.553 -1.545 958 HD13 ILE 14 HD13 ILE 14 38.507 2.945 -1.935 959 H LEU 15 HN LEU 15 35.923 4.260 3.305 960 HA LEU 15 HA LEU 15 33.312 3.355 2.737 961 HB2 LEU 15 HB2 LEU 15 34.563 4.568 5.201 962 HB3 LEU 15 HB1 LEU 15 32.876 4.053 5.175 963 HG LEU 15 HG LEU 15 35.140 2.232 4.345 964 HD11 LEU 15 HD11 LEU 15 35.102 1.287 6.572 965 HD12 LEU 15 HD12 LEU 15 33.782 2.355 7.050 966 HD13 LEU 15 HD13 LEU 15 35.382 3.022 6.723 967 HD21 LEU 15 HD21 LEU 15 32.215 1.883 5.054 968 HD22 LEU 15 HD22 LEU 15 33.338 0.525 5.000 969 HD23 LEU 15 HD23 LEU 15 33.020 1.462 3.542 970 H SER 16 HN SER 16 34.238 6.511 4.138 971 HA SER 16 HA SER 16 31.829 7.796 3.950 972 HB2 SER 16 HB2 SER 16 34.597 8.916 3.503 973 HB3 SER 16 HB1 SER 16 33.157 9.919 3.657 974 HG SER 16 HG SER 16 34.442 9.396 5.635 975 H ALA 17 HN ALA 17 34.190 7.248 1.374 976 HA ALA 17 HA ALA 17 33.051 8.902 -0.591 977 HB1 ALA 17 HB1 ALA 17 35.243 7.411 -0.523 978 HB2 ALA 17 HB2 ALA 17 34.488 7.847 -2.056 979 HB3 ALA 17 HB3 ALA 17 34.205 6.253 -1.354 980 H LEU 18 HN LEU 18 32.538 5.416 -0.033 981 HA LEU 18 HA LEU 18 30.441 5.196 -1.967 982 HB2 LEU 18 HB2 LEU 18 31.022 3.363 0.370 983 HB3 LEU 18 HB1 LEU 18 30.111 2.964 -1.086 984 HG LEU 18 HG LEU 18 33.039 3.735 -0.984 985 HD11 LEU 18 HD11 LEU 18 33.407 1.399 -1.687 986 HD12 LEU 18 HD12 LEU 18 31.673 1.095 -1.593 987 HD13 LEU 18 HD13 LEU 18 32.583 1.466 -0.129 988 HD21 LEU 18 HD21 LEU 18 31.162 3.056 -3.262 989 HD22 LEU 18 HD22 LEU 18 32.918 2.974 -3.420 990 HD23 LEU 18 HD23 LEU 18 32.135 4.513 -3.062 991 H HIS 19 HN HIS 19 30.571 6.273 1.280 992 HA HIS 19 HA HIS 19 27.901 5.700 2.032 993 HB2 HIS 19 HB2 HIS 19 29.478 6.131 3.768 994 HB3 HIS 19 HB1 HIS 19 29.942 7.672 3.050 995 HD2 HIS 19 HD2 HIS 19 28.115 9.795 3.474 996 HE1 HIS 19 HE1 HIS 19 25.577 7.665 6.089 997 HE2 HIS 19 HE2 HIS 19 26.112 9.959 5.143 998 H PHE 20 HN PHE 20 29.499 8.559 0.668 999 HA PHE 20 HA PHE 20 27.034 10.065 0.595 1000 HB2 PHE 20 HB2 PHE 20 29.835 10.604 0.253 1001 HB3 PHE 20 HB1 PHE 20 28.939 11.232 -1.131 1002 HD1 PHE 20 HD1 PHE 20 28.913 11.157 2.614 1003 HD2 PHE 20 HD2 PHE 20 27.713 13.220 -0.956 1004 HE1 PHE 20 HE1 PHE 20 28.085 13.050 3.986 1005 HE2 PHE 20 HE2 PHE 20 26.885 15.113 0.414 1006 HZ PHE 20 HZ PHE 20 27.063 15.024 2.885 1007 H MET 21 HN MET 21 28.715 7.855 -1.478 1008 HA MET 21 HA MET 21 27.560 8.722 -3.945 1009 HB2 MET 21 HB2 MET 21 28.887 6.177 -3.021 1010 HB3 MET 21 HB1 MET 21 28.218 6.342 -4.645 1011 HG2 MET 21 HG2 MET 21 30.174 8.326 -3.470 1012 HG3 MET 21 HG1 MET 21 30.683 6.939 -4.431 1013 HE1 MET 21 HE1 MET 21 31.582 9.584 -5.048 1014 HE2 MET 21 HE2 MET 21 31.144 10.081 -6.680 1015 HE3 MET 21 HE3 MET 21 31.834 8.483 -6.410 1016 H ALA 22 HN ALA 22 26.908 5.838 -1.970 1017 HA ALA 22 HA ALA 22 24.520 5.150 -3.340 1018 HB1 ALA 22 HB1 ALA 22 24.295 3.421 -1.810 1019 HB2 ALA 22 HB2 ALA 22 24.949 4.375 -0.479 1020 HB3 ALA 22 HB3 ALA 22 26.026 3.743 -1.724 1021 H TRP 23 HN TRP 23 25.095 6.968 -0.345 1022 HA TRP 23 HA TRP 23 22.392 7.277 0.380 1023 HB2 TRP 23 HB2 TRP 23 24.420 7.759 1.804 1024 HB3 TRP 23 HB1 TRP 23 24.576 9.286 0.935 1025 HD1 TRP 23 HD1 TRP 23 22.563 7.510 3.578 1026 HE1 TRP 23 HE1 TRP 23 20.859 9.144 4.610 1027 HE3 TRP 23 HE3 TRP 23 23.037 11.447 0.351 1028 HZ2 TRP 23 HZ2 TRP 23 19.831 11.765 4.135 1029 HZ3 TRP 23 HZ3 TRP 23 21.679 13.497 0.666 1030 HH2 TRP 23 HH2 TRP 23 20.078 13.660 2.553 1031 H THR 24 HN THR 24 24.471 9.133 -1.788 1032 HA THR 24 HA THR 24 22.686 11.312 -2.199 1033 HB THR 24 HB THR 24 25.004 10.199 -3.761 1034 HG1 THR 24 HG1 THR 24 24.473 12.558 -2.291 1035 HG21 THR 24 HG21 THR 24 24.742 12.352 -5.129 1036 HG22 THR 24 HG22 THR 24 23.085 12.403 -4.525 1037 HG23 THR 24 HG23 THR 24 23.628 11.036 -5.499 1038 H ILE 25 HN ILE 25 23.213 8.255 -3.935 1039 HA ILE 25 HA ILE 25 21.413 8.733 -6.050 1040 HB ILE 25 HB ILE 25 22.321 6.162 -4.745 1041 HG12 ILE 25 HG12 ILE 25 23.051 7.362 -7.428 1042 HG13 ILE 25 HG11 ILE 25 23.973 7.688 -5.960 1043 HG21 ILE 25 HG21 ILE 25 21.505 5.167 -6.958 1044 HG22 ILE 25 HG22 ILE 25 20.607 6.668 -7.189 1045 HG23 ILE 25 HG23 ILE 25 20.250 5.629 -5.810 1046 HD11 ILE 25 HD11 ILE 25 24.494 5.347 -5.683 1047 HD12 ILE 25 HD12 ILE 25 24.878 5.783 -7.348 1048 HD13 ILE 25 HD13 ILE 25 23.396 4.897 -6.987 1049 H GLY 26 HN GLY 26 20.940 7.252 -2.863 1050 HA2 GLY 26 HA2 GLY 26 18.225 6.520 -3.197 1051 HA3 GLY 26 HA1 GLY 26 19.028 6.789 -1.652 1052 H HIS 27 HN HIS 27 19.758 9.480 -1.999 1053 HA HIS 27 HA HIS 27 17.447 10.823 -1.139 1054 HB2 HIS 27 HB2 HIS 27 19.566 11.705 -0.503 1055 HB3 HIS 27 HB1 HIS 27 20.094 11.832 -2.181 1056 HD2 HIS 27 HD2 HIS 27 19.564 14.291 -3.315 1057 HE1 HIS 27 HE1 HIS 27 16.720 15.644 -0.502 1058 HE2 HIS 27 HE2 HIS 27 18.048 16.284 -2.570 1059 H LEU 28 HN LEU 28 19.034 10.719 -4.309 1060 HA LEU 28 HA LEU 28 17.227 12.574 -5.536 1061 HB2 LEU 28 HB2 LEU 28 19.149 10.547 -6.704 1062 HB3 LEU 28 HB1 LEU 28 18.263 11.742 -7.653 1063 HG LEU 28 HG LEU 28 20.046 12.491 -5.326 1064 HD11 LEU 28 HD11 LEU 28 21.798 12.966 -6.903 1065 HD12 LEU 28 HD12 LEU 28 20.740 12.621 -8.272 1066 HD13 LEU 28 HD13 LEU 28 21.268 11.313 -7.214 1067 HD21 LEU 28 HD21 LEU 28 19.995 14.699 -6.615 1068 HD22 LEU 28 HD22 LEU 28 18.477 14.225 -5.855 1069 HD23 LEU 28 HD23 LEU 28 18.703 13.994 -7.588 1070 H ASN 29 HN ASN 29 15.424 12.194 -6.758 1071 HA ASN 29 HA ASN 29 14.236 9.518 -6.500 1072 HB2 ASN 29 HB2 ASN 29 13.023 11.657 -5.782 1073 HB3 ASN 29 HB1 ASN 29 12.856 12.005 -7.502 1074 HD21 ASN 29 HD21 ASN 29 10.523 11.686 -7.478 1075 HD22 ASN 29 HD22 ASN 29 9.842 10.142 -7.285 1076 H GLN 30 HN GLN 30 13.592 8.309 -8.244 1077 HA GLN 30 HA GLN 30 14.570 9.233 -10.871 1078 HB2 GLN 30 HB2 GLN 30 14.324 6.533 -9.600 1079 HB3 GLN 30 HB1 GLN 30 14.252 6.665 -11.356 1080 HG2 GLN 30 HG2 GLN 30 16.527 6.483 -11.140 1081 HG3 GLN 30 HG1 GLN 30 16.396 8.225 -10.912 1082 HE21 GLN 30 HE21 GLN 30 18.505 6.542 -9.773 1083 HE22 GLN 30 HE22 GLN 30 18.359 6.647 -8.084 1084 H ILE 31 HN ILE 31 13.166 9.650 -12.439 1085 HA ILE 31 HA ILE 31 10.516 8.382 -12.391 1086 HB ILE 31 HB ILE 31 9.426 10.551 -12.852 1087 HG12 ILE 31 HG12 ILE 31 12.096 11.784 -12.110 1088 HG13 ILE 31 HG11 ILE 31 11.541 11.618 -13.775 1089 HG21 ILE 31 HG21 ILE 31 9.646 11.461 -10.559 1090 HG22 ILE 31 HG22 ILE 31 11.093 10.482 -10.318 1091 HG23 ILE 31 HG23 ILE 31 9.528 9.701 -10.545 1092 HD11 ILE 31 HD11 ILE 31 9.947 13.032 -11.622 1093 HD12 ILE 31 HD12 ILE 31 9.625 13.018 -13.356 1094 HD13 ILE 31 HD13 ILE 31 11.040 13.863 -12.728 1095 H LYS 32 HN LYS 32 9.459 8.353 -14.442 1096 HA LYS 32 HA LYS 32 11.316 8.796 -16.701 1097 HB2 LYS 32 HB2 LYS 32 9.032 6.825 -16.434 1098 HB3 LYS 32 HB1 LYS 32 9.998 7.060 -17.892 1099 HG2 LYS 32 HG2 LYS 32 12.041 6.618 -16.358 1100 HG3 LYS 32 HG1 LYS 32 10.865 5.955 -15.224 1101 HD2 LYS 32 HD2 LYS 32 11.111 5.066 -18.109 1102 HD3 LYS 32 HD1 LYS 32 11.873 4.232 -16.755 1103 HE2 LYS 32 HE2 LYS 32 9.620 3.960 -15.711 1104 HE3 LYS 32 HE1 LYS 32 8.902 4.683 -17.150 1105 HZ1 LYS 32 HZ1 LYS 32 10.286 2.101 -16.869 1106 HZ2 LYS 32 HZ2 LYS 32 10.238 2.877 -18.379 1107 HZ3 LYS 32 HZ3 LYS 32 8.793 2.439 -17.599 1108 H ARG 33 HN ARG 33 10.808 10.404 -18.017 1109 HA ARG 33 HA ARG 33 8.157 11.616 -17.886 1110 HB2 ARG 33 HB2 ARG 33 10.840 12.422 -18.864 1111 HB3 ARG 33 HB1 ARG 33 9.454 13.103 -19.717 1112 HG2 ARG 33 HG2 ARG 33 9.462 13.107 -16.716 1113 HG3 ARG 33 HG1 ARG 33 10.410 14.319 -17.579 1114 HD2 ARG 33 HD2 ARG 33 8.297 14.793 -18.940 1115 HD3 ARG 33 HD1 ARG 33 7.432 13.829 -17.747 1116 HE ARG 33 HE ARG 33 8.953 15.768 -16.384 1117 HH11 ARG 33 HH11 ARG 33 6.228 15.527 -18.546 1118 HH12 ARG 33 HH12 ARG 33 5.474 16.963 -17.941 1119 HH21 ARG 33 HH21 ARG 33 7.948 17.641 -15.618 1120 HH22 ARG 33 HH22 ARG 33 6.437 18.153 -16.296 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 53.590 27.625 10.358 2 H2 MET 1 HT2 MET 1 53.016 27.980 11.917 3 H3 MET 1 HT3 MET 1 52.344 28.756 10.564 4 HA MET 1 HA MET 1 52.111 26.019 10.124 5 HB2 MET 1 HB2 MET 1 51.521 26.930 12.926 6 HB3 MET 1 HB1 MET 1 50.517 25.684 12.183 7 HG2 MET 1 HG2 MET 1 52.527 24.337 11.712 8 HG3 MET 1 HG1 MET 1 53.536 25.580 12.451 9 HE1 MET 1 HE1 MET 1 50.662 22.628 14.390 10 HE2 MET 1 HE2 MET 1 50.988 22.926 12.685 11 HE3 MET 1 HE3 MET 1 49.953 24.033 13.583 12 H PHE 2 HN PHE 2 51.115 27.140 8.366 13 HA PHE 2 HA PHE 2 48.967 28.953 8.645 14 HB2 PHE 2 HB2 PHE 2 49.969 27.200 6.432 15 HB3 PHE 2 HB1 PHE 2 48.417 28.017 6.258 16 HD1 PHE 2 HD1 PHE 2 52.032 28.407 6.297 17 HD2 PHE 2 HD2 PHE 2 48.293 30.511 6.454 18 HE1 PHE 2 HE1 PHE 2 53.198 30.520 5.729 19 HE2 PHE 2 HE2 PHE 2 49.457 32.625 5.886 20 HZ PHE 2 HZ PHE 2 51.910 32.630 5.523 21 H GLU 3 HN GLU 3 49.063 25.424 8.285 22 HA GLU 3 HA GLU 3 46.222 25.148 8.199 23 HB2 GLU 3 HB2 GLU 3 46.644 22.755 8.397 24 HB3 GLU 3 HB1 GLU 3 47.773 23.469 7.244 25 HG2 GLU 3 HG2 GLU 3 49.483 23.618 9.039 26 HG3 GLU 3 HG1 GLU 3 48.360 22.839 10.152 27 HA PRO 4 HA PRO 4 45.390 25.229 12.550 28 HB2 PRO 4 HB2 PRO 4 43.121 23.730 12.678 29 HB3 PRO 4 HB1 PRO 4 43.161 25.360 11.978 30 HG2 PRO 4 HG2 PRO 4 43.096 22.720 10.628 31 HG3 PRO 4 HG1 PRO 4 42.347 24.253 10.155 32 HD2 PRO 4 HD2 PRO 4 44.694 23.239 9.055 33 HD3 PRO 4 HD1 PRO 4 44.214 24.950 9.012 34 H PHE 5 HN PHE 5 45.226 22.022 11.035 35 HA PHE 5 HA PHE 5 46.767 20.899 13.246 36 HB2 PHE 5 HB2 PHE 5 43.922 20.508 12.974 37 HB3 PHE 5 HB1 PHE 5 44.762 18.974 12.760 38 HD1 PHE 5 HD1 PHE 5 43.796 21.559 15.111 39 HD2 PHE 5 HD2 PHE 5 46.401 18.197 14.512 40 HE1 PHE 5 HE1 PHE 5 44.176 21.417 17.557 41 HE2 PHE 5 HE2 PHE 5 46.782 18.056 16.958 42 HZ PHE 5 HZ PHE 5 45.667 19.666 18.483 43 H GLN 6 HN GLN 6 44.779 19.394 10.699 44 HA GLN 6 HA GLN 6 47.178 18.702 9.179 45 HB2 GLN 6 HB2 GLN 6 45.384 16.726 10.575 46 HB3 GLN 6 HB1 GLN 6 46.256 16.280 9.108 47 HG2 GLN 6 HG2 GLN 6 47.570 17.447 11.578 48 HG3 GLN 6 HG1 GLN 6 47.498 15.725 11.216 49 HE21 GLN 6 HE21 GLN 6 48.607 14.995 9.188 50 HE22 GLN 6 HE22 GLN 6 49.906 15.906 8.582 51 H ILE 7 HN ILE 7 46.622 17.694 7.096 52 HA ILE 7 HA ILE 7 44.643 19.115 5.712 53 HB ILE 7 HB ILE 7 45.061 17.498 3.869 54 HG12 ILE 7 HG12 ILE 7 46.815 16.147 5.949 55 HG13 ILE 7 HG11 ILE 7 45.330 15.480 5.273 56 HG21 ILE 7 HG21 ILE 7 47.613 18.335 5.270 57 HG22 ILE 7 HG22 ILE 7 46.573 19.456 4.392 58 HG23 ILE 7 HG23 ILE 7 47.363 18.132 3.537 59 HD11 ILE 7 HD11 ILE 7 47.133 14.496 4.036 60 HD12 ILE 7 HD12 ILE 7 47.917 16.059 3.818 61 HD13 ILE 7 HD13 ILE 7 46.406 15.707 2.980 62 H LEU 8 HN LEU 8 44.562 16.024 7.326 63 HA LEU 8 HA LEU 8 42.050 15.146 6.251 64 HB2 LEU 8 HB2 LEU 8 43.662 14.301 8.665 65 HB3 LEU 8 HB1 LEU 8 42.151 13.523 8.196 66 HG LEU 8 HG LEU 8 44.392 13.860 6.208 67 HD11 LEU 8 HD11 LEU 8 44.015 11.646 8.243 68 HD12 LEU 8 HD12 LEU 8 45.423 12.691 8.058 69 HD13 LEU 8 HD13 LEU 8 45.041 11.500 6.816 70 HD21 LEU 8 HD21 LEU 8 42.275 11.709 6.472 71 HD22 LEU 8 HD22 LEU 8 43.275 12.068 5.064 72 HD23 LEU 8 HD23 LEU 8 42.012 13.194 5.558 73 H SER 9 HN SER 9 43.053 17.056 8.987 74 HA SER 9 HA SER 9 40.543 16.998 10.381 75 HB2 SER 9 HB2 SER 9 42.662 17.493 11.537 76 HB3 SER 9 HB1 SER 9 42.825 18.973 10.595 77 HG SER 9 HG SER 9 40.717 18.297 12.377 78 H ILE 10 HN ILE 10 42.095 19.256 8.122 79 HA ILE 10 HA ILE 10 40.010 21.210 8.278 80 HB ILE 10 HB ILE 10 41.112 22.221 6.324 81 HG12 ILE 10 HG12 ILE 10 42.799 19.708 6.375 82 HG13 ILE 10 HG11 ILE 10 41.636 20.123 5.121 83 HG21 ILE 10 HG21 ILE 10 43.231 22.674 7.378 84 HG22 ILE 10 HG22 ILE 10 43.184 21.143 8.252 85 HG23 ILE 10 HG23 ILE 10 42.053 22.430 8.666 86 HD11 ILE 10 HD11 ILE 10 42.974 22.278 4.796 87 HD12 ILE 10 HD12 ILE 10 43.746 20.789 4.251 88 HD13 ILE 10 HD13 ILE 10 44.227 21.523 5.781 89 H CYS 11 HN CYS 11 40.648 18.400 6.212 90 HA CYS 11 HA CYS 11 38.686 18.972 4.255 91 HB2 CYS 11 HB2 CYS 11 39.974 16.412 5.196 92 HB3 CYS 11 HB1 CYS 11 38.793 16.453 3.887 93 HG CYS 11 HG CYS 11 41.688 17.306 3.653 94 H SER 12 HN SER 12 38.576 16.826 7.129 95 HA SER 12 HA SER 12 35.860 16.150 6.844 96 HB2 SER 12 HB2 SER 12 35.988 15.372 9.130 97 HB3 SER 12 HB1 SER 12 37.495 14.967 8.313 98 HG SER 12 HG SER 12 37.091 16.501 10.476 99 H PHE 13 HN PHE 13 37.457 18.911 8.322 100 HA PHE 13 HA PHE 13 35.305 19.913 9.820 101 HB2 PHE 13 HB2 PHE 13 37.517 20.825 10.106 102 HB3 PHE 13 HB1 PHE 13 37.577 21.337 8.420 103 HD1 PHE 13 HD1 PHE 13 35.362 21.712 11.431 104 HD2 PHE 13 HD2 PHE 13 37.060 23.554 7.942 105 HE1 PHE 13 HE1 PHE 13 34.298 23.865 12.050 106 HE2 PHE 13 HE2 PHE 13 35.996 25.707 8.561 107 HZ PHE 13 HZ PHE 13 34.615 25.862 10.615 108 H ILE 14 HN ILE 14 36.300 20.672 6.471 109 HA ILE 14 HA ILE 14 34.117 22.423 5.966 110 HB ILE 14 HB ILE 14 35.895 20.866 4.077 111 HG12 ILE 14 HG12 ILE 14 36.828 22.674 5.683 112 HG13 ILE 14 HG11 ILE 14 37.219 22.824 3.971 113 HG21 ILE 14 HG21 ILE 14 33.974 21.397 2.798 114 HG22 ILE 14 HG22 ILE 14 35.087 22.722 2.464 115 HG23 ILE 14 HG23 ILE 14 33.757 22.952 3.600 116 HD11 ILE 14 HD11 ILE 14 34.782 24.193 5.110 117 HD12 ILE 14 HD12 ILE 14 35.695 24.588 3.654 118 HD13 ILE 14 HD13 ILE 14 36.376 24.934 5.241 119 H LEU 15 HN LEU 15 34.659 19.000 5.260 120 HA LEU 15 HA LEU 15 32.244 18.544 3.854 121 HB2 LEU 15 HB2 LEU 15 34.330 16.877 5.143 122 HB3 LEU 15 HB1 LEU 15 32.752 16.117 4.935 123 HG LEU 15 HG LEU 15 34.370 15.817 2.995 124 HD11 LEU 15 HD11 LEU 15 31.830 15.656 2.887 125 HD12 LEU 15 HD12 LEU 15 32.638 16.002 1.359 126 HD13 LEU 15 HD13 LEU 15 31.839 17.299 2.247 127 HD21 LEU 15 HD21 LEU 15 35.137 18.278 3.194 128 HD22 LEU 15 HD22 LEU 15 33.657 18.680 2.325 129 HD23 LEU 15 HD23 LEU 15 34.870 17.646 1.571 130 H SER 16 HN SER 16 32.983 18.806 7.224 131 HA SER 16 HA SER 16 30.585 17.534 8.179 132 HB2 SER 16 HB2 SER 16 32.587 17.620 9.576 133 HB3 SER 16 HB1 SER 16 32.525 19.381 9.573 134 HG SER 16 HG SER 16 30.475 19.220 10.576 135 H ALA 17 HN ALA 17 31.692 20.881 7.737 136 HA ALA 17 HA ALA 17 29.432 22.175 8.786 137 HB1 ALA 17 HB1 ALA 17 30.141 24.063 7.239 138 HB2 ALA 17 HB2 ALA 17 31.414 22.990 6.657 139 HB3 ALA 17 HB3 ALA 17 31.379 23.481 8.351 140 H LEU 18 HN LEU 18 30.159 21.164 5.439 141 HA LEU 18 HA LEU 18 27.633 22.080 4.439 142 HB2 LEU 18 HB2 LEU 18 29.517 20.083 3.186 143 HB3 LEU 18 HB1 LEU 18 28.300 21.064 2.368 144 HG LEU 18 HG LEU 18 30.733 22.125 3.830 145 HD11 LEU 18 HD11 LEU 18 31.166 21.001 1.631 146 HD12 LEU 18 HD12 LEU 18 31.555 22.722 1.632 147 HD13 LEU 18 HD13 LEU 18 30.065 22.155 0.878 148 HD21 LEU 18 HD21 LEU 18 28.496 23.507 2.322 149 HD22 LEU 18 HD22 LEU 18 30.002 24.298 2.784 150 HD23 LEU 18 HD23 LEU 18 28.904 23.700 4.026 151 H HIS 19 HN HIS 19 28.796 19.212 5.970 152 HA HIS 19 HA HIS 19 26.857 17.383 4.986 153 HB2 HIS 19 HB2 HIS 19 28.685 16.344 5.985 154 HB3 HIS 19 HB1 HIS 19 28.683 17.446 7.359 155 HD2 HIS 19 HD2 HIS 19 27.236 16.558 9.534 156 HE1 HIS 19 HE1 HIS 19 25.274 13.334 7.641 157 HE2 HIS 19 HE2 HIS 19 25.669 14.495 9.865 158 H PHE 20 HN PHE 20 27.027 19.303 7.979 159 HA PHE 20 HA PHE 20 24.409 18.475 8.831 160 HB2 PHE 20 HB2 PHE 20 26.633 19.862 9.964 161 HB3 PHE 20 HB1 PHE 20 25.198 20.871 10.145 162 HD1 PHE 20 HD1 PHE 20 27.020 18.182 11.545 163 HD2 PHE 20 HD2 PHE 20 23.010 19.577 10.893 164 HE1 PHE 20 HE1 PHE 20 26.213 16.727 13.386 165 HE2 PHE 20 HE2 PHE 20 22.204 18.122 12.732 166 HZ PHE 20 HZ PHE 20 23.799 16.703 13.979 167 H MET 21 HN MET 21 25.692 20.997 6.818 168 HA MET 21 HA MET 21 23.515 22.825 7.091 169 HB2 MET 21 HB2 MET 21 25.743 22.441 5.126 170 HB3 MET 21 HB1 MET 21 24.456 23.597 4.794 171 HG2 MET 21 HG2 MET 21 25.906 23.590 7.439 172 HG3 MET 21 HG1 MET 21 26.540 24.474 6.051 173 HE1 MET 21 HE1 MET 21 26.485 26.438 7.727 174 HE2 MET 21 HE2 MET 21 25.542 25.659 8.995 175 HE3 MET 21 HE3 MET 21 25.028 27.219 8.358 176 H ALA 22 HN ALA 22 24.408 20.673 4.393 177 HA ALA 22 HA ALA 22 21.947 20.995 3.021 178 HB1 ALA 22 HB1 ALA 22 22.747 18.763 1.914 179 HB2 ALA 22 HB2 ALA 22 24.229 19.066 2.820 180 HB3 ALA 22 HB3 ALA 22 23.659 20.249 1.642 181 H TRP 23 HN TRP 23 23.106 18.529 5.292 182 HA TRP 23 HA TRP 23 20.919 16.770 5.027 183 HB2 TRP 23 HB2 TRP 23 23.130 16.272 6.136 184 HB3 TRP 23 HB1 TRP 23 22.565 17.201 7.525 185 HD1 TRP 23 HD1 TRP 23 22.036 13.946 5.656 186 HE1 TRP 23 HE1 TRP 23 20.530 12.396 7.061 187 HE3 TRP 23 HE3 TRP 23 20.631 17.184 9.353 188 HZ2 TRP 23 HZ2 TRP 23 18.943 12.510 9.434 189 HZ3 TRP 23 HZ3 TRP 23 19.121 16.434 11.171 190 HH2 TRP 23 HH2 TRP 23 18.276 14.103 11.215 191 H THR 24 HN THR 24 21.473 19.555 7.149 192 HA THR 24 HA THR 24 19.118 19.246 8.712 193 HB THR 24 HB THR 24 20.888 21.615 8.124 194 HG1 THR 24 HG1 THR 24 20.424 20.119 10.483 195 HG21 THR 24 HG21 THR 24 18.396 21.415 9.819 196 HG22 THR 24 HG22 THR 24 18.774 22.605 8.572 197 HG23 THR 24 HG23 THR 24 19.636 22.636 10.110 198 H ILE 25 HN ILE 25 19.837 21.097 5.769 199 HA ILE 25 HA ILE 25 17.361 22.425 5.566 200 HB ILE 25 HB ILE 25 19.342 21.568 3.449 201 HG12 ILE 25 HG12 ILE 25 18.754 24.324 4.553 202 HG13 ILE 25 HG11 ILE 25 19.971 23.266 5.265 203 HG21 ILE 25 HG21 ILE 25 18.133 23.373 2.095 204 HG22 ILE 25 HG22 ILE 25 16.831 23.248 3.278 205 HG23 ILE 25 HG23 ILE 25 17.269 21.850 2.297 206 HD11 ILE 25 HD11 ILE 25 21.200 23.175 3.175 207 HD12 ILE 25 HD12 ILE 25 20.909 24.869 3.572 208 HD13 ILE 25 HD13 ILE 25 19.928 24.071 2.343 209 H GLY 26 HN GLY 26 18.457 19.307 4.274 210 HA2 GLY 26 HA2 GLY 26 16.116 18.668 2.822 211 HA3 GLY 26 HA1 GLY 26 17.294 17.505 3.425 212 H HIS 27 HN HIS 27 17.085 18.014 6.167 213 HA HIS 27 HA HIS 27 14.900 16.395 6.897 214 HB2 HIS 27 HB2 HIS 27 16.774 16.452 8.364 215 HB3 HIS 27 HB1 HIS 27 16.700 18.210 8.502 216 HD2 HIS 27 HD2 HIS 27 14.991 19.146 10.492 217 HE1 HIS 27 HE1 HIS 27 13.253 15.438 11.515 218 HE2 HIS 27 HE2 HIS 27 13.403 17.893 12.144 219 H LEU 28 HN LEU 28 15.354 19.911 6.989 220 HA LEU 28 HA LEU 28 12.798 20.402 8.199 221 HB2 LEU 28 HB2 LEU 28 15.063 21.872 7.963 222 HB3 LEU 28 HB1 LEU 28 14.098 22.572 6.663 223 HG LEU 28 HG LEU 28 13.600 23.837 8.635 224 HD11 LEU 28 HD11 LEU 28 11.330 21.848 8.503 225 HD12 LEU 28 HD12 LEU 28 11.659 22.967 7.179 226 HD13 LEU 28 HD13 LEU 28 11.251 23.587 8.778 227 HD21 LEU 28 HD21 LEU 28 14.485 22.003 10.181 228 HD22 LEU 28 HD22 LEU 28 12.884 21.271 10.075 229 HD23 LEU 28 HD23 LEU 28 13.072 22.882 10.762 230 H ASN 29 HN ASN 29 10.914 20.224 7.200 231 HA ASN 29 HA ASN 29 10.793 20.778 4.294 232 HB2 ASN 29 HB2 ASN 29 9.165 18.799 5.904 233 HB3 ASN 29 HB1 ASN 29 8.937 19.151 4.192 234 HD21 ASN 29 HD21 ASN 29 9.912 16.616 5.659 235 HD22 ASN 29 HD22 ASN 29 11.365 16.229 4.871 236 H GLN 30 HN GLN 30 9.543 22.438 3.743 237 HA GLN 30 HA GLN 30 7.410 23.276 5.617 238 HB2 GLN 30 HB2 GLN 30 9.237 25.006 3.933 239 HB3 GLN 30 HB1 GLN 30 7.843 25.604 4.834 240 HG2 GLN 30 HG2 GLN 30 8.828 24.784 6.932 241 HG3 GLN 30 HG1 GLN 30 10.212 24.148 6.043 242 HE21 GLN 30 HE21 GLN 30 11.879 25.538 6.764 243 HE22 GLN 30 HE22 GLN 30 11.835 27.226 6.593 244 H ILE 31 HN ILE 31 5.427 23.423 4.777 245 HA ILE 31 HA ILE 31 5.140 23.627 1.848 246 HB ILE 31 HB ILE 31 3.307 21.973 1.942 247 HG12 ILE 31 HG12 ILE 31 4.246 21.420 4.770 248 HG13 ILE 31 HG11 ILE 31 2.826 22.400 4.405 249 HG21 ILE 31 HG21 ILE 31 5.626 21.268 1.407 250 HG22 ILE 31 HG22 ILE 31 4.725 19.994 2.227 251 HG23 ILE 31 HG23 ILE 31 5.909 20.950 3.118 252 HD11 ILE 31 HD11 ILE 31 2.053 20.153 4.794 253 HD12 ILE 31 HD12 ILE 31 3.269 19.489 3.701 254 HD13 ILE 31 HD13 ILE 31 1.938 20.452 3.059 255 H LYS 32 HN LYS 32 3.167 24.570 1.134 256 HA LYS 32 HA LYS 32 1.922 26.297 3.173 257 HB2 LYS 32 HB2 LYS 32 2.643 26.630 0.351 258 HB3 LYS 32 HB1 LYS 32 1.013 27.188 0.732 259 HG2 LYS 32 HG2 LYS 32 3.270 27.931 2.563 260 HG3 LYS 32 HG1 LYS 32 3.064 28.815 1.050 261 HD2 LYS 32 HD2 LYS 32 0.897 29.561 1.647 262 HD3 LYS 32 HD1 LYS 32 0.752 28.367 2.937 263 HE2 LYS 32 HE2 LYS 32 1.206 30.572 3.901 264 HE3 LYS 32 HE1 LYS 32 2.588 29.509 4.167 265 HZ1 LYS 32 HZ1 LYS 32 3.706 30.494 2.301 266 HZ2 LYS 32 HZ2 LYS 32 3.224 31.727 3.365 267 HZ3 LYS 32 HZ3 LYS 32 2.354 31.450 1.932 268 H ARG 33 HN ARG 33 -0.129 25.987 3.772 269 HA ARG 33 HA ARG 33 -1.690 23.933 2.367 270 HB2 ARG 33 HB2 ARG 33 -2.348 25.277 4.992 271 HB3 ARG 33 HB1 ARG 33 -2.994 23.761 4.360 272 HG2 ARG 33 HG2 ARG 33 -0.612 22.870 4.388 273 HG3 ARG 33 HG1 ARG 33 -0.173 24.314 5.302 274 HD2 ARG 33 HD2 ARG 33 -0.624 22.625 6.931 275 HD3 ARG 33 HD1 ARG 33 -2.023 23.693 6.936 276 HE ARG 33 HE ARG 33 -2.378 21.506 5.122 277 HH11 ARG 33 HH11 ARG 33 -2.459 22.418 8.483 278 HH12 ARG 33 HH12 ARG 33 -3.584 21.180 8.918 279 HH21 ARG 33 HH21 ARG 33 -3.846 19.892 5.717 280 HH22 ARG 33 HH22 ARG 33 -4.367 19.757 7.363 281 H1 MET 1 HT1 MET 1 45.971 18.362 33.923 282 H2 MET 1 HT2 MET 1 45.876 16.691 34.211 283 H3 MET 1 HT3 MET 1 44.599 17.710 34.677 284 HA MET 1 HA MET 1 45.018 18.133 31.959 285 HB2 MET 1 HB2 MET 1 45.167 15.269 32.855 286 HB3 MET 1 HB1 MET 1 44.370 15.669 31.333 287 HG2 MET 1 HG2 MET 1 46.404 16.838 30.570 288 HG3 MET 1 HG1 MET 1 47.203 16.446 32.093 289 HE1 MET 1 HE1 MET 1 46.109 13.740 28.596 290 HE2 MET 1 HE2 MET 1 45.745 15.444 28.856 291 HE3 MET 1 HE3 MET 1 44.803 14.213 29.691 292 H PHE 2 HN PHE 2 43.216 19.410 32.637 293 HA PHE 2 HA PHE 2 40.865 18.357 33.798 294 HB2 PHE 2 HB2 PHE 2 41.522 20.835 32.245 295 HB3 PHE 2 HB1 PHE 2 39.836 20.442 32.587 296 HD1 PHE 2 HD1 PHE 2 42.986 21.625 33.967 297 HD2 PHE 2 HD2 PHE 2 39.080 20.136 34.954 298 HE1 PHE 2 HE1 PHE 2 43.243 22.488 36.277 299 HE2 PHE 2 HE2 PHE 2 39.336 20.998 37.265 300 HZ PHE 2 HZ PHE 2 41.417 22.174 37.927 301 H GLU 3 HN GLU 3 41.832 18.843 30.417 302 HA GLU 3 HA GLU 3 39.329 17.966 29.359 303 HB2 GLU 3 HB2 GLU 3 40.457 17.999 27.196 304 HB3 GLU 3 HB1 GLU 3 40.879 19.445 28.116 305 HG2 GLU 3 HG2 GLU 3 42.975 18.338 28.857 306 HG3 GLU 3 HG1 GLU 3 42.562 16.933 27.875 307 HA PRO 4 HA PRO 4 40.019 13.593 29.499 308 HB2 PRO 4 HB2 PRO 4 38.447 12.746 27.443 309 HB3 PRO 4 HB1 PRO 4 37.786 13.369 28.968 310 HG2 PRO 4 HG2 PRO 4 38.025 14.696 26.325 311 HG3 PRO 4 HG1 PRO 4 36.760 14.839 27.555 312 HD2 PRO 4 HD2 PRO 4 38.792 16.700 27.155 313 HD3 PRO 4 HD1 PRO 4 37.858 16.529 28.657 314 H PHE 5 HN PHE 5 40.275 15.065 26.278 315 HA PHE 5 HA PHE 5 42.718 13.547 25.778 316 HB2 PHE 5 HB2 PHE 5 40.182 12.847 24.595 317 HB3 PHE 5 HB1 PHE 5 41.302 13.384 23.344 318 HD1 PHE 5 HD1 PHE 5 40.487 10.761 25.711 319 HD2 PHE 5 HD2 PHE 5 43.580 12.322 23.172 320 HE1 PHE 5 HE1 PHE 5 41.691 8.597 25.846 321 HE2 PHE 5 HE2 PHE 5 44.784 10.159 23.308 322 HZ PHE 5 HZ PHE 5 43.839 8.296 24.645 323 H GLN 6 HN GLN 6 40.510 15.305 23.611 324 HA GLN 6 HA GLN 6 42.349 17.578 23.512 325 HB2 GLN 6 HB2 GLN 6 41.766 15.721 21.215 326 HB3 GLN 6 HB1 GLN 6 42.185 17.409 20.931 327 HG2 GLN 6 HG2 GLN 6 43.862 15.502 22.583 328 HG3 GLN 6 HG1 GLN 6 44.165 15.870 20.887 329 HE21 GLN 6 HE21 GLN 6 44.690 18.176 20.358 330 HE22 GLN 6 HE22 GLN 6 45.393 19.160 21.549 331 H ILE 7 HN ILE 7 41.435 19.383 22.244 332 HA ILE 7 HA ILE 7 38.792 19.963 22.970 333 HB ILE 7 HB ILE 7 39.011 21.888 21.412 334 HG12 ILE 7 HG12 ILE 7 41.667 20.573 20.742 335 HG13 ILE 7 HG11 ILE 7 40.295 20.727 19.646 336 HG21 ILE 7 HG21 ILE 7 41.537 21.409 23.015 337 HG22 ILE 7 HG22 ILE 7 39.991 21.848 23.742 338 HG23 ILE 7 HG23 ILE 7 40.791 22.961 22.633 339 HD11 ILE 7 HD11 ILE 7 41.782 22.534 19.122 340 HD12 ILE 7 HD12 ILE 7 41.966 22.955 20.824 341 HD13 ILE 7 HD13 ILE 7 40.430 23.238 20.008 342 H LEU 8 HN LEU 8 40.139 18.518 20.094 343 HA LEU 8 HA LEU 8 37.771 18.701 18.482 344 HB2 LEU 8 HB2 LEU 8 40.270 17.009 18.284 345 HB3 LEU 8 HB1 LEU 8 38.975 16.960 17.086 346 HG LEU 8 HG LEU 8 40.226 19.582 17.897 347 HD11 LEU 8 HD11 LEU 8 41.200 17.612 15.810 348 HD12 LEU 8 HD12 LEU 8 42.106 18.234 17.188 349 HD13 LEU 8 HD13 LEU 8 41.682 19.307 15.855 350 HD21 LEU 8 HD21 LEU 8 39.023 18.682 15.266 351 HD22 LEU 8 HD22 LEU 8 39.348 20.333 15.792 352 HD23 LEU 8 HD23 LEU 8 38.061 19.403 16.554 353 H SER 9 HN SER 9 39.045 16.413 20.778 354 HA SER 9 HA SER 9 37.275 14.247 20.117 355 HB2 SER 9 HB2 SER 9 39.427 13.866 21.260 356 HB3 SER 9 HB1 SER 9 38.836 14.759 22.660 357 HG SER 9 HG SER 9 37.735 12.388 21.545 358 H ILE 10 HN ILE 10 37.268 16.831 22.555 359 HA ILE 10 HA ILE 10 34.895 15.907 23.863 360 HB ILE 10 HB ILE 10 34.942 18.084 25.005 361 HG12 ILE 10 HG12 ILE 10 37.189 18.693 23.070 362 HG13 ILE 10 HG11 ILE 10 35.606 19.461 23.060 363 HG21 ILE 10 HG21 ILE 10 37.071 17.802 26.099 364 HG22 ILE 10 HG22 ILE 10 37.754 17.010 24.680 365 HG23 ILE 10 HG23 ILE 10 36.511 16.197 25.628 366 HD11 ILE 10 HD11 ILE 10 36.086 20.153 25.475 367 HD12 ILE 10 HD12 ILE 10 37.022 20.974 24.225 368 HD13 ILE 10 HD13 ILE 10 37.757 19.676 25.166 369 H CYS 11 HN CYS 11 35.574 18.155 21.204 370 HA CYS 11 HA CYS 11 32.994 19.311 21.077 371 HB2 CYS 11 HB2 CYS 11 35.193 18.944 19.046 372 HB3 CYS 11 HB1 CYS 11 33.683 19.773 18.669 373 HG CYS 11 HG CYS 11 35.965 20.951 20.271 374 H SER 12 HN SER 12 34.468 16.638 19.184 375 HA SER 12 HA SER 12 32.124 16.004 17.765 376 HB2 SER 12 HB2 SER 12 33.227 13.926 17.208 377 HB3 SER 12 HB1 SER 12 34.421 15.220 17.184 378 HG SER 12 HG SER 12 34.346 12.999 18.688 379 H PHE 13 HN PHE 13 33.267 15.076 20.953 380 HA PHE 13 HA PHE 13 31.555 12.898 21.418 381 HB2 PHE 13 HB2 PHE 13 33.379 13.352 22.926 382 HB3 PHE 13 HB1 PHE 13 32.721 14.939 23.320 383 HD1 PHE 13 HD1 PHE 13 31.635 11.344 23.267 384 HD2 PHE 13 HD2 PHE 13 31.467 15.141 25.269 385 HE1 PHE 13 HE1 PHE 13 30.274 10.330 25.076 386 HE2 PHE 13 HE2 PHE 13 30.106 14.127 27.077 387 HZ PHE 13 HZ PHE 13 29.510 11.723 26.981 388 H ILE 14 HN ILE 14 31.108 16.362 22.190 389 HA ILE 14 HA ILE 14 28.482 16.032 23.231 390 HB ILE 14 HB ILE 14 29.888 18.464 22.105 391 HG12 ILE 14 HG12 ILE 14 30.751 17.215 24.206 392 HG13 ILE 14 HG11 ILE 14 30.485 18.951 24.343 393 HG21 ILE 14 HG21 ILE 14 27.583 18.995 21.994 394 HG22 ILE 14 HG22 ILE 14 28.094 19.644 23.550 395 HG23 ILE 14 HG23 ILE 14 27.215 18.116 23.477 396 HD11 ILE 14 HD11 ILE 14 28.290 17.006 25.054 397 HD12 ILE 14 HD12 ILE 14 28.507 18.673 25.587 398 HD13 ILE 14 HD13 ILE 14 29.555 17.403 26.216 399 H LEU 15 HN LEU 15 29.704 16.996 20.051 400 HA LEU 15 HA LEU 15 27.194 17.506 18.851 401 HB2 LEU 15 HB2 LEU 15 29.974 17.059 17.922 402 HB3 LEU 15 HB1 LEU 15 28.704 16.741 16.741 403 HG LEU 15 HG LEU 15 29.592 19.124 16.772 404 HD11 LEU 15 HD11 LEU 15 27.319 18.366 15.905 405 HD12 LEU 15 HD12 LEU 15 27.435 20.067 16.355 406 HD13 LEU 15 HD13 LEU 15 26.646 18.921 17.437 407 HD21 LEU 15 HD21 LEU 15 29.648 19.119 19.357 408 HD22 LEU 15 HD22 LEU 15 27.913 19.420 19.271 409 HD23 LEU 15 HD23 LEU 15 29.043 20.575 18.567 410 H SER 16 HN SER 16 28.915 14.581 19.536 411 HA SER 16 HA SER 16 27.444 12.906 17.717 412 HB2 SER 16 HB2 SER 16 29.686 12.272 18.454 413 HB3 SER 16 HB1 SER 16 29.129 12.198 20.123 414 HG SER 16 HG SER 16 27.665 10.564 19.459 415 H ALA 17 HN ALA 17 27.334 13.597 21.199 416 HA ALA 17 HA ALA 17 25.288 11.798 21.882 417 HB1 ALA 17 HB1 ALA 17 24.871 13.430 23.784 418 HB2 ALA 17 HB2 ALA 17 26.124 14.445 23.070 419 HB3 ALA 17 HB3 ALA 17 26.522 12.825 23.643 420 H LEU 18 HN LEU 18 25.105 15.227 20.885 421 HA LEU 18 HA LEU 18 22.242 15.272 20.998 422 HB2 LEU 18 HB2 LEU 18 24.082 17.155 19.520 423 HB3 LEU 18 HB1 LEU 18 22.436 17.477 20.068 424 HG LEU 18 HG LEU 18 24.811 16.899 21.857 425 HD11 LEU 18 HD11 LEU 18 24.782 19.150 20.753 426 HD12 LEU 18 HD12 LEU 18 24.644 19.224 22.509 427 HD13 LEU 18 HD13 LEU 18 23.213 19.444 21.503 428 HD21 LEU 18 HD21 LEU 18 21.904 17.510 22.460 429 HD22 LEU 18 HD22 LEU 18 23.188 17.563 23.667 430 HD23 LEU 18 HD23 LEU 18 22.788 16.041 22.875 431 H HIS 19 HN HIS 19 24.617 14.325 18.675 432 HA HIS 19 HA HIS 19 23.062 14.644 16.321 433 HB2 HIS 19 HB2 HIS 19 25.334 14.365 15.900 434 HB3 HIS 19 HB1 HIS 19 25.482 13.035 17.047 435 HD2 HIS 19 HD2 HIS 19 25.166 10.528 15.939 436 HE1 HIS 19 HE1 HIS 19 23.682 11.746 12.178 437 HE2 HIS 19 HE2 HIS 19 24.454 9.752 13.549 438 H PHE 20 HN PHE 20 23.675 11.827 18.408 439 HA PHE 20 HA PHE 20 21.844 10.163 16.947 440 HB2 PHE 20 HB2 PHE 20 23.826 9.816 18.973 441 HB3 PHE 20 HB1 PHE 20 22.311 9.122 19.553 442 HD1 PHE 20 HD1 PHE 20 25.182 8.521 17.582 443 HD2 PHE 20 HD2 PHE 20 20.968 7.715 17.752 444 HE1 PHE 20 HE1 PHE 20 25.496 6.570 16.083 445 HE2 PHE 20 HE2 PHE 20 21.280 5.764 16.253 446 HZ PHE 20 HZ PHE 20 23.543 5.201 15.419 447 H MET 21 HN MET 21 21.601 12.416 19.576 448 HA MET 21 HA MET 21 19.221 11.355 20.744 449 HB2 MET 21 HB2 MET 21 20.673 13.972 20.863 450 HB3 MET 21 HB1 MET 21 19.078 13.809 21.591 451 HG2 MET 21 HG2 MET 21 21.269 11.818 22.166 452 HG3 MET 21 HG1 MET 21 21.121 13.310 23.096 453 HE1 MET 21 HE1 MET 21 21.076 11.652 25.076 454 HE2 MET 21 HE2 MET 21 20.876 10.164 24.154 455 HE3 MET 21 HE3 MET 21 19.757 10.538 25.463 456 H ALA 22 HN ALA 22 19.729 14.272 18.748 457 HA ALA 22 HA ALA 22 16.973 14.711 18.278 458 HB1 ALA 22 HB1 ALA 22 17.959 16.089 16.285 459 HB2 ALA 22 HB2 ALA 22 19.507 15.732 17.050 460 HB3 ALA 22 HB3 ALA 22 18.264 16.610 17.942 461 H TRP 23 HN TRP 23 19.474 13.046 16.393 462 HA TRP 23 HA TRP 23 17.918 12.605 14.080 463 HB2 TRP 23 HB2 TRP 23 20.418 12.331 14.294 464 HB3 TRP 23 HB1 TRP 23 20.112 10.804 15.121 465 HD1 TRP 23 HD1 TRP 23 19.933 12.486 11.730 466 HE1 TRP 23 HE1 TRP 23 19.494 10.704 9.920 467 HE3 TRP 23 HE3 TRP 23 18.992 8.429 14.691 468 HZ2 TRP 23 HZ2 TRP 23 18.831 7.930 9.750 469 HZ3 TRP 23 HZ3 TRP 23 18.459 6.231 13.676 470 HH2 TRP 23 HH2 TRP 23 18.377 5.977 11.211 471 H THR 24 HN THR 24 18.334 10.712 17.050 472 HA THR 24 HA THR 24 16.832 8.452 16.204 473 HB THR 24 HB THR 24 17.552 9.529 18.925 474 HG1 THR 24 HG1 THR 24 18.351 7.207 17.516 475 HG21 THR 24 HG21 THR 24 15.939 7.094 18.156 476 HG22 THR 24 HG22 THR 24 15.521 8.357 19.314 477 HG23 THR 24 HG23 THR 24 16.802 7.205 19.690 478 H ILE 25 HN ILE 25 15.962 11.408 17.976 479 HA ILE 25 HA ILE 25 13.296 10.706 18.550 480 HB ILE 25 HB ILE 25 14.609 13.398 18.135 481 HG12 ILE 25 HG12 ILE 25 13.668 12.071 20.688 482 HG13 ILE 25 HG11 ILE 25 15.301 11.851 20.059 483 HG21 ILE 25 HG21 ILE 25 12.556 14.200 19.437 484 HG22 ILE 25 HG22 ILE 25 11.818 12.650 19.035 485 HG23 ILE 25 HG23 ILE 25 12.280 13.766 17.751 486 HD11 ILE 25 HD11 ILE 25 15.727 14.236 20.173 487 HD12 ILE 25 HD12 ILE 25 15.120 13.707 21.742 488 HD13 ILE 25 HD13 ILE 25 14.052 14.555 20.623 489 H GLY 26 HN GLY 26 14.731 12.402 15.777 490 HA2 GLY 26 HA2 GLY 26 12.324 12.983 14.418 491 HA3 GLY 26 HA1 GLY 26 13.914 12.856 13.672 492 H HIS 27 HN HIS 27 14.502 10.191 14.287 493 HA HIS 27 HA HIS 27 13.244 8.813 12.177 494 HB2 HIS 27 HB2 HIS 27 15.404 8.073 12.853 495 HB3 HIS 27 HB1 HIS 27 14.884 7.860 14.525 496 HD2 HIS 27 HD2 HIS 27 13.750 5.377 15.083 497 HE1 HIS 27 HE1 HIS 27 13.586 3.946 11.114 498 HE2 HIS 27 HE2 HIS 27 13.235 3.326 13.552 499 H LEU 28 HN LEU 28 12.682 8.770 15.679 500 HA LEU 28 HA LEU 28 10.653 6.746 15.521 501 HB2 LEU 28 HB2 LEU 28 12.192 7.692 17.542 502 HB3 LEU 28 HB1 LEU 28 10.690 8.560 17.857 503 HG LEU 28 HG LEU 28 10.544 6.498 19.066 504 HD11 LEU 28 HD11 LEU 28 9.025 5.914 16.520 505 HD12 LEU 28 HD12 LEU 28 8.561 7.233 17.593 506 HD13 LEU 28 HD13 LEU 28 8.553 5.573 18.183 507 HD21 LEU 28 HD21 LEU 28 12.378 5.405 17.657 508 HD22 LEU 28 HD22 LEU 28 11.113 4.984 16.503 509 HD23 LEU 28 HD23 LEU 28 11.054 4.350 18.147 510 H ASN 29 HN ASN 29 8.678 7.049 14.757 511 HA ASN 29 HA ASN 29 7.437 9.720 15.060 512 HB2 ASN 29 HB2 ASN 29 7.077 7.716 12.819 513 HB3 ASN 29 HB1 ASN 29 6.198 9.235 12.977 514 HD21 ASN 29 HD21 ASN 29 8.287 8.272 10.919 515 HD22 ASN 29 HD22 ASN 29 9.437 9.520 10.898 516 H GLN 30 HN GLN 30 5.659 9.758 16.265 517 HA GLN 30 HA GLN 30 4.133 7.244 16.602 518 HB2 GLN 30 HB2 GLN 30 4.716 9.393 18.653 519 HB3 GLN 30 HB1 GLN 30 3.597 8.051 18.900 520 HG2 GLN 30 HG2 GLN 30 5.419 6.444 18.530 521 HG3 GLN 30 HG1 GLN 30 6.544 7.771 18.246 522 HE21 GLN 30 HE21 GLN 30 7.889 7.613 20.090 523 HE22 GLN 30 HE22 GLN 30 7.312 7.705 21.683 524 H ILE 31 HN ILE 31 2.026 7.353 16.136 525 HA ILE 31 HA ILE 31 0.729 10.001 16.053 526 HB ILE 31 HB ILE 31 -0.415 9.343 13.964 527 HG12 ILE 31 HG12 ILE 31 1.535 7.024 13.887 528 HG13 ILE 31 HG11 ILE 31 -0.141 6.851 14.407 529 HG21 ILE 31 HG21 ILE 31 1.690 10.660 13.900 530 HG22 ILE 31 HG22 ILE 31 1.518 9.624 12.482 531 HG23 ILE 31 HG23 ILE 31 2.608 9.157 13.789 532 HD11 ILE 31 HD11 ILE 31 -0.067 6.296 12.065 533 HD12 ILE 31 HD12 ILE 31 0.848 7.758 11.694 534 HD13 ILE 31 HD13 ILE 31 -0.836 7.877 12.203 535 H LYS 32 HN LYS 32 -1.549 9.970 16.362 536 HA LYS 32 HA LYS 32 -2.476 7.575 17.807 537 HB2 LYS 32 HB2 LYS 32 -2.868 10.461 18.136 538 HB3 LYS 32 HB1 LYS 32 -4.363 9.532 18.242 539 HG2 LYS 32 HG2 LYS 32 -1.934 8.555 19.707 540 HG3 LYS 32 HG1 LYS 32 -2.878 9.878 20.394 541 HD2 LYS 32 HD2 LYS 32 -4.836 8.554 20.547 542 HD3 LYS 32 HD1 LYS 32 -4.194 7.331 19.450 543 HE2 LYS 32 HE2 LYS 32 -4.090 6.510 21.754 544 HE3 LYS 32 HE1 LYS 32 -2.457 6.764 21.136 545 HZ1 LYS 32 HZ1 LYS 32 -2.356 8.864 22.263 546 HZ2 LYS 32 HZ2 LYS 32 -2.784 7.661 23.384 547 HZ3 LYS 32 HZ3 LYS 32 -3.965 8.722 22.781 548 H ARG 33 HN ARG 33 -4.030 6.325 16.982 549 HA ARG 33 HA ARG 33 -5.319 7.180 14.484 550 HB2 ARG 33 HB2 ARG 33 -5.411 4.446 15.766 551 HB3 ARG 33 HB1 ARG 33 -5.773 4.869 14.092 552 HG2 ARG 33 HG2 ARG 33 -3.372 5.684 13.900 553 HG3 ARG 33 HG1 ARG 33 -3.080 4.928 15.468 554 HD2 ARG 33 HD2 ARG 33 -2.460 3.298 13.834 555 HD3 ARG 33 HD1 ARG 33 -4.019 2.782 14.469 556 HE ARG 33 HE ARG 33 -4.322 4.437 12.152 557 HH11 ARG 33 HH11 ARG 33 -3.530 1.221 13.232 558 HH12 ARG 33 HH12 ARG 33 -4.044 0.470 11.762 559 HH21 ARG 33 HH21 ARG 33 -4.982 3.430 10.238 560 HH22 ARG 33 HH22 ARG 33 -4.861 1.710 10.076 561 H1 MET 1 HT1 MET 1 49.791 -5.313 25.207 562 H2 MET 1 HT2 MET 1 50.279 -5.674 23.619 563 H3 MET 1 HT3 MET 1 48.994 -6.526 24.331 564 HA MET 1 HA MET 1 48.350 -3.825 24.481 565 HB2 MET 1 HB2 MET 1 49.601 -4.710 21.896 566 HB3 MET 1 HB1 MET 1 48.266 -3.557 21.871 567 HG2 MET 1 HG2 MET 1 49.506 -2.081 23.409 568 HG3 MET 1 HG1 MET 1 50.841 -3.233 23.441 569 HE1 MET 1 HE1 MET 1 49.475 -0.451 20.103 570 HE2 MET 1 HE2 MET 1 48.747 -0.762 21.676 571 HE3 MET 1 HE3 MET 1 48.527 -1.922 20.368 572 H PHE 2 HN PHE 2 46.587 -5.053 25.331 573 HA PHE 2 HA PHE 2 45.160 -7.010 23.877 574 HB2 PHE 2 HB2 PHE 2 44.526 -5.239 26.210 575 HB3 PHE 2 HB1 PHE 2 43.237 -6.171 25.448 576 HD1 PHE 2 HD1 PHE 2 46.187 -6.299 27.570 577 HD2 PHE 2 HD2 PHE 2 43.429 -8.662 25.278 578 HE1 PHE 2 HE1 PHE 2 46.936 -8.337 28.770 579 HE2 PHE 2 HE2 PHE 2 44.177 -10.699 26.477 580 HZ PHE 2 HZ PHE 2 45.930 -10.537 28.223 581 H GLU 3 HN GLU 3 44.771 -3.492 24.137 582 HA GLU 3 HA GLU 3 42.422 -3.424 22.514 583 HB2 GLU 3 HB2 GLU 3 42.709 -1.003 22.547 584 HB3 GLU 3 HB1 GLU 3 42.979 -1.660 24.162 585 HG2 GLU 3 HG2 GLU 3 45.426 -1.646 23.735 586 HG3 GLU 3 HG1 GLU 3 45.131 -0.924 22.155 587 HA PRO 4 HA PRO 4 44.342 -3.467 18.522 588 HB2 PRO 4 HB2 PRO 4 42.491 -2.132 17.036 589 HB3 PRO 4 HB1 PRO 4 42.223 -3.770 17.663 590 HG2 PRO 4 HG2 PRO 4 41.182 -1.171 18.646 591 HG3 PRO 4 HG1 PRO 4 40.411 -2.765 18.621 592 HD2 PRO 4 HD2 PRO 4 41.568 -1.611 20.873 593 HD3 PRO 4 HD1 PRO 4 41.280 -3.353 20.664 594 H PHE 5 HN PHE 5 43.081 -0.314 19.565 595 HA PHE 5 HA PHE 5 45.548 0.968 18.672 596 HB2 PHE 5 HB2 PHE 5 43.079 1.145 17.195 597 HB3 PHE 5 HB1 PHE 5 43.515 2.731 17.828 598 HD1 PHE 5 HD1 PHE 5 44.321 0.139 15.425 599 HD2 PHE 5 HD2 PHE 5 45.812 3.664 17.376 600 HE1 PHE 5 HE1 PHE 5 46.070 0.364 13.680 601 HE2 PHE 5 HE2 PHE 5 47.560 3.888 15.632 602 HZ PHE 5 HZ PHE 5 47.690 2.239 13.784 603 H GLN 6 HN GLN 6 42.335 2.267 19.508 604 HA GLN 6 HA GLN 6 43.308 3.094 22.136 605 HB2 GLN 6 HB2 GLN 6 42.558 4.968 19.900 606 HB3 GLN 6 HB1 GLN 6 42.356 5.442 21.587 607 HG2 GLN 6 HG2 GLN 6 44.958 4.429 20.409 608 HG3 GLN 6 HG1 GLN 6 44.562 6.132 20.614 609 HE21 GLN 6 HE21 GLN 6 44.197 6.894 22.886 610 HE22 GLN 6 HE22 GLN 6 44.942 6.066 24.166 611 H ILE 7 HN ILE 7 41.556 4.006 23.460 612 HA ILE 7 HA ILE 7 39.247 2.421 23.433 613 HB ILE 7 HB ILE 7 38.375 4.021 25.124 614 HG12 ILE 7 HG12 ILE 7 40.918 5.543 24.455 615 HG13 ILE 7 HG11 ILE 7 39.278 6.086 24.106 616 HG21 ILE 7 HG21 ILE 7 41.313 3.402 25.529 617 HG22 ILE 7 HG22 ILE 7 40.037 2.189 25.648 618 HG23 ILE 7 HG23 ILE 7 40.070 3.549 26.773 619 HD11 ILE 7 HD11 ILE 7 39.924 7.168 26.145 620 HD12 ILE 7 HD12 ILE 7 40.532 5.658 26.824 621 HD13 ILE 7 HD13 ILE 7 38.798 5.886 26.592 622 H LEU 8 HN LEU 8 39.923 5.528 22.013 623 HA LEU 8 HA LEU 8 37.207 6.205 21.363 624 HB2 LEU 8 HB2 LEU 8 39.873 7.219 20.359 625 HB3 LEU 8 HB1 LEU 8 38.328 7.875 19.818 626 HG LEU 8 HG LEU 8 38.966 7.656 22.757 627 HD11 LEU 8 HD11 LEU 8 39.715 9.882 20.842 628 HD12 LEU 8 HD12 LEU 8 40.808 8.939 21.856 629 HD13 LEU 8 HD13 LEU 8 39.675 10.071 22.595 630 HD21 LEU 8 HD21 LEU 8 37.272 9.653 21.235 631 HD22 LEU 8 HD22 LEU 8 37.264 9.336 22.970 632 HD23 LEU 8 HD23 LEU 8 36.626 8.133 21.851 633 H SER 9 HN SER 9 39.770 4.435 19.806 634 HA SER 9 HA SER 9 38.582 4.344 17.192 635 HB2 SER 9 HB2 SER 9 41.002 4.027 17.531 636 HB3 SER 9 HB1 SER 9 40.679 2.542 18.422 637 HG SER 9 HG SER 9 40.000 3.106 15.720 638 H ILE 10 HN ILE 10 38.647 2.150 19.984 639 HA ILE 10 HA ILE 10 37.205 0.058 18.670 640 HB ILE 10 HB ILE 10 37.001 -0.916 20.920 641 HG12 ILE 10 HG12 ILE 10 38.204 1.712 21.819 642 HG13 ILE 10 HG11 ILE 10 36.558 1.186 22.149 643 HG21 ILE 10 HG21 ILE 10 39.359 -1.189 21.342 644 HG22 ILE 10 HG22 ILE 10 39.729 0.351 20.568 645 HG23 ILE 10 HG23 ILE 10 39.159 -1.007 19.599 646 HD11 ILE 10 HD11 ILE 10 37.595 -0.875 23.255 647 HD12 ILE 10 HD12 ILE 10 37.783 0.653 24.116 648 HD13 ILE 10 HD13 ILE 10 39.128 -0.008 23.187 649 H CYS 11 HN CYS 11 36.294 2.852 20.645 650 HA CYS 11 HA CYS 11 33.597 2.105 21.070 651 HB2 CYS 11 HB2 CYS 11 35.008 4.771 21.012 652 HB3 CYS 11 HB1 CYS 11 33.287 4.615 21.367 653 HG CYS 11 HG CYS 11 35.530 3.969 23.294 654 H SER 12 HN SER 12 35.067 4.292 18.635 655 HA SER 12 HA SER 12 32.668 4.771 17.239 656 HB2 SER 12 HB2 SER 12 34.071 5.608 15.457 657 HB3 SER 12 HB1 SER 12 34.765 6.102 16.998 658 HG SER 12 HG SER 12 35.833 4.591 15.054 659 H PHE 13 HN PHE 13 35.022 2.167 17.064 660 HA PHE 13 HA PHE 13 34.257 1.046 14.607 661 HB2 PHE 13 HB2 PHE 13 36.265 0.303 15.711 662 HB3 PHE 13 HB1 PHE 13 35.349 -0.243 17.115 663 HD1 PHE 13 HD1 PHE 13 35.386 -0.707 13.388 664 HD2 PHE 13 HD2 PHE 13 34.811 -2.501 17.247 665 HE1 PHE 13 HE1 PHE 13 35.055 -2.916 12.311 666 HE2 PHE 13 HE2 PHE 13 34.479 -4.711 16.171 667 HZ PHE 13 HZ PHE 13 34.602 -4.918 13.702 668 H ILE 14 HN ILE 14 33.122 0.282 17.908 669 HA ILE 14 HA ILE 14 31.196 -1.630 17.063 670 HB ILE 14 HB ILE 14 31.389 0.007 19.601 671 HG12 ILE 14 HG12 ILE 14 33.221 -1.691 18.905 672 HG13 ILE 14 HG11 ILE 14 32.530 -1.850 20.518 673 HG21 ILE 14 HG21 ILE 14 29.128 -0.690 19.503 674 HG22 ILE 14 HG22 ILE 14 29.918 -1.940 20.464 675 HG23 ILE 14 HG23 ILE 14 29.542 -2.238 18.766 676 HD11 ILE 14 HD11 ILE 14 31.348 -3.367 18.192 677 HD12 ILE 14 HD12 ILE 14 31.246 -3.727 19.915 678 HD13 ILE 14 HD13 ILE 14 32.759 -3.987 19.048 679 H LEU 15 HN LEU 15 30.971 1.802 17.865 680 HA LEU 15 HA LEU 15 28.166 2.057 17.556 681 HB2 LEU 15 HB2 LEU 15 30.484 3.896 17.717 682 HB3 LEU 15 HB1 LEU 15 29.042 4.536 16.930 683 HG LEU 15 HG LEU 15 29.166 4.907 19.444 684 HD11 LEU 15 HD11 LEU 15 27.054 4.882 18.017 685 HD12 LEU 15 HD12 LEU 15 26.820 4.563 19.735 686 HD13 LEU 15 HD13 LEU 15 26.798 3.232 18.582 687 HD21 LEU 15 HD21 LEU 15 30.076 2.513 19.797 688 HD22 LEU 15 HD22 LEU 15 28.401 1.986 19.628 689 HD23 LEU 15 HD23 LEU 15 28.853 3.087 20.930 690 H SER 16 HN SER 16 30.776 1.917 15.290 691 HA SER 16 HA SER 16 29.332 3.042 13.067 692 HB2 SER 16 HB2 SER 16 31.772 3.130 13.131 693 HB3 SER 16 HB1 SER 16 31.847 1.370 13.142 694 HG SER 16 HG SER 16 30.784 1.406 11.113 695 H ALA 17 HN ALA 17 30.192 -0.227 14.162 696 HA ALA 17 HA ALA 17 29.096 -1.656 12.008 697 HB1 ALA 17 HB1 ALA 17 28.881 -3.522 13.721 698 HB2 ALA 17 HB2 ALA 17 29.480 -2.373 14.916 699 HB3 ALA 17 HB3 ALA 17 30.492 -2.827 13.545 700 H LEU 18 HN LEU 18 27.623 -0.673 15.107 701 HA LEU 18 HA LEU 18 25.067 -1.790 14.437 702 HB2 LEU 18 HB2 LEU 18 25.693 0.311 16.515 703 HB3 LEU 18 HB1 LEU 18 24.301 -0.774 16.474 704 HG LEU 18 HG LEU 18 27.194 -1.623 16.769 705 HD11 LEU 18 HD11 LEU 18 26.157 -0.522 18.766 706 HD12 LEU 18 HD12 LEU 18 26.592 -2.210 19.039 707 HD13 LEU 18 HD13 LEU 18 24.909 -1.769 18.748 708 HD21 LEU 18 HD21 LEU 18 24.604 -3.196 16.687 709 HD22 LEU 18 HD22 LEU 18 26.143 -3.866 17.229 710 HD23 LEU 18 HD23 LEU 18 25.958 -3.322 15.563 711 H HIS 19 HN HIS 19 26.705 1.187 13.820 712 HA HIS 19 HA HIS 19 24.435 2.848 13.419 713 HB2 HIS 19 HB2 HIS 19 26.417 4.040 13.677 714 HB3 HIS 19 HB1 HIS 19 27.313 2.975 12.597 715 HD2 HIS 19 HD2 HIS 19 27.379 3.809 9.967 716 HE1 HIS 19 HE1 HIS 19 24.450 6.836 10.249 717 HE2 HIS 19 HE2 HIS 19 26.170 5.759 8.722 718 H PHE 20 HN PHE 20 26.480 1.010 11.162 719 HA PHE 20 HA PHE 20 24.831 1.673 8.902 720 HB2 PHE 20 HB2 PHE 20 27.383 0.473 9.348 721 HB3 PHE 20 HB1 PHE 20 26.412 -0.629 8.372 722 HD1 PHE 20 HD1 PHE 20 28.514 2.209 8.275 723 HD2 PHE 20 HD2 PHE 20 25.017 0.527 6.435 724 HE1 PHE 20 HE1 PHE 20 28.873 3.643 6.283 725 HE2 PHE 20 HE2 PHE 20 25.374 1.960 4.443 726 HZ PHE 20 HZ PHE 20 27.308 3.512 4.369 727 H MET 21 HN MET 21 24.845 -0.796 11.343 728 HA MET 21 HA MET 21 23.391 -2.767 9.876 729 HB2 MET 21 HB2 MET 21 23.985 -2.272 12.771 730 HB3 MET 21 HB1 MET 21 22.840 -3.525 12.301 731 HG2 MET 21 HG2 MET 21 25.570 -3.351 11.035 732 HG3 MET 21 HG1 MET 21 25.318 -4.220 12.548 733 HE1 MET 21 HE1 MET 21 26.408 -6.144 11.218 734 HE2 MET 21 HE2 MET 21 26.353 -5.406 9.619 735 HE3 MET 21 HE3 MET 21 25.673 -7.013 9.864 736 H ALA 22 HN ALA 22 22.356 -0.621 12.525 737 HA ALA 22 HA ALA 22 19.591 -1.149 12.179 738 HB1 ALA 22 HB1 ALA 22 19.415 1.108 13.489 739 HB2 ALA 22 HB2 ALA 22 21.162 0.934 13.648 740 HB3 ALA 22 HB3 ALA 22 20.090 -0.313 14.286 741 H TRP 23 HN TRP 23 21.690 1.447 10.981 742 HA TRP 23 HA TRP 23 19.654 3.038 9.849 743 HB2 TRP 23 HB2 TRP 23 22.048 3.720 10.257 744 HB3 TRP 23 HB1 TRP 23 22.487 2.784 8.827 745 HD1 TRP 23 HD1 TRP 23 20.718 5.947 9.936 746 HE1 TRP 23 HE1 TRP 23 20.235 7.417 7.876 747 HE3 TRP 23 HE3 TRP 23 22.020 2.703 6.208 748 HZ2 TRP 23 HZ2 TRP 23 20.379 7.243 5.027 749 HZ3 TRP 23 HZ3 TRP 23 21.835 3.384 3.832 750 HH2 TRP 23 HH2 TRP 23 21.018 5.647 3.238 751 H THR 24 HN THR 24 21.552 0.345 8.542 752 HA THR 24 HA THR 24 20.572 0.525 5.878 753 HB THR 24 HB THR 24 21.812 -1.725 7.458 754 HG1 THR 24 HG1 THR 24 22.732 -0.209 5.251 755 HG21 THR 24 HG21 THR 24 20.808 -1.665 4.611 756 HG22 THR 24 HG22 THR 24 20.452 -2.851 5.866 757 HG23 THR 24 HG23 THR 24 22.060 -2.787 5.144 758 H ILE 25 HN ILE 25 19.533 -1.339 8.718 759 HA ILE 25 HA ILE 25 17.524 -2.846 7.445 760 HB ILE 25 HB ILE 25 17.796 -1.897 10.303 761 HG12 ILE 25 HG12 ILE 25 18.175 -4.663 9.132 762 HG13 ILE 25 HG11 ILE 25 19.498 -3.504 9.256 763 HG21 ILE 25 HG21 ILE 25 16.151 -3.815 10.719 764 HG22 ILE 25 HG22 ILE 25 15.801 -3.757 8.991 765 HG23 ILE 25 HG23 ILE 25 15.469 -2.354 10.006 766 HD11 ILE 25 HD11 ILE 25 19.235 -3.373 11.665 767 HD12 ILE 25 HD12 ILE 25 19.360 -5.074 11.213 768 HD13 ILE 25 HD13 ILE 25 17.786 -4.377 11.600 769 H GLY 26 HN GLY 26 17.415 0.313 9.057 770 HA2 GLY 26 HA2 GLY 26 14.631 0.749 8.822 771 HA3 GLY 26 HA1 GLY 26 15.849 2.007 9.009 772 H HIS 27 HN HIS 27 17.344 1.540 6.691 773 HA HIS 27 HA HIS 27 15.912 3.020 4.767 774 HB2 HIS 27 HB2 HIS 27 18.289 3.130 4.701 775 HB3 HIS 27 HB1 HIS 27 18.438 1.376 4.588 776 HD2 HIS 27 HD2 HIS 27 18.314 0.365 1.996 777 HE1 HIS 27 HE1 HIS 27 17.263 3.962 0.052 778 HE2 HIS 27 HE2 HIS 27 17.932 1.538 -0.305 779 H LEU 28 HN LEU 28 16.577 -0.452 5.051 780 HA LEU 28 HA LEU 28 15.284 -1.098 2.571 781 HB2 LEU 28 HB2 LEU 28 17.064 -2.405 4.141 782 HB3 LEU 28 HB1 LEU 28 15.570 -3.202 4.629 783 HG LEU 28 HG LEU 28 16.431 -4.455 2.780 784 HD11 LEU 28 HD11 LEU 28 14.390 -2.638 1.490 785 HD12 LEU 28 HD12 LEU 28 13.950 -3.760 2.777 786 HD13 LEU 28 HD13 LEU 28 14.616 -4.371 1.263 787 HD21 LEU 28 HD21 LEU 28 17.926 -2.526 2.016 788 HD22 LEU 28 HD22 LEU 28 16.528 -1.914 1.134 789 HD23 LEU 28 HD23 LEU 28 17.202 -3.491 0.732 790 H ASN 29 HN ASN 29 13.166 -1.076 2.252 791 HA ASN 29 HA ASN 29 11.386 -1.706 4.532 792 HB2 ASN 29 HB2 ASN 29 10.895 0.189 2.222 793 HB3 ASN 29 HB1 ASN 29 9.720 -0.218 3.472 794 HD21 ASN 29 HD21 ASN 29 11.191 2.414 2.811 795 HD22 ASN 29 HD22 ASN 29 11.860 2.885 4.298 796 H GLN 30 HN GLN 30 10.178 -3.463 4.273 797 HA GLN 30 HA GLN 30 9.639 -4.408 1.520 798 HB2 GLN 30 HB2 GLN 30 10.225 -6.042 4.001 799 HB3 GLN 30 HB1 GLN 30 9.687 -6.716 2.462 800 HG2 GLN 30 HG2 GLN 30 11.664 -5.781 1.342 801 HG3 GLN 30 HG1 GLN 30 12.200 -5.068 2.862 802 HE21 GLN 30 HE21 GLN 30 14.063 -6.318 3.304 803 HE22 GLN 30 HE22 GLN 30 14.046 -8.008 3.456 804 H ILE 31 HN ILE 31 7.559 -4.718 1.022 805 HA ILE 31 HA ILE 31 5.606 -5.010 3.213 806 HB ILE 31 HB ILE 31 4.074 -3.489 2.010 807 HG12 ILE 31 HG12 ILE 31 6.467 -2.805 0.280 808 HG13 ILE 31 HG11 ILE 31 5.183 -3.893 -0.246 809 HG21 ILE 31 HG21 ILE 31 5.567 -2.633 3.801 810 HG22 ILE 31 HG22 ILE 31 5.240 -1.407 2.576 811 HG23 ILE 31 HG23 ILE 31 6.785 -2.256 2.584 812 HD11 ILE 31 HD11 ILE 31 4.634 -1.698 -1.071 813 HD12 ILE 31 HD12 ILE 31 4.911 -0.975 0.513 814 HD13 ILE 31 HD13 ILE 31 3.532 -2.046 0.261 815 H LYS 32 HN LYS 32 3.669 -6.109 2.641 816 HA LYS 32 HA LYS 32 4.004 -7.873 0.304 817 HB2 LYS 32 HB2 LYS 32 2.931 -8.217 3.010 818 HB3 LYS 32 HB1 LYS 32 1.889 -8.882 1.750 819 HG2 LYS 32 HG2 LYS 32 4.839 -9.420 1.636 820 HG3 LYS 32 HG1 LYS 32 3.838 -10.351 2.752 821 HD2 LYS 32 HD2 LYS 32 2.509 -11.236 1.002 822 HD3 LYS 32 HD1 LYS 32 3.074 -10.026 -0.150 823 HE2 LYS 32 HE2 LYS 32 4.168 -12.170 -0.602 824 HE3 LYS 32 HE1 LYS 32 5.358 -11.004 -0.022 825 HZ1 LYS 32 HZ1 LYS 32 5.219 -11.947 2.166 826 HZ2 LYS 32 HZ2 LYS 32 5.550 -13.188 1.053 827 HZ3 LYS 32 HZ3 LYS 32 3.984 -13.006 1.686 828 H ARG 33 HN ARG 33 2.692 -7.698 -1.402 829 HA ARG 33 HA ARG 33 0.460 -5.794 -1.248 830 HB2 ARG 33 HB2 ARG 33 1.587 -7.120 -3.717 831 HB3 ARG 33 HB1 ARG 33 0.585 -5.670 -3.629 832 HG2 ARG 33 HG2 ARG 33 2.447 -4.609 -2.259 833 HG3 ARG 33 HG1 ARG 33 3.445 -5.996 -2.699 834 HD2 ARG 33 HD2 ARG 33 3.929 -4.308 -4.318 835 HD3 ARG 33 HD1 ARG 33 2.886 -5.474 -5.127 836 HE ARG 33 HE ARG 33 1.370 -3.358 -3.932 837 HH11 ARG 33 HH11 ARG 33 3.365 -4.199 -6.661 838 HH12 ARG 33 HH12 ARG 33 2.631 -3.036 -7.709 839 HH21 ARG 33 HH21 ARG 33 0.431 -1.842 -5.320 840 HH22 ARG 33 HH22 ARG 33 0.981 -1.708 -6.958 841 H1 MET 1 HT1 MET 1 57.251 3.403 1.687 842 H2 MET 1 HT2 MET 1 57.255 5.067 1.343 843 H3 MET 1 HT3 MET 1 56.563 3.970 0.245 844 HA MET 1 HA MET 1 55.306 3.563 2.693 845 HB2 MET 1 HB2 MET 1 55.805 6.435 1.961 846 HB3 MET 1 HB1 MET 1 54.280 5.979 2.724 847 HG2 MET 1 HG2 MET 1 55.517 4.938 4.587 848 HG3 MET 1 HG1 MET 1 57.044 5.387 3.827 849 HE1 MET 1 HE1 MET 1 53.938 8.001 5.891 850 HE2 MET 1 HE2 MET 1 53.894 6.279 5.526 851 HE3 MET 1 HE3 MET 1 53.569 7.450 4.251 852 H PHE 2 HN PHE 2 54.335 2.176 1.119 853 HA PHE 2 HA PHE 2 53.083 3.082 -1.245 854 HB2 PHE 2 HB2 PHE 2 52.820 0.643 0.478 855 HB3 PHE 2 HB1 PHE 2 51.650 0.928 -0.811 856 HD1 PHE 2 HD1 PHE 2 55.062 -0.043 -0.007 857 HD2 PHE 2 HD2 PHE 2 52.438 1.195 -3.173 858 HE1 PHE 2 HE1 PHE 2 56.689 -0.877 -1.682 859 HE2 PHE 2 HE2 PHE 2 54.064 0.362 -4.849 860 HZ PHE 2 HZ PHE 2 56.190 -0.674 -4.103 861 H GLU 3 HN GLU 3 51.873 2.645 2.064 862 HA GLU 3 HA GLU 3 49.188 3.355 1.398 863 HB2 GLU 3 HB2 GLU 3 48.805 3.378 3.805 864 HB3 GLU 3 HB1 GLU 3 49.772 1.969 3.366 865 HG2 GLU 3 HG2 GLU 3 51.830 3.215 3.981 866 HG3 GLU 3 HG1 GLU 3 50.835 4.582 4.478 867 HA PRO 4 HA PRO 4 49.578 7.762 1.534 868 HB2 PRO 4 HB2 PRO 4 47.049 8.492 2.235 869 HB3 PRO 4 HB1 PRO 4 47.461 7.846 0.635 870 HG2 PRO 4 HG2 PRO 4 46.160 6.506 2.941 871 HG3 PRO 4 HG1 PRO 4 45.880 6.301 1.204 872 HD2 PRO 4 HD2 PRO 4 47.377 4.560 2.772 873 HD3 PRO 4 HD1 PRO 4 47.517 4.702 1.007 874 H PHE 5 HN PHE 5 47.947 6.304 4.328 875 HA PHE 5 HA PHE 5 49.535 7.964 6.132 876 HB2 PHE 5 HB2 PHE 5 46.760 8.495 5.549 877 HB3 PHE 5 HB1 PHE 5 46.941 8.024 7.238 878 HD1 PHE 5 HD1 PHE 5 47.555 10.601 4.763 879 HD2 PHE 5 HD2 PHE 5 48.608 9.227 8.695 880 HE1 PHE 5 HE1 PHE 5 48.482 12.839 5.296 881 HE2 PHE 5 HE2 PHE 5 49.535 11.465 9.227 882 HZ PHE 5 HZ PHE 5 49.472 13.271 7.528 883 H GLN 6 HN GLN 6 46.566 6.052 6.617 884 HA GLN 6 HA GLN 6 48.106 3.907 7.872 885 HB2 GLN 6 HB2 GLN 6 46.169 5.714 9.305 886 HB3 GLN 6 HB1 GLN 6 46.428 4.054 9.842 887 HG2 GLN 6 HG2 GLN 6 48.650 6.075 9.447 888 HG3 GLN 6 HG1 GLN 6 47.904 5.717 11.001 889 HE21 GLN 6 HE21 GLN 6 48.137 3.446 11.817 890 HE22 GLN 6 HE22 GLN 6 49.463 2.517 11.312 891 H ILE 7 HN ILE 7 46.720 2.042 8.406 892 HA ILE 7 HA ILE 7 45.061 1.298 6.274 893 HB ILE 7 HB ILE 7 44.411 -0.617 7.722 894 HG12 ILE 7 HG12 ILE 7 46.073 0.861 9.793 895 HG13 ILE 7 HG11 ILE 7 44.329 0.615 9.864 896 HG21 ILE 7 HG21 ILE 7 47.366 0.026 7.917 897 HG22 ILE 7 HG22 ILE 7 46.582 -0.505 6.428 898 HG23 ILE 7 HG23 ILE 7 46.623 -1.571 7.832 899 HD11 ILE 7 HD11 ILE 7 45.304 -1.094 11.232 900 HD12 ILE 7 HD12 ILE 7 46.491 -1.494 9.991 901 HD13 ILE 7 HD13 ILE 7 44.788 -1.881 9.741 902 H LEU 8 HN LEU 8 44.349 2.813 9.337 903 HA LEU 8 HA LEU 8 41.503 2.470 9.229 904 HB2 LEU 8 HB2 LEU 8 43.295 4.318 10.816 905 HB3 LEU 8 HB1 LEU 8 41.541 4.279 11.005 906 HG LEU 8 HG LEU 8 43.169 1.747 11.189 907 HD11 LEU 8 HD11 LEU 8 42.599 3.766 13.376 908 HD12 LEU 8 HD12 LEU 8 44.181 3.210 12.829 909 HD13 LEU 8 HD13 LEU 8 43.106 2.105 13.685 910 HD21 LEU 8 HD21 LEU 8 40.590 2.556 12.556 911 HD22 LEU 8 HD22 LEU 8 41.254 0.931 12.384 912 HD23 LEU 8 HD23 LEU 8 40.624 1.780 10.974 913 H SER 9 HN SER 9 43.767 4.850 8.066 914 HA SER 9 HA SER 9 41.838 6.891 7.468 915 HB2 SER 9 HB2 SER 9 44.223 7.414 7.815 916 HB3 SER 9 HB1 SER 9 44.630 6.491 6.371 917 HG SER 9 HG SER 9 42.954 8.780 6.527 918 H ILE 10 HN ILE 10 43.426 4.327 5.593 919 HA ILE 10 HA ILE 10 42.249 5.100 3.101 920 HB ILE 10 HB ILE 10 43.085 2.934 2.286 921 HG12 ILE 10 HG12 ILE 10 43.766 2.462 5.197 922 HG13 ILE 10 HG11 ILE 10 42.534 1.593 4.291 923 HG21 ILE 10 HG21 ILE 10 45.428 3.359 2.662 924 HG22 ILE 10 HG22 ILE 10 45.087 4.185 4.183 925 HG23 ILE 10 HG23 ILE 10 44.612 4.922 2.654 926 HD11 ILE 10 HD11 ILE 10 44.395 0.947 2.660 927 HD12 ILE 10 HD12 ILE 10 44.444 0.180 4.248 928 HD13 ILE 10 HD13 ILE 10 45.523 1.527 3.884 929 H CYS 11 HN CYS 11 41.333 2.887 5.717 930 HA CYS 11 HA CYS 11 39.252 1.568 4.324 931 HB2 CYS 11 HB2 CYS 11 39.785 2.065 7.252 932 HB3 CYS 11 HB1 CYS 11 38.395 1.140 6.685 933 HG CYS 11 HG CYS 11 41.244 0.120 6.791 934 H SER 12 HN SER 12 39.160 4.319 6.630 935 HA SER 12 HA SER 12 36.403 4.797 6.355 936 HB2 SER 12 HB2 SER 12 36.842 6.938 7.385 937 HB3 SER 12 HB1 SER 12 37.856 5.725 8.159 938 HG SER 12 HG SER 12 38.570 7.943 6.829 939 H PHE 13 HN PHE 13 39.169 5.816 4.442 940 HA PHE 13 HA PHE 13 37.953 7.876 2.973 941 HB2 PHE 13 HB2 PHE 13 40.338 7.546 2.863 942 HB3 PHE 13 HB1 PHE 13 40.130 5.921 2.210 943 HD1 PHE 13 HD1 PHE 13 39.032 9.440 1.483 944 HD2 PHE 13 HD2 PHE 13 40.300 5.650 -0.094 945 HE1 PHE 13 HE1 PHE 13 38.964 10.373 -0.814 946 HE2 PHE 13 HE2 PHE 13 40.231 6.583 -2.390 947 HZ PHE 13 HZ PHE 13 39.564 8.945 -2.750 948 H ILE 14 HN ILE 14 38.246 4.396 2.206 949 HA ILE 14 HA ILE 14 36.742 4.558 -0.201 950 HB ILE 14 HB ILE 14 37.328 2.217 1.623 951 HG12 ILE 14 HG12 ILE 14 39.205 3.531 0.406 952 HG13 ILE 14 HG11 ILE 14 39.168 1.781 0.200 953 HG21 ILE 14 HG21 ILE 14 35.445 1.538 0.360 954 HG22 ILE 14 HG22 ILE 14 36.817 0.932 -0.565 955 HG23 ILE 14 HG23 ILE 14 35.986 2.400 -1.081 956 HD11 ILE 14 HD11 ILE 14 37.725 3.579 -1.747 957 HD12 ILE 14 HD12 ILE 14 38.311 1.934 -1.986 958 HD13 ILE 14 HD13 ILE 14 39.453 3.274 -1.914 959 H LEU 15 HN LEU 15 35.880 3.664 3.112 960 HA LEU 15 HA LEU 15 33.180 2.986 2.602 961 HB2 LEU 15 HB2 LEU 15 34.829 3.607 4.986 962 HB3 LEU 15 HB1 LEU 15 33.091 3.836 5.169 963 HG LEU 15 HG LEU 15 33.950 1.515 5.755 964 HD11 LEU 15 HD11 LEU 15 31.572 2.122 5.075 965 HD12 LEU 15 HD12 LEU 15 32.026 0.435 4.839 966 HD13 LEU 15 HD13 LEU 15 31.975 1.534 3.463 967 HD21 LEU 15 HD21 LEU 15 35.535 1.537 3.712 968 HD22 LEU 15 HD22 LEU 15 34.109 1.124 2.759 969 HD23 LEU 15 HD23 LEU 15 34.660 0.042 4.037 970 H SER 16 HN SER 16 34.806 6.019 2.976 971 HA SER 16 HA SER 16 32.451 7.585 3.502 972 HB2 SER 16 HB2 SER 16 34.650 8.366 4.223 973 HB3 SER 16 HB1 SER 16 35.196 8.411 2.550 974 HG SER 16 HG SER 16 33.547 9.947 2.149 975 H ALA 17 HN ALA 17 34.480 6.911 0.664 976 HA ALA 17 HA ALA 17 33.148 8.576 -1.163 977 HB1 ALA 17 HB1 ALA 17 34.034 6.928 -2.884 978 HB2 ALA 17 HB2 ALA 17 34.668 5.992 -1.530 979 HB3 ALA 17 HB3 ALA 17 35.242 7.636 -1.811 980 H LEU 18 HN LEU 18 32.596 5.140 -0.354 981 HA LEU 18 HA LEU 18 30.367 4.908 -2.143 982 HB2 LEU 18 HB2 LEU 18 31.064 3.141 0.204 983 HB3 LEU 18 HB1 LEU 18 30.088 2.716 -1.203 984 HG LEU 18 HG LEU 18 33.026 3.453 -1.249 985 HD11 LEU 18 HD11 LEU 18 32.468 1.202 -0.299 986 HD12 LEU 18 HD12 LEU 18 33.404 1.125 -1.791 987 HD13 LEU 18 HD13 LEU 18 31.670 0.809 -1.822 988 HD21 LEU 18 HD21 LEU 18 31.087 2.658 -3.439 989 HD22 LEU 18 HD22 LEU 18 32.838 2.693 -3.643 990 HD23 LEU 18 HD23 LEU 18 31.964 4.183 -3.299 991 H HIS 19 HN HIS 19 30.837 5.999 1.100 992 HA HIS 19 HA HIS 19 28.207 5.567 2.080 993 HB2 HIS 19 HB2 HIS 19 29.762 5.991 3.759 994 HB3 HIS 19 HB1 HIS 19 30.491 7.331 2.880 995 HD2 HIS 19 HD2 HIS 19 29.441 9.808 3.492 996 HE1 HIS 19 HE1 HIS 19 26.079 8.482 5.676 997 HE2 HIS 19 HE2 HIS 19 27.406 10.527 4.962 998 H PHE 20 HN PHE 20 29.788 8.427 0.671 999 HA PHE 20 HA PHE 20 27.359 9.963 0.698 1000 HB2 PHE 20 HB2 PHE 20 30.134 10.451 0.234 1001 HB3 PHE 20 HB1 PHE 20 29.226 11.049 -1.154 1002 HD1 PHE 20 HD1 PHE 20 30.322 11.821 2.119 1003 HD2 PHE 20 HD2 PHE 20 27.001 12.363 -0.551 1004 HE1 PHE 20 HE1 PHE 20 29.572 13.777 3.448 1005 HE2 PHE 20 HE2 PHE 20 26.252 14.319 0.777 1006 HZ PHE 20 HZ PHE 20 27.534 15.024 2.783 1007 H MET 21 HN MET 21 28.857 7.716 -1.485 1008 HA MET 21 HA MET 21 27.583 8.624 -3.874 1009 HB2 MET 21 HB2 MET 21 28.960 6.105 -3.016 1010 HB3 MET 21 HB1 MET 21 28.106 6.170 -4.555 1011 HG2 MET 21 HG2 MET 21 30.097 8.299 -3.782 1012 HG3 MET 21 HG1 MET 21 30.613 6.806 -4.566 1013 HE1 MET 21 HE1 MET 21 31.666 8.465 -6.242 1014 HE2 MET 21 HE2 MET 21 30.878 9.931 -5.668 1015 HE3 MET 21 HE3 MET 21 30.778 9.497 -7.372 1016 H ALA 22 HN ALA 22 26.961 5.741 -1.868 1017 HA ALA 22 HA ALA 22 24.495 5.124 -3.118 1018 HB1 ALA 22 HB1 ALA 22 24.169 3.795 -0.889 1019 HB2 ALA 22 HB2 ALA 22 25.847 4.253 -0.593 1020 HB3 ALA 22 HB3 ALA 22 25.430 3.306 -2.021 1021 H TRP 23 HN TRP 23 25.286 6.933 -0.170 1022 HA TRP 23 HA TRP 23 22.638 7.261 0.748 1023 HB2 TRP 23 HB2 TRP 23 24.752 7.699 2.054 1024 HB3 TRP 23 HB1 TRP 23 24.916 9.207 1.153 1025 HD1 TRP 23 HD1 TRP 23 22.843 7.500 3.829 1026 HE1 TRP 23 HE1 TRP 23 21.318 9.241 4.960 1027 HE3 TRP 23 HE3 TRP 23 23.634 11.502 0.752 1028 HZ2 TRP 23 HZ2 TRP 23 20.535 11.966 4.610 1029 HZ3 TRP 23 HZ3 TRP 23 22.484 13.657 1.175 1030 HH2 TRP 23 HH2 TRP 23 20.936 13.894 3.098 1031 H THR 24 HN THR 24 24.637 9.193 -1.452 1032 HA THR 24 HA THR 24 22.806 11.347 -1.747 1033 HB THR 24 HB THR 24 25.062 10.329 -3.468 1034 HG1 THR 24 HG1 THR 24 24.742 12.694 -1.946 1035 HG21 THR 24 HG21 THR 24 23.181 12.653 -3.893 1036 HG22 THR 24 HG22 THR 24 23.604 11.372 -5.029 1037 HG23 THR 24 HG23 THR 24 24.793 12.605 -4.607 1038 H ILE 25 HN ILE 25 23.329 8.354 -3.587 1039 HA ILE 25 HA ILE 25 21.492 8.879 -5.656 1040 HB ILE 25 HB ILE 25 22.444 6.276 -4.448 1041 HG12 ILE 25 HG12 ILE 25 23.138 7.550 -7.105 1042 HG13 ILE 25 HG11 ILE 25 24.061 7.872 -5.638 1043 HG21 ILE 25 HG21 ILE 25 21.617 5.349 -6.687 1044 HG22 ILE 25 HG22 ILE 25 20.704 6.848 -6.857 1045 HG23 ILE 25 HG23 ILE 25 20.368 5.758 -5.511 1046 HD11 ILE 25 HD11 ILE 25 24.601 5.521 -5.391 1047 HD12 ILE 25 HD12 ILE 25 25.016 6.014 -7.033 1048 HD13 ILE 25 HD13 ILE 25 23.541 5.095 -6.735 1049 H GLY 26 HN GLY 26 21.085 7.272 -2.515 1050 HA2 GLY 26 HA2 GLY 26 18.379 6.527 -2.834 1051 HA3 GLY 26 HA1 GLY 26 19.201 6.753 -1.293 1052 H HIS 27 HN HIS 27 19.893 9.452 -1.529 1053 HA HIS 27 HA HIS 27 17.553 10.736 -0.632 1054 HB2 HIS 27 HB2 HIS 27 19.646 11.618 0.083 1055 HB3 HIS 27 HB1 HIS 27 20.215 11.804 -1.576 1056 HD2 HIS 27 HD2 HIS 27 19.502 14.210 -2.785 1057 HE1 HIS 27 HE1 HIS 27 16.930 15.612 0.256 1058 HE2 HIS 27 HE2 HIS 27 18.065 16.218 -1.933 1059 H LEU 28 HN LEU 28 19.188 10.764 -3.779 1060 HA LEU 28 HA LEU 28 17.356 12.649 -4.931 1061 HB2 LEU 28 HB2 LEU 28 19.844 11.813 -5.607 1062 HB3 LEU 28 HB1 LEU 28 18.876 10.852 -6.723 1063 HG LEU 28 HG LEU 28 19.367 12.907 -7.851 1064 HD11 LEU 28 HD11 LEU 28 16.601 13.381 -6.728 1065 HD12 LEU 28 HD12 LEU 28 16.940 12.039 -7.822 1066 HD13 LEU 28 HD13 LEU 28 17.195 13.699 -8.358 1067 HD21 LEU 28 HD21 LEU 28 19.938 14.107 -5.665 1068 HD22 LEU 28 HD22 LEU 28 18.214 14.442 -5.507 1069 HD23 LEU 28 HD23 LEU 28 19.112 15.078 -6.883 1070 H ASN 29 HN ASN 29 15.335 12.217 -5.484 1071 HA ASN 29 HA ASN 29 14.666 9.472 -6.370 1072 HB2 ASN 29 HB2 ASN 29 12.934 11.439 -4.853 1073 HB3 ASN 29 HB1 ASN 29 12.406 9.866 -5.451 1074 HD21 ASN 29 HD21 ASN 29 12.801 10.951 -2.589 1075 HD22 ASN 29 HD22 ASN 29 13.780 9.780 -1.846 1076 H GLN 30 HN GLN 30 13.961 9.328 -8.395 1077 HA GLN 30 HA GLN 30 12.802 11.738 -9.660 1078 HB2 GLN 30 HB2 GLN 30 14.609 9.641 -10.887 1079 HB3 GLN 30 HB1 GLN 30 13.784 10.908 -11.797 1080 HG2 GLN 30 HG2 GLN 30 14.936 12.630 -10.475 1081 HG3 GLN 30 HG1 GLN 30 15.741 11.378 -9.529 1082 HE21 GLN 30 HE21 GLN 30 17.908 11.625 -10.215 1083 HE22 GLN 30 HE22 GLN 30 18.401 11.504 -11.836 1084 H ILE 31 HN ILE 31 10.841 11.492 -10.531 1085 HA ILE 31 HA ILE 31 9.896 8.766 -11.146 1086 HB ILE 31 HB ILE 31 7.699 9.340 -10.172 1087 HG12 ILE 31 HG12 ILE 31 9.089 11.779 -9.031 1088 HG13 ILE 31 HG11 ILE 31 8.047 11.848 -10.451 1089 HG21 ILE 31 HG21 ILE 31 9.418 8.162 -8.822 1090 HG22 ILE 31 HG22 ILE 31 8.380 9.179 -7.822 1091 HG23 ILE 31 HG23 ILE 31 10.006 9.720 -8.239 1092 HD11 ILE 31 HD11 ILE 31 6.681 12.395 -8.545 1093 HD12 ILE 31 HD12 ILE 31 7.270 10.993 -7.652 1094 HD13 ILE 31 HD13 ILE 31 6.232 10.769 -9.060 1095 H LYS 32 HN LYS 32 8.250 8.653 -12.749 1096 HA LYS 32 HA LYS 32 8.240 10.990 -14.544 1097 HB2 LYS 32 HB2 LYS 32 8.278 8.086 -14.942 1098 HB3 LYS 32 HB1 LYS 32 7.093 8.919 -15.949 1099 HG2 LYS 32 HG2 LYS 32 9.860 10.056 -15.713 1100 HG3 LYS 32 HG1 LYS 32 9.585 8.678 -16.780 1101 HD2 LYS 32 HD2 LYS 32 8.035 9.875 -18.114 1102 HD3 LYS 32 HD1 LYS 32 7.830 11.131 -16.894 1103 HE2 LYS 32 HE2 LYS 32 9.242 11.969 -18.709 1104 HE3 LYS 32 HE1 LYS 32 10.197 11.815 -17.235 1105 HZ1 LYS 32 HZ1 LYS 32 11.061 9.730 -18.010 1106 HZ2 LYS 32 HZ2 LYS 32 11.321 10.910 -19.205 1107 HZ3 LYS 32 HZ3 LYS 32 10.071 9.774 -19.387 1108 H ARG 33 HN ARG 33 6.436 12.135 -14.847 1109 HA ARG 33 HA ARG 33 3.961 11.187 -13.578 1110 HB2 ARG 33 HB2 ARG 33 4.501 13.915 -14.759 1111 HB3 ARG 33 HB1 ARG 33 3.238 13.462 -13.613 1112 HG2 ARG 33 HG2 ARG 33 5.095 12.804 -12.004 1113 HG3 ARG 33 HG1 ARG 33 6.219 13.583 -13.117 1114 HD2 ARG 33 HD2 ARG 33 5.656 15.242 -11.493 1115 HD3 ARG 33 HD1 ARG 33 4.757 15.661 -12.948 1116 HE ARG 33 HE ARG 33 3.221 13.980 -11.211 1117 HH11 ARG 33 HH11 ARG 33 4.329 17.244 -11.715 1118 HH12 ARG 33 HH12 ARG 33 3.002 17.954 -10.865 1119 HH21 ARG 33 HH21 ARG 33 1.498 14.934 -10.101 1120 HH22 ARG 33 HH22 ARG 33 1.407 16.657 -9.957 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 52.059 25.672 11.026 2 H2 MET 1 HT2 MET 1 52.212 26.990 9.965 3 H3 MET 1 HT3 MET 1 50.826 26.007 9.910 4 HA MET 1 HA MET 1 50.625 26.735 12.408 5 HB2 MET 1 HB2 MET 1 52.681 28.447 11.258 6 HB3 MET 1 HB1 MET 1 51.318 29.387 11.866 7 HG2 MET 1 HG2 MET 1 51.467 28.086 14.012 8 HG3 MET 1 HG1 MET 1 52.944 27.341 13.400 9 HE1 MET 1 HE1 MET 1 55.013 28.233 13.094 10 HE2 MET 1 HE2 MET 1 55.603 29.864 13.401 11 HE3 MET 1 HE3 MET 1 54.655 29.537 11.953 12 H PHE 2 HN PHE 2 50.381 27.761 9.086 13 HA PHE 2 HA PHE 2 48.208 29.552 9.330 14 HB2 PHE 2 HB2 PHE 2 49.058 27.783 7.026 15 HB3 PHE 2 HB1 PHE 2 47.842 29.056 6.912 16 HD1 PHE 2 HD1 PHE 2 51.400 28.293 7.127 17 HD2 PHE 2 HD2 PHE 2 48.479 31.437 7.300 18 HE1 PHE 2 HE1 PHE 2 53.193 29.975 6.816 19 HE2 PHE 2 HE2 PHE 2 50.273 33.121 6.988 20 HZ PHE 2 HZ PHE 2 52.631 32.391 6.746 21 H GLU 3 HN GLU 3 48.384 26.043 8.917 22 HA GLU 3 HA GLU 3 45.490 25.836 8.800 23 HB2 GLU 3 HB2 GLU 3 47.654 23.725 8.776 24 HB3 GLU 3 HB1 GLU 3 45.931 23.385 8.620 25 HG2 GLU 3 HG2 GLU 3 46.670 23.500 6.385 26 HG3 GLU 3 HG1 GLU 3 45.976 25.094 6.673 27 HA PRO 4 HA PRO 4 44.914 25.133 13.125 28 HB2 PRO 4 HB2 PRO 4 42.770 23.432 13.116 29 HB3 PRO 4 HB1 PRO 4 42.643 25.164 12.754 30 HG2 PRO 4 HG2 PRO 4 42.697 22.840 10.899 31 HG3 PRO 4 HG1 PRO 4 41.753 24.338 10.812 32 HD2 PRO 4 HD2 PRO 4 44.018 23.902 9.322 33 HD3 PRO 4 HD1 PRO 4 43.466 25.519 9.814 34 H PHE 5 HN PHE 5 44.693 22.142 11.190 35 HA PHE 5 HA PHE 5 46.472 20.813 13.120 36 HB2 PHE 5 HB2 PHE 5 43.679 20.025 12.420 37 HB3 PHE 5 HB1 PHE 5 44.872 18.745 12.641 38 HD1 PHE 5 HD1 PHE 5 43.417 21.771 14.272 39 HD2 PHE 5 HD2 PHE 5 45.573 18.095 14.801 40 HE1 PHE 5 HE1 PHE 5 43.237 22.020 16.733 41 HE2 PHE 5 HE2 PHE 5 45.393 18.343 17.262 42 HZ PHE 5 HZ PHE 5 44.228 20.305 18.227 43 H GLN 6 HN GLN 6 44.552 19.834 10.283 44 HA GLN 6 HA GLN 6 46.883 19.645 8.604 45 HB2 GLN 6 HB2 GLN 6 46.507 17.152 8.206 46 HB3 GLN 6 HB1 GLN 6 47.295 17.592 9.722 47 HG2 GLN 6 HG2 GLN 6 45.187 17.391 10.926 48 HG3 GLN 6 HG1 GLN 6 44.325 17.075 9.425 49 HE21 GLN 6 HE21 GLN 6 45.641 15.513 12.067 50 HE22 GLN 6 HE22 GLN 6 45.911 13.988 11.370 51 H ILE 7 HN ILE 7 46.314 18.792 6.442 52 HA ILE 7 HA ILE 7 44.131 20.080 5.330 53 HB ILE 7 HB ILE 7 44.445 18.528 3.377 54 HG12 ILE 7 HG12 ILE 7 46.852 17.274 4.036 55 HG13 ILE 7 HG11 ILE 7 45.832 16.979 5.439 56 HG21 ILE 7 HG21 ILE 7 46.718 19.315 2.881 57 HG22 ILE 7 HG22 ILE 7 46.974 19.684 4.587 58 HG23 ILE 7 HG23 ILE 7 45.780 20.591 3.657 59 HD11 ILE 7 HD11 ILE 7 44.005 16.287 3.771 60 HD12 ILE 7 HD12 ILE 7 45.366 15.181 3.960 61 HD13 ILE 7 HD13 ILE 7 45.287 16.251 2.561 62 H LEU 8 HN LEU 8 44.353 16.820 6.651 63 HA LEU 8 HA LEU 8 41.863 15.864 5.716 64 HB2 LEU 8 HB2 LEU 8 43.867 14.593 6.795 65 HB3 LEU 8 HB1 LEU 8 43.078 14.988 8.321 66 HG LEU 8 HG LEU 8 41.265 13.924 6.248 67 HD11 LEU 8 HD11 LEU 8 43.331 12.119 7.545 68 HD12 LEU 8 HD12 LEU 8 43.336 12.587 5.844 69 HD13 LEU 8 HD13 LEU 8 42.015 11.612 6.486 70 HD21 LEU 8 HD21 LEU 8 40.306 12.802 8.136 71 HD22 LEU 8 HD22 LEU 8 40.775 14.402 8.710 72 HD23 LEU 8 HD23 LEU 8 41.777 13.001 9.087 73 H SER 9 HN SER 9 42.814 17.746 8.506 74 HA SER 9 HA SER 9 40.332 17.531 9.912 75 HB2 SER 9 HB2 SER 9 42.635 19.473 10.123 76 HB3 SER 9 HB1 SER 9 41.221 19.538 11.171 77 HG SER 9 HG SER 9 43.365 17.936 11.311 78 H ILE 10 HN ILE 10 41.716 19.870 7.642 79 HA ILE 10 HA ILE 10 39.689 21.824 7.832 80 HB ILE 10 HB ILE 10 41.563 21.078 5.581 81 HG12 ILE 10 HG12 ILE 10 41.557 23.523 7.363 82 HG13 ILE 10 HG11 ILE 10 42.413 22.045 7.803 83 HG21 ILE 10 HG21 ILE 10 39.678 22.148 4.541 84 HG22 ILE 10 HG22 ILE 10 40.938 23.372 4.697 85 HG23 ILE 10 HG23 ILE 10 39.582 23.356 5.824 86 HD11 ILE 10 HD11 ILE 10 43.777 22.167 5.807 87 HD12 ILE 10 HD12 ILE 10 43.851 23.734 6.611 88 HD13 ILE 10 HD13 ILE 10 42.831 23.520 5.188 89 H CYS 11 HN CYS 11 40.086 19.091 5.570 90 HA CYS 11 HA CYS 11 37.716 19.560 4.106 91 HB2 CYS 11 HB2 CYS 11 39.301 17.037 4.608 92 HB3 CYS 11 HB1 CYS 11 37.921 17.111 3.511 93 HG CYS 11 HG CYS 11 39.588 19.291 2.575 94 H SER 12 HN SER 12 38.345 17.312 6.802 95 HA SER 12 HA SER 12 35.811 16.239 7.054 96 HB2 SER 12 HB2 SER 12 37.773 15.454 8.332 97 HB3 SER 12 HB1 SER 12 37.723 16.922 9.304 98 HG SER 12 HG SER 12 36.587 15.390 10.414 99 H PHE 13 HN PHE 13 37.092 19.224 8.482 100 HA PHE 13 HA PHE 13 34.877 19.916 10.036 101 HB2 PHE 13 HB2 PHE 13 36.919 21.129 10.318 102 HB3 PHE 13 HB1 PHE 13 36.939 21.615 8.623 103 HD1 PHE 13 HD1 PHE 13 35.093 22.006 11.836 104 HD2 PHE 13 HD2 PHE 13 35.726 23.512 7.863 105 HE1 PHE 13 HE1 PHE 13 33.760 24.024 12.388 106 HE2 PHE 13 HE2 PHE 13 34.394 25.529 8.415 107 HZ PHE 13 HZ PHE 13 33.412 25.785 10.677 108 H ILE 14 HN ILE 14 35.648 20.812 6.669 109 HA ILE 14 HA ILE 14 33.334 22.368 6.234 110 HB ILE 14 HB ILE 14 35.065 20.831 4.284 111 HG12 ILE 14 HG12 ILE 14 36.059 22.715 5.726 112 HG13 ILE 14 HG11 ILE 14 36.254 22.869 3.983 113 HG21 ILE 14 HG21 ILE 14 34.065 22.560 2.656 114 HG22 ILE 14 HG22 ILE 14 32.816 22.811 3.876 115 HG23 ILE 14 HG23 ILE 14 33.025 21.222 3.142 116 HD11 ILE 14 HD11 ILE 14 33.920 24.138 5.424 117 HD12 ILE 14 HD12 ILE 14 34.562 24.520 3.828 118 HD13 ILE 14 HD13 ILE 14 35.472 24.958 5.272 119 H LEU 15 HN LEU 15 34.001 18.947 5.613 120 HA LEU 15 HA LEU 15 31.546 18.333 4.363 121 HB2 LEU 15 HB2 LEU 15 33.492 16.609 5.912 122 HB3 LEU 15 HB1 LEU 15 32.107 15.967 5.028 123 HG LEU 15 HG LEU 15 34.226 17.714 3.750 124 HD11 LEU 15 HD11 LEU 15 33.973 14.690 3.776 125 HD12 LEU 15 HD12 LEU 15 35.251 15.628 4.551 126 HD13 LEU 15 HD13 LEU 15 35.115 15.606 2.793 127 HD21 LEU 15 HD21 LEU 15 33.243 16.560 1.678 128 HD22 LEU 15 HD22 LEU 15 32.207 17.745 2.472 129 HD23 LEU 15 HD23 LEU 15 31.932 16.022 2.728 130 H SER 16 HN SER 16 32.509 18.532 7.714 131 HA SER 16 HA SER 16 30.170 17.260 8.787 132 HB2 SER 16 HB2 SER 16 32.234 19.069 10.047 133 HB3 SER 16 HB1 SER 16 30.942 18.272 10.941 134 HG SER 16 HG SER 16 31.781 16.290 10.302 135 H ALA 17 HN ALA 17 31.216 20.655 8.500 136 HA ALA 17 HA ALA 17 28.900 21.803 9.615 137 HB1 ALA 17 HB1 ALA 17 30.646 23.317 9.440 138 HB2 ALA 17 HB2 ALA 17 29.657 23.795 8.062 139 HB3 ALA 17 HB3 ALA 17 31.085 22.789 7.817 140 H LEU 18 HN LEU 18 29.709 20.912 6.281 141 HA LEU 18 HA LEU 18 27.349 22.012 5.135 142 HB2 LEU 18 HB2 LEU 18 29.563 20.251 4.255 143 HB3 LEU 18 HB1 LEU 18 28.050 20.119 3.358 144 HG LEU 18 HG LEU 18 28.059 22.451 2.821 145 HD11 LEU 18 HD11 LEU 18 28.755 23.525 4.810 146 HD12 LEU 18 HD12 LEU 18 30.058 23.863 3.674 147 HD13 LEU 18 HD13 LEU 18 30.254 22.603 4.892 148 HD21 LEU 18 HD21 LEU 18 30.789 21.170 2.544 149 HD22 LEU 18 HD22 LEU 18 30.365 22.691 1.758 150 HD23 LEU 18 HD23 LEU 18 29.489 21.215 1.352 151 H HIS 19 HN HIS 19 28.199 18.776 6.318 152 HA HIS 19 HA HIS 19 25.924 17.424 5.429 153 HB2 HIS 19 HB2 HIS 19 27.954 16.347 6.355 154 HB3 HIS 19 HB1 HIS 19 27.508 16.927 7.960 155 HD2 HIS 19 HD2 HIS 19 26.008 14.475 5.231 156 HE1 HIS 19 HE1 HIS 19 24.371 13.503 8.997 157 HE2 HIS 19 HE2 HIS 19 24.488 12.817 6.554 158 H PHE 20 HN PHE 20 26.508 19.217 8.417 159 HA PHE 20 HA PHE 20 23.933 18.598 9.536 160 HB2 PHE 20 HB2 PHE 20 26.357 19.860 10.410 161 HB3 PHE 20 HB1 PHE 20 24.990 20.917 10.766 162 HD1 PHE 20 HD1 PHE 20 26.437 17.549 11.326 163 HD2 PHE 20 HD2 PHE 20 23.289 20.287 12.352 164 HE1 PHE 20 HE1 PHE 20 25.801 16.104 13.240 165 HE2 PHE 20 HE2 PHE 20 22.654 18.842 14.264 166 HZ PHE 20 HZ PHE 20 23.905 16.747 14.716 167 H MET 21 HN MET 21 25.294 21.205 7.614 168 HA MET 21 HA MET 21 23.132 23.029 8.015 169 HB2 MET 21 HB2 MET 21 25.441 22.846 6.112 170 HB3 MET 21 HB1 MET 21 24.163 24.035 5.845 171 HG2 MET 21 HG2 MET 21 24.478 24.870 8.159 172 HG3 MET 21 HG1 MET 21 25.795 23.719 8.380 173 HE1 MET 21 HE1 MET 21 26.742 27.612 7.971 174 HE2 MET 21 HE2 MET 21 27.533 26.308 8.854 175 HE3 MET 21 HE3 MET 21 25.788 26.512 8.976 176 H ALA 22 HN ALA 22 24.053 21.007 5.253 177 HA ALA 22 HA ALA 22 21.839 21.590 3.643 178 HB1 ALA 22 HB1 ALA 22 22.442 19.580 2.388 179 HB2 ALA 22 HB2 ALA 22 23.450 19.030 3.727 180 HB3 ALA 22 HB3 ALA 22 23.896 20.479 2.826 181 H TRP 23 HN TRP 23 22.385 18.967 5.999 182 HA TRP 23 HA TRP 23 19.838 17.810 5.491 183 HB2 TRP 23 HB2 TRP 23 21.865 17.428 7.668 184 HB3 TRP 23 HB1 TRP 23 20.291 16.641 7.739 185 HD1 TRP 23 HD1 TRP 23 23.517 15.648 6.913 186 HE1 TRP 23 HE1 TRP 23 23.625 13.912 5.012 187 HE3 TRP 23 HE3 TRP 23 18.866 16.262 4.869 188 HZ2 TRP 23 HZ2 TRP 23 21.967 12.919 2.899 189 HZ3 TRP 23 HZ3 TRP 23 18.166 14.929 2.907 190 HH2 TRP 23 HH2 TRP 23 19.706 13.247 1.925 191 H THR 24 HN THR 24 20.966 20.316 7.611 192 HA THR 24 HA THR 24 18.773 20.352 9.402 193 HB THR 24 HB THR 24 20.894 22.273 8.572 194 HG1 THR 24 HG1 THR 24 21.548 21.853 10.537 195 HG21 THR 24 HG21 THR 24 19.083 23.802 8.633 196 HG22 THR 24 HG22 THR 24 19.824 23.907 10.229 197 HG23 THR 24 HG23 THR 24 18.336 22.987 10.008 198 H ILE 25 HN ILE 25 19.436 22.364 6.535 199 HA ILE 25 HA ILE 25 16.950 23.692 6.502 200 HB ILE 25 HB ILE 25 18.924 23.099 4.292 201 HG12 ILE 25 HG12 ILE 25 18.282 25.728 5.640 202 HG13 ILE 25 HG11 ILE 25 19.495 24.625 6.293 203 HG21 ILE 25 HG21 ILE 25 17.669 24.996 3.127 204 HG22 ILE 25 HG22 ILE 25 16.380 24.737 4.302 205 HG23 ILE 25 HG23 ILE 25 16.830 23.445 3.189 206 HD11 ILE 25 HD11 ILE 25 20.647 26.191 4.867 207 HD12 ILE 25 HD12 ILE 25 19.490 25.935 3.561 208 HD13 ILE 25 HD13 ILE 25 20.602 24.646 4.019 209 H GLY 26 HN GLY 26 18.033 20.712 4.944 210 HA2 GLY 26 HA2 GLY 26 15.725 20.213 3.390 211 HA3 GLY 26 HA1 GLY 26 16.878 18.995 3.926 212 H HIS 27 HN HIS 27 16.577 19.361 6.710 213 HA HIS 27 HA HIS 27 14.338 17.692 7.234 214 HB2 HIS 27 HB2 HIS 27 16.170 17.467 8.710 215 HB3 HIS 27 HB1 HIS 27 16.243 19.203 9.012 216 HD2 HIS 27 HD2 HIS 27 14.853 19.964 11.263 217 HE1 HIS 27 HE1 HIS 27 12.377 16.564 11.628 218 HE2 HIS 27 HE2 HIS 27 13.028 18.772 12.701 219 H LEU 28 HN LEU 28 14.924 21.154 7.642 220 HA LEU 28 HA LEU 28 12.575 21.764 9.084 221 HB2 LEU 28 HB2 LEU 28 14.714 23.202 8.505 222 HB3 LEU 28 HB1 LEU 28 13.727 23.718 7.137 223 HG LEU 28 HG LEU 28 11.868 24.070 8.946 224 HD11 LEU 28 HD11 LEU 28 12.887 24.766 11.136 225 HD12 LEU 28 HD12 LEU 28 14.420 24.090 10.584 226 HD13 LEU 28 HD13 LEU 28 13.022 23.038 10.813 227 HD21 LEU 28 HD21 LEU 28 12.577 26.371 9.211 228 HD22 LEU 28 HD22 LEU 28 13.067 25.838 7.603 229 HD23 LEU 28 HD23 LEU 28 14.259 25.936 8.899 230 H ASN 29 HN ASN 29 10.543 22.406 8.438 231 HA ASN 29 HA ASN 29 9.710 21.513 5.796 232 HB2 ASN 29 HB2 ASN 29 8.261 22.448 8.265 233 HB3 ASN 29 HB1 ASN 29 7.418 22.234 6.732 234 HD21 ASN 29 HD21 ASN 29 8.823 20.555 9.454 235 HD22 ASN 29 HD22 ASN 29 8.465 18.985 8.918 236 H GLN 30 HN GLN 30 9.694 22.832 4.104 237 HA GLN 30 HA GLN 30 9.265 25.724 4.573 238 HB2 GLN 30 HB2 GLN 30 11.582 24.974 3.761 239 HB3 GLN 30 HB1 GLN 30 10.789 24.573 2.239 240 HG2 GLN 30 HG2 GLN 30 11.513 26.788 1.902 241 HG3 GLN 30 HG1 GLN 30 9.821 26.978 2.357 242 HE21 GLN 30 HE21 GLN 30 11.257 29.214 2.837 243 HE22 GLN 30 HE22 GLN 30 11.655 29.373 4.479 244 H ILE 31 HN ILE 31 7.359 26.374 3.821 245 HA ILE 31 HA ILE 31 6.270 25.039 1.413 246 HB ILE 31 HB ILE 31 4.729 26.208 3.746 247 HG12 ILE 31 HG12 ILE 31 4.996 23.319 2.861 248 HG13 ILE 31 HG11 ILE 31 5.945 24.027 4.169 249 HG21 ILE 31 HG21 ILE 31 2.792 25.145 2.573 250 HG22 ILE 31 HG22 ILE 31 3.859 24.772 1.218 251 HG23 ILE 31 HG23 ILE 31 3.522 26.451 1.641 252 HD11 ILE 31 HD11 ILE 31 2.915 23.936 4.064 253 HD12 ILE 31 HD12 ILE 31 3.885 24.597 5.381 254 HD13 ILE 31 HD13 ILE 31 3.931 22.868 5.033 255 H LYS 32 HN LYS 32 6.131 26.352 -0.286 256 HA LYS 32 HA LYS 32 6.584 29.175 -0.060 257 HB2 LYS 32 HB2 LYS 32 6.935 27.367 -2.057 258 HB3 LYS 32 HB1 LYS 32 5.433 28.132 -2.576 259 HG2 LYS 32 HG2 LYS 32 7.189 29.436 -3.536 260 HG3 LYS 32 HG1 LYS 32 6.593 30.372 -2.165 261 HD2 LYS 32 HD2 LYS 32 8.799 30.464 -1.591 262 HD3 LYS 32 HD1 LYS 32 8.493 28.852 -0.941 263 HE2 LYS 32 HE2 LYS 32 10.352 28.464 -2.300 264 HE3 LYS 32 HE1 LYS 32 9.023 28.064 -3.388 265 HZ1 LYS 32 HZ1 LYS 32 9.176 30.166 -4.422 266 HZ2 LYS 32 HZ2 LYS 32 10.764 29.568 -4.330 267 HZ3 LYS 32 HZ3 LYS 32 10.238 30.762 -3.242 268 H ARG 33 HN ARG 33 4.965 30.130 1.133 269 HA ARG 33 HA ARG 33 2.174 29.681 0.456 270 HB2 ARG 33 HB2 ARG 33 3.537 30.481 2.759 271 HB3 ARG 33 HB1 ARG 33 2.673 31.925 2.227 272 HG2 ARG 33 HG2 ARG 33 0.569 30.785 2.242 273 HG3 ARG 33 HG1 ARG 33 1.348 29.213 2.429 274 HD2 ARG 33 HD2 ARG 33 0.382 30.079 4.565 275 HD3 ARG 33 HD1 ARG 33 2.120 29.805 4.653 276 HE ARG 33 HE ARG 33 2.419 32.088 4.919 277 HH11 ARG 33 HH11 ARG 33 -0.790 31.429 3.739 278 HH12 ARG 33 HH12 ARG 33 -1.326 33.063 3.935 279 HH21 ARG 33 HH21 ARG 33 1.696 34.208 5.170 280 HH22 ARG 33 HH22 ARG 33 0.071 34.629 4.741 281 H1 MET 1 HT1 MET 1 45.663 17.487 31.015 282 H2 MET 1 HT2 MET 1 45.102 18.579 32.188 283 H3 MET 1 HT3 MET 1 44.097 18.128 30.895 284 HA MET 1 HA MET 1 44.512 15.735 31.850 285 HB2 MET 1 HB2 MET 1 45.536 17.573 33.864 286 HB3 MET 1 HB1 MET 1 44.234 16.567 34.504 287 HG2 MET 1 HG2 MET 1 45.414 14.559 33.555 288 HG3 MET 1 HG1 MET 1 46.762 15.613 33.132 289 HE1 MET 1 HE1 MET 1 48.298 16.633 34.466 290 HE2 MET 1 HE2 MET 1 48.480 16.598 36.218 291 HE3 MET 1 HE3 MET 1 47.249 17.626 35.487 292 H PHE 2 HN PHE 2 42.948 18.808 32.366 293 HA PHE 2 HA PHE 2 40.560 17.897 33.576 294 HB2 PHE 2 HB2 PHE 2 41.083 20.293 31.803 295 HB3 PHE 2 HB1 PHE 2 39.594 20.028 32.711 296 HD1 PHE 2 HD1 PHE 2 43.098 21.012 32.888 297 HD2 PHE 2 HD2 PHE 2 39.639 19.958 35.203 298 HE1 PHE 2 HE1 PHE 2 44.162 21.971 34.912 299 HE2 PHE 2 HE2 PHE 2 40.702 20.917 37.229 300 HZ PHE 2 HZ PHE 2 42.963 21.924 37.082 301 H GLU 3 HN GLU 3 41.556 18.231 30.197 302 HA GLU 3 HA GLU 3 38.952 17.348 29.264 303 HB2 GLU 3 HB2 GLU 3 41.490 18.039 27.772 304 HB3 GLU 3 HB1 GLU 3 39.972 17.587 26.997 305 HG2 GLU 3 HG2 GLU 3 39.897 19.941 27.015 306 HG3 GLU 3 HG1 GLU 3 38.919 19.488 28.409 307 HA PRO 4 HA PRO 4 40.004 13.065 28.980 308 HB2 PRO 4 HB2 PRO 4 38.527 12.288 26.811 309 HB3 PRO 4 HB1 PRO 4 37.819 12.641 28.398 310 HG2 PRO 4 HG2 PRO 4 37.919 14.326 25.950 311 HG3 PRO 4 HG1 PRO 4 36.620 14.136 27.140 312 HD2 PRO 4 HD2 PRO 4 38.319 16.293 27.104 313 HD3 PRO 4 HD1 PRO 4 37.528 15.695 28.579 314 H PHE 5 HN PHE 5 40.013 14.707 25.810 315 HA PHE 5 HA PHE 5 42.608 13.457 25.218 316 HB2 PHE 5 HB2 PHE 5 40.071 13.138 23.679 317 HB3 PHE 5 HB1 PHE 5 41.576 13.294 22.773 318 HD1 PHE 5 HD1 PHE 5 39.940 11.368 25.521 319 HD2 PHE 5 HD2 PHE 5 43.079 11.478 22.591 320 HE1 PHE 5 HE1 PHE 5 40.488 8.999 26.018 321 HE2 PHE 5 HE2 PHE 5 43.626 9.111 23.088 322 HZ PHE 5 HZ PHE 5 42.331 7.872 24.801 323 H GLN 6 HN GLN 6 40.234 15.432 23.454 324 HA GLN 6 HA GLN 6 41.861 17.805 23.638 325 HB2 GLN 6 HB2 GLN 6 42.081 17.966 21.101 326 HB3 GLN 6 HB1 GLN 6 43.158 16.826 21.907 327 HG2 GLN 6 HG2 GLN 6 41.685 14.969 21.339 328 HG3 GLN 6 HG1 GLN 6 40.513 16.076 20.635 329 HE21 GLN 6 HE21 GLN 6 42.985 13.993 19.790 330 HE22 GLN 6 HE22 GLN 6 43.425 14.689 18.306 331 H ILE 7 HN ILE 7 40.890 19.615 22.405 332 HA ILE 7 HA ILE 7 38.199 19.954 22.967 333 HB ILE 7 HB ILE 7 38.290 21.848 21.315 334 HG12 ILE 7 HG12 ILE 7 41.030 22.007 20.794 335 HG13 ILE 7 HG11 ILE 7 40.631 20.332 20.429 336 HG21 ILE 7 HG21 ILE 7 39.975 23.115 22.575 337 HG22 ILE 7 HG22 ILE 7 40.649 21.611 23.204 338 HG23 ILE 7 HG23 ILE 7 39.020 22.107 23.663 339 HD11 ILE 7 HD11 ILE 7 38.638 21.257 19.100 340 HD12 ILE 7 HD12 ILE 7 40.239 21.504 18.402 341 HD13 ILE 7 HD13 ILE 7 39.426 22.829 19.236 342 H LEU 8 HN LEU 8 39.724 18.681 20.062 343 HA LEU 8 HA LEU 8 37.433 18.683 18.400 344 HB2 LEU 8 HB2 LEU 8 39.948 18.312 17.812 345 HB3 LEU 8 HB1 LEU 8 39.610 16.622 18.183 346 HG LEU 8 HG LEU 8 37.598 17.918 16.455 347 HD11 LEU 8 HD11 LEU 8 40.383 17.342 15.395 348 HD12 LEU 8 HD12 LEU 8 39.716 18.957 15.635 349 HD13 LEU 8 HD13 LEU 8 38.993 17.872 14.449 350 HD21 LEU 8 HD21 LEU 8 37.639 15.781 15.371 351 HD22 LEU 8 HD22 LEU 8 37.805 15.453 17.095 352 HD23 LEU 8 HD23 LEU 8 39.221 15.393 16.046 353 H SER 9 HN SER 9 38.660 16.456 20.796 354 HA SER 9 HA SER 9 36.925 14.274 20.140 355 HB2 SER 9 HB2 SER 9 38.544 14.923 22.605 356 HB3 SER 9 HB1 SER 9 37.577 13.460 22.445 357 HG SER 9 HG SER 9 40.008 14.003 21.459 358 H ILE 10 HN ILE 10 36.807 16.959 22.445 359 HA ILE 10 HA ILE 10 34.492 16.149 23.845 360 HB ILE 10 HB ILE 10 35.679 18.879 23.317 361 HG12 ILE 10 HG12 ILE 10 35.565 17.284 25.885 362 HG13 ILE 10 HG11 ILE 10 36.890 17.111 24.733 363 HG21 ILE 10 HG21 ILE 10 33.342 19.248 23.747 364 HG22 ILE 10 HG22 ILE 10 34.197 19.571 25.256 365 HG23 ILE 10 HG23 ILE 10 33.331 18.049 25.041 366 HD11 ILE 10 HD11 ILE 10 37.460 19.455 24.940 367 HD12 ILE 10 HD12 ILE 10 37.349 18.776 26.565 368 HD13 ILE 10 HD13 ILE 10 36.031 19.760 25.929 369 H CYS 11 HN CYS 11 34.886 18.322 21.039 370 HA CYS 11 HA CYS 11 32.141 18.906 20.719 371 HB2 CYS 11 HB2 CYS 11 34.435 18.891 18.754 372 HB3 CYS 11 HB1 CYS 11 32.814 19.453 18.344 373 HG CYS 11 HG CYS 11 33.422 20.973 20.737 374 H SER 12 HN SER 12 34.190 16.513 19.048 375 HA SER 12 HA SER 12 32.268 15.378 17.419 376 HB2 SER 12 HB2 SER 12 34.673 14.823 17.310 377 HB3 SER 12 HB1 SER 12 34.533 13.938 18.827 378 HG SER 12 HG SER 12 34.278 12.456 17.215 379 H PHE 13 HN PHE 13 33.056 14.582 20.783 380 HA PHE 13 HA PHE 13 31.362 12.379 21.087 381 HB2 PHE 13 HB2 PHE 13 32.967 12.849 22.795 382 HB3 PHE 13 HB1 PHE 13 32.309 14.464 23.058 383 HD1 PHE 13 HD1 PHE 13 31.552 10.829 23.372 384 HD2 PHE 13 HD2 PHE 13 30.442 14.827 24.482 385 HE1 PHE 13 HE1 PHE 13 29.961 9.924 25.046 386 HE2 PHE 13 HE2 PHE 13 28.852 13.922 26.156 387 HZ PHE 13 HZ PHE 13 28.612 11.470 26.438 388 H ILE 14 HN ILE 14 30.735 15.838 21.717 389 HA ILE 14 HA ILE 14 28.070 15.505 22.589 390 HB ILE 14 HB ILE 14 29.441 17.876 21.301 391 HG12 ILE 14 HG12 ILE 14 30.285 16.923 23.536 392 HG13 ILE 14 HG11 ILE 14 29.860 18.631 23.516 393 HG21 ILE 14 HG21 ILE 14 27.540 19.122 22.511 394 HG22 ILE 14 HG22 ILE 14 26.727 17.558 22.594 395 HG23 ILE 14 HG23 ILE 14 27.121 18.267 21.028 396 HD11 ILE 14 HD11 ILE 14 27.854 16.525 24.333 397 HD12 ILE 14 HD12 ILE 14 27.825 18.254 24.665 398 HD13 ILE 14 HD13 ILE 14 28.990 17.219 25.488 399 H LEU 15 HN LEU 15 29.422 16.204 19.391 400 HA LEU 15 HA LEU 15 26.967 16.523 18.033 401 HB2 LEU 15 HB2 LEU 15 29.702 15.675 17.056 402 HB3 LEU 15 HB1 LEU 15 28.343 16.013 15.984 403 HG LEU 15 HG LEU 15 29.373 17.992 18.033 404 HD11 LEU 15 HD11 LEU 15 29.986 17.782 15.069 405 HD12 LEU 15 HD12 LEU 15 31.133 17.519 16.383 406 HD13 LEU 15 HD13 LEU 15 30.455 19.125 16.112 407 HD21 LEU 15 HD21 LEU 15 28.139 19.565 16.422 408 HD22 LEU 15 HD22 LEU 15 27.126 18.506 17.401 409 HD23 LEU 15 HD23 LEU 15 27.434 18.114 15.709 410 H SER 16 HN SER 16 28.846 13.712 18.894 411 HA SER 16 HA SER 16 27.427 11.863 17.211 412 HB2 SER 16 HB2 SER 16 29.201 11.441 19.618 413 HB3 SER 16 HB1 SER 16 28.534 10.135 18.641 414 HG SER 16 HG SER 16 29.638 10.955 16.867 415 H ALA 17 HN ALA 17 27.340 12.609 20.695 416 HA ALA 17 HA ALA 17 25.284 10.800 21.359 417 HB1 ALA 17 HB1 ALA 17 26.392 11.608 23.227 418 HB2 ALA 17 HB2 ALA 17 24.924 12.581 23.268 419 HB3 ALA 17 HB3 ALA 17 26.419 13.266 22.628 420 H LEU 18 HN LEU 18 25.200 14.181 20.291 421 HA LEU 18 HA LEU 18 22.391 14.489 20.621 422 HB2 LEU 18 HB2 LEU 18 24.605 16.011 19.371 423 HB3 LEU 18 HB1 LEU 18 22.983 16.336 18.756 424 HG LEU 18 HG LEU 18 22.176 16.920 20.933 425 HD11 LEU 18 HD11 LEU 18 23.145 15.322 22.384 426 HD12 LEU 18 HD12 LEU 18 23.871 16.845 22.892 427 HD13 LEU 18 HD13 LEU 18 24.785 15.727 21.882 428 HD21 LEU 18 HD21 LEU 18 24.917 18.067 20.349 429 HD22 LEU 18 HD22 LEU 18 23.861 18.711 21.605 430 HD23 LEU 18 HD23 LEU 18 23.346 18.746 19.920 431 H HIS 19 HN HIS 19 24.433 13.558 17.871 432 HA HIS 19 HA HIS 19 22.459 13.576 15.895 433 HB2 HIS 19 HB2 HIS 19 24.893 13.364 15.480 434 HB3 HIS 19 HB1 HIS 19 24.841 11.722 16.125 435 HD2 HIS 19 HD2 HIS 19 23.289 13.697 13.058 436 HE1 HIS 19 HE1 HIS 19 23.272 9.567 12.185 437 HE2 HIS 19 HE2 HIS 19 22.790 11.879 11.251 438 H PHE 20 HN PHE 20 23.439 11.033 18.141 439 HA PHE 20 HA PHE 20 21.640 9.078 17.035 440 HB2 PHE 20 HB2 PHE 20 23.768 9.124 18.959 441 HB3 PHE 20 HB1 PHE 20 22.351 8.359 19.676 442 HD1 PHE 20 HD1 PHE 20 24.771 8.219 16.873 443 HD2 PHE 20 HD2 PHE 20 21.490 6.266 18.843 444 HE1 PHE 20 HE1 PHE 20 25.205 6.160 15.558 445 HE2 PHE 20 HE2 PHE 20 21.925 4.209 17.528 446 HZ PHE 20 HZ PHE 20 23.783 4.152 15.882 447 H MET 21 HN MET 21 21.537 11.439 19.635 448 HA MET 21 HA MET 21 19.205 10.381 20.903 449 HB2 MET 21 HB2 MET 21 20.744 12.948 21.067 450 HB3 MET 21 HB1 MET 21 19.172 12.804 21.858 451 HG2 MET 21 HG2 MET 21 19.965 10.763 23.024 452 HG3 MET 21 HG1 MET 21 21.548 10.968 22.275 453 HE1 MET 21 HE1 MET 21 21.202 11.799 26.200 454 HE2 MET 21 HE2 MET 21 22.558 11.198 25.253 455 HE3 MET 21 HE3 MET 21 20.959 10.495 25.030 456 H ALA 22 HN ALA 22 19.719 13.224 18.847 457 HA ALA 22 HA ALA 22 17.039 14.003 18.657 458 HB1 ALA 22 HB1 ALA 22 17.745 15.321 16.721 459 HB2 ALA 22 HB2 ALA 22 19.236 14.386 16.610 460 HB3 ALA 22 HB3 ALA 22 18.954 15.434 18.000 461 H TRP 23 HN TRP 23 19.008 11.886 16.569 462 HA TRP 23 HA TRP 23 16.856 11.458 14.759 463 HB2 TRP 23 HB2 TRP 23 19.494 10.091 15.164 464 HB3 TRP 23 HB1 TRP 23 18.307 9.464 14.024 465 HD1 TRP 23 HD1 TRP 23 21.244 11.302 13.772 466 HE1 TRP 23 HE1 TRP 23 21.215 13.070 11.897 467 HE3 TRP 23 HE3 TRP 23 16.205 11.667 12.956 468 HZ2 TRP 23 HZ2 TRP 23 19.312 14.463 10.273 469 HZ3 TRP 23 HZ3 TRP 23 15.312 13.234 11.265 470 HH2 TRP 23 HH2 TRP 23 16.863 14.623 9.907 471 H THR 24 HN THR 24 17.855 9.945 17.713 472 HA THR 24 HA THR 24 16.436 7.507 17.419 473 HB THR 24 HB THR 24 17.563 9.069 19.690 474 HG1 THR 24 HG1 THR 24 18.900 7.431 19.693 475 HG21 THR 24 HG21 THR 24 15.519 8.445 20.715 476 HG22 THR 24 HG22 THR 24 16.670 7.199 21.197 477 HG23 THR 24 HG23 THR 24 15.505 6.873 19.914 478 H ILE 25 HN ILE 25 15.562 10.502 19.157 479 HA ILE 25 HA ILE 25 12.935 9.717 19.813 480 HB ILE 25 HB ILE 25 14.184 12.447 19.462 481 HG12 ILE 25 HG12 ILE 25 13.306 11.048 21.994 482 HG13 ILE 25 HG11 ILE 25 14.918 10.812 21.318 483 HG21 ILE 25 HG21 ILE 25 12.151 13.177 20.829 484 HG22 ILE 25 HG22 ILE 25 11.428 11.626 20.404 485 HG23 ILE 25 HG23 ILE 25 11.839 12.783 19.138 486 HD11 ILE 25 HD11 ILE 25 15.076 12.595 22.933 487 HD12 ILE 25 HD12 ILE 25 13.680 13.420 22.238 488 HD13 ILE 25 HD13 ILE 25 15.192 13.326 21.333 489 H GLY 26 HN GLY 26 14.242 11.457 17.028 490 HA2 GLY 26 HA2 GLY 26 11.792 12.111 15.781 491 HA3 GLY 26 HA1 GLY 26 13.346 11.961 14.966 492 H HIS 27 HN HIS 27 13.854 9.254 15.595 493 HA HIS 27 HA HIS 27 12.456 7.944 13.491 494 HB2 HIS 27 HB2 HIS 27 14.651 7.174 13.910 495 HB3 HIS 27 HB1 HIS 27 14.338 6.972 15.634 496 HD2 HIS 27 HD2 HIS 27 13.582 4.409 16.300 497 HE1 HIS 27 HE1 HIS 27 12.389 3.110 12.464 498 HE2 HIS 27 HE2 HIS 27 12.714 2.398 14.880 499 H LEU 28 HN LEU 28 12.155 7.885 17.012 500 HA LEU 28 HA LEU 28 10.325 5.738 17.190 501 HB2 LEU 28 HB2 LEU 28 11.682 7.058 19.033 502 HB3 LEU 28 HB1 LEU 28 10.209 8.024 19.114 503 HG LEU 28 HG LEU 28 9.002 5.703 19.214 504 HD11 LEU 28 HD11 LEU 28 10.432 4.014 20.405 505 HD12 LEU 28 HD12 LEU 28 11.833 5.033 20.070 506 HD13 LEU 28 HD13 LEU 28 10.930 4.308 18.740 507 HD21 LEU 28 HD21 LEU 28 9.096 5.771 21.633 508 HD22 LEU 28 HD22 LEU 28 9.174 7.431 21.044 509 HD23 LEU 28 HD23 LEU 28 10.641 6.621 21.595 510 H ASN 29 HN ASN 29 8.099 5.675 17.225 511 HA ASN 29 HA ASN 29 6.748 7.845 15.831 512 HB2 ASN 29 HB2 ASN 29 5.963 5.062 16.674 513 HB3 ASN 29 HB1 ASN 29 4.769 6.209 16.069 514 HD21 ASN 29 HD21 ASN 29 7.371 4.074 15.142 515 HD22 ASN 29 HD22 ASN 29 7.311 4.405 13.478 516 H GLN 30 HN GLN 30 5.829 9.473 16.885 517 HA GLN 30 HA GLN 30 4.793 8.982 19.615 518 HB2 GLN 30 HB2 GLN 30 6.843 10.508 19.370 519 HB3 GLN 30 HB1 GLN 30 5.748 11.656 18.599 520 HG2 GLN 30 HG2 GLN 30 5.688 12.292 20.865 521 HG3 GLN 30 HG1 GLN 30 4.245 11.295 20.682 522 HE21 GLN 30 HE21 GLN 30 5.081 11.405 23.247 523 HE22 GLN 30 HE22 GLN 30 5.921 10.002 23.702 524 H ILE 31 HN ILE 31 2.644 9.055 19.664 525 HA ILE 31 HA ILE 31 1.258 10.908 17.819 526 HB ILE 31 HB ILE 31 0.281 8.229 18.846 527 HG12 ILE 31 HG12 ILE 31 1.037 9.057 16.027 528 HG13 ILE 31 HG11 ILE 31 2.120 8.175 17.104 529 HG21 ILE 31 HG21 ILE 31 -1.557 8.638 17.199 530 HG22 ILE 31 HG22 ILE 31 -0.917 10.260 16.937 531 HG23 ILE 31 HG23 ILE 31 -1.551 9.806 18.519 532 HD11 ILE 31 HD11 ILE 31 -0.635 7.238 16.252 533 HD12 ILE 31 HD12 ILE 31 0.482 6.353 17.292 534 HD13 ILE 31 HD13 ILE 31 0.889 6.638 15.599 535 H LYS 32 HN LYS 32 0.227 12.500 18.836 536 HA LYS 32 HA LYS 32 -0.068 12.533 21.687 537 HB2 LYS 32 HB2 LYS 32 0.112 14.471 19.792 538 HB3 LYS 32 HB1 LYS 32 -1.627 14.471 20.088 539 HG2 LYS 32 HG2 LYS 32 -0.702 16.014 21.660 540 HG3 LYS 32 HG1 LYS 32 -1.064 14.553 22.580 541 HD2 LYS 32 HD2 LYS 32 1.094 14.770 23.290 542 HD3 LYS 32 HD1 LYS 32 1.469 14.002 21.747 543 HE2 LYS 32 HE2 LYS 32 2.828 15.899 21.667 544 HE3 LYS 32 HE1 LYS 32 1.387 16.457 20.817 545 HZ1 LYS 32 HZ1 LYS 32 0.616 17.549 22.747 546 HZ2 LYS 32 HZ2 LYS 32 2.249 17.982 22.580 547 HZ3 LYS 32 HZ3 LYS 32 1.790 16.820 23.730 548 H ARG 33 HN ARG 33 -1.420 10.893 22.351 549 HA ARG 33 HA ARG 33 -4.042 10.565 21.142 550 HB2 ARG 33 HB2 ARG 33 -2.293 8.891 22.534 551 HB3 ARG 33 HB1 ARG 33 -3.645 9.144 23.639 552 HG2 ARG 33 HG2 ARG 33 -5.234 8.377 22.022 553 HG3 ARG 33 HG1 ARG 33 -4.034 8.414 20.729 554 HD2 ARG 33 HD2 ARG 33 -4.467 6.106 21.584 555 HD3 ARG 33 HD1 ARG 33 -2.787 6.606 21.765 556 HE ARG 33 HE ARG 33 -3.061 6.533 24.066 557 HH11 ARG 33 HH11 ARG 33 -6.166 6.529 22.486 558 HH12 ARG 33 HH12 ARG 33 -7.040 6.216 23.947 559 HH21 ARG 33 HH21 ARG 33 -4.224 6.120 25.953 560 HH22 ARG 33 HH22 ARG 33 -5.950 5.985 25.898 561 H1 MET 1 HT1 MET 1 48.609 -3.462 24.134 562 H2 MET 1 HT2 MET 1 48.181 -4.779 25.118 563 H3 MET 1 HT3 MET 1 46.980 -3.908 24.290 564 HA MET 1 HA MET 1 48.386 -4.612 22.205 565 HB2 MET 1 HB2 MET 1 49.433 -6.179 24.425 566 HB3 MET 1 HB1 MET 1 48.787 -7.212 23.148 567 HG2 MET 1 HG2 MET 1 50.118 -5.872 21.487 568 HG3 MET 1 HG1 MET 1 50.865 -5.027 22.843 569 HE1 MET 1 HE1 MET 1 52.380 -5.763 24.371 570 HE2 MET 1 HE2 MET 1 53.146 -7.340 24.541 571 HE3 MET 1 HE3 MET 1 51.494 -7.106 25.105 572 H PHE 2 HN PHE 2 46.248 -5.699 24.734 573 HA PHE 2 HA PHE 2 44.796 -7.647 23.287 574 HB2 PHE 2 HB2 PHE 2 43.951 -5.851 25.571 575 HB3 PHE 2 HB1 PHE 2 43.008 -7.215 24.969 576 HD1 PHE 2 HD1 PHE 2 45.903 -6.180 26.926 577 HD2 PHE 2 HD2 PHE 2 43.910 -9.534 25.130 578 HE1 PHE 2 HE1 PHE 2 47.251 -7.726 28.319 579 HE2 PHE 2 HE2 PHE 2 45.257 -11.081 26.524 580 HZ PHE 2 HZ PHE 2 46.928 -10.177 28.119 581 H GLU 3 HN GLU 3 44.443 -4.140 23.601 582 HA GLU 3 HA GLU 3 42.067 -4.154 21.933 583 HB2 GLU 3 HB2 GLU 3 43.623 -1.887 23.189 584 HB3 GLU 3 HB1 GLU 3 42.139 -1.680 22.258 585 HG2 GLU 3 HG2 GLU 3 41.377 -1.771 24.485 586 HG3 GLU 3 HG1 GLU 3 41.112 -3.408 23.892 587 HA PRO 4 HA PRO 4 44.187 -3.437 18.122 588 HB2 PRO 4 HB2 PRO 4 42.367 -1.904 16.770 589 HB3 PRO 4 HB1 PRO 4 42.166 -3.645 17.041 590 HG2 PRO 4 HG2 PRO 4 40.924 -1.349 18.468 591 HG3 PRO 4 HG1 PRO 4 40.225 -2.914 18.017 592 HD2 PRO 4 HD2 PRO 4 41.086 -2.331 20.558 593 HD3 PRO 4 HD1 PRO 4 41.059 -3.977 19.890 594 H PHE 5 HN PHE 5 42.633 -0.496 19.417 595 HA PHE 5 HA PHE 5 45.123 0.986 18.916 596 HB2 PHE 5 HB2 PHE 5 42.434 1.555 17.753 597 HB3 PHE 5 HB1 PHE 5 43.428 2.922 18.252 598 HD1 PHE 5 HD1 PHE 5 43.465 -0.186 16.185 599 HD2 PHE 5 HD2 PHE 5 45.249 3.650 16.930 600 HE1 PHE 5 HE1 PHE 5 44.820 -0.414 14.121 601 HE2 PHE 5 HE2 PHE 5 46.605 3.421 14.865 602 HZ PHE 5 HZ PHE 5 46.389 1.387 13.454 603 H GLN 6 HN GLN 6 41.810 1.778 19.978 604 HA GLN 6 HA GLN 6 42.630 2.120 22.715 605 HB2 GLN 6 HB2 GLN 6 41.921 4.572 22.716 606 HB3 GLN 6 HB1 GLN 6 43.494 4.214 22.004 607 HG2 GLN 6 HG2 GLN 6 42.539 4.271 19.762 608 HG3 GLN 6 HG1 GLN 6 40.925 4.501 20.425 609 HE21 GLN 6 HE21 GLN 6 43.463 6.194 19.066 610 HE22 GLN 6 HE22 GLN 6 43.150 7.724 19.729 611 H ILE 7 HN ILE 7 40.814 2.897 24.059 612 HA ILE 7 HA ILE 7 38.495 1.436 23.668 613 HB ILE 7 HB ILE 7 37.453 2.980 25.356 614 HG12 ILE 7 HG12 ILE 7 39.675 4.420 26.246 615 HG13 ILE 7 HG11 ILE 7 39.695 4.657 24.502 616 HG21 ILE 7 HG21 ILE 7 39.007 2.359 27.156 617 HG22 ILE 7 HG22 ILE 7 40.269 2.034 25.966 618 HG23 ILE 7 HG23 ILE 7 38.821 1.027 26.015 619 HD11 ILE 7 HD11 ILE 7 37.190 5.185 24.699 620 HD12 ILE 7 HD12 ILE 7 38.306 6.393 25.335 621 HD13 ILE 7 HD13 ILE 7 37.470 5.302 26.437 622 H LEU 8 HN LEU 8 39.249 4.718 22.637 623 HA LEU 8 HA LEU 8 36.643 5.471 21.840 624 HB2 LEU 8 HB2 LEU 8 38.799 6.906 22.151 625 HB3 LEU 8 HB1 LEU 8 39.126 6.473 20.472 626 HG LEU 8 HG LEU 8 36.359 7.367 20.987 627 HD11 LEU 8 HD11 LEU 8 38.660 9.342 21.144 628 HD12 LEU 8 HD12 LEU 8 37.664 8.851 22.515 629 HD13 LEU 8 HD13 LEU 8 36.940 9.733 21.171 630 HD21 LEU 8 HD21 LEU 8 36.666 8.440 18.866 631 HD22 LEU 8 HD22 LEU 8 37.496 6.888 18.749 632 HD23 LEU 8 HD23 LEU 8 38.422 8.366 19.008 633 H SER 9 HN SER 9 39.218 3.708 20.260 634 HA SER 9 HA SER 9 38.090 3.752 17.635 635 HB2 SER 9 HB2 SER 9 40.173 1.992 18.929 636 HB3 SER 9 HB1 SER 9 39.692 1.835 17.241 637 HG SER 9 HG SER 9 41.369 3.594 18.372 638 H ILE 10 HN ILE 10 37.973 1.490 20.356 639 HA ILE 10 HA ILE 10 36.611 -0.606 19.049 640 HB ILE 10 HB ILE 10 36.679 0.249 21.948 641 HG12 ILE 10 HG12 ILE 10 37.921 -2.165 20.612 642 HG13 ILE 10 HG11 ILE 10 38.766 -0.620 20.729 643 HG21 ILE 10 HG21 ILE 10 34.629 -0.976 21.669 644 HG22 ILE 10 HG22 ILE 10 35.805 -2.099 22.351 645 HG23 ILE 10 HG23 ILE 10 35.414 -2.168 20.633 646 HD11 ILE 10 HD11 ILE 10 38.649 -0.666 23.146 647 HD12 ILE 10 HD12 ILE 10 39.297 -2.214 22.606 648 HD13 ILE 10 HD13 ILE 10 37.612 -2.092 23.113 649 H CYS 11 HN CYS 11 35.370 2.117 20.990 650 HA CYS 11 HA CYS 11 32.636 1.452 20.738 651 HB2 CYS 11 HB2 CYS 11 34.023 4.093 21.210 652 HB3 CYS 11 HB1 CYS 11 32.270 3.901 21.249 653 HG CYS 11 HG CYS 11 33.166 1.841 23.080 654 H SER 12 HN SER 12 34.615 3.774 18.897 655 HA SER 12 HA SER 12 32.685 4.660 17.124 656 HB2 SER 12 HB2 SER 12 34.962 5.608 17.269 657 HB3 SER 12 HB1 SER 12 35.612 4.154 16.518 658 HG SER 12 HG SER 12 35.280 5.607 14.891 659 H PHE 13 HN PHE 13 34.773 1.800 16.864 660 HA PHE 13 HA PHE 13 34.006 0.964 14.315 661 HB2 PHE 13 HB2 PHE 13 35.878 -0.086 15.370 662 HB3 PHE 13 HB1 PHE 13 34.897 -0.593 16.746 663 HD1 PHE 13 HD1 PHE 13 35.411 -1.079 13.088 664 HD2 PHE 13 HD2 PHE 13 33.605 -2.586 16.683 665 HE1 PHE 13 HE1 PHE 13 34.827 -3.184 11.914 666 HE2 PHE 13 HE2 PHE 13 33.023 -4.691 15.509 667 HZ PHE 13 HZ PHE 13 33.634 -4.991 13.124 668 H ILE 14 HN ILE 14 32.640 0.079 17.489 669 HA ILE 14 HA ILE 14 30.644 -1.650 16.491 670 HB ILE 14 HB ILE 14 30.729 -0.014 19.035 671 HG12 ILE 14 HG12 ILE 14 32.521 -1.796 18.556 672 HG13 ILE 14 HG11 ILE 14 31.630 -1.958 20.066 673 HG21 ILE 14 HG21 ILE 14 29.069 -1.835 19.784 674 HG22 ILE 14 HG22 ILE 14 28.837 -2.164 18.067 675 HG23 ILE 14 HG23 ILE 14 28.447 -0.573 18.722 676 HD11 ILE 14 HD11 ILE 14 30.739 -3.382 17.553 677 HD12 ILE 14 HD12 ILE 14 30.307 -3.735 19.224 678 HD13 ILE 14 HD13 ILE 14 31.933 -4.083 18.641 679 H LEU 15 HN LEU 15 30.566 1.802 17.265 680 HA LEU 15 HA LEU 15 27.819 2.213 16.754 681 HB2 LEU 15 HB2 LEU 15 30.182 4.098 16.640 682 HB3 LEU 15 HB1 LEU 15 28.506 4.623 16.482 683 HG LEU 15 HG LEU 15 29.529 3.023 18.843 684 HD11 LEU 15 HD11 LEU 15 29.137 6.020 18.562 685 HD12 LEU 15 HD12 LEU 15 30.683 5.193 18.752 686 HD13 LEU 15 HD13 LEU 15 29.508 5.180 20.068 687 HD21 LEU 15 HD21 LEU 15 27.414 4.073 19.853 688 HD22 LEU 15 HD22 LEU 15 27.156 2.823 18.638 689 HD23 LEU 15 HD23 LEU 15 26.976 4.523 18.206 690 H SER 16 HN SER 16 30.628 2.134 14.679 691 HA SER 16 HA SER 16 29.338 3.240 12.366 692 HB2 SER 16 HB2 SER 16 31.860 1.608 12.676 693 HB3 SER 16 HB1 SER 16 31.324 2.317 11.155 694 HG SER 16 HG SER 16 31.467 4.347 12.102 695 H ALA 17 HN ALA 17 30.228 -0.071 13.342 696 HA ALA 17 HA ALA 17 29.143 -1.375 11.096 697 HB1 ALA 17 HB1 ALA 17 30.525 -2.756 12.345 698 HB2 ALA 17 HB2 ALA 17 28.937 -3.325 12.858 699 HB3 ALA 17 HB3 ALA 17 29.851 -2.218 13.884 700 H LEU 18 HN LEU 18 27.706 -0.475 14.206 701 HA LEU 18 HA LEU 18 25.213 -1.763 13.729 702 HB2 LEU 18 HB2 LEU 18 26.313 0.148 15.707 703 HB3 LEU 18 HB1 LEU 18 24.561 0.153 15.501 704 HG LEU 18 HG LEU 18 24.404 -2.180 16.012 705 HD11 LEU 18 HD11 LEU 18 26.234 -3.170 14.888 706 HD12 LEU 18 HD12 LEU 18 26.601 -3.426 16.593 707 HD13 LEU 18 HD13 LEU 18 27.408 -2.138 15.701 708 HD21 LEU 18 HD21 LEU 18 26.311 -0.703 17.842 709 HD22 LEU 18 HD22 LEU 18 25.601 -2.262 18.262 710 HD23 LEU 18 HD23 LEU 18 24.562 -0.861 18.003 711 H HIS 19 HN HIS 19 26.383 1.543 13.188 712 HA HIS 19 HA HIS 19 23.949 2.709 12.472 713 HB2 HIS 19 HB2 HIS 19 26.045 3.949 12.925 714 HB3 HIS 19 HB1 HIS 19 26.705 3.356 11.399 715 HD2 HIS 19 HD2 HIS 19 23.693 5.652 12.576 716 HE1 HIS 19 HE1 HIS 19 24.615 6.548 8.555 717 HE2 HIS 19 HE2 HIS 19 23.179 7.208 10.543 718 H PHE 20 HN PHE 20 26.346 1.009 10.509 719 HA PHE 20 HA PHE 20 24.941 1.445 8.040 720 HB2 PHE 20 HB2 PHE 20 27.478 0.382 8.856 721 HB3 PHE 20 HB1 PHE 20 26.683 -0.769 7.782 722 HD1 PHE 20 HD1 PHE 20 27.941 2.706 8.096 723 HD2 PHE 20 HD2 PHE 20 26.257 -0.246 5.466 724 HE1 PHE 20 HE1 PHE 20 28.505 4.122 6.140 725 HE2 PHE 20 HE2 PHE 20 26.821 1.173 3.512 726 HZ PHE 20 HZ PHE 20 27.951 3.362 3.836 727 H MET 21 HN MET 21 25.037 -1.083 10.481 728 HA MET 21 HA MET 21 23.688 -3.056 8.919 729 HB2 MET 21 HB2 MET 21 24.351 -2.725 11.824 730 HB3 MET 21 HB1 MET 21 23.259 -4.011 11.303 731 HG2 MET 21 HG2 MET 21 24.970 -4.787 9.684 732 HG3 MET 21 HG1 MET 21 26.067 -3.537 10.267 733 HE1 MET 21 HE1 MET 21 26.839 -7.352 11.300 734 HE2 MET 21 HE2 MET 21 27.909 -5.979 11.031 735 HE3 MET 21 HE3 MET 21 26.614 -6.316 9.884 736 H ALA 22 HN ALA 22 22.608 -1.011 11.600 737 HA ALA 22 HA ALA 22 19.915 -1.779 11.564 738 HB1 ALA 22 HB1 ALA 22 19.497 0.254 12.857 739 HB2 ALA 22 HB2 ALA 22 21.069 0.898 12.382 740 HB3 ALA 22 HB3 ALA 22 20.974 -0.525 13.420 741 H TRP 23 HN TRP 23 21.597 0.909 9.929 742 HA TRP 23 HA TRP 23 19.193 1.865 8.750 743 HB2 TRP 23 HB2 TRP 23 22.093 2.428 8.234 744 HB3 TRP 23 HB1 TRP 23 20.834 3.095 7.197 745 HD1 TRP 23 HD1 TRP 23 22.823 4.316 9.771 746 HE1 TRP 23 HE1 TRP 23 21.637 6.030 11.289 747 HE3 TRP 23 HE3 TRP 23 17.940 3.325 8.602 748 HZ2 TRP 23 HZ2 TRP 23 18.974 6.865 11.931 749 HZ3 TRP 23 HZ3 TRP 23 16.105 4.574 9.694 750 HH2 TRP 23 HH2 TRP 23 16.616 6.354 11.349 751 H THR 24 HN THR 24 21.545 -0.518 7.833 752 HA THR 24 HA THR 24 20.893 -0.697 5.084 753 HB THR 24 HB THR 24 22.200 -2.464 7.095 754 HG1 THR 24 HG1 THR 24 23.882 -1.970 5.915 755 HG21 THR 24 HG21 THR 24 20.909 -4.124 6.001 756 HG22 THR 24 HG22 THR 24 22.471 -4.150 5.186 757 HG23 THR 24 HG23 THR 24 21.096 -3.348 4.428 758 H ILE 25 HN ILE 25 19.821 -2.694 7.833 759 HA ILE 25 HA ILE 25 17.918 -4.204 6.402 760 HB ILE 25 HB ILE 25 18.102 -3.495 9.334 761 HG12 ILE 25 HG12 ILE 25 18.591 -6.146 7.964 762 HG13 ILE 25 HG11 ILE 25 19.871 -4.946 8.142 763 HG21 ILE 25 HG21 ILE 25 16.532 -5.498 9.566 764 HG22 ILE 25 HG22 ILE 25 16.206 -5.321 7.842 765 HG23 ILE 25 HG23 ILE 25 15.798 -4.015 8.955 766 HD11 ILE 25 HD11 ILE 25 20.027 -6.442 10.028 767 HD12 ILE 25 HD12 ILE 25 18.301 -6.291 10.356 768 HD13 ILE 25 HD13 ILE 25 19.372 -4.916 10.621 769 H GLY 26 HN GLY 26 17.631 -1.175 8.190 770 HA2 GLY 26 HA2 GLY 26 14.825 -0.869 8.014 771 HA3 GLY 26 HA1 GLY 26 15.981 0.439 8.242 772 H HIS 27 HN HIS 27 17.454 0.090 5.860 773 HA HIS 27 HA HIS 27 15.883 1.591 4.028 774 HB2 HIS 27 HB2 HIS 27 18.214 1.974 3.955 775 HB3 HIS 27 HB1 HIS 27 18.574 0.252 3.820 776 HD2 HIS 27 HD2 HIS 27 18.890 -0.582 1.216 777 HE1 HIS 27 HE1 HIS 27 16.916 2.625 -0.693 778 HE2 HIS 27 HE2 HIS 27 18.234 0.487 -1.073 779 H LEU 28 HN LEU 28 16.835 -1.810 4.177 780 HA LEU 28 HA LEU 28 15.887 -2.577 1.631 781 HB2 LEU 28 HB2 LEU 28 17.329 -3.857 3.438 782 HB3 LEU 28 HB1 LEU 28 15.753 -4.466 3.946 783 HG LEU 28 HG LEU 28 15.401 -4.933 1.395 784 HD11 LEU 28 HD11 LEU 28 17.581 -5.517 0.293 785 HD12 LEU 28 HD12 LEU 28 18.416 -4.738 1.636 786 HD13 LEU 28 HD13 LEU 28 17.376 -3.788 0.574 787 HD21 LEU 28 HD21 LEU 28 16.282 -7.169 1.695 788 HD22 LEU 28 HD22 LEU 28 15.659 -6.623 3.252 789 HD23 LEU 28 HD23 LEU 28 17.396 -6.612 2.944 790 H ASN 29 HN ASN 29 13.930 -3.382 0.937 791 HA ASN 29 HA ASN 29 11.607 -2.589 2.502 792 HB2 ASN 29 HB2 ASN 29 12.021 -3.597 -0.305 793 HB3 ASN 29 HB1 ASN 29 10.408 -3.467 0.396 794 HD21 ASN 29 HD21 ASN 29 13.056 -1.651 -0.977 795 HD22 ASN 29 HD22 ASN 29 12.341 -0.120 -0.823 796 H GLN 30 HN GLN 30 10.659 -3.929 3.885 797 HA GLN 30 HA GLN 30 10.801 -6.838 3.353 798 HB2 GLN 30 HB2 GLN 30 12.093 -5.926 5.375 799 HB3 GLN 30 HB1 GLN 30 10.513 -5.608 6.091 800 HG2 GLN 30 HG2 GLN 30 11.034 -7.765 6.875 801 HG3 GLN 30 HG1 GLN 30 9.984 -8.077 5.494 802 HE21 GLN 30 HE21 GLN 30 11.564 -10.192 6.060 803 HE22 GLN 30 HE22 GLN 30 12.888 -10.297 5.003 804 H ILE 31 HN ILE 31 8.879 -7.640 2.819 805 HA ILE 31 HA ILE 31 6.465 -6.425 4.027 806 HB ILE 31 HB ILE 31 6.739 -7.675 1.280 807 HG12 ILE 31 HG12 ILE 31 6.215 -4.786 2.045 808 HG13 ILE 31 HG11 ILE 31 7.808 -5.402 1.605 809 HG21 ILE 31 HG21 ILE 31 4.419 -6.779 1.003 810 HG22 ILE 31 HG22 ILE 31 4.418 -6.343 2.712 811 HG23 ILE 31 HG23 ILE 31 4.523 -8.038 2.233 812 HD11 ILE 31 HD11 ILE 31 5.338 -5.543 -0.150 813 HD12 ILE 31 HD12 ILE 31 6.950 -6.109 -0.587 814 HD13 ILE 31 HD13 ILE 31 6.657 -4.388 -0.343 815 H LYS 32 HN LYS 32 5.413 -7.768 5.339 816 HA LYS 32 HA LYS 32 6.103 -10.544 5.532 817 HB2 LYS 32 HB2 LYS 32 5.046 -8.743 7.270 818 HB3 LYS 32 HB1 LYS 32 3.594 -9.626 6.799 819 HG2 LYS 32 HG2 LYS 32 4.492 -10.807 8.672 820 HG3 LYS 32 HG1 LYS 32 4.915 -11.767 7.253 821 HD2 LYS 32 HD2 LYS 32 7.017 -11.684 8.137 822 HD3 LYS 32 HD1 LYS 32 7.059 -10.092 7.379 823 HE2 LYS 32 HE2 LYS 32 7.680 -9.582 9.571 824 HE3 LYS 32 HE1 LYS 32 5.940 -9.299 9.618 825 HZ1 LYS 32 HZ1 LYS 32 5.579 -11.397 10.607 826 HZ2 LYS 32 HZ2 LYS 32 6.852 -10.681 11.473 827 HZ3 LYS 32 HZ3 LYS 32 7.177 -11.896 10.331 828 H ARG 33 HN ARG 33 5.610 -11.604 3.637 829 HA ARG 33 HA ARG 33 2.957 -11.376 2.471 830 HB2 ARG 33 HB2 ARG 33 5.488 -12.040 1.493 831 HB3 ARG 33 HB1 ARG 33 4.580 -13.551 1.443 832 HG2 ARG 33 HG2 ARG 33 2.844 -12.573 0.117 833 HG3 ARG 33 HG1 ARG 33 3.466 -10.945 0.384 834 HD2 ARG 33 HD2 ARG 33 4.055 -11.851 -1.868 835 HD3 ARG 33 HD1 ARG 33 5.467 -11.446 -0.895 836 HE ARG 33 HE ARG 33 6.022 -13.696 -0.845 837 HH11 ARG 33 HH11 ARG 33 2.718 -13.297 -1.874 838 HH12 ARG 33 HH12 ARG 33 2.526 -14.964 -2.298 839 HH21 ARG 33 HH21 ARG 33 5.746 -15.861 -1.409 840 HH22 ARG 33 HH22 ARG 33 4.227 -16.409 -2.037 841 H1 MET 1 HT1 MET 1 55.247 4.366 3.471 842 H2 MET 1 HT2 MET 1 55.553 3.278 2.203 843 H3 MET 1 HT3 MET 1 53.954 3.636 2.653 844 HA MET 1 HA MET 1 54.703 6.075 2.100 845 HB2 MET 1 HB2 MET 1 56.827 4.355 1.093 846 HB3 MET 1 HB1 MET 1 56.091 5.303 -0.200 847 HG2 MET 1 HG2 MET 1 56.360 7.347 1.240 848 HG3 MET 1 HG1 MET 1 57.264 6.359 2.387 849 HE1 MET 1 HE1 MET 1 59.348 5.463 2.224 850 HE2 MET 1 HE2 MET 1 60.524 5.558 0.916 851 HE3 MET 1 HE3 MET 1 59.166 4.442 0.789 852 H PHE 2 HN PHE 2 53.934 2.935 0.793 853 HA PHE 2 HA PHE 2 52.664 3.744 -1.599 854 HB2 PHE 2 HB2 PHE 2 52.191 1.333 0.167 855 HB3 PHE 2 HB1 PHE 2 51.508 1.540 -1.446 856 HD1 PHE 2 HD1 PHE 2 54.498 0.758 0.484 857 HD2 PHE 2 HD2 PHE 2 53.006 1.681 -3.435 858 HE1 PHE 2 HE1 PHE 2 56.606 -0.084 -0.515 859 HE2 PHE 2 HE2 PHE 2 55.112 0.839 -4.437 860 HZ PHE 2 HZ PHE 2 56.912 -0.043 -2.977 861 H GLU 3 HN GLU 3 51.500 3.371 1.722 862 HA GLU 3 HA GLU 3 48.797 4.082 0.934 863 HB2 GLU 3 HB2 GLU 3 50.009 3.493 3.641 864 HB3 GLU 3 HB1 GLU 3 48.300 3.838 3.367 865 HG2 GLU 3 HG2 GLU 3 48.396 1.483 3.335 866 HG3 GLU 3 HG1 GLU 3 48.401 1.920 1.628 867 HA PRO 4 HA PRO 4 49.216 8.408 1.736 868 HB2 PRO 4 HB2 PRO 4 46.700 9.041 2.611 869 HB3 PRO 4 HB1 PRO 4 47.085 8.693 0.915 870 HG2 PRO 4 HG2 PRO 4 45.829 6.948 2.971 871 HG3 PRO 4 HG1 PRO 4 45.470 7.098 1.242 872 HD2 PRO 4 HD2 PRO 4 46.950 5.041 2.295 873 HD3 PRO 4 HD1 PRO 4 47.145 5.632 0.630 874 H PHE 5 HN PHE 5 47.457 6.681 4.320 875 HA PHE 5 HA PHE 5 49.125 8.058 6.313 876 HB2 PHE 5 HB2 PHE 5 46.153 8.191 6.061 877 HB3 PHE 5 HB1 PHE 5 46.846 8.096 7.681 878 HD1 PHE 5 HD1 PHE 5 47.024 10.002 4.476 879 HD2 PHE 5 HD2 PHE 5 47.838 9.987 8.693 880 HE1 PHE 5 HE1 PHE 5 47.610 12.410 4.370 881 HE2 PHE 5 HE2 PHE 5 48.425 12.395 8.588 882 HZ PHE 5 HZ PHE 5 48.311 13.606 6.427 883 H GLN 6 HN GLN 6 46.293 5.902 6.366 884 HA GLN 6 HA GLN 6 47.865 3.636 7.199 885 HB2 GLN 6 HB2 GLN 6 46.559 3.414 9.380 886 HB3 GLN 6 HB1 GLN 6 47.831 4.637 9.350 887 HG2 GLN 6 HG2 GLN 6 46.194 6.390 8.922 888 HG3 GLN 6 HG1 GLN 6 44.903 5.199 8.814 889 HE21 GLN 6 HE21 GLN 6 46.269 7.396 10.927 890 HE22 GLN 6 HE22 GLN 6 45.795 6.686 12.395 891 H ILE 7 HN ILE 7 46.470 1.739 7.642 892 HA ILE 7 HA ILE 7 44.652 1.261 5.612 893 HB ILE 7 HB ILE 7 43.868 -0.665 7.024 894 HG12 ILE 7 HG12 ILE 7 45.777 -0.683 9.062 895 HG13 ILE 7 HG11 ILE 7 45.140 0.956 9.104 896 HG21 ILE 7 HG21 ILE 7 46.048 -1.798 7.018 897 HG22 ILE 7 HG22 ILE 7 46.868 -0.242 6.891 898 HG23 ILE 7 HG23 ILE 7 45.858 -0.818 5.564 899 HD11 ILE 7 HD11 ILE 7 42.807 -0.113 9.009 900 HD12 ILE 7 HD12 ILE 7 43.699 -0.294 10.520 901 HD13 ILE 7 HD13 ILE 7 43.618 -1.636 9.379 902 H LEU 8 HN LEU 8 44.082 2.532 8.853 903 HA LEU 8 HA LEU 8 41.264 2.363 8.833 904 HB2 LEU 8 HB2 LEU 8 42.920 2.859 10.784 905 HB3 LEU 8 HB1 LEU 8 42.764 4.538 10.266 906 HG LEU 8 HG LEU 8 40.204 3.085 10.494 907 HD11 LEU 8 HD11 LEU 8 41.792 3.785 12.983 908 HD12 LEU 8 HD12 LEU 8 41.495 2.143 12.413 909 HD13 LEU 8 HD13 LEU 8 40.146 3.153 12.935 910 HD21 LEU 8 HD21 LEU 8 39.469 5.190 11.371 911 HD22 LEU 8 HD22 LEU 8 40.598 5.573 10.071 912 HD23 LEU 8 HD23 LEU 8 41.119 5.683 11.752 913 H SER 9 HN SER 9 43.527 4.734 7.607 914 HA SER 9 HA SER 9 41.606 6.783 7.081 915 HB2 SER 9 HB2 SER 9 44.400 6.294 6.050 916 HB3 SER 9 HB1 SER 9 43.437 7.697 5.593 917 HG SER 9 HG SER 9 44.852 7.263 7.828 918 H ILE 10 HN ILE 10 43.035 4.164 5.177 919 HA ILE 10 HA ILE 10 41.941 4.877 2.674 920 HB ILE 10 HB ILE 10 42.755 2.204 3.829 921 HG12 ILE 10 HG12 ILE 10 44.076 3.863 1.670 922 HG13 ILE 10 HG11 ILE 10 44.456 4.077 3.380 923 HG21 ILE 10 HG21 ILE 10 41.147 1.718 2.109 924 HG22 ILE 10 HG22 ILE 10 42.744 1.485 1.396 925 HG23 ILE 10 HG23 ILE 10 41.826 2.949 1.044 926 HD11 ILE 10 HD11 ILE 10 45.183 1.776 3.571 927 HD12 ILE 10 HD12 ILE 10 46.006 2.490 2.184 928 HD13 ILE 10 HD13 ILE 10 44.627 1.416 1.936 929 H CYS 11 HN CYS 11 40.736 2.651 5.200 930 HA CYS 11 HA CYS 11 38.375 1.910 3.844 931 HB2 CYS 11 HB2 CYS 11 39.065 1.998 6.784 932 HB3 CYS 11 HB1 CYS 11 37.552 1.335 6.166 933 HG CYS 11 HG CYS 11 39.544 -0.082 4.608 934 H SER 12 HN SER 12 38.895 4.361 6.380 935 HA SER 12 HA SER 12 36.319 5.345 6.550 936 HB2 SER 12 HB2 SER 12 38.159 6.034 8.046 937 HB3 SER 12 HB1 SER 12 38.884 6.950 6.728 938 HG SER 12 HG SER 12 37.636 8.369 7.866 939 H PHE 13 HN PHE 13 38.888 6.290 4.292 940 HA PHE 13 HA PHE 13 37.559 8.390 3.018 941 HB2 PHE 13 HB2 PHE 13 39.888 8.058 2.589 942 HB3 PHE 13 HB1 PHE 13 39.611 6.416 2.007 943 HD1 PHE 13 HD1 PHE 13 38.963 10.010 1.268 944 HD2 PHE 13 HD2 PHE 13 38.967 5.988 -0.240 945 HE1 PHE 13 HE1 PHE 13 38.611 10.871 -1.032 946 HE2 PHE 13 HE2 PHE 13 38.615 6.849 -2.539 947 HZ PHE 13 HZ PHE 13 38.438 9.290 -2.935 948 H ILE 14 HN ILE 14 37.644 4.922 2.175 949 HA ILE 14 HA ILE 14 35.984 5.124 -0.099 950 HB ILE 14 HB ILE 14 36.479 2.800 1.776 951 HG12 ILE 14 HG12 ILE 14 38.414 3.863 0.454 952 HG13 ILE 14 HG11 ILE 14 38.169 2.132 0.240 953 HG21 ILE 14 HG21 ILE 14 35.735 1.483 -0.309 954 HG22 ILE 14 HG22 ILE 14 35.031 3.000 -0.872 955 HG23 ILE 14 HG23 ILE 14 34.470 2.272 0.633 956 HD11 ILE 14 HD11 ILE 14 36.898 4.141 -1.625 957 HD12 ILE 14 HD12 ILE 14 37.176 2.422 -1.891 958 HD13 ILE 14 HD13 ILE 14 38.535 3.544 -1.883 959 H LEU 15 HN LEU 15 35.232 4.409 3.290 960 HA LEU 15 HA LEU 15 32.477 3.921 2.942 961 HB2 LEU 15 HB2 LEU 15 34.054 4.897 5.333 962 HB3 LEU 15 HB1 LEU 15 32.348 4.453 5.402 963 HG LEU 15 HG LEU 15 34.507 2.593 4.376 964 HD11 LEU 15 HD11 LEU 15 33.245 2.754 7.131 965 HD12 LEU 15 HD12 LEU 15 34.927 3.118 6.741 966 HD13 LEU 15 HD13 LEU 15 34.319 1.469 6.579 967 HD21 LEU 15 HD21 LEU 15 32.663 0.907 4.969 968 HD22 LEU 15 HD22 LEU 15 32.355 1.933 3.570 969 HD23 LEU 15 HD23 LEU 15 31.585 2.295 5.113 970 H SER 16 HN SER 16 34.323 6.863 3.346 971 HA SER 16 HA SER 16 32.074 8.577 3.830 972 HB2 SER 16 HB2 SER 16 34.894 9.163 2.924 973 HB3 SER 16 HB1 SER 16 33.703 10.403 3.306 974 HG SER 16 HG SER 16 33.599 9.601 5.398 975 H ALA 17 HN ALA 17 34.107 7.935 0.973 976 HA ALA 17 HA ALA 17 32.724 9.631 -0.795 977 HB1 ALA 17 HB1 ALA 17 34.766 8.940 -1.645 978 HB2 ALA 17 HB2 ALA 17 33.666 7.887 -2.532 979 HB3 ALA 17 HB3 ALA 17 34.537 7.270 -1.128 980 H LEU 18 HN LEU 18 32.235 6.221 0.053 981 HA LEU 18 HA LEU 18 30.185 5.766 -1.865 982 HB2 LEU 18 HB2 LEU 18 31.327 4.336 0.467 983 HB3 LEU 18 HB1 LEU 18 29.678 3.906 0.011 984 HG LEU 18 HG LEU 18 30.344 3.337 -2.216 985 HD11 LEU 18 HD11 LEU 18 31.880 5.026 -2.836 986 HD12 LEU 18 HD12 LEU 18 32.859 3.562 -2.803 987 HD13 LEU 18 HD13 LEU 18 32.932 4.701 -1.460 988 HD21 LEU 18 HD21 LEU 18 32.281 2.331 -0.118 989 HD22 LEU 18 HD22 LEU 18 32.209 1.663 -1.749 990 HD23 LEU 18 HD23 LEU 18 30.804 1.554 -0.688 991 H HIS 19 HN HIS 19 30.153 6.725 1.556 992 HA HIS 19 HA HIS 19 27.404 6.547 1.988 993 HB2 HIS 19 HB2 HIS 19 29.108 6.890 3.753 994 HB3 HIS 19 HB1 HIS 19 29.342 8.543 3.181 995 HD2 HIS 19 HD2 HIS 19 26.409 6.399 4.767 996 HE1 HIS 19 HE1 HIS 19 25.628 10.496 5.421 997 HE2 HIS 19 HE2 HIS 19 24.831 8.135 5.914 998 H PHE 20 HN PHE 20 29.357 9.217 0.739 999 HA PHE 20 HA PHE 20 27.133 11.025 0.535 1000 HB2 PHE 20 HB2 PHE 20 29.983 11.150 0.233 1001 HB3 PHE 20 HB1 PHE 20 29.216 11.855 -1.191 1002 HD1 PHE 20 HD1 PHE 20 29.512 12.055 2.499 1003 HD2 PHE 20 HD2 PHE 20 27.904 13.872 -1.047 1004 HE1 PHE 20 HE1 PHE 20 28.975 14.105 3.790 1005 HE2 PHE 20 HE2 PHE 20 27.367 15.919 0.244 1006 HZ PHE 20 HZ PHE 20 27.911 16.044 2.663 1007 H MET 21 HN MET 21 28.730 8.738 -1.601 1008 HA MET 21 HA MET 21 27.531 9.693 -4.009 1009 HB2 MET 21 HB2 MET 21 29.025 7.223 -3.207 1010 HB3 MET 21 HB1 MET 21 28.212 7.299 -4.773 1011 HG2 MET 21 HG2 MET 21 29.411 9.413 -5.273 1012 HG3 MET 21 HG1 MET 21 30.261 9.279 -3.734 1013 HE1 MET 21 HE1 MET 21 32.342 8.538 -7.101 1014 HE2 MET 21 HE2 MET 21 32.840 9.189 -5.542 1015 HE3 MET 21 HE3 MET 21 31.376 9.794 -6.313 1016 H ALA 22 HN ALA 22 26.906 6.827 -2.015 1017 HA ALA 22 HA ALA 22 24.683 5.896 -3.436 1018 HB1 ALA 22 HB1 ALA 22 24.193 4.568 -1.441 1019 HB2 ALA 22 HB2 ALA 22 25.273 5.581 -0.482 1020 HB3 ALA 22 HB3 ALA 22 25.927 4.558 -1.760 1021 H TRP 23 HN TRP 23 24.907 8.059 -0.604 1022 HA TRP 23 HA TRP 23 22.085 8.316 -0.418 1023 HB2 TRP 23 HB2 TRP 23 24.367 9.840 0.791 1024 HB3 TRP 23 HB1 TRP 23 22.700 10.370 1.005 1025 HD1 TRP 23 HD1 TRP 23 25.032 8.692 2.959 1026 HE1 TRP 23 HE1 TRP 23 24.013 6.877 4.479 1027 HE3 TRP 23 HE3 TRP 23 20.510 8.026 0.656 1028 HZ2 TRP 23 HZ2 TRP 23 21.606 5.338 4.687 1029 HZ3 TRP 23 HZ3 TRP 23 18.891 6.367 1.515 1030 HH2 TRP 23 HH2 TRP 23 19.424 5.030 3.540 1031 H THR 24 HN THR 24 24.539 9.981 -2.221 1032 HA THR 24 HA THR 24 23.067 12.314 -2.858 1033 HB THR 24 HB THR 24 25.408 10.877 -4.013 1034 HG1 THR 24 HG1 THR 24 26.386 12.588 -3.246 1035 HG21 THR 24 HG21 THR 24 24.324 11.415 -6.051 1036 HG22 THR 24 HG22 THR 24 25.460 12.734 -5.777 1037 HG23 THR 24 HG23 THR 24 23.746 12.961 -5.430 1038 H ILE 25 HN ILE 25 23.577 9.333 -4.746 1039 HA ILE 25 HA ILE 25 21.792 9.975 -6.831 1040 HB ILE 25 HB ILE 25 22.761 7.311 -5.781 1041 HG12 ILE 25 HG12 ILE 25 23.456 8.729 -8.361 1042 HG13 ILE 25 HG11 ILE 25 24.343 9.035 -6.868 1043 HG21 ILE 25 HG21 ILE 25 21.970 6.506 -8.075 1044 HG22 ILE 25 HG22 ILE 25 21.041 8.002 -8.174 1045 HG23 ILE 25 HG23 ILE 25 20.700 6.836 -6.896 1046 HD11 ILE 25 HD11 ILE 25 25.530 7.308 -8.063 1047 HD12 ILE 25 HD12 ILE 25 24.046 6.389 -8.312 1048 HD13 ILE 25 HD13 ILE 25 24.727 6.542 -6.693 1049 H GLY 26 HN GLY 26 21.312 8.236 -3.789 1050 HA2 GLY 26 HA2 GLY 26 18.646 7.411 -4.221 1051 HA3 GLY 26 HA1 GLY 26 19.408 7.627 -2.647 1052 H HIS 27 HN HIS 27 20.019 10.374 -2.866 1053 HA HIS 27 HA HIS 27 17.575 11.544 -2.021 1054 HB2 HIS 27 HB2 HIS 27 19.544 12.448 -1.079 1055 HB3 HIS 27 HB1 HIS 27 20.291 12.679 -2.661 1056 HD2 HIS 27 HD2 HIS 27 19.917 15.214 -3.668 1057 HE1 HIS 27 HE1 HIS 27 16.619 16.337 -1.283 1058 HE2 HIS 27 HE2 HIS 27 18.258 17.133 -3.053 1059 H LEU 28 HN LEU 28 19.410 11.700 -5.040 1060 HA LEU 28 HA LEU 28 17.899 13.728 -6.292 1061 HB2 LEU 28 HB2 LEU 28 20.158 12.538 -6.968 1062 HB3 LEU 28 HB1 LEU 28 19.078 11.491 -7.889 1063 HG LEU 28 HG LEU 28 18.019 13.742 -8.706 1064 HD11 LEU 28 HD11 LEU 28 19.768 15.542 -8.846 1065 HD12 LEU 28 HD12 LEU 28 20.764 14.597 -7.740 1066 HD13 LEU 28 HD13 LEU 28 19.208 15.231 -7.202 1067 HD21 LEU 28 HD21 LEU 28 19.524 13.747 -10.605 1068 HD22 LEU 28 HD22 LEU 28 19.342 12.079 -10.064 1069 HD23 LEU 28 HD23 LEU 28 20.798 12.984 -9.654 1070 H ASN 29 HN ASN 29 16.120 13.666 -7.629 1071 HA ASN 29 HA ASN 29 14.345 11.385 -7.273 1072 HB2 ASN 29 HB2 ASN 29 14.037 14.143 -8.447 1073 HB3 ASN 29 HB1 ASN 29 12.789 12.914 -8.649 1074 HD21 ASN 29 HD21 ASN 29 14.208 15.166 -6.390 1075 HD22 ASN 29 HD22 ASN 29 13.199 14.787 -5.079 1076 H GLN 30 HN GLN 30 14.327 9.738 -8.649 1077 HA GLN 30 HA GLN 30 15.059 10.253 -11.472 1078 HB2 GLN 30 HB2 GLN 30 16.662 8.833 -10.054 1079 HB3 GLN 30 HB1 GLN 30 15.396 7.606 -10.063 1080 HG2 GLN 30 HG2 GLN 30 16.719 7.031 -11.923 1081 HG3 GLN 30 HG1 GLN 30 15.389 7.940 -12.637 1082 HE21 GLN 30 HE21 GLN 30 17.580 7.946 -14.214 1083 HE22 GLN 30 HE22 GLN 30 18.441 9.404 -14.101 1084 H ILE 31 HN ILE 31 13.378 10.035 -12.793 1085 HA ILE 31 HA ILE 31 11.276 8.074 -12.083 1086 HB ILE 31 HB ILE 31 10.928 10.722 -13.516 1087 HG12 ILE 31 HG12 ILE 31 9.932 9.860 -10.784 1088 HG13 ILE 31 HG11 ILE 31 11.384 10.831 -11.026 1089 HG21 ILE 31 HG21 ILE 31 8.502 10.167 -13.261 1090 HG22 ILE 31 HG22 ILE 31 8.963 8.575 -12.658 1091 HG23 ILE 31 HG23 ILE 31 9.355 9.038 -14.314 1092 HD11 ILE 31 HD11 ILE 31 8.602 11.588 -11.969 1093 HD12 ILE 31 HD12 ILE 31 10.059 12.562 -12.163 1094 HD13 ILE 31 HD13 ILE 31 9.412 12.255 -10.551 1095 H LYS 32 HN LYS 32 11.139 6.455 -13.493 1096 HA LYS 32 HA LYS 32 12.580 6.485 -15.972 1097 HB2 LYS 32 HB2 LYS 32 11.729 4.510 -14.313 1098 HB3 LYS 32 HB1 LYS 32 10.503 4.419 -15.577 1099 HG2 LYS 32 HG2 LYS 32 12.269 2.974 -16.284 1100 HG3 LYS 32 HG1 LYS 32 12.428 4.437 -17.257 1101 HD2 LYS 32 HD2 LYS 32 14.598 4.364 -16.556 1102 HD3 LYS 32 HD1 LYS 32 13.944 5.108 -15.097 1103 HE2 LYS 32 HE2 LYS 32 15.112 3.289 -14.212 1104 HE3 LYS 32 HE1 LYS 32 13.485 2.628 -14.368 1105 HZ1 LYS 32 HZ1 LYS 32 14.066 1.549 -16.371 1106 HZ2 LYS 32 HZ2 LYS 32 15.311 1.203 -15.269 1107 HZ3 LYS 32 HZ3 LYS 32 15.546 2.369 -16.481 1108 H ARG 33 HN ARG 33 11.780 8.065 -17.321 1109 HA ARG 33 HA ARG 33 8.933 8.212 -17.891 1110 HB2 ARG 33 HB2 ARG 33 11.060 10.020 -18.005 1111 HB3 ARG 33 HB1 ARG 33 10.636 9.722 -19.692 1112 HG2 ARG 33 HG2 ARG 33 8.356 10.354 -19.328 1113 HG3 ARG 33 HG1 ARG 33 8.565 10.348 -17.576 1114 HD2 ARG 33 HD2 ARG 33 8.576 12.651 -18.547 1115 HD3 ARG 33 HD1 ARG 33 10.068 12.250 -17.699 1116 HE ARG 33 HE ARG 33 11.196 12.372 -19.721 1117 HH11 ARG 33 HH11 ARG 33 7.763 12.159 -20.273 1118 HH12 ARG 33 HH12 ARG 33 7.899 12.463 -21.971 1119 HH21 ARG 33 HH21 ARG 33 11.343 12.771 -21.935 1120 HH22 ARG 33 HH22 ARG 33 9.911 12.808 -22.908 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 54.519 25.491 10.936 2 H2 MET 1 HT2 MET 1 53.833 26.837 11.715 3 H3 MET 1 HT3 MET 1 53.985 26.817 10.023 4 HA MET 1 HA MET 1 52.460 24.872 9.969 5 HB2 MET 1 HB2 MET 1 52.591 25.459 12.888 6 HB3 MET 1 HB1 MET 1 51.016 25.009 12.231 7 HG2 MET 1 HG2 MET 1 52.001 22.976 11.245 8 HG3 MET 1 HG1 MET 1 53.579 23.422 11.895 9 HE1 MET 1 HE1 MET 1 49.843 21.996 14.094 10 HE2 MET 1 HE2 MET 1 50.058 22.376 12.387 11 HE3 MET 1 HE3 MET 1 49.900 23.681 13.559 12 H PHE 2 HN PHE 2 51.580 26.272 8.462 13 HA PHE 2 HA PHE 2 50.241 28.706 9.317 14 HB2 PHE 2 HB2 PHE 2 50.405 27.388 6.594 15 HB3 PHE 2 HB1 PHE 2 49.752 28.994 6.921 16 HD1 PHE 2 HD1 PHE 2 52.705 27.099 6.208 17 HD2 PHE 2 HD2 PHE 2 51.310 30.692 8.103 18 HE1 PHE 2 HE1 PHE 2 54.992 28.049 6.087 19 HE2 PHE 2 HE2 PHE 2 53.598 31.643 7.981 20 HZ PHE 2 HZ PHE 2 55.439 30.321 6.974 21 H GLU 3 HN GLU 3 49.445 25.410 8.523 22 HA GLU 3 HA GLU 3 46.643 25.913 8.124 23 HB2 GLU 3 HB2 GLU 3 46.436 23.461 8.111 24 HB3 GLU 3 HB1 GLU 3 47.743 23.997 7.057 25 HG2 GLU 3 HG2 GLU 3 48.875 23.676 9.632 26 HG3 GLU 3 HG1 GLU 3 47.872 22.254 9.350 27 HA PRO 4 HA PRO 4 45.348 25.810 12.365 28 HB2 PRO 4 HB2 PRO 4 42.842 24.739 12.118 29 HB3 PRO 4 HB1 PRO 4 43.243 26.399 11.635 30 HG2 PRO 4 HG2 PRO 4 42.911 23.967 9.956 31 HG3 PRO 4 HG1 PRO 4 42.431 25.640 9.632 32 HD2 PRO 4 HD2 PRO 4 44.674 24.484 8.555 33 HD3 PRO 4 HD1 PRO 4 44.513 26.228 8.840 34 H PHE 5 HN PHE 5 44.628 22.824 10.560 35 HA PHE 5 HA PHE 5 45.724 21.253 12.780 36 HB2 PHE 5 HB2 PHE 5 42.897 21.348 12.025 37 HB3 PHE 5 HB1 PHE 5 43.556 19.714 11.991 38 HD1 PHE 5 HD1 PHE 5 42.731 22.593 14.095 39 HD2 PHE 5 HD2 PHE 5 44.525 18.694 14.002 40 HE1 PHE 5 HE1 PHE 5 42.630 22.490 16.570 41 HE2 PHE 5 HE2 PHE 5 44.427 18.588 16.476 42 HZ PHE 5 HZ PHE 5 43.478 20.485 17.762 43 H GLN 6 HN GLN 6 43.809 20.097 10.042 44 HA GLN 6 HA GLN 6 46.180 19.373 8.522 45 HB2 GLN 6 HB2 GLN 6 44.313 17.290 9.677 46 HB3 GLN 6 HB1 GLN 6 45.544 16.970 8.455 47 HG2 GLN 6 HG2 GLN 6 47.257 17.892 10.064 48 HG3 GLN 6 HG1 GLN 6 45.988 17.949 11.287 49 HE21 GLN 6 HE21 GLN 6 45.504 16.014 12.388 50 HE22 GLN 6 HE22 GLN 6 46.180 14.508 11.991 51 H ILE 7 HN ILE 7 45.617 18.462 6.423 52 HA ILE 7 HA ILE 7 43.586 19.892 5.127 53 HB ILE 7 HB ILE 7 44.073 18.486 3.192 54 HG12 ILE 7 HG12 ILE 7 45.527 16.733 5.203 55 HG13 ILE 7 HG11 ILE 7 44.083 16.298 4.288 56 HG21 ILE 7 HG21 ILE 7 45.755 20.209 4.074 57 HG22 ILE 7 HG22 ILE 7 46.394 18.984 2.979 58 HG23 ILE 7 HG23 ILE 7 46.662 18.841 4.717 59 HD11 ILE 7 HD11 ILE 7 46.861 16.802 3.210 60 HD12 ILE 7 HD12 ILE 7 45.436 16.714 2.174 61 HD13 ILE 7 HD13 ILE 7 45.925 15.312 3.124 62 H LEU 8 HN LEU 8 43.618 16.691 6.561 63 HA LEU 8 HA LEU 8 41.078 15.862 5.526 64 HB2 LEU 8 HB2 LEU 8 42.762 14.845 7.827 65 HB3 LEU 8 HB1 LEU 8 41.262 14.082 7.297 66 HG LEU 8 HG LEU 8 43.599 14.606 5.440 67 HD11 LEU 8 HD11 LEU 8 42.887 12.152 7.068 68 HD12 LEU 8 HD12 LEU 8 44.398 13.060 7.101 69 HD13 LEU 8 HD13 LEU 8 43.973 12.109 5.678 70 HD21 LEU 8 HD21 LEU 8 42.370 12.746 4.160 71 HD22 LEU 8 HD22 LEU 8 41.574 14.318 4.203 72 HD23 LEU 8 HD23 LEU 8 41.024 13.022 5.265 73 H SER 9 HN SER 9 42.180 17.532 8.384 74 HA SER 9 HA SER 9 39.719 17.361 9.837 75 HB2 SER 9 HB2 SER 9 41.851 17.805 10.974 76 HB3 SER 9 HB1 SER 9 42.000 19.334 10.111 77 HG SER 9 HG SER 9 40.675 20.184 11.497 78 H ILE 10 HN ILE 10 41.189 19.812 7.731 79 HA ILE 10 HA ILE 10 39.178 21.777 8.041 80 HB ILE 10 HB ILE 10 41.117 21.228 5.789 81 HG12 ILE 10 HG12 ILE 10 41.107 23.462 7.829 82 HG13 ILE 10 HG11 ILE 10 41.919 21.924 8.129 83 HG21 ILE 10 HG21 ILE 10 40.559 23.652 5.190 84 HG22 ILE 10 HG22 ILE 10 39.143 23.481 6.227 85 HG23 ILE 10 HG23 ILE 10 39.319 22.459 4.801 86 HD11 ILE 10 HD11 ILE 10 43.365 23.783 7.128 87 HD12 ILE 10 HD12 ILE 10 42.443 23.568 5.645 88 HD13 ILE 10 HD13 ILE 10 43.403 22.235 6.288 89 H CYS 11 HN CYS 11 39.632 19.225 5.599 90 HA CYS 11 HA CYS 11 37.403 19.838 4.002 91 HB2 CYS 11 HB2 CYS 11 39.261 18.207 3.463 92 HB3 CYS 11 HB1 CYS 11 38.467 17.061 4.542 93 HG CYS 11 HG CYS 11 36.800 18.245 2.194 94 H SER 12 HN SER 12 37.692 17.490 6.692 95 HA SER 12 HA SER 12 35.002 16.697 6.682 96 HB2 SER 12 HB2 SER 12 35.422 15.929 8.980 97 HB3 SER 12 HB1 SER 12 36.745 15.482 7.905 98 HG SER 12 HG SER 12 37.644 16.399 9.714 99 H PHE 13 HN PHE 13 36.635 19.383 8.359 100 HA PHE 13 HA PHE 13 34.572 20.182 10.041 101 HB2 PHE 13 HB2 PHE 13 36.737 21.180 10.255 102 HB3 PHE 13 HB1 PHE 13 36.692 21.773 8.595 103 HD1 PHE 13 HD1 PHE 13 35.010 22.074 11.911 104 HD2 PHE 13 HD2 PHE 13 35.720 23.866 8.073 105 HE1 PHE 13 HE1 PHE 13 33.918 24.162 12.683 106 HE2 PHE 13 HE2 PHE 13 34.629 25.956 8.845 107 HZ PHE 13 HZ PHE 13 33.727 26.103 11.150 108 H ILE 14 HN ILE 14 35.307 21.487 6.798 109 HA ILE 14 HA ILE 14 32.976 23.084 6.643 110 HB ILE 14 HB ILE 14 34.910 23.514 5.225 111 HG12 ILE 14 HG12 ILE 14 33.701 23.548 2.957 112 HG13 ILE 14 HG11 ILE 14 32.341 22.809 3.787 113 HG21 ILE 14 HG21 ILE 14 35.587 21.148 4.914 114 HG22 ILE 14 HG22 ILE 14 35.520 22.029 3.396 115 HG23 ILE 14 HG23 ILE 14 34.226 20.918 3.818 116 HD11 ILE 14 HD11 ILE 14 33.644 25.461 4.439 117 HD12 ILE 14 HD12 ILE 14 32.419 24.698 5.448 118 HD13 ILE 14 HD13 ILE 14 32.016 25.207 3.811 119 H LEU 15 HN LEU 15 33.681 19.793 5.582 120 HA LEU 15 HA LEU 15 31.263 19.358 4.185 121 HB2 LEU 15 HB2 LEU 15 33.371 17.597 5.378 122 HB3 LEU 15 HB1 LEU 15 31.856 16.873 4.838 123 HG LEU 15 HG LEU 15 33.399 18.754 3.050 124 HD11 LEU 15 HD11 LEU 15 34.556 16.859 2.081 125 HD12 LEU 15 HD12 LEU 15 33.693 15.738 3.134 126 HD13 LEU 15 HD13 LEU 15 34.876 16.853 3.816 127 HD21 LEU 15 HD21 LEU 15 31.503 16.445 2.508 128 HD22 LEU 15 HD22 LEU 15 32.177 17.540 1.302 129 HD23 LEU 15 HD23 LEU 15 31.041 18.147 2.504 130 H SER 16 HN SER 16 32.083 19.294 7.547 131 HA SER 16 HA SER 16 29.780 17.829 8.420 132 HB2 SER 16 HB2 SER 16 31.691 19.620 9.916 133 HB3 SER 16 HB1 SER 16 30.437 18.639 10.670 134 HG SER 16 HG SER 16 32.112 17.292 10.680 135 H ALA 17 HN ALA 17 30.681 21.265 8.310 136 HA ALA 17 HA ALA 17 28.378 22.300 9.514 137 HB1 ALA 17 HB1 ALA 17 29.061 24.388 8.710 138 HB2 ALA 17 HB2 ALA 17 29.715 23.708 7.219 139 HB3 ALA 17 HB3 ALA 17 30.574 23.483 8.743 140 H LEU 18 HN LEU 18 29.065 21.812 6.037 141 HA LEU 18 HA LEU 18 26.447 22.567 5.205 142 HB2 LEU 18 HB2 LEU 18 28.652 22.462 3.839 143 HB3 LEU 18 HB1 LEU 18 28.244 20.760 3.616 144 HG LEU 18 HG LEU 18 25.970 22.565 3.171 145 HD11 LEU 18 HD11 LEU 18 26.745 23.524 1.102 146 HD12 LEU 18 HD12 LEU 18 28.264 22.634 1.195 147 HD13 LEU 18 HD13 LEU 18 27.933 23.935 2.338 148 HD21 LEU 18 HD21 LEU 18 25.706 21.125 1.211 149 HD22 LEU 18 HD22 LEU 18 26.051 20.136 2.630 150 HD23 LEU 18 HD23 LEU 18 27.323 20.464 1.454 151 H HIS 19 HN HIS 19 27.864 19.638 6.364 152 HA HIS 19 HA HIS 19 26.039 17.775 5.269 153 HB2 HIS 19 HB2 HIS 19 27.893 16.737 6.169 154 HB3 HIS 19 HB1 HIS 19 27.909 17.768 7.591 155 HD2 HIS 19 HD2 HIS 19 26.150 16.966 9.678 156 HE1 HIS 19 HE1 HIS 19 25.042 13.302 7.895 157 HE2 HIS 19 HE2 HIS 19 24.928 14.684 10.022 158 H PHE 20 HN PHE 20 26.100 19.355 8.458 159 HA PHE 20 HA PHE 20 23.541 18.299 9.197 160 HB2 PHE 20 HB2 PHE 20 25.656 19.756 10.463 161 HB3 PHE 20 HB1 PHE 20 24.136 20.606 10.738 162 HD1 PHE 20 HD1 PHE 20 26.200 17.935 11.833 163 HD2 PHE 20 HD2 PHE 20 22.084 19.082 11.390 164 HE1 PHE 20 HE1 PHE 20 25.543 16.236 13.519 165 HE2 PHE 20 HE2 PHE 20 21.429 17.385 13.073 166 HZ PHE 20 HZ PHE 20 23.155 15.965 14.139 167 H MET 21 HN MET 21 24.633 21.032 7.376 168 HA MET 21 HA MET 21 22.368 22.712 7.794 169 HB2 MET 21 HB2 MET 21 24.815 22.859 6.448 170 HB3 MET 21 HB1 MET 21 23.588 23.025 5.195 171 HG2 MET 21 HG2 MET 21 24.000 25.233 6.036 172 HG3 MET 21 HG1 MET 21 22.448 24.725 6.701 173 HE1 MET 21 HE1 MET 21 21.938 25.624 8.758 174 HE2 MET 21 HE2 MET 21 23.061 26.920 8.356 175 HE3 MET 21 HE3 MET 21 23.075 26.223 9.973 176 H ALA 22 HN ALA 22 23.296 20.674 5.021 177 HA ALA 22 HA ALA 22 20.820 20.954 3.670 178 HB1 ALA 22 HB1 ALA 22 21.684 19.532 2.086 179 HB2 ALA 22 HB2 ALA 22 22.474 18.504 3.281 180 HB3 ALA 22 HB3 ALA 22 23.175 20.066 2.859 181 H TRP 23 HN TRP 23 22.042 18.519 5.939 182 HA TRP 23 HA TRP 23 19.935 16.670 5.673 183 HB2 TRP 23 HB2 TRP 23 22.215 16.472 6.905 184 HB3 TRP 23 HB1 TRP 23 21.350 17.159 8.278 185 HD1 TRP 23 HD1 TRP 23 21.799 14.005 6.314 186 HE1 TRP 23 HE1 TRP 23 20.341 12.133 7.323 187 HE3 TRP 23 HE3 TRP 23 18.959 16.746 9.557 188 HZ2 TRP 23 HZ2 TRP 23 18.246 11.838 9.247 189 HZ3 TRP 23 HZ3 TRP 23 17.239 15.646 10.962 190 HH2 TRP 23 HH2 TRP 23 16.879 13.197 10.810 191 H THR 24 HN THR 24 20.331 19.502 7.786 192 HA THR 24 HA THR 24 17.936 19.089 9.272 193 HB THR 24 HB THR 24 18.226 21.570 9.797 194 HG1 THR 24 HG1 THR 24 19.350 22.231 8.018 195 HG21 THR 24 HG21 THR 24 20.331 19.469 10.298 196 HG22 THR 24 HG22 THR 24 19.093 20.079 11.396 197 HG23 THR 24 HG23 THR 24 20.481 21.086 10.987 198 H ILE 25 HN ILE 25 18.701 20.859 6.308 199 HA ILE 25 HA ILE 25 16.234 22.205 6.036 200 HB ILE 25 HB ILE 25 18.266 21.287 3.999 201 HG12 ILE 25 HG12 ILE 25 17.585 24.074 4.963 202 HG13 ILE 25 HG11 ILE 25 18.814 23.080 5.743 203 HG21 ILE 25 HG21 ILE 25 15.755 22.949 3.673 204 HG22 ILE 25 HG22 ILE 25 16.176 21.465 2.818 205 HG23 ILE 25 HG23 ILE 25 17.072 22.950 2.502 206 HD11 ILE 25 HD11 ILE 25 18.781 24.028 2.866 207 HD12 ILE 25 HD12 ILE 25 19.918 22.831 3.483 208 HD13 ILE 25 HD13 ILE 25 19.935 24.473 4.123 209 H GLY 26 HN GLY 26 17.342 19.047 4.825 210 HA2 GLY 26 HA2 GLY 26 14.994 18.395 3.390 211 HA3 GLY 26 HA1 GLY 26 16.175 17.237 3.993 212 H HIS 27 HN HIS 27 15.984 17.769 6.737 213 HA HIS 27 HA HIS 27 13.809 16.151 7.489 214 HB2 HIS 27 HB2 HIS 27 15.685 16.236 8.947 215 HB3 HIS 27 HB1 HIS 27 15.605 17.994 9.068 216 HD2 HIS 27 HD2 HIS 27 14.120 18.871 11.217 217 HE1 HIS 27 HE1 HIS 27 12.019 15.293 12.000 218 HE2 HIS 27 HE2 HIS 27 12.431 17.667 12.804 219 H LEU 28 HN LEU 28 14.234 19.671 7.551 220 HA LEU 28 HA LEU 28 11.555 20.070 8.615 221 HB2 LEU 28 HB2 LEU 28 13.654 22.043 7.683 222 HB3 LEU 28 HB1 LEU 28 12.137 22.470 8.475 223 HG LEU 28 HG LEU 28 14.227 20.644 9.697 224 HD11 LEU 28 HD11 LEU 28 13.636 23.532 10.400 225 HD12 LEU 28 HD12 LEU 28 14.971 23.046 9.355 226 HD13 LEU 28 HD13 LEU 28 14.931 22.517 11.037 227 HD21 LEU 28 HD21 LEU 28 11.667 21.922 10.691 228 HD22 LEU 28 HD22 LEU 28 12.885 21.270 11.787 229 HD23 LEU 28 HD23 LEU 28 12.071 20.206 10.642 230 H ASN 29 HN ASN 29 9.785 20.638 7.471 231 HA ASN 29 HA ASN 29 9.929 20.461 4.575 232 HB2 ASN 29 HB2 ASN 29 8.112 19.364 5.868 233 HB3 ASN 29 HB1 ASN 29 7.537 20.958 6.357 234 HD21 ASN 29 HD21 ASN 29 5.595 21.118 5.165 235 HD22 ASN 29 HD22 ASN 29 5.514 20.990 3.475 236 H GLN 30 HN GLN 30 10.395 22.187 3.387 237 HA GLN 30 HA GLN 30 9.864 24.866 4.439 238 HB2 GLN 30 HB2 GLN 30 11.369 23.923 1.986 239 HB3 GLN 30 HB1 GLN 30 11.184 25.613 2.458 240 HG2 GLN 30 HG2 GLN 30 12.313 25.175 4.584 241 HG3 GLN 30 HG1 GLN 30 12.440 23.461 4.185 242 HE21 GLN 30 HE21 GLN 30 14.589 25.630 4.582 243 HE22 GLN 30 HE22 GLN 30 15.541 25.520 3.182 244 H ILE 31 HN ILE 31 8.499 26.333 3.480 245 HA ILE 31 HA ILE 31 6.887 25.369 1.201 246 HB ILE 31 HB ILE 31 4.891 26.361 2.264 247 HG12 ILE 31 HG12 ILE 31 6.635 26.645 4.729 248 HG13 ILE 31 HG11 ILE 31 6.234 27.995 3.670 249 HG21 ILE 31 HG21 ILE 31 6.261 24.421 4.144 250 HG22 ILE 31 HG22 ILE 31 5.573 23.942 2.592 251 HG23 ILE 31 HG23 ILE 31 4.529 24.594 3.855 252 HD11 ILE 31 HD11 ILE 31 4.696 27.824 5.629 253 HD12 ILE 31 HD12 ILE 31 4.188 26.237 5.052 254 HD13 ILE 31 HD13 ILE 31 3.854 27.674 4.086 255 H LYS 32 HN LYS 32 5.932 27.045 -0.092 256 HA LYS 32 HA LYS 32 7.612 29.422 -0.225 257 HB2 LYS 32 HB2 LYS 32 5.653 28.074 -2.031 258 HB3 LYS 32 HB1 LYS 32 5.953 29.797 -2.261 259 HG2 LYS 32 HG2 LYS 32 8.296 27.957 -1.936 260 HG3 LYS 32 HG1 LYS 32 7.463 28.007 -3.491 261 HD2 LYS 32 HD2 LYS 32 7.992 30.663 -2.337 262 HD3 LYS 32 HD1 LYS 32 9.450 29.748 -2.728 263 HE2 LYS 32 HE2 LYS 32 7.303 29.676 -4.772 264 HE3 LYS 32 HE1 LYS 32 8.097 31.235 -4.550 265 HZ1 LYS 32 HZ1 LYS 32 9.181 29.766 -6.208 266 HZ2 LYS 32 HZ2 LYS 32 9.552 28.682 -4.953 267 HZ3 LYS 32 HZ3 LYS 32 10.209 30.248 -4.948 268 H ARG 33 HN ARG 33 7.043 30.872 1.322 269 HA ARG 33 HA ARG 33 4.212 31.499 1.751 270 HB2 ARG 33 HB2 ARG 33 6.753 32.272 3.186 271 HB3 ARG 33 HB1 ARG 33 5.190 33.000 3.561 272 HG2 ARG 33 HG2 ARG 33 4.253 30.886 4.187 273 HG3 ARG 33 HG1 ARG 33 5.639 30.007 3.539 274 HD2 ARG 33 HD2 ARG 33 5.766 30.172 5.998 275 HD3 ARG 33 HD1 ARG 33 7.095 31.038 5.234 276 HE ARG 33 HE ARG 33 6.214 33.022 6.053 277 HH11 ARG 33 HH11 ARG 33 3.848 30.470 6.281 278 HH12 ARG 33 HH12 ARG 33 2.746 31.412 7.217 279 HH21 ARG 33 HH21 ARG 33 4.750 34.230 7.279 280 HH22 ARG 33 HH22 ARG 33 3.249 33.527 7.780 281 H1 MET 1 HT1 MET 1 47.868 18.260 32.268 282 H2 MET 1 HT2 MET 1 47.136 17.263 33.432 283 H3 MET 1 HT3 MET 1 46.716 18.906 33.332 284 HA MET 1 HA MET 1 45.864 18.486 31.049 285 HB2 MET 1 HB2 MET 1 46.786 15.771 31.861 286 HB3 MET 1 HB1 MET 1 45.275 15.867 30.956 287 HG2 MET 1 HG2 MET 1 46.401 17.175 29.197 288 HG3 MET 1 HG1 MET 1 47.914 17.089 30.099 289 HE1 MET 1 HE1 MET 1 45.677 13.786 27.884 290 HE2 MET 1 HE2 MET 1 45.200 15.456 28.175 291 HE3 MET 1 HE3 MET 1 45.080 14.273 29.475 292 H PHE 2 HN PHE 2 44.178 19.570 32.041 293 HA PHE 2 HA PHE 2 42.580 18.253 34.082 294 HB2 PHE 2 HB2 PHE 2 42.190 20.902 32.665 295 HB3 PHE 2 HB1 PHE 2 41.264 20.333 34.055 296 HD1 PHE 2 HD1 PHE 2 44.214 22.052 32.979 297 HD2 PHE 2 HD2 PHE 2 42.588 19.709 36.191 298 HE1 PHE 2 HE1 PHE 2 45.972 22.917 34.500 299 HE2 PHE 2 HE2 PHE 2 44.345 20.575 37.713 300 HZ PHE 2 HZ PHE 2 46.036 22.180 36.867 301 H GLU 3 HN GLU 3 42.517 18.808 30.647 302 HA GLU 3 HA GLU 3 39.718 18.220 30.344 303 HB2 GLU 3 HB2 GLU 3 40.211 18.224 27.932 304 HB3 GLU 3 HB1 GLU 3 40.890 19.645 28.723 305 HG2 GLU 3 HG2 GLU 3 42.853 17.615 28.908 306 HG3 GLU 3 HG1 GLU 3 42.252 17.574 27.251 307 HA PRO 4 HA PRO 4 39.990 13.798 30.203 308 HB2 PRO 4 HB2 PRO 4 37.950 13.205 28.477 309 HB3 PRO 4 HB1 PRO 4 37.688 13.751 30.144 310 HG2 PRO 4 HG2 PRO 4 37.510 15.282 27.599 311 HG3 PRO 4 HG1 PRO 4 36.502 15.379 29.053 312 HD2 PRO 4 HD2 PRO 4 38.484 17.185 28.475 313 HD3 PRO 4 HD1 PRO 4 37.950 16.814 30.126 314 H PHE 5 HN PHE 5 39.573 15.320 27.010 315 HA PHE 5 HA PHE 5 41.739 13.644 25.960 316 HB2 PHE 5 HB2 PHE 5 38.916 13.392 25.232 317 HB3 PHE 5 HB1 PHE 5 39.953 13.687 23.839 318 HD1 PHE 5 HD1 PHE 5 39.108 11.359 26.534 319 HD2 PHE 5 HD2 PHE 5 41.778 12.150 23.267 320 HE1 PHE 5 HE1 PHE 5 39.867 8.999 26.586 321 HE2 PHE 5 HE2 PHE 5 42.541 9.792 23.318 322 HZ PHE 5 HZ PHE 5 41.585 8.215 24.976 323 H GLN 6 HN GLN 6 39.429 15.593 24.136 324 HA GLN 6 HA GLN 6 41.259 17.849 23.967 325 HB2 GLN 6 HB2 GLN 6 40.541 16.179 21.547 326 HB3 GLN 6 HB1 GLN 6 41.333 17.754 21.484 327 HG2 GLN 6 HG2 GLN 6 43.154 16.799 22.952 328 HG3 GLN 6 HG1 GLN 6 42.402 15.217 22.751 329 HE21 GLN 6 HE21 GLN 6 42.876 14.068 20.842 330 HE22 GLN 6 HE22 GLN 6 43.772 14.709 19.551 331 H ILE 7 HN ILE 7 40.307 19.653 22.782 332 HA ILE 7 HA ILE 7 37.649 20.147 23.518 333 HB ILE 7 HB ILE 7 37.838 22.167 22.159 334 HG12 ILE 7 HG12 ILE 7 40.307 20.814 21.017 335 HG13 ILE 7 HG11 ILE 7 38.823 21.192 20.141 336 HG21 ILE 7 HG21 ILE 7 39.164 21.865 24.333 337 HG22 ILE 7 HG22 ILE 7 39.717 23.143 23.252 338 HG23 ILE 7 HG23 ILE 7 40.577 21.603 23.312 339 HD11 ILE 7 HD11 ILE 7 40.823 23.141 21.299 340 HD12 ILE 7 HD12 ILE 7 39.219 23.629 20.751 341 HD13 ILE 7 HD13 ILE 7 40.369 22.937 19.608 342 H LEU 8 HN LEU 8 39.046 18.889 20.559 343 HA LEU 8 HA LEU 8 36.646 19.021 18.999 344 HB2 LEU 8 HB2 LEU 8 39.212 17.454 18.646 345 HB3 LEU 8 HB1 LEU 8 37.899 17.462 17.469 346 HG LEU 8 HG LEU 8 39.238 19.989 18.468 347 HD11 LEU 8 HD11 LEU 8 39.822 18.275 16.039 348 HD12 LEU 8 HD12 LEU 8 40.942 18.733 17.322 349 HD13 LEU 8 HD13 LEU 8 40.352 19.950 16.190 350 HD21 LEU 8 HD21 LEU 8 38.225 20.818 16.256 351 HD22 LEU 8 HD22 LEU 8 37.084 20.470 17.553 352 HD23 LEU 8 HD23 LEU 8 37.303 19.315 16.238 353 H SER 9 HN SER 9 38.119 16.672 21.111 354 HA SER 9 HA SER 9 36.435 14.469 20.384 355 HB2 SER 9 HB2 SER 9 38.609 14.110 21.467 356 HB3 SER 9 HB1 SER 9 38.035 14.938 22.912 357 HG SER 9 HG SER 9 37.067 13.165 23.475 358 H ILE 10 HN ILE 10 36.376 16.894 22.976 359 HA ILE 10 HA ILE 10 34.122 15.866 24.347 360 HB ILE 10 HB ILE 10 35.273 18.656 24.181 361 HG12 ILE 10 HG12 ILE 10 35.320 16.676 26.468 362 HG13 ILE 10 HG11 ILE 10 36.581 16.714 25.235 363 HG21 ILE 10 HG21 ILE 10 33.895 18.970 26.313 364 HG22 ILE 10 HG22 ILE 10 33.011 17.518 25.842 365 HG23 ILE 10 HG23 ILE 10 32.981 18.946 24.805 366 HD11 ILE 10 HD11 ILE 10 37.027 18.096 27.343 367 HD12 ILE 10 HD12 ILE 10 35.762 19.182 26.780 368 HD13 ILE 10 HD13 ILE 10 37.215 18.940 25.808 369 H CYS 11 HN CYS 11 34.429 18.380 21.839 370 HA CYS 11 HA CYS 11 31.719 19.108 21.713 371 HB2 CYS 11 HB2 CYS 11 33.670 20.286 20.611 372 HB3 CYS 11 HB1 CYS 11 33.632 19.030 19.373 373 HG CYS 11 HG CYS 11 31.018 20.642 19.889 374 H SER 12 HN SER 12 33.529 16.736 19.728 375 HA SER 12 HA SER 12 31.325 15.849 18.241 376 HB2 SER 12 HB2 SER 12 32.684 13.851 17.787 377 HB3 SER 12 HB1 SER 12 33.642 15.323 17.635 378 HG SER 12 HG SER 12 34.792 13.890 18.890 379 H PHE 13 HN PHE 13 32.599 14.769 21.384 380 HA PHE 13 HA PHE 13 31.082 12.460 21.716 381 HB2 PHE 13 HB2 PHE 13 32.825 12.971 23.274 382 HB3 PHE 13 HB1 PHE 13 32.067 14.502 23.711 383 HD1 PHE 13 HD1 PHE 13 31.568 10.805 23.786 384 HD2 PHE 13 HD2 PHE 13 30.434 14.611 25.420 385 HE1 PHE 13 HE1 PHE 13 30.258 9.657 25.550 386 HE2 PHE 13 HE2 PHE 13 29.123 13.464 27.185 387 HZ PHE 13 HZ PHE 13 29.036 10.986 27.251 388 H ILE 14 HN ILE 14 30.300 15.732 22.924 389 HA ILE 14 HA ILE 14 27.705 15.042 23.822 390 HB ILE 14 HB ILE 14 28.856 17.022 24.654 391 HG12 ILE 14 HG12 ILE 14 27.003 18.743 24.196 392 HG13 ILE 14 HG11 ILE 14 26.258 17.518 23.179 393 HG21 ILE 14 HG21 ILE 14 30.022 17.604 22.544 394 HG22 ILE 14 HG22 ILE 14 29.208 18.986 23.260 395 HG23 ILE 14 HG23 ILE 14 28.495 18.175 21.873 396 HD11 ILE 14 HD11 ILE 14 26.908 17.290 26.126 397 HD12 ILE 14 HD12 ILE 14 26.362 15.937 25.139 398 HD13 ILE 14 HD13 ILE 14 25.305 17.324 25.393 399 H LEU 15 HN LEU 15 28.902 16.365 20.774 400 HA LEU 15 HA LEU 15 26.381 16.863 19.604 401 HB2 LEU 15 HB2 LEU 15 29.166 16.500 18.568 402 HB3 LEU 15 HB1 LEU 15 27.823 16.513 17.425 403 HG LEU 15 HG LEU 15 28.097 18.670 19.521 404 HD11 LEU 15 HD11 LEU 15 29.348 20.020 17.945 405 HD12 LEU 15 HD12 LEU 15 29.233 18.765 16.710 406 HD13 LEU 15 HD13 LEU 15 30.214 18.497 18.151 407 HD21 LEU 15 HD21 LEU 15 26.854 18.594 16.751 408 HD22 LEU 15 HD22 LEU 15 26.756 19.931 17.897 409 HD23 LEU 15 HD23 LEU 15 25.961 18.401 18.259 410 H SER 16 HN SER 16 28.254 13.983 20.010 411 HA SER 16 HA SER 16 26.881 12.416 18.041 412 HB2 SER 16 HB2 SER 16 28.598 11.612 20.386 413 HB3 SER 16 HB1 SER 16 27.994 10.503 19.156 414 HG SER 16 HG SER 16 29.881 11.096 18.318 415 H ALA 17 HN ALA 17 26.695 12.750 21.574 416 HA ALA 17 HA ALA 17 24.735 10.804 22.036 417 HB1 ALA 17 HB1 ALA 17 24.502 11.742 24.166 418 HB2 ALA 17 HB2 ALA 17 24.786 13.382 23.579 419 HB3 ALA 17 HB3 ALA 17 26.128 12.246 23.708 420 H LEU 18 HN LEU 18 24.332 14.324 21.493 421 HA LEU 18 HA LEU 18 21.489 14.193 21.452 422 HB2 LEU 18 HB2 LEU 18 23.052 16.229 21.842 423 HB3 LEU 18 HB1 LEU 18 23.083 16.338 20.082 424 HG LEU 18 HG LEU 18 20.385 15.943 21.172 425 HD11 LEU 18 HD11 LEU 18 20.127 18.128 22.153 426 HD12 LEU 18 HD12 LEU 18 21.775 18.578 21.717 427 HD13 LEU 18 HD13 LEU 18 21.493 17.357 22.958 428 HD21 LEU 18 HD21 LEU 18 19.896 17.729 19.574 429 HD22 LEU 18 HD22 LEU 18 20.958 16.538 18.822 430 HD23 LEU 18 HD23 LEU 18 21.618 18.070 19.397 431 H HIS 19 HN HIS 19 23.967 13.655 19.106 432 HA HIS 19 HA HIS 19 22.479 14.111 16.746 433 HB2 HIS 19 HB2 HIS 19 24.739 13.919 16.318 434 HB3 HIS 19 HB1 HIS 19 24.936 12.562 17.416 435 HD2 HIS 19 HD2 HIS 19 24.269 10.021 16.325 436 HE1 HIS 19 HE1 HIS 19 23.698 11.407 12.378 437 HE2 HIS 19 HE2 HIS 19 23.918 9.335 13.831 438 H PHE 20 HN PHE 20 23.154 11.094 18.515 439 HA PHE 20 HA PHE 20 21.389 9.554 16.863 440 HB2 PHE 20 HB2 PHE 20 23.311 9.044 18.927 441 HB3 PHE 20 HB1 PHE 20 21.794 8.248 19.349 442 HD1 PHE 20 HD1 PHE 20 24.767 7.984 17.426 443 HD2 PHE 20 HD2 PHE 20 20.591 6.973 17.375 444 HE1 PHE 20 HE1 PHE 20 25.211 6.229 15.728 445 HE2 PHE 20 HE2 PHE 20 21.035 5.221 15.679 446 HZ PHE 20 HZ PHE 20 23.343 4.849 14.841 447 H MET 21 HN MET 21 21.004 11.577 19.647 448 HA MET 21 HA MET 21 18.637 10.370 20.681 449 HB2 MET 21 HB2 MET 21 20.351 12.464 21.385 450 HB3 MET 21 HB1 MET 21 18.783 13.219 21.120 451 HG2 MET 21 HG2 MET 21 18.817 12.515 23.412 452 HG3 MET 21 HG1 MET 21 17.783 11.375 22.554 453 HE1 MET 21 HE1 MET 21 17.755 9.246 23.426 454 HE2 MET 21 HE2 MET 21 18.272 9.969 24.948 455 HE3 MET 21 HE3 MET 21 19.016 8.471 24.394 456 H ALA 22 HN ALA 22 19.113 13.349 18.774 457 HA ALA 22 HA ALA 22 16.358 13.762 18.275 458 HB1 ALA 22 HB1 ALA 22 17.003 15.581 17.028 459 HB2 ALA 22 HB2 ALA 22 18.403 14.752 16.345 460 HB3 ALA 22 HB3 ALA 22 18.454 15.348 18.003 461 H TRP 23 HN TRP 23 18.893 12.106 16.434 462 HA TRP 23 HA TRP 23 17.423 11.687 14.067 463 HB2 TRP 23 HB2 TRP 23 19.942 11.303 14.583 464 HB3 TRP 23 HB1 TRP 23 19.425 9.703 15.110 465 HD1 TRP 23 HD1 TRP 23 20.057 11.777 12.059 466 HE1 TRP 23 HE1 TRP 23 19.602 10.380 9.942 467 HE3 TRP 23 HE3 TRP 23 17.812 7.699 14.160 468 HZ2 TRP 23 HZ2 TRP 23 18.436 7.868 9.232 469 HZ3 TRP 23 HZ3 TRP 23 17.037 5.820 12.740 470 HH2 TRP 23 HH2 TRP 23 17.346 5.900 10.281 471 H THR 24 HN THR 24 17.689 9.767 17.049 472 HA THR 24 HA THR 24 16.142 7.565 16.110 473 HB THR 24 HB THR 24 15.886 7.107 18.606 474 HG1 THR 24 HG1 THR 24 16.123 9.138 19.424 475 HG21 THR 24 HG21 THR 24 18.536 7.402 17.197 476 HG22 THR 24 HG22 THR 24 17.615 5.935 17.526 477 HG23 THR 24 HG23 THR 24 18.448 6.764 18.840 478 H ILE 25 HN ILE 25 15.350 10.574 17.798 479 HA ILE 25 HA ILE 25 12.665 9.952 18.407 480 HB ILE 25 HB ILE 25 14.073 12.579 17.926 481 HG12 ILE 25 HG12 ILE 25 13.007 11.374 20.488 482 HG13 ILE 25 HG11 ILE 25 14.649 11.083 19.921 483 HG21 ILE 25 HG21 ILE 25 11.240 11.993 18.823 484 HG22 ILE 25 HG22 ILE 25 11.747 12.974 17.448 485 HG23 ILE 25 HG23 ILE 25 12.038 13.542 19.092 486 HD11 ILE 25 HD11 ILE 25 13.399 13.754 20.613 487 HD12 ILE 25 HD12 ILE 25 14.963 13.588 19.818 488 HD13 ILE 25 HD13 ILE 25 14.730 12.953 21.445 489 H GLY 26 HN GLY 26 14.140 11.550 15.584 490 HA2 GLY 26 HA2 GLY 26 11.728 12.111 14.221 491 HA3 GLY 26 HA1 GLY 26 13.317 11.974 13.472 492 H HIS 27 HN HIS 27 13.909 9.317 14.133 493 HA HIS 27 HA HIS 27 12.653 7.909 12.044 494 HB2 HIS 27 HB2 HIS 27 14.804 7.172 12.738 495 HB3 HIS 27 HB1 HIS 27 14.282 6.990 14.414 496 HD2 HIS 27 HD2 HIS 27 13.417 4.443 15.011 497 HE1 HIS 27 HE1 HIS 27 12.777 3.080 11.067 498 HE2 HIS 27 HE2 HIS 27 12.757 2.406 13.515 499 H LEU 28 HN LEU 28 12.068 7.915 15.543 500 HA LEU 28 HA LEU 28 9.900 5.992 15.277 501 HB2 LEU 28 HB2 LEU 28 10.931 7.533 17.672 502 HB3 LEU 28 HB1 LEU 28 9.709 6.262 17.728 503 HG LEU 28 HG LEU 28 12.508 5.867 16.632 504 HD11 LEU 28 HD11 LEU 28 11.403 4.933 19.294 505 HD12 LEU 28 HD12 LEU 28 12.393 6.382 19.114 506 HD13 LEU 28 HD13 LEU 28 13.064 4.800 18.717 507 HD21 LEU 28 HD21 LEU 28 10.175 4.031 17.235 508 HD22 LEU 28 HD22 LEU 28 11.819 3.430 17.021 509 HD23 LEU 28 HD23 LEU 28 11.003 4.256 15.694 510 H ASN 29 HN ASN 29 7.768 6.454 15.265 511 HA ASN 29 HA ASN 29 6.984 9.229 14.920 512 HB2 ASN 29 HB2 ASN 29 6.088 7.426 13.465 513 HB3 ASN 29 HB1 ASN 29 5.286 6.727 14.872 514 HD21 ASN 29 HD21 ASN 29 3.097 7.183 14.424 515 HD22 ASN 29 HD22 ASN 29 2.495 8.748 14.156 516 H GLN 30 HN GLN 30 6.544 10.457 16.625 517 HA GLN 30 HA GLN 30 5.656 9.225 19.125 518 HB2 GLN 30 HB2 GLN 30 6.455 12.066 18.449 519 HB3 GLN 30 HB1 GLN 30 5.976 11.516 20.055 520 HG2 GLN 30 HG2 GLN 30 7.824 9.913 20.091 521 HG3 GLN 30 HG1 GLN 30 8.283 10.375 18.453 522 HE21 GLN 30 HE21 GLN 30 9.749 10.677 21.141 523 HE22 GLN 30 HE22 GLN 30 10.169 12.321 21.193 524 H ILE 31 HN ILE 31 3.698 9.631 20.095 525 HA ILE 31 HA ILE 31 1.756 11.249 18.565 526 HB ILE 31 HB ILE 31 0.034 9.548 19.055 527 HG12 ILE 31 HG12 ILE 31 2.346 7.815 19.978 528 HG13 ILE 31 HG11 ILE 31 1.255 8.642 21.089 529 HG21 ILE 31 HG21 ILE 31 2.433 8.292 17.699 530 HG22 ILE 31 HG22 ILE 31 1.433 9.530 16.940 531 HG23 ILE 31 HG23 ILE 31 0.730 7.972 17.376 532 HD11 ILE 31 HD11 ILE 31 0.572 6.282 20.651 533 HD12 ILE 31 HD12 ILE 31 0.364 6.691 18.947 534 HD13 ILE 31 HD13 ILE 31 -0.660 7.448 20.167 535 H LYS 32 HN LYS 32 -0.006 12.094 19.820 536 HA LYS 32 HA LYS 32 0.802 12.735 22.547 537 HB2 LYS 32 HB2 LYS 32 -1.187 13.802 20.590 538 HB3 LYS 32 HB1 LYS 32 -1.475 14.078 22.308 539 HG2 LYS 32 HG2 LYS 32 1.259 14.613 21.201 540 HG3 LYS 32 HG1 LYS 32 -0.022 15.791 20.911 541 HD2 LYS 32 HD2 LYS 32 0.095 14.820 23.687 542 HD3 LYS 32 HD1 LYS 32 1.533 15.704 23.177 543 HE2 LYS 32 HE2 LYS 32 -1.059 16.901 22.377 544 HE3 LYS 32 HE1 LYS 32 -0.705 16.923 24.105 545 HZ1 LYS 32 HZ1 LYS 32 0.130 18.886 22.867 546 HZ2 LYS 32 HZ2 LYS 32 1.184 17.858 22.016 547 HZ3 LYS 32 HZ3 LYS 32 1.341 18.037 23.699 548 H ARG 33 HN ARG 33 0.398 11.052 23.897 549 HA ARG 33 HA ARG 33 -2.185 9.674 23.764 550 HB2 ARG 33 HB2 ARG 33 0.367 9.168 25.298 551 HB3 ARG 33 HB1 ARG 33 -1.120 8.267 25.603 552 HG2 ARG 33 HG2 ARG 33 -1.168 7.412 23.366 553 HG3 ARG 33 HG1 ARG 33 0.110 8.511 22.849 554 HD2 ARG 33 HD2 ARG 33 0.998 6.240 23.220 555 HD3 ARG 33 HD1 ARG 33 1.698 7.389 24.356 556 HE ARG 33 HE ARG 33 0.624 6.269 26.082 557 HH11 ARG 33 HH11 ARG 33 -0.717 5.315 23.007 558 HH12 ARG 33 HH12 ARG 33 -1.661 4.036 23.680 559 HH21 ARG 33 HH21 ARG 33 -0.623 4.588 26.934 560 HH22 ARG 33 HH22 ARG 33 -1.611 3.625 25.888 561 H1 MET 1 HT1 MET 1 50.896 -3.718 25.224 562 H2 MET 1 HT2 MET 1 50.906 -5.057 24.178 563 H3 MET 1 HT3 MET 1 50.019 -5.113 25.625 564 HA MET 1 HA MET 1 48.629 -3.254 24.773 565 HB2 MET 1 HB2 MET 1 50.513 -3.689 22.506 566 HB3 MET 1 HB1 MET 1 48.830 -3.352 22.097 567 HG2 MET 1 HG2 MET 1 48.891 -1.321 23.495 568 HG3 MET 1 HG1 MET 1 50.570 -1.657 23.912 569 HE1 MET 1 HE1 MET 1 48.794 -0.315 19.928 570 HE2 MET 1 HE2 MET 1 47.975 -0.762 21.423 571 HE3 MET 1 HE3 MET 1 48.636 -2.019 20.379 572 H PHE 2 HN PHE 2 47.122 -4.766 25.441 573 HA PHE 2 HA PHE 2 46.734 -7.220 23.934 574 HB2 PHE 2 HB2 PHE 2 45.150 -6.034 26.227 575 HB3 PHE 2 HB1 PHE 2 44.936 -7.652 25.559 576 HD1 PHE 2 HD1 PHE 2 46.739 -5.650 27.916 577 HD2 PHE 2 HD2 PHE 2 47.006 -9.208 25.526 578 HE1 PHE 2 HE1 PHE 2 48.564 -6.489 29.369 579 HE2 PHE 2 HE2 PHE 2 48.830 -10.048 26.980 580 HZ PHE 2 HZ PHE 2 49.610 -8.688 28.902 581 H GLU 3 HN GLU 3 45.392 -4.014 24.126 582 HA GLU 3 HA GLU 3 42.949 -4.676 22.764 583 HB2 GLU 3 HB2 GLU 3 42.604 -2.241 22.674 584 HB3 GLU 3 HB1 GLU 3 43.058 -2.761 24.296 585 HG2 GLU 3 HG2 GLU 3 45.476 -2.259 22.912 586 HG3 GLU 3 HG1 GLU 3 44.406 -0.903 22.552 587 HA PRO 4 HA PRO 4 44.435 -4.430 18.594 588 HB2 PRO 4 HB2 PRO 4 42.211 -3.497 17.301 589 HB3 PRO 4 HB1 PRO 4 42.359 -5.157 17.910 590 HG2 PRO 4 HG2 PRO 4 40.923 -2.831 19.084 591 HG3 PRO 4 HG1 PRO 4 40.462 -4.540 19.036 592 HD2 PRO 4 HD2 PRO 4 41.530 -3.332 21.257 593 HD3 PRO 4 HD1 PRO 4 41.696 -5.065 20.910 594 H PHE 5 HN PHE 5 42.573 -1.576 19.631 595 HA PHE 5 HA PHE 5 44.667 0.155 18.527 596 HB2 PHE 5 HB2 PHE 5 41.962 -0.117 17.439 597 HB3 PHE 5 HB1 PHE 5 42.357 1.544 17.876 598 HD1 PHE 5 HD1 PHE 5 43.151 -1.269 15.672 599 HD2 PHE 5 HD2 PHE 5 44.260 2.709 16.849 600 HE1 PHE 5 HE1 PHE 5 44.533 -1.051 13.625 601 HE2 PHE 5 HE2 PHE 5 45.645 2.929 14.804 602 HZ PHE 5 HZ PHE 5 45.781 1.049 13.185 603 H GLN 6 HN GLN 6 41.423 1.078 19.586 604 HA GLN 6 HA GLN 6 42.364 1.844 22.230 605 HB2 GLN 6 HB2 GLN 6 41.410 3.884 20.206 606 HB3 GLN 6 HB1 GLN 6 41.644 4.206 21.925 607 HG2 GLN 6 HG2 GLN 6 44.039 3.451 21.652 608 HG3 GLN 6 HG1 GLN 6 43.757 3.392 19.912 609 HE21 GLN 6 HE21 GLN 6 43.893 5.354 18.761 610 HE22 GLN 6 HE22 GLN 6 44.092 6.869 19.500 611 H ILE 7 HN ILE 7 40.596 2.627 23.582 612 HA ILE 7 HA ILE 7 38.301 1.030 23.394 613 HB ILE 7 HB ILE 7 37.440 2.358 25.252 614 HG12 ILE 7 HG12 ILE 7 39.676 4.285 24.527 615 HG13 ILE 7 HG11 ILE 7 37.945 4.598 24.399 616 HG21 ILE 7 HG21 ILE 7 39.436 0.771 25.531 617 HG22 ILE 7 HG22 ILE 7 39.204 1.969 26.804 618 HG23 ILE 7 HG23 ILE 7 40.444 2.216 25.575 619 HD11 ILE 7 HD11 ILE 7 39.555 4.181 26.924 620 HD12 ILE 7 HD12 ILE 7 37.792 4.148 26.897 621 HD13 ILE 7 HD13 ILE 7 38.654 5.618 26.444 622 H LEU 8 HN LEU 8 38.953 4.301 22.298 623 HA LEU 8 HA LEU 8 36.246 4.944 21.618 624 HB2 LEU 8 HB2 LEU 8 38.893 6.156 20.789 625 HB3 LEU 8 HB1 LEU 8 37.325 6.816 20.325 626 HG LEU 8 HG LEU 8 38.123 6.319 23.204 627 HD11 LEU 8 HD11 LEU 8 38.353 8.813 21.499 628 HD12 LEU 8 HD12 LEU 8 39.648 7.981 22.361 629 HD13 LEU 8 HD13 LEU 8 38.397 8.838 23.262 630 HD21 LEU 8 HD21 LEU 8 36.250 8.052 23.513 631 HD22 LEU 8 HD22 LEU 8 35.747 6.447 22.987 632 HD23 LEU 8 HD23 LEU 8 35.852 7.764 21.819 633 H SER 9 HN SER 9 38.949 3.477 19.967 634 HA SER 9 HA SER 9 37.831 3.593 17.335 635 HB2 SER 9 HB2 SER 9 40.246 3.316 17.692 636 HB3 SER 9 HB1 SER 9 39.958 1.756 18.460 637 HG SER 9 HG SER 9 39.783 0.909 16.549 638 H ILE 10 HN ILE 10 37.926 1.119 19.879 639 HA ILE 10 HA ILE 10 36.641 -0.927 18.409 640 HB ILE 10 HB ILE 10 36.810 -0.395 21.379 641 HG12 ILE 10 HG12 ILE 10 38.179 -2.518 19.714 642 HG13 ILE 10 HG11 ILE 10 38.897 -0.929 19.982 643 HG21 ILE 10 HG21 ILE 10 36.179 -2.872 21.501 644 HG22 ILE 10 HG22 ILE 10 35.652 -2.720 19.825 645 HG23 ILE 10 HG23 ILE 10 34.871 -1.765 21.084 646 HD11 ILE 10 HD11 ILE 10 39.584 -2.770 21.625 647 HD12 ILE 10 HD12 ILE 10 37.947 -2.672 22.265 648 HD13 ILE 10 HD13 ILE 10 39.010 -1.266 22.339 649 H CYS 11 HN CYS 11 35.367 1.523 20.660 650 HA CYS 11 HA CYS 11 32.677 0.716 20.600 651 HB2 CYS 11 HB2 CYS 11 33.728 2.410 22.159 652 HB3 CYS 11 HB1 CYS 11 33.655 3.567 20.830 653 HG CYS 11 HG CYS 11 31.002 2.187 21.690 654 H SER 12 HN SER 12 34.345 3.211 18.645 655 HA SER 12 HA SER 12 32.138 3.865 17.046 656 HB2 SER 12 HB2 SER 12 33.794 4.761 15.464 657 HB3 SER 12 HB1 SER 12 34.176 5.223 17.122 658 HG SER 12 HG SER 12 36.037 4.439 16.182 659 H PHE 13 HN PHE 13 34.630 1.349 16.653 660 HA PHE 13 HA PHE 13 34.038 0.532 14.064 661 HB2 PHE 13 HB2 PHE 13 35.966 -0.345 15.178 662 HB3 PHE 13 HB1 PHE 13 34.983 -1.021 16.476 663 HD1 PHE 13 HD1 PHE 13 35.635 -1.244 12.810 664 HD2 PHE 13 HD2 PHE 13 34.037 -3.182 16.294 665 HE1 PHE 13 HE1 PHE 13 35.365 -3.343 11.519 666 HE2 PHE 13 HE2 PHE 13 33.767 -5.283 15.002 667 HZ PHE 13 HZ PHE 13 34.432 -5.363 12.614 668 H ILE 14 HN ILE 14 32.784 -0.893 17.090 669 HA ILE 14 HA ILE 14 30.938 -2.611 15.804 670 HB ILE 14 HB ILE 14 31.668 -3.014 18.092 671 HG12 ILE 14 HG12 ILE 14 29.351 -3.217 19.188 672 HG13 ILE 14 HG11 ILE 14 28.708 -2.507 17.714 673 HG21 ILE 14 HG21 ILE 14 31.864 -0.636 18.772 674 HG22 ILE 14 HG22 ILE 14 30.962 -1.593 19.939 675 HG23 ILE 14 HG23 ILE 14 30.105 -0.524 18.836 676 HD11 ILE 14 HD11 ILE 14 30.321 -5.056 17.952 677 HD12 ILE 14 HD12 ILE 14 29.895 -4.308 16.414 678 HD13 ILE 14 HD13 ILE 14 28.628 -4.914 17.479 679 H LEU 15 HN LEU 15 30.634 0.656 17.114 680 HA LEU 15 HA LEU 15 27.841 0.898 16.788 681 HB2 LEU 15 HB2 LEU 15 30.114 2.821 17.106 682 HB3 LEU 15 HB1 LEU 15 28.530 3.440 16.641 683 HG LEU 15 HG LEU 15 28.831 1.552 18.977 684 HD11 LEU 15 HD11 LEU 15 29.049 3.454 20.463 685 HD12 LEU 15 HD12 LEU 15 28.909 4.581 19.114 686 HD13 LEU 15 HD13 LEU 15 30.339 3.558 19.265 687 HD21 LEU 15 HD21 LEU 15 26.831 3.734 18.300 688 HD22 LEU 15 HD22 LEU 15 26.728 2.619 19.662 689 HD23 LEU 15 HD23 LEU 15 26.576 2.014 18.013 690 H SER 16 HN SER 16 30.497 1.176 14.582 691 HA SER 16 HA SER 16 29.067 2.560 12.522 692 HB2 SER 16 HB2 SER 16 31.611 0.943 12.443 693 HB3 SER 16 HB1 SER 16 30.987 1.901 11.102 694 HG SER 16 HG SER 16 32.245 3.322 12.111 695 H ALA 17 HN ALA 17 29.968 -0.827 13.115 696 HA ALA 17 HA ALA 17 28.916 -1.920 10.765 697 HB1 ALA 17 HB1 ALA 17 29.129 -4.007 11.801 698 HB2 ALA 17 HB2 ALA 17 28.715 -3.368 13.391 699 HB3 ALA 17 HB3 ALA 17 30.294 -3.025 12.687 700 H LEU 18 HN LEU 18 27.356 -1.567 13.965 701 HA LEU 18 HA LEU 18 24.818 -2.492 13.062 702 HB2 LEU 18 HB2 LEU 18 25.762 -2.335 15.476 703 HB3 LEU 18 HB1 LEU 18 25.180 -0.671 15.421 704 HG LEU 18 HG LEU 18 23.227 -2.614 14.405 705 HD11 LEU 18 HD11 LEU 18 22.681 -3.635 16.515 706 HD12 LEU 18 HD12 LEU 18 23.884 -2.662 17.360 707 HD13 LEU 18 HD13 LEU 18 24.400 -3.918 16.236 708 HD21 LEU 18 HD21 LEU 18 21.744 -1.288 15.821 709 HD22 LEU 18 HD22 LEU 18 22.804 -0.211 14.913 710 HD23 LEU 18 HD23 LEU 18 23.131 -0.541 16.614 711 H HIS 19 HN HIS 19 26.433 0.563 13.018 712 HA HIS 19 HA HIS 19 24.193 2.275 12.813 713 HB2 HIS 19 HB2 HIS 19 26.144 3.446 13.208 714 HB3 HIS 19 HB1 HIS 19 27.073 2.486 12.069 715 HD2 HIS 19 HD2 HIS 19 26.856 3.296 9.351 716 HE1 HIS 19 HE1 HIS 19 24.651 6.808 10.147 717 HE2 HIS 19 HE2 HIS 19 25.926 5.527 8.362 718 H PHE 20 HN PHE 20 26.260 0.861 10.278 719 HA PHE 20 HA PHE 20 24.579 1.815 8.163 720 HB2 PHE 20 HB2 PHE 20 27.127 0.529 8.402 721 HB3 PHE 20 HB1 PHE 20 26.134 -0.380 7.263 722 HD1 PHE 20 HD1 PHE 20 28.258 2.437 7.645 723 HD2 PHE 20 HD2 PHE 20 24.775 1.073 5.532 724 HE1 PHE 20 HE1 PHE 20 28.629 4.170 5.909 725 HE2 PHE 20 HE2 PHE 20 25.146 2.805 3.799 726 HZ PHE 20 HZ PHE 20 27.077 4.343 3.981 727 H MET 21 HN MET 21 24.558 -0.946 10.250 728 HA MET 21 HA MET 21 23.113 -2.717 8.547 729 HB2 MET 21 HB2 MET 21 24.275 -2.801 11.088 730 HB3 MET 21 HB1 MET 21 22.559 -3.090 11.356 731 HG2 MET 21 HG2 MET 21 23.544 -5.231 10.910 732 HG3 MET 21 HG1 MET 21 22.665 -4.770 9.453 733 HE1 MET 21 HE1 MET 21 23.550 -5.582 7.482 734 HE2 MET 21 HE2 MET 21 24.288 -6.844 8.465 735 HE3 MET 21 HE3 MET 21 25.225 -6.070 7.190 736 H ALA 22 HN ALA 22 22.057 -0.775 11.342 737 HA ALA 22 HA ALA 22 19.292 -1.244 10.938 738 HB1 ALA 22 HB1 ALA 22 18.937 0.139 12.737 739 HB2 ALA 22 HB2 ALA 22 20.215 1.260 12.264 740 HB3 ALA 22 HB3 ALA 22 20.627 -0.285 13.008 741 H TRP 23 HN TRP 23 21.454 1.361 9.875 742 HA TRP 23 HA TRP 23 19.479 3.085 8.850 743 HB2 TRP 23 HB2 TRP 23 22.025 3.458 9.226 744 HB3 TRP 23 HB1 TRP 23 22.197 2.796 7.602 745 HD1 TRP 23 HD1 TRP 23 21.167 5.870 9.473 746 HE1 TRP 23 HE1 TRP 23 20.471 7.712 7.810 747 HE3 TRP 23 HE3 TRP 23 21.019 3.150 5.151 748 HZ2 TRP 23 HZ2 TRP 23 19.922 7.996 5.017 749 HZ3 TRP 23 HZ3 TRP 23 20.404 4.230 3.006 750 HH2 TRP 23 HH2 TRP 23 19.856 6.647 2.934 751 H THR 24 HN THR 24 21.258 0.389 7.358 752 HA THR 24 HA THR 24 20.192 0.752 4.743 753 HB THR 24 HB THR 24 20.912 -1.680 4.469 754 HG1 THR 24 HG1 THR 24 20.799 -2.381 6.554 755 HG21 THR 24 HG21 THR 24 22.747 0.544 5.353 756 HG22 THR 24 HG22 THR 24 22.456 -0.069 3.725 757 HG23 THR 24 HG23 THR 24 23.391 -1.026 4.872 758 H ILE 25 HN ILE 25 19.164 -1.121 7.558 759 HA ILE 25 HA ILE 25 17.123 -2.602 6.289 760 HB ILE 25 HB ILE 25 17.470 -1.685 9.145 761 HG12 ILE 25 HG12 ILE 25 17.695 -4.450 7.939 762 HG13 ILE 25 HG11 ILE 25 19.073 -3.360 8.059 763 HG21 ILE 25 HG21 ILE 25 15.383 -3.487 7.890 764 HG22 ILE 25 HG22 ILE 25 15.107 -2.026 8.839 765 HG23 ILE 25 HG23 ILE 25 15.739 -3.476 9.617 766 HD11 ILE 25 HD11 ILE 25 17.398 -4.449 10.335 767 HD12 ILE 25 HD12 ILE 25 18.592 -3.169 10.532 768 HD13 ILE 25 HD13 ILE 25 19.101 -4.773 10.014 769 H GLY 26 HN GLY 26 17.065 0.544 7.954 770 HA2 GLY 26 HA2 GLY 26 14.287 1.005 7.704 771 HA3 GLY 26 HA1 GLY 26 15.511 2.249 7.936 772 H HIS 27 HN HIS 27 17.031 1.852 5.618 773 HA HIS 27 HA HIS 27 15.625 3.386 3.731 774 HB2 HIS 27 HB2 HIS 27 18.000 3.469 3.681 775 HB3 HIS 27 HB1 HIS 27 18.131 1.718 3.522 776 HD2 HIS 27 HD2 HIS 27 18.286 0.871 0.904 777 HE1 HIS 27 HE1 HIS 27 16.824 4.371 -0.950 778 HE2 HIS 27 HE2 HIS 27 17.797 2.063 -1.367 779 H LEU 28 HN LEU 28 16.253 -0.099 3.899 780 HA LEU 28 HA LEU 28 14.768 -0.581 1.445 781 HB2 LEU 28 HB2 LEU 28 16.032 -2.488 3.430 782 HB3 LEU 28 HB1 LEU 28 15.318 -2.953 1.885 783 HG LEU 28 HG LEU 28 17.591 -0.967 2.165 784 HD11 LEU 28 HD11 LEU 28 17.739 -3.842 1.221 785 HD12 LEU 28 HD12 LEU 28 18.147 -3.344 2.862 786 HD13 LEU 28 HD13 LEU 28 19.083 -2.733 1.498 787 HD21 LEU 28 HD21 LEU 28 16.218 -2.320 -0.170 788 HD22 LEU 28 HD22 LEU 28 17.802 -1.560 -0.318 789 HD23 LEU 28 HD23 LEU 28 16.398 -0.591 0.125 790 H ASN 29 HN ASN 29 12.711 -1.295 1.300 791 HA ASN 29 HA ASN 29 11.089 -1.252 3.709 792 HB2 ASN 29 HB2 ASN 29 10.328 -0.181 1.602 793 HB3 ASN 29 HB1 ASN 29 10.272 -1.772 0.844 794 HD21 ASN 29 HD21 ASN 29 8.022 -2.097 0.636 795 HD22 ASN 29 HD22 ASN 29 6.939 -2.060 1.942 796 H GLN 30 HN GLN 30 10.875 -3.010 4.922 797 HA GLN 30 HA GLN 30 11.260 -5.658 3.735 798 HB2 GLN 30 HB2 GLN 30 10.936 -4.763 6.609 799 HB3 GLN 30 HB1 GLN 30 11.186 -6.435 6.103 800 HG2 GLN 30 HG2 GLN 30 13.327 -5.836 5.079 801 HG3 GLN 30 HG1 GLN 30 13.073 -4.142 5.493 802 HE21 GLN 30 HE21 GLN 30 15.184 -6.164 6.437 803 HE22 GLN 30 HE22 GLN 30 15.101 -6.083 8.131 804 H ILE 31 HN ILE 31 9.700 -7.235 3.672 805 HA ILE 31 HA ILE 31 6.983 -6.468 4.543 806 HB ILE 31 HB ILE 31 6.091 -7.506 2.488 807 HG12 ILE 31 HG12 ILE 31 8.975 -7.576 1.553 808 HG13 ILE 31 HG11 ILE 31 8.118 -8.997 2.150 809 HG21 ILE 31 HG21 ILE 31 8.169 -5.407 1.818 810 HG22 ILE 31 HG22 ILE 31 6.663 -5.040 2.658 811 HG23 ILE 31 HG23 ILE 31 6.623 -5.680 1.015 812 HD11 ILE 31 HD11 ILE 31 8.043 -8.808 -0.337 813 HD12 ILE 31 HD12 ILE 31 7.184 -7.278 -0.165 814 HD13 ILE 31 HD13 ILE 31 6.439 -8.774 0.395 815 H LYS 32 HN LYS 32 5.566 -8.250 4.993 816 HA LYS 32 HA LYS 32 6.995 -10.543 6.080 817 HB2 LYS 32 HB2 LYS 32 4.257 -9.386 6.368 818 HB3 LYS 32 HB1 LYS 32 4.481 -11.101 6.718 819 HG2 LYS 32 HG2 LYS 32 6.419 -9.129 7.875 820 HG3 LYS 32 HG1 LYS 32 4.831 -9.300 8.623 821 HD2 LYS 32 HD2 LYS 32 6.131 -11.864 7.988 822 HD3 LYS 32 HD1 LYS 32 6.998 -10.897 9.182 823 HE2 LYS 32 HE2 LYS 32 4.058 -11.038 9.538 824 HE3 LYS 32 HE1 LYS 32 4.935 -12.542 9.819 825 HZ1 LYS 32 HZ1 LYS 32 4.711 -11.107 11.810 826 HZ2 LYS 32 HZ2 LYS 32 5.674 -9.940 11.038 827 HZ3 LYS 32 HZ3 LYS 32 6.319 -11.468 11.409 828 H ARG 33 HN ARG 33 7.563 -11.940 4.484 829 HA ARG 33 HA ARG 33 5.596 -12.686 2.443 830 HB2 ARG 33 HB2 ARG 33 8.538 -13.261 2.804 831 HB3 ARG 33 HB1 ARG 33 7.562 -14.046 1.562 832 HG2 ARG 33 HG2 ARG 33 7.041 -11.953 0.520 833 HG3 ARG 33 HG1 ARG 33 7.702 -11.040 1.878 834 HD2 ARG 33 HD2 ARG 33 9.282 -11.077 -0.017 835 HD3 ARG 33 HD1 ARG 33 9.948 -11.913 1.382 836 HE ARG 33 HE ARG 33 9.872 -13.895 0.178 837 HH11 ARG 33 HH11 ARG 33 7.934 -11.458 -1.391 838 HH12 ARG 33 HH12 ARG 33 7.674 -12.406 -2.810 839 HH21 ARG 33 HH21 ARG 33 9.516 -15.112 -1.693 840 HH22 ARG 33 HH22 ARG 33 8.561 -14.462 -2.983 841 H1 MET 1 HT1 MET 1 57.922 4.221 4.041 842 H2 MET 1 HT2 MET 1 57.944 5.242 2.684 843 H3 MET 1 HT3 MET 1 57.678 3.575 2.493 844 HA MET 1 HA MET 1 55.610 3.812 3.826 845 HB2 MET 1 HB2 MET 1 56.616 6.616 3.765 846 HB3 MET 1 HB1 MET 1 54.876 6.386 3.590 847 HG2 MET 1 HG2 MET 1 54.841 5.037 5.654 848 HG3 MET 1 HG1 MET 1 56.582 5.261 5.831 849 HE1 MET 1 HE1 MET 1 53.210 8.295 6.329 850 HE2 MET 1 HE2 MET 1 53.137 6.623 5.778 851 HE3 MET 1 HE3 MET 1 53.716 7.878 4.686 852 H PHE 2 HN PHE 2 54.939 2.696 2.006 853 HA PHE 2 HA PHE 2 54.759 4.042 -0.563 854 HB2 PHE 2 HB2 PHE 2 53.816 1.298 0.304 855 HB3 PHE 2 HB1 PHE 2 53.852 1.894 -1.355 856 HD1 PHE 2 HD1 PHE 2 55.718 0.279 1.239 857 HD2 PHE 2 HD2 PHE 2 56.129 2.718 -2.274 858 HE1 PHE 2 HE1 PHE 2 58.097 -0.396 1.049 859 HE2 PHE 2 HE2 PHE 2 58.508 2.041 -2.464 860 HZ PHE 2 HZ PHE 2 59.492 0.485 -0.803 861 H GLU 3 HN GLU 3 52.715 3.278 2.151 862 HA GLU 3 HA GLU 3 50.246 3.694 0.737 863 HB2 GLU 3 HB2 GLU 3 49.212 3.576 2.967 864 HB3 GLU 3 HB1 GLU 3 50.337 2.243 2.715 865 HG2 GLU 3 HG2 GLU 3 51.861 4.384 3.765 866 HG3 GLU 3 HG1 GLU 3 50.395 4.294 4.741 867 HA PRO 4 HA PRO 4 50.030 8.109 1.077 868 HB2 PRO 4 HB2 PRO 4 47.326 8.488 1.253 869 HB3 PRO 4 HB1 PRO 4 48.149 8.023 -0.249 870 HG2 PRO 4 HG2 PRO 4 46.615 6.343 1.669 871 HG3 PRO 4 HG1 PRO 4 46.677 6.273 -0.100 872 HD2 PRO 4 HD2 PRO 4 48.065 4.549 1.524 873 HD3 PRO 4 HD1 PRO 4 48.586 4.982 -0.117 874 H PHE 5 HN PHE 5 47.925 6.378 3.371 875 HA PHE 5 HA PHE 5 48.902 8.107 5.528 876 HB2 PHE 5 HB2 PHE 5 46.188 8.159 4.433 877 HB3 PHE 5 HB1 PHE 5 46.217 7.841 6.166 878 HD1 PHE 5 HD1 PHE 5 46.950 10.273 3.530 879 HD2 PHE 5 HD2 PHE 5 47.219 9.442 7.733 880 HE1 PHE 5 HE1 PHE 5 47.402 12.670 3.973 881 HE2 PHE 5 HE2 PHE 5 47.672 11.838 8.180 882 HZ PHE 5 HZ PHE 5 47.763 13.453 6.299 883 H GLN 6 HN GLN 6 46.125 5.930 5.587 884 HA GLN 6 HA GLN 6 47.671 3.772 6.779 885 HB2 GLN 6 HB2 GLN 6 45.526 5.253 8.319 886 HB3 GLN 6 HB1 GLN 6 46.249 3.725 8.818 887 HG2 GLN 6 HG2 GLN 6 48.501 4.862 8.741 888 HG3 GLN 6 HG1 GLN 6 47.655 6.386 8.475 889 HE21 GLN 6 HE21 GLN 6 46.806 7.447 10.304 890 HE22 GLN 6 HE22 GLN 6 46.810 6.784 11.867 891 H ILE 7 HN ILE 7 46.347 1.852 7.140 892 HA ILE 7 HA ILE 7 44.694 1.254 4.956 893 HB ILE 7 HB ILE 7 44.204 -0.830 6.130 894 HG12 ILE 7 HG12 ILE 7 45.387 0.591 8.541 895 HG13 ILE 7 HG11 ILE 7 43.710 0.077 8.350 896 HG21 ILE 7 HG21 ILE 7 46.535 -0.322 5.191 897 HG22 ILE 7 HG22 ILE 7 46.435 -1.629 6.369 898 HG23 ILE 7 HG23 ILE 7 47.033 -0.043 6.859 899 HD11 ILE 7 HD11 ILE 7 46.157 -1.684 8.589 900 HD12 ILE 7 HD12 ILE 7 44.588 -2.293 8.061 901 HD13 ILE 7 HD13 ILE 7 44.771 -1.609 9.676 902 H LEU 8 HN LEU 8 43.958 2.410 8.182 903 HA LEU 8 HA LEU 8 41.119 2.053 8.002 904 HB2 LEU 8 HB2 LEU 8 42.841 3.736 9.837 905 HB3 LEU 8 HB1 LEU 8 41.091 3.585 10.000 906 HG LEU 8 HG LEU 8 42.960 1.202 9.957 907 HD11 LEU 8 HD11 LEU 8 41.852 2.795 12.283 908 HD12 LEU 8 HD12 LEU 8 43.546 2.480 11.911 909 HD13 LEU 8 HD13 LEU 8 42.504 1.165 12.451 910 HD21 LEU 8 HD21 LEU 8 40.904 0.185 11.119 911 HD22 LEU 8 HD22 LEU 8 40.729 0.547 9.403 912 HD23 LEU 8 HD23 LEU 8 40.034 1.631 10.607 913 H SER 9 HN SER 9 43.365 4.600 7.218 914 HA SER 9 HA SER 9 41.412 6.660 6.830 915 HB2 SER 9 HB2 SER 9 43.770 7.198 7.260 916 HB3 SER 9 HB1 SER 9 44.228 6.431 5.742 917 HG SER 9 HG SER 9 43.634 8.177 4.741 918 H ILE 10 HN ILE 10 43.093 4.391 4.677 919 HA ILE 10 HA ILE 10 42.019 5.372 2.249 920 HB ILE 10 HB ILE 10 43.064 2.646 3.027 921 HG12 ILE 10 HG12 ILE 10 44.304 4.754 1.247 922 HG13 ILE 10 HG11 ILE 10 44.582 4.718 2.990 923 HG21 ILE 10 HG21 ILE 10 43.251 2.384 0.489 924 HG22 ILE 10 HG22 ILE 10 42.148 3.755 0.363 925 HG23 ILE 10 HG23 ILE 10 41.622 2.269 1.155 926 HD11 ILE 10 HD11 ILE 10 46.302 3.486 1.547 927 HD12 ILE 10 HD12 ILE 10 45.042 2.298 1.234 928 HD13 ILE 10 HD13 ILE 10 45.609 2.570 2.882 929 H CYS 11 HN CYS 11 40.976 2.736 4.410 930 HA CYS 11 HA CYS 11 38.790 1.853 2.884 931 HB2 CYS 11 HB2 CYS 11 39.791 0.723 4.917 932 HB3 CYS 11 HB1 CYS 11 38.927 1.900 5.905 933 HG CYS 11 HG CYS 11 37.262 0.188 3.910 934 H SER 12 HN SER 12 38.873 4.200 5.590 935 HA SER 12 HA SER 12 36.155 4.875 5.485 936 HB2 SER 12 HB2 SER 12 36.814 6.916 6.687 937 HB3 SER 12 HB1 SER 12 37.610 5.492 7.358 938 HG SER 12 HG SER 12 39.165 7.049 7.058 939 H PHE 13 HN PHE 13 38.954 6.207 3.736 940 HA PHE 13 HA PHE 13 37.752 8.444 2.600 941 HB2 PHE 13 HB2 PHE 13 40.113 8.127 2.380 942 HB3 PHE 13 HB1 PHE 13 39.888 6.583 1.556 943 HD1 PHE 13 HD1 PHE 13 39.240 10.245 1.250 944 HD2 PHE 13 HD2 PHE 13 39.598 6.481 -0.791 945 HE1 PHE 13 HE1 PHE 13 39.145 11.418 -0.931 946 HE2 PHE 13 HE2 PHE 13 39.504 7.656 -2.973 947 HZ PHE 13 HZ PHE 13 39.277 10.125 -3.043 948 H ILE 14 HN ILE 14 38.102 5.211 1.115 949 HA ILE 14 HA ILE 14 36.502 5.809 -1.142 950 HB ILE 14 HB ILE 14 38.073 3.948 -1.154 951 HG12 ILE 14 HG12 ILE 14 36.453 2.102 -1.912 952 HG13 ILE 14 HG11 ILE 14 35.157 3.222 -1.520 953 HG21 ILE 14 HG21 ILE 14 37.807 3.309 1.227 954 HG22 ILE 14 HG22 ILE 14 37.689 1.928 0.148 955 HG23 ILE 14 HG23 ILE 14 36.232 2.614 0.850 956 HD11 ILE 14 HD11 ILE 14 37.407 3.666 -3.494 957 HD12 ILE 14 HD12 ILE 14 36.264 4.918 -3.013 958 HD13 ILE 14 HD13 ILE 14 35.693 3.486 -3.866 959 H LEU 15 HN LEU 15 35.758 4.370 1.999 960 HA LEU 15 HA LEU 15 33.084 3.668 1.432 961 HB2 LEU 15 HB2 LEU 15 34.676 4.125 3.927 962 HB3 LEU 15 HB1 LEU 15 32.922 3.973 4.046 963 HG LEU 15 HG LEU 15 34.553 1.957 2.497 964 HD11 LEU 15 HD11 LEU 15 34.725 0.591 4.490 965 HD12 LEU 15 HD12 LEU 15 33.802 1.765 5.429 966 HD13 LEU 15 HD13 LEU 15 35.422 2.168 4.859 967 HD21 LEU 15 HD21 LEU 15 31.907 1.806 3.980 968 HD22 LEU 15 HD22 LEU 15 32.613 0.534 2.984 969 HD23 LEU 15 HD23 LEU 15 32.071 2.037 2.241 970 H SER 16 HN SER 16 34.596 6.669 2.261 971 HA SER 16 HA SER 16 32.201 8.037 3.047 972 HB2 SER 16 HB2 SER 16 34.906 9.070 2.201 973 HB3 SER 16 HB1 SER 16 33.603 10.071 2.841 974 HG SER 16 HG SER 16 34.672 9.537 4.629 975 H ALA 17 HN ALA 17 34.176 7.902 0.093 976 HA ALA 17 HA ALA 17 32.724 9.762 -1.416 977 HB1 ALA 17 HB1 ALA 17 33.876 8.940 -3.279 978 HB2 ALA 17 HB2 ALA 17 33.883 7.286 -2.665 979 HB3 ALA 17 HB3 ALA 17 34.946 8.500 -1.950 980 H LEU 18 HN LEU 18 32.360 6.198 -1.278 981 HA LEU 18 HA LEU 18 30.046 6.165 -2.934 982 HB2 LEU 18 HB2 LEU 18 31.690 4.247 -2.333 983 HB3 LEU 18 HB1 LEU 18 30.675 4.041 -0.905 984 HG LEU 18 HG LEU 18 29.133 4.347 -3.385 985 HD11 LEU 18 HD11 LEU 18 29.685 2.217 -4.360 986 HD12 LEU 18 HD12 LEU 18 30.778 1.827 -3.032 987 HD13 LEU 18 HD13 LEU 18 31.198 3.104 -4.174 988 HD21 LEU 18 HD21 LEU 18 27.934 2.449 -2.419 989 HD22 LEU 18 HD22 LEU 18 28.247 3.646 -1.163 990 HD23 LEU 18 HD23 LEU 18 29.235 2.189 -1.257 991 H HIS 19 HN HIS 19 30.599 6.697 0.435 992 HA HIS 19 HA HIS 19 28.044 6.026 1.435 993 HB2 HIS 19 HB2 HIS 19 29.585 6.316 3.128 994 HB3 HIS 19 HB1 HIS 19 30.286 7.745 2.386 995 HD2 HIS 19 HD2 HIS 19 28.899 10.176 2.903 996 HE1 HIS 19 HE1 HIS 19 26.214 8.524 5.713 997 HE2 HIS 19 HE2 HIS 19 27.085 10.690 4.709 998 H PHE 20 HN PHE 20 29.393 9.176 0.463 999 HA PHE 20 HA PHE 20 26.877 10.515 0.760 1000 HB2 PHE 20 HB2 PHE 20 29.600 11.248 0.254 1001 HB3 PHE 20 HB1 PHE 20 28.574 11.981 -0.980 1002 HD1 PHE 20 HD1 PHE 20 29.791 12.302 2.338 1003 HD2 PHE 20 HD2 PHE 20 26.336 13.062 -0.100 1004 HE1 PHE 20 HE1 PHE 20 28.990 13.975 3.987 1005 HE2 PHE 20 HE2 PHE 20 25.539 14.731 1.547 1006 HZ PHE 20 HZ PHE 20 26.855 15.178 3.590 1007 H MET 21 HN MET 21 28.376 8.639 -1.733 1008 HA MET 21 HA MET 21 26.998 9.774 -3.956 1009 HB2 MET 21 HB2 MET 21 28.957 7.823 -3.529 1010 HB3 MET 21 HB1 MET 21 27.603 6.967 -4.262 1011 HG2 MET 21 HG2 MET 21 28.935 7.804 -6.071 1012 HG3 MET 21 HG1 MET 21 27.506 8.833 -5.983 1013 HE1 MET 21 HE1 MET 21 27.833 11.014 -6.663 1014 HE2 MET 21 HE2 MET 21 29.197 10.398 -7.591 1015 HE3 MET 21 HE3 MET 21 29.364 11.901 -6.688 1016 H ALA 22 HN ALA 22 26.484 6.718 -2.183 1017 HA ALA 22 HA ALA 22 24.013 6.126 -3.433 1018 HB1 ALA 22 HB1 ALA 22 23.937 4.273 -2.075 1019 HB2 ALA 22 HB2 ALA 22 24.585 5.136 -0.680 1020 HB3 ALA 22 HB3 ALA 22 25.659 4.643 -1.989 1021 H TRP 23 HN TRP 23 24.823 7.808 -0.419 1022 HA TRP 23 HA TRP 23 22.208 8.005 0.611 1023 HB2 TRP 23 HB2 TRP 23 24.501 8.558 1.705 1024 HB3 TRP 23 HB1 TRP 23 24.271 10.155 0.995 1025 HD1 TRP 23 HD1 TRP 23 23.133 7.943 3.790 1026 HE1 TRP 23 HE1 TRP 23 21.402 9.183 5.239 1027 HE3 TRP 23 HE3 TRP 23 22.255 12.007 0.827 1028 HZ2 TRP 23 HZ2 TRP 23 19.846 11.581 5.153 1029 HZ3 TRP 23 HZ3 TRP 23 20.642 13.751 1.533 1030 HH2 TRP 23 HH2 TRP 23 19.438 13.544 3.691 1031 H THR 24 HN THR 24 24.037 10.110 -1.595 1032 HA THR 24 HA THR 24 22.066 12.164 -1.731 1033 HB THR 24 HB THR 24 23.307 12.754 -3.880 1034 HG1 THR 24 HG1 THR 24 24.137 10.784 -4.422 1035 HG21 THR 24 HG21 THR 24 24.616 12.519 -1.173 1036 HG22 THR 24 HG22 THR 24 23.960 13.952 -1.965 1037 HG23 THR 24 HG23 THR 24 25.471 13.246 -2.534 1038 H ILE 25 HN ILE 25 22.672 9.218 -3.602 1039 HA ILE 25 HA ILE 25 20.833 9.726 -5.681 1040 HB ILE 25 HB ILE 25 21.888 7.158 -4.493 1041 HG12 ILE 25 HG12 ILE 25 22.450 8.450 -7.171 1042 HG13 ILE 25 HG11 ILE 25 23.410 8.799 -5.735 1043 HG21 ILE 25 HG21 ILE 25 20.097 7.633 -6.890 1044 HG22 ILE 25 HG22 ILE 25 19.771 6.603 -5.496 1045 HG23 ILE 25 HG23 ILE 25 21.022 6.150 -6.653 1046 HD11 ILE 25 HD11 ILE 25 23.033 6.108 -7.075 1047 HD12 ILE 25 HD12 ILE 25 23.798 6.312 -5.501 1048 HD13 ILE 25 HD13 ILE 25 24.529 7.030 -6.934 1049 H GLY 26 HN GLY 26 20.469 8.046 -2.560 1050 HA2 GLY 26 HA2 GLY 26 17.774 7.272 -2.910 1051 HA3 GLY 26 HA1 GLY 26 18.591 7.453 -1.361 1052 H HIS 27 HN HIS 27 19.243 10.172 -1.501 1053 HA HIS 27 HA HIS 27 16.885 11.382 -0.552 1054 HB2 HIS 27 HB2 HIS 27 18.960 12.277 0.185 1055 HB3 HIS 27 HB1 HIS 27 19.523 12.530 -1.467 1056 HD2 HIS 27 HD2 HIS 27 18.975 15.053 -2.432 1057 HE1 HIS 27 HE1 HIS 27 16.021 16.146 0.380 1058 HE2 HIS 27 HE2 HIS 27 17.399 16.958 -1.593 1059 H LEU 28 HN LEU 28 18.496 11.552 -3.709 1060 HA LEU 28 HA LEU 28 16.449 13.337 -4.760 1061 HB2 LEU 28 HB2 LEU 28 18.820 11.998 -6.087 1062 HB3 LEU 28 HB1 LEU 28 17.773 13.199 -6.846 1063 HG LEU 28 HG LEU 28 19.329 13.688 -4.290 1064 HD11 LEU 28 HD11 LEU 28 19.954 14.712 -7.072 1065 HD12 LEU 28 HD12 LEU 28 20.752 13.311 -6.358 1066 HD13 LEU 28 HD13 LEU 28 20.930 14.901 -5.616 1067 HD21 LEU 28 HD21 LEU 28 17.672 15.418 -6.143 1068 HD22 LEU 28 HD22 LEU 28 18.813 16.100 -4.985 1069 HD23 LEU 28 HD23 LEU 28 17.440 15.152 -4.415 1070 H ASN 29 HN ASN 29 14.764 12.754 -6.021 1071 HA ASN 29 HA ASN 29 14.168 9.922 -6.255 1072 HB2 ASN 29 HB2 ASN 29 12.436 11.583 -5.606 1073 HB3 ASN 29 HB1 ASN 29 12.576 12.315 -7.203 1074 HD21 ASN 29 HD21 ASN 29 10.587 11.713 -8.145 1075 HD22 ASN 29 HD22 ASN 29 10.073 10.103 -8.313 1076 H GLN 30 HN GLN 30 14.854 8.756 -7.920 1077 HA GLN 30 HA GLN 30 15.571 10.100 -10.426 1078 HB2 GLN 30 HB2 GLN 30 16.049 7.273 -9.444 1079 HB3 GLN 30 HB1 GLN 30 16.570 7.887 -11.013 1080 HG2 GLN 30 HG2 GLN 30 17.946 9.593 -9.923 1081 HG3 GLN 30 HG1 GLN 30 17.381 9.065 -8.339 1082 HE21 GLN 30 HE21 GLN 30 20.174 9.004 -9.625 1083 HE22 GLN 30 HE22 GLN 30 20.674 7.392 -9.442 1084 H ILE 31 HN ILE 31 14.613 9.651 -12.369 1085 HA ILE 31 HA ILE 31 12.282 7.838 -12.338 1086 HB ILE 31 HB ILE 31 11.062 9.470 -13.726 1087 HG12 ILE 31 HG12 ILE 31 13.322 11.378 -13.061 1088 HG13 ILE 31 HG11 ILE 31 13.177 10.559 -14.615 1089 HG21 ILE 31 HG21 ILE 31 12.080 10.770 -11.188 1090 HG22 ILE 31 HG22 ILE 31 10.929 9.434 -11.193 1091 HG23 ILE 31 HG23 ILE 31 10.497 10.974 -11.938 1092 HD11 ILE 31 HD11 ILE 31 12.178 12.844 -14.643 1093 HD12 ILE 31 HD12 ILE 31 11.036 12.327 -13.402 1094 HD13 ILE 31 HD13 ILE 31 10.999 11.583 -15.001 1095 H LYS 32 HN LYS 32 11.701 6.951 -14.391 1096 HA LYS 32 HA LYS 32 14.008 6.533 -16.116 1097 HB2 LYS 32 HB2 LYS 32 11.338 5.246 -15.749 1098 HB3 LYS 32 HB1 LYS 32 12.152 5.055 -17.302 1099 HG2 LYS 32 HG2 LYS 32 13.721 4.609 -14.788 1100 HG3 LYS 32 HG1 LYS 32 12.618 3.347 -15.338 1101 HD2 LYS 32 HD2 LYS 32 14.288 4.487 -17.478 1102 HD3 LYS 32 HD1 LYS 32 15.203 3.653 -16.222 1103 HE2 LYS 32 HE2 LYS 32 12.750 2.271 -17.149 1104 HE3 LYS 32 HE1 LYS 32 14.061 2.372 -18.324 1105 HZ1 LYS 32 HZ1 LYS 32 14.152 0.388 -16.865 1106 HZ2 LYS 32 HZ2 LYS 32 14.406 1.417 -15.536 1107 HZ3 LYS 32 HZ3 LYS 32 15.547 1.350 -16.795 1108 H ARG 33 HN ARG 33 14.350 8.273 -17.414 1109 HA ARG 33 HA ARG 33 12.091 9.494 -18.826 1110 HB2 ARG 33 HB2 ARG 33 15.004 10.232 -18.534 1111 HB3 ARG 33 HB1 ARG 33 13.920 11.066 -19.648 1112 HG2 ARG 33 HG2 ARG 33 12.491 11.782 -17.865 1113 HG3 ARG 33 HG1 ARG 33 13.299 10.725 -16.706 1114 HD2 ARG 33 HD2 ARG 33 14.047 13.063 -16.445 1115 HD3 ARG 33 HD1 ARG 33 15.373 12.023 -16.954 1116 HE ARG 33 HE ARG 33 15.449 13.180 -18.964 1117 HH11 ARG 33 HH11 ARG 33 12.470 13.869 -17.287 1118 HH12 ARG 33 HH12 ARG 33 12.009 15.129 -18.374 1119 HH21 ARG 33 HH21 ARG 33 14.819 14.834 -20.371 1120 HH22 ARG 33 HH22 ARG 33 13.328 15.673 -20.109 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 51.793 26.087 5.256 2 H2 MET 1 HT2 MET 1 52.150 24.435 5.425 3 H3 MET 1 HT3 MET 1 53.222 25.458 4.593 4 HA MET 1 HA MET 1 53.476 24.748 7.175 5 HB2 MET 1 HB2 MET 1 54.885 26.175 5.337 6 HB3 MET 1 HB1 MET 1 54.464 27.454 6.477 7 HG2 MET 1 HG2 MET 1 56.530 26.551 7.262 8 HG3 MET 1 HG1 MET 1 55.288 25.883 8.321 9 HE1 MET 1 HE1 MET 1 57.657 22.945 8.229 10 HE2 MET 1 HE2 MET 1 56.245 23.495 9.126 11 HE3 MET 1 HE3 MET 1 57.545 24.627 8.764 12 H PHE 2 HN PHE 2 50.754 25.612 6.899 13 HA PHE 2 HA PHE 2 50.558 27.265 9.261 14 HB2 PHE 2 HB2 PHE 2 48.968 28.869 7.977 15 HB3 PHE 2 HB1 PHE 2 50.709 29.117 7.833 16 HD1 PHE 2 HD1 PHE 2 47.737 27.629 6.165 17 HD2 PHE 2 HD2 PHE 2 51.839 28.836 5.750 18 HE1 PHE 2 HE1 PHE 2 47.586 27.302 3.712 19 HE2 PHE 2 HE2 PHE 2 51.686 28.510 3.296 20 HZ PHE 2 HZ PHE 2 49.560 27.742 2.277 21 H GLU 3 HN GLU 3 49.752 24.584 8.224 22 HA GLU 3 HA GLU 3 46.912 24.640 7.866 23 HB2 GLU 3 HB2 GLU 3 48.798 22.363 8.515 24 HB3 GLU 3 HB1 GLU 3 47.087 22.164 8.139 25 HG2 GLU 3 HG2 GLU 3 48.059 21.849 6.042 26 HG3 GLU 3 HG1 GLU 3 47.671 23.567 6.000 27 HA PRO 4 HA PRO 4 45.773 24.765 12.160 28 HB2 PRO 4 HB2 PRO 4 43.298 23.641 12.079 29 HB3 PRO 4 HB1 PRO 4 43.640 25.256 11.427 30 HG2 PRO 4 HG2 PRO 4 43.345 22.661 9.995 31 HG3 PRO 4 HG1 PRO 4 42.770 24.275 9.541 32 HD2 PRO 4 HD2 PRO 4 45.031 23.122 8.485 33 HD3 PRO 4 HD1 PRO 4 44.791 24.878 8.613 34 H PHE 5 HN PHE 5 45.274 21.665 10.504 35 HA PHE 5 HA PHE 5 46.411 20.252 12.796 36 HB2 PHE 5 HB2 PHE 5 43.567 20.129 11.995 37 HB3 PHE 5 HB1 PHE 5 44.347 18.571 12.261 38 HD1 PHE 5 HD1 PHE 5 43.083 21.609 13.814 39 HD2 PHE 5 HD2 PHE 5 45.456 18.087 14.459 40 HE1 PHE 5 HE1 PHE 5 42.894 21.931 16.266 41 HE2 PHE 5 HE2 PHE 5 45.269 18.410 16.912 42 HZ PHE 5 HZ PHE 5 43.983 20.332 17.820 43 H GLN 6 HN GLN 6 44.455 18.918 10.162 44 HA GLN 6 HA GLN 6 46.836 18.155 8.665 45 HB2 GLN 6 HB2 GLN 6 44.954 16.140 9.907 46 HB3 GLN 6 HB1 GLN 6 46.097 15.755 8.620 47 HG2 GLN 6 HG2 GLN 6 47.950 16.588 10.065 48 HG3 GLN 6 HG1 GLN 6 46.785 16.850 11.361 49 HE21 GLN 6 HE21 GLN 6 48.987 14.600 10.187 50 HE22 GLN 6 HE22 GLN 6 48.341 13.205 10.907 51 H ILE 7 HN ILE 7 46.280 17.176 6.587 52 HA ILE 7 HA ILE 7 44.237 18.615 5.261 53 HB ILE 7 HB ILE 7 45.548 16.077 4.274 54 HG12 ILE 7 HG12 ILE 7 47.349 17.505 5.023 55 HG13 ILE 7 HG11 ILE 7 47.251 17.658 3.271 56 HG21 ILE 7 HG21 ILE 7 43.688 16.944 2.917 57 HG22 ILE 7 HG22 ILE 7 45.223 17.151 2.073 58 HG23 ILE 7 HG23 ILE 7 44.458 18.530 2.862 59 HD11 ILE 7 HD11 ILE 7 46.279 19.609 5.363 60 HD12 ILE 7 HD12 ILE 7 45.757 19.700 3.682 61 HD13 ILE 7 HD13 ILE 7 47.463 19.883 4.087 62 H LEU 8 HN LEU 8 44.439 15.273 6.391 63 HA LEU 8 HA LEU 8 41.895 14.456 5.361 64 HB2 LEU 8 HB2 LEU 8 43.961 13.315 7.141 65 HB3 LEU 8 HB1 LEU 8 42.319 12.745 7.429 66 HG LEU 8 HG LEU 8 43.639 11.377 5.762 67 HD11 LEU 8 HD11 LEU 8 41.228 12.687 4.491 68 HD12 LEU 8 HD12 LEU 8 41.082 11.594 5.867 69 HD13 LEU 8 HD13 LEU 8 41.763 11.013 4.348 70 HD21 LEU 8 HD21 LEU 8 44.697 13.485 4.743 71 HD22 LEU 8 HD22 LEU 8 43.170 13.706 3.888 72 HD23 LEU 8 HD23 LEU 8 44.137 12.257 3.609 73 H SER 9 HN SER 9 42.996 15.856 8.380 74 HA SER 9 HA SER 9 40.555 15.457 9.825 75 HB2 SER 9 HB2 SER 9 41.484 17.062 11.431 76 HB3 SER 9 HB1 SER 9 42.693 15.866 10.976 77 HG SER 9 HG SER 9 42.433 18.557 10.161 78 H ILE 10 HN ILE 10 41.913 18.133 7.944 79 HA ILE 10 HA ILE 10 39.817 19.966 8.445 80 HB ILE 10 HB ILE 10 41.957 19.742 6.354 81 HG12 ILE 10 HG12 ILE 10 42.258 20.631 8.757 82 HG13 ILE 10 HG11 ILE 10 42.837 21.660 7.449 83 HG21 ILE 10 HG21 ILE 10 41.078 22.046 5.588 84 HG22 ILE 10 HG22 ILE 10 39.559 21.584 6.358 85 HG23 ILE 10 HG23 ILE 10 40.202 20.622 5.027 86 HD11 ILE 10 HD11 ILE 10 41.161 23.223 7.749 87 HD12 ILE 10 HD12 ILE 10 41.283 22.626 9.402 88 HD13 ILE 10 HD13 ILE 10 40.001 22.039 8.351 89 H CYS 11 HN CYS 11 40.344 17.569 5.885 90 HA CYS 11 HA CYS 11 38.152 18.269 4.268 91 HB2 CYS 11 HB2 CYS 11 39.503 15.604 4.741 92 HB3 CYS 11 HB1 CYS 11 38.252 15.854 3.523 93 HG CYS 11 HG CYS 11 39.879 17.059 2.080 94 H SER 12 HN SER 12 38.384 15.848 6.892 95 HA SER 12 HA SER 12 35.702 15.044 6.837 96 HB2 SER 12 HB2 SER 12 37.425 13.823 8.080 97 HB3 SER 12 HB1 SER 12 37.596 15.174 9.195 98 HG SER 12 HG SER 12 35.138 13.842 8.711 99 H PHE 13 HN PHE 13 37.278 17.705 8.565 100 HA PHE 13 HA PHE 13 35.110 18.479 10.181 101 HB2 PHE 13 HB2 PHE 13 37.394 19.317 10.512 102 HB3 PHE 13 HB1 PHE 13 37.304 20.189 8.983 103 HD1 PHE 13 HD1 PHE 13 35.523 19.844 12.262 104 HD2 PHE 13 HD2 PHE 13 36.505 22.394 8.946 105 HE1 PHE 13 HE1 PHE 13 34.468 21.764 13.425 106 HE2 PHE 13 HE2 PHE 13 35.447 24.313 10.109 107 HZ PHE 13 HZ PHE 13 34.430 23.998 12.348 108 H ILE 14 HN ILE 14 36.119 19.746 6.982 109 HA ILE 14 HA ILE 14 33.895 21.496 6.734 110 HB ILE 14 HB ILE 14 35.960 21.803 5.434 111 HG12 ILE 14 HG12 ILE 14 33.652 21.261 3.554 112 HG13 ILE 14 HG11 ILE 14 33.670 22.630 4.667 113 HG21 ILE 14 HG21 ILE 14 35.068 19.252 4.067 114 HG22 ILE 14 HG22 ILE 14 36.577 19.530 4.934 115 HG23 ILE 14 HG23 ILE 14 36.278 20.348 3.402 116 HD11 ILE 14 HD11 ILE 14 35.709 22.046 2.500 117 HD12 ILE 14 HD12 ILE 14 35.845 23.356 3.674 118 HD13 ILE 14 HD13 ILE 14 34.527 23.356 2.502 119 H LEU 15 HN LEU 15 34.402 18.131 5.968 120 HA LEU 15 HA LEU 15 32.172 17.735 4.277 121 HB2 LEU 15 HB2 LEU 15 33.781 15.938 6.074 122 HB3 LEU 15 HB1 LEU 15 32.346 15.328 5.249 123 HG LEU 15 HG LEU 15 34.468 16.827 3.723 124 HD11 LEU 15 HD11 LEU 15 35.743 15.078 4.738 125 HD12 LEU 15 HD12 LEU 15 35.337 14.496 3.124 126 HD13 LEU 15 HD13 LEU 15 34.441 13.908 4.524 127 HD21 LEU 15 HD21 LEU 15 33.550 15.534 1.853 128 HD22 LEU 15 HD22 LEU 15 32.245 16.375 2.690 129 HD23 LEU 15 HD23 LEU 15 32.495 14.650 2.957 130 H SER 16 HN SER 16 32.470 16.830 7.725 131 HA SER 16 HA SER 16 29.811 16.296 8.207 132 HB2 SER 16 HB2 SER 16 30.293 16.741 10.569 133 HB3 SER 16 HB1 SER 16 31.613 15.851 9.817 134 HG SER 16 HG SER 16 32.496 17.541 10.958 135 H ALA 17 HN ALA 17 31.436 19.450 8.183 136 HA ALA 17 HA ALA 17 29.317 20.960 9.287 137 HB1 ALA 17 HB1 ALA 17 31.481 21.714 7.310 138 HB2 ALA 17 HB2 ALA 17 31.497 21.961 9.057 139 HB3 ALA 17 HB3 ALA 17 30.379 22.876 8.046 140 H LEU 18 HN LEU 18 30.137 20.190 5.929 141 HA LEU 18 HA LEU 18 27.953 21.547 4.735 142 HB2 LEU 18 HB2 LEU 18 29.642 19.235 3.761 143 HB3 LEU 18 HB1 LEU 18 28.455 20.071 2.760 144 HG LEU 18 HG LEU 18 30.732 21.475 4.178 145 HD11 LEU 18 HD11 LEU 18 31.936 21.464 2.108 146 HD12 LEU 18 HD12 LEU 18 30.559 20.790 1.236 147 HD13 LEU 18 HD13 LEU 18 31.440 19.796 2.396 148 HD21 LEU 18 HD21 LEU 18 28.670 22.288 2.121 149 HD22 LEU 18 HD22 LEU 18 30.143 23.218 2.391 150 HD23 LEU 18 HD23 LEU 18 28.978 23.016 3.697 151 H HIS 19 HN HIS 19 28.357 18.308 5.973 152 HA HIS 19 HA HIS 19 25.947 17.201 4.954 153 HB2 HIS 19 HB2 HIS 19 27.159 15.444 5.663 154 HB3 HIS 19 HB1 HIS 19 28.079 16.428 6.799 155 HD2 HIS 19 HD2 HIS 19 26.876 16.660 9.408 156 HE1 HIS 19 HE1 HIS 19 24.044 13.595 8.776 157 HE2 HIS 19 HE2 HIS 19 25.112 15.094 10.526 158 H PHE 20 HN PHE 20 26.744 18.921 7.903 159 HA PHE 20 HA PHE 20 24.187 18.487 9.159 160 HB2 PHE 20 HB2 PHE 20 26.717 19.570 9.903 161 HB3 PHE 20 HB1 PHE 20 25.485 20.790 10.223 162 HD1 PHE 20 HD1 PHE 20 26.649 17.380 11.019 163 HD2 PHE 20 HD2 PHE 20 23.700 20.394 11.827 164 HE1 PHE 20 HE1 PHE 20 25.914 16.121 13.027 165 HE2 PHE 20 HE2 PHE 20 22.964 19.140 13.835 166 HZ PHE 20 HZ PHE 20 24.060 17.000 14.438 167 H MET 21 HN MET 21 25.666 21.003 7.186 168 HA MET 21 HA MET 21 23.581 22.927 7.551 169 HB2 MET 21 HB2 MET 21 25.824 22.619 5.558 170 HB3 MET 21 HB1 MET 21 24.681 23.964 5.499 171 HG2 MET 21 HG2 MET 21 25.250 24.544 7.835 172 HG3 MET 21 HG1 MET 21 26.408 23.218 7.877 173 HE1 MET 21 HE1 MET 21 28.188 26.753 7.839 174 HE2 MET 21 HE2 MET 21 28.430 25.163 8.555 175 HE3 MET 21 HE3 MET 21 26.864 25.954 8.697 176 H ALA 22 HN ALA 22 24.444 20.809 4.849 177 HA ALA 22 HA ALA 22 22.272 21.489 3.191 178 HB1 ALA 22 HB1 ALA 22 22.749 19.118 2.215 179 HB2 ALA 22 HB2 ALA 22 24.129 19.144 3.314 180 HB3 ALA 22 HB3 ALA 22 23.970 20.381 2.067 181 H TRP 23 HN TRP 23 22.619 18.894 5.601 182 HA TRP 23 HA TRP 23 19.996 17.861 5.037 183 HB2 TRP 23 HB2 TRP 23 21.967 17.332 7.248 184 HB3 TRP 23 HB1 TRP 23 20.352 16.626 7.251 185 HD1 TRP 23 HD1 TRP 23 23.620 15.622 6.363 186 HE1 TRP 23 HE1 TRP 23 23.664 13.892 4.453 187 HE3 TRP 23 HE3 TRP 23 18.894 16.225 4.512 188 HZ2 TRP 23 HZ2 TRP 23 21.928 12.902 2.403 189 HZ3 TRP 23 HZ3 TRP 23 18.122 14.885 2.577 190 HH2 TRP 23 HH2 TRP 23 19.630 13.224 1.523 191 H THR 24 HN THR 24 21.286 20.333 7.126 192 HA THR 24 HA THR 24 19.104 20.509 8.938 193 HB THR 24 HB THR 24 21.329 22.319 8.099 194 HG1 THR 24 HG1 THR 24 21.591 22.257 10.405 195 HG21 THR 24 HG21 THR 24 18.813 23.155 9.546 196 HG22 THR 24 HG22 THR 24 19.590 23.935 8.169 197 HG23 THR 24 HG23 THR 24 20.342 24.007 9.761 198 H ILE 25 HN ILE 25 19.885 22.479 6.059 199 HA ILE 25 HA ILE 25 17.419 23.880 6.048 200 HB ILE 25 HB ILE 25 19.461 23.402 3.872 201 HG12 ILE 25 HG12 ILE 25 18.831 25.898 5.473 202 HG13 ILE 25 HG11 ILE 25 20.071 24.740 5.954 203 HG21 ILE 25 HG21 ILE 25 17.360 23.880 2.785 204 HG22 ILE 25 HG22 ILE 25 18.300 25.372 2.784 205 HG23 ILE 25 HG23 ILE 25 16.991 25.157 3.946 206 HD11 ILE 25 HD11 ILE 25 20.026 26.003 3.206 207 HD12 ILE 25 HD12 ILE 25 21.355 25.145 3.985 208 HD13 ILE 25 HD13 ILE 25 20.873 26.738 4.568 209 H GLY 26 HN GLY 26 18.537 21.009 4.295 210 HA2 GLY 26 HA2 GLY 26 16.280 20.658 2.644 211 HA3 GLY 26 HA1 GLY 26 17.397 19.384 3.126 212 H HIS 27 HN HIS 27 16.967 19.663 5.938 213 HA HIS 27 HA HIS 27 14.659 17.990 6.241 214 HB2 HIS 27 HB2 HIS 27 16.510 17.559 7.682 215 HB3 HIS 27 HB1 HIS 27 16.566 19.239 8.220 216 HD2 HIS 27 HD2 HIS 27 14.949 19.785 10.403 217 HE1 HIS 27 HE1 HIS 27 12.717 16.200 10.374 218 HE2 HIS 27 HE2 HIS 27 13.140 18.363 11.638 219 H LEU 28 HN LEU 28 15.417 21.367 6.885 220 HA LEU 28 HA LEU 28 13.157 22.009 8.444 221 HB2 LEU 28 HB2 LEU 28 15.249 23.413 8.081 222 HB3 LEU 28 HB1 LEU 28 14.552 23.882 6.531 223 HG LEU 28 HG LEU 28 12.466 24.574 7.832 224 HD11 LEU 28 HD11 LEU 28 13.022 25.165 10.260 225 HD12 LEU 28 HD12 LEU 28 14.417 24.099 10.096 226 HD13 LEU 28 HD13 LEU 28 12.785 23.452 9.917 227 HD21 LEU 28 HD21 LEU 28 13.900 26.292 6.982 228 HD22 LEU 28 HD22 LEU 28 15.137 25.955 8.194 229 HD23 LEU 28 HD23 LEU 28 13.612 26.700 8.674 230 H ASN 29 HN ASN 29 11.088 22.421 7.940 231 HA ASN 29 HA ASN 29 10.366 22.716 5.089 232 HB2 ASN 29 HB2 ASN 29 8.320 21.386 5.560 233 HB3 ASN 29 HB1 ASN 29 9.797 20.446 5.757 234 HD21 ASN 29 HD21 ASN 29 6.880 20.828 7.197 235 HD22 ASN 29 HD22 ASN 29 7.306 20.561 8.818 236 H GLN 30 HN GLN 30 8.903 24.283 4.648 237 HA GLN 30 HA GLN 30 7.474 25.546 6.890 238 HB2 GLN 30 HB2 GLN 30 8.117 27.764 6.166 239 HB3 GLN 30 HB1 GLN 30 9.584 26.821 6.434 240 HG2 GLN 30 HG2 GLN 30 9.614 26.288 3.981 241 HG3 GLN 30 HG1 GLN 30 8.259 27.394 3.769 242 HE21 GLN 30 HE21 GLN 30 11.514 27.316 3.364 243 HE22 GLN 30 HE22 GLN 30 11.893 28.939 3.688 244 H ILE 31 HN ILE 31 5.487 26.352 6.364 245 HA ILE 31 HA ILE 31 4.695 26.377 3.538 246 HB ILE 31 HB ILE 31 2.647 25.106 4.063 247 HG12 ILE 31 HG12 ILE 31 3.965 24.584 6.745 248 HG13 ILE 31 HG11 ILE 31 2.641 25.725 6.510 249 HG21 ILE 31 HG21 ILE 31 5.180 23.659 4.895 250 HG22 ILE 31 HG22 ILE 31 4.696 23.960 3.226 251 HG23 ILE 31 HG23 ILE 31 3.715 22.915 4.254 252 HD11 ILE 31 HD11 ILE 31 2.573 22.745 5.955 253 HD12 ILE 31 HD12 ILE 31 1.265 23.863 5.566 254 HD13 ILE 31 HD13 ILE 31 1.724 23.592 7.247 255 H LYS 32 HN LYS 32 2.904 27.717 3.086 256 HA LYS 32 HA LYS 32 2.614 29.928 4.917 257 HB2 LYS 32 HB2 LYS 32 1.346 30.976 3.169 258 HB3 LYS 32 HB1 LYS 32 2.700 30.143 2.403 259 HG2 LYS 32 HG2 LYS 32 1.163 28.179 2.014 260 HG3 LYS 32 HG1 LYS 32 -0.169 29.186 2.580 261 HD2 LYS 32 HD2 LYS 32 0.334 30.838 0.808 262 HD3 LYS 32 HD1 LYS 32 1.644 29.808 0.230 263 HE2 LYS 32 HE2 LYS 32 -0.283 29.355 -1.147 264 HE3 LYS 32 HE1 LYS 32 -0.060 27.968 -0.082 265 HZ1 LYS 32 HZ1 LYS 32 -2.390 29.026 -0.327 266 HZ2 LYS 32 HZ2 LYS 32 -1.794 30.190 0.758 267 HZ3 LYS 32 HZ3 LYS 32 -1.849 28.553 1.210 268 H ARG 33 HN ARG 33 0.764 30.567 6.013 269 HA ARG 33 HA ARG 33 -1.114 28.403 6.602 270 HB2 ARG 33 HB2 ARG 33 -0.135 30.806 7.988 271 HB3 ARG 33 HB1 ARG 33 -1.860 30.499 8.196 272 HG2 ARG 33 HG2 ARG 33 -0.614 29.332 9.944 273 HG3 ARG 33 HG1 ARG 33 -1.331 28.151 8.846 274 HD2 ARG 33 HD2 ARG 33 0.766 27.827 7.708 275 HD3 ARG 33 HD1 ARG 33 1.504 29.176 8.566 276 HE ARG 33 HE ARG 33 1.111 26.491 9.573 277 HH11 ARG 33 HH11 ARG 33 1.549 29.852 10.389 278 HH12 ARG 33 HH12 ARG 33 2.199 29.511 11.954 279 HH21 ARG 33 HH21 ARG 33 1.976 26.075 11.623 280 HH22 ARG 33 HH22 ARG 33 2.440 27.391 12.650 281 H1 MET 1 HT1 MET 1 43.125 23.062 30.839 282 H2 MET 1 HT2 MET 1 43.976 22.961 29.372 283 H3 MET 1 HT3 MET 1 44.380 24.155 30.511 284 HA MET 1 HA MET 1 45.647 21.796 30.250 285 HB2 MET 1 HB2 MET 1 45.914 24.065 31.726 286 HB3 MET 1 HB1 MET 1 45.535 22.902 32.997 287 HG2 MET 1 HG2 MET 1 47.911 22.849 32.769 288 HG3 MET 1 HG1 MET 1 47.324 21.398 31.957 289 HE1 MET 1 HE1 MET 1 50.274 22.190 29.738 290 HE2 MET 1 HE2 MET 1 49.133 20.880 30.025 291 HE3 MET 1 HE3 MET 1 49.863 21.718 31.393 292 H PHE 2 HN PHE 2 42.856 21.141 30.340 293 HA PHE 2 HA PHE 2 42.965 18.927 32.195 294 HB2 PHE 2 HB2 PHE 2 40.655 19.641 33.147 295 HB3 PHE 2 HB1 PHE 2 42.107 20.392 33.811 296 HD1 PHE 2 HD1 PHE 2 39.318 20.860 31.397 297 HD2 PHE 2 HD2 PHE 2 42.534 22.726 33.548 298 HE1 PHE 2 HE1 PHE 2 38.483 23.093 30.710 299 HE2 PHE 2 HE2 PHE 2 41.699 24.958 32.862 300 HZ PHE 2 HZ PHE 2 39.674 25.141 31.442 301 H GLU 3 HN GLU 3 42.674 19.512 29.281 302 HA GLU 3 HA GLU 3 39.981 18.861 28.557 303 HB2 GLU 3 HB2 GLU 3 42.546 18.817 26.950 304 HB3 GLU 3 HB1 GLU 3 40.938 18.567 26.271 305 HG2 GLU 3 HG2 GLU 3 41.229 20.855 25.933 306 HG3 GLU 3 HG1 GLU 3 40.372 20.829 27.471 307 HA PRO 4 HA PRO 4 40.304 14.447 28.969 308 HB2 PRO 4 HB2 PRO 4 38.369 13.617 27.249 309 HB3 PRO 4 HB1 PRO 4 38.002 14.412 28.793 310 HG2 PRO 4 HG2 PRO 4 38.020 15.544 26.039 311 HG3 PRO 4 HG1 PRO 4 36.893 15.835 27.374 312 HD2 PRO 4 HD2 PRO 4 38.922 17.564 26.705 313 HD3 PRO 4 HD1 PRO 4 38.241 17.435 28.341 314 H PHE 5 HN PHE 5 40.212 15.702 25.649 315 HA PHE 5 HA PHE 5 42.382 13.893 24.902 316 HB2 PHE 5 HB2 PHE 5 39.593 13.649 23.947 317 HB3 PHE 5 HB1 PHE 5 40.830 13.609 22.691 318 HD1 PHE 5 HD1 PHE 5 39.319 11.834 25.485 319 HD2 PHE 5 HD2 PHE 5 42.680 11.920 22.811 320 HE1 PHE 5 HE1 PHE 5 39.850 9.486 26.079 321 HE2 PHE 5 HE2 PHE 5 43.211 9.571 23.405 322 HZ PHE 5 HZ PHE 5 41.797 8.353 25.038 323 H GLN 6 HN GLN 6 40.151 15.628 22.765 324 HA GLN 6 HA GLN 6 42.038 17.825 22.441 325 HB2 GLN 6 HB2 GLN 6 41.320 15.926 20.200 326 HB3 GLN 6 HB1 GLN 6 42.045 17.514 19.949 327 HG2 GLN 6 HG2 GLN 6 43.944 16.840 21.418 328 HG3 GLN 6 HG1 GLN 6 43.236 15.231 21.546 329 HE21 GLN 6 HE21 GLN 6 45.489 17.006 19.797 330 HE22 GLN 6 HE22 GLN 6 45.542 16.051 18.395 331 H ILE 7 HN ILE 7 41.147 19.539 21.075 332 HA ILE 7 HA ILE 7 38.464 20.130 21.751 333 HB ILE 7 HB ILE 7 40.056 21.407 19.521 334 HG12 ILE 7 HG12 ILE 7 41.515 21.390 21.447 335 HG13 ILE 7 HG11 ILE 7 40.815 23.003 21.333 336 HG21 ILE 7 HG21 ILE 7 37.693 22.067 19.691 337 HG22 ILE 7 HG22 ILE 7 38.744 23.400 20.168 338 HG23 ILE 7 HG23 ILE 7 37.914 22.447 21.399 339 HD11 ILE 7 HD11 ILE 7 40.057 20.780 23.231 340 HD12 ILE 7 HD12 ILE 7 39.017 22.178 22.960 341 HD13 ILE 7 HD13 ILE 7 40.636 22.397 23.627 342 H LEU 8 HN LEU 8 39.970 19.010 18.751 343 HA LEU 8 HA LEU 8 37.578 19.055 17.183 344 HB2 LEU 8 HB2 LEU 8 40.343 18.057 16.863 345 HB3 LEU 8 HB1 LEU 8 39.117 17.196 15.936 346 HG LEU 8 HG LEU 8 40.167 19.161 14.740 347 HD11 LEU 8 HD11 LEU 8 37.206 19.568 15.200 348 HD12 LEU 8 HD12 LEU 8 37.831 18.182 14.307 349 HD13 LEU 8 HD13 LEU 8 38.125 19.818 13.716 350 HD21 LEU 8 HD21 LEU 8 40.185 20.567 16.890 351 HD22 LEU 8 HD22 LEU 8 38.469 20.846 16.592 352 HD23 LEU 8 HD23 LEU 8 39.667 21.386 15.417 353 H SER 9 HN SER 9 39.147 16.660 19.213 354 HA SER 9 HA SER 9 37.522 14.446 18.405 355 HB2 SER 9 HB2 SER 9 38.414 13.329 20.399 356 HB3 SER 9 HB1 SER 9 39.703 14.129 19.503 357 HG SER 9 HG SER 9 38.431 14.908 21.901 358 H ILE 10 HN ILE 10 37.372 16.786 21.060 359 HA ILE 10 HA ILE 10 35.116 15.664 22.343 360 HB ILE 10 HB ILE 10 36.435 18.356 22.393 361 HG12 ILE 10 HG12 ILE 10 37.226 16.247 23.648 362 HG13 ILE 10 HG11 ILE 10 37.029 17.714 24.603 363 HG21 ILE 10 HG21 ILE 10 34.732 18.862 24.266 364 HG22 ILE 10 HG22 ILE 10 33.743 17.594 23.542 365 HG23 ILE 10 HG23 ILE 10 34.171 19.025 22.603 366 HD11 ILE 10 HD11 ILE 10 35.166 16.913 25.711 367 HD12 ILE 10 HD12 ILE 10 35.981 15.383 25.395 368 HD13 ILE 10 HD13 ILE 10 34.653 15.899 24.362 369 H CYS 11 HN CYS 11 35.453 18.148 19.832 370 HA CYS 11 HA CYS 11 32.753 18.928 19.723 371 HB2 CYS 11 HB2 CYS 11 34.890 18.848 17.583 372 HB3 CYS 11 HB1 CYS 11 33.297 19.564 17.336 373 HG CYS 11 HG CYS 11 33.953 21.528 18.713 374 H SER 12 HN SER 12 34.506 16.457 17.819 375 HA SER 12 HA SER 12 32.301 15.540 16.359 376 HB2 SER 12 HB2 SER 12 34.610 14.925 15.804 377 HB3 SER 12 HB1 SER 12 34.731 13.993 17.293 378 HG SER 12 HG SER 12 32.743 13.542 15.321 379 H PHE 13 HN PHE 13 33.516 14.573 19.546 380 HA PHE 13 HA PHE 13 31.858 12.341 19.949 381 HB2 PHE 13 HB2 PHE 13 33.783 12.859 21.382 382 HB3 PHE 13 HB1 PHE 13 32.957 14.294 21.985 383 HD1 PHE 13 HD1 PHE 13 32.507 10.590 21.645 384 HD2 PHE 13 HD2 PHE 13 31.592 14.139 23.886 385 HE1 PHE 13 HE1 PHE 13 31.379 9.210 23.370 386 HE2 PHE 13 HE2 PHE 13 30.462 12.758 25.608 387 HZ PHE 13 HZ PHE 13 30.355 10.295 25.351 388 H ILE 14 HN ILE 14 31.372 15.737 20.987 389 HA ILE 14 HA ILE 14 28.784 15.267 22.057 390 HB ILE 14 HB ILE 14 30.137 17.217 22.703 391 HG12 ILE 14 HG12 ILE 14 27.606 18.152 21.334 392 HG13 ILE 14 HG11 ILE 14 27.586 17.171 22.801 393 HG21 ILE 14 HG21 ILE 14 29.627 18.084 19.846 394 HG22 ILE 14 HG22 ILE 14 31.187 17.809 20.618 395 HG23 ILE 14 HG23 ILE 14 30.188 19.171 21.115 396 HD11 ILE 14 HD11 ILE 14 28.893 19.887 22.470 397 HD12 ILE 14 HD12 ILE 14 29.019 18.887 23.916 398 HD13 ILE 14 HD13 ILE 14 27.452 19.525 23.420 399 H LEU 15 HN LEU 15 29.960 16.027 18.858 400 HA LEU 15 HA LEU 15 27.517 16.817 17.681 401 HB2 LEU 15 HB2 LEU 15 30.065 15.620 16.619 402 HB3 LEU 15 HB1 LEU 15 28.680 15.869 15.555 403 HG LEU 15 HG LEU 15 29.671 18.097 17.325 404 HD11 LEU 15 HD11 LEU 15 31.651 17.522 16.117 405 HD12 LEU 15 HD12 LEU 15 30.931 18.868 15.235 406 HD13 LEU 15 HD13 LEU 15 30.744 17.221 14.635 407 HD21 LEU 15 HD21 LEU 15 28.611 19.479 15.597 408 HD22 LEU 15 HD22 LEU 15 27.463 18.275 16.181 409 HD23 LEU 15 HD23 LEU 15 28.271 18.043 14.631 410 H SER 16 HN SER 16 29.159 13.658 17.349 411 HA SER 16 HA SER 16 27.070 12.257 16.231 412 HB2 SER 16 HB2 SER 16 28.138 10.231 17.103 413 HB3 SER 16 HB1 SER 16 29.344 11.357 16.487 414 HG SER 16 HG SER 16 30.020 10.666 18.487 415 H ALA 17 HN ALA 17 27.623 12.968 19.664 416 HA ALA 17 HA ALA 17 25.633 11.262 20.714 417 HB1 ALA 17 HB1 ALA 17 26.730 13.896 21.721 418 HB2 ALA 17 HB2 ALA 17 27.236 12.276 22.200 419 HB3 ALA 17 HB3 ALA 17 25.638 12.869 22.651 420 H LEU 18 HN LEU 18 25.510 14.663 19.732 421 HA LEU 18 HA LEU 18 22.765 15.075 20.308 422 HB2 LEU 18 HB2 LEU 18 24.639 16.483 18.396 423 HB3 LEU 18 HB1 LEU 18 23.004 17.039 18.755 424 HG LEU 18 HG LEU 18 25.111 16.560 20.876 425 HD11 LEU 18 HD11 LEU 18 25.534 18.917 20.891 426 HD12 LEU 18 HD12 LEU 18 24.203 19.229 19.777 427 HD13 LEU 18 HD13 LEU 18 25.657 18.409 19.207 428 HD21 LEU 18 HD21 LEU 18 22.354 17.803 20.843 429 HD22 LEU 18 HD22 LEU 18 23.503 18.100 22.149 430 HD23 LEU 18 HD23 LEU 18 22.930 16.464 21.835 431 H HIS 19 HN HIS 19 24.460 13.926 17.477 432 HA HIS 19 HA HIS 19 22.275 13.996 15.667 433 HB2 HIS 19 HB2 HIS 19 24.102 13.684 14.391 434 HB3 HIS 19 HB1 HIS 19 25.015 12.979 15.723 435 HD2 HIS 19 HD2 HIS 19 24.706 10.128 15.991 436 HE1 HIS 19 HE1 HIS 19 22.830 9.611 12.246 437 HE2 HIS 19 HE2 HIS 19 23.926 8.403 14.192 438 H PHE 20 HN PHE 20 23.456 11.575 17.912 439 HA PHE 20 HA PHE 20 21.674 9.498 17.017 440 HB2 PHE 20 HB2 PHE 20 23.883 9.728 18.806 441 HB3 PHE 20 HB1 PHE 20 22.524 9.047 19.699 442 HD1 PHE 20 HD1 PHE 20 24.815 8.577 16.848 443 HD2 PHE 20 HD2 PHE 20 21.550 6.906 19.079 444 HE1 PHE 20 HE1 PHE 20 25.174 6.391 15.735 445 HE2 PHE 20 HE2 PHE 20 21.909 4.719 17.969 446 HZ PHE 20 HZ PHE 20 23.723 4.462 16.297 447 H MET 21 HN MET 21 21.650 11.960 19.536 448 HA MET 21 HA MET 21 19.335 10.972 20.890 449 HB2 MET 21 HB2 MET 21 20.806 13.605 20.898 450 HB3 MET 21 HB1 MET 21 19.368 13.319 21.883 451 HG2 MET 21 HG2 MET 21 20.465 11.350 22.904 452 HG3 MET 21 HG1 MET 21 21.907 11.661 21.941 453 HE1 MET 21 HE1 MET 21 22.482 12.458 25.772 454 HE2 MET 21 HE2 MET 21 23.388 11.807 24.409 455 HE3 MET 21 HE3 MET 21 21.793 11.161 24.786 456 H ALA 22 HN ALA 22 19.852 13.715 18.712 457 HA ALA 22 HA ALA 22 17.166 14.547 18.581 458 HB1 ALA 22 HB1 ALA 22 17.968 15.528 16.299 459 HB2 ALA 22 HB2 ALA 22 19.558 14.977 16.829 460 HB3 ALA 22 HB3 ALA 22 18.657 16.142 17.801 461 H TRP 23 HN TRP 23 18.998 12.303 16.512 462 HA TRP 23 HA TRP 23 16.745 11.877 14.780 463 HB2 TRP 23 HB2 TRP 23 19.388 10.468 15.083 464 HB3 TRP 23 HB1 TRP 23 18.135 9.876 13.993 465 HD1 TRP 23 HD1 TRP 23 21.087 11.802 13.749 466 HE1 TRP 23 HE1 TRP 23 21.010 13.537 11.844 467 HE3 TRP 23 HE3 TRP 23 16.055 11.923 12.864 468 HZ2 TRP 23 HZ2 TRP 23 19.069 14.817 10.174 469 HZ3 TRP 23 HZ3 TRP 23 15.119 13.418 11.127 470 HH2 TRP 23 HH2 TRP 23 16.619 14.859 9.774 471 H THR 24 HN THR 24 17.877 10.461 17.759 472 HA THR 24 HA THR 24 16.438 8.018 17.616 473 HB THR 24 HB THR 24 17.652 9.651 19.807 474 HG1 THR 24 HG1 THR 24 18.652 7.580 20.128 475 HG21 THR 24 HG21 THR 24 15.610 7.452 20.155 476 HG22 THR 24 HG22 THR 24 15.643 9.044 20.916 477 HG23 THR 24 HG23 THR 24 16.814 7.814 21.392 478 H ILE 25 HN ILE 25 15.651 11.059 19.316 479 HA ILE 25 HA ILE 25 13.019 10.275 20.018 480 HB ILE 25 HB ILE 25 14.295 13.004 19.788 481 HG12 ILE 25 HG12 ILE 25 13.525 11.385 22.232 482 HG13 ILE 25 HG11 ILE 25 15.132 11.319 21.508 483 HG21 ILE 25 HG21 ILE 25 11.912 13.310 19.557 484 HG22 ILE 25 HG22 ILE 25 12.331 13.698 21.226 485 HG23 ILE 25 HG23 ILE 25 11.587 12.146 20.842 486 HD11 ILE 25 HD11 ILE 25 13.842 13.929 22.329 487 HD12 ILE 25 HD12 ILE 25 15.539 13.626 21.956 488 HD13 ILE 25 HD13 ILE 25 14.833 12.978 23.436 489 H GLY 26 HN GLY 26 14.287 12.189 17.317 490 HA2 GLY 26 HA2 GLY 26 11.821 12.939 16.179 491 HA3 GLY 26 HA1 GLY 26 13.349 12.822 15.310 492 H HIS 27 HN HIS 27 13.792 10.053 15.843 493 HA HIS 27 HA HIS 27 12.285 8.897 13.698 494 HB2 HIS 27 HB2 HIS 27 14.544 8.172 13.959 495 HB3 HIS 27 HB1 HIS 27 14.281 7.756 15.655 496 HD2 HIS 27 HD2 HIS 27 13.373 5.171 16.059 497 HE1 HIS 27 HE1 HIS 27 12.381 4.279 12.053 498 HE2 HIS 27 HE2 HIS 27 12.550 3.328 14.403 499 H LEU 28 HN LEU 28 12.211 8.684 17.212 500 HA LEU 28 HA LEU 28 10.486 6.471 17.459 501 HB2 LEU 28 HB2 LEU 28 11.851 7.597 19.290 502 HB3 LEU 28 HB1 LEU 28 10.587 8.825 19.348 503 HG LEU 28 HG LEU 28 8.927 6.908 19.653 504 HD11 LEU 28 HD11 LEU 28 10.041 4.850 20.692 505 HD12 LEU 28 HD12 LEU 28 11.553 5.446 20.006 506 HD13 LEU 28 HD13 LEU 28 10.210 5.021 18.946 507 HD21 LEU 28 HD21 LEU 28 9.452 8.272 21.549 508 HD22 LEU 28 HD22 LEU 28 11.054 7.553 21.709 509 HD23 LEU 28 HD23 LEU 28 9.619 6.604 22.097 510 H ASN 29 HN ASN 29 8.339 6.241 17.255 511 HA ASN 29 HA ASN 29 6.682 8.672 16.963 512 HB2 ASN 29 HB2 ASN 29 5.371 7.466 15.231 513 HB3 ASN 29 HB1 ASN 29 7.038 7.757 14.736 514 HD21 ASN 29 HD21 ASN 29 4.761 5.409 14.551 515 HD22 ASN 29 HD22 ASN 29 5.745 4.028 14.625 516 H GLN 30 HN GLN 30 4.771 8.639 18.028 517 HA GLN 30 HA GLN 30 3.842 6.093 19.176 518 HB2 GLN 30 HB2 GLN 30 3.549 7.084 21.364 519 HB3 GLN 30 HB1 GLN 30 5.230 7.305 20.875 520 HG2 GLN 30 HG2 GLN 30 4.620 9.591 20.037 521 HG3 GLN 30 HG1 GLN 30 3.011 9.363 20.720 522 HE21 GLN 30 HE21 GLN 30 5.838 10.873 21.424 523 HE22 GLN 30 HE22 GLN 30 5.818 10.766 23.118 524 H ILE 31 HN ILE 31 1.649 5.927 19.367 525 HA ILE 31 HA ILE 31 0.016 8.299 18.801 526 HB ILE 31 HB ILE 31 -1.296 7.044 17.132 527 HG12 ILE 31 HG12 ILE 31 0.908 4.968 17.336 528 HG13 ILE 31 HG11 ILE 31 -0.690 4.774 18.055 529 HG21 ILE 31 HG21 ILE 31 1.672 7.088 16.509 530 HG22 ILE 31 HG22 ILE 31 0.610 8.494 16.444 531 HG23 ILE 31 HG23 ILE 31 0.359 7.147 15.334 532 HD11 ILE 31 HD11 ILE 31 -0.073 5.151 15.110 533 HD12 ILE 31 HD12 ILE 31 -1.700 5.105 15.792 534 HD13 ILE 31 HD13 ILE 31 -0.666 3.678 15.879 535 H LYS 32 HN LYS 32 -2.130 8.153 19.563 536 HA LYS 32 HA LYS 32 -2.438 6.425 21.853 537 HB2 LYS 32 HB2 LYS 32 -4.446 7.663 22.292 538 HB3 LYS 32 HB1 LYS 32 -3.234 8.819 21.738 539 HG2 LYS 32 HG2 LYS 32 -4.180 8.570 19.411 540 HG3 LYS 32 HG1 LYS 32 -5.489 7.617 20.112 541 HD2 LYS 32 HD2 LYS 32 -6.081 9.519 21.579 542 HD3 LYS 32 HD1 LYS 32 -4.790 10.475 20.851 543 HE2 LYS 32 HE2 LYS 32 -6.841 11.076 19.735 544 HE3 LYS 32 HE1 LYS 32 -5.897 10.100 18.611 545 HZ1 LYS 32 HZ1 LYS 32 -8.381 9.561 18.990 546 HZ2 LYS 32 HZ2 LYS 32 -7.830 8.798 20.405 547 HZ3 LYS 32 HZ3 LYS 32 -7.262 8.291 18.887 548 H ARG 33 HN ARG 33 -3.937 4.783 22.138 549 HA ARG 33 HA ARG 33 -4.817 3.490 19.666 550 HB2 ARG 33 HB2 ARG 33 -4.179 2.628 22.406 551 HB3 ARG 33 HB1 ARG 33 -5.579 1.822 21.697 552 HG2 ARG 33 HG2 ARG 33 -3.556 0.571 21.139 553 HG3 ARG 33 HG1 ARG 33 -4.216 1.302 19.676 554 HD2 ARG 33 HD2 ARG 33 -2.599 3.085 19.748 555 HD3 ARG 33 HD1 ARG 33 -2.045 2.592 21.346 556 HE ARG 33 HE ARG 33 -1.301 1.404 18.813 557 HH11 ARG 33 HH11 ARG 33 -1.612 0.927 22.253 558 HH12 ARG 33 HH12 ARG 33 -0.423 -0.326 22.306 559 HH21 ARG 33 HH21 ARG 33 0.258 -0.231 18.917 560 HH22 ARG 33 HH22 ARG 33 0.629 -0.979 20.433 561 H1 MET 1 HT1 MET 1 45.109 -4.261 28.277 562 H2 MET 1 HT2 MET 1 45.410 -2.589 28.296 563 H3 MET 1 HT3 MET 1 45.827 -3.546 29.637 564 HA MET 1 HA MET 1 47.531 -2.812 27.690 565 HB2 MET 1 HB2 MET 1 47.640 -4.156 30.053 566 HB3 MET 1 HB1 MET 1 48.049 -5.454 28.931 567 HG2 MET 1 HG2 MET 1 50.126 -4.421 29.497 568 HG3 MET 1 HG1 MET 1 49.725 -3.829 27.885 569 HE1 MET 1 HE1 MET 1 51.417 -0.749 29.267 570 HE2 MET 1 HE2 MET 1 50.848 -1.383 27.724 571 HE3 MET 1 HE3 MET 1 51.734 -2.434 28.828 572 H PHE 2 HN PHE 2 45.230 -3.845 26.323 573 HA PHE 2 HA PHE 2 46.566 -5.499 24.365 574 HB2 PHE 2 HB2 PHE 2 44.610 -7.205 24.507 575 HB3 PHE 2 HB1 PHE 2 45.932 -7.342 25.667 576 HD1 PHE 2 HD1 PHE 2 42.479 -6.048 25.189 577 HD2 PHE 2 HD2 PHE 2 45.582 -7.000 28.002 578 HE1 PHE 2 HE1 PHE 2 40.879 -5.739 27.057 579 HE2 PHE 2 HE2 PHE 2 43.981 -6.691 29.872 580 HZ PHE 2 HZ PHE 2 41.630 -6.060 29.400 581 H GLU 3 HN GLU 3 45.163 -2.877 24.628 582 HA GLU 3 HA GLU 3 42.675 -3.109 23.229 583 HB2 GLU 3 HB2 GLU 3 44.455 -0.718 23.750 584 HB3 GLU 3 HB1 GLU 3 42.849 -0.627 23.029 585 HG2 GLU 3 HG2 GLU 3 42.364 -0.260 25.279 586 HG3 GLU 3 HG1 GLU 3 42.116 -1.998 25.142 587 HA PRO 4 HA PRO 4 44.325 -3.291 19.106 588 HB2 PRO 4 HB2 PRO 4 42.235 -2.323 17.662 589 HB3 PRO 4 HB1 PRO 4 42.204 -3.916 18.444 590 HG2 PRO 4 HG2 PRO 4 40.979 -1.350 19.329 591 HG3 PRO 4 HG1 PRO 4 40.333 -2.999 19.408 592 HD2 PRO 4 HD2 PRO 4 41.456 -1.711 21.562 593 HD3 PRO 4 HD1 PRO 4 41.431 -3.478 21.376 594 H PHE 5 HN PHE 5 42.778 -0.234 20.035 595 HA PHE 5 HA PHE 5 44.981 1.255 18.820 596 HB2 PHE 5 HB2 PHE 5 42.217 1.195 17.769 597 HB3 PHE 5 HB1 PHE 5 42.917 2.801 17.967 598 HD1 PHE 5 HD1 PHE 5 42.990 -0.303 16.069 599 HD2 PHE 5 HD2 PHE 5 45.090 3.362 16.849 600 HE1 PHE 5 HE1 PHE 5 44.322 -0.625 14.001 601 HE2 PHE 5 HE2 PHE 5 46.421 3.040 14.783 602 HZ PHE 5 HZ PHE 5 46.037 1.048 13.359 603 H GLN 6 HN GLN 6 41.774 2.455 19.729 604 HA GLN 6 HA GLN 6 42.754 3.362 22.319 605 HB2 GLN 6 HB2 GLN 6 41.880 5.259 20.132 606 HB3 GLN 6 HB1 GLN 6 42.008 5.710 21.832 607 HG2 GLN 6 HG2 GLN 6 44.397 4.999 21.804 608 HG3 GLN 6 HG1 GLN 6 44.249 4.670 20.078 609 HE21 GLN 6 HE21 GLN 6 45.199 7.047 22.253 610 HE22 GLN 6 HE22 GLN 6 45.038 8.403 21.243 611 H ILE 7 HN ILE 7 41.019 4.299 23.626 612 HA ILE 7 HA ILE 7 38.668 2.728 23.526 613 HB ILE 7 HB ILE 7 38.999 5.340 25.011 614 HG12 ILE 7 HG12 ILE 7 40.962 4.030 25.529 615 HG13 ILE 7 HG11 ILE 7 39.848 3.864 26.882 616 HG21 ILE 7 HG21 ILE 7 36.745 4.355 25.024 617 HG22 ILE 7 HG22 ILE 7 37.483 4.240 26.622 618 HG23 ILE 7 HG23 ILE 7 37.412 2.819 25.580 619 HD11 ILE 7 HD11 ILE 7 40.416 1.865 24.689 620 HD12 ILE 7 HD12 ILE 7 39.002 1.735 25.735 621 HD13 ILE 7 HD13 ILE 7 40.621 1.659 26.428 622 H LEU 8 HN LEU 8 39.324 6.087 22.625 623 HA LEU 8 HA LEU 8 36.631 6.734 21.910 624 HB2 LEU 8 HB2 LEU 8 39.289 8.007 21.666 625 HB3 LEU 8 HB1 LEU 8 38.112 8.474 20.441 626 HG LEU 8 HG LEU 8 38.110 9.916 22.518 627 HD11 LEU 8 HD11 LEU 8 35.486 8.458 22.154 628 HD12 LEU 8 HD12 LEU 8 36.133 9.540 20.921 629 HD13 LEU 8 HD13 LEU 8 35.746 10.161 22.525 630 HD21 LEU 8 HD21 LEU 8 38.460 7.874 24.037 631 HD22 LEU 8 HD22 LEU 8 36.737 7.556 23.823 632 HD23 LEU 8 HD23 LEU 8 37.270 9.060 24.574 633 H SER 9 HN SER 9 39.388 5.419 20.183 634 HA SER 9 HA SER 9 38.268 5.665 17.560 635 HB2 SER 9 HB2 SER 9 40.052 4.125 16.879 636 HB3 SER 9 HB1 SER 9 40.688 5.393 17.922 637 HG SER 9 HG SER 9 40.135 2.688 18.514 638 H ILE 10 HN ILE 10 38.378 3.073 19.970 639 HA ILE 10 HA ILE 10 37.089 1.116 18.386 640 HB ILE 10 HB ILE 10 37.549 1.465 21.330 641 HG12 ILE 10 HG12 ILE 10 39.266 0.604 19.608 642 HG13 ILE 10 HG11 ILE 10 39.005 -0.391 21.038 643 HG21 ILE 10 HG21 ILE 10 36.506 -0.891 21.502 644 HG22 ILE 10 HG22 ILE 10 35.723 -0.522 19.965 645 HG23 ILE 10 HG23 ILE 10 35.397 0.474 21.383 646 HD11 ILE 10 HD11 ILE 10 37.921 -2.055 19.856 647 HD12 ILE 10 HD12 ILE 10 38.971 -1.445 18.578 648 HD13 ILE 10 HD13 ILE 10 37.285 -0.943 18.643 649 H CYS 11 HN CYS 11 35.861 3.536 20.672 650 HA CYS 11 HA CYS 11 33.178 2.692 20.693 651 HB2 CYS 11 HB2 CYS 11 34.402 5.439 21.024 652 HB3 CYS 11 HB1 CYS 11 32.688 5.105 21.268 653 HG CYS 11 HG CYS 11 33.197 3.999 23.435 654 H SER 12 HN SER 12 34.798 5.135 18.642 655 HA SER 12 HA SER 12 32.576 5.767 17.060 656 HB2 SER 12 HB2 SER 12 34.637 7.096 17.046 657 HB3 SER 12 HB1 SER 12 35.506 5.759 16.296 658 HG SER 12 HG SER 12 33.177 6.938 15.182 659 H PHE 13 HN PHE 13 35.010 3.215 16.699 660 HA PHE 13 HA PHE 13 34.271 2.313 14.142 661 HB2 PHE 13 HB2 PHE 13 36.343 1.620 15.263 662 HB3 PHE 13 HB1 PHE 13 35.405 0.739 16.466 663 HD1 PHE 13 HD1 PHE 13 35.913 0.982 12.762 664 HD2 PHE 13 HD2 PHE 13 34.858 -1.512 16.098 665 HE1 PHE 13 HE1 PHE 13 35.859 -0.995 11.267 666 HE2 PHE 13 HE2 PHE 13 34.802 -3.489 14.601 667 HZ PHE 13 HZ PHE 13 35.303 -3.230 12.185 668 H ILE 14 HN ILE 14 33.242 1.100 17.354 669 HA ILE 14 HA ILE 14 31.404 -0.785 16.293 670 HB ILE 14 HB ILE 14 32.300 -0.968 18.576 671 HG12 ILE 14 HG12 ILE 14 29.303 -0.576 18.694 672 HG13 ILE 14 HG11 ILE 14 30.050 -1.937 17.859 673 HG21 ILE 14 HG21 ILE 14 30.640 1.519 19.057 674 HG22 ILE 14 HG22 ILE 14 32.380 1.335 19.268 675 HG23 ILE 14 HG23 ILE 14 31.269 0.496 20.346 676 HD11 ILE 14 HD11 ILE 14 30.363 -1.235 20.792 677 HD12 ILE 14 HD12 ILE 14 31.240 -2.530 19.975 678 HD13 ILE 14 HD13 ILE 14 29.485 -2.616 20.131 679 H LEU 15 HN LEU 15 31.175 2.607 17.092 680 HA LEU 15 HA LEU 15 28.361 2.852 17.113 681 HB2 LEU 15 HB2 LEU 15 30.627 4.752 16.562 682 HB3 LEU 15 HB1 LEU 15 28.953 5.268 16.351 683 HG LEU 15 HG LEU 15 29.825 3.899 18.890 684 HD11 LEU 15 HD11 LEU 15 31.361 5.726 18.774 685 HD12 LEU 15 HD12 LEU 15 30.043 6.279 19.809 686 HD13 LEU 15 HD13 LEU 15 30.130 6.813 18.130 687 HD21 LEU 15 HD21 LEU 15 27.908 5.128 19.804 688 HD22 LEU 15 HD22 LEU 15 27.403 4.210 18.385 689 HD23 LEU 15 HD23 LEU 15 27.674 5.947 18.260 690 H SER 16 HN SER 16 30.604 3.791 14.489 691 HA SER 16 HA SER 16 28.734 4.155 12.502 692 HB2 SER 16 HB2 SER 16 30.549 3.749 10.906 693 HB3 SER 16 HB1 SER 16 31.115 4.716 12.265 694 HG SER 16 HG SER 16 32.588 3.088 11.932 695 H ALA 17 HN ALA 17 30.189 1.109 13.594 696 HA ALA 17 HA ALA 17 29.225 -0.526 11.501 697 HB1 ALA 17 HB1 ALA 17 29.823 -1.149 14.402 698 HB2 ALA 17 HB2 ALA 17 30.888 -1.389 13.016 699 HB3 ALA 17 HB3 ALA 17 29.437 -2.377 13.194 700 H LEU 18 HN LEU 18 27.842 0.284 14.660 701 HA LEU 18 HA LEU 18 25.452 -1.211 14.367 702 HB2 LEU 18 HB2 LEU 18 26.105 1.198 16.076 703 HB3 LEU 18 HB1 LEU 18 24.600 0.286 16.202 704 HG LEU 18 HG LEU 18 27.344 -0.969 16.465 705 HD11 LEU 18 HD11 LEU 18 27.075 -0.889 18.844 706 HD12 LEU 18 HD12 LEU 18 25.416 -0.308 18.703 707 HD13 LEU 18 HD13 LEU 18 26.760 0.745 18.260 708 HD21 LEU 18 HD21 LEU 18 24.507 -1.914 16.921 709 HD22 LEU 18 HD22 LEU 18 25.899 -2.752 17.609 710 HD23 LEU 18 HD23 LEU 18 25.728 -2.617 15.862 711 H HIS 19 HN HIS 19 26.341 2.056 13.506 712 HA HIS 19 HA HIS 19 23.746 3.002 12.851 713 HB2 HIS 19 HB2 HIS 19 25.049 4.833 12.941 714 HB3 HIS 19 HB1 HIS 19 26.513 3.911 12.608 715 HD2 HIS 19 HD2 HIS 19 27.115 3.614 9.808 716 HE1 HIS 19 HE1 HIS 19 24.308 6.494 8.524 717 HE2 HIS 19 HE2 HIS 19 26.286 5.070 7.806 718 H PHE 20 HN PHE 20 26.234 1.350 11.010 719 HA PHE 20 HA PHE 20 24.905 1.622 8.470 720 HB2 PHE 20 HB2 PHE 20 27.430 0.698 9.417 721 HB3 PHE 20 HB1 PHE 20 26.696 -0.594 8.468 722 HD1 PHE 20 HD1 PHE 20 27.930 2.882 8.410 723 HD2 PHE 20 HD2 PHE 20 26.204 -0.303 6.103 724 HE1 PHE 20 HE1 PHE 20 28.487 4.094 6.321 725 HE2 PHE 20 HE2 PHE 20 26.762 0.910 4.013 726 HZ PHE 20 HZ PHE 20 27.905 3.105 4.122 727 H MET 21 HN MET 21 25.048 -0.806 11.021 728 HA MET 21 HA MET 21 23.695 -2.851 9.552 729 HB2 MET 21 HB2 MET 21 24.291 -2.414 12.476 730 HB3 MET 21 HB1 MET 21 23.408 -3.828 11.890 731 HG2 MET 21 HG2 MET 21 25.286 -4.362 10.371 732 HG3 MET 21 HG1 MET 21 26.171 -2.968 10.982 733 HE1 MET 21 HE1 MET 21 27.758 -6.384 12.193 734 HE2 MET 21 HE2 MET 21 28.296 -4.778 11.707 735 HE3 MET 21 HE3 MET 21 27.167 -5.666 10.687 736 H ALA 22 HN ALA 22 22.665 -0.692 12.161 737 HA ALA 22 HA ALA 22 19.973 -1.516 12.226 738 HB1 ALA 22 HB1 ALA 22 19.648 0.877 13.211 739 HB2 ALA 22 HB2 ALA 22 21.409 0.942 13.151 740 HB3 ALA 22 HB3 ALA 22 20.604 -0.308 14.099 741 H TRP 23 HN TRP 23 21.549 1.111 10.410 742 HA TRP 23 HA TRP 23 19.056 1.973 9.268 743 HB2 TRP 23 HB2 TRP 23 21.927 2.629 8.644 744 HB3 TRP 23 HB1 TRP 23 20.597 3.233 7.657 745 HD1 TRP 23 HD1 TRP 23 22.638 4.436 10.279 746 HE1 TRP 23 HE1 TRP 23 21.447 6.159 11.781 747 HE3 TRP 23 HE3 TRP 23 17.777 3.537 8.979 748 HZ2 TRP 23 HZ2 TRP 23 18.784 7.034 12.363 749 HZ3 TRP 23 HZ3 TRP 23 15.937 4.819 10.030 750 HH2 TRP 23 HH2 TRP 23 16.433 6.568 11.716 751 H THR 24 HN THR 24 21.470 -0.403 8.438 752 HA THR 24 HA THR 24 20.805 -0.712 5.695 753 HB THR 24 HB THR 24 22.180 -2.385 7.755 754 HG1 THR 24 HG1 THR 24 23.763 -2.298 6.056 755 HG21 THR 24 HG21 THR 24 21.067 -3.369 5.125 756 HG22 THR 24 HG22 THR 24 20.915 -4.105 6.720 757 HG23 THR 24 HG23 THR 24 22.469 -4.122 5.887 758 H ILE 25 HN ILE 25 19.823 -2.643 8.537 759 HA ILE 25 HA ILE 25 17.909 -4.191 7.132 760 HB ILE 25 HB ILE 25 18.225 -3.593 10.077 761 HG12 ILE 25 HG12 ILE 25 18.802 -6.119 8.502 762 HG13 ILE 25 HG11 ILE 25 20.024 -4.885 8.814 763 HG21 ILE 25 HG21 ILE 25 15.918 -4.205 9.717 764 HG22 ILE 25 HG22 ILE 25 16.748 -5.635 10.329 765 HG23 ILE 25 HG23 ILE 25 16.379 -5.498 8.610 766 HD11 ILE 25 HD11 ILE 25 18.416 -6.157 11.037 767 HD12 ILE 25 HD12 ILE 25 19.900 -5.216 11.172 768 HD13 ILE 25 HD13 ILE 25 19.944 -6.834 10.472 769 H GLY 26 HN GLY 26 17.611 -1.262 9.106 770 HA2 GLY 26 HA2 GLY 26 14.801 -1.058 9.080 771 HA3 GLY 26 HA1 GLY 26 15.916 0.286 9.310 772 H HIS 27 HN HIS 27 17.261 -0.002 6.808 773 HA HIS 27 HA HIS 27 15.504 1.517 5.132 774 HB2 HIS 27 HB2 HIS 27 17.825 2.065 5.060 775 HB3 HIS 27 HB1 HIS 27 18.275 0.393 4.718 776 HD2 HIS 27 HD2 HIS 27 18.307 -0.244 2.023 777 HE1 HIS 27 HE1 HIS 27 16.314 3.195 0.597 778 HE2 HIS 27 HE2 HIS 27 17.519 1.068 -0.093 779 H LEU 28 HN LEU 28 16.677 -1.802 5.177 780 HA LEU 28 HA LEU 28 15.821 -2.580 2.608 781 HB2 LEU 28 HB2 LEU 28 17.353 -3.853 4.192 782 HB3 LEU 28 HB1 LEU 28 15.896 -4.370 5.040 783 HG LEU 28 HG LEU 28 15.034 -5.185 2.777 784 HD11 LEU 28 HD11 LEU 28 16.957 -5.733 1.177 785 HD12 LEU 28 HD12 LEU 28 17.923 -4.582 2.101 786 HD13 LEU 28 HD13 LEU 28 16.475 -4.038 1.254 787 HD21 LEU 28 HD21 LEU 28 15.768 -6.814 4.371 788 HD22 LEU 28 HD22 LEU 28 17.463 -6.397 4.121 789 HD23 LEU 28 HD23 LEU 28 16.565 -7.233 2.855 790 H ASN 29 HN ASN 29 13.883 -3.121 1.797 791 HA ASN 29 HA ASN 29 11.621 -3.471 3.669 792 HB2 ASN 29 HB2 ASN 29 10.192 -2.270 2.028 793 HB3 ASN 29 HB1 ASN 29 11.445 -1.239 2.716 794 HD21 ASN 29 HD21 ASN 29 9.983 -1.796 -0.162 795 HD22 ASN 29 HD22 ASN 29 11.275 -1.497 -1.221 796 H GLN 30 HN GLN 30 10.267 -5.128 3.208 797 HA GLN 30 HA GLN 30 10.523 -6.469 0.600 798 HB2 GLN 30 HB2 GLN 30 10.720 -8.646 1.640 799 HB3 GLN 30 HB1 GLN 30 12.008 -7.614 2.264 800 HG2 GLN 30 HG2 GLN 30 10.545 -7.086 4.235 801 HG3 GLN 30 HG1 GLN 30 9.389 -8.275 3.638 802 HE21 GLN 30 HE21 GLN 30 11.753 -7.997 5.895 803 HE22 GLN 30 HE22 GLN 30 12.335 -9.592 5.916 804 H ILE 31 HN ILE 31 8.658 -7.400 -0.130 805 HA ILE 31 HA ILE 31 6.342 -7.483 1.669 806 HB ILE 31 HB ILE 31 4.946 -6.340 -0.014 807 HG12 ILE 31 HG12 ILE 31 7.573 -5.728 -1.403 808 HG13 ILE 31 HG11 ILE 31 6.429 -6.949 -1.961 809 HG21 ILE 31 HG21 ILE 31 7.396 -4.734 0.774 810 HG22 ILE 31 HG22 ILE 31 6.030 -5.071 1.837 811 HG23 ILE 31 HG23 ILE 31 5.801 -4.086 0.392 812 HD11 ILE 31 HD11 ILE 31 5.891 -3.981 -1.657 813 HD12 ILE 31 HD12 ILE 31 4.669 -5.179 -2.085 814 HD13 ILE 31 HD13 ILE 31 6.023 -4.875 -3.173 815 H LYS 32 HN LYS 32 4.707 -8.933 1.014 816 HA LYS 32 HA LYS 32 5.679 -11.152 -0.554 817 HB2 LYS 32 HB2 LYS 32 3.676 -12.281 0.132 818 HB3 LYS 32 HB1 LYS 32 4.261 -11.369 1.524 819 HG2 LYS 32 HG2 LYS 32 2.697 -9.505 0.856 820 HG3 LYS 32 HG1 LYS 32 2.018 -10.592 -0.356 821 HD2 LYS 32 HD2 LYS 32 1.451 -12.216 1.424 822 HD3 LYS 32 HD1 LYS 32 2.103 -11.108 2.632 823 HE2 LYS 32 HE2 LYS 32 -0.285 -10.779 2.577 824 HE3 LYS 32 HE1 LYS 32 0.457 -9.377 1.806 825 HZ1 LYS 32 HZ1 LYS 32 -1.502 -10.580 0.654 826 HZ2 LYS 32 HZ2 LYS 32 -0.318 -11.700 0.176 827 HZ3 LYS 32 HZ3 LYS 32 -0.179 -10.068 -0.276 828 H ARG 33 HN ARG 33 4.881 -11.899 -2.512 829 HA ARG 33 HA ARG 33 3.614 -9.855 -4.175 830 HB2 ARG 33 HB2 ARG 33 5.349 -12.188 -4.625 831 HB3 ARG 33 HB1 ARG 33 4.073 -11.988 -5.827 832 HG2 ARG 33 HG2 ARG 33 6.052 -10.740 -6.532 833 HG3 ARG 33 HG1 ARG 33 4.763 -9.610 -6.116 834 HD2 ARG 33 HD2 ARG 33 5.750 -9.160 -3.966 835 HD3 ARG 33 HD1 ARG 33 6.923 -10.457 -4.171 836 HE ARG 33 HE ARG 33 7.068 -7.798 -5.306 837 HH11 ARG 33 HH11 ARG 33 8.079 -11.124 -5.585 838 HH12 ARG 33 HH12 ARG 33 9.515 -10.737 -6.468 839 HH21 ARG 33 HH21 ARG 33 8.960 -7.323 -6.452 840 HH22 ARG 33 HH22 ARG 33 10.011 -8.603 -6.958 841 H1 MET 1 HT1 MET 1 53.527 -1.173 2.623 842 H2 MET 1 HT2 MET 1 53.329 -1.034 4.304 843 H3 MET 1 HT3 MET 1 54.411 -2.177 3.665 844 HA MET 1 HA MET 1 55.110 0.263 4.555 845 HB2 MET 1 HB2 MET 1 56.356 -1.959 3.599 846 HB3 MET 1 HB1 MET 1 56.731 -0.808 2.316 847 HG2 MET 1 HG2 MET 1 58.494 -0.586 3.911 848 HG3 MET 1 HG1 MET 1 57.443 0.807 4.169 849 HE1 MET 1 HE1 MET 1 58.540 0.196 7.730 850 HE2 MET 1 HE2 MET 1 57.708 1.425 6.780 851 HE3 MET 1 HE3 MET 1 59.163 0.663 6.141 852 H PHE 2 HN PHE 2 52.886 0.715 2.804 853 HA PHE 2 HA PHE 2 53.929 2.959 1.311 854 HB2 PHE 2 HB2 PHE 2 52.694 2.094 -0.807 855 HB3 PHE 2 HB1 PHE 2 54.302 1.460 -0.452 856 HD1 PHE 2 HD1 PHE 2 50.663 0.755 -0.157 857 HD2 PHE 2 HD2 PHE 2 54.644 -0.840 0.084 858 HE1 PHE 2 HE1 PHE 2 49.736 -1.541 -0.033 859 HE2 PHE 2 HE2 PHE 2 53.716 -3.136 0.208 860 HZ PHE 2 HZ PHE 2 51.262 -3.487 0.150 861 H GLU 3 HN GLU 3 52.001 2.312 3.498 862 HA GLU 3 HA GLU 3 49.369 2.756 2.458 863 HB2 GLU 3 HB2 GLU 3 50.464 2.959 5.273 864 HB3 GLU 3 HB1 GLU 3 48.756 3.082 4.856 865 HG2 GLU 3 HG2 GLU 3 48.941 0.815 5.370 866 HG3 GLU 3 HG1 GLU 3 49.168 0.803 3.623 867 HA PRO 4 HA PRO 4 49.574 7.186 2.178 868 HB2 PRO 4 HB2 PRO 4 46.946 7.847 2.389 869 HB3 PRO 4 HB1 PRO 4 47.624 7.053 0.954 870 HG2 PRO 4 HG2 PRO 4 46.079 5.879 3.211 871 HG3 PRO 4 HG1 PRO 4 45.987 5.531 1.476 872 HD2 PRO 4 HD2 PRO 4 47.334 3.939 3.267 873 HD3 PRO 4 HD1 PRO 4 47.755 4.052 1.543 874 H PHE 5 HN PHE 5 47.610 5.881 4.830 875 HA PHE 5 HA PHE 5 48.786 7.828 6.668 876 HB2 PHE 5 HB2 PHE 5 45.967 7.854 5.770 877 HB3 PHE 5 HB1 PHE 5 46.208 7.964 7.513 878 HD1 PHE 5 HD1 PHE 5 46.541 9.667 4.314 879 HD2 PHE 5 HD2 PHE 5 47.647 9.784 8.463 880 HE1 PHE 5 HE1 PHE 5 47.164 12.056 4.080 881 HE2 PHE 5 HE2 PHE 5 48.271 12.173 8.229 882 HZ PHE 5 HZ PHE 5 48.028 13.309 6.038 883 H GLN 6 HN GLN 6 45.844 5.908 7.113 884 HA GLN 6 HA GLN 6 47.307 3.844 8.561 885 HB2 GLN 6 HB2 GLN 6 45.271 5.653 9.877 886 HB3 GLN 6 HB1 GLN 6 45.810 4.118 10.559 887 HG2 GLN 6 HG2 GLN 6 48.158 4.948 10.486 888 HG3 GLN 6 HG1 GLN 6 47.560 6.505 9.912 889 HE21 GLN 6 HE21 GLN 6 48.444 4.872 12.712 890 HE22 GLN 6 HE22 GLN 6 47.587 5.807 13.840 891 H ILE 7 HN ILE 7 45.897 2.049 9.180 892 HA ILE 7 HA ILE 7 44.188 1.279 7.060 893 HB ILE 7 HB ILE 7 44.226 0.083 9.838 894 HG12 ILE 7 HG12 ILE 7 46.537 0.238 9.149 895 HG13 ILE 7 HG11 ILE 7 46.018 -1.424 8.880 896 HG21 ILE 7 HG21 ILE 7 42.475 -0.740 8.318 897 HG22 ILE 7 HG22 ILE 7 43.691 -1.987 8.601 898 HG23 ILE 7 HG23 ILE 7 43.693 -1.080 7.088 899 HD11 ILE 7 HD11 ILE 7 46.389 0.763 6.828 900 HD12 ILE 7 HD12 ILE 7 45.485 -0.710 6.476 901 HD13 ILE 7 HD13 ILE 7 47.192 -0.804 6.906 902 H LEU 8 HN LEU 8 43.538 2.462 10.329 903 HA LEU 8 HA LEU 8 40.691 2.218 10.173 904 HB2 LEU 8 HB2 LEU 8 42.648 3.406 12.043 905 HB3 LEU 8 HB1 LEU 8 41.057 4.163 12.034 906 HG LEU 8 HG LEU 8 41.316 2.261 13.678 907 HD11 LEU 8 HD11 LEU 8 39.247 1.649 11.560 908 HD12 LEU 8 HD12 LEU 8 39.122 3.063 12.608 909 HD13 LEU 8 HD13 LEU 8 39.116 1.443 13.307 910 HD21 LEU 8 HD21 LEU 8 42.705 0.892 12.005 911 HD22 LEU 8 HD22 LEU 8 41.172 0.486 11.233 912 HD23 LEU 8 HD23 LEU 8 41.469 0.016 12.907 913 H SER 9 HN SER 9 42.993 4.744 9.396 914 HA SER 9 HA SER 9 41.065 6.828 9.014 915 HB2 SER 9 HB2 SER 9 42.892 8.035 7.909 916 HB3 SER 9 HB1 SER 9 43.443 7.318 9.421 917 HG SER 9 HG SER 9 43.904 6.482 6.762 918 H ILE 10 HN ILE 10 42.679 4.520 6.865 919 HA ILE 10 HA ILE 10 41.562 5.498 4.458 920 HB ILE 10 HB ILE 10 42.828 2.908 5.285 921 HG12 ILE 10 HG12 ILE 10 44.067 5.089 4.682 922 HG13 ILE 10 HG11 ILE 10 44.576 3.626 3.843 923 HG21 ILE 10 HG21 ILE 10 42.613 2.310 2.783 924 HG22 ILE 10 HG22 ILE 10 41.304 3.493 2.739 925 HG23 ILE 10 HG23 ILE 10 41.184 2.082 3.791 926 HD11 ILE 10 HD11 ILE 10 43.689 4.307 1.821 927 HD12 ILE 10 HD12 ILE 10 44.050 5.887 2.512 928 HD13 ILE 10 HD13 ILE 10 42.407 5.259 2.568 929 H CYS 11 HN CYS 11 40.505 3.008 6.752 930 HA CYS 11 HA CYS 11 38.329 2.032 5.260 931 HB2 CYS 11 HB2 CYS 11 38.762 2.233 8.247 932 HB3 CYS 11 HB1 CYS 11 37.387 1.401 7.521 933 HG CYS 11 HG CYS 11 38.862 -0.490 6.865 934 H SER 12 HN SER 12 38.434 4.598 7.753 935 HA SER 12 HA SER 12 35.737 5.329 7.589 936 HB2 SER 12 HB2 SER 12 37.212 6.098 9.390 937 HB3 SER 12 HB1 SER 12 38.136 7.058 8.238 938 HG SER 12 HG SER 12 35.339 7.338 8.626 939 H PHE 13 HN PHE 13 38.541 6.425 5.722 940 HA PHE 13 HA PHE 13 37.307 8.542 4.343 941 HB2 PHE 13 HB2 PHE 13 39.735 8.185 4.352 942 HB3 PHE 13 HB1 PHE 13 39.528 6.702 3.421 943 HD1 PHE 13 HD1 PHE 13 38.718 10.360 3.311 944 HD2 PHE 13 HD2 PHE 13 39.556 6.787 1.077 945 HE1 PHE 13 HE1 PHE 13 38.748 11.679 1.211 946 HE2 PHE 13 HE2 PHE 13 39.583 8.108 -1.022 947 HZ PHE 13 HZ PHE 13 39.179 10.553 -0.955 948 H ILE 14 HN ILE 14 37.759 5.134 3.328 949 HA ILE 14 HA ILE 14 36.290 5.435 0.916 950 HB ILE 14 HB ILE 14 37.892 3.597 1.259 951 HG12 ILE 14 HG12 ILE 14 35.113 2.461 0.882 952 HG13 ILE 14 HG11 ILE 14 35.904 3.460 -0.339 953 HG21 ILE 14 HG21 ILE 14 35.842 2.653 3.278 954 HG22 ILE 14 HG22 ILE 14 37.533 3.050 3.575 955 HG23 ILE 14 HG23 ILE 14 37.116 1.627 2.623 956 HD11 ILE 14 HD11 ILE 14 36.935 0.840 0.789 957 HD12 ILE 14 HD12 ILE 14 37.832 1.868 -0.330 958 HD13 ILE 14 HD13 ILE 14 36.324 1.111 -0.843 959 H LEU 15 HN LEU 15 35.382 4.722 4.214 960 HA LEU 15 HA LEU 15 32.777 3.723 3.716 961 HB2 LEU 15 HB2 LEU 15 34.098 5.083 6.052 962 HB3 LEU 15 HB1 LEU 15 32.373 4.715 6.090 963 HG LEU 15 HG LEU 15 34.375 2.598 5.326 964 HD11 LEU 15 HD11 LEU 15 35.204 3.302 7.455 965 HD12 LEU 15 HD12 LEU 15 34.197 1.891 7.781 966 HD13 LEU 15 HD13 LEU 15 33.576 3.512 8.100 967 HD21 LEU 15 HD21 LEU 15 32.594 1.116 6.129 968 HD22 LEU 15 HD22 LEU 15 31.939 2.243 4.940 969 HD23 LEU 15 HD23 LEU 15 31.649 2.509 6.659 970 H SER 16 HN SER 16 33.705 6.995 4.842 971 HA SER 16 HA SER 16 31.261 8.215 4.474 972 HB2 SER 16 HB2 SER 16 32.492 10.332 4.349 973 HB3 SER 16 HB1 SER 16 33.168 9.284 5.593 974 HG SER 16 HG SER 16 34.854 10.057 4.373 975 H ALA 17 HN ALA 17 33.787 7.601 2.067 976 HA ALA 17 HA ALA 17 32.704 9.178 -0.012 977 HB1 ALA 17 HB1 ALA 17 34.359 6.647 -0.085 978 HB2 ALA 17 HB2 ALA 17 34.939 8.306 -0.218 979 HB3 ALA 17 HB3 ALA 17 33.971 7.604 -1.513 980 H LEU 18 HN LEU 18 32.247 5.765 0.816 981 HA LEU 18 HA LEU 18 30.419 5.163 -1.266 982 HB2 LEU 18 HB2 LEU 18 30.877 3.866 1.428 983 HB3 LEU 18 HB1 LEU 18 29.818 3.197 0.184 984 HG LEU 18 HG LEU 18 32.738 3.860 -0.280 985 HD11 LEU 18 HD11 LEU 18 33.241 1.538 0.030 986 HD12 LEU 18 HD12 LEU 18 31.533 1.115 0.143 987 HD13 LEU 18 HD13 LEU 18 32.303 2.030 1.440 988 HD21 LEU 18 HD21 LEU 18 30.594 2.420 -1.857 989 HD22 LEU 18 HD22 LEU 18 32.311 2.229 -2.213 990 HD23 LEU 18 HD23 LEU 18 31.554 3.813 -2.351 991 H HIS 19 HN HIS 19 30.016 6.388 1.977 992 HA HIS 19 HA HIS 19 27.193 6.133 2.140 993 HB2 HIS 19 HB2 HIS 19 27.878 6.557 4.239 994 HB3 HIS 19 HB1 HIS 19 29.353 7.347 3.690 995 HD2 HIS 19 HD2 HIS 19 29.073 10.171 3.202 996 HE1 HIS 19 HE1 HIS 19 25.307 10.494 5.080 997 HE2 HIS 19 HE2 HIS 19 27.263 11.807 4.130 998 H PHE 20 HN PHE 20 29.312 8.661 0.955 999 HA PHE 20 HA PHE 20 27.215 10.595 0.556 1000 HB2 PHE 20 HB2 PHE 20 30.063 10.554 0.440 1001 HB3 PHE 20 HB1 PHE 20 29.461 11.149 -1.107 1002 HD1 PHE 20 HD1 PHE 20 29.565 11.742 2.532 1003 HD2 PHE 20 HD2 PHE 20 28.167 13.204 -1.255 1004 HE1 PHE 20 HE1 PHE 20 29.040 13.930 3.573 1005 HE2 PHE 20 HE2 PHE 20 27.644 15.395 -0.216 1006 HZ PHE 20 HZ PHE 20 28.079 15.760 2.201 1007 H MET 21 HN MET 21 28.857 8.174 -1.408 1008 HA MET 21 HA MET 21 27.743 9.016 -3.902 1009 HB2 MET 21 HB2 MET 21 29.101 6.494 -2.958 1010 HB3 MET 21 HB1 MET 21 28.517 6.694 -4.613 1011 HG2 MET 21 HG2 MET 21 29.874 8.749 -4.838 1012 HG3 MET 21 HG1 MET 21 30.473 8.529 -3.197 1013 HE1 MET 21 HE1 MET 21 33.270 7.832 -5.908 1014 HE2 MET 21 HE2 MET 21 33.140 8.527 -4.294 1015 HE3 MET 21 HE3 MET 21 32.045 9.062 -5.565 1016 H ALA 22 HN ALA 22 27.045 6.282 -1.764 1017 HA ALA 22 HA ALA 22 24.870 5.263 -3.234 1018 HB1 ALA 22 HB1 ALA 22 24.216 4.304 -0.898 1019 HB2 ALA 22 HB2 ALA 22 25.768 4.973 -0.392 1020 HB3 ALA 22 HB3 ALA 22 25.703 3.765 -1.676 1021 H TRP 23 HN TRP 23 24.960 7.599 -0.548 1022 HA TRP 23 HA TRP 23 22.096 7.835 -0.504 1023 HB2 TRP 23 HB2 TRP 23 24.296 9.434 0.783 1024 HB3 TRP 23 HB1 TRP 23 22.605 9.918 0.894 1025 HD1 TRP 23 HD1 TRP 23 24.951 8.207 2.905 1026 HE1 TRP 23 HE1 TRP 23 23.871 6.442 4.443 1027 HE3 TRP 23 HE3 TRP 23 20.403 7.710 0.626 1028 HZ2 TRP 23 HZ2 TRP 23 21.408 5.002 4.670 1029 HZ3 TRP 23 HZ3 TRP 23 18.720 6.125 1.512 1030 HH2 TRP 23 HH2 TRP 23 19.211 4.776 3.535 1031 H THR 24 HN THR 24 24.678 9.367 -2.272 1032 HA THR 24 HA THR 24 23.279 11.702 -3.085 1033 HB THR 24 HB THR 24 25.664 10.195 -4.071 1034 HG1 THR 24 HG1 THR 24 26.517 12.337 -3.799 1035 HG21 THR 24 HG21 THR 24 24.089 12.244 -5.635 1036 HG22 THR 24 HG22 THR 24 24.674 10.671 -6.177 1037 HG23 THR 24 HG23 THR 24 25.813 11.987 -5.903 1038 H ILE 25 HN ILE 25 23.859 8.631 -4.821 1039 HA ILE 25 HA ILE 25 22.119 9.241 -6.977 1040 HB ILE 25 HB ILE 25 23.187 6.607 -5.948 1041 HG12 ILE 25 HG12 ILE 25 23.918 8.203 -8.420 1042 HG13 ILE 25 HG11 ILE 25 24.769 8.373 -6.885 1043 HG21 ILE 25 HG21 ILE 25 21.163 6.127 -7.171 1044 HG22 ILE 25 HG22 ILE 25 22.517 5.794 -8.250 1045 HG23 ILE 25 HG23 ILE 25 21.589 7.282 -8.433 1046 HD11 ILE 25 HD11 ILE 25 24.400 5.690 -8.232 1047 HD12 ILE 25 HD12 ILE 25 25.516 6.109 -6.932 1048 HD13 ILE 25 HD13 ILE 25 25.788 6.727 -8.561 1049 H GLY 26 HN GLY 26 21.656 7.380 -3.995 1050 HA2 GLY 26 HA2 GLY 26 19.053 6.441 -4.523 1051 HA3 GLY 26 HA1 GLY 26 19.753 6.652 -2.921 1052 H HIS 27 HN HIS 27 20.241 9.456 -3.176 1053 HA HIS 27 HA HIS 27 17.680 10.466 -2.379 1054 HB2 HIS 27 HB2 HIS 27 19.594 11.355 -1.266 1055 HB3 HIS 27 HB1 HIS 27 20.367 11.777 -2.797 1056 HD2 HIS 27 HD2 HIS 27 19.706 14.295 -3.744 1057 HE1 HIS 27 HE1 HIS 27 16.468 15.054 -1.142 1058 HE2 HIS 27 HE2 HIS 27 17.938 16.049 -2.959 1059 H LEU 28 HN LEU 28 19.694 10.718 -5.255 1060 HA LEU 28 HA LEU 28 18.314 12.810 -6.545 1061 HB2 LEU 28 HB2 LEU 28 20.572 11.815 -7.170 1062 HB3 LEU 28 HB1 LEU 28 19.677 10.499 -7.930 1063 HG LEU 28 HG LEU 28 18.400 12.296 -9.222 1064 HD11 LEU 28 HD11 LEU 28 19.773 14.444 -9.457 1065 HD12 LEU 28 HD12 LEU 28 20.616 13.948 -7.989 1066 HD13 LEU 28 HD13 LEU 28 18.880 14.259 -7.948 1067 HD21 LEU 28 HD21 LEU 28 20.041 11.003 -10.392 1068 HD22 LEU 28 HD22 LEU 28 21.371 11.837 -9.588 1069 HD23 LEU 28 HD23 LEU 28 20.390 12.687 -10.782 1070 H ASN 29 HN ASN 29 16.458 12.883 -7.663 1071 HA ASN 29 HA ASN 29 15.121 10.335 -8.339 1072 HB2 ASN 29 HB2 ASN 29 12.958 11.417 -7.763 1073 HB3 ASN 29 HB1 ASN 29 14.018 11.240 -6.366 1074 HD21 ASN 29 HD21 ASN 29 11.928 13.413 -7.644 1075 HD22 ASN 29 HD22 ASN 29 12.667 14.863 -7.161 1076 H GLN 30 HN GLN 30 14.221 10.245 -10.332 1077 HA GLN 30 HA GLN 30 13.990 12.734 -11.886 1078 HB2 GLN 30 HB2 GLN 30 15.124 11.757 -13.787 1079 HB3 GLN 30 HB1 GLN 30 16.194 11.651 -12.388 1080 HG2 GLN 30 HG2 GLN 30 15.359 9.314 -12.006 1081 HG3 GLN 30 HG1 GLN 30 14.462 9.436 -13.518 1082 HE21 GLN 30 HE21 GLN 30 17.245 8.144 -12.357 1083 HE22 GLN 30 HE22 GLN 30 18.231 8.275 -13.734 1084 H ILE 31 HN ILE 31 12.335 12.744 -13.347 1085 HA ILE 31 HA ILE 31 10.851 10.252 -13.790 1086 HB ILE 31 HB ILE 31 8.722 11.384 -13.269 1087 HG12 ILE 31 HG12 ILE 31 10.470 13.615 -12.186 1088 HG13 ILE 31 HG11 ILE 31 9.603 13.705 -13.720 1089 HG21 ILE 31 HG21 ILE 31 10.732 11.544 -11.002 1090 HG22 ILE 31 HG22 ILE 31 9.936 10.064 -11.538 1091 HG23 ILE 31 HG23 ILE 31 8.984 11.373 -10.837 1092 HD11 ILE 31 HD11 ILE 31 8.372 13.329 -10.976 1093 HD12 ILE 31 HD12 ILE 31 7.472 13.268 -12.491 1094 HD13 ILE 31 HD13 ILE 31 8.256 14.766 -11.992 1095 H LYS 32 HN LYS 32 9.575 10.253 -15.683 1096 HA LYS 32 HA LYS 32 10.576 11.989 -17.760 1097 HB2 LYS 32 HB2 LYS 32 9.311 10.616 -19.268 1098 HB3 LYS 32 HB1 LYS 32 10.031 9.543 -18.067 1099 HG2 LYS 32 HG2 LYS 32 7.873 9.686 -16.766 1100 HG3 LYS 32 HG1 LYS 32 7.177 10.553 -18.136 1101 HD2 LYS 32 HD2 LYS 32 7.702 8.637 -19.610 1102 HD3 LYS 32 HD1 LYS 32 8.367 7.765 -18.228 1103 HE2 LYS 32 HE2 LYS 32 6.100 7.001 -18.532 1104 HE3 LYS 32 HE1 LYS 32 6.122 8.026 -17.096 1105 HZ1 LYS 32 HZ1 LYS 32 4.323 8.389 -18.896 1106 HZ2 LYS 32 HZ2 LYS 32 5.556 9.210 -19.728 1107 HZ3 LYS 32 HZ3 LYS 32 5.072 9.735 -18.186 1108 H ARG 33 HN ARG 33 9.435 13.522 -18.932 1109 HA ARG 33 HA ARG 33 7.173 14.711 -17.508 1110 HB2 ARG 33 HB2 ARG 33 9.256 15.658 -19.357 1111 HB3 ARG 33 HB1 ARG 33 7.659 16.350 -19.645 1112 HG2 ARG 33 HG2 ARG 33 8.863 17.736 -18.031 1113 HG3 ARG 33 HG1 ARG 33 7.513 16.936 -17.226 1114 HD2 ARG 33 HD2 ARG 33 8.970 15.276 -16.268 1115 HD3 ARG 33 HD1 ARG 33 10.331 15.833 -17.238 1116 HE ARG 33 HE ARG 33 9.340 17.033 -14.796 1117 HH11 ARG 33 HH11 ARG 33 11.107 17.537 -17.760 1118 HH12 ARG 33 HH12 ARG 33 12.007 18.874 -17.136 1119 HH21 ARG 33 HH21 ARG 33 10.542 18.778 -14.004 1120 HH22 ARG 33 HH22 ARG 33 11.692 19.574 -15.025 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 52.789 25.035 11.557 2 H2 MET 1 HT2 MET 1 53.631 24.197 12.769 3 H3 MET 1 HT3 MET 1 53.689 25.893 12.710 4 HA MET 1 HA MET 1 51.319 24.220 13.337 5 HB2 MET 1 HB2 MET 1 53.208 24.670 15.068 6 HB3 MET 1 HB1 MET 1 52.599 26.325 15.072 7 HG2 MET 1 HG2 MET 1 50.388 25.571 15.727 8 HG3 MET 1 HG1 MET 1 50.873 23.884 15.565 9 HE1 MET 1 HE1 MET 1 53.138 23.158 16.539 10 HE2 MET 1 HE2 MET 1 51.912 22.491 17.613 11 HE3 MET 1 HE3 MET 1 53.361 23.227 18.294 12 H PHE 2 HN PHE 2 51.292 25.881 11.086 13 HA PHE 2 HA PHE 2 50.069 28.404 11.922 14 HB2 PHE 2 HB2 PHE 2 50.935 27.276 9.268 15 HB3 PHE 2 HB1 PHE 2 49.930 28.721 9.373 16 HD1 PHE 2 HD1 PHE 2 53.258 27.518 9.337 17 HD2 PHE 2 HD2 PHE 2 50.774 30.551 11.092 18 HE1 PHE 2 HE1 PHE 2 55.269 28.885 9.821 19 HE2 PHE 2 HE2 PHE 2 52.786 31.919 11.576 20 HZ PHE 2 HZ PHE 2 55.033 31.086 10.941 21 H GLU 3 HN GLU 3 49.244 25.344 10.390 22 HA GLU 3 HA GLU 3 46.572 26.133 9.762 23 HB2 GLU 3 HB2 GLU 3 46.242 23.795 9.126 24 HB3 GLU 3 HB1 GLU 3 47.771 24.382 8.487 25 HG2 GLU 3 HG2 GLU 3 48.959 23.366 10.393 26 HG3 GLU 3 HG1 GLU 3 47.430 22.774 11.037 27 HA PRO 4 HA PRO 4 44.370 25.361 13.499 28 HB2 PRO 4 HB2 PRO 4 42.668 23.408 12.018 29 HB3 PRO 4 HB1 PRO 4 42.195 24.848 12.936 30 HG2 PRO 4 HG2 PRO 4 42.161 24.834 10.278 31 HG3 PRO 4 HG1 PRO 4 42.640 26.276 11.193 32 HD2 PRO 4 HD2 PRO 4 44.346 24.347 9.689 33 HD3 PRO 4 HD1 PRO 4 44.543 26.097 9.923 34 H PHE 5 HN PHE 5 45.051 22.442 11.583 35 HA PHE 5 HA PHE 5 46.318 21.124 13.786 36 HB2 PHE 5 HB2 PHE 5 43.466 20.717 13.397 37 HB3 PHE 5 HB1 PHE 5 44.367 19.208 13.247 38 HD1 PHE 5 HD1 PHE 5 42.909 21.498 15.529 39 HD2 PHE 5 HD2 PHE 5 46.229 18.812 15.073 40 HE1 PHE 5 HE1 PHE 5 43.176 21.410 17.993 41 HE2 PHE 5 HE2 PHE 5 46.497 18.724 17.537 42 HZ PHE 5 HZ PHE 5 44.970 20.022 18.997 43 H GLN 6 HN GLN 6 44.349 19.908 11.076 44 HA GLN 6 HA GLN 6 46.747 19.250 9.558 45 HB2 GLN 6 HB2 GLN 6 45.196 17.263 11.075 46 HB3 GLN 6 HB1 GLN 6 45.452 16.846 9.380 47 HG2 GLN 6 HG2 GLN 6 47.831 17.029 9.604 48 HG3 GLN 6 HG1 GLN 6 47.690 17.768 11.197 49 HE21 GLN 6 HE21 GLN 6 49.261 15.690 11.449 50 HE22 GLN 6 HE22 GLN 6 48.468 14.286 11.981 51 H ILE 7 HN ILE 7 46.233 18.475 7.386 52 HA ILE 7 HA ILE 7 44.220 19.975 6.131 53 HB ILE 7 HB ILE 7 45.770 17.564 5.194 54 HG12 ILE 7 HG12 ILE 7 46.013 20.475 4.396 55 HG13 ILE 7 HG11 ILE 7 46.947 19.772 5.717 56 HG21 ILE 7 HG21 ILE 7 43.776 17.618 3.866 57 HG22 ILE 7 HG22 ILE 7 45.029 18.399 2.902 58 HG23 ILE 7 HG23 ILE 7 43.827 19.376 3.744 59 HD11 ILE 7 HD11 ILE 7 48.060 18.253 4.259 60 HD12 ILE 7 HD12 ILE 7 48.082 19.803 3.419 61 HD13 ILE 7 HD13 ILE 7 46.923 18.561 2.945 62 H LEU 8 HN LEU 8 44.249 16.734 7.396 63 HA LEU 8 HA LEU 8 41.859 15.792 6.184 64 HB2 LEU 8 HB2 LEU 8 43.539 14.968 8.492 65 HB3 LEU 8 HB1 LEU 8 41.881 14.367 8.460 66 HG LEU 8 HG LEU 8 43.590 12.888 7.294 67 HD11 LEU 8 HD11 LEU 8 42.058 12.268 5.593 68 HD12 LEU 8 HD12 LEU 8 41.483 13.920 5.384 69 HD13 LEU 8 HD13 LEU 8 41.048 13.011 6.832 70 HD21 LEU 8 HD21 LEU 8 43.453 14.961 5.092 71 HD22 LEU 8 HD22 LEU 8 44.535 13.578 5.226 72 HD23 LEU 8 HD23 LEU 8 44.753 14.971 6.283 73 H SER 9 HN SER 9 42.262 16.645 9.621 74 HA SER 9 HA SER 9 39.621 16.854 10.327 75 HB2 SER 9 HB2 SER 9 40.342 18.393 12.100 76 HB3 SER 9 HB1 SER 9 41.502 17.081 11.915 77 HG SER 9 HG SER 9 42.386 19.275 12.029 78 H ILE 10 HN ILE 10 41.569 19.157 8.518 79 HA ILE 10 HA ILE 10 39.706 21.322 8.647 80 HB ILE 10 HB ILE 10 41.995 20.693 6.790 81 HG12 ILE 10 HG12 ILE 10 41.711 22.917 8.817 82 HG13 ILE 10 HG11 ILE 10 42.330 21.330 9.266 83 HG21 ILE 10 HG21 ILE 10 40.476 22.029 5.500 84 HG22 ILE 10 HG22 ILE 10 41.718 23.123 6.107 85 HG23 ILE 10 HG23 ILE 10 40.132 23.075 6.876 86 HD11 ILE 10 HD11 ILE 10 43.532 23.380 7.422 87 HD12 ILE 10 HD12 ILE 10 43.940 21.683 7.214 88 HD13 ILE 10 HD13 ILE 10 44.296 22.485 8.733 89 H CYS 11 HN CYS 11 40.391 18.834 6.205 90 HA CYS 11 HA CYS 11 38.500 19.676 4.293 91 HB2 CYS 11 HB2 CYS 11 39.655 16.947 4.909 92 HB3 CYS 11 HB1 CYS 11 38.605 17.265 3.528 93 HG CYS 11 HG CYS 11 40.837 17.789 2.489 94 H SER 12 HN SER 12 38.239 17.256 6.914 95 HA SER 12 HA SER 12 35.540 16.582 6.430 96 HB2 SER 12 HB2 SER 12 37.238 16.401 8.923 97 HB3 SER 12 HB1 SER 12 35.609 15.742 8.804 98 HG SER 12 HG SER 12 37.891 14.662 7.996 99 H PHE 13 HN PHE 13 37.064 19.189 8.198 100 HA PHE 13 HA PHE 13 34.881 20.010 9.776 101 HB2 PHE 13 HB2 PHE 13 37.149 20.868 10.122 102 HB3 PHE 13 HB1 PHE 13 37.094 21.676 8.563 103 HD1 PHE 13 HD1 PHE 13 35.607 21.591 11.951 104 HD2 PHE 13 HD2 PHE 13 35.916 23.738 8.243 105 HE1 PHE 13 HE1 PHE 13 34.496 23.549 12.992 106 HE2 PHE 13 HE2 PHE 13 34.806 25.696 9.284 107 HZ PHE 13 HZ PHE 13 34.096 25.602 11.659 108 H ILE 14 HN ILE 14 35.938 21.093 6.539 109 HA ILE 14 HA ILE 14 33.756 22.885 6.152 110 HB ILE 14 HB ILE 14 35.635 21.535 4.213 111 HG12 ILE 14 HG12 ILE 14 35.437 24.422 5.120 112 HG13 ILE 14 HG11 ILE 14 36.521 23.243 5.859 113 HG21 ILE 14 HG21 ILE 14 33.482 23.617 3.753 114 HG22 ILE 14 HG22 ILE 14 33.610 22.032 2.993 115 HG23 ILE 14 HG23 ILE 14 34.779 23.289 2.606 116 HD11 ILE 14 HD11 ILE 14 37.736 24.514 4.157 117 HD12 ILE 14 HD12 ILE 14 36.521 24.097 2.950 118 HD13 ILE 14 HD13 ILE 14 37.555 22.841 3.628 119 H LEU 15 HN LEU 15 34.307 19.514 5.264 120 HA LEU 15 HA LEU 15 31.982 19.138 3.698 121 HB2 LEU 15 HB2 LEU 15 33.797 17.312 5.231 122 HB3 LEU 15 HB1 LEU 15 32.299 16.679 4.545 123 HG LEU 15 HG LEU 15 34.213 18.314 2.881 124 HD11 LEU 15 HD11 LEU 15 35.507 16.438 3.773 125 HD12 LEU 15 HD12 LEU 15 35.140 16.147 2.074 126 HD13 LEU 15 HD13 LEU 15 34.224 15.313 3.329 127 HD21 LEU 15 HD21 LEU 15 33.104 16.964 1.069 128 HD22 LEU 15 HD22 LEU 15 31.983 17.992 1.959 129 HD23 LEU 15 HD23 LEU 15 32.051 16.264 2.298 130 H SER 16 HN SER 16 32.513 18.003 7.039 131 HA SER 16 HA SER 16 29.989 17.262 7.738 132 HB2 SER 16 HB2 SER 16 31.881 17.054 9.273 133 HB3 SER 16 HB1 SER 16 31.961 18.804 9.448 134 HG SER 16 HG SER 16 30.579 18.509 10.998 135 H ALA 17 HN ALA 17 31.295 20.568 7.599 136 HA ALA 17 HA ALA 17 29.126 21.936 8.747 137 HB1 ALA 17 HB1 ALA 17 30.655 23.020 6.390 138 HB2 ALA 17 HB2 ALA 17 31.442 22.807 7.954 139 HB3 ALA 17 HB3 ALA 17 30.050 23.880 7.807 140 H LEU 18 HN LEU 18 29.780 21.418 5.263 141 HA LEU 18 HA LEU 18 27.218 22.328 4.419 142 HB2 LEU 18 HB2 LEU 18 29.538 20.951 3.178 143 HB3 LEU 18 HB1 LEU 18 27.985 20.737 2.371 144 HG LEU 18 HG LEU 18 29.347 22.740 1.593 145 HD11 LEU 18 HD11 LEU 18 26.691 23.523 2.816 146 HD12 LEU 18 HD12 LEU 18 26.800 22.448 1.424 147 HD13 LEU 18 HD13 LEU 18 27.410 24.098 1.315 148 HD21 LEU 18 HD21 LEU 18 29.568 24.636 3.011 149 HD22 LEU 18 HD22 LEU 18 30.031 23.275 4.029 150 HD23 LEU 18 HD23 LEU 18 28.431 23.998 4.192 151 H HIS 19 HN HIS 19 28.276 19.390 5.802 152 HA HIS 19 HA HIS 19 26.344 17.648 4.672 153 HB2 HIS 19 HB2 HIS 19 28.505 16.998 5.874 154 HB3 HIS 19 HB1 HIS 19 27.636 17.314 7.374 155 HD2 HIS 19 HD2 HIS 19 24.875 15.930 5.454 156 HE1 HIS 19 HE1 HIS 19 26.950 12.457 6.668 157 HE2 HIS 19 HE2 HIS 19 24.763 13.332 5.723 158 H PHE 20 HN PHE 20 26.504 19.430 7.741 159 HA PHE 20 HA PHE 20 23.896 18.559 8.579 160 HB2 PHE 20 HB2 PHE 20 26.115 19.895 9.753 161 HB3 PHE 20 HB1 PHE 20 24.705 20.936 9.942 162 HD1 PHE 20 HD1 PHE 20 25.386 17.237 10.043 163 HD2 PHE 20 HD2 PHE 20 23.551 20.631 11.932 164 HE1 PHE 20 HE1 PHE 20 24.539 15.771 11.854 165 HE2 PHE 20 HE2 PHE 20 22.704 19.164 13.744 166 HZ PHE 20 HZ PHE 20 23.189 16.727 13.701 167 H MET 21 HN MET 21 25.147 21.125 6.628 168 HA MET 21 HA MET 21 22.948 22.928 6.953 169 HB2 MET 21 HB2 MET 21 25.105 22.631 4.859 170 HB3 MET 21 HB1 MET 21 23.866 23.883 4.776 171 HG2 MET 21 HG2 MET 21 25.646 23.472 7.186 172 HG3 MET 21 HG1 MET 21 26.012 24.614 5.897 173 HE1 MET 21 HE1 MET 21 23.716 25.296 9.558 174 HE2 MET 21 HE2 MET 21 25.083 24.271 9.127 175 HE3 MET 21 HE3 MET 21 23.441 23.704 8.837 176 H ALA 22 HN ALA 22 23.873 20.876 4.187 177 HA ALA 22 HA ALA 22 21.398 21.203 2.841 178 HB1 ALA 22 HB1 ALA 22 23.164 18.810 2.449 179 HB2 ALA 22 HB2 ALA 22 23.689 20.409 1.924 180 HB3 ALA 22 HB3 ALA 22 22.220 19.698 1.254 181 H TRP 23 HN TRP 23 22.625 18.700 5.025 182 HA TRP 23 HA TRP 23 20.505 16.876 4.723 183 HB2 TRP 23 HB2 TRP 23 22.698 16.414 5.841 184 HB3 TRP 23 HB1 TRP 23 22.124 17.341 7.229 185 HD1 TRP 23 HD1 TRP 23 21.634 14.068 5.368 186 HE1 TRP 23 HE1 TRP 23 20.167 12.502 6.799 187 HE3 TRP 23 HE3 TRP 23 20.235 17.301 9.068 188 HZ2 TRP 23 HZ2 TRP 23 18.606 12.607 9.194 189 HZ3 TRP 23 HZ3 TRP 23 18.760 16.541 10.909 190 HH2 TRP 23 HH2 TRP 23 17.944 14.202 10.977 191 H THR 24 HN THR 24 20.949 19.636 6.898 192 HA THR 24 HA THR 24 18.612 19.215 8.444 193 HB THR 24 HB THR 24 20.256 21.675 7.869 194 HG1 THR 24 HG1 THR 24 19.936 19.932 10.076 195 HG21 THR 24 HG21 THR 24 17.772 21.326 9.545 196 HG22 THR 24 HG22 THR 24 18.128 22.576 8.351 197 HG23 THR 24 HG23 THR 24 18.964 22.574 9.905 198 H ILE 25 HN ILE 25 19.243 21.079 5.497 199 HA ILE 25 HA ILE 25 16.724 22.322 5.284 200 HB ILE 25 HB ILE 25 18.727 21.485 3.181 201 HG12 ILE 25 HG12 ILE 25 18.021 24.239 4.223 202 HG13 ILE 25 HG11 ILE 25 19.299 23.256 4.937 203 HG21 ILE 25 HG21 ILE 25 16.144 23.047 2.963 204 HG22 ILE 25 HG22 ILE 25 16.647 21.644 2.021 205 HG23 ILE 25 HG23 ILE 25 17.440 23.199 1.778 206 HD11 ILE 25 HD11 ILE 25 20.297 23.069 2.605 207 HD12 ILE 25 HD12 ILE 25 20.359 24.679 3.322 208 HD13 ILE 25 HD13 ILE 25 19.143 24.304 2.101 209 H GLY 26 HN GLY 26 17.912 19.224 4.002 210 HA2 GLY 26 HA2 GLY 26 15.566 18.498 2.602 211 HA3 GLY 26 HA1 GLY 26 16.797 17.378 3.180 212 H HIS 27 HN HIS 27 16.639 17.831 5.937 213 HA HIS 27 HA HIS 27 14.568 16.135 6.716 214 HB2 HIS 27 HB2 HIS 27 16.458 16.409 8.161 215 HB3 HIS 27 HB1 HIS 27 16.192 18.148 8.282 216 HD2 HIS 27 HD2 HIS 27 14.776 18.801 10.549 217 HE1 HIS 27 HE1 HIS 27 12.798 15.117 11.124 218 HE2 HIS 27 HE2 HIS 27 13.142 17.447 12.072 219 H LEU 28 HN LEU 28 14.763 19.684 6.800 220 HA LEU 28 HA LEU 28 12.165 20.014 7.939 221 HB2 LEU 28 HB2 LEU 28 14.288 21.768 6.846 222 HB3 LEU 28 HB1 LEU 28 12.647 22.409 6.763 223 HG LEU 28 HG LEU 28 13.897 22.974 8.893 224 HD11 LEU 28 HD11 LEU 28 11.458 21.255 9.402 225 HD12 LEU 28 HD12 LEU 28 11.350 22.829 8.619 226 HD13 LEU 28 HD13 LEU 28 11.964 22.700 10.266 227 HD21 LEU 28 HD21 LEU 28 13.393 20.077 9.624 228 HD22 LEU 28 HD22 LEU 28 14.346 21.272 10.495 229 HD23 LEU 28 HD23 LEU 28 14.941 20.615 8.972 230 H ASN 29 HN ASN 29 10.223 20.132 7.006 231 HA ASN 29 HA ASN 29 10.005 19.463 4.203 232 HB2 ASN 29 HB2 ASN 29 7.889 20.076 6.281 233 HB3 ASN 29 HB1 ASN 29 7.568 19.472 4.657 234 HD21 ASN 29 HD21 ASN 29 7.400 18.270 7.584 235 HD22 ASN 29 HD22 ASN 29 8.103 16.738 7.384 236 H GLN 30 HN GLN 30 9.314 20.746 2.548 237 HA GLN 30 HA GLN 30 9.323 23.634 3.062 238 HB2 GLN 30 HB2 GLN 30 9.715 21.914 0.640 239 HB3 GLN 30 HB1 GLN 30 9.220 23.596 0.438 240 HG2 GLN 30 HG2 GLN 30 11.618 23.580 0.386 241 HG3 GLN 30 HG1 GLN 30 11.152 24.230 1.957 242 HE21 GLN 30 HE21 GLN 30 13.060 23.500 3.082 243 HE22 GLN 30 HE22 GLN 30 13.383 21.853 3.336 244 H ILE 31 HN ILE 31 7.457 24.661 3.332 245 HA ILE 31 HA ILE 31 5.034 23.544 2.048 246 HB ILE 31 HB ILE 31 5.234 25.195 4.583 247 HG12 ILE 31 HG12 ILE 31 4.495 22.272 4.237 248 HG13 ILE 31 HG11 ILE 31 6.101 22.819 4.717 249 HG21 ILE 31 HG21 ILE 31 2.873 23.751 3.337 250 HG22 ILE 31 HG22 ILE 31 3.136 25.490 3.239 251 HG23 ILE 31 HG23 ILE 31 2.850 24.731 4.802 252 HD11 ILE 31 HD11 ILE 31 3.514 23.352 6.203 253 HD12 ILE 31 HD12 ILE 31 5.088 24.006 6.656 254 HD13 ILE 31 HD13 ILE 31 4.807 22.266 6.712 255 H LYS 32 HN LYS 32 4.057 24.783 0.579 256 HA LYS 32 HA LYS 32 4.953 27.568 0.278 257 HB2 LYS 32 HB2 LYS 32 5.131 26.139 -1.706 258 HB3 LYS 32 HB1 LYS 32 3.408 25.775 -1.611 259 HG2 LYS 32 HG2 LYS 32 2.852 28.127 -1.959 260 HG3 LYS 32 HG1 LYS 32 4.562 28.557 -1.949 261 HD2 LYS 32 HD2 LYS 32 4.946 27.199 -3.954 262 HD3 LYS 32 HD1 LYS 32 3.259 26.685 -3.947 263 HE2 LYS 32 HE2 LYS 32 4.080 29.593 -4.103 264 HE3 LYS 32 HE1 LYS 32 3.802 28.601 -5.534 265 HZ1 LYS 32 HZ1 LYS 32 1.907 29.932 -4.008 266 HZ2 LYS 32 HZ2 LYS 32 1.657 28.279 -3.713 267 HZ3 LYS 32 HZ3 LYS 32 1.632 28.875 -5.303 268 H ARG 33 HN ARG 33 3.740 28.999 1.343 269 HA ARG 33 HA ARG 33 0.831 28.538 1.534 270 HB2 ARG 33 HB2 ARG 33 2.293 28.925 3.621 271 HB3 ARG 33 HB1 ARG 33 2.386 30.601 3.083 272 HG2 ARG 33 HG2 ARG 33 -0.016 30.840 3.170 273 HG3 ARG 33 HG1 ARG 33 -0.222 29.115 3.476 274 HD2 ARG 33 HD2 ARG 33 -0.434 30.369 5.566 275 HD3 ARG 33 HD1 ARG 33 1.005 29.355 5.607 276 HE ARG 33 HE ARG 33 1.659 31.948 4.640 277 HH11 ARG 33 HH11 ARG 33 0.782 30.198 7.514 278 HH12 ARG 33 HH12 ARG 33 1.616 31.272 8.574 279 HH21 ARG 33 HH21 ARG 33 2.754 33.353 6.048 280 HH22 ARG 33 HH22 ARG 33 2.731 33.053 7.753 281 H1 MET 1 HT1 MET 1 46.673 17.244 30.709 282 H2 MET 1 HT2 MET 1 48.054 16.348 30.296 283 H3 MET 1 HT3 MET 1 47.602 16.512 31.925 284 HA MET 1 HA MET 1 46.127 15.034 29.816 285 HB2 MET 1 HB2 MET 1 48.256 14.072 30.960 286 HB3 MET 1 HB1 MET 1 47.238 13.941 32.395 287 HG2 MET 1 HG2 MET 1 45.649 12.539 31.212 288 HG3 MET 1 HG1 MET 1 46.516 12.773 29.695 289 HE1 MET 1 HE1 MET 1 49.081 12.592 29.706 290 HE2 MET 1 HE2 MET 1 48.496 11.135 28.908 291 HE3 MET 1 HE3 MET 1 49.813 11.023 30.073 292 H PHE 2 HN PHE 2 44.932 17.221 31.091 293 HA PHE 2 HA PHE 2 43.369 16.140 33.317 294 HB2 PHE 2 HB2 PHE 2 43.640 18.875 32.082 295 HB3 PHE 2 HB1 PHE 2 42.355 18.502 33.231 296 HD1 PHE 2 HD1 PHE 2 45.702 19.607 32.902 297 HD2 PHE 2 HD2 PHE 2 43.143 17.266 35.436 298 HE1 PHE 2 HE1 PHE 2 47.294 19.901 34.781 299 HE2 PHE 2 HE2 PHE 2 44.734 17.560 37.316 300 HZ PHE 2 HZ PHE 2 46.809 18.878 36.988 301 H GLU 3 HN GLU 3 43.009 17.149 29.963 302 HA GLU 3 HA GLU 3 40.168 16.872 29.961 303 HB2 GLU 3 HB2 GLU 3 40.328 17.247 27.552 304 HB3 GLU 3 HB1 GLU 3 41.355 18.390 28.407 305 HG2 GLU 3 HG2 GLU 3 43.310 16.945 27.993 306 HG3 GLU 3 HG1 GLU 3 42.285 15.798 27.134 307 HA PRO 4 HA PRO 4 39.557 12.577 29.195 308 HB2 PRO 4 HB2 PRO 4 38.100 13.301 26.691 309 HB3 PRO 4 HB1 PRO 4 37.552 12.343 28.080 310 HG2 PRO 4 HG2 PRO 4 36.692 14.829 27.694 311 HG3 PRO 4 HG1 PRO 4 37.009 14.197 29.320 312 HD2 PRO 4 HD2 PRO 4 38.627 16.101 27.689 313 HD3 PRO 4 HD1 PRO 4 38.386 16.029 29.447 314 H PHE 5 HN PHE 5 40.400 14.470 26.302 315 HA PHE 5 HA PHE 5 42.609 12.768 25.661 316 HB2 PHE 5 HB2 PHE 5 40.014 12.145 24.504 317 HB3 PHE 5 HB1 PHE 5 41.210 12.518 23.263 318 HD1 PHE 5 HD1 PHE 5 39.955 9.990 25.408 319 HD2 PHE 5 HD2 PHE 5 43.583 11.418 23.607 320 HE1 PHE 5 HE1 PHE 5 40.993 7.761 25.734 321 HE2 PHE 5 HE2 PHE 5 44.622 9.189 23.933 322 HZ PHE 5 HZ PHE 5 43.323 7.357 24.996 323 H GLN 6 HN GLN 6 40.317 14.581 23.623 324 HA GLN 6 HA GLN 6 42.200 16.792 23.379 325 HB2 GLN 6 HB2 GLN 6 41.828 14.743 21.301 326 HB3 GLN 6 HB1 GLN 6 41.655 16.403 20.729 327 HG2 GLN 6 HG2 GLN 6 43.831 17.000 21.545 328 HG3 GLN 6 HG1 GLN 6 43.986 15.483 22.426 329 HE21 GLN 6 HE21 GLN 6 46.080 15.684 20.870 330 HE22 GLN 6 HE22 GLN 6 45.922 14.861 19.393 331 H ILE 7 HN ILE 7 41.269 18.624 22.209 332 HA ILE 7 HA ILE 7 38.628 19.186 22.966 333 HB ILE 7 HB ILE 7 40.418 20.479 20.911 334 HG12 ILE 7 HG12 ILE 7 39.574 21.448 23.653 335 HG13 ILE 7 HG11 ILE 7 41.032 20.488 23.393 336 HG21 ILE 7 HG21 ILE 7 38.173 21.050 20.289 337 HG22 ILE 7 HG22 ILE 7 38.793 22.420 21.212 338 HG23 ILE 7 HG23 ILE 7 37.694 21.271 21.973 339 HD11 ILE 7 HD11 ILE 7 42.014 22.162 22.014 340 HD12 ILE 7 HD12 ILE 7 41.334 23.035 23.388 341 HD13 ILE 7 HD13 ILE 7 40.486 23.027 21.842 342 H LEU 8 HN LEU 8 39.970 17.854 20.041 343 HA LEU 8 HA LEU 8 37.689 18.131 18.373 344 HB2 LEU 8 HB2 LEU 8 40.167 16.489 18.333 345 HB3 LEU 8 HB1 LEU 8 38.823 15.932 17.335 346 HG LEU 8 HG LEU 8 40.432 17.529 16.184 347 HD11 LEU 8 HD11 LEU 8 38.691 18.581 14.967 348 HD12 LEU 8 HD12 LEU 8 37.638 18.673 16.375 349 HD13 LEU 8 HD13 LEU 8 37.943 17.117 15.603 350 HD21 LEU 8 HD21 LEU 8 39.040 19.651 17.837 351 HD22 LEU 8 HD22 LEU 8 40.445 19.831 16.789 352 HD23 LEU 8 HD23 LEU 8 40.596 18.974 18.322 353 H SER 9 HN SER 9 38.890 15.078 19.763 354 HA SER 9 HA SER 9 36.657 13.528 19.406 355 HB2 SER 9 HB2 SER 9 37.435 12.180 21.303 356 HB3 SER 9 HB1 SER 9 38.801 12.692 20.317 357 HG SER 9 HG SER 9 39.005 12.983 22.661 358 H ILE 10 HN ILE 10 37.208 16.001 21.846 359 HA ILE 10 HA ILE 10 34.952 15.351 23.477 360 HB ILE 10 HB ILE 10 36.619 17.844 23.183 361 HG12 ILE 10 HG12 ILE 10 36.373 15.947 25.523 362 HG13 ILE 10 HG11 ILE 10 37.527 15.669 24.223 363 HG21 ILE 10 HG21 ILE 10 34.462 18.605 23.905 364 HG22 ILE 10 HG22 ILE 10 35.470 18.507 25.348 365 HG23 ILE 10 HG23 ILE 10 34.285 17.244 25.012 366 HD11 ILE 10 HD11 ILE 10 37.444 17.902 26.236 367 HD12 ILE 10 HD12 ILE 10 38.230 18.164 24.686 368 HD13 ILE 10 HD13 ILE 10 38.807 16.896 25.753 369 H CYS 11 HN CYS 11 35.503 17.761 20.919 370 HA CYS 11 HA CYS 11 32.951 18.952 20.992 371 HB2 CYS 11 HB2 CYS 11 34.958 18.632 18.749 372 HB3 CYS 11 HB1 CYS 11 33.484 19.590 18.602 373 HG CYS 11 HG CYS 11 35.039 21.348 19.511 374 H SER 12 HN SER 12 34.221 16.287 18.969 375 HA SER 12 HA SER 12 31.814 15.787 17.583 376 HB2 SER 12 HB2 SER 12 34.185 14.013 18.187 377 HB3 SER 12 HB1 SER 12 32.860 13.542 17.129 378 HG SER 12 HG SER 12 34.983 15.026 16.559 379 H PHE 13 HN PHE 13 33.015 14.771 20.710 380 HA PHE 13 HA PHE 13 31.299 12.588 21.173 381 HB2 PHE 13 HB2 PHE 13 33.223 13.077 22.610 382 HB3 PHE 13 HB1 PHE 13 32.453 14.561 23.154 383 HD1 PHE 13 HD1 PHE 13 32.199 10.869 23.173 384 HD2 PHE 13 HD2 PHE 13 30.701 14.556 24.788 385 HE1 PHE 13 HE1 PHE 13 30.968 9.606 24.916 386 HE2 PHE 13 HE2 PHE 13 29.470 13.293 26.532 387 HZ PHE 13 HZ PHE 13 29.604 10.818 26.596 388 H ILE 14 HN ILE 14 30.935 16.039 22.020 389 HA ILE 14 HA ILE 14 28.330 15.747 23.138 390 HB ILE 14 HB ILE 14 29.803 18.142 22.042 391 HG12 ILE 14 HG12 ILE 14 29.099 17.363 24.886 392 HG13 ILE 14 HG11 ILE 14 30.645 16.980 24.128 393 HG21 ILE 14 HG21 ILE 14 27.128 17.947 23.451 394 HG22 ILE 14 HG22 ILE 14 27.436 18.611 21.846 395 HG23 ILE 14 HG23 ILE 14 28.033 19.449 23.275 396 HD11 ILE 14 HD11 ILE 14 30.864 19.052 25.406 397 HD12 ILE 14 HD12 ILE 14 29.490 19.752 24.549 398 HD13 ILE 14 HD13 ILE 14 30.989 19.411 23.683 399 H LEU 15 HN LEU 15 29.502 16.613 19.920 400 HA LEU 15 HA LEU 15 27.011 17.270 18.761 401 HB2 LEU 15 HB2 LEU 15 29.652 16.356 17.681 402 HB3 LEU 15 HB1 LEU 15 28.259 16.460 16.603 403 HG LEU 15 HG LEU 15 29.010 18.755 18.412 404 HD11 LEU 15 HD11 LEU 15 30.994 18.263 17.065 405 HD12 LEU 15 HD12 LEU 15 30.210 19.720 16.455 406 HD13 LEU 15 HD13 LEU 15 30.009 18.189 15.603 407 HD21 LEU 15 HD21 LEU 15 27.819 20.013 16.588 408 HD22 LEU 15 HD22 LEU 15 26.791 18.846 17.416 409 HD23 LEU 15 HD23 LEU 15 27.449 18.466 15.826 410 H SER 16 HN SER 16 28.860 14.258 18.267 411 HA SER 16 HA SER 16 27.001 12.710 17.029 412 HB2 SER 16 HB2 SER 16 29.245 11.888 17.495 413 HB3 SER 16 HB1 SER 16 28.906 11.856 19.224 414 HG SER 16 HG SER 16 28.231 9.906 18.832 415 H ALA 17 HN ALA 17 27.208 13.439 20.502 416 HA ALA 17 HA ALA 17 25.216 11.688 21.429 417 HB1 ALA 17 HB1 ALA 17 25.564 14.473 22.521 418 HB2 ALA 17 HB2 ALA 17 26.819 13.253 22.737 419 HB3 ALA 17 HB3 ALA 17 25.204 12.982 23.392 420 H LEU 18 HN LEU 18 24.863 15.158 20.609 421 HA LEU 18 HA LEU 18 22.019 15.125 20.725 422 HB2 LEU 18 HB2 LEU 18 24.122 17.013 19.812 423 HB3 LEU 18 HB1 LEU 18 22.520 17.233 19.107 424 HG LEU 18 HG LEU 18 22.948 18.520 21.260 425 HD11 LEU 18 HD11 LEU 18 20.702 16.509 21.524 426 HD12 LEU 18 HD12 LEU 18 20.665 17.793 20.318 427 HD13 LEU 18 HD13 LEU 18 20.720 18.195 22.033 428 HD21 LEU 18 HD21 LEU 18 23.071 17.356 23.327 429 HD22 LEU 18 HD22 LEU 18 24.178 16.477 22.275 430 HD23 LEU 18 HD23 LEU 18 22.571 15.831 22.601 431 H HIS 19 HN HIS 19 24.242 14.046 18.366 432 HA HIS 19 HA HIS 19 22.626 14.367 16.053 433 HB2 HIS 19 HB2 HIS 19 25.148 13.940 16.142 434 HB3 HIS 19 HB1 HIS 19 24.741 12.251 16.435 435 HD2 HIS 19 HD2 HIS 19 22.027 13.056 14.152 436 HE1 HIS 19 HE1 HIS 19 25.270 12.448 11.513 437 HE2 HIS 19 HE2 HIS 19 22.743 12.639 11.671 438 H PHE 20 HN PHE 20 23.238 11.625 18.234 439 HA PHE 20 HA PHE 20 21.382 9.906 16.870 440 HB2 PHE 20 HB2 PHE 20 23.385 9.630 18.872 441 HB3 PHE 20 HB1 PHE 20 21.873 9.022 19.544 442 HD1 PHE 20 HD1 PHE 20 23.561 8.976 16.181 443 HD2 PHE 20 HD2 PHE 20 21.547 6.743 19.250 444 HE1 PHE 20 HE1 PHE 20 23.781 6.913 14.825 445 HE2 PHE 20 HE2 PHE 20 21.768 4.680 17.892 446 HZ PHE 20 HZ PHE 20 22.889 4.762 15.682 447 H MET 21 HN MET 21 21.175 12.286 19.368 448 HA MET 21 HA MET 21 18.773 11.319 20.586 449 HB2 MET 21 HB2 MET 21 20.156 14.006 20.553 450 HB3 MET 21 HB1 MET 21 18.651 13.722 21.427 451 HG2 MET 21 HG2 MET 21 21.137 12.044 21.821 452 HG3 MET 21 HG1 MET 21 20.734 13.432 22.829 453 HE1 MET 21 HE1 MET 21 19.615 9.243 23.408 454 HE2 MET 21 HE2 MET 21 21.008 10.066 22.712 455 HE3 MET 21 HE3 MET 21 19.592 9.751 21.715 456 H ALA 22 HN ALA 22 19.325 14.138 18.471 457 HA ALA 22 HA ALA 22 16.569 14.579 17.974 458 HB1 ALA 22 HB1 ALA 22 18.726 15.425 16.067 459 HB2 ALA 22 HB2 ALA 22 18.588 16.175 17.657 460 HB3 ALA 22 HB3 ALA 22 17.247 16.274 16.515 461 H TRP 23 HN TRP 23 19.072 12.818 16.189 462 HA TRP 23 HA TRP 23 17.569 12.294 13.870 463 HB2 TRP 23 HB2 TRP 23 20.038 11.963 14.133 464 HB3 TRP 23 HB1 TRP 23 19.688 10.509 15.071 465 HD1 TRP 23 HD1 TRP 23 19.586 11.934 11.553 466 HE1 TRP 23 HE1 TRP 23 19.145 10.017 9.886 467 HE3 TRP 23 HE3 TRP 23 18.566 8.139 14.816 468 HZ2 TRP 23 HZ2 TRP 23 18.451 7.242 9.929 469 HZ3 TRP 23 HZ3 TRP 23 18.019 5.872 13.977 470 HH2 TRP 23 HH2 TRP 23 17.960 5.419 11.540 471 H THR 24 HN THR 24 17.877 10.530 16.927 472 HA THR 24 HA THR 24 16.359 8.267 16.154 473 HB THR 24 HB THR 24 16.977 9.480 18.842 474 HG1 THR 24 HG1 THR 24 17.866 7.204 17.411 475 HG21 THR 24 HG21 THR 24 15.352 7.042 18.118 476 HG22 THR 24 HG22 THR 24 14.943 8.344 19.237 477 HG23 THR 24 HG23 THR 24 16.191 7.173 19.664 478 H ILE 25 HN ILE 25 15.483 11.336 17.690 479 HA ILE 25 HA ILE 25 12.779 10.741 18.223 480 HB ILE 25 HB ILE 25 14.174 13.355 17.624 481 HG12 ILE 25 HG12 ILE 25 13.081 12.275 20.232 482 HG13 ILE 25 HG11 ILE 25 14.742 11.990 19.710 483 HG21 ILE 25 HG21 ILE 25 11.324 12.762 18.449 484 HG22 ILE 25 HG22 ILE 25 11.877 13.739 17.090 485 HG23 ILE 25 HG23 ILE 25 12.085 14.325 18.741 486 HD11 ILE 25 HD11 ILE 25 14.969 14.510 19.452 487 HD12 ILE 25 HD12 ILE 25 14.794 13.939 21.110 488 HD13 ILE 25 HD13 ILE 25 13.416 14.653 20.273 489 H GLY 26 HN GLY 26 14.330 12.200 15.372 490 HA2 GLY 26 HA2 GLY 26 11.971 12.680 13.891 491 HA3 GLY 26 HA1 GLY 26 13.584 12.499 13.210 492 H HIS 27 HN HIS 27 14.181 9.882 13.977 493 HA HIS 27 HA HIS 27 13.022 8.365 11.948 494 HB2 HIS 27 HB2 HIS 27 15.110 7.660 12.884 495 HB3 HIS 27 HB1 HIS 27 14.416 7.542 14.502 496 HD2 HIS 27 HD2 HIS 27 13.659 4.963 15.090 497 HE1 HIS 27 HE1 HIS 27 13.080 3.574 11.146 498 HE2 HIS 27 HE2 HIS 27 13.035 2.912 13.597 499 H LEU 28 HN LEU 28 12.224 8.519 15.408 500 HA LEU 28 HA LEU 28 10.129 6.584 15.234 501 HB2 LEU 28 HB2 LEU 28 11.216 8.418 17.293 502 HB3 LEU 28 HB1 LEU 28 9.521 7.969 17.483 503 HG LEU 28 HG LEU 28 11.166 6.421 18.635 504 HD11 LEU 28 HD11 LEU 28 9.596 5.027 16.455 505 HD12 LEU 28 HD12 LEU 28 8.808 5.809 17.822 506 HD13 LEU 28 HD13 LEU 28 9.917 4.465 18.090 507 HD21 LEU 28 HD21 LEU 28 11.749 5.422 15.834 508 HD22 LEU 28 HD22 LEU 28 12.551 4.983 17.337 509 HD23 LEU 28 HD23 LEU 28 12.800 6.584 16.645 510 H ASN 29 HN ASN 29 8.041 6.807 14.738 511 HA ASN 29 HA ASN 29 7.156 9.332 13.647 512 HB2 ASN 29 HB2 ASN 29 5.712 6.692 13.993 513 HB3 ASN 29 HB1 ASN 29 5.090 8.080 13.102 514 HD21 ASN 29 HD21 ASN 29 6.197 5.210 12.331 515 HD22 ASN 29 HD22 ASN 29 7.209 5.559 11.013 516 H GLN 30 HN GLN 30 5.653 10.716 14.474 517 HA GLN 30 HA GLN 30 5.002 10.374 17.313 518 HB2 GLN 30 HB2 GLN 30 5.077 12.699 15.425 519 HB3 GLN 30 HB1 GLN 30 4.098 12.800 16.889 520 HG2 GLN 30 HG2 GLN 30 6.262 13.665 17.454 521 HG3 GLN 30 HG1 GLN 30 6.151 12.064 18.182 522 HE21 GLN 30 HE21 GLN 30 8.439 11.618 18.108 523 HE22 GLN 30 HE22 GLN 30 9.271 11.408 16.644 524 H ILE 31 HN ILE 31 3.104 9.532 17.866 525 HA ILE 31 HA ILE 31 0.822 9.860 16.010 526 HB ILE 31 HB ILE 31 1.332 7.627 17.994 527 HG12 ILE 31 HG12 ILE 31 1.378 7.559 14.960 528 HG13 ILE 31 HG11 ILE 31 2.831 7.684 15.952 529 HG21 ILE 31 HG21 ILE 31 -0.792 7.926 15.846 530 HG22 ILE 31 HG22 ILE 31 -1.075 8.190 17.566 531 HG23 ILE 31 HG23 ILE 31 -0.630 6.589 16.983 532 HD11 ILE 31 HD11 ILE 31 0.807 5.429 16.011 533 HD12 ILE 31 HD12 ILE 31 2.174 5.575 17.115 534 HD13 ILE 31 HD13 ILE 31 2.455 5.343 15.390 535 H LYS 32 HN LYS 32 -0.875 10.969 16.746 536 HA LYS 32 HA LYS 32 -0.945 11.689 19.598 537 HB2 LYS 32 HB2 LYS 32 -1.000 13.547 18.005 538 HB3 LYS 32 HB1 LYS 32 -2.422 12.854 17.226 539 HG2 LYS 32 HG2 LYS 32 -3.714 13.097 19.283 540 HG3 LYS 32 HG1 LYS 32 -2.290 13.692 20.136 541 HD2 LYS 32 HD2 LYS 32 -2.181 15.640 18.644 542 HD3 LYS 32 HD1 LYS 32 -3.568 15.035 17.736 543 HE2 LYS 32 HE2 LYS 32 -3.686 15.597 20.706 544 HE3 LYS 32 HE1 LYS 32 -4.101 16.804 19.490 545 HZ1 LYS 32 HZ1 LYS 32 -5.729 14.808 20.504 546 HZ2 LYS 32 HZ2 LYS 32 -5.392 14.349 18.904 547 HZ3 LYS 32 HZ3 LYS 32 -6.076 15.869 19.229 548 H ARG 33 HN ARG 33 -2.120 10.351 20.816 549 HA ARG 33 HA ARG 33 -4.564 9.159 19.668 550 HB2 ARG 33 HB2 ARG 33 -2.694 7.713 20.690 551 HB3 ARG 33 HB1 ARG 33 -3.249 8.327 22.248 552 HG2 ARG 33 HG2 ARG 33 -5.469 7.443 21.884 553 HG3 ARG 33 HG1 ARG 33 -5.069 7.000 20.224 554 HD2 ARG 33 HD2 ARG 33 -4.963 5.027 21.670 555 HD3 ARG 33 HD1 ARG 33 -3.359 5.428 21.062 556 HE ARG 33 HE ARG 33 -3.799 6.689 23.572 557 HH11 ARG 33 HH11 ARG 33 -3.207 3.600 22.086 558 HH12 ARG 33 HH12 ARG 33 -2.423 2.943 23.472 559 HH21 ARG 33 HH21 ARG 33 -2.763 5.809 25.391 560 HH22 ARG 33 HH22 ARG 33 -2.169 4.182 25.340 561 H1 MET 1 HT1 MET 1 49.831 -3.267 23.574 562 H2 MET 1 HT2 MET 1 51.167 -2.335 23.091 563 H3 MET 1 HT3 MET 1 51.294 -4.027 23.176 564 HA MET 1 HA MET 1 49.643 -2.462 21.269 565 HB2 MET 1 HB2 MET 1 52.214 -2.747 20.986 566 HB3 MET 1 HB1 MET 1 51.832 -4.432 20.628 567 HG2 MET 1 HG2 MET 1 50.388 -3.776 18.792 568 HG3 MET 1 HG1 MET 1 50.574 -2.071 19.205 569 HE1 MET 1 HE1 MET 1 52.933 -1.197 19.760 570 HE2 MET 1 HE2 MET 1 52.530 -0.550 18.172 571 HE3 MET 1 HE3 MET 1 54.146 -1.186 18.472 572 H PHE 2 HN PHE 2 48.402 -4.203 23.073 573 HA PHE 2 HA PHE 2 48.071 -6.755 21.681 574 HB2 PHE 2 HB2 PHE 2 47.124 -5.676 24.330 575 HB3 PHE 2 HB1 PHE 2 46.474 -7.169 23.653 576 HD1 PHE 2 HD1 PHE 2 49.050 -5.785 25.648 577 HD2 PHE 2 HD2 PHE 2 48.285 -8.890 22.781 578 HE1 PHE 2 HE1 PHE 2 51.041 -7.022 26.457 579 HE2 PHE 2 HE2 PHE 2 50.277 -10.128 23.590 580 HZ PHE 2 HZ PHE 2 51.654 -9.193 25.427 581 H GLU 3 HN GLU 3 46.308 -3.797 22.418 582 HA GLU 3 HA GLU 3 43.839 -4.747 21.347 583 HB2 GLU 3 HB2 GLU 3 43.049 -2.456 21.658 584 HB3 GLU 3 HB1 GLU 3 43.947 -2.977 23.077 585 HG2 GLU 3 HG2 GLU 3 45.958 -1.833 22.224 586 HG3 GLU 3 HG1 GLU 3 45.059 -1.304 20.803 587 HA PRO 4 HA PRO 4 44.223 -3.966 17.027 588 HB2 PRO 4 HB2 PRO 4 41.851 -2.163 17.208 589 HB3 PRO 4 HB1 PRO 4 42.106 -3.595 16.194 590 HG2 PRO 4 HG2 PRO 4 40.510 -3.673 18.320 591 HG3 PRO 4 HG1 PRO 4 41.527 -5.054 17.871 592 HD2 PRO 4 HD2 PRO 4 41.890 -3.086 20.083 593 HD3 PRO 4 HD1 PRO 4 42.297 -4.813 20.019 594 H PHE 5 HN PHE 5 43.457 -1.087 18.971 595 HA PHE 5 HA PHE 5 45.688 0.375 17.939 596 HB2 PHE 5 HB2 PHE 5 43.137 0.618 16.563 597 HB3 PHE 5 HB1 PHE 5 43.681 2.166 17.211 598 HD1 PHE 5 HD1 PHE 5 43.997 -0.121 14.519 599 HD2 PHE 5 HD2 PHE 5 46.231 2.721 16.838 600 HE1 PHE 5 HE1 PHE 5 45.661 0.063 12.688 601 HE2 PHE 5 HE2 PHE 5 47.896 2.905 15.008 602 HZ PHE 5 HZ PHE 5 47.610 1.577 12.934 603 H GLN 6 HN GLN 6 42.426 1.401 18.947 604 HA GLN 6 HA GLN 6 43.414 2.131 21.588 605 HB2 GLN 6 HB2 GLN 6 42.935 4.079 19.434 606 HB3 GLN 6 HB1 GLN 6 42.124 4.454 20.955 607 HG2 GLN 6 HG2 GLN 6 44.191 4.394 22.171 608 HG3 GLN 6 HG1 GLN 6 45.053 3.715 20.794 609 HE21 GLN 6 HE21 GLN 6 46.331 5.885 21.529 610 HE22 GLN 6 HE22 GLN 6 45.911 7.265 20.633 611 H ILE 7 HN ILE 7 41.669 2.799 23.032 612 HA ILE 7 HA ILE 7 39.405 1.155 22.858 613 HB ILE 7 HB ILE 7 39.942 3.611 24.521 614 HG12 ILE 7 HG12 ILE 7 39.864 0.690 25.317 615 HG13 ILE 7 HG11 ILE 7 41.347 1.495 24.801 616 HG21 ILE 7 HG21 ILE 7 37.553 3.386 24.404 617 HG22 ILE 7 HG22 ILE 7 38.050 2.665 25.935 618 HG23 ILE 7 HG23 ILE 7 37.650 1.633 24.562 619 HD11 ILE 7 HD11 ILE 7 41.283 3.014 26.631 620 HD12 ILE 7 HD12 ILE 7 40.901 1.440 27.327 621 HD13 ILE 7 HD13 ILE 7 39.613 2.602 27.018 622 H LEU 8 HN LEU 8 39.969 4.436 21.835 623 HA LEU 8 HA LEU 8 37.268 5.199 21.395 624 HB2 LEU 8 HB2 LEU 8 39.932 6.193 20.525 625 HB3 LEU 8 HB1 LEU 8 38.538 6.704 19.572 626 HG LEU 8 HG LEU 8 39.134 8.230 21.516 627 HD11 LEU 8 HD11 LEU 8 36.861 8.710 21.978 628 HD12 LEU 8 HD12 LEU 8 36.378 7.023 21.828 629 HD13 LEU 8 HD13 LEU 8 36.818 7.946 20.391 630 HD21 LEU 8 HD21 LEU 8 37.872 6.062 23.214 631 HD22 LEU 8 HD22 LEU 8 38.703 7.518 23.747 632 HD23 LEU 8 HD23 LEU 8 39.621 6.196 23.029 633 H SER 9 HN SER 9 39.679 4.497 18.869 634 HA SER 9 HA SER 9 37.989 4.164 16.735 635 HB2 SER 9 HB2 SER 9 39.718 2.729 15.742 636 HB3 SER 9 HB1 SER 9 40.456 4.093 16.577 637 HG SER 9 HG SER 9 41.354 1.928 17.005 638 H ILE 10 HN ILE 10 38.634 1.911 19.359 639 HA ILE 10 HA ILE 10 37.352 -0.347 18.165 640 HB ILE 10 HB ILE 10 38.054 0.343 21.014 641 HG12 ILE 10 HG12 ILE 10 39.165 -1.821 19.220 642 HG13 ILE 10 HG11 ILE 10 39.830 -0.191 19.224 643 HG21 ILE 10 HG21 ILE 10 36.157 -1.116 21.166 644 HG22 ILE 10 HG22 ILE 10 37.585 -2.121 21.411 645 HG23 ILE 10 HG23 ILE 10 36.756 -2.131 19.855 646 HD11 ILE 10 HD11 ILE 10 39.829 -2.239 21.426 647 HD12 ILE 10 HD12 ILE 10 39.929 -0.532 21.832 648 HD13 ILE 10 HD13 ILE 10 41.164 -1.263 20.822 649 H CYS 11 HN CYS 11 36.297 2.091 20.528 650 HA CYS 11 HA CYS 11 33.703 1.080 20.951 651 HB2 CYS 11 HB2 CYS 11 34.825 3.882 21.134 652 HB3 CYS 11 HB1 CYS 11 33.180 3.467 21.619 653 HG CYS 11 HG CYS 11 34.403 3.040 23.784 654 H SER 12 HN SER 12 34.883 3.578 18.679 655 HA SER 12 HA SER 12 32.385 4.088 17.469 656 HB2 SER 12 HB2 SER 12 35.212 4.436 16.457 657 HB3 SER 12 HB1 SER 12 33.788 5.007 15.592 658 HG SER 12 HG SER 12 35.089 6.175 17.584 659 H PHE 13 HN PHE 13 34.822 1.626 16.953 660 HA PHE 13 HA PHE 13 34.047 0.743 14.397 661 HB2 PHE 13 HB2 PHE 13 36.131 0.020 15.462 662 HB3 PHE 13 HB1 PHE 13 35.218 -0.844 16.690 663 HD1 PHE 13 HD1 PHE 13 36.018 -0.724 13.077 664 HD2 PHE 13 HD2 PHE 13 34.212 -2.974 16.260 665 HE1 PHE 13 HE1 PHE 13 35.862 -2.702 11.591 666 HE2 PHE 13 HE2 PHE 13 34.057 -4.953 14.773 667 HZ PHE 13 HZ PHE 13 34.883 -4.818 12.438 668 H ILE 14 HN ILE 14 33.054 -0.392 17.633 669 HA ILE 14 HA ILE 14 31.184 -2.309 16.662 670 HB ILE 14 HB ILE 14 31.460 -0.929 19.331 671 HG12 ILE 14 HG12 ILE 14 32.023 -3.789 18.499 672 HG13 ILE 14 HG11 ILE 14 33.256 -2.527 18.533 673 HG21 ILE 14 HG21 ILE 14 29.605 -3.156 18.447 674 HG22 ILE 14 HG22 ILE 14 29.139 -1.585 19.098 675 HG23 ILE 14 HG23 ILE 14 29.933 -2.764 20.134 676 HD11 ILE 14 HD11 ILE 14 33.320 -3.776 20.633 677 HD12 ILE 14 HD12 ILE 14 31.600 -3.480 20.887 678 HD13 ILE 14 HD13 ILE 14 32.743 -2.138 20.942 679 H LEU 15 HN LEU 15 30.884 1.053 17.697 680 HA LEU 15 HA LEU 15 28.067 1.250 17.579 681 HB2 LEU 15 HB2 LEU 15 30.318 3.221 17.408 682 HB3 LEU 15 HB1 LEU 15 28.666 3.749 17.075 683 HG LEU 15 HG LEU 15 29.327 2.160 19.553 684 HD11 LEU 15 HD11 LEU 15 30.786 4.126 19.591 685 HD12 LEU 15 HD12 LEU 15 29.471 4.342 20.746 686 HD13 LEU 15 HD13 LEU 15 29.424 5.172 19.190 687 HD21 LEU 15 HD21 LEU 15 27.285 3.388 20.357 688 HD22 LEU 15 HD22 LEU 15 26.968 2.345 18.974 689 HD23 LEU 15 HD23 LEU 15 27.122 4.086 18.746 690 H SER 16 HN SER 16 30.395 2.528 15.196 691 HA SER 16 HA SER 16 28.732 3.152 13.136 692 HB2 SER 16 HB2 SER 16 31.135 3.528 13.004 693 HB3 SER 16 HB1 SER 16 31.431 1.793 12.944 694 HG SER 16 HG SER 16 31.222 2.033 10.871 695 H ALA 17 HN ALA 17 29.913 -0.079 14.033 696 HA ALA 17 HA ALA 17 28.933 -1.523 11.831 697 HB1 ALA 17 HB1 ALA 17 28.841 -2.600 14.643 698 HB2 ALA 17 HB2 ALA 17 30.383 -2.296 13.842 699 HB3 ALA 17 HB3 ALA 17 29.241 -3.446 13.147 700 H LEU 18 HN LEU 18 27.370 -1.084 15.021 701 HA LEU 18 HA LEU 18 24.866 -2.160 14.194 702 HB2 LEU 18 HB2 LEU 18 25.911 -0.702 16.561 703 HB3 LEU 18 HB1 LEU 18 24.170 -0.606 16.291 704 HG LEU 18 HG LEU 18 24.944 -2.554 17.731 705 HD11 LEU 18 HD11 LEU 18 23.578 -3.447 15.182 706 HD12 LEU 18 HD12 LEU 18 22.772 -2.409 16.356 707 HD13 LEU 18 HD13 LEU 18 23.305 -4.022 16.824 708 HD21 LEU 18 HD21 LEU 18 26.086 -4.379 16.728 709 HD22 LEU 18 HD22 LEU 18 26.963 -2.960 16.162 710 HD23 LEU 18 HD23 LEU 18 25.816 -3.771 15.098 711 H HIS 19 HN HIS 19 26.348 0.877 13.694 712 HA HIS 19 HA HIS 19 24.014 2.476 13.455 713 HB2 HIS 19 HB2 HIS 19 26.423 3.279 13.763 714 HB3 HIS 19 HB1 HIS 19 26.630 2.970 12.041 715 HD2 HIS 19 HD2 HIS 19 23.186 4.137 11.953 716 HE1 HIS 19 HE1 HIS 19 25.351 7.756 12.187 717 HE2 HIS 19 HE2 HIS 19 23.088 6.733 11.661 718 H PHE 20 HN PHE 20 26.075 0.809 11.086 719 HA PHE 20 HA PHE 20 24.420 1.561 8.860 720 HB2 PHE 20 HB2 PHE 20 26.981 0.378 9.240 721 HB3 PHE 20 HB1 PHE 20 26.022 -0.731 8.260 722 HD1 PHE 20 HD1 PHE 20 26.400 3.002 8.551 723 HD2 PHE 20 HD2 PHE 20 26.262 -0.431 5.971 724 HE1 PHE 20 HE1 PHE 20 26.705 4.471 6.580 725 HE2 PHE 20 HE2 PHE 20 26.567 1.041 3.999 726 HZ PHE 20 HZ PHE 20 26.794 3.490 4.304 727 H MET 21 HN MET 21 24.433 -1.002 11.185 728 HA MET 21 HA MET 21 22.968 -2.903 9.632 729 HB2 MET 21 HB2 MET 21 23.453 -2.564 12.594 730 HB3 MET 21 HB1 MET 21 22.482 -3.880 11.936 731 HG2 MET 21 HG2 MET 21 25.310 -3.301 11.036 732 HG3 MET 21 HG1 MET 21 24.915 -4.464 12.300 733 HE1 MET 21 HE1 MET 21 25.250 -5.146 7.987 734 HE2 MET 21 HE2 MET 21 26.053 -4.080 9.136 735 HE3 MET 21 HE3 MET 21 24.525 -3.589 8.411 736 H ALA 22 HN ALA 22 21.949 -0.900 12.393 737 HA ALA 22 HA ALA 22 19.182 -1.412 12.016 738 HB1 ALA 22 HB1 ALA 22 20.213 1.058 13.368 739 HB2 ALA 22 HB2 ALA 22 20.429 -0.527 14.109 740 HB3 ALA 22 HB3 ALA 22 18.806 0.078 13.776 741 H TRP 23 HN TRP 23 21.300 1.228 10.966 742 HA TRP 23 HA TRP 23 19.298 2.922 9.950 743 HB2 TRP 23 HB2 TRP 23 21.692 3.542 10.344 744 HB3 TRP 23 HB1 TRP 23 22.111 2.632 8.890 745 HD1 TRP 23 HD1 TRP 23 20.405 5.807 10.084 746 HE1 TRP 23 HE1 TRP 23 19.970 7.340 8.056 747 HE3 TRP 23 HE3 TRP 23 21.676 2.633 6.290 748 HZ2 TRP 23 HZ2 TRP 23 20.138 7.232 5.202 749 HZ3 TRP 23 HZ3 TRP 23 21.529 3.373 3.930 750 HH2 TRP 23 HH2 TRP 23 20.763 5.666 3.381 751 H THR 24 HN THR 24 21.121 0.271 8.469 752 HA THR 24 HA THR 24 20.123 0.614 5.839 753 HB THR 24 HB THR 24 21.263 -1.772 7.287 754 HG1 THR 24 HG1 THR 24 22.203 0.010 5.299 755 HG21 THR 24 HG21 THR 24 20.238 -1.499 4.462 756 HG22 THR 24 HG22 THR 24 19.890 -2.765 5.641 757 HG23 THR 24 HG23 THR 24 21.482 -2.672 4.889 758 H ILE 25 HN ILE 25 19.016 -1.312 8.597 759 HA ILE 25 HA ILE 25 16.939 -2.699 7.292 760 HB ILE 25 HB ILE 25 17.257 -1.817 10.166 761 HG12 ILE 25 HG12 ILE 25 17.476 -4.571 8.926 762 HG13 ILE 25 HG11 ILE 25 18.865 -3.499 9.107 763 HG21 ILE 25 HG21 ILE 25 15.143 -3.519 8.827 764 HG22 ILE 25 HG22 ILE 25 14.910 -2.123 9.880 765 HG23 ILE 25 HG23 ILE 25 15.499 -3.644 10.550 766 HD11 ILE 25 HD11 ILE 25 18.288 -3.339 11.571 767 HD12 ILE 25 HD12 ILE 25 18.832 -4.930 11.040 768 HD13 ILE 25 HD13 ILE 25 17.114 -4.629 11.306 769 H GLY 26 HN GLY 26 16.937 0.416 9.008 770 HA2 GLY 26 HA2 GLY 26 14.176 0.965 8.744 771 HA3 GLY 26 HA1 GLY 26 15.434 2.169 9.000 772 H HIS 27 HN HIS 27 16.965 1.819 6.692 773 HA HIS 27 HA HIS 27 15.652 3.417 4.827 774 HB2 HIS 27 HB2 HIS 27 18.042 3.293 4.778 775 HB3 HIS 27 HB1 HIS 27 18.008 1.545 4.536 776 HD2 HIS 27 HD2 HIS 27 18.263 0.895 1.875 777 HE1 HIS 27 HE1 HIS 27 16.750 4.470 0.217 778 HE2 HIS 27 HE2 HIS 27 17.753 2.202 -0.328 779 H LEU 28 HN LEU 28 16.089 -0.112 4.888 780 HA LEU 28 HA LEU 28 14.685 -0.545 2.438 781 HB2 LEU 28 HB2 LEU 28 15.862 -2.217 4.583 782 HB3 LEU 28 HB1 LEU 28 14.535 -2.949 3.680 783 HG LEU 28 HG LEU 28 16.836 -3.367 2.705 784 HD11 LEU 28 HD11 LEU 28 15.068 -1.769 0.840 785 HD12 LEU 28 HD12 LEU 28 14.611 -3.367 1.420 786 HD13 LEU 28 HD13 LEU 28 16.072 -3.160 0.457 787 HD21 LEU 28 HD21 LEU 28 16.672 -0.480 1.805 788 HD22 LEU 28 HD22 LEU 28 18.033 -1.588 1.674 789 HD23 LEU 28 HD23 LEU 28 17.567 -0.951 3.250 790 H ASN 29 HN ASN 29 12.580 -0.804 2.044 791 HA ASN 29 HA ASN 29 10.708 -0.242 4.172 792 HB2 ASN 29 HB2 ASN 29 10.271 -0.904 1.249 793 HB3 ASN 29 HB1 ASN 29 9.015 -0.374 2.367 794 HD21 ASN 29 HD21 ASN 29 10.539 0.911 -0.102 795 HD22 ASN 29 HD22 ASN 29 10.882 2.475 0.466 796 H GLN 30 HN GLN 30 9.255 -1.614 5.104 797 HA GLN 30 HA GLN 30 9.751 -4.480 4.715 798 HB2 GLN 30 HB2 GLN 30 8.524 -2.824 6.888 799 HB3 GLN 30 HB1 GLN 30 8.118 -4.536 6.768 800 HG2 GLN 30 HG2 GLN 30 10.014 -4.386 8.229 801 HG3 GLN 30 HG1 GLN 30 10.611 -5.006 6.690 802 HE21 GLN 30 HE21 GLN 30 12.760 -4.129 6.900 803 HE22 GLN 30 HE22 GLN 30 13.060 -2.460 6.883 804 H ILE 31 HN ILE 31 8.476 -5.589 3.389 805 HA ILE 31 HA ILE 31 5.697 -4.651 2.989 806 HB ILE 31 HB ILE 31 7.460 -6.199 1.071 807 HG12 ILE 31 HG12 ILE 31 6.473 -3.335 0.900 808 HG13 ILE 31 HG11 ILE 31 8.084 -3.777 1.465 809 HG21 ILE 31 HG21 ILE 31 4.736 -4.926 0.663 810 HG22 ILE 31 HG22 ILE 31 4.993 -6.651 0.921 811 HG23 ILE 31 HG23 ILE 31 5.645 -5.870 -0.517 812 HD11 ILE 31 HD11 ILE 31 6.911 -4.384 -1.263 813 HD12 ILE 31 HD12 ILE 31 8.480 -4.958 -0.697 814 HD13 ILE 31 HD13 ILE 31 8.196 -3.230 -0.908 815 H LYS 32 HN LYS 32 4.125 -5.988 3.608 816 HA LYS 32 HA LYS 32 4.843 -8.731 4.390 817 HB2 LYS 32 HB2 LYS 32 3.728 -7.366 6.092 818 HB3 LYS 32 HB1 LYS 32 2.376 -7.084 4.996 819 HG2 LYS 32 HG2 LYS 32 1.866 -9.473 4.950 820 HG3 LYS 32 HG1 LYS 32 3.272 -9.815 5.959 821 HD2 LYS 32 HD2 LYS 32 2.309 -8.502 7.795 822 HD3 LYS 32 HD1 LYS 32 0.924 -8.083 6.786 823 HE2 LYS 32 HE2 LYS 32 1.678 -10.945 7.412 824 HE3 LYS 32 HE1 LYS 32 0.548 -10.018 8.398 825 HZ1 LYS 32 HZ1 LYS 32 -0.000 -11.402 6.063 826 HZ2 LYS 32 HZ2 LYS 32 -0.117 -9.759 5.653 827 HZ3 LYS 32 HZ3 LYS 32 -1.047 -10.388 6.927 828 H ARG 33 HN ARG 33 4.579 -10.194 2.827 829 HA ARG 33 HA ARG 33 2.324 -9.879 0.950 830 HB2 ARG 33 HB2 ARG 33 4.755 -10.115 0.131 831 HB3 ARG 33 HB1 ARG 33 4.621 -11.802 0.628 832 HG2 ARG 33 HG2 ARG 33 2.754 -12.168 -0.859 833 HG3 ARG 33 HG1 ARG 33 2.657 -10.448 -1.237 834 HD2 ARG 33 HD2 ARG 33 3.800 -11.640 -3.043 835 HD3 ARG 33 HD1 ARG 33 4.919 -10.549 -2.230 836 HE ARG 33 HE ARG 33 5.040 -13.133 -1.050 837 HH11 ARG 33 HH11 ARG 33 5.914 -11.341 -3.900 838 HH12 ARG 33 HH12 ARG 33 7.277 -12.333 -4.257 839 HH21 ARG 33 HH21 ARG 33 6.839 -14.430 -1.534 840 HH22 ARG 33 HH22 ARG 33 7.805 -14.077 -2.928 841 H1 MET 1 HT1 MET 1 55.965 4.943 4.698 842 H2 MET 1 HT2 MET 1 56.746 5.909 5.854 843 H3 MET 1 HT3 MET 1 57.381 5.778 4.284 844 HA MET 1 HA MET 1 54.835 7.087 5.070 845 HB2 MET 1 HB2 MET 1 57.153 8.220 5.404 846 HB3 MET 1 HB1 MET 1 57.186 8.323 3.643 847 HG2 MET 1 HG2 MET 1 55.116 9.587 3.620 848 HG3 MET 1 HG1 MET 1 54.915 9.365 5.358 849 HE1 MET 1 HE1 MET 1 56.964 9.709 6.880 850 HE2 MET 1 HE2 MET 1 55.912 11.097 7.149 851 HE3 MET 1 HE3 MET 1 57.651 11.334 7.003 852 H PHE 2 HN PHE 2 54.785 4.866 3.368 853 HA PHE 2 HA PHE 2 54.789 5.906 0.634 854 HB2 PHE 2 HB2 PHE 2 54.458 3.162 1.831 855 HB3 PHE 2 HB1 PHE 2 54.088 3.480 0.137 856 HD1 PHE 2 HD1 PHE 2 56.647 2.587 2.413 857 HD2 PHE 2 HD2 PHE 2 55.946 4.827 -1.184 858 HE1 PHE 2 HE1 PHE 2 59.060 2.449 1.857 859 HE2 PHE 2 HE2 PHE 2 58.359 4.689 -1.740 860 HZ PHE 2 HZ PHE 2 59.915 3.499 -0.219 861 H GLU 3 HN GLU 3 52.567 4.773 3.120 862 HA GLU 3 HA GLU 3 50.276 4.870 1.419 863 HB2 GLU 3 HB2 GLU 3 48.993 4.435 3.453 864 HB3 GLU 3 HB1 GLU 3 50.403 3.387 3.399 865 HG2 GLU 3 HG2 GLU 3 51.617 4.945 4.875 866 HG3 GLU 3 HG1 GLU 3 50.204 5.995 4.936 867 HA PRO 4 HA PRO 4 49.032 9.092 1.607 868 HB2 PRO 4 HB2 PRO 4 46.424 8.208 2.757 869 HB3 PRO 4 HB1 PRO 4 46.750 9.163 1.299 870 HG2 PRO 4 HG2 PRO 4 45.999 6.617 1.144 871 HG3 PRO 4 HG1 PRO 4 47.179 7.308 0.015 872 HD2 PRO 4 HD2 PRO 4 47.633 5.476 2.322 873 HD3 PRO 4 HD1 PRO 4 48.482 5.576 0.765 874 H PHE 5 HN PHE 5 48.103 7.180 4.460 875 HA PHE 5 HA PHE 5 49.374 9.002 6.265 876 HB2 PHE 5 HB2 PHE 5 46.567 9.423 5.638 877 HB3 PHE 5 HB1 PHE 5 46.811 9.092 7.353 878 HD1 PHE 5 HD1 PHE 5 46.914 11.593 4.840 879 HD2 PHE 5 HD2 PHE 5 48.834 10.353 8.478 880 HE1 PHE 5 HE1 PHE 5 47.787 13.892 5.163 881 HE2 PHE 5 HE2 PHE 5 49.707 12.653 8.801 882 HZ PHE 5 HZ PHE 5 49.179 14.425 7.141 883 H GLN 6 HN GLN 6 46.454 6.982 6.561 884 HA GLN 6 HA GLN 6 47.967 4.895 7.914 885 HB2 GLN 6 HB2 GLN 6 46.292 6.856 9.329 886 HB3 GLN 6 HB1 GLN 6 45.925 5.173 9.709 887 HG2 GLN 6 HG2 GLN 6 48.189 4.737 10.366 888 HG3 GLN 6 HG1 GLN 6 48.739 6.283 9.725 889 HE21 GLN 6 HE21 GLN 6 49.496 6.166 12.231 890 HE22 GLN 6 HE22 GLN 6 48.436 6.943 13.305 891 H ILE 7 HN ILE 7 46.654 2.981 8.331 892 HA ILE 7 HA ILE 7 45.026 2.267 6.161 893 HB ILE 7 HB ILE 7 45.328 1.031 8.897 894 HG12 ILE 7 HG12 ILE 7 46.347 0.091 6.204 895 HG13 ILE 7 HG11 ILE 7 47.295 1.131 7.268 896 HG21 ILE 7 HG21 ILE 7 43.197 0.301 8.069 897 HG22 ILE 7 HG22 ILE 7 44.337 -1.001 7.725 898 HG23 ILE 7 HG23 ILE 7 43.831 0.093 6.437 899 HD11 ILE 7 HD11 ILE 7 47.372 -0.519 8.984 900 HD12 ILE 7 HD12 ILE 7 47.709 -1.389 7.488 901 HD13 ILE 7 HD13 ILE 7 46.108 -1.483 8.220 902 H LEU 8 HN LEU 8 44.275 3.625 9.283 903 HA LEU 8 HA LEU 8 41.462 3.114 9.250 904 HB2 LEU 8 HB2 LEU 8 43.307 4.903 10.757 905 HB3 LEU 8 HB1 LEU 8 41.599 5.350 10.752 906 HG LEU 8 HG LEU 8 42.304 3.814 12.649 907 HD11 LEU 8 HD11 LEU 8 40.254 2.626 12.591 908 HD12 LEU 8 HD12 LEU 8 40.264 2.512 10.834 909 HD13 LEU 8 HD13 LEU 8 39.941 4.059 11.616 910 HD21 LEU 8 HD21 LEU 8 42.322 1.669 10.511 911 HD22 LEU 8 HD22 LEU 8 42.834 1.541 12.191 912 HD23 LEU 8 HD23 LEU 8 43.809 2.454 11.042 913 H SER 9 HN SER 9 43.080 6.266 8.783 914 HA SER 9 HA SER 9 40.958 7.671 7.738 915 HB2 SER 9 HB2 SER 9 42.612 9.126 6.661 916 HB3 SER 9 HB1 SER 9 43.160 8.666 8.270 917 HG SER 9 HG SER 9 44.728 8.463 6.499 918 H ILE 10 HN ILE 10 43.013 5.310 6.146 919 HA ILE 10 HA ILE 10 42.129 5.856 3.484 920 HB ILE 10 HB ILE 10 43.460 3.465 4.752 921 HG12 ILE 10 HG12 ILE 10 44.533 5.404 2.697 922 HG13 ILE 10 HG11 ILE 10 44.656 5.727 4.423 923 HG21 ILE 10 HG21 ILE 10 42.219 2.589 2.899 924 HG22 ILE 10 HG22 ILE 10 43.878 2.796 2.337 925 HG23 ILE 10 HG23 ILE 10 42.639 3.968 1.885 926 HD11 ILE 10 HD11 ILE 10 45.946 3.540 2.811 927 HD12 ILE 10 HD12 ILE 10 45.667 3.301 4.530 928 HD13 ILE 10 HD13 ILE 10 46.678 4.628 3.986 929 H CYS 11 HN CYS 11 41.227 3.413 5.902 930 HA CYS 11 HA CYS 11 39.303 2.063 4.353 931 HB2 CYS 11 HB2 CYS 11 39.566 2.442 7.341 932 HB3 CYS 11 HB1 CYS 11 38.353 1.396 6.606 933 HG CYS 11 HG CYS 11 40.256 -0.240 6.820 934 H SER 12 HN SER 12 38.937 4.751 6.675 935 HA SER 12 HA SER 12 36.143 5.045 6.356 936 HB2 SER 12 HB2 SER 12 38.279 6.984 7.256 937 HB3 SER 12 HB1 SER 12 36.556 7.345 7.301 938 HG SER 12 HG SER 12 38.004 5.994 9.060 939 H PHE 13 HN PHE 13 38.894 6.227 4.544 940 HA PHE 13 HA PHE 13 37.644 8.307 3.116 941 HB2 PHE 13 HB2 PHE 13 40.071 7.992 3.115 942 HB3 PHE 13 HB1 PHE 13 39.887 6.476 2.245 943 HD1 PHE 13 HD1 PHE 13 39.425 10.141 2.012 944 HD2 PHE 13 HD2 PHE 13 39.462 6.407 -0.110 945 HE1 PHE 13 HE1 PHE 13 39.388 11.366 -0.144 946 HE2 PHE 13 HE2 PHE 13 39.425 7.632 -2.266 947 HZ PHE 13 HZ PHE 13 39.389 10.112 -2.283 948 H ILE 14 HN ILE 14 38.095 4.870 2.271 949 HA ILE 14 HA ILE 14 36.653 5.026 -0.181 950 HB ILE 14 HB ILE 14 37.344 2.698 1.614 951 HG12 ILE 14 HG12 ILE 14 38.420 3.508 -1.102 952 HG13 ILE 14 HG11 ILE 14 39.181 3.969 0.422 953 HG21 ILE 14 HG21 ILE 14 36.021 2.763 -1.112 954 HG22 ILE 14 HG22 ILE 14 35.368 2.068 0.370 955 HG23 ILE 14 HG23 ILE 14 36.752 1.317 -0.416 956 HD11 ILE 14 HD11 ILE 14 40.252 1.949 -0.454 957 HD12 ILE 14 HD12 ILE 14 38.688 1.138 -0.546 958 HD13 ILE 14 HD13 ILE 14 39.370 1.561 1.024 959 H LEU 15 HN LEU 15 35.741 4.156 3.122 960 HA LEU 15 HA LEU 15 33.097 3.291 2.557 961 HB2 LEU 15 HB2 LEU 15 34.502 4.336 4.994 962 HB3 LEU 15 HB1 LEU 15 32.753 4.103 5.032 963 HG LEU 15 HG LEU 15 34.600 1.929 4.051 964 HD11 LEU 15 HD11 LEU 15 35.351 2.497 6.310 965 HD12 LEU 15 HD12 LEU 15 34.463 0.974 6.349 966 HD13 LEU 15 HD13 LEU 15 33.688 2.461 6.896 967 HD21 LEU 15 HD21 LEU 15 32.653 0.532 4.817 968 HD22 LEU 15 HD22 LEU 15 32.237 1.661 3.529 969 HD23 LEU 15 HD23 LEU 15 31.790 2.023 5.195 970 H SER 16 HN SER 16 34.096 6.409 3.986 971 HA SER 16 HA SER 16 31.746 7.790 3.865 972 HB2 SER 16 HB2 SER 16 33.774 8.766 4.813 973 HB3 SER 16 HB1 SER 16 34.514 8.837 3.216 974 HG SER 16 HG SER 16 33.586 10.712 3.081 975 H ALA 17 HN ALA 17 34.035 7.168 1.218 976 HA ALA 17 HA ALA 17 32.878 8.811 -0.748 977 HB1 ALA 17 HB1 ALA 17 33.994 6.085 -1.373 978 HB2 ALA 17 HB2 ALA 17 35.048 7.380 -0.804 979 HB3 ALA 17 HB3 ALA 17 34.138 7.578 -2.301 980 H LEU 18 HN LEU 18 32.339 5.309 -0.225 981 HA LEU 18 HA LEU 18 30.135 5.158 -2.023 982 HB2 LEU 18 HB2 LEU 18 31.407 3.384 -0.009 983 HB3 LEU 18 HB1 LEU 18 29.718 3.042 -0.389 984 HG LEU 18 HG LEU 18 31.424 1.843 -1.845 985 HD11 LEU 18 HD11 LEU 18 29.644 3.715 -3.423 986 HD12 LEU 18 HD12 LEU 18 28.986 2.397 -2.457 987 HD13 LEU 18 HD13 LEU 18 30.077 2.050 -3.797 988 HD21 LEU 18 HD21 LEU 18 32.670 3.067 -3.454 989 HD22 LEU 18 HD22 LEU 18 32.878 3.985 -1.964 990 HD23 LEU 18 HD23 LEU 18 31.739 4.538 -3.191 991 H HIS 19 HN HIS 19 30.428 6.314 1.176 992 HA HIS 19 HA HIS 19 27.781 5.820 2.070 993 HB2 HIS 19 HB2 HIS 19 29.817 6.411 3.499 994 HB3 HIS 19 HB1 HIS 19 29.554 8.079 2.992 995 HD2 HIS 19 HD2 HIS 19 26.074 7.046 3.215 996 HE1 HIS 19 HE1 HIS 19 27.049 7.774 7.260 997 HE2 HIS 19 HE2 HIS 19 25.137 7.435 5.624 998 H PHE 20 HN PHE 20 29.374 8.651 0.628 999 HA PHE 20 HA PHE 20 26.955 10.207 0.597 1000 HB2 PHE 20 HB2 PHE 20 29.730 10.676 0.186 1001 HB3 PHE 20 HB1 PHE 20 28.880 11.200 -1.268 1002 HD1 PHE 20 HD1 PHE 20 28.224 11.263 2.437 1003 HD2 PHE 20 HD2 PHE 20 28.272 13.439 -1.266 1004 HE1 PHE 20 HE1 PHE 20 27.440 13.294 3.621 1005 HE2 PHE 20 HE2 PHE 20 27.488 15.471 -0.081 1006 HZ PHE 20 HZ PHE 20 27.065 15.389 2.357 1007 H MET 21 HN MET 21 28.453 7.888 -1.489 1008 HA MET 21 HA MET 21 27.192 8.731 -3.919 1009 HB2 MET 21 HB2 MET 21 28.466 6.144 -3.017 1010 HB3 MET 21 HB1 MET 21 27.763 6.346 -4.622 1011 HG2 MET 21 HG2 MET 21 29.867 8.202 -3.490 1012 HG3 MET 21 HG1 MET 21 30.246 6.814 -4.508 1013 HE1 MET 21 HE1 MET 21 29.382 10.930 -5.731 1014 HE2 MET 21 HE2 MET 21 30.157 10.193 -4.332 1015 HE3 MET 21 HE3 MET 21 28.406 10.371 -4.366 1016 H ALA 22 HN ALA 22 26.557 5.911 -1.833 1017 HA ALA 22 HA ALA 22 24.090 5.278 -3.085 1018 HB1 ALA 22 HB1 ALA 22 24.732 4.507 -0.260 1019 HB2 ALA 22 HB2 ALA 22 25.621 3.800 -1.608 1020 HB3 ALA 22 HB3 ALA 22 23.873 3.584 -1.491 1021 H TRP 23 HN TRP 23 24.904 7.137 -0.188 1022 HA TRP 23 HA TRP 23 22.281 7.498 0.769 1023 HB2 TRP 23 HB2 TRP 23 24.388 7.992 2.029 1024 HB3 TRP 23 HB1 TRP 23 24.571 9.447 1.047 1025 HD1 TRP 23 HD1 TRP 23 22.485 7.920 3.827 1026 HE1 TRP 23 HE1 TRP 23 21.006 9.756 4.870 1027 HE3 TRP 23 HE3 TRP 23 23.359 11.733 0.543 1028 HZ2 TRP 23 HZ2 TRP 23 20.288 12.481 4.378 1029 HZ3 TRP 23 HZ3 TRP 23 22.265 13.935 0.852 1030 HH2 TRP 23 HH2 TRP 23 20.733 14.314 2.764 1031 H THR 24 HN THR 24 24.228 9.348 -1.539 1032 HA THR 24 HA THR 24 22.404 11.496 -1.859 1033 HB THR 24 HB THR 24 24.582 10.394 -3.626 1034 HG1 THR 24 HG1 THR 24 24.285 12.669 -1.969 1035 HG21 THR 24 HG21 THR 24 22.688 12.703 -4.056 1036 HG22 THR 24 HG22 THR 24 23.115 11.408 -5.176 1037 HG23 THR 24 HG23 THR 24 24.290 12.667 -4.793 1038 H ILE 25 HN ILE 25 22.823 8.411 -3.556 1039 HA ILE 25 HA ILE 25 20.938 8.848 -5.608 1040 HB ILE 25 HB ILE 25 21.878 6.314 -4.255 1041 HG12 ILE 25 HG12 ILE 25 22.487 7.396 -7.016 1042 HG13 ILE 25 HG11 ILE 25 23.482 7.775 -5.609 1043 HG21 ILE 25 HG21 ILE 25 20.049 6.749 -6.627 1044 HG22 ILE 25 HG22 ILE 25 19.752 5.765 -5.194 1045 HG23 ILE 25 HG23 ILE 25 20.943 5.247 -6.388 1046 HD11 ILE 25 HD11 ILE 25 23.688 5.270 -5.224 1047 HD12 ILE 25 HD12 ILE 25 24.497 5.876 -6.670 1048 HD13 ILE 25 HD13 ILE 25 22.945 5.047 -6.809 1049 H GLY 26 HN GLY 26 20.581 7.418 -2.369 1050 HA2 GLY 26 HA2 GLY 26 17.845 6.741 -2.581 1051 HA3 GLY 26 HA1 GLY 26 18.719 7.008 -1.075 1052 H HIS 27 HN HIS 27 19.472 9.678 -1.393 1053 HA HIS 27 HA HIS 27 17.230 11.063 -0.472 1054 HB2 HIS 27 HB2 HIS 27 19.408 11.927 0.016 1055 HB3 HIS 27 HB1 HIS 27 19.813 12.044 -1.697 1056 HD2 HIS 27 HD2 HIS 27 19.388 14.586 -2.662 1057 HE1 HIS 27 HE1 HIS 27 16.462 15.821 0.122 1058 HE2 HIS 27 HE2 HIS 27 17.853 16.548 -1.875 1059 H LEU 28 HN LEU 28 18.665 10.941 -3.723 1060 HA LEU 28 HA LEU 28 16.756 12.739 -4.862 1061 HB2 LEU 28 HB2 LEU 28 18.983 11.043 -5.834 1062 HB3 LEU 28 HB1 LEU 28 17.712 11.384 -7.008 1063 HG LEU 28 HG LEU 28 19.602 13.071 -6.973 1064 HD11 LEU 28 HD11 LEU 28 16.950 14.294 -6.177 1065 HD12 LEU 28 HD12 LEU 28 17.188 13.505 -7.734 1066 HD13 LEU 28 HD13 LEU 28 18.140 14.926 -7.308 1067 HD21 LEU 28 HD21 LEU 28 18.333 14.022 -4.392 1068 HD22 LEU 28 HD22 LEU 28 19.841 14.554 -5.127 1069 HD23 LEU 28 HD23 LEU 28 19.735 12.953 -4.397 1070 H ASN 29 HN ASN 29 14.804 12.367 -5.704 1071 HA ASN 29 HA ASN 29 13.622 9.760 -5.318 1072 HB2 ASN 29 HB2 ASN 29 12.497 12.311 -6.503 1073 HB3 ASN 29 HB1 ASN 29 11.560 10.862 -6.147 1074 HD21 ASN 29 HD21 ASN 29 11.769 13.767 -4.903 1075 HD22 ASN 29 HD22 ASN 29 11.811 13.442 -3.238 1076 H GLN 30 HN GLN 30 12.985 8.308 -6.859 1077 HA GLN 30 HA GLN 30 14.153 8.687 -9.529 1078 HB2 GLN 30 HB2 GLN 30 13.256 6.321 -7.920 1079 HB3 GLN 30 HB1 GLN 30 13.337 6.188 -9.677 1080 HG2 GLN 30 HG2 GLN 30 15.474 5.488 -8.851 1081 HG3 GLN 30 HG1 GLN 30 15.703 7.104 -9.518 1082 HE21 GLN 30 HE21 GLN 30 17.462 7.698 -8.110 1083 HE22 GLN 30 HE22 GLN 30 17.252 7.902 -6.439 1084 H ILE 31 HN ILE 31 12.907 9.407 -11.119 1085 HA ILE 31 HA ILE 31 9.998 8.879 -10.990 1086 HB ILE 31 HB ILE 31 11.438 11.196 -12.314 1087 HG12 ILE 31 HG12 ILE 31 9.656 11.185 -9.856 1088 HG13 ILE 31 HG11 ILE 31 11.418 11.179 -9.778 1089 HG21 ILE 31 HG21 ILE 31 8.479 10.712 -11.851 1090 HG22 ILE 31 HG22 ILE 31 9.293 10.460 -13.394 1091 HG23 ILE 31 HG23 ILE 31 9.202 12.076 -12.703 1092 HD11 ILE 31 HD11 ILE 31 9.690 13.302 -11.081 1093 HD12 ILE 31 HD12 ILE 31 11.452 13.272 -11.132 1094 HD13 ILE 31 HD13 ILE 31 10.620 13.475 -9.591 1095 H LYS 32 HN LYS 32 9.163 7.678 -12.570 1096 HA LYS 32 HA LYS 32 10.855 7.036 -14.887 1097 HB2 LYS 32 HB2 LYS 32 9.986 5.136 -13.606 1098 HB3 LYS 32 HB1 LYS 32 8.337 5.712 -13.851 1099 HG2 LYS 32 HG2 LYS 32 8.559 5.437 -16.268 1100 HG3 LYS 32 HG1 LYS 32 10.246 4.959 -16.080 1101 HD2 LYS 32 HD2 LYS 32 9.574 2.984 -14.791 1102 HD3 LYS 32 HD1 LYS 32 7.884 3.474 -14.896 1103 HE2 LYS 32 HE2 LYS 32 9.597 2.974 -17.340 1104 HE3 LYS 32 HE1 LYS 32 8.604 1.722 -16.593 1105 HZ1 LYS 32 HZ1 LYS 32 7.799 3.650 -18.413 1106 HZ2 LYS 32 HZ2 LYS 32 7.080 4.086 -16.939 1107 HZ3 LYS 32 HZ3 LYS 32 6.820 2.540 -17.590 1108 H ARG 33 HN ARG 33 10.555 8.359 -16.566 1109 HA ARG 33 HA ARG 33 7.836 9.345 -17.140 1110 HB2 ARG 33 HB2 ARG 33 9.850 10.930 -16.886 1111 HB3 ARG 33 HB1 ARG 33 10.364 10.312 -18.456 1112 HG2 ARG 33 HG2 ARG 33 8.315 11.045 -19.500 1113 HG3 ARG 33 HG1 ARG 33 7.612 11.465 -17.937 1114 HD2 ARG 33 HD2 ARG 33 8.422 13.481 -19.067 1115 HD3 ARG 33 HD1 ARG 33 9.366 13.172 -17.612 1116 HE ARG 33 HE ARG 33 10.608 11.954 -19.862 1117 HH11 ARG 33 HH11 ARG 33 9.971 15.035 -18.374 1118 HH12 ARG 33 HH12 ARG 33 11.379 15.782 -19.027 1119 HH21 ARG 33 HH21 ARG 33 12.460 12.955 -20.713 1120 HH22 ARG 33 HH22 ARG 33 12.789 14.616 -20.348 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 52.744 26.824 7.520 2 H2 MET 1 HT2 MET 1 52.059 25.275 7.603 3 H3 MET 1 HT3 MET 1 53.747 25.466 7.639 4 HA MET 1 HA MET 1 52.771 24.975 9.841 5 HB2 MET 1 HB2 MET 1 53.889 27.014 10.953 6 HB3 MET 1 HB1 MET 1 54.893 26.023 9.894 7 HG2 MET 1 HG2 MET 1 54.607 27.587 8.061 8 HG3 MET 1 HG1 MET 1 53.445 28.528 8.995 9 HE1 MET 1 HE1 MET 1 55.279 30.755 11.205 10 HE2 MET 1 HE2 MET 1 54.257 29.382 11.625 11 HE3 MET 1 HE3 MET 1 53.862 30.367 10.219 12 H PHE 2 HN PHE 2 51.662 27.931 8.269 13 HA PHE 2 HA PHE 2 50.136 29.029 10.337 14 HB2 PHE 2 HB2 PHE 2 49.415 30.481 8.744 15 HB3 PHE 2 HB1 PHE 2 50.635 29.700 7.738 16 HD1 PHE 2 HD1 PHE 2 47.069 30.116 8.382 17 HD2 PHE 2 HD2 PHE 2 49.982 27.873 6.158 18 HE1 PHE 2 HE1 PHE 2 45.285 29.305 6.864 19 HE2 PHE 2 HE2 PHE 2 48.194 27.062 4.639 20 HZ PHE 2 HZ PHE 2 45.847 27.778 4.993 21 H GLU 3 HN GLU 3 49.664 26.151 8.498 22 HA GLU 3 HA GLU 3 46.896 25.920 8.476 23 HB2 GLU 3 HB2 GLU 3 49.012 23.787 8.780 24 HB3 GLU 3 HB1 GLU 3 47.308 23.449 8.479 25 HG2 GLU 3 HG2 GLU 3 47.406 24.791 6.412 26 HG3 GLU 3 HG1 GLU 3 49.115 25.111 6.705 27 HA PRO 4 HA PRO 4 45.920 25.425 12.780 28 HB2 PRO 4 HB2 PRO 4 43.479 24.222 12.580 29 HB3 PRO 4 HB1 PRO 4 43.747 25.931 12.191 30 HG2 PRO 4 HG2 PRO 4 43.428 23.606 10.378 31 HG3 PRO 4 HG1 PRO 4 42.892 25.281 10.180 32 HD2 PRO 4 HD2 PRO 4 45.144 24.199 8.969 33 HD3 PRO 4 HD1 PRO 4 44.873 25.934 9.234 34 H PHE 5 HN PHE 5 44.998 22.541 10.886 35 HA PHE 5 HA PHE 5 46.395 20.869 12.876 36 HB2 PHE 5 HB2 PHE 5 43.573 20.675 11.919 37 HB3 PHE 5 HB1 PHE 5 44.456 19.175 12.204 38 HD1 PHE 5 HD1 PHE 5 42.956 22.137 13.740 39 HD2 PHE 5 HD2 PHE 5 45.363 18.652 14.447 40 HE1 PHE 5 HE1 PHE 5 42.598 22.385 16.181 41 HE2 PHE 5 HE2 PHE 5 45.006 18.898 16.888 42 HZ PHE 5 HZ PHE 5 43.621 20.764 17.755 43 H GLN 6 HN GLN 6 44.515 19.925 10.034 44 HA GLN 6 HA GLN 6 46.895 19.473 8.437 45 HB2 GLN 6 HB2 GLN 6 45.278 17.231 9.627 46 HB3 GLN 6 HB1 GLN 6 46.148 17.020 8.107 47 HG2 GLN 6 HG2 GLN 6 48.225 17.851 9.292 48 HG3 GLN 6 HG1 GLN 6 47.314 17.763 10.800 49 HE21 GLN 6 HE21 GLN 6 49.439 16.000 8.929 50 HE22 GLN 6 HE22 GLN 6 49.018 14.438 9.442 51 H ILE 7 HN ILE 7 46.347 18.707 6.264 52 HA ILE 7 HA ILE 7 44.268 20.158 5.098 53 HB ILE 7 HB ILE 7 44.721 18.861 3.070 54 HG12 ILE 7 HG12 ILE 7 46.347 17.069 4.911 55 HG13 ILE 7 HG11 ILE 7 44.835 16.624 4.122 56 HG21 ILE 7 HG21 ILE 7 46.368 20.591 3.978 57 HG22 ILE 7 HG22 ILE 7 47.027 19.430 2.826 58 HG23 ILE 7 HG23 ILE 7 47.332 19.231 4.551 59 HD11 ILE 7 HD11 ILE 7 47.507 17.180 2.836 60 HD12 ILE 7 HD12 ILE 7 46.008 17.202 1.906 61 HD13 ILE 7 HD13 ILE 7 46.520 15.724 2.719 62 H LEU 8 HN LEU 8 44.340 16.909 6.392 63 HA LEU 8 HA LEU 8 41.836 16.065 5.301 64 HB2 LEU 8 HB2 LEU 8 43.619 14.501 6.100 65 HB3 LEU 8 HB1 LEU 8 43.263 15.001 7.753 66 HG LEU 8 HG LEU 8 40.859 14.321 7.335 67 HD11 LEU 8 HD11 LEU 8 40.738 14.324 4.946 68 HD12 LEU 8 HD12 LEU 8 40.620 12.633 5.430 69 HD13 LEU 8 HD13 LEU 8 42.143 13.268 4.805 70 HD21 LEU 8 HD21 LEU 8 43.044 12.226 7.114 71 HD22 LEU 8 HD22 LEU 8 41.363 11.867 7.510 72 HD23 LEU 8 HD23 LEU 8 42.333 12.857 8.600 73 H SER 9 HN SER 9 42.851 17.691 8.208 74 HA SER 9 HA SER 9 40.349 17.472 9.603 75 HB2 SER 9 HB2 SER 9 42.699 19.332 9.980 76 HB3 SER 9 HB1 SER 9 41.299 19.289 11.045 77 HG SER 9 HG SER 9 43.432 17.629 10.921 78 H ILE 10 HN ILE 10 41.867 19.947 7.567 79 HA ILE 10 HA ILE 10 39.849 21.913 7.883 80 HB ILE 10 HB ILE 10 41.848 21.433 5.664 81 HG12 ILE 10 HG12 ILE 10 41.792 23.572 7.807 82 HG13 ILE 10 HG11 ILE 10 42.625 22.032 8.027 83 HG21 ILE 10 HG21 ILE 10 40.017 22.704 4.728 84 HG22 ILE 10 HG22 ILE 10 41.321 23.836 5.083 85 HG23 ILE 10 HG23 ILE 10 39.930 23.727 6.162 86 HD11 ILE 10 HD11 ILE 10 44.051 22.466 6.112 87 HD12 ILE 10 HD12 ILE 10 44.121 23.864 7.182 88 HD13 ILE 10 HD13 ILE 10 43.143 23.926 5.717 89 H CYS 11 HN CYS 11 40.356 19.382 5.435 90 HA CYS 11 HA CYS 11 38.201 20.038 3.759 91 HB2 CYS 11 HB2 CYS 11 39.541 17.394 4.355 92 HB3 CYS 11 HB1 CYS 11 38.319 17.599 3.101 93 HG CYS 11 HG CYS 11 39.938 18.916 1.695 94 H SER 12 HN SER 12 38.366 17.668 6.442 95 HA SER 12 HA SER 12 35.680 16.887 6.326 96 HB2 SER 12 HB2 SER 12 37.559 17.004 8.690 97 HB3 SER 12 HB1 SER 12 36.003 16.179 8.687 98 HG SER 12 HG SER 12 38.394 15.533 7.415 99 H PHE 13 HN PHE 13 37.245 19.574 8.010 100 HA PHE 13 HA PHE 13 35.157 20.408 9.652 101 HB2 PHE 13 HB2 PHE 13 37.663 21.347 9.025 102 HB3 PHE 13 HB1 PHE 13 36.612 22.604 8.379 103 HD1 PHE 13 HD1 PHE 13 37.567 20.737 11.419 104 HD2 PHE 13 HD2 PHE 13 35.256 23.984 9.825 105 HE1 PHE 13 HE1 PHE 13 37.175 21.582 13.716 106 HE2 PHE 13 HE2 PHE 13 34.861 24.833 12.122 107 HZ PHE 13 HZ PHE 13 35.822 23.631 14.068 108 H ILE 14 HN ILE 14 35.935 21.669 6.389 109 HA ILE 14 HA ILE 14 33.605 23.257 6.174 110 HB ILE 14 HB ILE 14 34.153 23.277 3.726 111 HG12 ILE 14 HG12 ILE 14 36.409 21.425 4.591 112 HG13 ILE 14 HG11 ILE 14 35.050 20.961 3.582 113 HG21 ILE 14 HG21 ILE 14 35.220 24.777 5.466 114 HG22 ILE 14 HG22 ILE 14 36.179 24.536 4.006 115 HG23 ILE 14 HG23 ILE 14 36.587 23.663 5.483 116 HD11 ILE 14 HD11 ILE 14 35.735 22.761 1.959 117 HD12 ILE 14 HD12 ILE 14 36.889 21.438 2.116 118 HD13 ILE 14 HD13 ILE 14 37.198 22.976 2.921 119 H LEU 15 HN LEU 15 34.315 19.938 5.146 120 HA LEU 15 HA LEU 15 31.930 19.494 3.699 121 HB2 LEU 15 HB2 LEU 15 33.824 17.605 5.120 122 HB3 LEU 15 HB1 LEU 15 32.491 17.064 4.098 123 HG LEU 15 HG LEU 15 34.583 19.005 3.098 124 HD11 LEU 15 HD11 LEU 15 35.872 17.200 2.229 125 HD12 LEU 15 HD12 LEU 15 34.617 16.021 2.611 126 HD13 LEU 15 HD13 LEU 15 35.548 16.768 3.908 127 HD21 LEU 15 HD21 LEU 15 32.521 18.889 1.793 128 HD22 LEU 15 HD22 LEU 15 32.615 17.129 1.753 129 HD23 LEU 15 HD23 LEU 15 33.816 18.098 0.898 130 H SER 16 HN SER 16 32.692 19.448 7.079 131 HA SER 16 HA SER 16 30.372 17.982 7.913 132 HB2 SER 16 HB2 SER 16 32.254 19.783 9.438 133 HB3 SER 16 HB1 SER 16 30.996 18.793 10.171 134 HG SER 16 HG SER 16 32.033 16.968 9.415 135 H ALA 17 HN ALA 17 31.282 21.418 7.801 136 HA ALA 17 HA ALA 17 28.962 22.463 8.971 137 HB1 ALA 17 HB1 ALA 17 29.518 24.530 7.594 138 HB2 ALA 17 HB2 ALA 17 30.835 23.597 6.881 139 HB3 ALA 17 HB3 ALA 17 30.824 23.927 8.613 140 H LEU 18 HN LEU 18 29.692 21.732 5.556 141 HA LEU 18 HA LEU 18 27.125 22.574 4.626 142 HB2 LEU 18 HB2 LEU 18 29.181 22.494 3.211 143 HB3 LEU 18 HB1 LEU 18 29.099 20.733 3.268 144 HG LEU 18 HG LEU 18 26.749 20.904 2.354 145 HD11 LEU 18 HD11 LEU 18 27.595 23.801 2.120 146 HD12 LEU 18 HD12 LEU 18 26.140 23.156 2.880 147 HD13 LEU 18 HD13 LEU 18 26.312 23.109 1.127 148 HD21 LEU 18 HD21 LEU 18 27.494 21.170 0.079 149 HD22 LEU 18 HD22 LEU 18 28.822 20.446 0.984 150 HD23 LEU 18 HD23 LEU 18 28.860 22.164 0.587 151 H HIS 19 HN HIS 19 28.449 19.651 5.910 152 HA HIS 19 HA HIS 19 26.564 17.798 4.887 153 HB2 HIS 19 HB2 HIS 19 28.495 16.835 5.802 154 HB3 HIS 19 HB1 HIS 19 28.381 17.783 7.283 155 HD2 HIS 19 HD2 HIS 19 26.682 16.717 9.251 156 HE1 HIS 19 HE1 HIS 19 25.488 13.301 7.077 157 HE2 HIS 19 HE2 HIS 19 25.411 14.438 9.347 158 H PHE 20 HN PHE 20 26.701 19.485 8.016 159 HA PHE 20 HA PHE 20 24.120 18.509 8.820 160 HB2 PHE 20 HB2 PHE 20 26.310 19.787 10.064 161 HB3 PHE 20 HB1 PHE 20 24.927 20.863 10.259 162 HD1 PHE 20 HD1 PHE 20 26.364 17.602 11.105 163 HD2 PHE 20 HD2 PHE 20 22.869 20.084 11.391 164 HE1 PHE 20 HE1 PHE 20 25.458 16.121 12.875 165 HE2 PHE 20 HE2 PHE 20 21.963 18.602 13.162 166 HZ PHE 20 HZ PHE 20 23.261 16.623 13.905 167 H MET 21 HN MET 21 25.303 21.233 7.013 168 HA MET 21 HA MET 21 23.060 22.945 7.445 169 HB2 MET 21 HB2 MET 21 25.380 22.826 5.607 170 HB3 MET 21 HB1 MET 21 24.001 23.798 5.099 171 HG2 MET 21 HG2 MET 21 24.056 25.000 7.258 172 HG3 MET 21 HG1 MET 21 25.445 24.035 7.757 173 HE1 MET 21 HE1 MET 21 26.649 26.231 8.307 174 HE2 MET 21 HE2 MET 21 25.340 27.243 7.699 175 HE3 MET 21 HE3 MET 21 26.993 27.536 7.164 176 H ALA 22 HN ALA 22 24.021 21.039 4.584 177 HA ALA 22 HA ALA 22 21.567 21.380 3.221 178 HB1 ALA 22 HB1 ALA 22 23.887 19.515 2.915 179 HB2 ALA 22 HB2 ALA 22 23.306 20.766 1.815 180 HB3 ALA 22 HB3 ALA 22 22.418 19.252 1.974 181 H TRP 23 HN TRP 23 22.742 18.864 5.404 182 HA TRP 23 HA TRP 23 20.582 17.064 5.026 183 HB2 TRP 23 HB2 TRP 23 22.784 16.498 6.073 184 HB3 TRP 23 HB1 TRP 23 22.281 17.405 7.500 185 HD1 TRP 23 HD1 TRP 23 20.462 14.802 5.275 186 HE1 TRP 23 HE1 TRP 23 19.399 13.037 6.824 187 HE3 TRP 23 HE3 TRP 23 21.996 16.572 9.814 188 HZ2 TRP 23 HZ2 TRP 23 19.221 12.454 9.620 189 HZ3 TRP 23 HZ3 TRP 23 21.364 15.395 11.901 190 HH2 TRP 23 HH2 TRP 23 19.981 13.342 11.810 191 H THR 24 HN THR 24 21.131 19.719 7.330 192 HA THR 24 HA THR 24 18.839 19.259 8.933 193 HB THR 24 HB THR 24 20.497 21.716 8.401 194 HG1 THR 24 HG1 THR 24 21.281 19.864 9.635 195 HG21 THR 24 HG21 THR 24 18.340 22.577 8.960 196 HG22 THR 24 HG22 THR 24 19.287 22.623 10.446 197 HG23 THR 24 HG23 THR 24 18.096 21.346 10.199 198 H ILE 25 HN ILE 25 19.365 21.542 6.236 199 HA ILE 25 HA ILE 25 16.773 22.617 6.237 200 HB ILE 25 HB ILE 25 17.252 23.288 3.901 201 HG12 ILE 25 HG12 ILE 25 19.766 21.624 4.269 202 HG13 ILE 25 HG11 ILE 25 18.425 21.191 3.220 203 HG21 ILE 25 HG21 ILE 25 19.626 23.562 5.769 204 HG22 ILE 25 HG22 ILE 25 18.174 24.558 5.828 205 HG23 ILE 25 HG23 ILE 25 19.239 24.632 4.424 206 HD11 ILE 25 HD11 ILE 25 20.029 22.213 1.804 207 HD12 ILE 25 HD12 ILE 25 20.292 23.535 2.940 208 HD13 ILE 25 HD13 ILE 25 18.772 23.423 2.054 209 H GLY 26 HN GLY 26 18.088 19.754 4.574 210 HA2 GLY 26 HA2 GLY 26 15.780 19.160 3.058 211 HA3 GLY 26 HA1 GLY 26 17.037 18.011 3.505 212 H HIS 27 HN HIS 27 16.837 18.116 6.276 213 HA HIS 27 HA HIS 27 14.797 16.273 6.797 214 HB2 HIS 27 HB2 HIS 27 16.671 16.330 8.264 215 HB3 HIS 27 HB1 HIS 27 16.430 18.041 8.618 216 HD2 HIS 27 HD2 HIS 27 14.743 18.531 10.761 217 HE1 HIS 27 HE1 HIS 27 13.198 14.623 11.182 218 HE2 HIS 27 HE2 HIS 27 13.234 16.952 12.194 219 H LEU 28 HN LEU 28 14.949 19.772 7.372 220 HA LEU 28 HA LEU 28 12.514 20.049 8.740 221 HB2 LEU 28 HB2 LEU 28 13.936 21.984 6.898 222 HB3 LEU 28 HB1 LEU 28 12.608 22.414 7.976 223 HG LEU 28 HG LEU 28 15.172 21.126 8.936 224 HD11 LEU 28 HD11 LEU 28 15.593 23.361 7.917 225 HD12 LEU 28 HD12 LEU 28 15.866 23.356 9.659 226 HD13 LEU 28 HD13 LEU 28 14.387 24.055 9.001 227 HD21 LEU 28 HD21 LEU 28 13.393 20.789 10.497 228 HD22 LEU 28 HD22 LEU 28 12.799 22.436 10.279 229 HD23 LEU 28 HD23 LEU 28 14.325 22.152 11.117 230 H ASN 29 HN ASN 29 10.427 20.337 8.091 231 HA ASN 29 HA ASN 29 9.834 19.669 5.288 232 HB2 ASN 29 HB2 ASN 29 8.843 18.294 7.147 233 HB3 ASN 29 HB1 ASN 29 7.937 19.723 7.641 234 HD21 ASN 29 HD21 ASN 29 5.817 19.122 7.009 235 HD22 ASN 29 HD22 ASN 29 5.393 18.723 5.415 236 H GLN 30 HN GLN 30 9.404 21.310 3.971 237 HA GLN 30 HA GLN 30 8.065 23.698 5.095 238 HB2 GLN 30 HB2 GLN 30 10.032 23.507 2.803 239 HB3 GLN 30 HB1 GLN 30 9.168 24.974 3.267 240 HG2 GLN 30 HG2 GLN 30 10.153 24.720 5.577 241 HG3 GLN 30 HG1 GLN 30 11.150 23.413 4.942 242 HE21 GLN 30 HE21 GLN 30 13.175 24.559 5.153 243 HE22 GLN 30 HE22 GLN 30 13.541 25.920 4.206 244 H ILE 31 HN ILE 31 6.104 24.116 4.329 245 HA ILE 31 HA ILE 31 5.374 23.120 1.648 246 HB ILE 31 HB ILE 31 3.676 22.937 4.148 247 HG12 ILE 31 HG12 ILE 31 4.719 20.719 2.369 248 HG13 ILE 31 HG11 ILE 31 5.571 21.252 3.818 249 HG21 ILE 31 HG21 ILE 31 2.139 21.695 2.558 250 HG22 ILE 31 HG22 ILE 31 3.138 22.298 1.236 251 HG23 ILE 31 HG23 ILE 31 2.260 23.430 2.263 252 HD11 ILE 31 HD11 ILE 31 3.799 20.579 5.243 253 HD12 ILE 31 HD12 ILE 31 3.951 19.263 4.079 254 HD13 ILE 31 HD13 ILE 31 2.658 20.449 3.903 255 H LYS 32 HN LYS 32 4.366 24.583 0.391 256 HA LYS 32 HA LYS 32 3.999 27.267 1.404 257 HB2 LYS 32 HB2 LYS 32 3.467 26.052 -1.317 258 HB3 LYS 32 HB1 LYS 32 3.330 27.770 -0.941 259 HG2 LYS 32 HG2 LYS 32 5.729 27.717 -0.174 260 HG3 LYS 32 HG1 LYS 32 5.828 26.063 -0.779 261 HD2 LYS 32 HD2 LYS 32 5.188 26.857 -3.034 262 HD3 LYS 32 HD1 LYS 32 5.128 28.511 -2.426 263 HE2 LYS 32 HE2 LYS 32 7.283 28.290 -3.414 264 HE3 LYS 32 HE1 LYS 32 7.553 28.163 -1.676 265 HZ1 LYS 32 HZ1 LYS 32 7.151 25.630 -2.212 266 HZ2 LYS 32 HZ2 LYS 32 8.686 26.342 -2.365 267 HZ3 LYS 32 HZ3 LYS 32 7.716 26.102 -3.739 268 H ARG 33 HN ARG 33 2.279 27.477 2.736 269 HA ARG 33 HA ARG 33 -0.305 26.327 1.920 270 HB2 ARG 33 HB2 ARG 33 -1.023 26.787 4.206 271 HB3 ARG 33 HB1 ARG 33 0.487 25.875 4.223 272 HG2 ARG 33 HG2 ARG 33 1.743 27.995 4.511 273 HG3 ARG 33 HG1 ARG 33 0.217 28.878 4.559 274 HD2 ARG 33 HD2 ARG 33 0.935 26.638 6.463 275 HD3 ARG 33 HD1 ARG 33 1.163 28.344 6.829 276 HE ARG 33 HE ARG 33 -1.503 28.003 6.049 277 HH11 ARG 33 HH11 ARG 33 0.661 26.979 8.587 278 HH12 ARG 33 HH12 ARG 33 -0.594 26.841 9.767 279 HH21 ARG 33 HH21 ARG 33 -3.124 27.814 7.616 280 HH22 ARG 33 HH22 ARG 33 -2.722 27.310 9.223 281 H1 MET 1 HT1 MET 1 44.674 21.117 32.418 282 H2 MET 1 HT2 MET 1 44.527 20.853 30.748 283 H3 MET 1 HT3 MET 1 45.992 21.415 31.399 284 HA MET 1 HA MET 1 46.035 19.029 30.806 285 HB2 MET 1 HB2 MET 1 46.852 18.314 33.144 286 HB3 MET 1 HB1 MET 1 47.655 19.696 32.397 287 HG2 MET 1 HG2 MET 1 46.317 21.248 33.696 288 HG3 MET 1 HG1 MET 1 45.343 19.929 34.342 289 HE1 MET 1 HE1 MET 1 47.134 18.433 37.129 290 HE2 MET 1 HE2 MET 1 46.751 17.731 35.559 291 HE3 MET 1 HE3 MET 1 45.629 18.867 36.304 292 H PHE 2 HN PHE 2 43.663 19.990 33.234 293 HA PHE 2 HA PHE 2 42.720 17.475 34.005 294 HB2 PHE 2 HB2 PHE 2 41.108 18.651 35.093 295 HB3 PHE 2 HB1 PHE 2 42.062 20.053 34.613 296 HD1 PHE 2 HD1 PHE 2 38.989 18.167 34.073 297 HD2 PHE 2 HD2 PHE 2 41.435 21.366 32.577 298 HE1 PHE 2 HE1 PHE 2 37.089 18.977 32.704 299 HE2 PHE 2 HE2 PHE 2 39.531 22.177 31.206 300 HZ PHE 2 HZ PHE 2 37.359 20.982 31.269 301 H GLU 3 HN GLU 3 42.458 19.129 30.991 302 HA GLU 3 HA GLU 3 40.041 18.173 30.009 303 HB2 GLU 3 HB2 GLU 3 42.638 18.722 28.566 304 HB3 GLU 3 HB1 GLU 3 41.105 18.406 27.752 305 HG2 GLU 3 HG2 GLU 3 40.088 20.322 28.926 306 HG3 GLU 3 HG1 GLU 3 41.626 20.647 29.723 307 HA PRO 4 HA PRO 4 40.826 13.826 29.550 308 HB2 PRO 4 HB2 PRO 4 38.912 13.186 27.717 309 HB3 PRO 4 HB1 PRO 4 38.537 13.584 29.404 310 HG2 PRO 4 HG2 PRO 4 38.259 15.246 26.964 311 HG3 PRO 4 HG1 PRO 4 37.247 15.181 28.414 312 HD2 PRO 4 HD2 PRO 4 39.139 17.149 27.897 313 HD3 PRO 4 HD1 PRO 4 38.502 16.751 29.508 314 H PHE 5 HN PHE 5 40.144 15.377 26.406 315 HA PHE 5 HA PHE 5 42.557 14.076 25.316 316 HB2 PHE 5 HB2 PHE 5 39.752 13.972 24.293 317 HB3 PHE 5 HB1 PHE 5 41.062 14.075 23.115 318 HD1 PHE 5 HD1 PHE 5 39.434 11.999 25.649 319 HD2 PHE 5 HD2 PHE 5 42.808 12.321 23.011 320 HE1 PHE 5 HE1 PHE 5 39.904 9.583 25.955 321 HE2 PHE 5 HE2 PHE 5 43.278 9.905 23.315 322 HZ PHE 5 HZ PHE 5 41.826 8.534 24.787 323 H GLN 6 HN GLN 6 40.138 16.100 23.704 324 HA GLN 6 HA GLN 6 41.830 18.451 23.821 325 HB2 GLN 6 HB2 GLN 6 41.434 16.848 21.304 326 HB3 GLN 6 HB1 GLN 6 41.732 18.586 21.240 327 HG2 GLN 6 HG2 GLN 6 43.775 18.189 22.683 328 HG3 GLN 6 HG1 GLN 6 43.518 16.461 22.449 329 HE21 GLN 6 HE21 GLN 6 45.251 19.025 21.217 330 HE22 GLN 6 HE22 GLN 6 45.489 18.457 19.635 331 H ILE 7 HN ILE 7 40.794 20.310 22.799 332 HA ILE 7 HA ILE 7 38.118 20.609 23.535 333 HB ILE 7 HB ILE 7 38.173 22.710 22.282 334 HG12 ILE 7 HG12 ILE 7 40.770 21.636 21.127 335 HG13 ILE 7 HG11 ILE 7 39.265 21.853 20.236 336 HG21 ILE 7 HG21 ILE 7 39.482 22.385 24.451 337 HG22 ILE 7 HG22 ILE 7 39.989 23.737 23.440 338 HG23 ILE 7 HG23 ILE 7 40.924 22.242 23.447 339 HD11 ILE 7 HD11 ILE 7 41.048 23.982 21.417 340 HD12 ILE 7 HD12 ILE 7 39.376 24.317 20.966 341 HD13 ILE 7 HD13 ILE 7 40.531 23.796 19.741 342 H LEU 8 HN LEU 8 39.546 19.545 20.526 343 HA LEU 8 HA LEU 8 37.162 19.703 18.956 344 HB2 LEU 8 HB2 LEU 8 39.472 19.652 17.997 345 HB3 LEU 8 HB1 LEU 8 39.596 17.962 18.488 346 HG LEU 8 HG LEU 8 37.491 17.521 17.151 347 HD11 LEU 8 HD11 LEU 8 36.543 19.709 16.960 348 HD12 LEU 8 HD12 LEU 8 37.082 19.279 15.339 349 HD13 LEU 8 HD13 LEU 8 38.045 20.380 16.324 350 HD21 LEU 8 HD21 LEU 8 39.951 18.582 15.724 351 HD22 LEU 8 HD22 LEU 8 38.689 17.625 14.946 352 HD23 LEU 8 HD23 LEU 8 39.662 16.919 16.236 353 H SER 9 HN SER 9 38.639 17.287 20.984 354 HA SER 9 HA SER 9 36.953 15.107 20.181 355 HB2 SER 9 HB2 SER 9 38.667 15.519 22.635 356 HB3 SER 9 HB1 SER 9 37.801 14.029 22.282 357 HG SER 9 HG SER 9 40.124 14.968 21.257 358 H ILE 10 HN ILE 10 36.903 17.448 22.843 359 HA ILE 10 HA ILE 10 34.660 16.368 24.194 360 HB ILE 10 HB ILE 10 35.800 19.168 24.131 361 HG12 ILE 10 HG12 ILE 10 35.904 17.070 26.312 362 HG13 ILE 10 HG11 ILE 10 37.157 17.218 25.078 363 HG21 ILE 10 HG21 ILE 10 33.480 19.346 24.786 364 HG22 ILE 10 HG22 ILE 10 34.453 19.436 26.254 365 HG23 ILE 10 HG23 ILE 10 33.618 17.939 25.840 366 HD11 ILE 10 HD11 ILE 10 37.633 19.499 25.757 367 HD12 ILE 10 HD12 ILE 10 37.686 18.470 27.187 368 HD13 ILE 10 HD13 ILE 10 36.278 19.486 26.886 369 H CYS 11 HN CYS 11 34.960 18.924 21.747 370 HA CYS 11 HA CYS 11 32.260 19.700 21.667 371 HB2 CYS 11 HB2 CYS 11 34.407 19.719 19.538 372 HB3 CYS 11 HB1 CYS 11 32.816 20.448 19.318 373 HG CYS 11 HG CYS 11 33.402 22.288 20.928 374 H SER 12 HN SER 12 34.015 17.339 19.621 375 HA SER 12 HA SER 12 31.795 16.523 18.122 376 HB2 SER 12 HB2 SER 12 34.272 14.981 18.908 377 HB3 SER 12 HB1 SER 12 33.111 14.458 17.690 378 HG SER 12 HG SER 12 34.979 16.522 17.641 379 H PHE 13 HN PHE 13 33.035 15.402 21.242 380 HA PHE 13 HA PHE 13 31.511 13.101 21.578 381 HB2 PHE 13 HB2 PHE 13 33.268 14.543 23.124 382 HB3 PHE 13 HB1 PHE 13 31.749 14.726 24.001 383 HD1 PHE 13 HD1 PHE 13 34.197 12.296 22.674 384 HD2 PHE 13 HD2 PHE 13 30.660 12.841 25.048 385 HE1 PHE 13 HE1 PHE 13 34.417 9.981 23.531 386 HE2 PHE 13 HE2 PHE 13 30.879 10.525 25.906 387 HZ PHE 13 HZ PHE 13 32.759 9.095 25.148 388 H ILE 14 HN ILE 14 30.707 16.372 22.790 389 HA ILE 14 HA ILE 14 28.103 15.691 23.657 390 HB ILE 14 HB ILE 14 27.729 18.170 23.664 391 HG12 ILE 14 HG12 ILE 14 30.565 18.232 22.559 392 HG13 ILE 14 HG11 ILE 14 29.124 18.710 21.676 393 HG21 ILE 14 HG21 ILE 14 28.875 16.870 25.510 394 HG22 ILE 14 HG22 ILE 14 29.287 18.584 25.442 395 HG23 ILE 14 HG23 ILE 14 30.413 17.381 24.815 396 HD11 ILE 14 HD11 ILE 14 28.666 20.403 23.482 397 HD12 ILE 14 HD12 ILE 14 30.124 20.714 22.541 398 HD13 ILE 14 HD13 ILE 14 30.250 20.015 24.156 399 H LEU 15 HN LEU 15 29.307 17.018 20.602 400 HA LEU 15 HA LEU 15 26.790 17.543 19.421 401 HB2 LEU 15 HB2 LEU 15 29.509 16.961 18.222 402 HB3 LEU 15 HB1 LEU 15 28.112 17.460 17.270 403 HG LEU 15 HG LEU 15 29.084 19.067 19.639 404 HD11 LEU 15 HD11 LEU 15 30.434 20.404 18.205 405 HD12 LEU 15 HD12 LEU 15 29.777 19.647 16.754 406 HD13 LEU 15 HD13 LEU 15 30.857 18.739 17.810 407 HD21 LEU 15 HD21 LEU 15 26.816 19.555 18.877 408 HD22 LEU 15 HD22 LEU 15 27.376 19.690 17.211 409 HD23 LEU 15 HD23 LEU 15 27.878 20.882 18.410 410 H SER 16 HN SER 16 28.674 14.661 19.813 411 HA SER 16 HA SER 16 27.306 13.106 17.824 412 HB2 SER 16 HB2 SER 16 29.020 12.288 20.171 413 HB3 SER 16 HB1 SER 16 28.431 11.191 18.925 414 HG SER 16 HG SER 16 29.603 12.330 17.409 415 H ALA 17 HN ALA 17 27.118 13.404 21.363 416 HA ALA 17 HA ALA 17 25.162 11.451 21.806 417 HB1 ALA 17 HB1 ALA 17 24.596 12.856 23.850 418 HB2 ALA 17 HB2 ALA 17 25.781 14.026 23.269 419 HB3 ALA 17 HB3 ALA 17 26.290 12.392 23.697 420 H LEU 18 HN LEU 18 24.822 14.921 21.080 421 HA LEU 18 HA LEU 18 21.963 14.850 21.118 422 HB2 LEU 18 HB2 LEU 18 23.324 16.906 21.512 423 HB3 LEU 18 HB1 LEU 18 23.764 16.891 19.803 424 HG LEU 18 HG LEU 18 21.294 16.900 19.264 425 HD11 LEU 18 HD11 LEU 18 21.158 17.310 22.260 426 HD12 LEU 18 HD12 LEU 18 20.306 16.108 21.293 427 HD13 LEU 18 HD13 LEU 18 19.856 17.807 21.180 428 HD21 LEU 18 HD21 LEU 18 21.084 19.279 19.572 429 HD22 LEU 18 HD22 LEU 18 22.793 18.935 19.305 430 HD23 LEU 18 HD23 LEU 18 22.203 19.254 20.936 431 H HIS 19 HN HIS 19 24.416 14.232 18.765 432 HA HIS 19 HA HIS 19 22.891 14.582 16.401 433 HB2 HIS 19 HB2 HIS 19 25.206 14.452 16.067 434 HB3 HIS 19 HB1 HIS 19 25.361 12.995 17.043 435 HD2 HIS 19 HD2 HIS 19 24.832 10.590 15.685 436 HE1 HIS 19 HE1 HIS 19 23.957 12.323 11.936 437 HE2 HIS 19 HE2 HIS 19 24.368 10.134 13.157 438 H PHE 20 HN PHE 20 23.639 11.649 18.267 439 HA PHE 20 HA PHE 20 21.892 10.016 16.672 440 HB2 PHE 20 HB2 PHE 20 23.928 9.585 18.580 441 HB3 PHE 20 HB1 PHE 20 22.459 8.871 19.248 442 HD1 PHE 20 HD1 PHE 20 24.952 8.713 16.567 443 HD2 PHE 20 HD2 PHE 20 21.236 7.113 18.014 444 HE1 PHE 20 HE1 PHE 20 25.172 6.792 15.013 445 HE2 PHE 20 HE2 PHE 20 21.458 5.194 16.460 446 HZ PHE 20 HZ PHE 20 23.426 5.035 14.963 447 H MET 21 HN MET 21 21.553 12.017 19.493 448 HA MET 21 HA MET 21 19.221 10.757 20.548 449 HB2 MET 21 HB2 MET 21 20.679 13.302 20.945 450 HB3 MET 21 HB1 MET 21 18.997 13.250 21.469 451 HG2 MET 21 HG2 MET 21 19.471 11.210 22.780 452 HG3 MET 21 HG1 MET 21 21.157 11.273 22.267 453 HE1 MET 21 HE1 MET 21 21.812 11.106 24.740 454 HE2 MET 21 HE2 MET 21 20.146 11.174 25.313 455 HE3 MET 21 HE3 MET 21 21.354 12.250 26.010 456 H ALA 22 HN ALA 22 19.607 13.833 18.794 457 HA ALA 22 HA ALA 22 16.837 14.226 18.357 458 HB1 ALA 22 HB1 ALA 22 19.324 15.408 17.184 459 HB2 ALA 22 HB2 ALA 22 18.068 16.182 18.150 460 HB3 ALA 22 HB3 ALA 22 17.755 15.772 16.464 461 H TRP 23 HN TRP 23 19.358 12.699 16.410 462 HA TRP 23 HA TRP 23 17.799 12.347 14.065 463 HB2 TRP 23 HB2 TRP 23 20.291 12.175 14.195 464 HB3 TRP 23 HB1 TRP 23 20.093 10.631 15.023 465 HD1 TRP 23 HD1 TRP 23 18.407 12.152 11.881 466 HE1 TRP 23 HE1 TRP 23 18.500 10.395 9.998 467 HE3 TRP 23 HE3 TRP 23 20.887 8.398 14.299 468 HZ2 TRP 23 HZ2 TRP 23 19.491 7.747 9.574 469 HZ3 TRP 23 HZ3 TRP 23 21.389 6.270 13.133 470 HH2 TRP 23 HH2 TRP 23 20.694 5.939 10.775 471 H THR 24 HN THR 24 18.357 10.294 16.916 472 HA THR 24 HA THR 24 17.005 7.999 15.953 473 HB THR 24 HB THR 24 17.609 8.996 18.730 474 HG1 THR 24 HG1 THR 24 19.262 8.192 17.248 475 HG21 THR 24 HG21 THR 24 15.639 7.671 19.000 476 HG22 THR 24 HG22 THR 24 16.995 6.622 19.406 477 HG23 THR 24 HG23 THR 24 16.204 6.473 17.837 478 H ILE 25 HN ILE 25 15.888 10.614 18.109 479 HA ILE 25 HA ILE 25 13.270 9.656 18.428 480 HB ILE 25 HB ILE 25 12.689 11.982 19.051 481 HG12 ILE 25 HG12 ILE 25 15.527 12.597 18.163 482 HG13 ILE 25 HG11 ILE 25 14.079 13.114 17.314 483 HG21 ILE 25 HG21 ILE 25 15.390 11.071 20.084 484 HG22 ILE 25 HG22 ILE 25 13.835 10.466 20.650 485 HG23 ILE 25 HG23 ILE 25 14.276 12.153 20.918 486 HD11 ILE 25 HD11 ILE 25 14.735 14.969 18.641 487 HD12 ILE 25 HD12 ILE 25 14.996 13.950 20.057 488 HD13 ILE 25 HD13 ILE 25 13.358 14.245 19.472 489 H GLY 26 HN GLY 26 14.661 11.777 15.933 490 HA2 GLY 26 HA2 GLY 26 12.232 12.399 14.629 491 HA3 GLY 26 HA1 GLY 26 13.834 12.473 13.902 492 H HIS 27 HN HIS 27 14.600 9.810 14.131 493 HA HIS 27 HA HIS 27 13.477 8.666 11.838 494 HB2 HIS 27 HB2 HIS 27 15.652 7.961 12.501 495 HB3 HIS 27 HB1 HIS 27 15.084 7.481 14.101 496 HD2 HIS 27 HD2 HIS 27 14.194 4.862 14.251 497 HE1 HIS 27 HE1 HIS 27 14.055 4.062 10.108 498 HE2 HIS 27 HE2 HIS 27 13.792 3.044 12.419 499 H LEU 28 HN LEU 28 12.840 8.050 15.274 500 HA LEU 28 HA LEU 28 11.068 5.895 14.962 501 HB2 LEU 28 HB2 LEU 28 11.150 8.049 17.087 502 HB3 LEU 28 HB1 LEU 28 10.220 6.555 17.206 503 HG LEU 28 HG LEU 28 13.209 6.617 16.737 504 HD11 LEU 28 HD11 LEU 28 12.605 7.637 18.928 505 HD12 LEU 28 HD12 LEU 28 13.460 6.106 19.114 506 HD13 LEU 28 HD13 LEU 28 11.712 6.172 19.336 507 HD21 LEU 28 HD21 LEU 28 12.263 4.538 16.032 508 HD22 LEU 28 HD22 LEU 28 11.192 4.471 17.431 509 HD23 LEU 28 HD23 LEU 28 12.928 4.240 17.637 510 H ASN 29 HN ASN 29 8.891 5.747 14.627 511 HA ASN 29 HA ASN 29 7.564 8.179 13.635 512 HB2 ASN 29 HB2 ASN 29 7.718 6.143 12.167 513 HB3 ASN 29 HB1 ASN 29 6.682 5.304 13.322 514 HD21 ASN 29 HD21 ASN 29 4.733 5.162 12.128 515 HD22 ASN 29 HD22 ASN 29 3.905 6.513 11.522 516 H GLN 30 HN GLN 30 6.259 9.194 15.005 517 HA GLN 30 HA GLN 30 4.788 7.580 17.002 518 HB2 GLN 30 HB2 GLN 30 5.790 10.428 17.206 519 HB3 GLN 30 HB1 GLN 30 4.774 9.631 18.407 520 HG2 GLN 30 HG2 GLN 30 6.539 7.837 18.587 521 HG3 GLN 30 HG1 GLN 30 7.571 8.834 17.563 522 HE21 GLN 30 HE21 GLN 30 9.134 9.317 19.232 523 HE22 GLN 30 HE22 GLN 30 8.746 10.280 20.576 524 H ILE 31 HN ILE 31 2.650 7.579 16.814 525 HA ILE 31 HA ILE 31 1.334 9.860 15.480 526 HB ILE 31 HB ILE 31 0.749 6.927 15.005 527 HG12 ILE 31 HG12 ILE 31 1.672 9.042 13.044 528 HG13 ILE 31 HG11 ILE 31 2.795 7.975 13.887 529 HG21 ILE 31 HG21 ILE 31 -0.838 7.910 13.286 530 HG22 ILE 31 HG22 ILE 31 -0.579 9.477 14.051 531 HG23 ILE 31 HG23 ILE 31 -1.319 8.162 14.964 532 HD11 ILE 31 HD11 ILE 31 1.903 6.036 12.851 533 HD12 ILE 31 HD12 ILE 31 1.999 7.224 11.552 534 HD13 ILE 31 HD13 ILE 31 0.450 6.885 12.322 535 H LYS 32 HN LYS 32 -0.418 10.620 16.524 536 HA LYS 32 HA LYS 32 -1.139 9.444 19.065 537 HB2 LYS 32 HB2 LYS 32 -2.234 11.840 17.574 538 HB3 LYS 32 HB1 LYS 32 -2.703 11.376 19.210 539 HG2 LYS 32 HG2 LYS 32 -0.276 11.517 19.866 540 HG3 LYS 32 HG1 LYS 32 0.062 12.179 18.267 541 HD2 LYS 32 HD2 LYS 32 -1.527 14.027 18.703 542 HD3 LYS 32 HD1 LYS 32 -1.829 13.375 20.315 543 HE2 LYS 32 HE2 LYS 32 -0.189 15.075 20.627 544 HE3 LYS 32 HE1 LYS 32 0.697 13.553 20.698 545 HZ1 LYS 32 HZ1 LYS 32 0.858 14.003 18.119 546 HZ2 LYS 32 HZ2 LYS 32 1.979 14.661 19.213 547 HZ3 LYS 32 HZ3 LYS 32 0.700 15.613 18.627 548 H ARG 33 HN ARG 33 -2.268 7.581 18.885 549 HA ARG 33 HA ARG 33 -4.542 7.465 17.018 550 HB2 ARG 33 HB2 ARG 33 -4.506 5.056 17.412 551 HB3 ARG 33 HB1 ARG 33 -2.896 5.614 16.953 552 HG2 ARG 33 HG2 ARG 33 -2.265 5.712 19.351 553 HG3 ARG 33 HG1 ARG 33 -3.858 5.090 19.781 554 HD2 ARG 33 HD2 ARG 33 -1.922 3.652 17.953 555 HD3 ARG 33 HD1 ARG 33 -2.063 3.329 19.677 556 HE ARG 33 HE ARG 33 -4.627 3.119 18.572 557 HH11 ARG 33 HH11 ARG 33 -1.514 1.559 18.345 558 HH12 ARG 33 HH12 ARG 33 -2.181 0.015 17.949 559 HH21 ARG 33 HH21 ARG 33 -5.471 1.085 18.054 560 HH22 ARG 33 HH22 ARG 33 -4.405 -0.253 17.784 561 H1 MET 1 HT1 MET 1 47.334 -4.876 27.240 562 H2 MET 1 HT2 MET 1 46.756 -3.371 26.716 563 H3 MET 1 HT3 MET 1 48.131 -3.458 27.710 564 HA MET 1 HA MET 1 48.654 -3.007 25.349 565 HB2 MET 1 HB2 MET 1 50.325 -4.965 25.196 566 HB3 MET 1 HB1 MET 1 50.434 -3.919 26.613 567 HG2 MET 1 HG2 MET 1 49.189 -5.511 27.956 568 HG3 MET 1 HG1 MET 1 48.875 -6.517 26.543 569 HE1 MET 1 HE1 MET 1 51.788 -8.606 25.945 570 HE2 MET 1 HE2 MET 1 51.150 -7.296 24.955 571 HE3 MET 1 HE3 MET 1 50.045 -8.317 25.871 572 H PHE 2 HN PHE 2 46.988 -6.043 26.024 573 HA PHE 2 HA PHE 2 47.079 -7.213 23.489 574 HB2 PHE 2 HB2 PHE 2 45.626 -8.723 24.371 575 HB3 PHE 2 HB1 PHE 2 45.949 -7.877 25.883 576 HD1 PHE 2 HD1 PHE 2 43.519 -8.505 23.236 577 HD2 PHE 2 HD2 PHE 2 44.375 -6.110 26.700 578 HE1 PHE 2 HE1 PHE 2 41.139 -7.822 23.350 579 HE2 PHE 2 HE2 PHE 2 41.993 -5.426 26.812 580 HZ PHE 2 HZ PHE 2 40.376 -6.281 25.137 581 H GLU 3 HN GLU 3 45.438 -4.386 24.584 582 HA GLU 3 HA GLU 3 43.206 -4.331 22.930 583 HB2 GLU 3 HB2 GLU 3 44.957 -2.065 23.895 584 HB3 GLU 3 HB1 GLU 3 43.399 -1.838 23.100 585 HG2 GLU 3 HG2 GLU 3 42.308 -3.190 24.850 586 HG3 GLU 3 HG1 GLU 3 43.863 -3.401 25.653 587 HA PRO 4 HA PRO 4 44.995 -3.858 18.892 588 HB2 PRO 4 HB2 PRO 4 42.863 -2.815 17.546 589 HB3 PRO 4 HB1 PRO 4 42.939 -4.508 18.070 590 HG2 PRO 4 HG2 PRO 4 41.460 -2.226 19.253 591 HG3 PRO 4 HG1 PRO 4 41.010 -3.934 19.142 592 HD2 PRO 4 HD2 PRO 4 42.012 -2.717 21.429 593 HD3 PRO 4 HD1 PRO 4 42.053 -4.463 21.109 594 H PHE 5 HN PHE 5 42.959 -1.056 19.763 595 HA PHE 5 HA PHE 5 45.176 0.719 18.963 596 HB2 PHE 5 HB2 PHE 5 42.341 0.725 18.021 597 HB3 PHE 5 HB1 PHE 5 43.131 2.280 18.279 598 HD1 PHE 5 HD1 PHE 5 43.029 -0.759 16.243 599 HD2 PHE 5 HD2 PHE 5 45.173 2.882 17.016 600 HE1 PHE 5 HE1 PHE 5 44.232 -1.009 14.088 601 HE2 PHE 5 HE2 PHE 5 46.375 2.633 14.862 602 HZ PHE 5 HZ PHE 5 45.904 0.688 13.397 603 H GLN 6 HN GLN 6 41.914 1.516 20.069 604 HA GLN 6 HA GLN 6 42.820 2.100 22.763 605 HB2 GLN 6 HB2 GLN 6 42.123 4.249 20.773 606 HB3 GLN 6 HB1 GLN 6 41.887 4.499 22.503 607 HG2 GLN 6 HG2 GLN 6 44.304 3.815 22.831 608 HG3 GLN 6 HG1 GLN 6 44.480 3.858 21.077 609 HE21 GLN 6 HE21 GLN 6 44.949 5.735 23.792 610 HE22 GLN 6 HE22 GLN 6 44.833 7.273 23.080 611 H ILE 7 HN ILE 7 41.031 2.811 24.145 612 HA ILE 7 HA ILE 7 38.756 1.221 23.867 613 HB ILE 7 HB ILE 7 37.821 2.524 25.717 614 HG12 ILE 7 HG12 ILE 7 40.125 4.431 25.173 615 HG13 ILE 7 HG11 ILE 7 38.420 4.774 24.879 616 HG21 ILE 7 HG21 ILE 7 39.773 0.909 26.040 617 HG22 ILE 7 HG22 ILE 7 39.542 2.102 27.318 618 HG23 ILE 7 HG23 ILE 7 40.813 2.331 26.116 619 HD11 ILE 7 HD11 ILE 7 39.808 4.375 27.529 620 HD12 ILE 7 HD12 ILE 7 38.055 4.249 27.372 621 HD13 ILE 7 HD13 ILE 7 38.867 5.765 26.985 622 H LEU 8 HN LEU 8 39.409 4.482 22.778 623 HA LEU 8 HA LEU 8 36.712 5.154 22.116 624 HB2 LEU 8 HB2 LEU 8 38.524 6.834 22.503 625 HB3 LEU 8 HB1 LEU 8 39.264 6.328 20.984 626 HG LEU 8 HG LEU 8 37.059 6.850 19.851 627 HD11 LEU 8 HD11 LEU 8 35.526 6.819 21.685 628 HD12 LEU 8 HD12 LEU 8 35.630 8.504 21.179 629 HD13 LEU 8 HD13 LEU 8 36.502 7.957 22.612 630 HD21 LEU 8 HD21 LEU 8 38.550 9.078 21.275 631 HD22 LEU 8 HD22 LEU 8 37.431 9.332 19.936 632 HD23 LEU 8 HD23 LEU 8 38.915 8.414 19.683 633 H SER 9 HN SER 9 39.363 3.622 20.456 634 HA SER 9 HA SER 9 38.196 3.695 17.832 635 HB2 SER 9 HB2 SER 9 40.404 1.996 19.000 636 HB3 SER 9 HB1 SER 9 39.925 1.956 17.308 637 HG SER 9 HG SER 9 41.450 3.755 18.637 638 H ILE 10 HN ILE 10 38.319 1.304 20.447 639 HA ILE 10 HA ILE 10 37.016 -0.786 19.043 640 HB ILE 10 HB ILE 10 37.244 -0.196 22.000 641 HG12 ILE 10 HG12 ILE 10 38.609 -2.316 20.322 642 HG13 ILE 10 HG11 ILE 10 39.319 -0.727 20.604 643 HG21 ILE 10 HG21 ILE 10 35.293 -1.588 21.690 644 HG22 ILE 10 HG22 ILE 10 36.608 -2.634 22.225 645 HG23 ILE 10 HG23 ILE 10 36.140 -2.604 20.524 646 HD11 ILE 10 HD11 ILE 10 39.320 -1.093 23.005 647 HD12 ILE 10 HD12 ILE 10 40.102 -2.471 22.232 648 HD13 ILE 10 HD13 ILE 10 38.443 -2.611 22.811 649 H CYS 11 HN CYS 11 35.799 1.752 21.221 650 HA CYS 11 HA CYS 11 33.110 0.943 21.280 651 HB2 CYS 11 HB2 CYS 11 34.386 3.671 21.531 652 HB3 CYS 11 HB1 CYS 11 32.669 3.377 21.803 653 HG CYS 11 HG CYS 11 33.185 2.155 23.940 654 H SER 12 HN SER 12 34.725 3.345 19.166 655 HA SER 12 HA SER 12 32.474 3.952 17.621 656 HB2 SER 12 HB2 SER 12 35.401 3.978 16.870 657 HB3 SER 12 HB1 SER 12 34.115 4.699 15.907 658 HG SER 12 HG SER 12 35.204 5.483 18.349 659 H PHE 13 HN PHE 13 34.884 1.384 17.301 660 HA PHE 13 HA PHE 13 34.257 0.434 14.759 661 HB2 PHE 13 HB2 PHE 13 35.929 -0.348 16.796 662 HB3 PHE 13 HB1 PHE 13 34.773 -1.676 16.718 663 HD1 PHE 13 HD1 PHE 13 37.264 0.273 14.812 664 HD2 PHE 13 HD2 PHE 13 34.636 -3.122 14.787 665 HE1 PHE 13 HE1 PHE 13 38.383 -0.575 12.769 666 HE2 PHE 13 HE2 PHE 13 35.755 -3.974 12.742 667 HZ PHE 13 HZ PHE 13 37.628 -2.699 11.734 668 H ILE 14 HN ILE 14 32.982 -0.802 17.871 669 HA ILE 14 HA ILE 14 31.087 -2.539 16.691 670 HB ILE 14 HB ILE 14 30.052 -2.545 18.976 671 HG12 ILE 14 HG12 ILE 14 32.265 -0.544 19.582 672 HG13 ILE 14 HG11 ILE 14 30.547 -0.178 19.559 673 HG21 ILE 14 HG21 ILE 14 32.033 -3.959 18.276 674 HG22 ILE 14 HG22 ILE 14 31.904 -3.668 20.011 675 HG23 ILE 14 HG23 ILE 14 33.069 -2.758 19.047 676 HD11 ILE 14 HD11 ILE 14 30.221 -1.946 21.323 677 HD12 ILE 14 HD12 ILE 14 31.162 -0.551 21.850 678 HD13 ILE 14 HD13 ILE 14 31.979 -2.059 21.439 679 H LEU 15 HN LEU 15 30.846 0.811 17.836 680 HA LEU 15 HA LEU 15 28.050 1.087 17.540 681 HB2 LEU 15 HB2 LEU 15 30.306 3.108 17.486 682 HB3 LEU 15 HB1 LEU 15 28.599 3.553 17.483 683 HG LEU 15 HG LEU 15 29.775 1.739 19.600 684 HD11 LEU 15 HD11 LEU 15 30.179 3.612 21.012 685 HD12 LEU 15 HD12 LEU 15 29.337 4.714 19.922 686 HD13 LEU 15 HD13 LEU 15 30.902 4.045 19.463 687 HD21 LEU 15 HD21 LEU 15 27.340 1.709 19.400 688 HD22 LEU 15 HD22 LEU 15 27.289 3.471 19.430 689 HD23 LEU 15 HD23 LEU 15 27.786 2.577 20.867 690 H SER 16 HN SER 16 30.694 1.215 15.301 691 HA SER 16 HA SER 16 29.271 2.536 13.189 692 HB2 SER 16 HB2 SER 16 31.788 0.868 13.165 693 HB3 SER 16 HB1 SER 16 31.174 1.782 11.790 694 HG SER 16 HG SER 16 31.446 3.663 12.955 695 H ALA 17 HN ALA 17 30.116 -0.836 13.934 696 HA ALA 17 HA ALA 17 29.029 -2.014 11.636 697 HB1 ALA 17 HB1 ALA 17 28.761 -4.055 13.129 698 HB2 ALA 17 HB2 ALA 17 29.327 -3.049 14.463 699 HB3 ALA 17 HB3 ALA 17 30.381 -3.360 13.084 700 H LEU 18 HN LEU 18 27.515 -1.268 14.780 701 HA LEU 18 HA LEU 18 24.958 -2.282 14.004 702 HB2 LEU 18 HB2 LEU 18 25.738 -2.085 16.368 703 HB3 LEU 18 HB1 LEU 18 25.610 -0.331 16.218 704 HG LEU 18 HG LEU 18 23.196 -0.658 15.540 705 HD11 LEU 18 HD11 LEU 18 23.890 -3.497 16.328 706 HD12 LEU 18 HD12 LEU 18 23.156 -2.940 14.824 707 HD13 LEU 18 HD13 LEU 18 22.231 -2.896 16.323 708 HD21 LEU 18 HD21 LEU 18 22.435 -0.895 17.813 709 HD22 LEU 18 HD22 LEU 18 24.000 -0.083 17.867 710 HD23 LEU 18 HD23 LEU 18 23.883 -1.798 18.259 711 H HIS 19 HN HIS 19 26.621 0.732 13.684 712 HA HIS 19 HA HIS 19 24.400 2.449 13.308 713 HB2 HIS 19 HB2 HIS 19 26.431 3.543 13.712 714 HB3 HIS 19 HB1 HIS 19 27.290 2.605 12.491 715 HD2 HIS 19 HD2 HIS 19 27.058 3.580 9.864 716 HE1 HIS 19 HE1 HIS 19 24.606 6.893 10.777 717 HE2 HIS 19 HE2 HIS 19 25.975 5.774 8.954 718 H PHE 20 HN PHE 20 26.488 0.809 10.946 719 HA PHE 20 HA PHE 20 24.863 1.626 8.723 720 HB2 PHE 20 HB2 PHE 20 27.430 0.504 9.085 721 HB3 PHE 20 HB1 PHE 20 26.509 -0.660 8.133 722 HD1 PHE 20 HD1 PHE 20 27.978 2.696 8.211 723 HD2 PHE 20 HD2 PHE 20 25.500 -0.006 5.972 724 HE1 PHE 20 HE1 PHE 20 28.209 4.141 6.208 725 HE2 PHE 20 HE2 PHE 20 25.732 1.439 3.970 726 HZ PHE 20 HZ PHE 20 27.076 3.515 4.090 727 H MET 21 HN MET 21 24.870 -1.036 10.962 728 HA MET 21 HA MET 21 23.440 -2.882 9.320 729 HB2 MET 21 HB2 MET 21 24.175 -2.634 12.178 730 HB3 MET 21 HB1 MET 21 22.826 -3.696 11.785 731 HG2 MET 21 HG2 MET 21 24.236 -4.874 10.133 732 HG3 MET 21 HG1 MET 21 25.590 -3.818 10.536 733 HE1 MET 21 HE1 MET 21 27.002 -5.928 10.891 734 HE2 MET 21 HE2 MET 21 25.649 -7.025 10.623 735 HE3 MET 21 HE3 MET 21 26.661 -7.217 12.052 736 H ALA 22 HN ALA 22 22.375 -0.943 12.122 737 HA ALA 22 HA ALA 22 19.619 -1.453 11.745 738 HB1 ALA 22 HB1 ALA 22 21.178 0.553 13.325 739 HB2 ALA 22 HB2 ALA 22 20.123 -0.740 13.894 740 HB3 ALA 22 HB3 ALA 22 19.428 0.716 13.184 741 H TRP 23 HN TRP 23 21.728 1.153 10.632 742 HA TRP 23 HA TRP 23 19.679 2.808 9.577 743 HB2 TRP 23 HB2 TRP 23 22.031 3.522 10.047 744 HB3 TRP 23 HB1 TRP 23 22.541 2.598 8.634 745 HD1 TRP 23 HD1 TRP 23 19.606 5.059 9.235 746 HE1 TRP 23 HE1 TRP 23 19.593 6.768 7.305 747 HE3 TRP 23 HE3 TRP 23 23.661 3.434 6.587 748 HZ2 TRP 23 HZ2 TRP 23 21.101 7.366 4.951 749 HZ3 TRP 23 HZ3 TRP 23 24.348 4.590 4.506 750 HH2 TRP 23 HH2 TRP 23 23.074 6.552 3.684 751 H THR 24 HN THR 24 21.653 0.215 8.149 752 HA THR 24 HA THR 24 20.768 0.542 5.478 753 HB THR 24 HB THR 24 21.907 -1.809 6.976 754 HG1 THR 24 HG1 THR 24 23.166 0.107 6.400 755 HG21 THR 24 HG21 THR 24 20.573 -2.799 5.259 756 HG22 THR 24 HG22 THR 24 22.226 -2.774 4.646 757 HG23 THR 24 HG23 THR 24 21.059 -1.577 4.084 758 H ILE 25 HN ILE 25 19.691 -1.728 8.017 759 HA ILE 25 HA ILE 25 17.688 -2.967 6.491 760 HB ILE 25 HB ILE 25 16.701 -3.628 8.664 761 HG12 ILE 25 HG12 ILE 25 18.830 -1.803 9.832 762 HG13 ILE 25 HG11 ILE 25 17.106 -1.465 9.847 763 HG21 ILE 25 HG21 ILE 25 19.731 -3.731 8.607 764 HG22 ILE 25 HG22 ILE 25 18.666 -4.819 7.722 765 HG23 ILE 25 HG23 ILE 25 18.676 -4.835 9.485 766 HD11 ILE 25 HD11 ILE 25 17.593 -2.396 11.977 767 HD12 ILE 25 HD12 ILE 25 18.550 -3.694 11.265 768 HD13 ILE 25 HD13 ILE 25 16.798 -3.675 11.059 769 H GLY 26 HN GLY 26 17.571 -0.040 8.521 770 HA2 GLY 26 HA2 GLY 26 14.787 0.390 8.322 771 HA3 GLY 26 HA1 GLY 26 15.992 1.622 8.687 772 H HIS 27 HN HIS 27 17.509 1.534 6.359 773 HA HIS 27 HA HIS 27 16.095 3.245 4.659 774 HB2 HIS 27 HB2 HIS 27 18.474 3.323 4.618 775 HB3 HIS 27 HB1 HIS 27 18.593 1.603 4.242 776 HD2 HIS 27 HD2 HIS 27 18.569 1.028 1.533 777 HE1 HIS 27 HE1 HIS 27 17.374 4.832 0.146 778 HE2 HIS 27 HE2 HIS 27 18.143 2.520 -0.568 779 H LEU 28 HN LEU 28 16.762 -0.229 4.397 780 HA LEU 28 HA LEU 28 15.662 -0.648 1.849 781 HB2 LEU 28 HB2 LEU 28 15.793 -2.506 4.235 782 HB3 LEU 28 HB1 LEU 28 15.409 -3.010 2.588 783 HG LEU 28 HG LEU 28 17.956 -1.551 3.324 784 HD11 LEU 28 HD11 LEU 28 17.808 -3.762 4.462 785 HD12 LEU 28 HD12 LEU 28 19.071 -3.725 3.232 786 HD13 LEU 28 HD13 LEU 28 17.534 -4.523 2.895 787 HD21 LEU 28 HD21 LEU 28 17.461 -1.314 0.998 788 HD22 LEU 28 HD22 LEU 28 16.950 -2.998 0.866 789 HD23 LEU 28 HD23 LEU 28 18.653 -2.609 1.105 790 H ASN 29 HN ASN 29 13.623 -1.075 1.120 791 HA ASN 29 HA ASN 29 11.427 -0.471 2.983 792 HB2 ASN 29 HB2 ASN 29 11.678 0.857 0.864 793 HB3 ASN 29 HB1 ASN 29 11.336 -0.621 -0.034 794 HD21 ASN 29 HD21 ASN 29 9.233 -0.172 -0.822 795 HD22 ASN 29 HD22 ASN 29 7.911 0.185 0.181 796 H GLN 30 HN GLN 30 10.383 -2.149 3.825 797 HA GLN 30 HA GLN 30 10.127 -4.605 2.195 798 HB2 GLN 30 HB2 GLN 30 10.299 -4.313 5.202 799 HB3 GLN 30 HB1 GLN 30 9.973 -5.826 4.357 800 HG2 GLN 30 HG2 GLN 30 12.136 -5.493 3.100 801 HG3 GLN 30 HG1 GLN 30 12.474 -4.128 4.163 802 HE21 GLN 30 HE21 GLN 30 14.275 -5.135 5.257 803 HE22 GLN 30 HE22 GLN 30 14.074 -6.479 6.275 804 H ILE 31 HN ILE 31 8.128 -5.158 1.641 805 HA ILE 31 HA ILE 31 5.876 -4.231 3.308 806 HB ILE 31 HB ILE 31 6.021 -4.133 0.286 807 HG12 ILE 31 HG12 ILE 31 5.657 -1.871 2.267 808 HG13 ILE 31 HG11 ILE 31 7.237 -2.337 1.638 809 HG21 ILE 31 HG21 ILE 31 3.769 -3.004 0.592 810 HG22 ILE 31 HG22 ILE 31 3.802 -3.556 2.266 811 HG23 ILE 31 HG23 ILE 31 3.784 -4.730 0.952 812 HD11 ILE 31 HD11 ILE 31 6.645 -1.761 -0.585 813 HD12 ILE 31 HD12 ILE 31 5.992 -0.449 0.396 814 HD13 ILE 31 HD13 ILE 31 4.923 -1.716 -0.205 815 H LYS 32 HN LYS 32 4.400 -5.769 3.752 816 HA LYS 32 HA LYS 32 4.867 -8.460 2.805 817 HB2 LYS 32 HB2 LYS 32 2.736 -7.307 4.619 818 HB3 LYS 32 HB1 LYS 32 2.951 -9.027 4.289 819 HG2 LYS 32 HG2 LYS 32 5.318 -8.815 5.119 820 HG3 LYS 32 HG1 LYS 32 4.941 -7.163 5.610 821 HD2 LYS 32 HD2 LYS 32 3.117 -8.015 7.050 822 HD3 LYS 32 HD1 LYS 32 3.527 -9.665 6.580 823 HE2 LYS 32 HE2 LYS 32 4.635 -9.318 8.658 824 HE3 LYS 32 HE1 LYS 32 5.891 -9.159 7.430 825 HZ1 LYS 32 HZ1 LYS 32 5.104 -6.660 7.538 826 HZ2 LYS 32 HZ2 LYS 32 6.277 -7.275 8.601 827 HZ3 LYS 32 HZ3 LYS 32 4.665 -7.110 9.113 828 H ARG 33 HN ARG 33 4.311 -8.767 0.714 829 HA ARG 33 HA ARG 33 1.697 -7.790 -0.223 830 HB2 ARG 33 HB2 ARG 33 2.527 -8.275 -2.468 831 HB3 ARG 33 HB1 ARG 33 3.687 -7.267 -1.602 832 HG2 ARG 33 HG2 ARG 33 4.984 -9.299 -1.009 833 HG3 ARG 33 HG1 ARG 33 3.847 -10.277 -1.938 834 HD2 ARG 33 HD2 ARG 33 5.438 -7.977 -3.095 835 HD3 ARG 33 HD1 ARG 33 5.937 -9.662 -3.197 836 HE ARG 33 HE ARG 33 3.325 -9.499 -4.190 837 HH11 ARG 33 HH11 ARG 33 6.519 -8.317 -4.945 838 HH12 ARG 33 HH12 ARG 33 6.223 -8.247 -6.646 839 HH21 ARG 33 HH21 ARG 33 2.968 -9.401 -6.421 840 HH22 ARG 33 HH22 ARG 33 4.228 -8.857 -7.479 841 H1 MET 1 HT1 MET 1 55.173 0.590 2.364 842 H2 MET 1 HT2 MET 1 54.041 0.857 3.600 843 H3 MET 1 HT3 MET 1 55.632 0.398 3.984 844 HA MET 1 HA MET 1 55.183 2.786 4.363 845 HB2 MET 1 HB2 MET 1 57.198 3.539 2.942 846 HB3 MET 1 HB1 MET 1 57.466 2.226 4.089 847 HG2 MET 1 HG2 MET 1 57.258 0.569 2.328 848 HG3 MET 1 HG1 MET 1 56.796 1.809 1.163 849 HE1 MET 1 HE1 MET 1 59.815 3.405 -0.077 850 HE2 MET 1 HE2 MET 1 58.536 4.094 0.918 851 HE3 MET 1 HE3 MET 1 58.141 2.874 -0.289 852 H PHE 2 HN PHE 2 54.791 1.634 1.051 853 HA PHE 2 HA PHE 2 54.366 4.068 -0.254 854 HB2 PHE 2 HB2 PHE 2 53.793 2.769 -2.029 855 HB3 PHE 2 HB1 PHE 2 54.343 1.443 -1.005 856 HD1 PHE 2 HD1 PHE 2 51.463 3.106 -2.503 857 HD2 PHE 2 HD2 PHE 2 52.692 0.105 0.316 858 HE1 PHE 2 HE1 PHE 2 49.168 2.168 -2.501 859 HE2 PHE 2 HE2 PHE 2 50.393 -0.831 0.318 860 HZ PHE 2 HZ PHE 2 48.632 0.201 -1.091 861 H GLU 3 HN GLU 3 52.441 2.424 2.087 862 HA GLU 3 HA GLU 3 49.870 3.210 1.383 863 HB2 GLU 3 HB2 GLU 3 51.106 2.860 4.117 864 HB3 GLU 3 HB1 GLU 3 49.378 3.066 3.834 865 HG2 GLU 3 HG2 GLU 3 49.377 1.074 2.379 866 HG3 GLU 3 HG1 GLU 3 51.101 0.860 2.678 867 HA PRO 4 HA PRO 4 49.986 7.607 1.989 868 HB2 PRO 4 HB2 PRO 4 47.323 8.117 2.293 869 HB3 PRO 4 HB1 PRO 4 48.053 7.687 0.736 870 HG2 PRO 4 HG2 PRO 4 46.472 6.016 2.607 871 HG3 PRO 4 HG1 PRO 4 46.515 6.007 0.838 872 HD2 PRO 4 HD2 PRO 4 47.834 4.175 2.447 873 HD3 PRO 4 HD1 PRO 4 48.272 4.537 0.765 874 H PHE 5 HN PHE 5 47.640 6.050 4.181 875 HA PHE 5 HA PHE 5 48.855 7.521 6.433 876 HB2 PHE 5 HB2 PHE 5 45.997 7.430 5.571 877 HB3 PHE 5 HB1 PHE 5 46.341 7.431 7.301 878 HD1 PHE 5 HD1 PHE 5 46.448 9.368 4.198 879 HD2 PHE 5 HD2 PHE 5 47.577 9.305 8.341 880 HE1 PHE 5 HE1 PHE 5 46.874 11.812 4.119 881 HE2 PHE 5 HE2 PHE 5 48.004 11.746 8.264 882 HZ PHE 5 HZ PHE 5 47.650 13.003 6.157 883 H GLN 6 HN GLN 6 46.064 5.343 6.381 884 HA GLN 6 HA GLN 6 47.609 3.117 7.414 885 HB2 GLN 6 HB2 GLN 6 45.698 4.706 9.113 886 HB3 GLN 6 HB1 GLN 6 45.996 2.996 9.429 887 HG2 GLN 6 HG2 GLN 6 48.469 3.532 9.471 888 HG3 GLN 6 HG1 GLN 6 48.028 5.239 9.416 889 HE21 GLN 6 HE21 GLN 6 48.812 2.813 11.567 890 HE22 GLN 6 HE22 GLN 6 48.028 3.413 12.948 891 H ILE 7 HN ILE 7 46.265 1.196 7.711 892 HA ILE 7 HA ILE 7 44.586 0.701 5.536 893 HB ILE 7 HB ILE 7 43.986 -1.382 6.678 894 HG12 ILE 7 HG12 ILE 7 45.324 -0.116 9.097 895 HG13 ILE 7 HG11 ILE 7 43.597 -0.430 8.928 896 HG21 ILE 7 HG21 ILE 7 46.310 -0.986 5.697 897 HG22 ILE 7 HG22 ILE 7 46.188 -2.288 6.881 898 HG23 ILE 7 HG23 ILE 7 46.862 -0.726 7.351 899 HD11 ILE 7 HD11 ILE 7 45.838 -2.439 9.149 900 HD12 ILE 7 HD12 ILE 7 44.249 -2.887 8.530 901 HD13 ILE 7 HD13 ILE 7 44.413 -2.273 10.175 902 H LEU 8 HN LEU 8 43.866 1.888 8.748 903 HA LEU 8 HA LEU 8 41.029 1.570 8.588 904 HB2 LEU 8 HB2 LEU 8 42.298 1.799 10.731 905 HB3 LEU 8 HB1 LEU 8 42.602 3.488 10.328 906 HG LEU 8 HG LEU 8 40.095 3.786 10.121 907 HD11 LEU 8 HD11 LEU 8 39.339 1.539 9.815 908 HD12 LEU 8 HD12 LEU 8 38.777 2.017 11.416 909 HD13 LEU 8 HD13 LEU 8 40.195 0.980 11.253 910 HD21 LEU 8 HD21 LEU 8 41.264 2.916 12.784 911 HD22 LEU 8 HD22 LEU 8 39.738 3.784 12.608 912 HD23 LEU 8 HD23 LEU 8 41.250 4.550 12.121 913 H SER 9 HN SER 9 43.298 4.071 7.725 914 HA SER 9 HA SER 9 41.355 6.130 7.250 915 HB2 SER 9 HB2 SER 9 44.214 5.820 6.328 916 HB3 SER 9 HB1 SER 9 43.233 7.247 6.021 917 HG SER 9 HG SER 9 44.532 6.491 8.271 918 H ILE 10 HN ILE 10 43.032 3.765 5.208 919 HA ILE 10 HA ILE 10 41.994 4.670 2.733 920 HB ILE 10 HB ILE 10 43.014 1.960 3.602 921 HG12 ILE 10 HG12 ILE 10 44.293 4.045 1.816 922 HG13 ILE 10 HG11 ILE 10 44.564 3.993 3.559 923 HG21 ILE 10 HG21 ILE 10 41.564 1.609 1.702 924 HG22 ILE 10 HG22 ILE 10 43.224 1.579 1.112 925 HG23 ILE 10 HG23 ILE 10 42.229 3.015 0.872 926 HD11 ILE 10 HD11 ILE 10 45.475 1.750 3.408 927 HD12 ILE 10 HD12 ILE 10 46.314 2.765 2.238 928 HD13 ILE 10 HD13 ILE 10 45.058 1.652 1.697 929 H CYS 11 HN CYS 11 40.898 2.162 5.000 930 HA CYS 11 HA CYS 11 38.737 1.196 3.487 931 HB2 CYS 11 HB2 CYS 11 39.178 1.347 6.474 932 HB3 CYS 11 HB1 CYS 11 37.812 0.509 5.738 933 HG CYS 11 HG CYS 11 39.341 -1.299 4.887 934 H SER 12 HN SER 12 38.787 3.690 6.058 935 HA SER 12 HA SER 12 36.074 4.358 5.890 936 HB2 SER 12 HB2 SER 12 38.443 6.068 6.664 937 HB3 SER 12 HB1 SER 12 36.760 6.518 6.917 938 HG SER 12 HG SER 12 38.325 4.583 8.172 939 H PHE 13 HN PHE 13 38.876 5.538 4.075 940 HA PHE 13 HA PHE 13 37.737 7.723 2.781 941 HB2 PHE 13 HB2 PHE 13 40.142 6.399 2.665 942 HB3 PHE 13 HB1 PHE 13 39.465 6.099 1.066 943 HD1 PHE 13 HD1 PHE 13 40.497 8.709 3.467 944 HD2 PHE 13 HD2 PHE 13 39.117 7.893 -0.516 945 HE1 PHE 13 HE1 PHE 13 41.064 11.027 2.798 946 HE2 PHE 13 HE2 PHE 13 39.682 10.213 -1.189 947 HZ PHE 13 HZ PHE 13 40.657 11.780 0.469 948 H ILE 14 HN ILE 14 37.993 4.389 1.497 949 HA ILE 14 HA ILE 14 36.397 4.877 -0.786 950 HB ILE 14 HB ILE 14 36.231 2.376 -0.892 951 HG12 ILE 14 HG12 ILE 14 37.840 2.528 1.688 952 HG13 ILE 14 HG11 ILE 14 36.186 1.954 1.559 953 HG21 ILE 14 HG21 ILE 14 38.184 3.740 -1.752 954 HG22 ILE 14 HG22 ILE 14 38.563 2.061 -1.367 955 HG23 ILE 14 HG23 ILE 14 39.024 3.348 -0.252 956 HD11 ILE 14 HD11 ILE 14 36.994 0.219 -0.079 957 HD12 ILE 14 HD12 ILE 14 37.608 0.020 1.561 958 HD13 ILE 14 HD13 ILE 14 38.641 0.715 0.312 959 H LEU 15 HN LEU 15 35.596 3.660 2.444 960 HA LEU 15 HA LEU 15 32.907 2.969 1.911 961 HB2 LEU 15 HB2 LEU 15 34.329 3.758 4.467 962 HB3 LEU 15 HB1 LEU 15 32.669 3.165 4.418 963 HG LEU 15 HG LEU 15 34.953 1.615 3.184 964 HD11 LEU 15 HD11 LEU 15 35.246 0.393 5.205 965 HD12 LEU 15 HD12 LEU 15 33.810 1.108 5.937 966 HD13 LEU 15 HD13 LEU 15 35.255 2.088 5.691 967 HD21 LEU 15 HD21 LEU 15 32.711 0.966 2.464 968 HD22 LEU 15 HD22 LEU 15 32.168 0.886 4.140 969 HD23 LEU 15 HD23 LEU 15 33.353 -0.274 3.539 970 H SER 16 HN SER 16 34.496 5.976 2.585 971 HA SER 16 HA SER 16 32.136 7.450 3.279 972 HB2 SER 16 HB2 SER 16 34.870 8.366 2.378 973 HB3 SER 16 HB1 SER 16 33.596 9.430 2.969 974 HG SER 16 HG SER 16 33.680 8.383 4.940 975 H ALA 17 HN ALA 17 34.116 7.105 0.347 976 HA ALA 17 HA ALA 17 32.714 8.907 -1.274 977 HB1 ALA 17 HB1 ALA 17 33.562 7.447 -3.177 978 HB2 ALA 17 HB2 ALA 17 34.222 6.371 -1.946 979 HB3 ALA 17 HB3 ALA 17 34.799 8.033 -2.065 980 H LEU 18 HN LEU 18 32.190 5.424 -0.724 981 HA LEU 18 HA LEU 18 29.928 5.289 -2.465 982 HB2 LEU 18 HB2 LEU 18 31.359 3.334 -1.867 983 HB3 LEU 18 HB1 LEU 18 30.689 3.396 -0.235 984 HG LEU 18 HG LEU 18 28.391 3.215 -1.271 985 HD11 LEU 18 HD11 LEU 18 30.093 2.765 -3.733 986 HD12 LEU 18 HD12 LEU 18 28.771 3.912 -3.526 987 HD13 LEU 18 HD13 LEU 18 28.432 2.186 -3.617 988 HD21 LEU 18 HD21 LEU 18 28.533 0.821 -1.524 989 HD22 LEU 18 HD22 LEU 18 29.717 1.293 -0.305 990 HD23 LEU 18 HD23 LEU 18 30.242 0.916 -1.946 991 H HIS 19 HN HIS 19 30.443 6.100 0.853 992 HA HIS 19 HA HIS 19 27.826 5.665 1.851 993 HB2 HIS 19 HB2 HIS 19 29.468 5.963 3.495 994 HB3 HIS 19 HB1 HIS 19 30.101 7.420 2.735 995 HD2 HIS 19 HD2 HIS 19 28.737 9.790 3.387 996 HE1 HIS 19 HE1 HIS 19 25.882 8.029 5.950 997 HE2 HIS 19 HE2 HIS 19 26.828 10.231 5.111 998 H PHE 20 HN PHE 20 29.389 8.630 0.664 999 HA PHE 20 HA PHE 20 26.950 10.143 0.811 1000 HB2 PHE 20 HB2 PHE 20 29.697 10.704 0.480 1001 HB3 PHE 20 HB1 PHE 20 28.888 11.305 -0.966 1002 HD1 PHE 20 HD1 PHE 20 29.266 11.666 2.658 1003 HD2 PHE 20 HD2 PHE 20 27.072 12.983 -0.793 1004 HE1 PHE 20 HE1 PHE 20 28.415 13.609 3.941 1005 HE2 PHE 20 HE2 PHE 20 26.219 14.926 0.492 1006 HZ PHE 20 HZ PHE 20 26.897 15.240 2.861 1007 H MET 21 HN MET 21 28.478 8.097 -1.550 1008 HA MET 21 HA MET 21 27.179 9.178 -3.849 1009 HB2 MET 21 HB2 MET 21 28.720 6.743 -3.173 1010 HB3 MET 21 HB1 MET 21 27.684 6.667 -4.595 1011 HG2 MET 21 HG2 MET 21 28.736 8.726 -5.468 1012 HG3 MET 21 HG1 MET 21 29.782 8.791 -4.049 1013 HE1 MET 21 HE1 MET 21 31.776 8.981 -5.646 1014 HE2 MET 21 HE2 MET 21 30.790 8.793 -7.093 1015 HE3 MET 21 HE3 MET 21 32.229 7.800 -6.882 1016 H ALA 22 HN ALA 22 26.597 6.151 -2.057 1017 HA ALA 22 HA ALA 22 24.144 5.561 -3.340 1018 HB1 ALA 22 HB1 ALA 22 25.491 4.576 -0.855 1019 HB2 ALA 22 HB2 ALA 22 25.109 3.704 -2.340 1020 HB3 ALA 22 HB3 ALA 22 23.827 4.105 -1.198 1021 H TRP 23 HN TRP 23 24.911 7.282 -0.352 1022 HA TRP 23 HA TRP 23 22.243 7.536 0.576 1023 HB2 TRP 23 HB2 TRP 23 24.308 7.884 1.950 1024 HB3 TRP 23 HB1 TRP 23 24.561 9.405 1.093 1025 HD1 TRP 23 HD1 TRP 23 21.417 7.786 2.687 1026 HE1 TRP 23 HE1 TRP 23 20.264 9.564 4.156 1027 HE3 TRP 23 HE3 TRP 23 24.639 11.697 2.034 1028 HZ2 TRP 23 HZ2 TRP 23 20.657 12.284 4.948 1029 HZ3 TRP 23 HZ3 TRP 23 24.222 13.869 3.154 1030 HH2 TRP 23 HH2 TRP 23 22.237 14.167 4.608 1031 H THR 24 HN THR 24 24.288 9.609 -1.474 1032 HA THR 24 HA THR 24 22.507 11.806 -1.628 1033 HB THR 24 HB THR 24 24.708 10.832 -3.439 1034 HG1 THR 24 HG1 THR 24 25.093 11.771 -1.305 1035 HG21 THR 24 HG21 THR 24 23.225 12.004 -4.899 1036 HG22 THR 24 HG22 THR 24 24.494 13.148 -4.466 1037 HG23 THR 24 HG23 THR 24 22.913 13.250 -3.693 1038 H ILE 25 HN ILE 25 23.047 9.097 -3.891 1039 HA ILE 25 HA ILE 25 21.095 9.861 -5.759 1040 HB ILE 25 HB ILE 25 21.125 7.493 -6.486 1041 HG12 ILE 25 HG12 ILE 25 22.897 7.094 -4.052 1042 HG13 ILE 25 HG11 ILE 25 21.258 6.481 -4.207 1043 HG21 ILE 25 HG21 ILE 25 23.855 8.588 -5.749 1044 HG22 ILE 25 HG22 ILE 25 22.919 9.074 -7.159 1045 HG23 ILE 25 HG23 ILE 25 23.519 7.422 -7.027 1046 HD11 ILE 25 HD11 ILE 25 22.675 4.666 -4.787 1047 HD12 ILE 25 HD12 ILE 25 23.674 5.688 -5.820 1048 HD13 ILE 25 HD13 ILE 25 22.028 5.282 -6.309 1049 H GLY 26 HN GLY 26 20.823 7.865 -2.823 1050 HA2 GLY 26 HA2 GLY 26 18.134 7.081 -3.200 1051 HA3 GLY 26 HA1 GLY 26 18.981 7.131 -1.657 1052 H HIS 27 HN HIS 27 19.590 9.840 -1.515 1053 HA HIS 27 HA HIS 27 17.259 10.920 -0.409 1054 HB2 HIS 27 HB2 HIS 27 19.358 11.774 0.319 1055 HB3 HIS 27 HB1 HIS 27 19.835 12.199 -1.325 1056 HD2 HIS 27 HD2 HIS 27 19.077 14.746 -2.104 1057 HE1 HIS 27 HE1 HIS 27 16.441 15.565 1.092 1058 HE2 HIS 27 HE2 HIS 27 17.562 16.544 -0.967 1059 H LEU 28 HN LEU 28 18.775 11.461 -3.570 1060 HA LEU 28 HA LEU 28 17.059 13.483 -4.489 1061 HB2 LEU 28 HB2 LEU 28 18.508 11.320 -6.033 1062 HB3 LEU 28 HB1 LEU 28 17.761 12.745 -6.758 1063 HG LEU 28 HG LEU 28 19.870 12.897 -4.593 1064 HD11 LEU 28 HD11 LEU 28 20.754 11.819 -6.659 1065 HD12 LEU 28 HD12 LEU 28 21.469 13.406 -6.372 1066 HD13 LEU 28 HD13 LEU 28 20.208 13.214 -7.591 1067 HD21 LEU 28 HD21 LEU 28 18.582 14.908 -4.697 1068 HD22 LEU 28 HD22 LEU 28 18.567 14.890 -6.461 1069 HD23 LEU 28 HD23 LEU 28 20.063 15.240 -5.594 1070 H ASN 29 HN ASN 29 15.105 13.476 -5.517 1071 HA ASN 29 HA ASN 29 13.587 10.956 -5.399 1072 HB2 ASN 29 HB2 ASN 29 12.719 13.010 -4.236 1073 HB3 ASN 29 HB1 ASN 29 12.540 13.761 -5.821 1074 HD21 ASN 29 HD21 ASN 29 10.261 13.774 -6.035 1075 HD22 ASN 29 HD22 ASN 29 9.305 12.373 -5.977 1076 H GLN 30 HN GLN 30 13.397 9.842 -7.226 1077 HA GLN 30 HA GLN 30 13.349 11.331 -9.782 1078 HB2 GLN 30 HB2 GLN 30 14.427 8.561 -9.204 1079 HB3 GLN 30 HB1 GLN 30 14.287 9.270 -10.813 1080 HG2 GLN 30 HG2 GLN 30 15.711 11.188 -10.002 1081 HG3 GLN 30 HG1 GLN 30 15.977 10.282 -8.513 1082 HE21 GLN 30 HE21 GLN 30 18.249 9.891 -8.887 1083 HE22 GLN 30 HE22 GLN 30 18.797 8.892 -10.145 1084 H ILE 31 HN ILE 31 11.533 11.174 -10.914 1085 HA ILE 31 HA ILE 31 9.803 8.816 -10.515 1086 HB ILE 31 HB ILE 31 8.894 11.703 -10.631 1087 HG12 ILE 31 HG12 ILE 31 8.577 9.677 -8.402 1088 HG13 ILE 31 HG11 ILE 31 9.917 10.821 -8.462 1089 HG21 ILE 31 HG21 ILE 31 6.649 10.621 -10.150 1090 HG22 ILE 31 HG22 ILE 31 7.399 9.069 -10.530 1091 HG23 ILE 31 HG23 ILE 31 7.282 10.319 -11.769 1092 HD11 ILE 31 HD11 ILE 31 8.474 12.692 -8.259 1093 HD12 ILE 31 HD12 ILE 31 7.838 11.520 -7.105 1094 HD13 ILE 31 HD13 ILE 31 7.046 11.741 -8.663 1095 H LYS 32 HN LYS 32 9.068 7.923 -12.360 1096 HA LYS 32 HA LYS 32 9.950 9.023 -14.884 1097 HB2 LYS 32 HB2 LYS 32 8.311 6.566 -14.223 1098 HB3 LYS 32 HB1 LYS 32 8.890 6.981 -15.835 1099 HG2 LYS 32 HG2 LYS 32 11.230 7.010 -14.907 1100 HG3 LYS 32 HG1 LYS 32 10.579 6.390 -13.391 1101 HD2 LYS 32 HD2 LYS 32 9.668 4.427 -14.592 1102 HD3 LYS 32 HD1 LYS 32 10.355 5.039 -16.096 1103 HE2 LYS 32 HE2 LYS 32 11.945 3.463 -15.286 1104 HE3 LYS 32 HE1 LYS 32 12.614 5.044 -14.884 1105 HZ1 LYS 32 HZ1 LYS 32 11.223 4.625 -12.703 1106 HZ2 LYS 32 HZ2 LYS 32 12.806 4.036 -12.878 1107 HZ3 LYS 32 HZ3 LYS 32 11.480 3.004 -13.128 1108 H ARG 33 HN ARG 33 8.842 10.801 -15.504 1109 HA ARG 33 HA ARG 33 5.901 10.767 -15.372 1110 HB2 ARG 33 HB2 ARG 33 6.039 13.170 -15.793 1111 HB3 ARG 33 HB1 ARG 33 7.078 12.735 -14.434 1112 HG2 ARG 33 HG2 ARG 33 9.025 12.659 -15.970 1113 HG3 ARG 33 HG1 ARG 33 7.979 13.159 -17.299 1114 HD2 ARG 33 HD2 ARG 33 8.358 14.751 -14.753 1115 HD3 ARG 33 HD1 ARG 33 9.256 15.048 -16.238 1116 HE ARG 33 HE ARG 33 6.533 15.079 -16.885 1117 HH11 ARG 33 HH11 ARG 33 8.807 16.865 -14.931 1118 HH12 ARG 33 HH12 ARG 33 7.953 18.359 -15.087 1119 HH21 ARG 33 HH21 ARG 33 5.438 17.050 -17.071 1120 HH22 ARG 33 HH22 ARG 33 6.059 18.466 -16.290 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 53.898 27.365 12.363 2 H2 MET 1 HT2 MET 1 53.823 27.452 10.668 3 H3 MET 1 HT3 MET 1 54.347 26.024 11.426 4 HA MET 1 HA MET 1 52.255 25.328 11.148 5 HB2 MET 1 HB2 MET 1 52.580 26.050 13.638 6 HB3 MET 1 HB1 MET 1 51.455 27.346 13.231 7 HG2 MET 1 HG2 MET 1 50.099 25.295 12.162 8 HG3 MET 1 HG1 MET 1 50.979 24.408 13.406 9 HE1 MET 1 HE1 MET 1 49.329 28.146 13.313 10 HE2 MET 1 HE2 MET 1 47.735 27.550 13.768 11 HE3 MET 1 HE3 MET 1 48.539 26.896 12.343 12 H PHE 2 HN PHE 2 51.181 25.776 9.322 13 HA PHE 2 HA PHE 2 50.248 28.520 8.829 14 HB2 PHE 2 HB2 PHE 2 51.510 27.399 7.027 15 HB3 PHE 2 HB1 PHE 2 50.299 26.118 6.990 16 HD1 PHE 2 HD1 PHE 2 50.703 29.815 6.639 17 HD2 PHE 2 HD2 PHE 2 48.337 26.357 5.700 18 HE1 PHE 2 HE1 PHE 2 49.303 31.186 5.119 19 HE2 PHE 2 HE2 PHE 2 46.935 27.727 4.180 20 HZ PHE 2 HZ PHE 2 47.419 30.142 3.889 21 H GLU 3 HN GLU 3 49.037 25.168 8.751 22 HA GLU 3 HA GLU 3 46.300 26.164 8.756 23 HB2 GLU 3 HB2 GLU 3 47.392 23.354 8.571 24 HB3 GLU 3 HB1 GLU 3 45.682 23.769 8.491 25 HG2 GLU 3 HG2 GLU 3 46.098 23.831 6.244 26 HG3 GLU 3 HG1 GLU 3 46.639 25.467 6.621 27 HA PRO 4 HA PRO 4 45.424 25.643 13.045 28 HB2 PRO 4 HB2 PRO 4 43.156 23.846 12.325 29 HB3 PRO 4 HB1 PRO 4 43.151 25.351 13.265 30 HG2 PRO 4 HG2 PRO 4 42.207 25.288 10.791 31 HG3 PRO 4 HG1 PRO 4 43.124 26.681 11.388 32 HD2 PRO 4 HD2 PRO 4 44.031 24.485 9.552 33 HD3 PRO 4 HD1 PRO 4 44.420 26.219 9.521 34 H PHE 5 HN PHE 5 45.149 22.651 11.140 35 HA PHE 5 HA PHE 5 46.700 21.235 13.193 36 HB2 PHE 5 HB2 PHE 5 43.886 20.685 12.444 37 HB3 PHE 5 HB1 PHE 5 44.946 19.279 12.546 38 HD1 PHE 5 HD1 PHE 5 43.581 22.172 14.416 39 HD2 PHE 5 HD2 PHE 5 45.838 18.525 14.646 40 HE1 PHE 5 HE1 PHE 5 43.442 22.242 16.891 41 HE2 PHE 5 HE2 PHE 5 45.701 18.596 17.121 42 HZ PHE 5 HZ PHE 5 44.503 20.454 18.242 43 H GLN 6 HN GLN 6 44.872 19.945 10.459 44 HA GLN 6 HA GLN 6 47.283 19.701 8.836 45 HB2 GLN 6 HB2 GLN 6 46.017 17.456 10.282 46 HB3 GLN 6 HB1 GLN 6 46.359 17.157 8.579 47 HG2 GLN 6 HG2 GLN 6 48.389 18.254 10.545 48 HG3 GLN 6 HG1 GLN 6 48.258 16.550 10.111 49 HE21 GLN 6 HE21 GLN 6 48.787 15.945 7.862 50 HE22 GLN 6 HE22 GLN 6 49.709 16.985 6.886 51 H ILE 7 HN ILE 7 46.745 18.682 6.692 52 HA ILE 7 HA ILE 7 44.643 20.075 5.450 53 HB ILE 7 HB ILE 7 46.246 17.663 4.574 54 HG12 ILE 7 HG12 ILE 7 46.335 20.527 3.596 55 HG13 ILE 7 HG11 ILE 7 47.343 19.949 4.923 56 HG21 ILE 7 HG21 ILE 7 44.155 19.290 3.114 57 HG22 ILE 7 HG22 ILE 7 44.219 17.539 3.319 58 HG23 ILE 7 HG23 ILE 7 45.382 18.347 2.267 59 HD11 ILE 7 HD11 ILE 7 47.351 19.023 2.043 60 HD12 ILE 7 HD12 ILE 7 48.120 18.097 3.335 61 HD13 ILE 7 HD13 ILE 7 48.683 19.726 2.962 62 H LEU 8 HN LEU 8 44.873 16.745 6.603 63 HA LEU 8 HA LEU 8 42.374 15.845 5.608 64 HB2 LEU 8 HB2 LEU 8 44.245 14.374 6.434 65 HB3 LEU 8 HB1 LEU 8 43.799 14.837 8.077 66 HG LEU 8 HG LEU 8 41.526 13.964 6.422 67 HD11 LEU 8 HD11 LEU 8 43.570 11.907 7.302 68 HD12 LEU 8 HD12 LEU 8 43.410 12.468 5.637 69 HD13 LEU 8 HD13 LEU 8 42.075 11.617 6.414 70 HD21 LEU 8 HD21 LEU 8 40.996 12.738 8.491 71 HD22 LEU 8 HD22 LEU 8 41.418 14.411 8.859 72 HD23 LEU 8 HD23 LEU 8 42.592 13.123 9.139 73 H SER 9 HN SER 9 43.339 17.500 8.530 74 HA SER 9 HA SER 9 40.839 17.200 9.917 75 HB2 SER 9 HB2 SER 9 43.126 19.136 10.306 76 HB3 SER 9 HB1 SER 9 41.734 19.025 11.378 77 HG SER 9 HG SER 9 43.660 17.736 11.938 78 H ILE 10 HN ILE 10 42.277 19.715 7.865 79 HA ILE 10 HA ILE 10 40.214 21.628 8.199 80 HB ILE 10 HB ILE 10 42.297 21.186 6.071 81 HG12 ILE 10 HG12 ILE 10 42.756 22.103 8.453 82 HG13 ILE 10 HG11 ILE 10 43.388 23.022 7.088 83 HG21 ILE 10 HG21 ILE 10 40.535 22.164 4.822 84 HG22 ILE 10 HG22 ILE 10 41.548 23.526 5.294 85 HG23 ILE 10 HG23 ILE 10 40.044 23.203 6.159 86 HD11 ILE 10 HD11 ILE 10 40.648 23.664 8.171 87 HD12 ILE 10 HD12 ILE 10 41.777 24.706 7.309 88 HD13 ILE 10 HD13 ILE 10 42.082 24.275 8.985 89 H CYS 11 HN CYS 11 40.735 19.072 5.777 90 HA CYS 11 HA CYS 11 38.542 19.707 4.136 91 HB2 CYS 11 HB2 CYS 11 39.950 17.094 4.699 92 HB3 CYS 11 HB1 CYS 11 38.680 17.262 3.487 93 HG CYS 11 HG CYS 11 41.075 19.212 3.241 94 H SER 12 HN SER 12 38.794 17.335 6.809 95 HA SER 12 HA SER 12 36.130 16.496 6.746 96 HB2 SER 12 HB2 SER 12 38.077 16.684 9.052 97 HB3 SER 12 HB1 SER 12 36.503 15.899 9.165 98 HG SER 12 HG SER 12 38.776 14.924 8.199 99 H PHE 13 HN PHE 13 37.621 19.263 8.355 100 HA PHE 13 HA PHE 13 35.436 20.066 9.926 101 HB2 PHE 13 HB2 PHE 13 37.991 21.132 9.128 102 HB3 PHE 13 HB1 PHE 13 36.763 22.396 9.046 103 HD1 PHE 13 HD1 PHE 13 38.914 20.528 11.206 104 HD2 PHE 13 HD2 PHE 13 35.152 22.597 11.073 105 HE1 PHE 13 HE1 PHE 13 38.933 20.724 13.679 106 HE2 PHE 13 HE2 PHE 13 35.170 22.792 13.543 107 HZ PHE 13 HZ PHE 13 37.060 21.856 14.848 108 H ILE 14 HN ILE 14 36.398 21.126 6.649 109 HA ILE 14 HA ILE 14 34.197 22.857 6.246 110 HB ILE 14 HB ILE 14 35.964 21.402 4.263 111 HG12 ILE 14 HG12 ILE 14 36.013 24.311 5.104 112 HG13 ILE 14 HG11 ILE 14 36.976 23.083 5.924 113 HG21 ILE 14 HG21 ILE 14 35.158 23.283 2.739 114 HG22 ILE 14 HG22 ILE 14 33.900 23.593 3.937 115 HG23 ILE 14 HG23 ILE 14 33.963 22.039 3.106 116 HD11 ILE 14 HD11 ILE 14 37.838 22.463 3.558 117 HD12 ILE 14 HD12 ILE 14 38.444 23.948 4.288 118 HD13 ILE 14 HD13 ILE 14 37.178 24.022 3.064 119 H LEU 15 HN LEU 15 34.747 19.448 5.485 120 HA LEU 15 HA LEU 15 32.392 19.019 3.992 121 HB2 LEU 15 HB2 LEU 15 34.174 17.201 5.596 122 HB3 LEU 15 HB1 LEU 15 32.709 16.593 4.823 123 HG LEU 15 HG LEU 15 34.784 18.185 3.310 124 HD11 LEU 15 HD11 LEU 15 35.501 15.906 2.444 125 HD12 LEU 15 HD12 LEU 15 34.591 15.202 3.781 126 HD13 LEU 15 HD13 LEU 15 35.966 16.256 4.108 127 HD21 LEU 15 HD21 LEU 15 33.689 16.858 1.407 128 HD22 LEU 15 HD22 LEU 15 32.687 18.095 2.158 129 HD23 LEU 15 HD23 LEU 15 32.451 16.398 2.574 130 H SER 16 HN SER 16 33.012 18.033 7.358 131 HA SER 16 HA SER 16 30.507 17.299 8.130 132 HB2 SER 16 HB2 SER 16 32.476 18.907 9.774 133 HB3 SER 16 HB1 SER 16 31.102 18.019 10.424 134 HG SER 16 HG SER 16 33.246 16.936 10.356 135 H ALA 17 HN ALA 17 31.767 20.613 7.931 136 HA ALA 17 HA ALA 17 29.581 21.958 9.050 137 HB1 ALA 17 HB1 ALA 17 31.741 23.026 8.478 138 HB2 ALA 17 HB2 ALA 17 30.373 23.907 7.799 139 HB3 ALA 17 HB3 ALA 17 31.350 22.866 6.766 140 H LEU 18 HN LEU 18 30.249 21.520 5.555 141 HA LEU 18 HA LEU 18 27.685 22.372 4.710 142 HB2 LEU 18 HB2 LEU 18 30.012 21.000 3.485 143 HB3 LEU 18 HB1 LEU 18 28.461 20.771 2.678 144 HG LEU 18 HG LEU 18 29.821 22.777 1.901 145 HD11 LEU 18 HD11 LEU 18 27.128 23.523 3.063 146 HD12 LEU 18 HD12 LEU 18 27.292 22.445 1.677 147 HD13 LEU 18 HD13 LEU 18 27.871 24.106 1.574 148 HD21 LEU 18 HD21 LEU 18 30.062 24.666 3.288 149 HD22 LEU 18 HD22 LEU 18 30.413 23.334 4.387 150 HD23 LEU 18 HD23 LEU 18 28.831 24.115 4.425 151 H HIS 19 HN HIS 19 28.762 19.430 6.078 152 HA HIS 19 HA HIS 19 26.852 17.675 4.940 153 HB2 HIS 19 HB2 HIS 19 29.028 17.064 6.143 154 HB3 HIS 19 HB1 HIS 19 28.141 17.336 7.643 155 HD2 HIS 19 HD2 HIS 19 25.281 15.907 6.733 156 HE1 HIS 19 HE1 HIS 19 27.671 12.493 6.057 157 HE2 HIS 19 HE2 HIS 19 25.293 13.318 6.399 158 H PHE 20 HN PHE 20 26.996 19.407 8.046 159 HA PHE 20 HA PHE 20 24.397 18.492 8.838 160 HB2 PHE 20 HB2 PHE 20 26.574 19.905 10.034 161 HB3 PHE 20 HB1 PHE 20 25.102 20.852 10.252 162 HD1 PHE 20 HD1 PHE 20 26.976 18.004 11.375 163 HD2 PHE 20 HD2 PHE 20 23.004 19.617 11.103 164 HE1 PHE 20 HE1 PHE 20 26.217 16.437 13.144 165 HE2 PHE 20 HE2 PHE 20 22.247 18.052 12.870 166 HZ PHE 20 HZ PHE 20 23.845 16.462 13.888 167 H MET 21 HN MET 21 25.615 21.122 6.917 168 HA MET 21 HA MET 21 23.398 22.885 7.265 169 HB2 MET 21 HB2 MET 21 25.497 22.607 5.111 170 HB3 MET 21 HB1 MET 21 24.285 23.891 5.127 171 HG2 MET 21 HG2 MET 21 26.076 23.340 7.494 172 HG3 MET 21 HG1 MET 21 26.530 24.462 6.214 173 HE1 MET 21 HE1 MET 21 24.385 26.067 5.269 174 HE2 MET 21 HE2 MET 21 25.815 26.780 6.012 175 HE3 MET 21 HE3 MET 21 24.215 27.379 6.444 176 H ALA 22 HN ALA 22 24.287 20.707 4.586 177 HA ALA 22 HA ALA 22 21.825 21.072 3.199 178 HB1 ALA 22 HB1 ALA 22 23.576 18.650 2.897 179 HB2 ALA 22 HB2 ALA 22 24.079 20.225 2.285 180 HB3 ALA 22 HB3 ALA 22 22.606 19.470 1.674 181 H TRP 23 HN TRP 23 22.972 18.648 5.505 182 HA TRP 23 HA TRP 23 20.826 16.839 5.230 183 HB2 TRP 23 HB2 TRP 23 23.100 16.627 6.500 184 HB3 TRP 23 HB1 TRP 23 22.191 17.271 7.862 185 HD1 TRP 23 HD1 TRP 23 22.778 14.187 5.849 186 HE1 TRP 23 HE1 TRP 23 21.311 12.264 6.738 187 HE3 TRP 23 HE3 TRP 23 19.725 16.795 9.008 188 HZ2 TRP 23 HZ2 TRP 23 19.129 11.882 8.547 189 HZ3 TRP 23 HZ3 TRP 23 17.963 15.626 10.301 190 HH2 TRP 23 HH2 TRP 23 17.661 13.174 10.074 191 H THR 24 HN THR 24 21.266 19.696 7.292 192 HA THR 24 HA THR 24 18.857 19.347 8.777 193 HB THR 24 HB THR 24 19.185 21.830 9.263 194 HG1 THR 24 HG1 THR 24 20.615 22.834 8.132 195 HG21 THR 24 HG21 THR 24 20.029 20.377 10.901 196 HG22 THR 24 HG22 THR 24 21.444 21.328 10.452 197 HG23 THR 24 HG23 THR 24 21.241 19.698 9.814 198 H ILE 25 HN ILE 25 19.673 21.094 5.794 199 HA ILE 25 HA ILE 25 17.208 22.445 5.502 200 HB ILE 25 HB ILE 25 19.265 21.522 3.495 201 HG12 ILE 25 HG12 ILE 25 18.592 24.316 4.445 202 HG13 ILE 25 HG11 ILE 25 19.787 23.308 5.261 203 HG21 ILE 25 HG21 ILE 25 16.717 23.112 3.137 204 HG22 ILE 25 HG22 ILE 25 17.269 21.709 2.220 205 HG23 ILE 25 HG23 ILE 25 18.075 23.264 2.021 206 HD11 ILE 25 HD11 ILE 25 20.877 23.023 2.945 207 HD12 ILE 25 HD12 ILE 25 21.045 24.599 3.717 208 HD13 ILE 25 HD13 ILE 25 19.858 24.369 2.432 209 H GLY 26 HN GLY 26 18.342 19.306 4.266 210 HA2 GLY 26 HA2 GLY 26 15.999 18.643 2.825 211 HA3 GLY 26 HA1 GLY 26 17.193 17.492 3.418 212 H HIS 27 HN HIS 27 16.995 18.014 6.170 213 HA HIS 27 HA HIS 27 14.904 16.335 6.944 214 HB2 HIS 27 HB2 HIS 27 16.781 16.638 8.405 215 HB3 HIS 27 HB1 HIS 27 16.498 18.376 8.506 216 HD2 HIS 27 HD2 HIS 27 14.746 19.127 10.520 217 HE1 HIS 27 HE1 HIS 27 13.302 15.280 11.487 218 HE2 HIS 27 HE2 HIS 27 13.252 17.732 12.145 219 H LEU 28 HN LEU 28 15.117 19.886 6.955 220 HA LEU 28 HA LEU 28 12.448 20.194 8.007 221 HB2 LEU 28 HB2 LEU 28 14.486 21.820 8.175 222 HB3 LEU 28 HB1 LEU 28 13.950 22.369 6.586 223 HG LEU 28 HG LEU 28 11.804 22.087 8.602 224 HD11 LEU 28 HD11 LEU 28 13.752 24.395 8.800 225 HD12 LEU 28 HD12 LEU 28 13.797 23.007 9.886 226 HD13 LEU 28 HD13 LEU 28 12.378 24.055 9.851 227 HD21 LEU 28 HD21 LEU 28 12.565 24.422 6.831 228 HD22 LEU 28 HD22 LEU 28 10.981 24.059 7.516 229 HD23 LEU 28 HD23 LEU 28 11.644 23.040 6.238 230 H ASN 29 HN ASN 29 10.656 19.918 6.850 231 HA ASN 29 HA ASN 29 10.770 20.395 3.931 232 HB2 ASN 29 HB2 ASN 29 8.957 18.515 5.461 233 HB3 ASN 29 HB1 ASN 29 8.976 18.743 3.713 234 HD21 ASN 29 HD21 ASN 29 11.566 18.634 2.952 235 HD22 ASN 29 HD22 ASN 29 12.322 17.207 3.476 236 H GLN 30 HN GLN 30 9.190 21.621 2.982 237 HA GLN 30 HA GLN 30 7.369 23.032 4.834 238 HB2 GLN 30 HB2 GLN 30 8.734 23.858 2.284 239 HB3 GLN 30 HB1 GLN 30 7.286 24.695 2.844 240 HG2 GLN 30 HG2 GLN 30 9.739 24.263 4.567 241 HG3 GLN 30 HG1 GLN 30 9.454 25.728 3.628 242 HE21 GLN 30 HE21 GLN 30 7.494 27.027 4.209 243 HE22 GLN 30 HE22 GLN 30 6.855 26.911 5.777 244 H ILE 31 HN ILE 31 5.309 22.458 4.716 245 HA ILE 31 HA ILE 31 4.296 21.311 2.187 246 HB ILE 31 HB ILE 31 3.404 20.876 5.045 247 HG12 ILE 31 HG12 ILE 31 4.372 18.840 3.033 248 HG13 ILE 31 HG11 ILE 31 5.496 19.705 4.083 249 HG21 ILE 31 HG21 ILE 31 1.863 19.177 3.913 250 HG22 ILE 31 HG22 ILE 31 2.214 20.012 2.401 251 HG23 ILE 31 HG23 ILE 31 1.417 20.871 3.719 252 HD11 ILE 31 HD11 ILE 31 4.703 17.471 4.984 253 HD12 ILE 31 HD12 ILE 31 3.095 18.181 5.126 254 HD13 ILE 31 HD13 ILE 31 4.436 18.842 6.060 255 H LYS 32 HN LYS 32 2.783 22.406 1.120 256 HA LYS 32 HA LYS 32 1.263 24.488 2.575 257 HB2 LYS 32 HB2 LYS 32 2.480 24.558 -0.189 258 HB3 LYS 32 HB1 LYS 32 1.234 25.693 0.333 259 HG2 LYS 32 HG2 LYS 32 2.623 26.558 2.080 260 HG3 LYS 32 HG1 LYS 32 3.791 25.250 1.891 261 HD2 LYS 32 HD2 LYS 32 4.728 27.183 0.809 262 HD3 LYS 32 HD1 LYS 32 4.192 26.089 -0.467 263 HE2 LYS 32 HE2 LYS 32 3.470 28.360 -1.001 264 HE3 LYS 32 HE1 LYS 32 2.061 27.369 -0.631 265 HZ1 LYS 32 HZ1 LYS 32 1.537 28.755 0.995 266 HZ2 LYS 32 HZ2 LYS 32 2.862 29.739 0.598 267 HZ3 LYS 32 HZ3 LYS 32 3.033 28.508 1.756 268 H ARG 33 HN ARG 33 -0.802 23.907 2.708 269 HA ARG 33 HA ARG 33 -1.958 22.217 0.592 270 HB2 ARG 33 HB2 ARG 33 -2.936 22.848 3.388 271 HB3 ARG 33 HB1 ARG 33 -3.771 21.806 2.237 272 HG2 ARG 33 HG2 ARG 33 -1.853 20.295 2.163 273 HG3 ARG 33 HG1 ARG 33 -0.947 21.355 3.243 274 HD2 ARG 33 HD2 ARG 33 -1.881 19.549 4.555 275 HD3 ARG 33 HD1 ARG 33 -2.733 21.023 4.974 276 HE ARG 33 HE ARG 33 -3.787 18.762 3.423 277 HH11 ARG 33 HH11 ARG 33 -4.303 21.965 4.736 278 HH12 ARG 33 HH12 ARG 33 -6.017 21.869 4.580 279 HH21 ARG 33 HH21 ARG 33 -6.018 18.693 3.227 280 HH22 ARG 33 HH22 ARG 33 -6.983 20.040 3.728 281 H1 MET 1 HT1 MET 1 47.200 17.015 33.292 282 H2 MET 1 HT2 MET 1 46.567 18.584 33.138 283 H3 MET 1 HT3 MET 1 47.682 17.999 31.998 284 HA MET 1 HA MET 1 45.893 17.522 30.769 285 HB2 MET 1 HB2 MET 1 46.782 15.320 31.862 286 HB3 MET 1 HB1 MET 1 45.270 15.363 32.769 287 HG2 MET 1 HG2 MET 1 44.276 15.830 30.324 288 HG3 MET 1 HG1 MET 1 45.719 14.932 29.853 289 HE1 MET 1 HE1 MET 1 43.152 14.585 33.014 290 HE2 MET 1 HE2 MET 1 42.019 13.592 32.101 291 HE3 MET 1 HE3 MET 1 42.473 15.183 31.494 292 H PHE 2 HN PHE 2 44.214 18.887 30.698 293 HA PHE 2 HA PHE 2 42.444 19.125 33.033 294 HB2 PHE 2 HB2 PHE 2 43.323 21.210 32.046 295 HB3 PHE 2 HB1 PHE 2 42.572 20.785 30.508 296 HD1 PHE 2 HD1 PHE 2 41.794 21.383 34.112 297 HD2 PHE 2 HD2 PHE 2 40.316 21.333 30.080 298 HE1 PHE 2 HE1 PHE 2 39.658 22.378 34.883 299 HE2 PHE 2 HE2 PHE 2 38.179 22.328 30.850 300 HZ PHE 2 HZ PHE 2 37.850 22.851 33.252 301 H GLU 3 HN GLU 3 42.262 18.659 29.505 302 HA GLU 3 HA GLU 3 39.505 17.755 29.774 303 HB2 GLU 3 HB2 GLU 3 41.219 18.207 27.327 304 HB3 GLU 3 HB1 GLU 3 39.530 17.710 27.287 305 HG2 GLU 3 HG2 GLU 3 39.170 19.964 27.166 306 HG3 GLU 3 HG1 GLU 3 39.322 19.853 28.918 307 HA PRO 4 HA PRO 4 40.230 13.413 29.596 308 HB2 PRO 4 HB2 PRO 4 38.450 13.249 27.211 309 HB3 PRO 4 HB1 PRO 4 38.324 12.417 28.773 310 HG2 PRO 4 HG2 PRO 4 36.697 14.413 28.159 311 HG3 PRO 4 HG1 PRO 4 37.327 14.216 29.804 312 HD2 PRO 4 HD2 PRO 4 38.177 16.176 27.691 313 HD3 PRO 4 HD1 PRO 4 38.035 16.397 29.449 314 H PHE 5 HN PHE 5 40.211 15.005 26.415 315 HA PHE 5 HA PHE 5 42.666 13.559 25.706 316 HB2 PHE 5 HB2 PHE 5 40.033 13.279 24.378 317 HB3 PHE 5 HB1 PHE 5 41.417 13.497 23.307 318 HD1 PHE 5 HD1 PHE 5 39.972 11.376 25.979 319 HD2 PHE 5 HD2 PHE 5 43.109 11.804 23.077 320 HE1 PHE 5 HE1 PHE 5 40.618 9.008 26.329 321 HE2 PHE 5 HE2 PHE 5 43.756 9.436 23.427 322 HZ PHE 5 HZ PHE 5 42.511 8.037 25.053 323 H GLN 6 HN GLN 6 40.498 15.452 23.661 324 HA GLN 6 HA GLN 6 42.228 17.794 23.827 325 HB2 GLN 6 HB2 GLN 6 42.173 15.924 21.538 326 HB3 GLN 6 HB1 GLN 6 42.022 17.631 21.120 327 HG2 GLN 6 HG2 GLN 6 44.180 16.519 22.936 328 HG3 GLN 6 HG1 GLN 6 44.402 16.821 21.212 329 HE21 GLN 6 HE21 GLN 6 44.329 19.093 20.479 330 HE22 GLN 6 HE22 GLN 6 44.559 20.360 21.583 331 H ILE 7 HN ILE 7 41.338 19.588 22.441 332 HA ILE 7 HA ILE 7 38.650 20.080 23.091 333 HB ILE 7 HB ILE 7 40.493 21.372 21.073 334 HG12 ILE 7 HG12 ILE 7 39.457 22.419 23.719 335 HG13 ILE 7 HG11 ILE 7 40.954 21.497 23.588 336 HG21 ILE 7 HG21 ILE 7 37.677 22.082 21.921 337 HG22 ILE 7 HG22 ILE 7 38.291 21.851 20.284 338 HG23 ILE 7 HG23 ILE 7 38.780 23.265 21.217 339 HD11 ILE 7 HD11 ILE 7 40.305 24.173 22.334 340 HD12 ILE 7 HD12 ILE 7 41.673 23.189 21.807 341 HD13 ILE 7 HD13 ILE 7 41.605 23.790 23.463 342 H LEU 8 HN LEU 8 40.158 18.962 20.102 343 HA LEU 8 HA LEU 8 37.831 19.007 18.482 344 HB2 LEU 8 HB2 LEU 8 40.199 18.822 17.647 345 HB3 LEU 8 HB1 LEU 8 40.192 17.143 18.187 346 HG LEU 8 HG LEU 8 37.849 17.888 16.569 347 HD11 LEU 8 HD11 LEU 8 40.556 17.690 15.221 348 HD12 LEU 8 HD12 LEU 8 39.723 19.217 15.506 349 HD13 LEU 8 HD13 LEU 8 38.999 18.003 14.452 350 HD21 LEU 8 HD21 LEU 8 38.376 15.721 15.522 351 HD22 LEU 8 HD22 LEU 8 38.404 15.579 17.279 352 HD23 LEU 8 HD23 LEU 8 39.917 15.672 16.377 353 H SER 9 HN SER 9 39.174 16.655 20.687 354 HA SER 9 HA SER 9 37.440 14.484 19.947 355 HB2 SER 9 HB2 SER 9 39.094 14.969 22.427 356 HB3 SER 9 HB1 SER 9 38.205 13.484 22.109 357 HG SER 9 HG SER 9 40.490 13.573 21.426 358 H ILE 10 HN ILE 10 37.382 16.992 22.459 359 HA ILE 10 HA ILE 10 35.086 16.038 23.819 360 HB ILE 10 HB ILE 10 36.416 18.734 23.647 361 HG12 ILE 10 HG12 ILE 10 37.336 16.686 24.947 362 HG13 ILE 10 HG11 ILE 10 37.213 18.217 25.814 363 HG21 ILE 10 HG21 ILE 10 34.148 19.338 23.984 364 HG22 ILE 10 HG22 ILE 10 34.834 19.287 25.606 365 HG23 ILE 10 HG23 ILE 10 33.840 17.950 25.027 366 HD11 ILE 10 HD11 ILE 10 34.902 16.282 25.877 367 HD12 ILE 10 HD12 ILE 10 35.354 17.514 27.050 368 HD13 ILE 10 HD13 ILE 10 36.288 16.031 26.929 369 H CYS 11 HN CYS 11 35.498 18.402 21.189 370 HA CYS 11 HA CYS 11 32.811 19.213 21.037 371 HB2 CYS 11 HB2 CYS 11 34.997 19.076 18.957 372 HB3 CYS 11 HB1 CYS 11 33.413 19.783 18.643 373 HG CYS 11 HG CYS 11 34.956 20.905 21.085 374 H SER 12 HN SER 12 34.557 16.706 19.165 375 HA SER 12 HA SER 12 32.362 15.823 17.683 376 HB2 SER 12 HB2 SER 12 34.808 14.334 18.647 377 HB3 SER 12 HB1 SER 12 33.640 13.660 17.514 378 HG SER 12 HG SER 12 35.662 15.309 17.025 379 H PHE 13 HN PHE 13 33.450 14.924 20.917 380 HA PHE 13 HA PHE 13 31.751 12.727 21.339 381 HB2 PHE 13 HB2 PHE 13 33.509 14.387 22.903 382 HB3 PHE 13 HB1 PHE 13 32.017 14.087 23.795 383 HD1 PHE 13 HD1 PHE 13 35.177 12.731 22.817 384 HD2 PHE 13 HD2 PHE 13 31.152 11.640 23.844 385 HE1 PHE 13 HE1 PHE 13 35.932 10.422 23.325 386 HE2 PHE 13 HE2 PHE 13 31.905 9.334 24.350 387 HZ PHE 13 HZ PHE 13 34.295 8.724 24.091 388 H ILE 14 HN ILE 14 31.276 16.170 22.179 389 HA ILE 14 HA ILE 14 28.671 15.855 23.236 390 HB ILE 14 HB ILE 14 30.045 18.269 22.031 391 HG12 ILE 14 HG12 ILE 14 29.539 17.600 24.942 392 HG13 ILE 14 HG11 ILE 14 31.018 17.114 24.113 393 HG21 ILE 14 HG21 ILE 14 28.301 19.491 23.436 394 HG22 ILE 14 HG22 ILE 14 27.458 17.949 23.574 395 HG23 ILE 14 HG23 ILE 14 27.683 18.692 21.991 396 HD11 ILE 14 HD11 ILE 14 31.220 19.609 23.430 397 HD12 ILE 14 HD12 ILE 14 31.582 19.185 25.102 398 HD13 ILE 14 HD13 ILE 14 30.025 19.905 24.696 399 H LEU 15 HN LEU 15 29.879 16.641 20.008 400 HA LEU 15 HA LEU 15 27.390 17.217 18.811 401 HB2 LEU 15 HB2 LEU 15 30.026 16.256 17.723 402 HB3 LEU 15 HB1 LEU 15 28.624 16.459 16.670 403 HG LEU 15 HG LEU 15 29.572 18.647 18.526 404 HD11 LEU 15 HD11 LEU 15 30.582 19.626 16.409 405 HD12 LEU 15 HD12 LEU 15 30.381 18.035 15.674 406 HD13 LEU 15 HD13 LEU 15 31.437 18.233 17.073 407 HD21 LEU 15 HD21 LEU 15 28.344 20.010 16.732 408 HD22 LEU 15 HD22 LEU 15 27.331 19.008 17.767 409 HD23 LEU 15 HD23 LEU 15 27.722 18.473 16.132 410 H SER 16 HN SER 16 29.305 14.234 18.446 411 HA SER 16 HA SER 16 27.489 12.623 17.213 412 HB2 SER 16 HB2 SER 16 29.348 11.813 19.463 413 HB3 SER 16 HB1 SER 16 28.562 10.700 18.347 414 HG SER 16 HG SER 16 30.783 11.461 17.838 415 H ALA 17 HN ALA 17 27.638 13.362 20.683 416 HA ALA 17 HA ALA 17 25.642 11.608 21.568 417 HB1 ALA 17 HB1 ALA 17 27.112 12.921 23.065 418 HB2 ALA 17 HB2 ALA 17 25.409 13.125 23.476 419 HB3 ALA 17 HB3 ALA 17 26.259 14.389 22.592 420 H LEU 18 HN LEU 18 25.246 15.105 20.878 421 HA LEU 18 HA LEU 18 22.419 15.048 20.937 422 HB2 LEU 18 HB2 LEU 18 24.518 16.946 20.044 423 HB3 LEU 18 HB1 LEU 18 22.918 17.163 19.335 424 HG LEU 18 HG LEU 18 23.343 18.429 21.502 425 HD11 LEU 18 HD11 LEU 18 21.067 16.445 21.688 426 HD12 LEU 18 HD12 LEU 18 21.076 17.766 20.521 427 HD13 LEU 18 HD13 LEU 18 21.103 18.117 22.247 428 HD21 LEU 18 HD21 LEU 18 23.478 17.276 23.552 429 HD22 LEU 18 HD22 LEU 18 24.517 16.316 22.502 430 HD23 LEU 18 HD23 LEU 18 22.879 15.769 22.860 431 H HIS 19 HN HIS 19 24.657 14.028 18.560 432 HA HIS 19 HA HIS 19 23.055 14.380 16.251 433 HB2 HIS 19 HB2 HIS 19 25.579 13.976 16.366 434 HB3 HIS 19 HB1 HIS 19 25.181 12.274 16.593 435 HD2 HIS 19 HD2 HIS 19 22.700 12.102 14.386 436 HE1 HIS 19 HE1 HIS 19 25.607 13.432 11.628 437 HE2 HIS 19 HE2 HIS 19 23.331 12.328 11.863 438 H PHE 20 HN PHE 20 23.692 11.576 18.346 439 HA PHE 20 HA PHE 20 21.851 9.911 16.913 440 HB2 PHE 20 HB2 PHE 20 23.805 9.585 18.972 441 HB3 PHE 20 HB1 PHE 20 22.277 8.908 19.535 442 HD1 PHE 20 HD1 PHE 20 25.132 8.404 17.422 443 HD2 PHE 20 HD2 PHE 20 21.002 7.344 17.929 444 HE1 PHE 20 HE1 PHE 20 25.461 6.427 15.960 445 HE2 PHE 20 HE2 PHE 20 21.328 5.368 16.467 446 HZ PHE 20 HZ PHE 20 23.557 4.913 15.486 447 H MET 21 HN MET 21 21.601 12.224 19.496 448 HA MET 21 HA MET 21 19.213 11.199 20.675 449 HB2 MET 21 HB2 MET 21 20.502 13.930 20.660 450 HB3 MET 21 HB1 MET 21 19.051 13.546 21.591 451 HG2 MET 21 HG2 MET 21 21.585 11.919 21.814 452 HG3 MET 21 HG1 MET 21 21.269 13.314 22.842 453 HE1 MET 21 HE1 MET 21 18.576 13.520 23.723 454 HE2 MET 21 HE2 MET 21 19.909 13.338 24.859 455 HE3 MET 21 HE3 MET 21 18.433 12.404 25.088 456 H ALA 22 HN ALA 22 19.771 13.945 18.468 457 HA ALA 22 HA ALA 22 16.999 14.418 18.019 458 HB1 ALA 22 HB1 ALA 22 19.164 15.210 16.094 459 HB2 ALA 22 HB2 ALA 22 18.989 16.014 17.654 460 HB3 ALA 22 HB3 ALA 22 17.668 16.059 16.485 461 H TRP 23 HN TRP 23 19.451 12.558 16.278 462 HA TRP 23 HA TRP 23 17.926 12.016 13.967 463 HB2 TRP 23 HB2 TRP 23 20.451 11.597 14.499 464 HB3 TRP 23 HB1 TRP 23 19.885 10.029 15.062 465 HD1 TRP 23 HD1 TRP 23 20.635 12.011 11.995 466 HE1 TRP 23 HE1 TRP 23 20.129 10.606 9.894 467 HE3 TRP 23 HE3 TRP 23 18.151 8.092 14.131 468 HZ2 TRP 23 HZ2 TRP 23 18.839 8.148 9.209 469 HZ3 TRP 23 HZ3 TRP 23 17.295 6.234 12.731 470 HH2 TRP 23 HH2 TRP 23 17.636 6.257 10.274 471 H THR 24 HN THR 24 18.182 10.334 17.085 472 HA THR 24 HA THR 24 16.576 8.102 16.332 473 HB THR 24 HB THR 24 16.333 7.844 18.858 474 HG1 THR 24 HG1 THR 24 16.989 9.429 20.038 475 HG21 THR 24 HG21 THR 24 18.026 6.542 17.886 476 HG22 THR 24 HG22 THR 24 18.900 7.484 19.095 477 HG23 THR 24 HG23 THR 24 18.967 7.953 17.397 478 H ILE 25 HN ILE 25 15.871 11.244 17.831 479 HA ILE 25 HA ILE 25 13.169 10.719 18.471 480 HB ILE 25 HB ILE 25 14.647 13.276 17.849 481 HG12 ILE 25 HG12 ILE 25 13.562 12.248 20.481 482 HG13 ILE 25 HG11 ILE 25 15.186 11.859 19.917 483 HG21 ILE 25 HG21 ILE 25 11.782 12.792 18.689 484 HG22 ILE 25 HG22 ILE 25 12.378 13.794 17.366 485 HG23 ILE 25 HG23 ILE 25 12.609 14.311 19.035 486 HD11 ILE 25 HD11 ILE 25 15.509 14.398 19.625 487 HD12 ILE 25 HD12 ILE 25 15.468 13.784 21.276 488 HD13 ILE 25 HD13 ILE 25 14.046 14.574 20.595 489 H GLY 26 HN GLY 26 14.678 12.159 15.588 490 HA2 GLY 26 HA2 GLY 26 12.282 12.683 14.179 491 HA3 GLY 26 HA1 GLY 26 13.875 12.497 13.451 492 H HIS 27 HN HIS 27 14.428 9.864 14.255 493 HA HIS 27 HA HIS 27 13.253 8.361 12.214 494 HB2 HIS 27 HB2 HIS 27 15.337 7.642 13.163 495 HB3 HIS 27 HB1 HIS 27 14.627 7.512 14.772 496 HD2 HIS 27 HD2 HIS 27 13.472 5.048 15.310 497 HE1 HIS 27 HE1 HIS 27 13.555 3.511 11.377 498 HE2 HIS 27 HE2 HIS 27 13.031 2.962 13.801 499 H LEU 28 HN LEU 28 12.454 8.552 15.677 500 HA LEU 28 HA LEU 28 10.292 6.657 15.434 501 HB2 LEU 28 HB2 LEU 28 11.735 7.257 17.530 502 HB3 LEU 28 HB1 LEU 28 10.586 8.583 17.717 503 HG LEU 28 HG LEU 28 9.371 5.941 17.165 504 HD11 LEU 28 HD11 LEU 28 10.552 6.510 19.895 505 HD12 LEU 28 HD12 LEU 28 11.327 5.454 18.715 506 HD13 LEU 28 HD13 LEU 28 9.739 5.039 19.359 507 HD21 LEU 28 HD21 LEU 28 8.836 7.951 19.366 508 HD22 LEU 28 HD22 LEU 28 7.725 6.748 18.711 509 HD23 LEU 28 HD23 LEU 28 8.197 8.138 17.733 510 H ASN 29 HN ASN 29 8.375 7.120 14.571 511 HA ASN 29 HA ASN 29 7.412 9.917 14.686 512 HB2 ASN 29 HB2 ASN 29 6.785 7.793 12.621 513 HB3 ASN 29 HB1 ASN 29 6.179 9.449 12.622 514 HD21 ASN 29 HD21 ASN 29 8.313 11.046 13.073 515 HD22 ASN 29 HD22 ASN 29 9.562 10.763 11.959 516 H GLN 30 HN GLN 30 5.335 10.309 15.344 517 HA GLN 30 HA GLN 30 3.885 7.997 16.478 518 HB2 GLN 30 HB2 GLN 30 4.074 10.887 17.287 519 HB3 GLN 30 HB1 GLN 30 2.708 9.894 17.798 520 HG2 GLN 30 HG2 GLN 30 5.600 9.102 18.220 521 HG3 GLN 30 HG1 GLN 30 4.633 9.937 19.434 522 HE21 GLN 30 HE21 GLN 30 2.680 8.767 20.259 523 HE22 GLN 30 HE22 GLN 30 2.634 7.071 20.189 524 H ILE 31 HN ILE 31 2.146 7.379 15.389 525 HA ILE 31 HA ILE 31 0.738 9.367 13.713 526 HB ILE 31 HB ILE 31 0.968 6.363 13.437 527 HG12 ILE 31 HG12 ILE 31 1.769 8.513 11.469 528 HG13 ILE 31 HG11 ILE 31 2.880 7.944 12.716 529 HG21 ILE 31 HG21 ILE 31 -0.314 6.839 11.275 530 HG22 ILE 31 HG22 ILE 31 -0.714 8.409 11.971 531 HG23 ILE 31 HG23 ILE 31 -1.253 6.928 12.764 532 HD11 ILE 31 HD11 ILE 31 3.075 6.748 10.487 533 HD12 ILE 31 HD12 ILE 31 1.467 6.087 10.784 534 HD13 ILE 31 HD13 ILE 31 2.798 5.694 11.874 535 H LYS 32 HN LYS 32 -1.276 9.891 14.249 536 HA LYS 32 HA LYS 32 -2.771 8.076 16.048 537 HB2 LYS 32 HB2 LYS 32 -2.573 11.091 16.070 538 HB3 LYS 32 HB1 LYS 32 -3.851 10.213 16.912 539 HG2 LYS 32 HG2 LYS 32 -2.279 9.079 18.313 540 HG3 LYS 32 HG1 LYS 32 -0.915 9.610 17.328 541 HD2 LYS 32 HD2 LYS 32 -0.953 11.016 19.280 542 HD3 LYS 32 HD1 LYS 32 -1.541 11.991 17.933 543 HE2 LYS 32 HE2 LYS 32 -2.999 12.325 19.864 544 HE3 LYS 32 HE1 LYS 32 -3.879 11.461 18.606 545 HZ1 LYS 32 HZ1 LYS 32 -4.222 9.803 20.011 546 HZ2 LYS 32 HZ2 LYS 32 -3.423 10.662 21.237 547 HZ3 LYS 32 HZ3 LYS 32 -2.555 9.591 20.246 548 H ARG 33 HN ARG 33 -4.432 7.223 14.985 549 HA ARG 33 HA ARG 33 -5.684 8.756 12.806 550 HB2 ARG 33 HB2 ARG 33 -5.853 5.818 13.522 551 HB3 ARG 33 HB1 ARG 33 -6.687 6.576 12.166 552 HG2 ARG 33 HG2 ARG 33 -4.551 7.247 11.186 553 HG3 ARG 33 HG1 ARG 33 -3.682 6.582 12.570 554 HD2 ARG 33 HD2 ARG 33 -3.603 4.966 10.771 555 HD3 ARG 33 HD1 ARG 33 -4.653 4.334 12.025 556 HE ARG 33 HE ARG 33 -5.470 5.348 9.392 557 HH11 ARG 33 HH11 ARG 33 -6.415 4.054 12.503 558 HH12 ARG 33 HH12 ARG 33 -7.990 3.611 11.960 559 HH21 ARG 33 HH21 ARG 33 -7.533 4.766 8.739 560 HH22 ARG 33 HH22 ARG 33 -8.624 4.014 9.853 561 H1 MET 1 HT1 MET 1 51.167 -5.090 23.968 562 H2 MET 1 HT2 MET 1 50.099 -5.214 25.284 563 H3 MET 1 HT3 MET 1 50.874 -3.739 24.951 564 HA MET 1 HA MET 1 48.989 -3.198 23.906 565 HB2 MET 1 HB2 MET 1 50.788 -3.847 22.124 566 HB3 MET 1 HB1 MET 1 49.733 -5.226 21.811 567 HG2 MET 1 HG2 MET 1 47.872 -3.297 21.804 568 HG3 MET 1 HG1 MET 1 49.259 -2.325 21.311 569 HE1 MET 1 HE1 MET 1 48.145 -6.173 20.494 570 HE2 MET 1 HE2 MET 1 47.101 -5.681 19.162 571 HE3 MET 1 HE3 MET 1 46.846 -5.003 20.768 572 H PHE 2 HN PHE 2 47.070 -3.757 24.738 573 HA PHE 2 HA PHE 2 46.217 -6.568 24.648 574 HB2 PHE 2 HB2 PHE 2 46.070 -5.397 26.816 575 HB3 PHE 2 HB1 PHE 2 44.993 -4.205 26.088 576 HD1 PHE 2 HD1 PHE 2 45.360 -7.871 26.710 577 HD2 PHE 2 HD2 PHE 2 42.670 -4.609 25.950 578 HE1 PHE 2 HE1 PHE 2 43.426 -9.368 27.126 579 HE2 PHE 2 HE2 PHE 2 40.737 -6.106 26.366 580 HZ PHE 2 HZ PHE 2 41.115 -8.485 26.954 581 H GLU 3 HN GLU 3 44.976 -3.313 23.896 582 HA GLU 3 HA GLU 3 42.862 -4.500 22.281 583 HB2 GLU 3 HB2 GLU 3 43.431 -1.623 23.008 584 HB3 GLU 3 HB1 GLU 3 42.046 -2.160 22.061 585 HG2 GLU 3 HG2 GLU 3 41.040 -2.238 24.111 586 HG3 GLU 3 HG1 GLU 3 41.807 -3.823 24.176 587 HA PRO 4 HA PRO 4 44.695 -3.953 18.309 588 HB2 PRO 4 HB2 PRO 4 42.331 -2.336 17.481 589 HB3 PRO 4 HB1 PRO 4 42.993 -3.818 16.765 590 HG2 PRO 4 HG2 PRO 4 40.755 -3.870 18.178 591 HG3 PRO 4 HG1 PRO 4 41.938 -5.185 18.287 592 HD2 PRO 4 HD2 PRO 4 41.415 -2.966 20.243 593 HD3 PRO 4 HD1 PRO 4 41.824 -4.669 20.545 594 H PHE 5 HN PHE 5 43.130 -1.027 19.590 595 HA PHE 5 HA PHE 5 45.499 0.535 18.837 596 HB2 PHE 5 HB2 PHE 5 42.768 0.870 17.739 597 HB3 PHE 5 HB1 PHE 5 43.579 2.350 18.254 598 HD1 PHE 5 HD1 PHE 5 43.804 -0.597 16.018 599 HD2 PHE 5 HD2 PHE 5 45.499 3.204 17.084 600 HE1 PHE 5 HE1 PHE 5 45.179 -0.630 13.954 601 HE2 PHE 5 HE2 PHE 5 46.873 3.170 15.020 602 HZ PHE 5 HZ PHE 5 46.713 1.253 13.453 603 H GLN 6 HN GLN 6 42.313 1.633 19.903 604 HA GLN 6 HA GLN 6 43.253 2.017 22.636 605 HB2 GLN 6 HB2 GLN 6 42.956 4.196 20.660 606 HB3 GLN 6 HB1 GLN 6 42.190 4.485 22.222 607 HG2 GLN 6 HG2 GLN 6 45.060 3.571 21.890 608 HG3 GLN 6 HG1 GLN 6 44.582 5.254 22.114 609 HE21 GLN 6 HE21 GLN 6 43.608 5.847 24.215 610 HE22 GLN 6 HE22 GLN 6 43.834 4.856 25.575 611 H ILE 7 HN ILE 7 41.474 2.947 24.003 612 HA ILE 7 HA ILE 7 39.146 1.393 23.776 613 HB ILE 7 HB ILE 7 39.735 3.887 25.379 614 HG12 ILE 7 HG12 ILE 7 39.412 1.016 26.287 615 HG13 ILE 7 HG11 ILE 7 40.972 1.687 25.811 616 HG21 ILE 7 HG21 ILE 7 37.302 2.089 25.338 617 HG22 ILE 7 HG22 ILE 7 37.357 3.845 25.165 618 HG23 ILE 7 HG23 ILE 7 37.709 3.100 26.725 619 HD11 ILE 7 HD11 ILE 7 39.195 2.557 28.100 620 HD12 ILE 7 HD12 ILE 7 40.521 3.556 27.501 621 HD13 ILE 7 HD13 ILE 7 40.854 1.962 28.179 622 H LEU 8 HN LEU 8 39.793 4.749 22.905 623 HA LEU 8 HA LEU 8 37.141 5.455 22.183 624 HB2 LEU 8 HB2 LEU 8 39.028 7.070 22.600 625 HB3 LEU 8 HB1 LEU 8 39.687 6.609 21.030 626 HG LEU 8 HG LEU 8 36.823 7.285 20.972 627 HD11 LEU 8 HD11 LEU 8 38.840 9.499 21.436 628 HD12 LEU 8 HD12 LEU 8 37.755 8.895 22.688 629 HD13 LEU 8 HD13 LEU 8 37.095 9.665 21.247 630 HD21 LEU 8 HD21 LEU 8 37.556 8.513 18.967 631 HD22 LEU 8 HD22 LEU 8 38.223 6.881 18.968 632 HD23 LEU 8 HD23 LEU 8 39.242 8.249 19.412 633 H SER 9 HN SER 9 39.773 3.933 20.462 634 HA SER 9 HA SER 9 38.587 4.078 17.848 635 HB2 SER 9 HB2 SER 9 40.774 2.312 18.955 636 HB3 SER 9 HB1 SER 9 40.299 2.352 17.261 637 HG SER 9 HG SER 9 42.084 3.780 17.935 638 H ILE 10 HN ILE 10 38.683 1.628 20.416 639 HA ILE 10 HA ILE 10 37.361 -0.416 18.967 640 HB ILE 10 HB ILE 10 37.721 0.131 21.907 641 HG12 ILE 10 HG12 ILE 10 39.576 -0.706 20.298 642 HG13 ILE 10 HG11 ILE 10 39.326 -1.604 21.793 643 HG21 ILE 10 HG21 ILE 10 35.633 -0.994 21.880 644 HG22 ILE 10 HG22 ILE 10 36.818 -2.272 22.142 645 HG23 ILE 10 HG23 ILE 10 36.112 -2.038 20.542 646 HD11 ILE 10 HD11 ILE 10 37.832 -2.415 19.303 647 HD12 ILE 10 HD12 ILE 10 38.285 -3.392 20.696 648 HD13 ILE 10 HD13 ILE 10 39.504 -2.911 19.527 649 H CYS 11 HN CYS 11 36.156 2.118 21.152 650 HA CYS 11 HA CYS 11 33.464 1.305 21.172 651 HB2 CYS 11 HB2 CYS 11 34.750 4.019 21.496 652 HB3 CYS 11 HB1 CYS 11 33.021 3.741 21.709 653 HG CYS 11 HG CYS 11 34.916 1.957 23.392 654 H SER 12 HN SER 12 35.106 3.736 19.117 655 HA SER 12 HA SER 12 32.885 4.388 17.553 656 HB2 SER 12 HB2 SER 12 35.831 4.382 16.877 657 HB3 SER 12 HB1 SER 12 34.590 5.056 15.822 658 HG SER 12 HG SER 12 35.760 6.173 17.927 659 H PHE 13 HN PHE 13 35.227 1.764 17.226 660 HA PHE 13 HA PHE 13 34.474 0.842 14.685 661 HB2 PHE 13 HB2 PHE 13 36.107 -0.059 16.880 662 HB3 PHE 13 HB1 PHE 13 35.164 -1.407 16.244 663 HD1 PHE 13 HD1 PHE 13 38.047 0.649 15.753 664 HD2 PHE 13 HD2 PHE 13 35.105 -1.680 13.663 665 HE1 PHE 13 HE1 PHE 13 39.556 0.504 13.789 666 HE2 PHE 13 HE2 PHE 13 36.612 -1.825 11.700 667 HZ PHE 13 HZ PHE 13 38.838 -0.733 11.762 668 H ILE 14 HN ILE 14 33.358 -0.217 17.910 669 HA ILE 14 HA ILE 14 31.472 -2.101 16.965 670 HB ILE 14 HB ILE 14 31.598 -0.566 19.572 671 HG12 ILE 14 HG12 ILE 14 32.334 -3.449 19.005 672 HG13 ILE 14 HG11 ILE 14 33.512 -2.143 18.888 673 HG21 ILE 14 HG21 ILE 14 30.168 -2.526 20.359 674 HG22 ILE 14 HG22 ILE 14 29.903 -2.903 18.657 675 HG23 ILE 14 HG23 ILE 14 29.351 -1.364 19.315 676 HD11 ILE 14 HD11 ILE 14 32.748 -1.505 21.283 677 HD12 ILE 14 HD12 ILE 14 33.763 -2.935 21.101 678 HD13 ILE 14 HD13 ILE 14 32.024 -3.113 21.327 679 H LEU 15 HN LEU 15 31.226 1.318 17.812 680 HA LEU 15 HA LEU 15 28.422 1.556 17.589 681 HB2 LEU 15 HB2 LEU 15 30.681 3.524 17.324 682 HB3 LEU 15 HB1 LEU 15 29.008 4.013 17.049 683 HG LEU 15 HG LEU 15 29.865 2.540 19.546 684 HD11 LEU 15 HD11 LEU 15 29.765 4.846 20.608 685 HD12 LEU 15 HD12 LEU 15 29.788 5.513 18.976 686 HD13 LEU 15 HD13 LEU 15 31.155 4.565 19.561 687 HD21 LEU 15 HD21 LEU 15 27.762 3.751 20.378 688 HD22 LEU 15 HD22 LEU 15 27.496 2.460 19.210 689 HD23 LEU 15 HD23 LEU 15 27.441 4.143 18.689 690 H SER 16 HN SER 16 30.867 2.642 15.237 691 HA SER 16 HA SER 16 29.278 3.219 13.100 692 HB2 SER 16 HB2 SER 16 31.944 1.783 13.007 693 HB3 SER 16 HB1 SER 16 31.176 2.581 11.638 694 HG SER 16 HG SER 16 32.771 3.817 12.944 695 H ALA 17 HN ALA 17 30.391 -0.004 14.097 696 HA ALA 17 HA ALA 17 29.404 -1.476 11.931 697 HB1 ALA 17 HB1 ALA 17 30.859 -2.403 13.707 698 HB2 ALA 17 HB2 ALA 17 29.416 -3.389 13.461 699 HB3 ALA 17 HB3 ALA 17 29.515 -2.299 14.843 700 H LEU 18 HN LEU 18 27.821 -1.064 15.116 701 HA LEU 18 HA LEU 18 25.321 -2.106 14.289 702 HB2 LEU 18 HB2 LEU 18 26.354 -0.596 16.623 703 HB3 LEU 18 HB1 LEU 18 24.618 -0.493 16.336 704 HG LEU 18 HG LEU 18 25.373 -2.413 17.825 705 HD11 LEU 18 HD11 LEU 18 23.969 -3.323 15.305 706 HD12 LEU 18 HD12 LEU 18 23.198 -2.264 16.485 707 HD13 LEU 18 HD13 LEU 18 23.712 -3.882 16.957 708 HD21 LEU 18 HD21 LEU 18 26.524 -4.253 16.909 709 HD22 LEU 18 HD22 LEU 18 27.372 -2.879 16.202 710 HD23 LEU 18 HD23 LEU 18 26.185 -3.769 15.248 711 H HIS 19 HN HIS 19 26.802 0.928 13.753 712 HA HIS 19 HA HIS 19 24.478 2.522 13.479 713 HB2 HIS 19 HB2 HIS 19 26.891 3.308 13.802 714 HB3 HIS 19 HB1 HIS 19 27.099 3.005 12.077 715 HD2 HIS 19 HD2 HIS 19 24.175 4.212 11.057 716 HE1 HIS 19 HE1 HIS 19 25.446 7.771 12.938 717 HE2 HIS 19 HE2 HIS 19 23.808 6.789 11.263 718 H PHE 20 HN PHE 20 26.566 0.866 11.124 719 HA PHE 20 HA PHE 20 24.905 1.614 8.911 720 HB2 PHE 20 HB2 PHE 20 27.452 0.377 9.293 721 HB3 PHE 20 HB1 PHE 20 26.470 -0.664 8.260 722 HD1 PHE 20 HD1 PHE 20 28.447 2.328 8.415 723 HD2 PHE 20 HD2 PHE 20 25.227 0.442 6.289 724 HE1 PHE 20 HE1 PHE 20 28.804 3.872 6.506 725 HE2 PHE 20 HE2 PHE 20 25.584 1.985 4.380 726 HZ PHE 20 HZ PHE 20 27.370 3.700 4.486 727 H MET 21 HN MET 21 24.909 -0.966 11.243 728 HA MET 21 HA MET 21 23.462 -2.871 9.688 729 HB2 MET 21 HB2 MET 21 23.828 -2.487 12.660 730 HB3 MET 21 HB1 MET 21 22.959 -3.853 11.957 731 HG2 MET 21 HG2 MET 21 25.768 -3.129 11.119 732 HG3 MET 21 HG1 MET 21 25.441 -4.242 12.445 733 HE1 MET 21 HE1 MET 21 23.273 -6.014 11.960 734 HE2 MET 21 HE2 MET 21 24.908 -6.606 12.241 735 HE3 MET 21 HE3 MET 21 23.934 -7.310 10.953 736 H ALA 22 HN ALA 22 22.425 -0.690 12.306 737 HA ALA 22 HA ALA 22 19.652 -1.251 11.958 738 HB1 ALA 22 HB1 ALA 22 20.700 1.281 13.182 739 HB2 ALA 22 HB2 ALA 22 20.847 -0.267 14.014 740 HB3 ALA 22 HB3 ALA 22 19.252 0.366 13.604 741 H TRP 23 HN TRP 23 21.783 1.292 10.731 742 HA TRP 23 HA TRP 23 19.781 2.940 9.621 743 HB2 TRP 23 HB2 TRP 23 22.343 3.336 9.955 744 HB3 TRP 23 HB1 TRP 23 22.475 2.654 8.338 745 HD1 TRP 23 HD1 TRP 23 21.530 5.732 10.220 746 HE1 TRP 23 HE1 TRP 23 20.762 7.565 8.580 747 HE3 TRP 23 HE3 TRP 23 21.159 2.981 5.932 748 HZ2 TRP 23 HZ2 TRP 23 20.077 7.830 5.817 749 HZ3 TRP 23 HZ3 TRP 23 20.447 4.050 3.812 750 HH2 TRP 23 HH2 TRP 23 19.905 6.468 3.749 751 H THR 24 HN THR 24 21.560 0.162 8.306 752 HA THR 24 HA THR 24 20.501 0.371 5.668 753 HB THR 24 HB THR 24 21.223 -2.074 5.540 754 HG1 THR 24 HG1 THR 24 21.762 -2.997 7.327 755 HG21 THR 24 HG21 THR 24 22.777 -0.531 4.695 756 HG22 THR 24 HG22 THR 24 23.704 -1.390 5.924 757 HG23 THR 24 HG23 THR 24 23.049 0.209 6.274 758 H ILE 25 HN ILE 25 19.491 -1.376 8.588 759 HA ILE 25 HA ILE 25 17.437 -2.901 7.388 760 HB ILE 25 HB ILE 25 17.817 -1.877 10.201 761 HG12 ILE 25 HG12 ILE 25 18.038 -4.691 9.109 762 HG13 ILE 25 HG11 ILE 25 19.411 -3.585 9.148 763 HG21 ILE 25 HG21 ILE 25 15.676 -3.647 9.006 764 HG22 ILE 25 HG22 ILE 25 15.473 -2.229 10.034 765 HG23 ILE 25 HG23 ILE 25 16.102 -3.727 10.716 766 HD11 ILE 25 HD11 ILE 25 18.874 -3.273 11.646 767 HD12 ILE 25 HD12 ILE 25 19.574 -4.819 11.170 768 HD13 ILE 25 HD13 ILE 25 17.842 -4.694 11.480 769 H GLY 26 HN GLY 26 17.393 0.284 8.967 770 HA2 GLY 26 HA2 GLY 26 14.612 0.754 8.708 771 HA3 GLY 26 HA1 GLY 26 15.843 1.997 8.918 772 H HIS 27 HN HIS 27 17.367 1.517 6.608 773 HA HIS 27 HA HIS 27 16.046 3.060 4.693 774 HB2 HIS 27 HB2 HIS 27 18.440 2.918 4.653 775 HB3 HIS 27 HB1 HIS 27 18.391 1.167 4.449 776 HD2 HIS 27 HD2 HIS 27 18.248 0.334 1.807 777 HE1 HIS 27 HE1 HIS 27 17.418 4.090 0.069 778 HE2 HIS 27 HE2 HIS 27 17.935 1.654 -0.424 779 H LEU 28 HN LEU 28 16.465 -0.467 4.903 780 HA LEU 28 HA LEU 28 14.984 -0.941 2.473 781 HB2 LEU 28 HB2 LEU 28 16.822 -2.416 3.602 782 HB3 LEU 28 HB1 LEU 28 15.481 -3.032 4.568 783 HG LEU 28 HG LEU 28 14.956 -2.863 1.661 784 HD11 LEU 28 HD11 LEU 28 16.783 -5.025 2.732 785 HD12 LEU 28 HD12 LEU 28 17.377 -3.617 1.851 786 HD13 LEU 28 HD13 LEU 28 16.294 -4.763 1.059 787 HD21 LEU 28 HD21 LEU 28 14.658 -5.171 3.599 788 HD22 LEU 28 HD22 LEU 28 13.781 -4.907 2.093 789 HD23 LEU 28 HD23 LEU 28 13.475 -3.868 3.484 790 H ASN 29 HN ASN 29 12.842 -0.815 2.321 791 HA ASN 29 HA ASN 29 11.220 -1.341 4.741 792 HB2 ASN 29 HB2 ASN 29 10.558 0.436 2.381 793 HB3 ASN 29 HB1 ASN 29 9.544 0.175 3.798 794 HD21 ASN 29 HD21 ASN 29 11.145 0.454 5.955 795 HD22 ASN 29 HD22 ASN 29 11.965 1.940 5.950 796 H GLN 30 HN GLN 30 9.474 -2.692 4.588 797 HA GLN 30 HA GLN 30 9.225 -4.192 2.054 798 HB2 GLN 30 HB2 GLN 30 8.844 -4.970 4.934 799 HB3 GLN 30 HB1 GLN 30 8.080 -5.896 3.641 800 HG2 GLN 30 HG2 GLN 30 11.040 -5.259 3.716 801 HG3 GLN 30 HG1 GLN 30 10.351 -6.758 4.337 802 HE21 GLN 30 HE21 GLN 30 9.220 -8.177 2.732 803 HE22 GLN 30 HE22 GLN 30 9.642 -8.077 1.091 804 H ILE 31 HN ILE 31 7.471 -3.766 0.899 805 HA ILE 31 HA ILE 31 5.070 -2.744 2.288 806 HB ILE 31 HB ILE 31 6.040 -2.318 -0.546 807 HG12 ILE 31 HG12 ILE 31 5.467 -0.259 1.591 808 HG13 ILE 31 HG11 ILE 31 7.052 -1.020 1.444 809 HG21 ILE 31 HG21 ILE 31 4.016 -0.753 -0.607 810 HG22 ILE 31 HG22 ILE 31 3.447 -1.593 0.836 811 HG23 ILE 31 HG23 ILE 31 3.660 -2.480 -0.673 812 HD11 ILE 31 HD11 ILE 31 6.803 1.171 0.189 813 HD12 ILE 31 HD12 ILE 31 5.656 0.347 -0.869 814 HD13 ILE 31 HD13 ILE 31 7.333 -0.193 -0.793 815 H LYS 32 HN LYS 32 3.298 -3.961 2.265 816 HA LYS 32 HA LYS 32 3.096 -6.117 0.248 817 HB2 LYS 32 HB2 LYS 32 2.419 -6.155 3.191 818 HB3 LYS 32 HB1 LYS 32 1.814 -7.364 2.059 819 HG2 LYS 32 HG2 LYS 32 4.026 -8.095 1.512 820 HG3 LYS 32 HG1 LYS 32 4.757 -6.713 2.328 821 HD2 LYS 32 HD2 LYS 32 4.989 -8.594 3.807 822 HD3 LYS 32 HD1 LYS 32 3.723 -7.567 4.478 823 HE2 LYS 32 HE2 LYS 32 2.985 -9.895 4.533 824 HE3 LYS 32 HE1 LYS 32 2.012 -8.998 3.370 825 HZ1 LYS 32 HZ1 LYS 32 2.661 -10.382 1.788 826 HZ2 LYS 32 HZ2 LYS 32 3.549 -11.278 2.923 827 HZ3 LYS 32 HZ3 LYS 32 4.293 -10.015 2.066 828 H ARG 33 HN ARG 33 1.489 -5.679 -1.111 829 HA ARG 33 HA ARG 33 -0.815 -4.117 -0.153 830 HB2 ARG 33 HB2 ARG 33 0.122 -4.761 -2.959 831 HB3 ARG 33 HB1 ARG 33 -1.306 -3.804 -2.566 832 HG2 ARG 33 HG2 ARG 33 0.075 -2.162 -1.400 833 HG3 ARG 33 HG1 ARG 33 1.518 -3.134 -1.694 834 HD2 ARG 33 HD2 ARG 33 1.436 -1.374 -3.352 835 HD3 ARG 33 HD1 ARG 33 1.107 -2.897 -4.156 836 HE ARG 33 HE ARG 33 -0.817 -0.745 -3.607 837 HH11 ARG 33 HH11 ARG 33 -0.225 -3.951 -4.881 838 HH12 ARG 33 HH12 ARG 33 -1.694 -3.979 -5.783 839 HH21 ARG 33 HH21 ARG 33 -2.719 -0.836 -4.787 840 HH22 ARG 33 HH22 ARG 33 -3.098 -2.239 -5.729 841 H1 MET 1 HT1 MET 1 57.860 4.871 2.689 842 H2 MET 1 HT2 MET 1 57.345 3.265 2.479 843 H3 MET 1 HT3 MET 1 57.538 3.901 4.042 844 HA MET 1 HA MET 1 55.347 4.256 3.968 845 HB2 MET 1 HB2 MET 1 56.584 6.521 3.553 846 HB3 MET 1 HB1 MET 1 55.907 6.397 1.928 847 HG2 MET 1 HG2 MET 1 53.687 5.843 3.326 848 HG3 MET 1 HG1 MET 1 54.520 6.820 4.534 849 HE1 MET 1 HE1 MET 1 54.298 7.051 0.458 850 HE2 MET 1 HE2 MET 1 52.792 7.963 0.505 851 HE3 MET 1 HE3 MET 1 52.889 6.394 1.303 852 H PHE 2 HN PHE 2 54.025 2.795 3.071 853 HA PHE 2 HA PHE 2 53.990 2.478 0.149 854 HB2 PHE 2 HB2 PHE 2 54.228 0.439 1.521 855 HB3 PHE 2 HB1 PHE 2 52.692 0.801 2.308 856 HD1 PHE 2 HD1 PHE 2 54.227 0.197 -1.045 857 HD2 PHE 2 HD2 PHE 2 50.654 0.114 1.337 858 HE1 PHE 2 HE1 PHE 2 53.016 -0.917 -2.900 859 HE2 PHE 2 HE2 PHE 2 49.442 -1.000 -0.519 860 HZ PHE 2 HZ PHE 2 50.624 -1.516 -2.638 861 H GLU 3 HN GLU 3 51.724 2.863 2.874 862 HA GLU 3 HA GLU 3 49.618 3.622 1.016 863 HB2 GLU 3 HB2 GLU 3 49.585 3.253 4.012 864 HB3 GLU 3 HB1 GLU 3 48.172 3.646 3.037 865 HG2 GLU 3 HG2 GLU 3 47.935 1.373 2.983 866 HG3 GLU 3 HG1 GLU 3 49.085 1.513 1.654 867 HA PRO 4 HA PRO 4 49.865 8.003 1.463 868 HB2 PRO 4 HB2 PRO 4 47.015 8.036 2.334 869 HB3 PRO 4 HB1 PRO 4 47.790 8.874 0.976 870 HG2 PRO 4 HG2 PRO 4 46.225 6.777 0.569 871 HG3 PRO 4 HG1 PRO 4 47.691 7.028 -0.395 872 HD2 PRO 4 HD2 PRO 4 47.238 5.102 1.864 873 HD3 PRO 4 HD1 PRO 4 48.172 4.892 0.366 874 H PHE 5 HN PHE 5 48.055 6.382 4.061 875 HA PHE 5 HA PHE 5 49.535 7.966 6.042 876 HB2 PHE 5 HB2 PHE 5 46.616 8.072 5.555 877 HB3 PHE 5 HB1 PHE 5 47.110 7.928 7.241 878 HD1 PHE 5 HD1 PHE 5 47.403 9.986 4.175 879 HD2 PHE 5 HD2 PHE 5 48.243 9.721 8.379 880 HE1 PHE 5 HE1 PHE 5 47.991 12.395 4.209 881 HE2 PHE 5 HE2 PHE 5 48.831 12.131 8.414 882 HZ PHE 5 HZ PHE 5 48.702 13.475 6.326 883 H GLN 6 HN GLN 6 46.685 5.915 6.460 884 HA GLN 6 HA GLN 6 48.309 3.691 7.415 885 HB2 GLN 6 HB2 GLN 6 46.811 5.529 9.178 886 HB3 GLN 6 HB1 GLN 6 46.534 3.812 9.473 887 HG2 GLN 6 HG2 GLN 6 49.283 5.071 9.253 888 HG3 GLN 6 HG1 GLN 6 48.460 4.762 10.781 889 HE21 GLN 6 HE21 GLN 6 48.088 2.481 11.388 890 HE22 GLN 6 HE22 GLN 6 48.999 1.242 10.666 891 H ILE 7 HN ILE 7 46.876 1.831 8.056 892 HA ILE 7 HA ILE 7 45.120 1.182 5.960 893 HB ILE 7 HB ILE 7 45.485 -0.017 8.712 894 HG12 ILE 7 HG12 ILE 7 46.269 -1.096 5.993 895 HG13 ILE 7 HG11 ILE 7 47.347 -0.087 6.958 896 HG21 ILE 7 HG21 ILE 7 43.756 -0.885 6.386 897 HG22 ILE 7 HG22 ILE 7 43.272 -0.636 8.064 898 HG23 ILE 7 HG23 ILE 7 44.294 -2.007 7.636 899 HD11 ILE 7 HD11 ILE 7 46.229 -2.809 7.658 900 HD12 ILE 7 HD12 ILE 7 46.966 -1.753 8.864 901 HD13 ILE 7 HD13 ILE 7 47.921 -2.339 7.503 902 H LEU 8 HN LEU 8 44.506 2.355 9.236 903 HA LEU 8 HA LEU 8 41.679 2.150 9.168 904 HB2 LEU 8 HB2 LEU 8 43.082 2.472 11.235 905 HB3 LEU 8 HB1 LEU 8 43.304 4.153 10.748 906 HG LEU 8 HG LEU 8 40.502 3.250 10.692 907 HD11 LEU 8 HD11 LEU 8 41.875 3.597 13.372 908 HD12 LEU 8 HD12 LEU 8 41.456 2.025 12.691 909 HD13 LEU 8 HD13 LEU 8 40.185 3.182 13.082 910 HD21 LEU 8 HD21 LEU 8 40.188 5.433 11.789 911 HD22 LEU 8 HD22 LEU 8 41.242 5.597 10.384 912 HD23 LEU 8 HD23 LEU 8 41.931 5.584 12.008 913 H SER 9 HN SER 9 43.933 4.613 8.124 914 HA SER 9 HA SER 9 41.977 6.660 7.635 915 HB2 SER 9 HB2 SER 9 44.800 6.301 6.617 916 HB3 SER 9 HB1 SER 9 43.816 7.729 6.315 917 HG SER 9 HG SER 9 45.260 7.769 8.212 918 H ILE 10 HN ILE 10 43.556 4.186 5.639 919 HA ILE 10 HA ILE 10 42.455 5.011 3.163 920 HB ILE 10 HB ILE 10 43.573 2.397 4.158 921 HG12 ILE 10 HG12 ILE 10 44.969 4.511 3.596 922 HG13 ILE 10 HG11 ILE 10 45.467 2.986 2.868 923 HG21 ILE 10 HG21 ILE 10 41.980 1.660 2.565 924 HG22 ILE 10 HG22 ILE 10 43.487 1.771 1.659 925 HG23 ILE 10 HG23 ILE 10 42.270 3.039 1.504 926 HD11 ILE 10 HD11 ILE 10 43.536 4.775 1.398 927 HD12 ILE 10 HD12 ILE 10 44.662 3.585 0.751 928 HD13 ILE 10 HD13 ILE 10 45.259 5.121 1.360 929 H CYS 11 HN CYS 11 41.365 2.646 5.591 930 HA CYS 11 HA CYS 11 39.156 1.672 4.150 931 HB2 CYS 11 HB2 CYS 11 39.682 1.920 7.115 932 HB3 CYS 11 HB1 CYS 11 38.259 1.114 6.453 933 HG CYS 11 HG CYS 11 41.004 0.114 5.420 934 H SER 12 HN SER 12 39.319 4.258 6.626 935 HA SER 12 HA SER 12 36.627 4.992 6.501 936 HB2 SER 12 HB2 SER 12 39.083 6.639 7.126 937 HB3 SER 12 HB1 SER 12 37.435 7.227 7.333 938 HG SER 12 HG SER 12 38.867 5.696 8.964 939 H PHE 13 HN PHE 13 39.367 6.001 4.510 940 HA PHE 13 HA PHE 13 38.122 8.088 3.110 941 HB2 PHE 13 HB2 PHE 13 40.552 6.553 2.927 942 HB3 PHE 13 HB1 PHE 13 39.861 6.772 1.319 943 HD1 PHE 13 HD1 PHE 13 41.756 8.305 3.934 944 HD2 PHE 13 HD2 PHE 13 39.056 9.163 0.706 945 HE1 PHE 13 HE1 PHE 13 42.536 10.660 3.908 946 HE2 PHE 13 HE2 PHE 13 39.834 11.516 0.679 947 HZ PHE 13 HZ PHE 13 41.574 12.265 2.279 948 H ILE 14 HN ILE 14 38.431 4.636 2.243 949 HA ILE 14 HA ILE 14 36.935 4.803 -0.152 950 HB ILE 14 HB ILE 14 37.465 2.458 1.692 951 HG12 ILE 14 HG12 ILE 14 38.740 3.132 -0.973 952 HG13 ILE 14 HG11 ILE 14 39.414 3.694 0.555 953 HG21 ILE 14 HG21 ILE 14 36.956 1.154 -0.443 954 HG22 ILE 14 HG22 ILE 14 36.272 2.647 -1.086 955 HG23 ILE 14 HG23 ILE 14 35.563 1.896 0.343 956 HD11 ILE 14 HD11 ILE 14 39.307 1.206 1.288 957 HD12 ILE 14 HD12 ILE 14 40.566 1.673 0.146 958 HD13 ILE 14 HD13 ILE 14 39.112 0.858 -0.430 959 H LEU 15 HN LEU 15 36.040 4.059 3.195 960 HA LEU 15 HA LEU 15 33.362 3.310 2.684 961 HB2 LEU 15 HB2 LEU 15 34.781 4.413 5.100 962 HB3 LEU 15 HB1 LEU 15 33.044 4.111 5.123 963 HG LEU 15 HG LEU 15 35.029 2.008 4.244 964 HD11 LEU 15 HD11 LEU 15 34.650 1.071 6.577 965 HD12 LEU 15 HD12 LEU 15 33.966 2.639 7.009 966 HD13 LEU 15 HD13 LEU 15 35.652 2.520 6.505 967 HD21 LEU 15 HD21 LEU 15 33.060 0.551 5.006 968 HD22 LEU 15 HD22 LEU 15 32.796 1.502 3.547 969 HD23 LEU 15 HD23 LEU 15 32.118 2.040 5.083 970 H SER 16 HN SER 16 34.547 6.391 4.010 971 HA SER 16 HA SER 16 32.260 7.875 3.914 972 HB2 SER 16 HB2 SER 16 35.037 8.833 3.178 973 HB3 SER 16 HB1 SER 16 33.679 9.881 3.574 974 HG SER 16 HG SER 16 35.202 9.256 5.327 975 H ALA 17 HN ALA 17 34.463 7.201 1.218 976 HA ALA 17 HA ALA 17 33.275 8.837 -0.717 977 HB1 ALA 17 HB1 ALA 17 35.417 7.635 -1.019 978 HB2 ALA 17 HB2 ALA 17 34.303 7.329 -2.351 979 HB3 ALA 17 HB3 ALA 17 34.535 6.110 -1.100 980 H LEU 18 HN LEU 18 32.742 5.323 -0.275 981 HA LEU 18 HA LEU 18 30.502 5.198 -2.008 982 HB2 LEU 18 HB2 LEU 18 31.773 3.422 -0.004 983 HB3 LEU 18 HB1 LEU 18 30.077 3.098 -0.363 984 HG LEU 18 HG LEU 18 31.764 1.884 -1.832 985 HD11 LEU 18 HD11 LEU 18 29.932 3.732 -3.378 986 HD12 LEU 18 HD12 LEU 18 29.320 2.404 -2.391 987 HD13 LEU 18 HD13 LEU 18 30.379 2.070 -3.761 988 HD21 LEU 18 HD21 LEU 18 33.017 3.065 -3.439 989 HD22 LEU 18 HD22 LEU 18 33.183 4.076 -2.004 990 HD23 LEU 18 HD23 LEU 18 32.044 4.526 -3.273 991 H HIS 19 HN HIS 19 30.840 6.326 1.200 992 HA HIS 19 HA HIS 19 28.207 5.849 2.129 993 HB2 HIS 19 HB2 HIS 19 30.285 6.408 3.514 994 HB3 HIS 19 HB1 HIS 19 30.005 8.086 3.048 995 HD2 HIS 19 HD2 HIS 19 26.696 8.091 3.359 996 HE1 HIS 19 HE1 HIS 19 27.474 6.902 7.334 997 HE2 HIS 19 HE2 HIS 19 25.723 7.874 5.772 998 H PHE 20 HN PHE 20 29.802 8.715 0.745 999 HA PHE 20 HA PHE 20 27.382 10.249 0.762 1000 HB2 PHE 20 HB2 PHE 20 30.154 10.717 0.247 1001 HB3 PHE 20 HB1 PHE 20 29.218 11.305 -1.128 1002 HD1 PHE 20 HD1 PHE 20 30.239 11.963 2.250 1003 HD2 PHE 20 HD2 PHE 20 27.154 12.769 -0.629 1004 HE1 PHE 20 HE1 PHE 20 29.519 13.934 3.574 1005 HE2 PHE 20 HE2 PHE 20 26.435 14.739 0.694 1006 HZ PHE 20 HZ PHE 20 27.610 15.317 2.795 1007 H MET 21 HN MET 21 28.838 7.958 -1.410 1008 HA MET 21 HA MET 21 27.551 8.847 -3.797 1009 HB2 MET 21 HB2 MET 21 28.733 6.199 -2.951 1010 HB3 MET 21 HB1 MET 21 28.090 6.504 -4.567 1011 HG2 MET 21 HG2 MET 21 30.170 8.288 -3.301 1012 HG3 MET 21 HG1 MET 21 30.604 6.886 -4.276 1013 HE1 MET 21 HE1 MET 21 28.967 6.522 -6.571 1014 HE2 MET 21 HE2 MET 21 30.702 6.797 -6.702 1015 HE3 MET 21 HE3 MET 21 29.600 7.641 -7.787 1016 H ALA 22 HN ALA 22 26.851 6.119 -1.614 1017 HA ALA 22 HA ALA 22 24.379 5.473 -2.876 1018 HB1 ALA 22 HB1 ALA 22 25.031 4.786 -0.028 1019 HB2 ALA 22 HB2 ALA 22 25.850 3.991 -1.371 1020 HB3 ALA 22 HB3 ALA 22 24.100 3.857 -1.202 1021 H TRP 23 HN TRP 23 25.221 7.457 -0.070 1022 HA TRP 23 HA TRP 23 22.598 7.875 0.879 1023 HB2 TRP 23 HB2 TRP 23 24.922 8.458 1.928 1024 HB3 TRP 23 HB1 TRP 23 24.709 9.994 1.095 1025 HD1 TRP 23 HD1 TRP 23 23.612 8.026 4.067 1026 HE1 TRP 23 HE1 TRP 23 21.888 9.373 5.427 1027 HE3 TRP 23 HE3 TRP 23 22.659 11.812 0.775 1028 HZ2 TRP 23 HZ2 TRP 23 20.310 11.741 5.154 1029 HZ3 TRP 23 HZ3 TRP 23 21.041 13.599 1.351 1030 HH2 TRP 23 HH2 TRP 23 19.865 13.569 3.535 1031 H THR 24 HN THR 24 24.553 9.614 -1.522 1032 HA THR 24 HA THR 24 22.691 11.732 -1.929 1033 HB THR 24 HB THR 24 23.973 12.000 -4.118 1034 HG1 THR 24 HG1 THR 24 25.286 10.470 -4.641 1035 HG21 THR 24 HG21 THR 24 24.689 13.389 -2.368 1036 HG22 THR 24 HG22 THR 24 26.159 12.520 -2.807 1037 HG23 THR 24 HG23 THR 24 25.239 12.032 -1.384 1038 H ILE 25 HN ILE 25 23.187 8.575 -3.472 1039 HA ILE 25 HA ILE 25 21.357 8.934 -5.597 1040 HB ILE 25 HB ILE 25 22.323 6.466 -4.152 1041 HG12 ILE 25 HG12 ILE 25 22.943 7.454 -6.945 1042 HG13 ILE 25 HG11 ILE 25 23.899 7.934 -5.543 1043 HG21 ILE 25 HG21 ILE 25 20.483 6.781 -6.533 1044 HG22 ILE 25 HG22 ILE 25 20.238 5.804 -5.084 1045 HG23 ILE 25 HG23 ILE 25 21.438 5.320 -6.281 1046 HD11 ILE 25 HD11 ILE 25 24.127 5.418 -5.048 1047 HD12 ILE 25 HD12 ILE 25 25.031 6.043 -6.426 1048 HD13 ILE 25 HD13 ILE 25 23.526 5.161 -6.686 1049 H GLY 26 HN GLY 26 20.952 7.562 -2.339 1050 HA2 GLY 26 HA2 GLY 26 18.219 6.872 -2.602 1051 HA3 GLY 26 HA1 GLY 26 19.061 7.148 -1.079 1052 H HIS 27 HN HIS 27 19.834 9.821 -1.465 1053 HA HIS 27 HA HIS 27 17.599 11.223 -0.559 1054 HB2 HIS 27 HB2 HIS 27 19.797 12.077 -0.116 1055 HB3 HIS 27 HB1 HIS 27 20.167 12.182 -1.838 1056 HD2 HIS 27 HD2 HIS 27 19.420 14.578 -3.017 1057 HE1 HIS 27 HE1 HIS 27 17.081 16.075 0.165 1058 HE2 HIS 27 HE2 HIS 27 18.059 16.616 -2.116 1059 H LEU 28 HN LEU 28 19.016 11.034 -3.816 1060 HA LEU 28 HA LEU 28 17.022 12.781 -4.952 1061 HB2 LEU 28 HB2 LEU 28 19.455 12.293 -5.775 1062 HB3 LEU 28 HB1 LEU 28 18.715 10.901 -6.568 1063 HG LEU 28 HG LEU 28 17.262 13.455 -6.912 1064 HD11 LEU 28 HD11 LEU 28 19.854 12.995 -8.404 1065 HD12 LEU 28 HD12 LEU 28 19.726 14.078 -7.019 1066 HD13 LEU 28 HD13 LEU 28 18.803 14.408 -8.485 1067 HD21 LEU 28 HD21 LEU 28 18.247 11.445 -8.951 1068 HD22 LEU 28 HD22 LEU 28 16.896 12.567 -9.107 1069 HD23 LEU 28 HD23 LEU 28 16.780 11.196 -8.003 1070 H ASN 29 HN ASN 29 14.996 12.194 -5.373 1071 HA ASN 29 HA ASN 29 14.444 9.345 -5.958 1072 HB2 ASN 29 HB2 ASN 29 12.602 11.404 -4.717 1073 HB3 ASN 29 HB1 ASN 29 12.206 9.715 -5.031 1074 HD21 ASN 29 HD21 ASN 29 14.275 8.251 -4.095 1075 HD22 ASN 29 HD22 ASN 29 14.610 8.596 -2.467 1076 H GLN 30 HN GLN 30 13.183 8.835 -7.704 1077 HA GLN 30 HA GLN 30 12.555 11.070 -9.533 1078 HB2 GLN 30 HB2 GLN 30 13.343 8.206 -10.000 1079 HB3 GLN 30 HB1 GLN 30 12.489 9.121 -11.244 1080 HG2 GLN 30 HG2 GLN 30 15.024 10.091 -9.901 1081 HG3 GLN 30 HG1 GLN 30 15.008 9.212 -11.429 1082 HE21 GLN 30 HE21 GLN 30 13.856 10.272 -13.278 1083 HE22 GLN 30 HE22 GLN 30 13.685 11.960 -13.293 1084 H ILE 31 HN ILE 31 10.477 11.564 -9.714 1085 HA ILE 31 HA ILE 31 8.465 9.479 -9.129 1086 HB ILE 31 HB ILE 31 8.320 12.488 -8.852 1087 HG12 ILE 31 HG12 ILE 31 7.922 10.369 -6.733 1088 HG13 ILE 31 HG11 ILE 31 9.521 11.020 -7.099 1089 HG21 ILE 31 HG21 ILE 31 6.037 11.912 -7.849 1090 HG22 ILE 31 HG22 ILE 31 6.213 10.330 -8.608 1091 HG23 ILE 31 HG23 ILE 31 6.165 11.785 -9.603 1092 HD11 ILE 31 HD11 ILE 31 8.294 12.200 -5.217 1093 HD12 ILE 31 HD12 ILE 31 7.139 12.765 -6.424 1094 HD13 ILE 31 HD13 ILE 31 8.832 13.251 -6.528 1095 H LYS 32 HN LYS 32 7.183 8.843 -10.735 1096 HA LYS 32 HA LYS 32 6.944 10.582 -13.118 1097 HB2 LYS 32 HB2 LYS 32 7.281 7.586 -12.936 1098 HB3 LYS 32 HB1 LYS 32 6.702 8.395 -14.394 1099 HG2 LYS 32 HG2 LYS 32 8.733 9.635 -14.627 1100 HG3 LYS 32 HG1 LYS 32 9.279 9.176 -13.013 1101 HD2 LYS 32 HD2 LYS 32 10.477 7.792 -14.573 1102 HD3 LYS 32 HD1 LYS 32 9.262 6.769 -13.807 1103 HE2 LYS 32 HE2 LYS 32 9.248 6.371 -16.217 1104 HE3 LYS 32 HE1 LYS 32 7.748 7.164 -15.744 1105 HZ1 LYS 32 HZ1 LYS 32 8.207 8.817 -17.121 1106 HZ2 LYS 32 HZ2 LYS 32 9.622 8.022 -17.619 1107 HZ3 LYS 32 HZ3 LYS 32 9.678 9.130 -16.335 1108 H ARG 33 HN ARG 33 4.931 11.321 -13.267 1109 HA ARG 33 HA ARG 33 2.721 9.693 -12.203 1110 HB2 ARG 33 HB2 ARG 33 2.849 12.625 -12.957 1111 HB3 ARG 33 HB1 ARG 33 1.417 11.803 -12.335 1112 HG2 ARG 33 HG2 ARG 33 2.593 11.247 -10.268 1113 HG3 ARG 33 HG1 ARG 33 4.074 11.978 -10.887 1114 HD2 ARG 33 HD2 ARG 33 2.988 13.576 -9.432 1115 HD3 ARG 33 HD1 ARG 33 2.848 14.158 -11.080 1116 HE ARG 33 HE ARG 33 0.690 13.069 -9.410 1117 HH11 ARG 33 HH11 ARG 33 1.697 14.339 -12.512 1118 HH12 ARG 33 HH12 ARG 33 0.085 14.680 -13.015 1119 HH21 ARG 33 HH21 ARG 33 -1.387 13.520 -10.116 1120 HH22 ARG 33 HH22 ARG 33 -1.649 14.218 -11.679
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