NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
465807 | 2kq3 | 16585 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 HT1 ALA 1 -0.163 31.529 -9.470 2 H2 ALA 1 HT2 ALA 1 -0.305 31.084 -7.818 3 H3 ALA 1 HT3 ALA 1 1.149 31.788 -8.398 4 HA ALA 1 HA ALA 1 -0.426 33.221 -7.100 5 HB1 ALA 1 HB1 ALA 1 1.000 33.791 -9.626 6 HB2 ALA 1 HB2 ALA 1 1.232 34.463 -8.012 7 HB3 ALA 1 HB3 ALA 1 -0.090 35.041 -9.027 8 H THR 2 HN THR 2 -2.198 31.330 -8.440 9 HA THR 2 HA THR 2 -4.431 33.088 -8.818 10 HB THR 2 HB THR 2 -4.867 31.798 -11.118 11 HG1 THR 2 HG1 THR 2 -2.057 32.153 -11.098 12 HG21 THR 2 HG21 THR 2 -3.006 34.136 -11.213 13 HG22 THR 2 HG22 THR 2 -4.676 34.310 -10.674 14 HG23 THR 2 HG23 THR 2 -4.331 33.720 -12.300 15 H SER 3 HN SER 3 -3.248 29.784 -9.400 16 HA SER 3 HA SER 3 -5.395 28.751 -7.729 17 HB2 SER 3 HB2 SER 3 -6.385 28.701 -9.961 18 HB3 SER 3 HB1 SER 3 -4.979 27.840 -10.587 19 HG SER 3 HG SER 3 -6.036 26.113 -10.051 20 H THR 4 HN THR 4 -4.707 27.127 -6.478 21 HA THR 4 HA THR 4 -2.357 25.583 -7.319 22 HB THR 4 HB THR 4 -2.708 26.716 -4.539 23 HG1 THR 4 HG1 THR 4 -1.290 28.257 -5.087 24 HG21 THR 4 HG21 THR 4 -0.668 24.969 -5.801 25 HG22 THR 4 HG22 THR 4 -1.329 24.944 -4.167 26 HG23 THR 4 HG23 THR 4 -0.143 26.168 -4.619 27 H LYS 5 HN LYS 5 -5.239 25.005 -7.226 28 HA LYS 5 HA LYS 5 -5.282 22.893 -5.179 29 HB2 LYS 5 HB2 LYS 5 -7.720 22.914 -5.420 30 HB3 LYS 5 HB1 LYS 5 -7.110 24.504 -4.987 31 HG2 LYS 5 HG2 LYS 5 -7.137 24.662 -7.700 32 HG3 LYS 5 HG1 LYS 5 -8.523 23.615 -7.391 33 HD2 LYS 5 HD2 LYS 5 -9.635 25.238 -6.156 34 HD3 LYS 5 HD1 LYS 5 -8.154 26.136 -5.820 35 HE2 LYS 5 HE2 LYS 5 -8.464 27.417 -7.610 36 HE3 LYS 5 HE1 LYS 5 -8.596 26.002 -8.653 37 HZ1 LYS 5 HZ1 LYS 5 -10.603 27.229 -8.829 38 HZ2 LYS 5 HZ2 LYS 5 -10.779 27.334 -7.150 39 HZ3 LYS 5 HZ3 LYS 5 -10.957 25.842 -7.926 40 H LYS 6 HN LYS 6 -3.750 22.102 -7.126 41 HA LYS 6 HA LYS 6 -5.204 20.871 -9.292 42 HB2 LYS 6 HB2 LYS 6 -2.731 21.781 -9.211 43 HB3 LYS 6 HB1 LYS 6 -2.378 20.162 -8.623 44 HG2 LYS 6 HG2 LYS 6 -2.055 19.906 -10.875 45 HG3 LYS 6 HG1 LYS 6 -3.741 19.412 -10.716 46 HD2 LYS 6 HD2 LYS 6 -3.750 20.858 -12.551 47 HD3 LYS 6 HD1 LYS 6 -4.301 21.868 -11.212 48 HE2 LYS 6 HE2 LYS 6 -2.739 23.263 -12.112 49 HE3 LYS 6 HE1 LYS 6 -1.712 22.363 -10.996 50 HZ1 LYS 6 HZ1 LYS 6 -2.056 21.713 -13.874 51 HZ2 LYS 6 HZ2 LYS 6 -0.999 20.956 -12.792 52 HZ3 LYS 6 HZ3 LYS 6 -0.748 22.571 -13.228 53 H LEU 7 HN LEU 7 -5.215 18.580 -9.710 54 HA LEU 7 HA LEU 7 -5.592 16.405 -9.168 55 HB2 LEU 7 HB2 LEU 7 -3.422 17.229 -7.382 56 HB3 LEU 7 HB1 LEU 7 -4.364 15.888 -6.762 57 HG LEU 7 HG LEU 7 -3.970 14.903 -9.175 58 HD11 LEU 7 HD11 LEU 7 -1.845 16.994 -8.873 59 HD12 LEU 7 HD12 LEU 7 -2.862 16.635 -10.269 60 HD13 LEU 7 HD13 LEU 7 -1.565 15.530 -9.815 61 HD21 LEU 7 HD21 LEU 7 -1.608 14.163 -8.174 62 HD22 LEU 7 HD22 LEU 7 -3.142 13.553 -7.553 63 HD23 LEU 7 HD23 LEU 7 -2.316 14.870 -6.721 64 H HIS 8 HN HIS 8 -6.267 14.993 -7.075 65 HA HIS 8 HA HIS 8 -7.677 16.246 -5.001 66 HB2 HIS 8 HB2 HIS 8 -10.012 15.775 -5.801 67 HB3 HIS 8 HB1 HIS 8 -9.202 17.088 -6.648 68 HD1 HIS 8 HD1 HIS 8 -8.994 16.884 -9.141 69 HD2 HIS 8 HD2 HIS 8 -10.177 13.331 -7.342 70 HE1 HIS 8 HE1 HIS 8 -9.593 15.340 -11.033 71 HE2 HIS 8 HE2 HIS 8 -10.221 13.167 -9.922 72 H LYS 9 HN LYS 9 -7.672 14.744 -3.475 73 HA LYS 9 HA LYS 9 -8.000 11.926 -4.273 74 HB2 LYS 9 HB2 LYS 9 -6.383 13.120 -2.019 75 HB3 LYS 9 HB1 LYS 9 -6.692 11.398 -2.192 76 HG2 LYS 9 HG2 LYS 9 -4.623 11.591 -3.157 77 HG3 LYS 9 HG1 LYS 9 -5.674 11.736 -4.566 78 HD2 LYS 9 HD2 LYS 9 -3.945 13.432 -4.649 79 HD3 LYS 9 HD1 LYS 9 -5.518 14.191 -4.398 80 HE2 LYS 9 HE2 LYS 9 -4.170 13.506 -1.907 81 HE3 LYS 9 HE1 LYS 9 -3.246 14.631 -2.903 82 HZ1 LYS 9 HZ1 LYS 9 -5.665 15.715 -3.059 83 HZ2 LYS 9 HZ2 LYS 9 -4.542 16.130 -1.865 84 HZ3 LYS 9 HZ3 LYS 9 -5.771 15.020 -1.520 85 H GLU 10 HN GLU 10 -8.956 10.521 -2.595 86 HA GLU 10 HA GLU 10 -10.954 11.981 -0.996 87 HB2 GLU 10 HB2 GLU 10 -11.489 10.320 -3.098 88 HB3 GLU 10 HB1 GLU 10 -11.597 9.207 -1.742 89 HG2 GLU 10 HG2 GLU 10 -13.133 10.963 -0.681 90 HG3 GLU 10 HG1 GLU 10 -13.233 11.649 -2.301 91 HA PRO 11 HA PRO 11 -9.069 9.744 2.371 92 HB2 PRO 11 HB2 PRO 11 -10.559 10.711 4.372 93 HB3 PRO 11 HB1 PRO 11 -9.403 11.734 3.510 94 HG2 PRO 11 HG2 PRO 11 -12.372 11.561 3.209 95 HG3 PRO 11 HG1 PRO 11 -11.328 12.993 3.208 96 HD2 PRO 11 HD2 PRO 11 -12.309 11.766 0.938 97 HD3 PRO 11 HD1 PRO 11 -10.858 12.785 0.984 98 H ALA 12 HN ALA 12 -9.742 8.276 4.152 99 HA ALA 12 HA ALA 12 -12.363 7.159 4.152 100 HB1 ALA 12 HB1 ALA 12 -10.139 5.550 2.909 101 HB2 ALA 12 HB2 ALA 12 -11.610 6.113 2.116 102 HB3 ALA 12 HB3 ALA 12 -11.706 4.897 3.390 103 H THR 13 HN THR 13 -12.434 5.144 5.563 104 HA THR 13 HA THR 13 -10.355 5.302 7.647 105 HB THR 13 HB THR 13 -13.195 4.590 8.296 106 HG1 THR 13 HG1 THR 13 -12.180 7.234 8.273 107 HG21 THR 13 HG21 THR 13 -10.937 4.721 9.835 108 HG22 THR 13 HG22 THR 13 -12.598 4.794 10.425 109 HG23 THR 13 HG23 THR 13 -11.702 6.283 10.125 110 H LEU 14 HN LEU 14 -9.838 3.367 8.733 111 HA LEU 14 HA LEU 14 -10.106 1.017 7.106 112 HB2 LEU 14 HB2 LEU 14 -8.299 1.932 9.036 113 HB3 LEU 14 HB1 LEU 14 -9.048 0.517 9.755 114 HG LEU 14 HG LEU 14 -6.913 0.092 8.497 115 HD11 LEU 14 HD11 LEU 14 -7.636 -1.997 8.344 116 HD12 LEU 14 HD12 LEU 14 -8.690 -1.592 6.990 117 HD13 LEU 14 HD13 LEU 14 -9.269 -1.404 8.645 118 HD21 LEU 14 HD21 LEU 14 -8.326 0.065 5.927 119 HD22 LEU 14 HD22 LEU 14 -6.669 0.529 6.310 120 HD23 LEU 14 HD23 LEU 14 -7.986 1.672 6.568 121 H ILE 15 HN ILE 15 -11.974 -0.063 7.105 122 HA ILE 15 HA ILE 15 -13.787 -0.088 9.301 123 HB ILE 15 HB ILE 15 -13.720 -1.987 6.952 124 HG12 ILE 15 HG12 ILE 15 -13.738 0.388 6.239 125 HG13 ILE 15 HG11 ILE 15 -15.232 -0.448 5.827 126 HG21 ILE 15 HG21 ILE 15 -15.149 -2.541 8.970 127 HG22 ILE 15 HG22 ILE 15 -15.983 -2.452 7.419 128 HG23 ILE 15 HG23 ILE 15 -16.103 -1.115 8.562 129 HD11 ILE 15 HD11 ILE 15 -16.049 1.517 6.645 130 HD12 ILE 15 HD12 ILE 15 -14.745 1.700 7.819 131 HD13 ILE 15 HD13 ILE 15 -16.042 0.541 8.114 132 H LYS 16 HN LYS 16 -11.449 -2.385 7.990 133 HA LYS 16 HA LYS 16 -10.919 -3.542 10.515 134 HB2 LYS 16 HB2 LYS 16 -13.140 -4.643 9.121 135 HB3 LYS 16 HB1 LYS 16 -11.837 -5.820 9.044 136 HG2 LYS 16 HG2 LYS 16 -12.166 -4.667 11.696 137 HG3 LYS 16 HG1 LYS 16 -13.610 -5.499 11.115 138 HD2 LYS 16 HD2 LYS 16 -12.506 -7.540 10.923 139 HD3 LYS 16 HD1 LYS 16 -10.912 -6.783 10.887 140 HE2 LYS 16 HE2 LYS 16 -12.698 -6.680 13.303 141 HE3 LYS 16 HE1 LYS 16 -11.561 -7.998 13.024 142 HZ1 LYS 16 HZ1 LYS 16 -9.806 -6.231 12.844 143 HZ2 LYS 16 HZ2 LYS 16 -10.468 -6.439 14.386 144 HZ3 LYS 16 HZ3 LYS 16 -10.948 -5.128 13.431 145 H ALA 17 HN ALA 17 -8.971 -4.552 10.483 146 HA ALA 17 HA ALA 17 -7.470 -4.451 8.047 147 HB1 ALA 17 HB1 ALA 17 -6.383 -3.807 10.091 148 HB2 ALA 17 HB2 ALA 17 -5.594 -5.252 9.457 149 HB3 ALA 17 HB3 ALA 17 -6.717 -5.383 10.811 150 H ILE 18 HN ILE 18 -6.914 -6.088 6.718 151 HA ILE 18 HA ILE 18 -8.128 -8.693 7.209 152 HB ILE 18 HB ILE 18 -6.541 -8.074 4.748 153 HG12 ILE 18 HG12 ILE 18 -8.417 -6.283 5.498 154 HG13 ILE 18 HG11 ILE 18 -8.060 -6.670 3.825 155 HG21 ILE 18 HG21 ILE 18 -8.542 -9.463 3.827 156 HG22 ILE 18 HG22 ILE 18 -8.753 -9.917 5.518 157 HG23 ILE 18 HG23 ILE 18 -7.231 -10.262 4.695 158 HD11 ILE 18 HD11 ILE 18 -10.137 -8.247 5.258 159 HD12 ILE 18 HD12 ILE 18 -10.006 -7.846 3.546 160 HD13 ILE 18 HD13 ILE 18 -10.518 -6.617 4.703 161 H ASP 19 HN ASP 19 -5.021 -7.820 5.704 162 HA ASP 19 HA ASP 19 -3.646 -9.557 7.626 163 HB2 ASP 19 HB2 ASP 19 -3.965 -10.092 4.733 164 HB3 ASP 19 HB1 ASP 19 -2.339 -10.309 5.375 165 H GLY 20 HN GLY 20 -2.186 -8.527 4.621 166 HA2 GLY 20 HA2 GLY 20 -0.658 -6.499 6.133 167 HA3 GLY 20 HA1 GLY 20 0.053 -7.512 4.880 168 H ASP 21 HN ASP 21 -0.546 -7.159 2.689 169 HA ASP 21 HA ASP 21 -0.870 -4.443 2.014 170 HB2 ASP 21 HB2 ASP 21 -1.018 -6.962 0.355 171 HB3 ASP 21 HB1 ASP 21 -1.113 -5.344 -0.334 172 H THR 22 HN THR 22 -3.087 -7.009 2.633 173 HA THR 22 HA THR 22 -5.290 -5.607 1.331 174 HB THR 22 HB THR 22 -5.436 -8.204 2.856 175 HG1 THR 22 HG1 THR 22 -4.856 -7.811 0.109 176 HG21 THR 22 HG21 THR 22 -7.098 -8.195 0.597 177 HG22 THR 22 HG22 THR 22 -7.354 -6.657 1.422 178 HG23 THR 22 HG23 THR 22 -7.569 -8.173 2.297 179 H VAL 23 HN VAL 23 -6.765 -4.463 2.371 180 HA VAL 23 HA VAL 23 -7.284 -4.799 5.191 181 HB VAL 23 HB VAL 23 -6.889 -2.408 5.730 182 HG11 VAL 23 HG11 VAL 23 -4.310 -3.597 4.770 183 HG12 VAL 23 HG12 VAL 23 -5.217 -4.327 6.095 184 HG13 VAL 23 HG13 VAL 23 -4.630 -2.670 6.236 185 HG21 VAL 23 HG21 VAL 23 -6.847 -1.161 3.819 186 HG22 VAL 23 HG22 VAL 23 -5.977 -2.392 2.902 187 HG23 VAL 23 HG23 VAL 23 -5.113 -1.379 4.058 188 H LYS 24 HN LYS 24 -9.282 -3.936 5.810 189 HA LYS 24 HA LYS 24 -11.038 -3.286 3.590 190 HB2 LYS 24 HB2 LYS 24 -11.686 -4.931 5.366 191 HB3 LYS 24 HB1 LYS 24 -11.738 -3.601 6.512 192 HG2 LYS 24 HG2 LYS 24 -13.955 -3.892 5.891 193 HG3 LYS 24 HG1 LYS 24 -13.419 -2.529 4.906 194 HD2 LYS 24 HD2 LYS 24 -14.602 -3.911 3.423 195 HD3 LYS 24 HD1 LYS 24 -12.902 -4.259 3.102 196 HE2 LYS 24 HE2 LYS 24 -13.724 -6.388 3.226 197 HE3 LYS 24 HE1 LYS 24 -13.291 -6.129 4.915 198 HZ1 LYS 24 HZ1 LYS 24 -15.403 -6.891 5.159 199 HZ2 LYS 24 HZ2 LYS 24 -15.936 -6.278 3.676 200 HZ3 LYS 24 HZ3 LYS 24 -15.750 -5.242 4.999 201 H LEU 25 HN LEU 25 -11.580 -1.279 3.043 202 HA LEU 25 HA LEU 25 -11.208 0.850 5.037 203 HB2 LEU 25 HB2 LEU 25 -10.541 0.721 2.146 204 HB3 LEU 25 HB1 LEU 25 -10.998 2.268 2.821 205 HG LEU 25 HG LEU 25 -8.811 0.615 4.048 206 HD11 LEU 25 HD11 LEU 25 -8.775 2.140 1.531 207 HD12 LEU 25 HD12 LEU 25 -7.729 0.833 2.087 208 HD13 LEU 25 HD13 LEU 25 -7.458 2.482 2.653 209 HD21 LEU 25 HD21 LEU 25 -8.067 2.786 4.878 210 HD22 LEU 25 HD22 LEU 25 -9.727 2.451 5.372 211 HD23 LEU 25 HD23 LEU 25 -9.410 3.571 4.047 212 H MET 26 HN MET 26 -12.623 2.698 4.868 213 HA MET 26 HA MET 26 -15.327 1.890 4.211 214 HB2 MET 26 HB2 MET 26 -14.642 3.123 6.334 215 HB3 MET 26 HB1 MET 26 -14.456 4.552 5.327 216 HG2 MET 26 HG2 MET 26 -16.669 4.869 5.129 217 HG3 MET 26 HG1 MET 26 -17.019 3.143 5.049 218 HE1 MET 26 HE1 MET 26 -19.066 3.978 6.105 219 HE2 MET 26 HE2 MET 26 -19.300 4.268 7.829 220 HE3 MET 26 HE3 MET 26 -18.994 2.633 7.243 221 H TYR 27 HN TYR 27 -15.915 2.066 2.148 222 HA TYR 27 HA TYR 27 -15.320 4.591 0.751 223 HB2 TYR 27 HB2 TYR 27 -14.037 2.642 -0.157 224 HB3 TYR 27 HB1 TYR 27 -15.572 1.875 -0.551 225 HD1 TYR 27 HD1 TYR 27 -14.676 5.458 -0.923 226 HD2 TYR 27 HD2 TYR 27 -15.494 1.781 -2.896 227 HE1 TYR 27 HE1 TYR 27 -14.700 6.632 -3.084 228 HE2 TYR 27 HE2 TYR 27 -15.520 2.942 -5.063 229 HH TYR 27 HH TYR 27 -15.740 6.248 -5.375 230 H LYS 28 HN LYS 28 -17.071 5.716 0.238 231 HA LYS 28 HA LYS 28 -19.231 6.280 -0.183 232 HB2 LYS 28 HB2 LYS 28 -19.197 3.491 -1.331 233 HB3 LYS 28 HB1 LYS 28 -20.553 4.596 -1.506 234 HG2 LYS 28 HG2 LYS 28 -19.210 6.143 -2.754 235 HG3 LYS 28 HG1 LYS 28 -17.760 5.183 -2.455 236 HD2 LYS 28 HD2 LYS 28 -18.298 4.453 -4.559 237 HD3 LYS 28 HD1 LYS 28 -19.194 3.284 -3.588 238 HE2 LYS 28 HE2 LYS 28 -20.823 5.592 -3.982 239 HE3 LYS 28 HE1 LYS 28 -20.184 5.078 -5.543 240 HZ1 LYS 28 HZ1 LYS 28 -22.284 3.993 -5.030 241 HZ2 LYS 28 HZ2 LYS 28 -21.627 3.337 -3.617 242 HZ3 LYS 28 HZ3 LYS 28 -21.032 2.859 -5.126 243 H GLY 29 HN GLY 29 -18.750 5.515 2.415 244 HA2 GLY 29 HA2 GLY 29 -19.856 4.924 4.336 245 HA3 GLY 29 HA1 GLY 29 -21.331 4.979 3.381 246 H GLN 30 HN GLN 30 -18.887 2.840 2.277 247 HA GLN 30 HA GLN 30 -20.134 0.562 3.640 248 HB2 GLN 30 HB2 GLN 30 -20.832 -0.459 1.746 249 HB3 GLN 30 HB1 GLN 30 -20.805 1.165 1.078 250 HG2 GLN 30 HG2 GLN 30 -18.328 0.550 0.487 251 HG3 GLN 30 HG1 GLN 30 -18.926 -1.101 0.639 252 HE21 GLN 30 HE21 GLN 30 -17.970 -0.283 -1.744 253 HE22 GLN 30 HE22 GLN 30 -19.257 -0.091 -2.881 254 HA PRO 31 HA PRO 31 -15.966 -0.803 4.010 255 HB2 PRO 31 HB2 PRO 31 -16.319 -3.328 4.723 256 HB3 PRO 31 HB1 PRO 31 -16.985 -2.020 5.713 257 HG2 PRO 31 HG2 PRO 31 -18.379 -3.769 3.719 258 HG3 PRO 31 HG1 PRO 31 -18.909 -3.281 5.340 259 HD2 PRO 31 HD2 PRO 31 -19.702 -2.054 2.992 260 HD3 PRO 31 HD1 PRO 31 -19.735 -1.287 4.592 261 H MET 32 HN MET 32 -14.579 -1.030 2.384 262 HA MET 32 HA MET 32 -15.053 -3.165 0.409 263 HB2 MET 32 HB2 MET 32 -15.199 -0.645 -0.307 264 HB3 MET 32 HB1 MET 32 -13.443 -0.728 -0.257 265 HG2 MET 32 HG2 MET 32 -13.981 -1.166 -2.475 266 HG3 MET 32 HG1 MET 32 -13.665 -2.756 -1.782 267 HE1 MET 32 HE1 MET 32 -14.639 -3.780 -3.778 268 HE2 MET 32 HE2 MET 32 -15.476 -2.485 -4.635 269 HE3 MET 32 HE3 MET 32 -16.359 -3.929 -4.140 270 H THR 33 HN THR 33 -13.226 -4.282 -0.366 271 HA THR 33 HA THR 33 -11.066 -4.415 1.568 272 HB THR 33 HB THR 33 -11.308 -6.115 -0.903 273 HG1 THR 33 HG1 THR 33 -12.622 -7.504 0.304 274 HG21 THR 33 HG21 THR 33 -9.922 -7.578 0.089 275 HG22 THR 33 HG22 THR 33 -10.545 -7.243 1.705 276 HG23 THR 33 HG23 THR 33 -9.387 -6.140 0.959 277 H PHE 34 HN PHE 34 -9.388 -3.107 1.333 278 HA PHE 34 HA PHE 34 -8.570 -2.309 -1.366 279 HB2 PHE 34 HB2 PHE 34 -8.302 -1.067 1.336 280 HB3 PHE 34 HB1 PHE 34 -7.090 -0.689 0.115 281 HD1 PHE 34 HD1 PHE 34 -10.750 -0.673 0.748 282 HD2 PHE 34 HD2 PHE 34 -7.513 0.911 -1.516 283 HE1 PHE 34 HE1 PHE 34 -12.264 0.989 -0.254 284 HE2 PHE 34 HE2 PHE 34 -9.018 2.580 -2.514 285 HZ PHE 34 HZ PHE 34 -11.397 2.620 -1.884 286 H ARG 35 HN ARG 35 -6.333 -2.350 -1.960 287 HA ARG 35 HA ARG 35 -4.688 -4.157 -0.336 288 HB2 ARG 35 HB2 ARG 35 -4.200 -5.570 -2.106 289 HB3 ARG 35 HB1 ARG 35 -5.895 -5.200 -2.388 290 HG2 ARG 35 HG2 ARG 35 -5.160 -4.848 -4.484 291 HG3 ARG 35 HG1 ARG 35 -4.783 -3.249 -3.839 292 HD2 ARG 35 HD2 ARG 35 -2.584 -3.566 -4.076 293 HD3 ARG 35 HD1 ARG 35 -2.658 -5.172 -3.353 294 HE ARG 35 HE ARG 35 -2.659 -4.526 -6.156 295 HH11 ARG 35 HH11 ARG 35 -3.531 -6.915 -3.766 296 HH12 ARG 35 HH12 ARG 35 -3.499 -8.232 -4.889 297 HH21 ARG 35 HH21 ARG 35 -2.617 -6.257 -7.635 298 HH22 ARG 35 HH22 ARG 35 -2.982 -7.859 -7.086 299 H LEU 36 HN LEU 36 -2.493 -3.745 -0.308 300 HA LEU 36 HA LEU 36 -1.649 -1.123 -0.920 301 HB2 LEU 36 HB2 LEU 36 -0.125 -3.628 -0.197 302 HB3 LEU 36 HB1 LEU 36 0.680 -2.096 -0.500 303 HG LEU 36 HG LEU 36 -1.353 -2.602 1.676 304 HD11 LEU 36 HD11 LEU 36 0.929 -3.668 1.918 305 HD12 LEU 36 HD12 LEU 36 0.445 -2.565 3.207 306 HD13 LEU 36 HD13 LEU 36 1.584 -2.032 1.969 307 HD21 LEU 36 HD21 LEU 36 -1.402 -0.299 0.811 308 HD22 LEU 36 HD22 LEU 36 0.328 -0.162 1.119 309 HD23 LEU 36 HD23 LEU 36 -0.792 -0.381 2.463 310 H LEU 37 HN LEU 37 -2.219 -0.869 -3.127 311 HA LEU 37 HA LEU 37 -1.641 -2.339 -5.306 312 HB2 LEU 37 HB2 LEU 37 -2.731 -0.054 -5.180 313 HB3 LEU 37 HB1 LEU 37 -1.115 0.619 -5.254 314 HG LEU 37 HG LEU 37 -0.840 -0.695 -7.429 315 HD11 LEU 37 HD11 LEU 37 -3.288 -0.812 -8.476 316 HD12 LEU 37 HD12 LEU 37 -3.684 -1.189 -6.799 317 HD13 LEU 37 HD13 LEU 37 -2.524 -2.186 -7.676 318 HD21 LEU 37 HD21 LEU 37 -1.340 1.193 -8.561 319 HD22 LEU 37 HD22 LEU 37 -1.565 1.846 -6.938 320 HD23 LEU 37 HD23 LEU 37 -2.960 1.306 -7.873 321 H LEU 38 HN LEU 38 0.002 -2.588 -6.779 322 HA LEU 38 HA LEU 38 2.137 -3.278 -7.232 323 HB2 LEU 38 HB2 LEU 38 3.668 -1.349 -7.578 324 HB3 LEU 38 HB1 LEU 38 2.101 -1.194 -8.345 325 HG LEU 38 HG LEU 38 2.355 0.034 -5.666 326 HD11 LEU 38 HD11 LEU 38 3.576 1.399 -8.050 327 HD12 LEU 38 HD12 LEU 38 4.531 0.513 -6.861 328 HD13 LEU 38 HD13 LEU 38 3.589 1.919 -6.365 329 HD21 LEU 38 HD21 LEU 38 0.396 0.771 -6.434 330 HD22 LEU 38 HD22 LEU 38 0.767 0.281 -8.086 331 HD23 LEU 38 HD23 LEU 38 1.325 1.840 -7.481 332 H VAL 39 HN VAL 39 1.563 -3.633 -4.410 333 HA VAL 39 HA VAL 39 4.284 -3.248 -3.334 334 HB VAL 39 HB VAL 39 1.733 -3.484 -1.728 335 HG11 VAL 39 HG11 VAL 39 4.544 -2.872 -0.828 336 HG12 VAL 39 HG12 VAL 39 3.722 -4.419 -0.621 337 HG13 VAL 39 HG13 VAL 39 3.113 -2.980 0.197 338 HG21 VAL 39 HG21 VAL 39 1.465 -1.309 -2.129 339 HG22 VAL 39 HG22 VAL 39 3.016 -1.209 -2.964 340 HG23 VAL 39 HG23 VAL 39 2.944 -1.029 -1.211 341 H ASP 40 HN ASP 40 5.271 -4.984 -2.314 342 HA ASP 40 HA ASP 40 4.139 -7.587 -2.997 343 HB2 ASP 40 HB2 ASP 40 6.700 -6.571 -3.180 344 HB3 ASP 40 HB1 ASP 40 6.783 -7.587 -1.744 345 H THR 41 HN THR 41 3.442 -9.036 -1.551 346 HA THR 41 HA THR 41 3.549 -8.273 1.282 347 HB THR 41 HB THR 41 1.760 -10.478 0.619 348 HG1 THR 41 HG1 THR 41 0.289 -9.166 -0.552 349 HG21 THR 41 HG21 THR 41 1.666 -7.958 2.136 350 HG22 THR 41 HG22 THR 41 1.086 -9.568 2.559 351 HG23 THR 41 HG23 THR 41 0.138 -8.544 1.481 352 HA PRO 42 HA PRO 42 6.240 -11.524 2.530 353 HB2 PRO 42 HB2 PRO 42 4.091 -12.292 4.455 354 HB3 PRO 42 HB1 PRO 42 5.808 -11.991 4.747 355 HG2 PRO 42 HG2 PRO 42 3.987 -10.173 5.419 356 HG3 PRO 42 HG1 PRO 42 5.544 -9.685 4.723 357 HD2 PRO 42 HD2 PRO 42 2.845 -9.770 3.460 358 HD3 PRO 42 HD1 PRO 42 4.183 -8.634 3.193 359 H GLU 43 HN GLU 43 2.888 -12.224 1.808 360 HA GLU 43 HA GLU 43 1.845 -14.018 0.882 361 HB2 GLU 43 HB2 GLU 43 4.607 -14.144 -0.174 362 HB3 GLU 43 HB1 GLU 43 3.654 -15.613 -0.333 363 HG2 GLU 43 HG2 GLU 43 2.067 -14.581 -1.691 364 HG3 GLU 43 HG1 GLU 43 2.581 -12.963 -1.217 365 H THR 44 HN THR 44 2.811 -14.186 3.624 366 HA THR 44 HA THR 44 3.424 -17.037 3.904 367 HB THR 44 HB THR 44 4.840 -15.447 5.142 368 HG1 THR 44 HG1 THR 44 4.817 -17.250 6.268 369 HG21 THR 44 HG21 THR 44 2.360 -14.756 6.698 370 HG22 THR 44 HG22 THR 44 3.184 -13.688 5.561 371 HG23 THR 44 HG23 THR 44 4.003 -14.210 7.034 372 H LYS 45 HN LYS 45 2.375 -17.594 6.362 373 HA LYS 45 HA LYS 45 -0.489 -17.017 6.185 374 HB2 LYS 45 HB2 LYS 45 -0.838 -19.527 6.751 375 HB3 LYS 45 HB1 LYS 45 -0.548 -19.057 5.083 376 HG2 LYS 45 HG2 LYS 45 1.989 -19.525 6.080 377 HG3 LYS 45 HG1 LYS 45 0.998 -20.778 6.828 378 HD2 LYS 45 HD2 LYS 45 0.486 -20.342 3.968 379 HD3 LYS 45 HD1 LYS 45 2.099 -20.950 4.349 380 HE2 LYS 45 HE2 LYS 45 0.982 -22.931 4.179 381 HE3 LYS 45 HE1 LYS 45 0.722 -22.597 5.891 382 HZ1 LYS 45 HZ1 LYS 45 -1.408 -21.461 5.100 383 HZ2 LYS 45 HZ2 LYS 45 -1.371 -23.152 5.095 384 HZ3 LYS 45 HZ3 LYS 45 -1.175 -22.298 3.648 385 H HIS 46 HN HIS 46 1.748 -19.047 8.100 386 HA HIS 46 HA HIS 46 1.635 -17.512 10.426 387 HB2 HIS 46 HB2 HIS 46 -0.809 -18.494 10.143 388 HB3 HIS 46 HB1 HIS 46 -0.072 -19.926 10.855 389 HD1 HIS 46 HD1 HIS 46 -1.092 -16.424 11.652 390 HD2 HIS 46 HD2 HIS 46 0.642 -19.684 13.557 391 HE1 HIS 46 HE1 HIS 46 -1.143 -15.874 14.105 392 HE2 HIS 46 HE2 HIS 46 -0.005 -17.821 15.229 393 HA PRO 47 HA PRO 47 4.611 -21.148 10.122 394 HB2 PRO 47 HB2 PRO 47 6.866 -19.621 10.341 395 HB3 PRO 47 HB1 PRO 47 6.122 -20.049 8.797 396 HG2 PRO 47 HG2 PRO 47 5.893 -17.517 10.373 397 HG3 PRO 47 HG1 PRO 47 6.086 -17.734 8.623 398 HD2 PRO 47 HD2 PRO 47 3.698 -17.174 9.745 399 HD3 PRO 47 HD1 PRO 47 3.847 -18.206 8.307 400 H LYS 48 HN LYS 48 6.047 -21.904 11.790 401 HA LYS 48 HA LYS 48 5.145 -21.446 14.387 402 HB2 LYS 48 HB2 LYS 48 7.304 -22.966 13.117 403 HB3 LYS 48 HB1 LYS 48 7.689 -22.441 14.750 404 HG2 LYS 48 HG2 LYS 48 6.082 -23.749 15.702 405 HG3 LYS 48 HG1 LYS 48 5.047 -23.711 14.273 406 HD2 LYS 48 HD2 LYS 48 6.633 -25.188 13.109 407 HD3 LYS 48 HD1 LYS 48 7.627 -25.250 14.565 408 HE2 LYS 48 HE2 LYS 48 4.734 -26.066 14.546 409 HE3 LYS 48 HE1 LYS 48 6.035 -27.195 14.172 410 HZ1 LYS 48 HZ1 LYS 48 6.329 -25.653 16.621 411 HZ2 LYS 48 HZ2 LYS 48 6.702 -27.273 16.310 412 HZ3 LYS 48 HZ3 LYS 48 5.103 -26.818 16.621 413 H LYS 49 HN LYS 49 7.182 -21.076 16.100 414 HA LYS 49 HA LYS 49 7.442 -18.323 16.298 415 HB2 LYS 49 HB2 LYS 49 8.764 -20.653 17.583 416 HB3 LYS 49 HB1 LYS 49 9.547 -19.089 17.765 417 HG2 LYS 49 HG2 LYS 49 8.045 -19.615 19.630 418 HG3 LYS 49 HG1 LYS 49 7.554 -18.160 18.760 419 HD2 LYS 49 HD2 LYS 49 6.388 -20.791 17.971 420 HD3 LYS 49 HD1 LYS 49 5.789 -19.987 19.424 421 HE2 LYS 49 HE2 LYS 49 5.786 -17.928 17.670 422 HE3 LYS 49 HE1 LYS 49 5.453 -19.278 16.586 423 HZ1 LYS 49 HZ1 LYS 49 3.350 -18.901 17.231 424 HZ2 LYS 49 HZ2 LYS 49 3.795 -18.120 18.664 425 HZ3 LYS 49 HZ3 LYS 49 3.781 -19.810 18.592 426 H GLY 50 HN GLY 50 9.401 -20.626 14.570 427 HA2 GLY 50 HA2 GLY 50 11.307 -18.477 13.890 428 HA3 GLY 50 HA1 GLY 50 11.675 -20.194 13.825 429 H VAL 51 HN VAL 51 12.422 -19.680 11.642 430 HA VAL 51 HA VAL 51 12.190 -19.822 9.381 431 HB VAL 51 HB VAL 51 9.301 -20.546 9.860 432 HG11 VAL 51 HG11 VAL 51 10.099 -20.015 7.530 433 HG12 VAL 51 HG12 VAL 51 9.397 -21.618 7.747 434 HG13 VAL 51 HG13 VAL 51 11.147 -21.429 7.653 435 HG21 VAL 51 HG21 VAL 51 10.053 -22.892 9.893 436 HG22 VAL 51 HG22 VAL 51 10.676 -21.969 11.260 437 HG23 VAL 51 HG23 VAL 51 11.727 -22.340 9.893 438 H GLU 52 HN GLU 52 11.964 -18.280 7.877 439 HA GLU 52 HA GLU 52 11.373 -16.322 6.885 440 HB2 GLU 52 HB2 GLU 52 8.905 -17.649 7.602 441 HB3 GLU 52 HB1 GLU 52 8.704 -15.903 7.645 442 HG2 GLU 52 HG2 GLU 52 9.645 -15.800 5.348 443 HG3 GLU 52 HG1 GLU 52 9.650 -17.563 5.322 444 H LYS 53 HN LYS 53 12.411 -14.655 7.785 445 HA LYS 53 HA LYS 53 11.968 -13.779 10.462 446 HB2 LYS 53 HB2 LYS 53 13.428 -11.841 9.749 447 HB3 LYS 53 HB1 LYS 53 14.142 -13.438 9.571 448 HG2 LYS 53 HG2 LYS 53 13.972 -13.395 7.255 449 HG3 LYS 53 HG1 LYS 53 12.754 -12.118 7.273 450 HD2 LYS 53 HD2 LYS 53 14.704 -11.032 6.578 451 HD3 LYS 53 HD1 LYS 53 14.591 -10.649 8.297 452 HE2 LYS 53 HE2 LYS 53 16.071 -13.108 7.671 453 HE3 LYS 53 HE1 LYS 53 16.811 -11.626 7.069 454 HZ1 LYS 53 HZ1 LYS 53 16.661 -10.717 9.330 455 HZ2 LYS 53 HZ2 LYS 53 17.619 -12.109 9.265 456 HZ3 LYS 53 HZ3 LYS 53 16.047 -12.194 9.882 457 H TYR 54 HN TYR 54 10.644 -12.942 7.364 458 HA TYR 54 HA TYR 54 9.380 -10.535 8.426 459 HB2 TYR 54 HB2 TYR 54 8.502 -10.375 6.022 460 HB3 TYR 54 HB1 TYR 54 10.232 -10.160 6.265 461 HD1 TYR 54 HD2 TYR 54 7.656 -12.579 5.159 462 HD2 TYR 54 HD1 TYR 54 11.795 -11.598 5.226 463 HE1 TYR 54 HE2 TYR 54 8.099 -14.362 3.525 464 HE2 TYR 54 HE1 TYR 54 12.250 -13.378 3.591 465 HH TYR 54 HH TYR 54 10.620 -14.585 1.683 466 H GLY 55 HN GLY 55 7.021 -10.227 7.673 467 HA2 GLY 55 HA2 GLY 55 5.028 -11.709 7.069 468 HA3 GLY 55 HA1 GLY 55 5.549 -12.662 8.450 469 HA PRO 56 HA PRO 56 2.821 -10.403 11.077 470 HB2 PRO 56 HB2 PRO 56 5.065 -10.373 13.032 471 HB3 PRO 56 HB1 PRO 56 3.403 -10.940 13.234 472 HG2 PRO 56 HG2 PRO 56 5.408 -12.673 12.975 473 HG3 PRO 56 HG1 PRO 56 3.834 -12.978 12.216 474 HD2 PRO 56 HD2 PRO 56 6.391 -12.054 10.978 475 HD3 PRO 56 HD1 PRO 56 5.152 -13.149 10.330 476 H GLU 57 HN GLU 57 6.211 -9.311 11.171 477 HA GLU 57 HA GLU 57 5.705 -6.697 12.042 478 HB2 GLU 57 HB2 GLU 57 7.964 -8.101 10.726 479 HB3 GLU 57 HB1 GLU 57 7.962 -6.345 10.627 480 HG2 GLU 57 HG2 GLU 57 9.262 -7.087 12.522 481 HG3 GLU 57 HG1 GLU 57 7.832 -6.208 13.063 482 H ALA 58 HN ALA 58 5.818 -8.088 8.801 483 HA ALA 58 HA ALA 58 5.603 -5.616 7.414 484 HB1 ALA 58 HB1 ALA 58 4.670 -7.361 5.608 485 HB2 ALA 58 HB2 ALA 58 5.472 -8.482 6.708 486 HB3 ALA 58 HB3 ALA 58 6.386 -7.168 5.967 487 H SER 59 HN SER 59 3.240 -8.093 8.350 488 HA SER 59 HA SER 59 1.014 -6.747 7.193 489 HB2 SER 59 HB2 SER 59 1.438 -9.130 8.903 490 HB3 SER 59 HB1 SER 59 -0.147 -8.365 9.019 491 HG SER 59 HG SER 59 0.482 -10.060 7.250 492 H ALA 60 HN ALA 60 2.356 -6.923 10.459 493 HA ALA 60 HA ALA 60 0.329 -5.482 11.766 494 HB1 ALA 60 HB1 ALA 60 3.209 -5.433 12.609 495 HB2 ALA 60 HB2 ALA 60 2.211 -6.876 12.786 496 HB3 ALA 60 HB3 ALA 60 1.762 -5.387 13.616 497 H PHE 61 HN PHE 61 3.442 -4.400 10.421 498 HA PHE 61 HA PHE 61 3.383 -1.752 11.135 499 HB2 PHE 61 HB2 PHE 61 5.280 -2.830 9.997 500 HB3 PHE 61 HB1 PHE 61 4.353 -2.874 8.501 501 HD1 PHE 61 HD1 PHE 61 5.793 -0.577 11.018 502 HD2 PHE 61 HD2 PHE 61 4.343 -1.052 7.049 503 HE1 PHE 61 HE1 PHE 61 6.603 1.681 10.455 504 HE2 PHE 61 HE2 PHE 61 5.140 1.201 6.478 505 HZ PHE 61 HZ PHE 61 6.274 2.573 8.183 506 H THR 62 HN THR 62 2.114 -3.095 8.078 507 HA THR 62 HA THR 62 1.103 -0.773 6.989 508 HB THR 62 HB THR 62 -0.131 -3.532 6.830 509 HG1 THR 62 HG1 THR 62 1.785 -3.857 5.976 510 HG21 THR 62 HG21 THR 62 -0.940 -2.840 4.632 511 HG22 THR 62 HG22 THR 62 -0.357 -1.204 4.939 512 HG23 THR 62 HG23 THR 62 -1.649 -1.880 5.931 513 H LYS 63 HN LYS 63 -0.439 -2.960 9.306 514 HA LYS 63 HA LYS 63 -2.883 -1.471 9.417 515 HB2 LYS 63 HB2 LYS 63 -2.683 -3.911 9.953 516 HB3 LYS 63 HB1 LYS 63 -1.812 -3.471 11.415 517 HG2 LYS 63 HG2 LYS 63 -4.216 -1.979 11.372 518 HG3 LYS 63 HG1 LYS 63 -4.614 -3.656 10.996 519 HD2 LYS 63 HD2 LYS 63 -2.981 -2.742 13.364 520 HD3 LYS 63 HD1 LYS 63 -4.688 -3.184 13.416 521 HE2 LYS 63 HE2 LYS 63 -3.320 -5.300 12.139 522 HE3 LYS 63 HE1 LYS 63 -2.384 -4.868 13.570 523 HZ1 LYS 63 HZ1 LYS 63 -4.277 -5.206 14.945 524 HZ2 LYS 63 HZ2 LYS 63 -4.132 -6.569 13.954 525 HZ3 LYS 63 HZ3 LYS 63 -5.303 -5.398 13.612 526 H LYS 64 HN LYS 64 0.154 -1.450 11.118 527 HA LYS 64 HA LYS 64 -0.570 -0.030 13.416 528 HB2 LYS 64 HB2 LYS 64 1.721 -1.144 12.506 529 HB3 LYS 64 HB1 LYS 64 2.081 0.555 12.238 530 HG2 LYS 64 HG2 LYS 64 1.140 -0.534 14.877 531 HG3 LYS 64 HG1 LYS 64 2.842 -0.388 14.430 532 HD2 LYS 64 HD2 LYS 64 1.067 1.993 14.160 533 HD3 LYS 64 HD1 LYS 64 1.625 1.522 15.767 534 HE2 LYS 64 HE2 LYS 64 3.844 1.925 15.258 535 HE3 LYS 64 HE1 LYS 64 3.584 1.748 13.523 536 HZ1 LYS 64 HZ1 LYS 64 2.078 3.864 13.987 537 HZ2 LYS 64 HZ2 LYS 64 3.725 3.986 13.623 538 HZ3 LYS 64 HZ3 LYS 64 3.206 4.078 15.230 539 H MET 65 HN MET 65 0.624 1.144 10.281 540 HA MET 65 HA MET 65 0.630 3.873 10.950 541 HB2 MET 65 HB2 MET 65 0.560 2.383 8.347 542 HB3 MET 65 HB1 MET 65 0.474 4.139 8.384 543 HG2 MET 65 HG2 MET 65 2.604 4.006 9.811 544 HG3 MET 65 HG1 MET 65 2.719 2.349 9.220 545 HE1 MET 65 HE1 MET 65 1.695 5.553 6.449 546 HE2 MET 65 HE2 MET 65 3.086 6.301 7.235 547 HE3 MET 65 HE3 MET 65 1.723 5.737 8.203 548 H VAL 66 HN VAL 66 -1.783 1.985 9.115 549 HA VAL 66 HA VAL 66 -3.587 4.095 8.736 550 HB VAL 66 HB VAL 66 -5.302 2.322 8.365 551 HG11 VAL 66 HG11 VAL 66 -4.178 2.932 6.431 552 HG12 VAL 66 HG12 VAL 66 -3.937 1.185 6.483 553 HG13 VAL 66 HG13 VAL 66 -2.643 2.269 6.993 554 HG21 VAL 66 HG21 VAL 66 -3.033 0.486 9.126 555 HG22 VAL 66 HG22 VAL 66 -4.535 -0.029 8.361 556 HG23 VAL 66 HG23 VAL 66 -4.565 0.681 9.974 557 H GLU 67 HN GLU 67 -3.416 1.649 11.300 558 HA GLU 67 HA GLU 67 -5.765 2.470 12.632 559 HB2 GLU 67 HB2 GLU 67 -3.348 0.985 13.668 560 HB3 GLU 67 HB1 GLU 67 -4.861 1.167 14.546 561 HG2 GLU 67 HG2 GLU 67 -4.781 -0.057 11.815 562 HG3 GLU 67 HG1 GLU 67 -4.452 -1.007 13.265 563 H ASN 68 HN ASN 68 -2.344 3.270 13.117 564 HA ASN 68 HA ASN 68 -2.801 4.941 15.375 565 HB2 ASN 68 HB2 ASN 68 -0.483 4.520 13.510 566 HB3 ASN 68 HB1 ASN 68 -0.450 5.823 14.694 567 HD21 ASN 68 HD21 ASN 68 -1.387 2.398 14.610 568 HD22 ASN 68 HD22 ASN 68 -0.556 1.962 16.061 569 H ALA 69 HN ALA 69 -2.803 5.439 11.923 570 HA ALA 69 HA ALA 69 -2.694 8.295 12.031 571 HB1 ALA 69 HB1 ALA 69 -3.689 7.903 9.609 572 HB2 ALA 69 HB2 ALA 69 -3.146 6.255 9.923 573 HB3 ALA 69 HB3 ALA 69 -1.994 7.589 9.982 574 H LYS 70 HN LYS 70 -4.273 9.608 12.632 575 HA LYS 70 HA LYS 70 -6.847 8.769 13.335 576 HB2 LYS 70 HB2 LYS 70 -5.794 11.526 12.692 577 HB3 LYS 70 HB1 LYS 70 -7.385 11.220 13.375 578 HG2 LYS 70 HG2 LYS 70 -5.895 9.882 15.146 579 HG3 LYS 70 HG1 LYS 70 -4.720 11.096 14.637 580 HD2 LYS 70 HD2 LYS 70 -6.584 12.803 15.044 581 HD3 LYS 70 HD1 LYS 70 -7.412 11.506 15.907 582 HE2 LYS 70 HE2 LYS 70 -4.952 11.353 17.017 583 HE3 LYS 70 HE1 LYS 70 -5.039 13.078 16.664 584 HZ1 LYS 70 HZ1 LYS 70 -6.667 11.474 18.501 585 HZ2 LYS 70 HZ2 LYS 70 -7.371 12.829 17.776 586 HZ3 LYS 70 HZ3 LYS 70 -5.983 13.005 18.725 587 H LYS 71 HN LYS 71 -5.527 9.559 10.261 588 HA LYS 71 HA LYS 71 -8.158 9.174 9.053 589 HB2 LYS 71 HB2 LYS 71 -7.397 11.690 9.337 590 HB3 LYS 71 HB1 LYS 71 -6.440 11.328 7.908 591 HG2 LYS 71 HG2 LYS 71 -8.424 10.731 6.676 592 HG3 LYS 71 HG1 LYS 71 -9.419 10.948 8.117 593 HD2 LYS 71 HD2 LYS 71 -7.726 13.216 7.181 594 HD3 LYS 71 HD1 LYS 71 -9.216 12.849 6.309 595 HE2 LYS 71 HE2 LYS 71 -9.370 12.982 9.265 596 HE3 LYS 71 HE1 LYS 71 -9.136 14.502 8.403 597 HZ1 LYS 71 HZ1 LYS 71 -11.198 12.752 7.346 598 HZ2 LYS 71 HZ2 LYS 71 -11.198 14.432 7.543 599 HZ3 LYS 71 HZ3 LYS 71 -11.521 13.427 8.864 600 H ILE 72 HN ILE 72 -8.127 8.133 7.106 601 HA ILE 72 HA ILE 72 -5.477 7.377 6.060 602 HB ILE 72 HB ILE 72 -7.935 5.706 5.662 603 HG12 ILE 72 HG12 ILE 72 -5.998 5.507 7.980 604 HG13 ILE 72 HG11 ILE 72 -7.686 5.996 8.091 605 HG21 ILE 72 HG21 ILE 72 -5.644 5.495 4.424 606 HG22 ILE 72 HG22 ILE 72 -6.509 4.055 4.964 607 HG23 ILE 72 HG23 ILE 72 -5.154 4.675 5.907 608 HD11 ILE 72 HD11 ILE 72 -7.416 3.704 8.796 609 HD12 ILE 72 HD12 ILE 72 -6.668 3.292 7.253 610 HD13 ILE 72 HD13 ILE 72 -8.364 3.774 7.310 611 H GLU 73 HN GLU 73 -5.174 7.389 3.842 612 HA GLU 73 HA GLU 73 -7.410 8.422 2.225 613 HB2 GLU 73 HB2 GLU 73 -4.576 9.268 1.704 614 HB3 GLU 73 HB1 GLU 73 -6.069 10.027 1.171 615 HG2 GLU 73 HG2 GLU 73 -6.527 10.690 3.501 616 HG3 GLU 73 HG1 GLU 73 -4.976 9.998 3.975 617 H VAL 74 HN VAL 74 -7.658 7.545 0.219 618 HA VAL 74 HA VAL 74 -5.639 5.572 -0.614 619 HB VAL 74 HB VAL 74 -7.645 4.399 -1.738 620 HG11 VAL 74 HG11 VAL 74 -7.958 3.914 1.117 621 HG12 VAL 74 HG12 VAL 74 -6.273 3.981 0.600 622 HG13 VAL 74 HG13 VAL 74 -7.384 2.844 -0.163 623 HG21 VAL 74 HG21 VAL 74 -9.059 6.487 -0.747 624 HG22 VAL 74 HG22 VAL 74 -9.318 5.278 0.511 625 HG23 VAL 74 HG23 VAL 74 -9.754 4.920 -1.160 626 H GLU 75 HN GLU 75 -5.117 5.443 -2.745 627 HA GLU 75 HA GLU 75 -6.478 7.298 -4.582 628 HB2 GLU 75 HB2 GLU 75 -4.379 8.328 -3.872 629 HB3 GLU 75 HB1 GLU 75 -3.493 6.882 -4.333 630 HG2 GLU 75 HG2 GLU 75 -3.667 7.317 -6.574 631 HG3 GLU 75 HG1 GLU 75 -5.135 8.275 -6.385 632 H PHE 76 HN PHE 76 -7.457 6.026 -6.030 633 HA PHE 76 HA PHE 76 -6.527 3.416 -6.691 634 HB2 PHE 76 HB2 PHE 76 -8.719 5.158 -7.818 635 HB3 PHE 76 HB1 PHE 76 -8.371 3.547 -8.434 636 HD1 PHE 76 HD2 PHE 76 -8.030 1.824 -6.261 637 HD2 PHE 76 HD1 PHE 76 -10.581 5.224 -6.511 638 HE1 PHE 76 HE2 PHE 76 -9.489 0.854 -4.534 639 HE2 PHE 76 HE1 PHE 76 -12.042 4.258 -4.784 640 HZ PHE 76 HZ PHE 76 -11.498 2.070 -3.796 641 H ASP 77 HN ASP 77 -5.955 2.688 -8.790 642 HA ASP 77 HA ASP 77 -3.968 4.298 -10.022 643 HB2 ASP 77 HB2 ASP 77 -3.692 2.426 -11.577 644 HB3 ASP 77 HB1 ASP 77 -3.796 1.847 -9.918 645 H LYS 78 HN LYS 78 -4.119 3.989 -12.684 646 HA LYS 78 HA LYS 78 -6.498 5.568 -13.396 647 HB2 LYS 78 HB2 LYS 78 -4.298 5.572 -15.330 648 HB3 LYS 78 HB1 LYS 78 -5.202 6.917 -14.649 649 HG2 LYS 78 HG2 LYS 78 -2.890 5.488 -13.352 650 HG3 LYS 78 HG1 LYS 78 -2.853 7.092 -14.086 651 HD2 LYS 78 HD2 LYS 78 -4.886 7.410 -12.346 652 HD3 LYS 78 HD1 LYS 78 -3.917 6.217 -11.478 653 HE2 LYS 78 HE2 LYS 78 -3.173 8.356 -10.766 654 HE3 LYS 78 HE1 LYS 78 -1.934 7.717 -11.846 655 HZ1 LYS 78 HZ1 LYS 78 -3.466 9.056 -13.566 656 HZ2 LYS 78 HZ2 LYS 78 -2.125 9.731 -12.787 657 HZ3 LYS 78 HZ3 LYS 78 -3.681 10.006 -12.182 658 H GLY 79 HN GLY 79 -5.161 2.517 -13.745 659 HA2 GLY 79 HA2 GLY 79 -6.234 2.086 -16.428 660 HA3 GLY 79 HA1 GLY 79 -5.270 0.948 -15.502 661 H GLN 80 HN GLN 80 -6.265 -0.475 -14.108 662 HA GLN 80 HA GLN 80 -9.065 -0.941 -14.634 663 HB2 GLN 80 HB2 GLN 80 -8.750 -3.035 -13.467 664 HB3 GLN 80 HB1 GLN 80 -7.432 -2.787 -14.600 665 HG2 GLN 80 HG2 GLN 80 -6.104 -1.888 -12.638 666 HG3 GLN 80 HG1 GLN 80 -7.379 -2.546 -11.614 667 HE21 GLN 80 HE21 GLN 80 -7.980 -4.892 -12.792 668 HE22 GLN 80 HE22 GLN 80 -6.614 -5.948 -12.779 669 H ARG 81 HN ARG 81 -7.092 -0.417 -11.723 670 HA ARG 81 HA ARG 81 -7.597 0.597 -9.739 671 HB2 ARG 81 HB2 ARG 81 -10.371 1.111 -10.806 672 HB3 ARG 81 HB1 ARG 81 -9.565 1.933 -9.478 673 HG2 ARG 81 HG2 ARG 81 -8.021 2.979 -10.988 674 HG3 ARG 81 HG1 ARG 81 -8.654 2.044 -12.345 675 HD2 ARG 81 HD2 ARG 81 -9.490 4.390 -12.241 676 HD3 ARG 81 HD1 ARG 81 -10.760 3.168 -12.226 677 HE ARG 81 HE ARG 81 -9.943 4.021 -9.606 678 HH11 ARG 81 HH11 ARG 81 -12.052 4.689 -12.306 679 HH12 ARG 81 HH12 ARG 81 -13.206 5.558 -11.351 680 HH21 ARG 81 HH21 ARG 81 -11.460 5.161 -8.348 681 HH22 ARG 81 HH22 ARG 81 -12.869 5.827 -9.104 682 H THR 82 HN THR 82 -9.198 -2.050 -11.057 683 HA THR 82 HA THR 82 -9.653 -3.180 -8.458 684 HB THR 82 HB THR 82 -12.086 -3.810 -9.249 685 HG1 THR 82 HG1 THR 82 -13.029 -2.027 -10.351 686 HG21 THR 82 HG21 THR 82 -12.896 -2.408 -7.697 687 HG22 THR 82 HG22 THR 82 -12.054 -1.007 -8.361 688 HG23 THR 82 HG23 THR 82 -11.187 -2.158 -7.343 689 H ASP 83 HN ASP 83 -8.976 -5.202 -8.600 690 HA ASP 83 HA ASP 83 -8.593 -6.445 -11.171 691 HB2 ASP 83 HB2 ASP 83 -7.716 -6.926 -8.400 692 HB3 ASP 83 HB1 ASP 83 -7.954 -8.383 -9.360 693 H LYS 84 HN LYS 84 -9.026 -9.055 -10.870 694 HA LYS 84 HA LYS 84 -11.635 -9.509 -11.527 695 HB2 LYS 84 HB2 LYS 84 -11.047 -11.851 -10.233 696 HB3 LYS 84 HB1 LYS 84 -10.637 -11.484 -11.905 697 HG2 LYS 84 HG2 LYS 84 -8.724 -10.646 -9.794 698 HG3 LYS 84 HG1 LYS 84 -8.852 -12.367 -10.161 699 HD2 LYS 84 HD2 LYS 84 -8.747 -11.214 -12.656 700 HD3 LYS 84 HD1 LYS 84 -7.652 -10.204 -11.711 701 HE2 LYS 84 HE2 LYS 84 -7.492 -13.197 -11.610 702 HE3 LYS 84 HE1 LYS 84 -6.696 -12.282 -12.889 703 HZ1 LYS 84 HZ1 LYS 84 -6.022 -12.502 -10.074 704 HZ2 LYS 84 HZ2 LYS 84 -5.861 -10.956 -10.741 705 HZ3 LYS 84 HZ3 LYS 84 -5.017 -12.258 -11.414 706 H TYR 85 HN TYR 85 -10.243 -9.991 -8.291 707 HA TYR 85 HA TYR 85 -12.726 -10.615 -7.087 708 HB2 TYR 85 HB2 TYR 85 -9.953 -10.370 -6.268 709 HB3 TYR 85 HB1 TYR 85 -11.039 -9.707 -5.052 710 HD1 TYR 85 HD1 TYR 85 -10.180 -12.747 -6.965 711 HD2 TYR 85 HD2 TYR 85 -12.405 -11.133 -3.717 712 HE1 TYR 85 HE1 TYR 85 -10.653 -15.024 -6.165 713 HE2 TYR 85 HE2 TYR 85 -12.883 -13.406 -2.908 714 HH TYR 85 HH TYR 85 -12.574 -16.098 -4.700 715 H GLY 86 HN GLY 86 -11.772 -7.757 -8.356 716 HA2 GLY 86 HA2 GLY 86 -12.609 -5.627 -8.176 717 HA3 GLY 86 HA1 GLY 86 -13.812 -6.268 -7.066 718 H ARG 87 HN ARG 87 -10.503 -6.835 -6.309 719 HA ARG 87 HA ARG 87 -10.636 -5.638 -3.793 720 HB2 ARG 87 HB2 ARG 87 -8.199 -6.226 -5.484 721 HB3 ARG 87 HB1 ARG 87 -8.169 -5.864 -3.763 722 HG2 ARG 87 HG2 ARG 87 -9.559 -8.222 -5.020 723 HG3 ARG 87 HG1 ARG 87 -7.983 -8.264 -4.228 724 HD2 ARG 87 HD2 ARG 87 -9.317 -8.930 -2.497 725 HD3 ARG 87 HD1 ARG 87 -9.328 -7.186 -2.239 726 HE ARG 87 HE ARG 87 -11.473 -7.522 -3.803 727 HH11 ARG 87 HH11 ARG 87 -10.432 -9.208 -0.928 728 HH12 ARG 87 HH12 ARG 87 -12.043 -9.586 -0.418 729 HH21 ARG 87 HH21 ARG 87 -13.590 -8.017 -3.130 730 HH22 ARG 87 HH22 ARG 87 -13.835 -8.910 -1.666 731 H GLY 88 HN GLY 88 -9.083 -3.861 -3.053 732 HA2 GLY 88 HA2 GLY 88 -9.636 -1.522 -4.698 733 HA3 GLY 88 HA1 GLY 88 -9.074 -1.510 -3.036 734 H LEU 89 HN LEU 89 -8.214 -1.179 -6.287 735 HA LEU 89 HA LEU 89 -5.389 -1.686 -5.885 736 HB2 LEU 89 HB2 LEU 89 -7.011 -0.761 -8.241 737 HB3 LEU 89 HB1 LEU 89 -5.261 -0.846 -8.277 738 HG LEU 89 HG LEU 89 -6.621 -2.803 -9.246 739 HD11 LEU 89 HD11 LEU 89 -4.407 -3.289 -7.265 740 HD12 LEU 89 HD12 LEU 89 -4.217 -2.857 -8.965 741 HD13 LEU 89 HD13 LEU 89 -4.920 -4.413 -8.523 742 HD21 LEU 89 HD21 LEU 89 -7.357 -4.493 -7.749 743 HD22 LEU 89 HD22 LEU 89 -8.096 -2.978 -7.227 744 HD23 LEU 89 HD23 LEU 89 -6.707 -3.628 -6.357 745 H ALA 90 HN ALA 90 -5.429 0.007 -4.118 746 HA ALA 90 HA ALA 90 -4.501 2.527 -5.254 747 HB1 ALA 90 HB1 ALA 90 -6.802 3.044 -4.864 748 HB2 ALA 90 HB2 ALA 90 -5.855 3.823 -3.600 749 HB3 ALA 90 HB3 ALA 90 -6.742 2.341 -3.250 750 H TYR 91 HN TYR 91 -3.522 3.936 -3.526 751 HA TYR 91 HA TYR 91 -1.986 2.240 -1.711 752 HB2 TYR 91 HB2 TYR 91 -1.462 5.169 -2.086 753 HB3 TYR 91 HB1 TYR 91 -0.332 3.887 -1.681 754 HD1 TYR 91 HD2 TYR 91 -2.396 5.246 -4.456 755 HD2 TYR 91 HD1 TYR 91 0.942 2.849 -3.356 756 HE1 TYR 91 HE2 TYR 91 -1.724 5.112 -6.816 757 HE2 TYR 91 HE1 TYR 91 1.626 2.712 -5.713 758 HH TYR 91 HH TYR 91 -0.332 3.420 -8.240 759 H ILE 92 HN ILE 92 -2.155 2.350 0.468 760 HA ILE 92 HA ILE 92 -4.305 4.018 1.551 761 HB ILE 92 HB ILE 92 -2.728 1.808 2.880 762 HG12 ILE 92 HG12 ILE 92 -5.228 0.830 2.618 763 HG13 ILE 92 HG11 ILE 92 -5.162 1.848 1.184 764 HG21 ILE 92 HG21 ILE 92 -4.410 1.869 4.608 765 HG22 ILE 92 HG22 ILE 92 -5.287 3.139 3.754 766 HG23 ILE 92 HG23 ILE 92 -3.694 3.472 4.434 767 HD11 ILE 92 HD11 ILE 92 -4.521 -0.460 0.718 768 HD12 ILE 92 HD12 ILE 92 -3.194 -0.319 1.873 769 HD13 ILE 92 HD13 ILE 92 -3.198 0.666 0.408 770 H TYR 93 HN TYR 93 -3.901 5.865 2.550 771 HA TYR 93 HA TYR 93 -1.162 6.463 3.397 772 HB2 TYR 93 HB2 TYR 93 -3.534 8.314 3.087 773 HB3 TYR 93 HB1 TYR 93 -1.897 8.806 3.484 774 HD1 TYR 93 HD2 TYR 93 -2.810 6.294 0.902 775 HD2 TYR 93 HD1 TYR 93 -1.486 10.257 1.682 776 HE1 TYR 93 HE2 TYR 93 -2.360 6.601 -1.485 777 HE2 TYR 93 HE1 TYR 93 -1.018 10.573 -0.711 778 HH TYR 93 HH TYR 93 -1.800 9.596 -2.885 779 H ALA 94 HN ALA 94 -0.837 7.654 5.406 780 HA ALA 94 HA ALA 94 -2.905 7.318 7.437 781 HB1 ALA 94 HB1 ALA 94 -0.394 5.789 7.311 782 HB2 ALA 94 HB2 ALA 94 -1.918 5.406 8.110 783 HB3 ALA 94 HB3 ALA 94 -0.769 6.500 8.880 784 H ASP 95 HN ASP 95 -3.126 9.276 8.295 785 HA ASP 95 HA ASP 95 -2.650 11.261 9.297 786 HB2 ASP 95 HB2 ASP 95 -0.852 9.685 10.405 787 HB3 ASP 95 HB1 ASP 95 0.271 10.635 9.437 788 H GLY 96 HN GLY 96 -1.940 10.538 6.303 789 HA2 GLY 96 HA2 GLY 96 -1.854 12.347 4.692 790 HA3 GLY 96 HA1 GLY 96 -0.743 13.178 5.767 791 H LYS 97 HN LYS 97 -0.092 9.858 5.550 792 HA LYS 97 HA LYS 97 1.858 10.301 3.403 793 HB2 LYS 97 HB2 LYS 97 2.345 9.438 6.205 794 HB3 LYS 97 HB1 LYS 97 3.276 8.639 4.947 795 HG2 LYS 97 HG2 LYS 97 3.994 10.888 4.148 796 HG3 LYS 97 HG1 LYS 97 3.193 11.581 5.560 797 HD2 LYS 97 HD2 LYS 97 5.109 9.367 6.034 798 HD3 LYS 97 HD1 LYS 97 5.780 10.926 5.551 799 HE2 LYS 97 HE2 LYS 97 5.172 11.943 7.486 800 HE3 LYS 97 HE1 LYS 97 3.716 10.966 7.668 801 HZ1 LYS 97 HZ1 LYS 97 6.495 10.075 8.219 802 HZ2 LYS 97 HZ2 LYS 97 5.117 9.103 8.353 803 HZ3 LYS 97 HZ3 LYS 97 5.315 10.434 9.378 804 H MET 98 HN MET 98 1.997 8.682 1.945 805 HA MET 98 HA MET 98 0.072 6.608 1.980 806 HB2 MET 98 HB2 MET 98 2.469 6.378 0.221 807 HB3 MET 98 HB1 MET 98 0.777 6.056 -0.136 808 HG2 MET 98 HG2 MET 98 0.778 7.981 -1.230 809 HG3 MET 98 HG1 MET 98 0.806 8.762 0.349 810 HE1 MET 98 HE1 MET 98 1.806 10.641 0.335 811 HE2 MET 98 HE2 MET 98 3.365 11.135 -0.325 812 HE3 MET 98 HE3 MET 98 3.294 10.227 1.185 813 H VAL 99 HN VAL 99 0.123 4.951 3.305 814 HA VAL 99 HA VAL 99 2.306 4.014 4.747 815 HB VAL 99 HB VAL 99 -0.088 2.362 3.934 816 HG11 VAL 99 HG11 VAL 99 2.026 1.378 5.122 817 HG12 VAL 99 HG12 VAL 99 0.409 0.933 5.666 818 HG13 VAL 99 HG13 VAL 99 1.333 2.149 6.547 819 HG21 VAL 99 HG21 VAL 99 -0.803 4.513 4.870 820 HG22 VAL 99 HG22 VAL 99 0.212 4.231 6.284 821 HG23 VAL 99 HG23 VAL 99 -1.167 3.179 5.965 822 H ASN 100 HN ASN 100 1.120 3.082 1.575 823 HA ASN 100 HA ASN 100 2.508 0.705 1.185 824 HB2 ASN 100 HB2 ASN 100 2.156 2.758 -0.996 825 HB3 ASN 100 HB1 ASN 100 2.145 1.002 -1.136 826 HD21 ASN 100 HD21 ASN 100 0.220 0.143 -1.394 827 HD22 ASN 100 HD22 ASN 100 -1.276 0.798 -0.842 828 H GLU 101 HN GLU 101 3.559 4.032 0.497 829 HA GLU 101 HA GLU 101 6.096 3.399 -0.508 830 HB2 GLU 101 HB2 GLU 101 4.766 5.667 -0.405 831 HB3 GLU 101 HB1 GLU 101 5.662 5.891 1.091 832 HG2 GLU 101 HG2 GLU 101 7.255 5.076 -1.245 833 HG3 GLU 101 HG1 GLU 101 6.536 6.684 -1.322 834 H ALA 102 HN ALA 102 4.898 3.748 2.763 835 HA ALA 102 HA ALA 102 7.339 3.931 4.127 836 HB1 ALA 102 HB1 ALA 102 6.124 3.245 6.094 837 HB2 ALA 102 HB2 ALA 102 4.814 2.601 5.104 838 HB3 ALA 102 HB3 ALA 102 5.119 4.338 5.142 839 H LEU 103 HN LEU 103 5.319 1.023 3.629 840 HA LEU 103 HA LEU 103 7.156 -0.823 4.634 841 HB2 LEU 103 HB2 LEU 103 5.136 -1.274 2.437 842 HB3 LEU 103 HB1 LEU 103 5.887 -2.515 3.421 843 HG LEU 103 HG LEU 103 4.615 -0.619 5.148 844 HD11 LEU 103 HD11 LEU 103 3.193 -1.134 2.669 845 HD12 LEU 103 HD12 LEU 103 2.849 0.023 3.954 846 HD13 LEU 103 HD13 LEU 103 2.281 -1.640 4.091 847 HD21 LEU 103 HD21 LEU 103 5.178 -3.035 5.548 848 HD22 LEU 103 HD22 LEU 103 3.801 -3.451 4.529 849 HD23 LEU 103 HD23 LEU 103 3.551 -2.554 6.026 850 H VAL 104 HN VAL 104 6.690 0.423 1.371 851 HA VAL 104 HA VAL 104 8.576 -1.229 0.073 852 HB VAL 104 HB VAL 104 7.713 1.556 -0.718 853 HG11 VAL 104 HG11 VAL 104 8.772 -0.725 -2.385 854 HG12 VAL 104 HG12 VAL 104 9.674 0.720 -1.928 855 HG13 VAL 104 HG13 VAL 104 8.267 0.855 -2.982 856 HG21 VAL 104 HG21 VAL 104 6.018 -0.519 -0.312 857 HG22 VAL 104 HG22 VAL 104 6.450 -0.769 -2.003 858 HG23 VAL 104 HG23 VAL 104 5.750 0.766 -1.490 859 H ARG 105 HN ARG 105 8.807 1.967 1.553 860 HA ARG 105 HA ARG 105 11.550 2.334 0.806 861 HB2 ARG 105 HB2 ARG 105 10.191 4.285 1.032 862 HB3 ARG 105 HB1 ARG 105 9.700 3.832 2.657 863 HG2 ARG 105 HG2 ARG 105 12.585 4.094 2.378 864 HG3 ARG 105 HG1 ARG 105 11.713 5.580 1.996 865 HD2 ARG 105 HD2 ARG 105 11.852 5.888 4.232 866 HD3 ARG 105 HD1 ARG 105 10.418 4.864 4.230 867 HE ARG 105 HE ARG 105 11.675 3.116 5.084 868 HH11 ARG 105 HH11 ARG 105 13.735 5.835 4.328 869 HH12 ARG 105 HH12 ARG 105 15.089 5.211 5.207 870 HH21 ARG 105 HH21 ARG 105 13.461 2.297 6.237 871 HH22 ARG 105 HH22 ARG 105 14.936 3.203 6.285 872 H GLN 106 HN GLN 106 9.850 1.091 3.612 873 HA GLN 106 HA GLN 106 12.151 1.147 5.325 874 HB2 GLN 106 HB2 GLN 106 9.353 0.488 5.572 875 HB3 GLN 106 HB1 GLN 106 10.340 -0.749 6.332 876 HG2 GLN 106 HG2 GLN 106 10.301 0.586 8.111 877 HG3 GLN 106 HG1 GLN 106 11.502 1.540 7.239 878 HE21 GLN 106 HE21 GLN 106 11.047 3.581 6.831 879 HE22 GLN 106 HE22 GLN 106 9.493 4.322 6.967 880 H GLY 107 HN GLY 107 10.366 -1.474 3.693 881 HA2 GLY 107 HA2 GLY 107 12.102 -2.992 2.515 882 HA3 GLY 107 HA1 GLY 107 12.670 -3.239 4.159 883 H LEU 108 HN LEU 108 9.708 -2.996 4.983 884 HA LEU 108 HA LEU 108 9.169 -5.684 5.338 885 HB2 LEU 108 HB2 LEU 108 7.003 -3.620 5.039 886 HB3 LEU 108 HB1 LEU 108 6.995 -5.058 6.041 887 HG LEU 108 HG LEU 108 8.567 -2.526 6.503 888 HD11 LEU 108 HD11 LEU 108 6.220 -2.427 7.144 889 HD12 LEU 108 HD12 LEU 108 7.265 -2.428 8.565 890 HD13 LEU 108 HD13 LEU 108 6.409 -3.898 8.099 891 HD21 LEU 108 HD21 LEU 108 10.104 -3.958 7.348 892 HD22 LEU 108 HD22 LEU 108 8.938 -5.265 7.553 893 HD23 LEU 108 HD23 LEU 108 9.003 -3.949 8.725 894 H ALA 109 HN ALA 109 8.265 -3.566 2.677 895 HA ALA 109 HA ALA 109 7.403 -5.941 1.168 896 HB1 ALA 109 HB1 ALA 109 5.324 -5.061 1.454 897 HB2 ALA 109 HB2 ALA 109 5.817 -4.135 0.037 898 HB3 ALA 109 HB3 ALA 109 5.924 -3.414 1.643 899 H LYS 110 HN LYS 110 7.057 -5.071 -1.273 900 HA LYS 110 HA LYS 110 9.136 -3.204 -2.049 901 HB2 LYS 110 HB2 LYS 110 10.048 -4.950 -3.698 902 HB3 LYS 110 HB1 LYS 110 10.536 -5.080 -2.015 903 HG2 LYS 110 HG2 LYS 110 8.559 -6.722 -1.802 904 HG3 LYS 110 HG1 LYS 110 8.637 -6.792 -3.564 905 HD2 LYS 110 HD2 LYS 110 10.201 -8.363 -3.312 906 HD3 LYS 110 HD1 LYS 110 11.276 -7.074 -2.768 907 HE2 LYS 110 HE2 LYS 110 10.492 -7.455 -0.452 908 HE3 LYS 110 HE1 LYS 110 9.521 -8.807 -1.033 909 HZ1 LYS 110 HZ1 LYS 110 11.418 -10.033 -1.561 910 HZ2 LYS 110 HZ2 LYS 110 11.788 -9.336 -0.065 911 HZ3 LYS 110 HZ3 LYS 110 12.440 -8.687 -1.485 912 H VAL 111 HN VAL 111 9.086 -2.711 -4.362 913 HA VAL 111 HA VAL 111 6.371 -2.636 -5.319 914 HB VAL 111 HB VAL 111 8.928 -1.508 -6.461 915 HG11 VAL 111 HG11 VAL 111 7.685 -1.648 -8.374 916 HG12 VAL 111 HG12 VAL 111 7.120 -0.098 -7.750 917 HG13 VAL 111 HG13 VAL 111 6.148 -1.552 -7.515 918 HG21 VAL 111 HG21 VAL 111 7.892 -0.609 -4.285 919 HG22 VAL 111 HG22 VAL 111 6.627 0.039 -5.328 920 HG23 VAL 111 HG23 VAL 111 8.302 0.543 -5.556 921 H ALA 112 HN ALA 112 5.518 -4.224 -6.482 922 HA ALA 112 HA ALA 112 7.102 -5.452 -8.607 923 HB1 ALA 112 HB1 ALA 112 6.144 -7.714 -7.894 924 HB2 ALA 112 HB2 ALA 112 5.834 -6.948 -6.336 925 HB3 ALA 112 HB3 ALA 112 7.483 -7.060 -6.952 926 H TYR 113 HN TYR 113 5.942 -5.963 -10.398 927 HA TYR 113 HA TYR 113 4.215 -6.013 -11.873 928 HB2 TYR 113 HB2 TYR 113 2.762 -6.781 -9.347 929 HB3 TYR 113 HB1 TYR 113 1.940 -6.673 -10.901 930 HD1 TYR 113 HD2 TYR 113 4.495 -8.492 -8.973 931 HD2 TYR 113 HD1 TYR 113 2.258 -8.348 -12.588 932 HE1 TYR 113 HE2 TYR 113 5.211 -10.784 -9.500 933 HE2 TYR 113 HE1 TYR 113 2.967 -10.640 -13.126 934 HH TYR 113 HH TYR 113 4.536 -12.662 -10.842 935 H VAL 114 HN VAL 114 4.263 -3.887 -12.500 936 HA VAL 114 HA VAL 114 1.954 -2.326 -11.904 937 HB VAL 114 HB VAL 114 3.269 -1.730 -9.925 938 HG11 VAL 114 HG11 VAL 114 5.464 -2.026 -11.472 939 HG12 VAL 114 HG12 VAL 114 5.450 -1.166 -9.932 940 HG13 VAL 114 HG13 VAL 114 5.322 -0.268 -11.444 941 HG21 VAL 114 HG21 VAL 114 2.934 0.405 -12.020 942 HG22 VAL 114 HG22 VAL 114 3.393 0.765 -10.355 943 HG23 VAL 114 HG23 VAL 114 1.845 -0.008 -10.695 944 H TYR 115 HN TYR 115 1.505 -0.967 -13.565 945 HA TYR 115 HA TYR 115 3.399 0.307 -15.198 946 HB2 TYR 115 HB2 TYR 115 3.179 -0.992 -17.268 947 HB3 TYR 115 HB1 TYR 115 3.898 -1.960 -15.986 948 HD1 TYR 115 HD1 TYR 115 2.528 -3.703 -14.847 949 HD2 TYR 115 HD2 TYR 115 1.111 -1.607 -18.268 950 HE1 TYR 115 HE1 TYR 115 0.816 -5.434 -15.191 951 HE2 TYR 115 HE2 TYR 115 -0.606 -3.332 -18.621 952 HH TYR 115 HH TYR 115 -1.625 -5.387 -16.436 953 H LYS 116 HN LYS 116 2.363 1.137 -17.274 954 HA LYS 116 HA LYS 116 0.076 2.587 -16.688 955 HB2 LYS 116 HB2 LYS 116 0.003 3.155 -19.053 956 HB3 LYS 116 HB1 LYS 116 1.665 3.164 -18.477 957 HG2 LYS 116 HG2 LYS 116 0.890 0.572 -19.504 958 HG3 LYS 116 HG1 LYS 116 0.695 1.851 -20.707 959 HD2 LYS 116 HD2 LYS 116 3.035 2.582 -20.170 960 HD3 LYS 116 HD1 LYS 116 3.193 1.129 -19.180 961 HE2 LYS 116 HE2 LYS 116 2.672 1.271 -22.146 962 HE3 LYS 116 HE1 LYS 116 4.136 0.697 -21.348 963 HZ1 LYS 116 HZ1 LYS 116 2.920 -1.151 -20.446 964 HZ2 LYS 116 HZ2 LYS 116 2.690 -1.113 -22.121 965 HZ3 LYS 116 HZ3 LYS 116 1.465 -0.574 -21.089 966 HA PRO 117 HA PRO 117 -1.671 3.534 -17.742 967 HB2 PRO 117 HB2 PRO 117 -4.379 3.271 -16.748 968 HB3 PRO 117 HB1 PRO 117 -3.828 3.936 -18.286 969 HG2 PRO 117 HG2 PRO 117 -5.236 1.608 -18.069 970 HG3 PRO 117 HG1 PRO 117 -4.107 1.952 -19.390 971 HD2 PRO 117 HD2 PRO 117 -3.691 0.307 -16.919 972 HD3 PRO 117 HD1 PRO 117 -3.176 -0.018 -18.590 973 H ASN 118 HN ASN 118 -1.132 1.383 -15.497 974 HA ASN 118 HA ASN 118 -2.008 2.939 -13.186 975 HB2 ASN 118 HB2 ASN 118 -0.491 0.358 -12.994 976 HB3 ASN 118 HB1 ASN 118 -1.677 1.035 -11.883 977 HD21 ASN 118 HD21 ASN 118 -1.286 -0.432 -15.069 978 HD22 ASN 118 HD22 ASN 118 -2.877 -1.104 -15.149 979 H ASN 119 HN ASN 119 -0.671 4.531 -12.622 980 HA ASN 119 HA ASN 119 2.008 4.007 -11.857 981 HB2 ASN 119 HB2 ASN 119 3.006 5.695 -13.520 982 HB3 ASN 119 HB1 ASN 119 2.652 4.077 -14.116 983 HD21 ASN 119 HD21 ASN 119 1.926 4.172 -16.106 984 HD22 ASN 119 HD22 ASN 119 0.803 5.328 -16.730 985 H THR 120 HN THR 120 -0.402 5.207 -10.792 986 HA THR 120 HA THR 120 -0.366 7.986 -10.703 987 HB THR 120 HB THR 120 -1.042 6.276 -8.317 988 HG1 THR 120 HG1 THR 120 -2.163 5.250 -9.848 989 HG21 THR 120 HG21 THR 120 -3.056 8.084 -8.684 990 HG22 THR 120 HG22 THR 120 -1.623 9.005 -9.139 991 HG23 THR 120 HG23 THR 120 -1.717 8.249 -7.549 992 H HIS 121 HN HIS 121 1.306 5.653 -8.610 993 HA HIS 121 HA HIS 121 3.069 7.847 -7.734 994 HB2 HIS 121 HB2 HIS 121 1.583 5.854 -6.166 995 HB3 HIS 121 HB1 HIS 121 3.281 5.994 -5.723 996 HD1 HIS 121 HD1 HIS 121 1.050 6.882 -3.788 997 HD2 HIS 121 HD2 HIS 121 3.006 9.424 -6.430 998 HE1 HIS 121 HE1 HIS 121 0.793 9.188 -2.818 999 HE2 HIS 121 HE2 HIS 121 1.903 10.719 -4.482 1000 H GLU 122 HN GLU 122 3.357 5.974 -9.981 1001 HA GLU 122 HA GLU 122 5.124 3.885 -9.441 1002 HB2 GLU 122 HB2 GLU 122 3.916 4.515 -11.638 1003 HB3 GLU 122 HB1 GLU 122 5.307 5.546 -11.940 1004 HG2 GLU 122 HG2 GLU 122 6.673 3.385 -11.474 1005 HG3 GLU 122 HG1 GLU 122 5.146 2.571 -11.816 1006 H GLN 123 HN GLN 123 5.879 7.207 -10.490 1007 HA GLN 123 HA GLN 123 8.668 6.954 -10.318 1008 HB2 GLN 123 HB2 GLN 123 6.994 9.450 -9.989 1009 HB3 GLN 123 HB1 GLN 123 8.714 9.404 -10.352 1010 HG2 GLN 123 HG2 GLN 123 6.960 7.919 -12.195 1011 HG3 GLN 123 HG1 GLN 123 6.803 9.675 -12.210 1012 HE21 GLN 123 HE21 GLN 123 9.198 7.081 -12.384 1013 HE22 GLN 123 HE22 GLN 123 10.281 7.911 -13.443 1014 H LEU 124 HN LEU 124 6.247 7.524 -7.893 1015 HA LEU 124 HA LEU 124 8.037 8.538 -5.902 1016 HB2 LEU 124 HB2 LEU 124 5.680 9.080 -5.806 1017 HB3 LEU 124 HB1 LEU 124 5.257 7.382 -5.706 1018 HG LEU 124 HG LEU 124 6.833 7.582 -3.526 1019 HD11 LEU 124 HD11 LEU 124 7.109 10.042 -4.005 1020 HD12 LEU 124 HD12 LEU 124 6.532 9.633 -2.389 1021 HD13 LEU 124 HD13 LEU 124 5.400 10.224 -3.606 1022 HD21 LEU 124 HD21 LEU 124 4.922 7.221 -2.346 1023 HD22 LEU 124 HD22 LEU 124 4.294 6.948 -3.971 1024 HD23 LEU 124 HD23 LEU 124 4.035 8.500 -3.175 1025 H LEU 125 HN LEU 125 6.488 5.397 -6.488 1026 HA LEU 125 HA LEU 125 7.892 4.132 -4.318 1027 HB2 LEU 125 HB2 LEU 125 5.961 3.261 -6.416 1028 HB3 LEU 125 HB1 LEU 125 6.929 2.040 -5.613 1029 HG LEU 125 HG LEU 125 5.977 3.445 -3.477 1030 HD11 LEU 125 HD11 LEU 125 3.406 3.364 -4.224 1031 HD12 LEU 125 HD12 LEU 125 4.141 3.851 -5.752 1032 HD13 LEU 125 HD13 LEU 125 4.392 4.825 -4.303 1033 HD21 LEU 125 HD21 LEU 125 5.938 1.104 -3.458 1034 HD22 LEU 125 HD22 LEU 125 4.939 1.019 -4.908 1035 HD23 LEU 125 HD23 LEU 125 4.239 1.574 -3.387 1036 H ARG 126 HN ARG 126 8.441 4.632 -7.706 1037 HA ARG 126 HA ARG 126 10.132 2.521 -8.328 1038 HB2 ARG 126 HB2 ARG 126 9.571 5.170 -9.399 1039 HB3 ARG 126 HB1 ARG 126 11.248 4.703 -9.642 1040 HG2 ARG 126 HG2 ARG 126 10.560 2.684 -10.776 1041 HG3 ARG 126 HG1 ARG 126 8.864 3.057 -10.460 1042 HD2 ARG 126 HD2 ARG 126 8.810 4.759 -12.004 1043 HD3 ARG 126 HD1 ARG 126 10.542 5.064 -11.885 1044 HE ARG 126 HE ARG 126 9.878 2.509 -13.030 1045 HH11 ARG 126 HH11 ARG 126 10.427 5.893 -13.685 1046 HH12 ARG 126 HH12 ARG 126 10.841 5.632 -15.346 1047 HH21 ARG 126 HH21 ARG 126 10.424 2.164 -15.213 1048 HH22 ARG 126 HH22 ARG 126 10.842 3.515 -16.213 1049 H LYS 127 HN LYS 127 10.854 5.578 -6.710 1050 HA LYS 127 HA LYS 127 13.667 4.992 -6.491 1051 HB2 LYS 127 HB2 LYS 127 12.263 7.079 -4.854 1052 HB3 LYS 127 HB1 LYS 127 13.901 7.092 -5.491 1053 HG2 LYS 127 HG2 LYS 127 11.363 7.436 -7.072 1054 HG3 LYS 127 HG1 LYS 127 12.533 8.692 -6.667 1055 HD2 LYS 127 HD2 LYS 127 13.877 6.500 -7.938 1056 HD3 LYS 127 HD1 LYS 127 12.508 7.008 -8.928 1057 HE2 LYS 127 HE2 LYS 127 14.739 8.162 -9.350 1058 HE3 LYS 127 HE1 LYS 127 13.326 9.195 -9.137 1059 HZ1 LYS 127 HZ1 LYS 127 14.956 8.537 -6.788 1060 HZ2 LYS 127 HZ2 LYS 127 14.050 9.927 -7.113 1061 HZ3 LYS 127 HZ3 LYS 127 15.540 9.691 -7.879 1062 H SER 128 HN SER 128 10.906 5.133 -4.262 1063 HA SER 128 HA SER 128 12.208 4.504 -1.904 1064 HB2 SER 128 HB2 SER 128 9.988 5.131 -1.617 1065 HB3 SER 128 HB1 SER 128 9.415 4.064 -2.898 1066 HG SER 128 HG SER 128 8.915 3.326 -0.753 1067 H GLU 129 HN GLU 129 11.182 2.389 -4.510 1068 HA GLU 129 HA GLU 129 11.663 -0.036 -3.060 1069 HB2 GLU 129 HB2 GLU 129 10.062 -0.071 -4.856 1070 HB3 GLU 129 HB1 GLU 129 11.258 0.520 -6.000 1071 HG2 GLU 129 HG2 GLU 129 12.108 -1.929 -4.708 1072 HG3 GLU 129 HG1 GLU 129 10.565 -2.114 -5.539 1073 H ALA 130 HN ALA 130 13.322 1.403 -5.876 1074 HA ALA 130 HA ALA 130 15.539 -0.325 -5.765 1075 HB1 ALA 130 HB1 ALA 130 16.054 2.300 -6.944 1076 HB2 ALA 130 HB2 ALA 130 14.605 1.501 -7.556 1077 HB3 ALA 130 HB3 ALA 130 16.169 0.690 -7.656 1078 H GLN 131 HN GLN 131 14.899 2.744 -4.194 1079 HA GLN 131 HA GLN 131 17.554 3.361 -3.499 1080 HB2 GLN 131 HB2 GLN 131 16.669 4.983 -2.007 1081 HB3 GLN 131 HB1 GLN 131 15.599 4.935 -3.395 1082 HG2 GLN 131 HG2 GLN 131 14.056 4.977 -1.756 1083 HG3 GLN 131 HG1 GLN 131 14.280 3.235 -1.865 1084 HE21 GLN 131 HE21 GLN 131 13.294 4.610 0.391 1085 HE22 GLN 131 HE22 GLN 131 14.420 4.394 1.684 1086 H ALA 132 HN ALA 132 15.022 1.665 -1.683 1087 HA ALA 132 HA ALA 132 16.741 1.112 0.540 1088 HB1 ALA 132 HB1 ALA 132 14.039 0.006 -0.217 1089 HB2 ALA 132 HB2 ALA 132 14.379 1.300 0.931 1090 HB3 ALA 132 HB3 ALA 132 14.876 -0.353 1.294 1091 H LYS 133 HN LYS 133 16.056 -0.408 -2.481 1092 HA LYS 133 HA LYS 133 16.785 -3.061 -1.834 1093 HB2 LYS 133 HB2 LYS 133 15.864 -1.669 -4.094 1094 HB3 LYS 133 HB1 LYS 133 17.404 -2.371 -4.570 1095 HG2 LYS 133 HG2 LYS 133 16.569 -4.436 -4.641 1096 HG3 LYS 133 HG1 LYS 133 15.697 -4.235 -3.121 1097 HD2 LYS 133 HD2 LYS 133 14.036 -2.830 -4.431 1098 HD3 LYS 133 HD1 LYS 133 14.828 -3.434 -5.888 1099 HE2 LYS 133 HE2 LYS 133 14.329 -5.728 -5.213 1100 HE3 LYS 133 HE1 LYS 133 13.555 -5.134 -3.745 1101 HZ1 LYS 133 HZ1 LYS 133 12.636 -4.278 -6.419 1102 HZ2 LYS 133 HZ2 LYS 133 11.800 -4.226 -4.949 1103 HZ3 LYS 133 HZ3 LYS 133 12.074 -5.710 -5.714 1104 H LYS 134 HN LYS 134 18.620 -0.463 -3.440 1105 HA LYS 134 HA LYS 134 21.013 -1.831 -3.753 1106 HB2 LYS 134 HB2 LYS 134 21.934 0.186 -4.386 1107 HB3 LYS 134 HB1 LYS 134 20.223 0.497 -4.610 1108 HG2 LYS 134 HG2 LYS 134 20.489 2.322 -3.393 1109 HG3 LYS 134 HG1 LYS 134 20.713 1.276 -1.995 1110 HD2 LYS 134 HD2 LYS 134 22.883 2.314 -3.816 1111 HD3 LYS 134 HD1 LYS 134 22.545 2.869 -2.176 1112 HE2 LYS 134 HE2 LYS 134 23.136 0.709 -1.278 1113 HE3 LYS 134 HE1 LYS 134 23.339 0.053 -2.902 1114 HZ1 LYS 134 HZ1 LYS 134 25.037 2.026 -1.499 1115 HZ2 LYS 134 HZ2 LYS 134 25.101 1.835 -3.179 1116 HZ3 LYS 134 HZ3 LYS 134 25.485 0.536 -2.166 1117 H GLU 135 HN GLU 135 19.736 -0.193 -0.942 1118 HA GLU 135 HA GLU 135 22.237 -0.665 0.512 1119 HB2 GLU 135 HB2 GLU 135 20.489 0.510 2.317 1120 HB3 GLU 135 HB1 GLU 135 21.750 1.326 1.401 1121 HG2 GLU 135 HG2 GLU 135 20.193 1.988 -0.281 1122 HG3 GLU 135 HG1 GLU 135 18.925 0.992 0.429 1123 H LYS 136 HN LYS 136 19.305 -2.227 -0.010 1124 HA LYS 136 HA LYS 136 18.149 -3.860 1.095 1125 HB2 LYS 136 HB2 LYS 136 20.962 -4.485 2.014 1126 HB3 LYS 136 HB1 LYS 136 19.598 -5.589 2.140 1127 HG2 LYS 136 HG2 LYS 136 19.364 -5.431 -0.350 1128 HG3 LYS 136 HG1 LYS 136 20.893 -4.549 -0.364 1129 HD2 LYS 136 HD2 LYS 136 21.721 -6.643 -0.668 1130 HD3 LYS 136 HD1 LYS 136 21.634 -6.663 1.095 1131 HE2 LYS 136 HE2 LYS 136 19.811 -8.047 1.128 1132 HE3 LYS 136 HE1 LYS 136 19.230 -7.496 -0.444 1133 HZ1 LYS 136 HZ1 LYS 136 20.688 -8.882 -1.559 1134 HZ2 LYS 136 HZ2 LYS 136 20.227 -9.839 -0.243 1135 HZ3 LYS 136 HZ3 LYS 136 21.725 -9.055 -0.233 1136 H LEU 137 HN LEU 137 17.424 -1.856 2.360 1137 HA LEU 137 HA LEU 137 18.290 -1.159 4.859 1138 HB2 LEU 137 HB2 LEU 137 15.638 -1.096 3.507 1139 HB3 LEU 137 HB1 LEU 137 15.686 -0.769 5.231 1140 HG LEU 137 HG LEU 137 17.265 0.742 3.148 1141 HD11 LEU 137 HD11 LEU 137 14.693 1.383 4.572 1142 HD12 LEU 137 HD12 LEU 137 14.974 1.270 2.834 1143 HD13 LEU 137 HD13 LEU 137 15.684 2.594 3.757 1144 HD21 LEU 137 HD21 LEU 137 16.932 1.098 6.120 1145 HD22 LEU 137 HD22 LEU 137 17.585 2.340 5.051 1146 HD23 LEU 137 HD23 LEU 137 18.424 0.799 5.227 1147 H ASN 138 HN ASN 138 15.141 -2.658 5.086 1148 HA ASN 138 HA ASN 138 16.275 -4.636 6.949 1149 HB2 ASN 138 HB2 ASN 138 14.197 -4.442 8.269 1150 HB3 ASN 138 HB1 ASN 138 15.069 -2.916 8.182 1151 HD21 ASN 138 HD21 ASN 138 13.780 -1.252 7.954 1152 HD22 ASN 138 HD22 ASN 138 12.296 -1.216 7.069 1153 H ILE 139 HN ILE 139 15.753 -6.706 6.653 1154 HA ILE 139 HA ILE 139 14.651 -8.587 5.967 1155 HB ILE 139 HB ILE 139 12.604 -6.841 4.612 1156 HG12 ILE 139 HG12 ILE 139 11.853 -8.030 7.175 1157 HG13 ILE 139 HG11 ILE 139 13.153 -6.853 7.328 1158 HG21 ILE 139 HG21 ILE 139 11.181 -8.892 5.105 1159 HG22 ILE 139 HG22 ILE 139 12.701 -9.727 5.426 1160 HG23 ILE 139 HG23 ILE 139 12.391 -9.040 3.831 1161 HD11 ILE 139 HD11 ILE 139 10.326 -6.461 6.779 1162 HD12 ILE 139 HD12 ILE 139 11.385 -5.570 5.685 1163 HD13 ILE 139 HD13 ILE 139 11.526 -5.344 7.429 1164 H TRP 140 HN TRP 140 16.001 -6.270 3.978 1165 HA TRP 140 HA TRP 140 15.473 -7.520 1.450 1166 HB2 TRP 140 HB2 TRP 140 17.701 -5.588 2.109 1167 HB3 TRP 140 HB1 TRP 140 17.040 -5.947 0.518 1168 HD1 TRP 140 HD1 TRP 140 15.965 -4.310 3.836 1169 HE1 TRP 140 HE1 TRP 140 14.238 -2.478 3.308 1170 HE3 TRP 140 HE3 TRP 140 15.482 -5.094 -1.184 1171 HZ2 TRP 140 HZ2 TRP 140 12.853 -1.498 1.059 1172 HZ3 TRP 140 HZ3 TRP 140 13.928 -3.667 -2.455 1173 HH2 TRP 140 HH2 TRP 140 12.642 -1.907 -1.356 Start of MODEL 2 1 H1 ALA 1 HT1 ALA 1 -15.965 33.356 -13.889 2 H2 ALA 1 HT2 ALA 1 -16.024 34.903 -13.149 3 H3 ALA 1 HT3 ALA 1 -17.477 34.060 -13.499 4 HA ALA 1 HA ALA 1 -15.460 33.525 -11.452 5 HB1 ALA 1 HB1 ALA 1 -17.700 33.260 -10.164 6 HB2 ALA 1 HB2 ALA 1 -18.385 34.130 -11.537 7 HB3 ALA 1 HB3 ALA 1 -17.112 34.873 -10.567 8 H THR 2 HN THR 2 -16.031 31.582 -10.097 9 HA THR 2 HA THR 2 -16.351 29.297 -11.872 10 HB THR 2 HB THR 2 -15.784 29.141 -8.923 11 HG1 THR 2 HG1 THR 2 -14.273 30.585 -9.681 12 HG21 THR 2 HG21 THR 2 -15.788 27.270 -11.082 13 HG22 THR 2 HG22 THR 2 -15.516 26.995 -9.361 14 HG23 THR 2 HG23 THR 2 -14.163 27.410 -10.412 15 H SER 3 HN SER 3 -18.000 27.855 -11.807 16 HA SER 3 HA SER 3 -20.376 28.657 -10.342 17 HB2 SER 3 HB2 SER 3 -19.840 27.277 -12.800 18 HB3 SER 3 HB1 SER 3 -20.854 26.257 -11.779 19 HG SER 3 HG SER 3 -22.361 27.890 -11.670 20 H THR 4 HN THR 4 -18.757 25.519 -10.873 21 HA THR 4 HA THR 4 -18.875 24.923 -8.047 22 HB THR 4 HB THR 4 -20.148 22.844 -9.755 23 HG1 THR 4 HG1 THR 4 -21.940 23.906 -10.042 24 HG21 THR 4 HG21 THR 4 -19.730 23.117 -7.051 25 HG22 THR 4 HG22 THR 4 -20.837 21.987 -7.830 26 HG23 THR 4 HG23 THR 4 -21.429 23.545 -7.254 27 H LYS 5 HN LYS 5 -16.946 24.105 -7.617 28 HA LYS 5 HA LYS 5 -15.449 22.732 -9.707 29 HB2 LYS 5 HB2 LYS 5 -14.784 24.130 -7.187 30 HB3 LYS 5 HB1 LYS 5 -13.763 22.757 -7.590 31 HG2 LYS 5 HG2 LYS 5 -14.254 24.614 -9.806 32 HG3 LYS 5 HG1 LYS 5 -13.354 25.291 -8.448 33 HD2 LYS 5 HD2 LYS 5 -11.513 24.248 -9.129 34 HD3 LYS 5 HD1 LYS 5 -12.330 22.690 -9.000 35 HE2 LYS 5 HE2 LYS 5 -11.988 22.561 -11.212 36 HE3 LYS 5 HE1 LYS 5 -13.363 23.657 -11.326 37 HZ1 LYS 5 HZ1 LYS 5 -11.001 24.162 -12.419 38 HZ2 LYS 5 HZ2 LYS 5 -10.769 24.900 -10.915 39 HZ3 LYS 5 HZ3 LYS 5 -12.056 25.379 -11.901 40 H LYS 6 HN LYS 6 -15.051 20.599 -9.743 41 HA LYS 6 HA LYS 6 -16.328 18.945 -7.718 42 HB2 LYS 6 HB2 LYS 6 -16.391 18.656 -10.334 43 HB3 LYS 6 HB1 LYS 6 -14.867 17.821 -10.073 44 HG2 LYS 6 HG2 LYS 6 -15.862 16.016 -9.206 45 HG3 LYS 6 HG1 LYS 6 -17.016 16.974 -8.278 46 HD2 LYS 6 HD2 LYS 6 -17.219 16.579 -11.257 47 HD3 LYS 6 HD1 LYS 6 -18.004 15.516 -10.087 48 HE2 LYS 6 HE2 LYS 6 -19.726 16.925 -10.102 49 HE3 LYS 6 HE1 LYS 6 -18.689 18.088 -9.276 50 HZ1 LYS 6 HZ1 LYS 6 -18.068 19.044 -11.352 51 HZ2 LYS 6 HZ2 LYS 6 -19.757 18.950 -11.322 52 HZ3 LYS 6 HZ3 LYS 6 -18.864 17.834 -12.227 53 H LEU 7 HN LEU 7 -15.060 16.813 -7.245 54 HA LEU 7 HA LEU 7 -12.347 17.597 -6.408 55 HB2 LEU 7 HB2 LEU 7 -14.150 15.514 -5.175 56 HB3 LEU 7 HB1 LEU 7 -12.578 16.013 -4.577 57 HG LEU 7 HG LEU 7 -13.817 18.394 -4.541 58 HD11 LEU 7 HD11 LEU 7 -16.038 16.564 -3.720 59 HD12 LEU 7 HD12 LEU 7 -15.908 17.142 -5.382 60 HD13 LEU 7 HD13 LEU 7 -16.084 18.294 -4.058 61 HD21 LEU 7 HD21 LEU 7 -14.492 16.693 -2.229 62 HD22 LEU 7 HD22 LEU 7 -13.616 18.222 -2.300 63 HD23 LEU 7 HD23 LEU 7 -12.794 16.714 -2.704 64 H HIS 8 HN HIS 8 -11.145 15.328 -5.810 65 HA HIS 8 HA HIS 8 -11.494 13.429 -7.997 66 HB2 HIS 8 HB2 HIS 8 -8.944 13.531 -8.355 67 HB3 HIS 8 HB1 HIS 8 -9.924 14.812 -9.058 68 HD1 HIS 8 HD1 HIS 8 -10.065 17.044 -7.411 69 HD2 HIS 8 HD2 HIS 8 -6.846 14.461 -6.931 70 HE1 HIS 8 HE1 HIS 8 -8.310 18.374 -6.196 71 HE2 HIS 8 HE2 HIS 8 -6.409 16.762 -5.835 72 H LYS 9 HN LYS 9 -9.670 14.318 -5.091 73 HA LYS 9 HA LYS 9 -9.022 11.545 -4.561 74 HB2 LYS 9 HB2 LYS 9 -7.728 12.387 -2.694 75 HB3 LYS 9 HB1 LYS 9 -7.354 13.322 -4.133 76 HG2 LYS 9 HG2 LYS 9 -9.474 14.352 -2.333 77 HG3 LYS 9 HG1 LYS 9 -7.799 14.459 -1.789 78 HD2 LYS 9 HD2 LYS 9 -7.713 15.321 -4.424 79 HD3 LYS 9 HD1 LYS 9 -9.206 16.016 -3.795 80 HE2 LYS 9 HE2 LYS 9 -7.379 16.435 -1.763 81 HE3 LYS 9 HE1 LYS 9 -6.442 16.713 -3.231 82 HZ1 LYS 9 HZ1 LYS 9 -8.995 18.042 -2.496 83 HZ2 LYS 9 HZ2 LYS 9 -8.173 18.270 -3.957 84 HZ3 LYS 9 HZ3 LYS 9 -7.459 18.752 -2.502 85 H GLU 10 HN GLU 10 -9.467 10.634 -2.412 86 HA GLU 10 HA GLU 10 -11.684 11.724 -0.926 87 HB2 GLU 10 HB2 GLU 10 -12.815 10.594 -2.806 88 HB3 GLU 10 HB1 GLU 10 -12.010 9.092 -2.376 89 HG2 GLU 10 HG2 GLU 10 -13.154 9.613 -0.034 90 HG3 GLU 10 HG1 GLU 10 -14.285 10.468 -1.082 91 HA PRO 11 HA PRO 11 -9.404 9.386 2.109 92 HB2 PRO 11 HB2 PRO 11 -10.747 10.151 4.290 93 HB3 PRO 11 HB1 PRO 11 -9.737 11.292 3.392 94 HG2 PRO 11 HG2 PRO 11 -12.707 10.954 3.351 95 HG3 PRO 11 HG1 PRO 11 -11.749 12.445 3.346 96 HD2 PRO 11 HD2 PRO 11 -12.867 11.286 1.100 97 HD3 PRO 11 HD1 PRO 11 -11.485 12.398 1.080 98 H ALA 12 HN ALA 12 -10.081 7.978 4.115 99 HA ALA 12 HA ALA 12 -12.590 6.637 3.953 100 HB1 ALA 12 HB1 ALA 12 -11.863 4.483 3.211 101 HB2 ALA 12 HB2 ALA 12 -10.184 5.020 3.137 102 HB3 ALA 12 HB3 ALA 12 -11.369 5.671 2.005 103 H THR 13 HN THR 13 -12.648 4.714 5.453 104 HA THR 13 HA THR 13 -10.724 5.038 7.659 105 HB THR 13 HB THR 13 -13.641 4.413 8.089 106 HG1 THR 13 HG1 THR 13 -12.424 6.969 8.225 107 HG21 THR 13 HG21 THR 13 -13.013 5.626 10.297 108 HG22 THR 13 HG22 THR 13 -11.366 5.182 9.850 109 HG23 THR 13 HG23 THR 13 -12.589 3.929 10.067 110 H LEU 14 HN LEU 14 -9.799 3.201 8.326 111 HA LEU 14 HA LEU 14 -10.149 0.782 6.977 112 HB2 LEU 14 HB2 LEU 14 -8.401 1.793 8.909 113 HB3 LEU 14 HB1 LEU 14 -9.131 0.383 9.658 114 HG LEU 14 HG LEU 14 -6.988 -0.081 8.479 115 HD11 LEU 14 HD11 LEU 14 -8.069 -2.050 8.712 116 HD12 LEU 14 HD12 LEU 14 -8.187 -1.930 6.957 117 HD13 LEU 14 HD13 LEU 14 -9.551 -1.452 7.966 118 HD21 LEU 14 HD21 LEU 14 -8.327 1.326 6.367 119 HD22 LEU 14 HD22 LEU 14 -7.876 -0.290 5.827 120 HD23 LEU 14 HD23 LEU 14 -6.648 0.799 6.471 121 H ILE 15 HN ILE 15 -11.988 -0.348 6.968 122 HA ILE 15 HA ILE 15 -13.806 -0.386 9.175 123 HB ILE 15 HB ILE 15 -13.728 -2.256 6.804 124 HG12 ILE 15 HG12 ILE 15 -13.826 0.138 6.142 125 HG13 ILE 15 HG11 ILE 15 -15.288 -0.745 5.717 126 HG21 ILE 15 HG21 ILE 15 -16.051 -2.673 7.275 127 HG22 ILE 15 HG22 ILE 15 -16.032 -1.499 8.591 128 HG23 ILE 15 HG23 ILE 15 -15.101 -2.990 8.727 129 HD11 ILE 15 HD11 ILE 15 -16.092 0.174 8.056 130 HD12 ILE 15 HD12 ILE 15 -16.208 1.139 6.583 131 HD13 ILE 15 HD13 ILE 15 -14.877 1.407 7.711 132 H LYS 16 HN LYS 16 -11.332 -2.534 7.894 133 HA LYS 16 HA LYS 16 -10.871 -3.734 10.415 134 HB2 LYS 16 HB2 LYS 16 -12.947 -4.919 8.894 135 HB3 LYS 16 HB1 LYS 16 -11.570 -6.007 8.802 136 HG2 LYS 16 HG2 LYS 16 -12.265 -4.940 11.473 137 HG3 LYS 16 HG1 LYS 16 -13.367 -6.117 10.757 138 HD2 LYS 16 HD2 LYS 16 -10.468 -6.731 10.654 139 HD3 LYS 16 HD1 LYS 16 -11.260 -6.830 12.228 140 HE2 LYS 16 HE2 LYS 16 -12.854 -8.417 11.392 141 HE3 LYS 16 HE1 LYS 16 -12.259 -8.214 9.745 142 HZ1 LYS 16 HZ1 LYS 16 -10.876 -9.495 12.030 143 HZ2 LYS 16 HZ2 LYS 16 -10.070 -9.057 10.609 144 HZ3 LYS 16 HZ3 LYS 16 -11.319 -10.196 10.554 145 H ALA 17 HN ALA 17 -8.789 -4.257 10.451 146 HA ALA 17 HA ALA 17 -7.263 -4.241 8.031 147 HB1 ALA 17 HB1 ALA 17 -5.852 -5.103 10.431 148 HB2 ALA 17 HB2 ALA 17 -6.724 -3.584 10.634 149 HB3 ALA 17 HB3 ALA 17 -5.528 -3.750 9.349 150 H ILE 18 HN ILE 18 -6.786 -5.938 6.809 151 HA ILE 18 HA ILE 18 -7.411 -8.614 7.754 152 HB ILE 18 HB ILE 18 -6.196 -8.094 5.070 153 HG12 ILE 18 HG12 ILE 18 -8.292 -6.539 5.828 154 HG13 ILE 18 HG11 ILE 18 -7.995 -7.046 4.175 155 HG21 ILE 18 HG21 ILE 18 -8.308 -10.016 6.026 156 HG22 ILE 18 HG22 ILE 18 -6.599 -10.385 5.791 157 HG23 ILE 18 HG23 ILE 18 -7.609 -9.962 4.408 158 HD11 ILE 18 HD11 ILE 18 -10.329 -7.335 4.836 159 HD12 ILE 18 HD12 ILE 18 -9.825 -8.430 6.122 160 HD13 ILE 18 HD13 ILE 18 -9.568 -8.874 4.435 161 H ASP 19 HN ASP 19 -4.658 -7.385 5.852 162 HA ASP 19 HA ASP 19 -2.806 -8.508 7.798 163 HB2 ASP 19 HB2 ASP 19 -3.196 -9.602 5.037 164 HB3 ASP 19 HB1 ASP 19 -1.584 -9.615 5.748 165 H GLY 20 HN GLY 20 -1.724 -8.030 4.537 166 HA2 GLY 20 HA2 GLY 20 -0.680 -5.373 5.295 167 HA3 GLY 20 HA1 GLY 20 0.311 -6.566 4.463 168 H ASP 21 HN ASP 21 -0.412 -7.254 2.316 169 HA ASP 21 HA ASP 21 -0.986 -5.054 0.657 170 HB2 ASP 21 HB2 ASP 21 -1.100 -6.714 -1.163 171 HB3 ASP 21 HB1 ASP 21 0.310 -6.967 -0.138 172 H THR 22 HN THR 22 -3.043 -7.013 2.518 173 HA THR 22 HA THR 22 -5.361 -6.088 0.957 174 HB THR 22 HB THR 22 -5.369 -8.613 2.601 175 HG1 THR 22 HG1 THR 22 -4.609 -8.259 -0.097 176 HG21 THR 22 HG21 THR 22 -7.465 -7.332 1.561 177 HG22 THR 22 HG22 THR 22 -7.375 -9.088 1.699 178 HG23 THR 22 HG23 THR 22 -6.998 -8.303 0.165 179 H VAL 23 HN VAL 23 -6.785 -4.896 2.051 180 HA VAL 23 HA VAL 23 -7.150 -5.202 4.903 181 HB VAL 23 HB VAL 23 -6.762 -2.769 5.352 182 HG11 VAL 23 HG11 VAL 23 -5.102 -4.745 5.713 183 HG12 VAL 23 HG12 VAL 23 -4.546 -3.083 5.909 184 HG13 VAL 23 HG13 VAL 23 -4.186 -3.963 4.424 185 HG21 VAL 23 HG21 VAL 23 -5.986 -2.874 2.506 186 HG22 VAL 23 HG22 VAL 23 -4.941 -1.924 3.563 187 HG23 VAL 23 HG23 VAL 23 -6.660 -1.547 3.453 188 H LYS 24 HN LYS 24 -9.099 -4.323 5.645 189 HA LYS 24 HA LYS 24 -10.994 -3.701 3.535 190 HB2 LYS 24 HB2 LYS 24 -11.506 -5.307 5.420 191 HB3 LYS 24 HB1 LYS 24 -11.547 -3.919 6.494 192 HG2 LYS 24 HG2 LYS 24 -13.787 -4.457 5.888 193 HG3 LYS 24 HG1 LYS 24 -13.347 -2.950 5.084 194 HD2 LYS 24 HD2 LYS 24 -14.528 -4.315 3.516 195 HD3 LYS 24 HD1 LYS 24 -12.832 -4.272 3.035 196 HE2 LYS 24 HE2 LYS 24 -12.856 -6.452 4.646 197 HE3 LYS 24 HE1 LYS 24 -14.486 -6.517 3.979 198 HZ1 LYS 24 HZ1 LYS 24 -13.470 -7.583 2.309 199 HZ2 LYS 24 HZ2 LYS 24 -11.941 -6.964 2.681 200 HZ3 LYS 24 HZ3 LYS 24 -13.034 -6.034 1.787 201 H LEU 25 HN LEU 25 -11.819 -1.725 3.126 202 HA LEU 25 HA LEU 25 -11.293 0.423 5.058 203 HB2 LEU 25 HB2 LEU 25 -10.278 0.140 2.354 204 HB3 LEU 25 HB1 LEU 25 -11.144 1.648 2.573 205 HG LEU 25 HG LEU 25 -8.959 0.779 4.450 206 HD11 LEU 25 HD11 LEU 25 -8.763 2.104 1.780 207 HD12 LEU 25 HD12 LEU 25 -7.746 0.850 2.489 208 HD13 LEU 25 HD13 LEU 25 -7.620 2.514 3.060 209 HD21 LEU 25 HD21 LEU 25 -10.657 3.147 4.082 210 HD22 LEU 25 HD22 LEU 25 -8.948 3.483 4.352 211 HD23 LEU 25 HD23 LEU 25 -9.857 2.534 5.528 212 H MET 26 HN MET 26 -12.684 2.282 4.855 213 HA MET 26 HA MET 26 -15.379 1.505 4.112 214 HB2 MET 26 HB2 MET 26 -14.644 2.757 6.263 215 HB3 MET 26 HB1 MET 26 -14.605 4.183 5.235 216 HG2 MET 26 HG2 MET 26 -16.864 4.253 4.999 217 HG3 MET 26 HG1 MET 26 -17.050 2.510 5.179 218 HE1 MET 26 HE1 MET 26 -19.192 2.951 6.628 219 HE2 MET 26 HE2 MET 26 -19.002 4.704 6.590 220 HE3 MET 26 HE3 MET 26 -19.214 3.873 8.131 221 H TYR 27 HN TYR 27 -16.153 1.885 2.157 222 HA TYR 27 HA TYR 27 -15.361 4.351 0.766 223 HB2 TYR 27 HB2 TYR 27 -14.140 2.461 -0.226 224 HB3 TYR 27 HB1 TYR 27 -15.662 1.623 -0.502 225 HD1 TYR 27 HD1 TYR 27 -14.068 4.906 -1.270 226 HD2 TYR 27 HD2 TYR 27 -16.584 1.755 -2.613 227 HE1 TYR 27 HE1 TYR 27 -14.254 6.003 -3.464 228 HE2 TYR 27 HE2 TYR 27 -16.779 2.838 -4.813 229 HH TYR 27 HH TYR 27 -14.771 5.132 -5.917 230 H LYS 28 HN LYS 28 -17.071 5.573 0.370 231 HA LYS 28 HA LYS 28 -19.196 6.257 -0.031 232 HB2 LYS 28 HB2 LYS 28 -19.279 3.548 -1.353 233 HB3 LYS 28 HB1 LYS 28 -20.589 4.715 -1.454 234 HG2 LYS 28 HG2 LYS 28 -19.046 6.325 -2.496 235 HG3 LYS 28 HG1 LYS 28 -17.777 5.100 -2.452 236 HD2 LYS 28 HD2 LYS 28 -18.496 4.328 -4.409 237 HD3 LYS 28 HD1 LYS 28 -20.028 3.893 -3.648 238 HE2 LYS 28 HE2 LYS 28 -20.562 6.438 -4.008 239 HE3 LYS 28 HE1 LYS 28 -19.313 6.308 -5.244 240 HZ1 LYS 28 HZ1 LYS 28 -21.958 5.045 -5.134 241 HZ2 LYS 28 HZ2 LYS 28 -20.710 4.235 -5.938 242 HZ3 LYS 28 HZ3 LYS 28 -21.171 5.783 -6.438 243 H GLY 29 HN GLY 29 -18.826 5.410 2.520 244 HA2 GLY 29 HA2 GLY 29 -19.981 4.777 4.398 245 HA3 GLY 29 HA1 GLY 29 -21.432 4.894 3.415 246 H GLN 30 HN GLN 30 -19.038 2.727 2.276 247 HA GLN 30 HA GLN 30 -20.343 0.442 3.571 248 HB2 GLN 30 HB2 GLN 30 -21.137 -0.440 1.660 249 HB3 GLN 30 HB1 GLN 30 -20.915 1.162 0.975 250 HG2 GLN 30 HG2 GLN 30 -18.683 0.488 0.186 251 HG3 GLN 30 HG1 GLN 30 -18.968 -1.131 0.822 252 HE21 GLN 30 HE21 GLN 30 -19.144 0.793 -1.867 253 HE22 GLN 30 HE22 GLN 30 -20.224 -0.160 -2.821 254 HA PRO 31 HA PRO 31 -16.215 -1.028 3.936 255 HB2 PRO 31 HB2 PRO 31 -16.615 -3.590 4.485 256 HB3 PRO 31 HB1 PRO 31 -17.276 -2.331 5.543 257 HG2 PRO 31 HG2 PRO 31 -18.667 -3.912 3.408 258 HG3 PRO 31 HG1 PRO 31 -19.205 -3.556 5.062 259 HD2 PRO 31 HD2 PRO 31 -19.989 -2.128 2.844 260 HD3 PRO 31 HD1 PRO 31 -19.962 -1.470 4.493 261 H MET 32 HN MET 32 -14.795 -1.184 2.337 262 HA MET 32 HA MET 32 -15.238 -3.197 0.235 263 HB2 MET 32 HB2 MET 32 -15.333 -0.542 -0.240 264 HB3 MET 32 HB1 MET 32 -13.607 -0.815 -0.429 265 HG2 MET 32 HG2 MET 32 -14.739 -0.961 -2.561 266 HG3 MET 32 HG1 MET 32 -14.053 -2.522 -2.112 267 HE1 MET 32 HE1 MET 32 -17.922 -1.911 -3.816 268 HE2 MET 32 HE2 MET 32 -16.526 -2.785 -4.444 269 HE3 MET 32 HE3 MET 32 -16.364 -1.099 -3.954 270 H THR 33 HN THR 33 -13.376 -4.225 -0.589 271 HA THR 33 HA THR 33 -11.237 -4.412 1.356 272 HB THR 33 HB THR 33 -11.177 -5.967 -1.182 273 HG1 THR 33 HG1 THR 33 -13.256 -6.336 -0.822 274 HG21 THR 33 HG21 THR 33 -10.912 -7.777 0.746 275 HG22 THR 33 HG22 THR 33 -10.360 -6.353 1.628 276 HG23 THR 33 HG23 THR 33 -9.558 -6.829 0.131 277 H PHE 34 HN PHE 34 -9.594 -3.047 1.235 278 HA PHE 34 HA PHE 34 -8.734 -2.082 -1.397 279 HB2 PHE 34 HB2 PHE 34 -8.573 -0.971 1.370 280 HB3 PHE 34 HB1 PHE 34 -7.307 -0.532 0.226 281 HD1 PHE 34 HD1 PHE 34 -11.000 -0.585 0.646 282 HD2 PHE 34 HD2 PHE 34 -7.652 1.183 -1.304 283 HE1 PHE 34 HE1 PHE 34 -12.473 1.133 -0.323 284 HE2 PHE 34 HE2 PHE 34 -9.120 2.905 -2.271 285 HZ PHE 34 HZ PHE 34 -11.533 2.881 -1.781 286 H ARG 35 HN ARG 35 -6.538 -2.214 -2.026 287 HA ARG 35 HA ARG 35 -4.922 -4.044 -0.392 288 HB2 ARG 35 HB2 ARG 35 -4.486 -5.457 -2.160 289 HB3 ARG 35 HB1 ARG 35 -6.141 -4.980 -2.512 290 HG2 ARG 35 HG2 ARG 35 -5.360 -4.564 -4.559 291 HG3 ARG 35 HG1 ARG 35 -4.751 -3.069 -3.847 292 HD2 ARG 35 HD2 ARG 35 -2.626 -3.709 -4.093 293 HD3 ARG 35 HD1 ARG 35 -2.950 -5.305 -3.418 294 HE ARG 35 HE ARG 35 -3.892 -4.973 -6.114 295 HH11 ARG 35 HH11 ARG 35 -1.158 -5.829 -4.122 296 HH12 ARG 35 HH12 ARG 35 -0.395 -6.773 -5.358 297 HH21 ARG 35 HH21 ARG 35 -2.891 -6.215 -7.739 298 HH22 ARG 35 HH22 ARG 35 -1.379 -6.992 -7.412 299 H LEU 36 HN LEU 36 -2.682 -3.815 -0.489 300 HA LEU 36 HA LEU 36 -1.755 -1.169 -0.960 301 HB2 LEU 36 HB2 LEU 36 -0.139 -3.676 -0.462 302 HB3 LEU 36 HB1 LEU 36 0.445 -2.026 -0.322 303 HG LEU 36 HG LEU 36 -1.714 -3.235 1.409 304 HD11 LEU 36 HD11 LEU 36 -0.026 -3.272 3.164 305 HD12 LEU 36 HD12 LEU 36 1.187 -2.692 2.023 306 HD13 LEU 36 HD13 LEU 36 0.459 -4.283 1.802 307 HD21 LEU 36 HD21 LEU 36 -1.343 -0.615 0.880 308 HD22 LEU 36 HD22 LEU 36 -0.241 -0.827 2.240 309 HD23 LEU 36 HD23 LEU 36 -1.947 -1.234 2.416 310 H LEU 37 HN LEU 37 -2.347 -0.932 -3.199 311 HA LEU 37 HA LEU 37 -1.675 -2.383 -5.369 312 HB2 LEU 37 HB2 LEU 37 -2.783 -0.050 -5.162 313 HB3 LEU 37 HB1 LEU 37 -1.158 0.562 -5.402 314 HG LEU 37 HG LEU 37 -1.051 -0.696 -7.543 315 HD11 LEU 37 HD11 LEU 37 -3.707 -1.562 -6.617 316 HD12 LEU 37 HD12 LEU 37 -2.529 -2.390 -7.636 317 HD13 LEU 37 HD13 LEU 37 -3.574 -1.149 -8.326 318 HD21 LEU 37 HD21 LEU 37 -2.236 0.916 -8.786 319 HD22 LEU 37 HD22 LEU 37 -1.753 1.728 -7.297 320 HD23 LEU 37 HD23 LEU 37 -3.411 1.161 -7.494 321 H LEU 38 HN LEU 38 0.040 -2.731 -6.693 322 HA LEU 38 HA LEU 38 2.223 -3.300 -7.073 323 HB2 LEU 38 HB2 LEU 38 3.622 -1.408 -7.584 324 HB3 LEU 38 HB1 LEU 38 1.986 -1.106 -8.133 325 HG LEU 38 HG LEU 38 2.751 -0.069 -5.453 326 HD11 LEU 38 HD11 LEU 38 3.692 1.960 -6.468 327 HD12 LEU 38 HD12 LEU 38 3.636 1.180 -8.048 328 HD13 LEU 38 HD13 LEU 38 4.681 0.534 -6.784 329 HD21 LEU 38 HD21 LEU 38 0.641 0.251 -7.356 330 HD22 LEU 38 HD22 LEU 38 1.415 1.809 -7.072 331 HD23 LEU 38 HD23 LEU 38 0.766 0.887 -5.717 332 H VAL 39 HN VAL 39 1.749 -4.028 -4.534 333 HA VAL 39 HA VAL 39 4.279 -3.349 -3.203 334 HB VAL 39 HB VAL 39 1.644 -3.684 -1.757 335 HG11 VAL 39 HG11 VAL 39 4.291 -2.799 -0.631 336 HG12 VAL 39 HG12 VAL 39 3.728 -4.469 -0.584 337 HG13 VAL 39 HG13 VAL 39 2.818 -3.210 0.248 338 HG21 VAL 39 HG21 VAL 39 1.288 -1.513 -2.076 339 HG22 VAL 39 HG22 VAL 39 2.766 -1.397 -3.030 340 HG23 VAL 39 HG23 VAL 39 2.821 -1.149 -1.286 341 H ASP 40 HN ASP 40 5.332 -5.041 -2.247 342 HA ASP 40 HA ASP 40 4.189 -7.696 -2.746 343 HB2 ASP 40 HB2 ASP 40 6.606 -6.741 -3.483 344 HB3 ASP 40 HB1 ASP 40 7.023 -7.445 -1.923 345 H THR 41 HN THR 41 4.190 -9.302 -1.156 346 HA THR 41 HA THR 41 4.105 -8.261 1.566 347 HB THR 41 HB THR 41 3.363 -10.879 1.775 348 HG1 THR 41 HG1 THR 41 2.381 -10.008 -0.732 349 HG21 THR 41 HG21 THR 41 1.085 -9.420 0.855 350 HG22 THR 41 HG22 THR 41 2.076 -8.398 1.897 351 HG23 THR 41 HG23 THR 41 1.490 -9.955 2.486 352 HA PRO 42 HA PRO 42 7.988 -9.794 2.968 353 HB2 PRO 42 HB2 PRO 42 6.452 -10.957 5.243 354 HB3 PRO 42 HB1 PRO 42 7.875 -9.908 5.264 355 HG2 PRO 42 HG2 PRO 42 5.466 -8.933 5.836 356 HG3 PRO 42 HG1 PRO 42 6.628 -7.988 4.888 357 HD2 PRO 42 HD2 PRO 42 4.201 -9.468 3.984 358 HD3 PRO 42 HD1 PRO 42 4.884 -7.944 3.383 359 H GLU 43 HN GLU 43 5.489 -12.145 3.959 360 HA GLU 43 HA GLU 43 6.579 -14.169 2.213 361 HB2 GLU 43 HB2 GLU 43 7.920 -14.056 4.477 362 HB3 GLU 43 HB1 GLU 43 6.525 -14.923 5.107 363 HG2 GLU 43 HG2 GLU 43 7.831 -15.927 2.632 364 HG3 GLU 43 HG1 GLU 43 8.626 -16.193 4.184 365 H THR 44 HN THR 44 4.326 -13.731 1.527 366 HA THR 44 HA THR 44 2.488 -15.503 2.976 367 HB THR 44 HB THR 44 1.798 -12.777 1.864 368 HG1 THR 44 HG1 THR 44 1.664 -13.753 4.520 369 HG21 THR 44 HG21 THR 44 -0.362 -13.251 1.922 370 HG22 THR 44 HG22 THR 44 -0.223 -14.022 3.502 371 HG23 THR 44 HG23 THR 44 0.099 -14.950 2.036 372 H LYS 45 HN LYS 45 2.351 -17.165 1.590 373 HA LYS 45 HA LYS 45 0.888 -16.980 -0.780 374 HB2 LYS 45 HB2 LYS 45 2.875 -17.691 -2.316 375 HB3 LYS 45 HB1 LYS 45 2.592 -15.987 -1.990 376 HG2 LYS 45 HG2 LYS 45 4.294 -16.220 -0.118 377 HG3 LYS 45 HG1 LYS 45 4.707 -17.777 -0.839 378 HD2 LYS 45 HD2 LYS 45 4.593 -15.699 -2.843 379 HD3 LYS 45 HD1 LYS 45 5.709 -15.268 -1.546 380 HE2 LYS 45 HE2 LYS 45 5.819 -18.020 -2.680 381 HE3 LYS 45 HE1 LYS 45 6.501 -16.691 -3.616 382 HZ1 LYS 45 HZ1 LYS 45 7.582 -16.193 -1.256 383 HZ2 LYS 45 HZ2 LYS 45 8.312 -17.203 -2.398 384 HZ3 LYS 45 HZ3 LYS 45 7.426 -17.873 -1.123 385 H HIS 46 HN HIS 46 -0.141 -18.842 -0.480 386 HA HIS 46 HA HIS 46 1.009 -21.322 -0.983 387 HB2 HIS 46 HB2 HIS 46 1.586 -20.469 1.634 388 HB3 HIS 46 HB1 HIS 46 0.311 -21.671 1.799 389 HD1 HIS 46 HD1 HIS 46 3.709 -21.342 0.124 390 HD2 HIS 46 HD2 HIS 46 1.210 -24.226 1.768 391 HE1 HIS 46 HE1 HIS 46 5.030 -23.479 0.079 392 HE2 HIS 46 HE2 HIS 46 3.536 -25.188 1.172 393 HA PRO 47 HA PRO 47 -3.447 -22.010 0.566 394 HB2 PRO 47 HB2 PRO 47 -4.672 -20.224 2.133 395 HB3 PRO 47 HB1 PRO 47 -3.499 -21.370 2.794 396 HG2 PRO 47 HG2 PRO 47 -3.141 -18.483 2.097 397 HG3 PRO 47 HG1 PRO 47 -2.542 -19.377 3.504 398 HD2 PRO 47 HD2 PRO 47 -1.035 -18.793 1.272 399 HD3 PRO 47 HD1 PRO 47 -0.704 -20.133 2.385 400 H LYS 48 HN LYS 48 -5.506 -21.505 -0.311 401 HA LYS 48 HA LYS 48 -5.542 -19.087 -1.996 402 HB2 LYS 48 HB2 LYS 48 -7.100 -20.475 -3.475 403 HB3 LYS 48 HB1 LYS 48 -5.392 -20.892 -3.495 404 HG2 LYS 48 HG2 LYS 48 -5.791 -22.768 -2.032 405 HG3 LYS 48 HG1 LYS 48 -7.488 -22.314 -1.866 406 HD2 LYS 48 HD2 LYS 48 -8.035 -23.070 -3.950 407 HD3 LYS 48 HD1 LYS 48 -6.433 -22.733 -4.610 408 HE2 LYS 48 HE2 LYS 48 -5.573 -24.732 -3.908 409 HE3 LYS 48 HE1 LYS 48 -6.678 -24.851 -2.540 410 HZ1 LYS 48 HZ1 LYS 48 -7.024 -25.734 -5.286 411 HZ2 LYS 48 HZ2 LYS 48 -8.386 -25.037 -4.567 412 HZ3 LYS 48 HZ3 LYS 48 -7.649 -26.380 -3.852 413 H LYS 49 HN LYS 49 -7.443 -21.292 -0.008 414 HA LYS 49 HA LYS 49 -9.621 -19.309 0.023 415 HB2 LYS 49 HB2 LYS 49 -9.619 -22.295 0.402 416 HB3 LYS 49 HB1 LYS 49 -10.960 -21.301 0.953 417 HG2 LYS 49 HG2 LYS 49 -10.749 -20.409 -1.567 418 HG3 LYS 49 HG1 LYS 49 -10.156 -22.057 -1.779 419 HD2 LYS 49 HD2 LYS 49 -12.186 -22.934 -0.755 420 HD3 LYS 49 HD1 LYS 49 -12.773 -21.292 -0.487 421 HE2 LYS 49 HE2 LYS 49 -13.857 -21.728 -2.436 422 HE3 LYS 49 HE1 LYS 49 -12.340 -21.131 -3.104 423 HZ1 LYS 49 HZ1 LYS 49 -11.642 -23.259 -3.634 424 HZ2 LYS 49 HZ2 LYS 49 -13.294 -23.321 -3.991 425 HZ3 LYS 49 HZ3 LYS 49 -12.712 -24.005 -2.557 426 H GLY 50 HN GLY 50 -7.735 -18.454 1.581 427 HA2 GLY 50 HA2 GLY 50 -7.551 -17.647 3.749 428 HA3 GLY 50 HA1 GLY 50 -8.831 -18.747 4.236 429 H VAL 51 HN VAL 51 -8.304 -20.543 5.325 430 HA VAL 51 HA VAL 51 -7.072 -22.178 6.325 431 HB VAL 51 HB VAL 51 -4.865 -21.511 4.375 432 HG11 VAL 51 HG11 VAL 51 -3.809 -22.940 5.770 433 HG12 VAL 51 HG12 VAL 51 -4.673 -24.153 4.826 434 HG13 VAL 51 HG13 VAL 51 -5.313 -23.625 6.382 435 HG21 VAL 51 HG21 VAL 51 -6.564 -23.839 3.828 436 HG22 VAL 51 HG22 VAL 51 -5.903 -22.631 2.727 437 HG23 VAL 51 HG23 VAL 51 -7.370 -22.281 3.642 438 H GLU 52 HN GLU 52 -4.579 -19.810 5.366 439 HA GLU 52 HA GLU 52 -4.292 -18.841 8.053 440 HB2 GLU 52 HB2 GLU 52 -2.738 -21.096 7.243 441 HB3 GLU 52 HB1 GLU 52 -1.661 -19.718 7.413 442 HG2 GLU 52 HG2 GLU 52 -2.433 -19.360 9.681 443 HG3 GLU 52 HG1 GLU 52 -3.580 -20.689 9.519 444 H LYS 53 HN LYS 53 -3.242 -16.893 8.134 445 HA LYS 53 HA LYS 53 -1.492 -15.955 6.101 446 HB2 LYS 53 HB2 LYS 53 -4.108 -15.821 5.327 447 HB3 LYS 53 HB1 LYS 53 -3.885 -14.240 6.061 448 HG2 LYS 53 HG2 LYS 53 -2.010 -13.795 4.583 449 HG3 LYS 53 HG1 LYS 53 -2.172 -15.403 3.873 450 HD2 LYS 53 HD2 LYS 53 -4.669 -14.525 3.505 451 HD3 LYS 53 HD1 LYS 53 -3.827 -12.975 3.492 452 HE2 LYS 53 HE2 LYS 53 -2.215 -14.426 1.882 453 HE3 LYS 53 HE1 LYS 53 -3.771 -15.183 1.543 454 HZ1 LYS 53 HZ1 LYS 53 -2.933 -13.054 0.254 455 HZ2 LYS 53 HZ2 LYS 53 -3.678 -12.266 1.552 456 HZ3 LYS 53 HZ3 LYS 53 -4.575 -13.317 0.575 457 H TYR 54 HN TYR 54 -0.122 -14.822 7.298 458 HA TYR 54 HA TYR 54 -1.119 -12.677 8.982 459 HB2 TYR 54 HB2 TYR 54 -0.709 -15.037 10.228 460 HB3 TYR 54 HB1 TYR 54 0.914 -14.362 10.324 461 HD1 TYR 54 HD2 TYR 54 -2.402 -12.671 10.540 462 HD2 TYR 54 HD1 TYR 54 1.203 -13.723 12.540 463 HE1 TYR 54 HE2 TYR 54 -3.087 -11.317 12.475 464 HE2 TYR 54 HE1 TYR 54 0.529 -12.372 14.481 465 HH TYR 54 HH TYR 54 -1.546 -10.076 14.493 466 H GLY 55 HN GLY 55 0.754 -11.396 9.915 467 HA2 GLY 55 HA2 GLY 55 3.340 -11.635 8.748 468 HA3 GLY 55 HA1 GLY 55 2.381 -10.434 7.895 469 HA PRO 56 HA PRO 56 2.949 -9.055 12.627 470 HB2 PRO 56 HB2 PRO 56 5.671 -10.237 12.874 471 HB3 PRO 56 HB1 PRO 56 4.409 -10.049 14.097 472 HG2 PRO 56 HG2 PRO 56 4.906 -12.431 13.016 473 HG3 PRO 56 HG1 PRO 56 3.245 -11.921 13.373 474 HD2 PRO 56 HD2 PRO 56 4.669 -12.052 10.751 475 HD3 PRO 56 HD1 PRO 56 2.969 -12.398 11.133 476 H GLU 57 HN GLU 57 5.433 -9.366 10.157 477 HA GLU 57 HA GLU 57 6.764 -6.924 10.891 478 HB2 GLU 57 HB2 GLU 57 7.551 -9.111 9.508 479 HB3 GLU 57 HB1 GLU 57 7.174 -8.024 8.178 480 HG2 GLU 57 HG2 GLU 57 9.441 -7.691 8.591 481 HG3 GLU 57 HG1 GLU 57 8.644 -6.323 9.367 482 H ALA 58 HN ALA 58 4.824 -7.918 8.065 483 HA ALA 58 HA ALA 58 4.627 -5.203 7.123 484 HB1 ALA 58 HB1 ALA 58 2.866 -6.483 5.577 485 HB2 ALA 58 HB2 ALA 58 3.797 -7.868 6.148 486 HB3 ALA 58 HB3 ALA 58 4.607 -6.548 5.304 487 H SER 59 HN SER 59 2.253 -7.604 8.263 488 HA SER 59 HA SER 59 -0.014 -6.044 8.204 489 HB2 SER 59 HB2 SER 59 0.458 -8.574 8.938 490 HB3 SER 59 HB1 SER 59 0.287 -7.858 10.541 491 HG SER 59 HG SER 59 -1.693 -8.657 9.490 492 H ALA 60 HN ALA 60 2.238 -6.418 10.944 493 HA ALA 60 HA ALA 60 0.920 -4.767 12.751 494 HB1 ALA 60 HB1 ALA 60 2.886 -6.270 13.209 495 HB2 ALA 60 HB2 ALA 60 2.937 -4.688 13.989 496 HB3 ALA 60 HB3 ALA 60 3.913 -4.995 12.551 497 H PHE 61 HN PHE 61 3.664 -3.870 10.641 498 HA PHE 61 HA PHE 61 3.643 -1.155 11.263 499 HB2 PHE 61 HB2 PHE 61 5.497 -2.318 10.106 500 HB3 PHE 61 HB1 PHE 61 4.498 -2.430 8.660 501 HD1 PHE 61 HD1 PHE 61 6.189 -0.098 10.944 502 HD2 PHE 61 HD2 PHE 61 4.271 -0.607 7.189 503 HE1 PHE 61 HE1 PHE 61 6.967 2.137 10.249 504 HE2 PHE 61 HE2 PHE 61 5.031 1.616 6.482 505 HZ PHE 61 HZ PHE 61 6.388 2.997 8.011 506 H THR 62 HN THR 62 2.261 -2.771 8.393 507 HA THR 62 HA THR 62 1.109 -0.553 7.204 508 HB THR 62 HB THR 62 0.001 -3.369 7.265 509 HG1 THR 62 HG1 THR 62 1.639 -2.250 5.263 510 HG21 THR 62 HG21 THR 62 -1.482 -2.834 5.707 511 HG22 THR 62 HG22 THR 62 -0.308 -1.881 4.800 512 HG23 THR 62 HG23 THR 62 -1.183 -1.153 6.148 513 H LYS 63 HN LYS 63 -0.150 -2.629 9.758 514 HA LYS 63 HA LYS 63 -2.699 -1.334 9.893 515 HB2 LYS 63 HB2 LYS 63 -2.417 -3.667 10.577 516 HB3 LYS 63 HB1 LYS 63 -1.313 -3.172 11.853 517 HG2 LYS 63 HG2 LYS 63 -3.946 -1.878 11.922 518 HG3 LYS 63 HG1 LYS 63 -3.956 -3.621 12.194 519 HD2 LYS 63 HD2 LYS 63 -2.179 -1.687 13.677 520 HD3 LYS 63 HD1 LYS 63 -3.739 -2.256 14.276 521 HE2 LYS 63 HE2 LYS 63 -2.244 -4.528 13.487 522 HE3 LYS 63 HE1 LYS 63 -1.184 -3.508 14.459 523 HZ1 LYS 63 HZ1 LYS 63 -3.876 -3.900 15.483 524 HZ2 LYS 63 HZ2 LYS 63 -2.400 -3.854 16.307 525 HZ3 LYS 63 HZ3 LYS 63 -2.874 -5.264 15.502 526 H LYS 64 HN LYS 64 0.415 -0.836 11.342 527 HA LYS 64 HA LYS 64 -0.356 0.639 13.604 528 HB2 LYS 64 HB2 LYS 64 2.126 0.209 12.068 529 HB3 LYS 64 HB1 LYS 64 2.066 1.702 12.992 530 HG2 LYS 64 HG2 LYS 64 1.198 -0.659 14.484 531 HG3 LYS 64 HG1 LYS 64 2.880 -0.711 13.947 532 HD2 LYS 64 HD2 LYS 64 1.852 1.783 15.217 533 HD3 LYS 64 HD1 LYS 64 2.219 0.394 16.243 534 HE2 LYS 64 HE2 LYS 64 4.284 1.310 16.256 535 HE3 LYS 64 HE1 LYS 64 4.436 0.440 14.730 536 HZ1 LYS 64 HZ1 LYS 64 4.036 2.386 13.512 537 HZ2 LYS 64 HZ2 LYS 64 5.111 2.858 14.730 538 HZ3 LYS 64 HZ3 LYS 64 3.468 3.234 14.862 539 H MET 65 HN MET 65 0.845 1.798 10.462 540 HA MET 65 HA MET 65 0.447 4.520 10.947 541 HB2 MET 65 HB2 MET 65 1.213 2.855 8.734 542 HB3 MET 65 HB1 MET 65 0.107 4.103 8.179 543 HG2 MET 65 HG2 MET 65 1.698 5.632 8.262 544 HG3 MET 65 HG1 MET 65 2.043 5.250 9.947 545 HE1 MET 65 HE1 MET 65 5.210 4.034 10.136 546 HE2 MET 65 HE2 MET 65 4.191 2.594 10.168 547 HE3 MET 65 HE3 MET 65 3.596 4.111 10.843 548 H VAL 66 HN VAL 66 -1.673 2.240 9.196 549 HA VAL 66 HA VAL 66 -3.671 4.120 8.594 550 HB VAL 66 HB VAL 66 -5.163 2.142 8.277 551 HG11 VAL 66 HG11 VAL 66 -3.890 1.212 6.394 552 HG12 VAL 66 HG12 VAL 66 -2.429 1.983 7.012 553 HG13 VAL 66 HG13 VAL 66 -3.782 2.971 6.457 554 HG21 VAL 66 HG21 VAL 66 -3.508 -0.020 8.324 555 HG22 VAL 66 HG22 VAL 66 -4.675 0.383 9.582 556 HG23 VAL 66 HG23 VAL 66 -2.987 0.860 9.761 557 H GLU 67 HN GLU 67 -3.210 2.049 11.413 558 HA GLU 67 HA GLU 67 -5.756 2.732 12.535 559 HB2 GLU 67 HB2 GLU 67 -3.383 1.272 13.690 560 HB3 GLU 67 HB1 GLU 67 -4.912 1.489 14.531 561 HG2 GLU 67 HG2 GLU 67 -4.662 0.135 11.860 562 HG3 GLU 67 HG1 GLU 67 -4.611 -0.720 13.402 563 H ASN 68 HN ASN 68 -2.371 3.518 13.315 564 HA ASN 68 HA ASN 68 -2.982 5.218 15.485 565 HB2 ASN 68 HB2 ASN 68 -0.563 4.911 13.723 566 HB3 ASN 68 HB1 ASN 68 -0.633 6.158 14.962 567 HD21 ASN 68 HD21 ASN 68 -0.979 2.680 14.462 568 HD22 ASN 68 HD22 ASN 68 -0.392 2.220 16.020 569 H ALA 69 HN ALA 69 -2.935 5.709 12.045 570 HA ALA 69 HA ALA 69 -2.862 8.571 12.155 571 HB1 ALA 69 HB1 ALA 69 -2.043 7.502 10.182 572 HB2 ALA 69 HB2 ALA 69 -3.489 8.413 9.747 573 HB3 ALA 69 HB3 ALA 69 -3.574 6.662 9.937 574 H LYS 70 HN LYS 70 -4.478 9.827 12.778 575 HA LYS 70 HA LYS 70 -7.059 8.921 13.373 576 HB2 LYS 70 HB2 LYS 70 -5.860 11.648 13.005 577 HB3 LYS 70 HB1 LYS 70 -7.586 11.464 13.289 578 HG2 LYS 70 HG2 LYS 70 -6.736 9.983 15.303 579 HG3 LYS 70 HG1 LYS 70 -5.299 10.989 15.116 580 HD2 LYS 70 HD2 LYS 70 -6.341 12.843 15.870 581 HD3 LYS 70 HD1 LYS 70 -7.863 12.433 15.077 582 HE2 LYS 70 HE2 LYS 70 -8.474 10.949 16.824 583 HE3 LYS 70 HE1 LYS 70 -6.858 11.005 17.528 584 HZ1 LYS 70 HZ1 LYS 70 -7.230 13.043 18.452 585 HZ2 LYS 70 HZ2 LYS 70 -8.800 12.416 18.519 586 HZ3 LYS 70 HZ3 LYS 70 -8.377 13.503 17.295 587 H LYS 71 HN LYS 71 -5.660 9.894 10.378 588 HA LYS 71 HA LYS 71 -8.268 9.556 9.087 589 HB2 LYS 71 HB2 LYS 71 -7.420 12.040 9.428 590 HB3 LYS 71 HB1 LYS 71 -6.446 11.658 8.015 591 HG2 LYS 71 HG2 LYS 71 -8.708 10.851 7.012 592 HG3 LYS 71 HG1 LYS 71 -9.408 11.874 8.268 593 HD2 LYS 71 HD2 LYS 71 -8.779 13.779 7.240 594 HD3 LYS 71 HD1 LYS 71 -7.229 13.109 6.728 595 HE2 LYS 71 HE2 LYS 71 -8.114 12.198 4.796 596 HE3 LYS 71 HE1 LYS 71 -9.754 12.161 5.443 597 HZ1 LYS 71 HZ1 LYS 71 -9.282 14.780 5.432 598 HZ2 LYS 71 HZ2 LYS 71 -9.990 13.957 4.135 599 HZ3 LYS 71 HZ3 LYS 71 -8.336 14.313 4.108 600 H ILE 72 HN ILE 72 -8.224 8.529 7.143 601 HA ILE 72 HA ILE 72 -5.577 7.735 6.119 602 HB ILE 72 HB ILE 72 -8.044 6.069 5.750 603 HG12 ILE 72 HG12 ILE 72 -6.054 5.791 8.012 604 HG13 ILE 72 HG11 ILE 72 -7.691 6.416 8.189 605 HG21 ILE 72 HG21 ILE 72 -5.770 5.849 4.478 606 HG22 ILE 72 HG22 ILE 72 -6.635 4.414 5.027 607 HG23 ILE 72 HG23 ILE 72 -5.264 5.025 5.954 608 HD11 ILE 72 HD11 ILE 72 -6.763 3.634 7.703 609 HD12 ILE 72 HD12 ILE 72 -8.353 4.127 7.115 610 HD13 ILE 72 HD13 ILE 72 -7.972 4.244 8.833 611 H GLU 73 HN GLU 73 -5.279 7.729 3.903 612 HA GLU 73 HA GLU 73 -7.504 8.791 2.288 613 HB2 GLU 73 HB2 GLU 73 -4.656 9.536 1.704 614 HB3 GLU 73 HB1 GLU 73 -6.134 10.349 1.212 615 HG2 GLU 73 HG2 GLU 73 -6.486 10.913 3.647 616 HG3 GLU 73 HG1 GLU 73 -4.839 10.348 3.920 617 H VAL 74 HN VAL 74 -7.761 7.950 0.254 618 HA VAL 74 HA VAL 74 -5.883 5.810 -0.503 619 HB VAL 74 HB VAL 74 -7.911 4.827 -1.728 620 HG11 VAL 74 HG11 VAL 74 -8.753 4.091 0.767 621 HG12 VAL 74 HG12 VAL 74 -7.114 4.662 1.076 622 HG13 VAL 74 HG13 VAL 74 -7.396 3.381 -0.104 623 HG21 VAL 74 HG21 VAL 74 -9.555 6.151 0.376 624 HG22 VAL 74 HG22 VAL 74 -10.046 5.465 -1.173 625 HG23 VAL 74 HG23 VAL 74 -9.218 7.021 -1.120 626 H GLU 75 HN GLU 75 -5.264 5.633 -2.612 627 HA GLU 75 HA GLU 75 -6.300 7.636 -4.498 628 HB2 GLU 75 HB2 GLU 75 -3.897 7.961 -3.378 629 HB3 GLU 75 HB1 GLU 75 -3.431 6.862 -4.670 630 HG2 GLU 75 HG2 GLU 75 -5.139 9.045 -5.565 631 HG3 GLU 75 HG1 GLU 75 -3.612 9.583 -4.866 632 H PHE 76 HN PHE 76 -7.396 6.413 -5.921 633 HA PHE 76 HA PHE 76 -6.625 3.754 -6.604 634 HB2 PHE 76 HB2 PHE 76 -8.718 5.637 -7.680 635 HB3 PHE 76 HB1 PHE 76 -8.450 4.040 -8.369 636 HD1 PHE 76 HD2 PHE 76 -8.107 2.261 -6.203 637 HD2 PHE 76 HD1 PHE 76 -10.632 5.682 -6.426 638 HE1 PHE 76 HE2 PHE 76 -9.576 1.284 -4.487 639 HE2 PHE 76 HE1 PHE 76 -12.106 4.709 -4.713 640 HZ PHE 76 HZ PHE 76 -11.581 2.508 -3.742 641 H ASP 77 HN ASP 77 -5.648 2.996 -8.389 642 HA ASP 77 HA ASP 77 -3.695 4.505 -9.645 643 HB2 ASP 77 HB2 ASP 77 -3.381 2.624 -11.140 644 HB3 ASP 77 HB1 ASP 77 -3.722 2.026 -9.520 645 H LYS 78 HN LYS 78 -3.780 4.085 -12.328 646 HA LYS 78 HA LYS 78 -5.880 5.958 -13.163 647 HB2 LYS 78 HB2 LYS 78 -4.235 6.010 -15.264 648 HB3 LYS 78 HB1 LYS 78 -3.990 7.023 -13.851 649 HG2 LYS 78 HG2 LYS 78 -2.713 4.449 -13.535 650 HG3 LYS 78 HG1 LYS 78 -2.161 5.272 -14.984 651 HD2 LYS 78 HD2 LYS 78 -2.355 7.044 -12.693 652 HD3 LYS 78 HD1 LYS 78 -1.248 5.696 -12.429 653 HE2 LYS 78 HE2 LYS 78 -1.136 7.308 -14.952 654 HE3 LYS 78 HE1 LYS 78 -0.335 7.871 -13.487 655 HZ1 LYS 78 HZ1 LYS 78 0.148 5.132 -14.440 656 HZ2 LYS 78 HZ2 LYS 78 1.153 6.140 -13.526 657 HZ3 LYS 78 HZ3 LYS 78 0.952 6.424 -15.182 658 H GLY 79 HN GLY 79 -4.458 2.835 -13.840 659 HA2 GLY 79 HA2 GLY 79 -5.873 2.393 -16.281 660 HA3 GLY 79 HA1 GLY 79 -5.034 1.177 -15.335 661 H GLN 80 HN GLN 80 -6.207 -0.275 -14.259 662 HA GLN 80 HA GLN 80 -9.009 -0.392 -14.629 663 HB2 GLN 80 HB2 GLN 80 -8.903 -2.396 -13.186 664 HB3 GLN 80 HB1 GLN 80 -7.721 -2.416 -14.484 665 HG2 GLN 80 HG2 GLN 80 -6.134 -1.420 -12.672 666 HG3 GLN 80 HG1 GLN 80 -7.308 -2.116 -11.554 667 HE21 GLN 80 HE21 GLN 80 -7.737 -4.404 -11.731 668 HE22 GLN 80 HE22 GLN 80 -6.490 -5.465 -12.281 669 H ARG 81 HN ARG 81 -7.143 -0.075 -11.608 670 HA ARG 81 HA ARG 81 -7.594 1.092 -9.691 671 HB2 ARG 81 HB2 ARG 81 -10.168 1.975 -11.008 672 HB3 ARG 81 HB1 ARG 81 -9.471 2.629 -9.536 673 HG2 ARG 81 HG2 ARG 81 -7.498 3.351 -10.868 674 HG3 ARG 81 HG1 ARG 81 -8.357 2.839 -12.321 675 HD2 ARG 81 HD2 ARG 81 -9.699 4.700 -10.419 676 HD3 ARG 81 HD1 ARG 81 -8.457 5.329 -11.497 677 HE ARG 81 HE ARG 81 -9.827 4.853 -13.332 678 HH11 ARG 81 HH11 ARG 81 -11.356 3.931 -10.327 679 HH12 ARG 81 HH12 ARG 81 -12.936 3.826 -11.026 680 HH21 ARG 81 HH21 ARG 81 -11.903 4.710 -14.243 681 HH22 ARG 81 HH22 ARG 81 -13.247 4.265 -13.245 682 H THR 82 HN THR 82 -9.497 -1.338 -11.043 683 HA THR 82 HA THR 82 -10.164 -2.379 -8.467 684 HB THR 82 HB THR 82 -12.676 -2.574 -9.252 685 HG1 THR 82 HG1 THR 82 -13.305 -0.630 -10.302 686 HG21 THR 82 HG21 THR 82 -11.474 -1.118 -7.330 687 HG22 THR 82 HG22 THR 82 -13.211 -1.128 -7.635 688 HG23 THR 82 HG23 THR 82 -12.206 0.158 -8.303 689 H ASP 83 HN ASP 83 -9.854 -4.487 -8.626 690 HA ASP 83 HA ASP 83 -9.639 -5.766 -11.182 691 HB2 ASP 83 HB2 ASP 83 -9.054 -6.452 -8.376 692 HB3 ASP 83 HB1 ASP 83 -9.528 -7.816 -9.384 693 H LYS 84 HN LYS 84 -10.613 -8.222 -10.998 694 HA LYS 84 HA LYS 84 -13.202 -8.139 -11.825 695 HB2 LYS 84 HB2 LYS 84 -13.222 -10.563 -10.596 696 HB3 LYS 84 HB1 LYS 84 -12.525 -10.257 -12.181 697 HG2 LYS 84 HG2 LYS 84 -10.757 -9.823 -9.851 698 HG3 LYS 84 HG1 LYS 84 -11.216 -11.490 -10.205 699 HD2 LYS 84 HD2 LYS 84 -10.579 -10.534 -12.686 700 HD3 LYS 84 HD1 LYS 84 -9.431 -9.677 -11.658 701 HE2 LYS 84 HE2 LYS 84 -8.605 -11.864 -12.542 702 HE3 LYS 84 HE1 LYS 84 -8.572 -11.723 -10.784 703 HZ1 LYS 84 HZ1 LYS 84 -9.592 -13.811 -12.057 704 HZ2 LYS 84 HZ2 LYS 84 -10.987 -12.862 -11.935 705 HZ3 LYS 84 HZ3 LYS 84 -10.140 -13.303 -10.538 706 H TYR 85 HN TYR 85 -12.317 -9.226 -8.548 707 HA TYR 85 HA TYR 85 -14.948 -9.170 -7.569 708 HB2 TYR 85 HB2 TYR 85 -12.292 -9.692 -6.524 709 HB3 TYR 85 HB1 TYR 85 -13.275 -8.817 -5.359 710 HD1 TYR 85 HD1 TYR 85 -13.792 -11.622 -7.769 711 HD2 TYR 85 HD2 TYR 85 -14.346 -10.147 -3.821 712 HE1 TYR 85 HE1 TYR 85 -14.913 -13.724 -7.150 713 HE2 TYR 85 HE2 TYR 85 -15.468 -12.242 -3.187 714 HH TYR 85 HH TYR 85 -15.615 -14.540 -3.894 715 H GLY 86 HN GLY 86 -12.859 -6.643 -8.316 716 HA2 GLY 86 HA2 GLY 86 -13.444 -4.366 -8.222 717 HA3 GLY 86 HA1 GLY 86 -14.613 -4.742 -6.963 718 H ARG 87 HN ARG 87 -11.453 -6.085 -6.692 719 HA ARG 87 HA ARG 87 -10.912 -5.203 -4.159 720 HB2 ARG 87 HB2 ARG 87 -9.613 -6.802 -5.851 721 HB3 ARG 87 HB1 ARG 87 -8.597 -5.377 -6.020 722 HG2 ARG 87 HG2 ARG 87 -7.493 -6.227 -4.272 723 HG3 ARG 87 HG1 ARG 87 -8.815 -5.551 -3.320 724 HD2 ARG 87 HD2 ARG 87 -8.586 -8.375 -4.349 725 HD3 ARG 87 HD1 ARG 87 -8.438 -7.846 -2.674 726 HE ARG 87 HE ARG 87 -10.954 -7.183 -3.914 727 HH11 ARG 87 HH11 ARG 87 -9.178 -9.586 -2.111 728 HH12 ARG 87 HH12 ARG 87 -10.601 -10.334 -1.466 729 HH21 ARG 87 HH21 ARG 87 -12.825 -8.166 -3.068 730 HH22 ARG 87 HH22 ARG 87 -12.671 -9.530 -2.011 731 H GLY 88 HN GLY 88 -9.349 -3.626 -3.341 732 HA2 GLY 88 HA2 GLY 88 -9.751 -1.069 -4.666 733 HA3 GLY 88 HA1 GLY 88 -9.133 -1.308 -3.044 734 H LEU 89 HN LEU 89 -8.376 -0.823 -6.340 735 HA LEU 89 HA LEU 89 -5.564 -1.459 -6.041 736 HB2 LEU 89 HB2 LEU 89 -7.195 -0.344 -8.309 737 HB3 LEU 89 HB1 LEU 89 -5.461 -0.571 -8.400 738 HG LEU 89 HG LEU 89 -6.937 -2.369 -9.427 739 HD11 LEU 89 HD11 LEU 89 -4.572 -2.699 -9.076 740 HD12 LEU 89 HD12 LEU 89 -5.450 -4.178 -8.683 741 HD13 LEU 89 HD13 LEU 89 -4.860 -3.134 -7.390 742 HD21 LEU 89 HD21 LEU 89 -7.210 -3.319 -6.594 743 HD22 LEU 89 HD22 LEU 89 -7.940 -3.998 -8.050 744 HD23 LEU 89 HD23 LEU 89 -8.483 -2.436 -7.435 745 H ALA 90 HN ALA 90 -5.588 0.199 -4.187 746 HA ALA 90 HA ALA 90 -4.571 2.719 -5.256 747 HB1 ALA 90 HB1 ALA 90 -6.813 2.537 -3.254 748 HB2 ALA 90 HB2 ALA 90 -6.847 3.296 -4.843 749 HB3 ALA 90 HB3 ALA 90 -5.879 4.002 -3.553 750 H TYR 91 HN TYR 91 -3.798 4.117 -3.301 751 HA TYR 91 HA TYR 91 -2.229 2.345 -1.567 752 HB2 TYR 91 HB2 TYR 91 -1.603 5.251 -1.973 753 HB3 TYR 91 HB1 TYR 91 -0.524 3.946 -1.505 754 HD1 TYR 91 HD2 TYR 91 -2.623 5.039 -4.402 755 HD2 TYR 91 HD1 TYR 91 0.924 3.095 -3.085 756 HE1 TYR 91 HE2 TYR 91 -1.883 4.827 -6.734 757 HE2 TYR 91 HE1 TYR 91 1.679 2.886 -5.415 758 HH TYR 91 HH TYR 91 0.056 4.481 -8.028 759 H ILE 92 HN ILE 92 -2.308 2.551 0.626 760 HA ILE 92 HA ILE 92 -4.453 4.236 1.685 761 HB ILE 92 HB ILE 92 -2.827 2.143 3.132 762 HG12 ILE 92 HG12 ILE 92 -5.066 0.849 2.842 763 HG13 ILE 92 HG11 ILE 92 -5.352 1.963 1.508 764 HG21 ILE 92 HG21 ILE 92 -5.459 3.446 3.811 765 HG22 ILE 92 HG22 ILE 92 -3.910 3.776 4.589 766 HG23 ILE 92 HG23 ILE 92 -4.656 2.186 4.747 767 HD11 ILE 92 HD11 ILE 92 -4.002 -0.430 1.382 768 HD12 ILE 92 HD12 ILE 92 -2.713 0.774 1.400 769 HD13 ILE 92 HD13 ILE 92 -3.975 0.852 0.170 770 H TYR 93 HN TYR 93 -4.076 6.071 2.744 771 HA TYR 93 HA TYR 93 -1.303 6.719 3.457 772 HB2 TYR 93 HB2 TYR 93 -3.679 8.553 3.087 773 HB3 TYR 93 HB1 TYR 93 -2.050 9.070 3.479 774 HD1 TYR 93 HD2 TYR 93 -2.979 6.479 0.976 775 HD2 TYR 93 HD1 TYR 93 -1.574 10.436 1.638 776 HE1 TYR 93 HE2 TYR 93 -2.505 6.700 -1.418 777 HE2 TYR 93 HE1 TYR 93 -1.083 10.666 -0.759 778 HH TYR 93 HH TYR 93 -2.239 9.224 -3.021 779 H ALA 94 HN ALA 94 -0.906 7.929 5.413 780 HA ALA 94 HA ALA 94 -2.941 7.711 7.499 781 HB1 ALA 94 HB1 ALA 94 -1.956 5.878 8.325 782 HB2 ALA 94 HB2 ALA 94 -0.677 6.966 8.866 783 HB3 ALA 94 HB3 ALA 94 -0.513 6.100 7.339 784 H ASP 95 HN ASP 95 -3.135 9.708 8.272 785 HA ASP 95 HA ASP 95 -2.632 11.749 9.140 786 HB2 ASP 95 HB2 ASP 95 -0.739 10.124 10.205 787 HB3 ASP 95 HB1 ASP 95 0.278 11.280 9.349 788 H GLY 96 HN GLY 96 -1.948 10.859 6.190 789 HA2 GLY 96 HA2 GLY 96 -1.824 12.572 4.485 790 HA3 GLY 96 HA1 GLY 96 -0.697 13.439 5.512 791 H LYS 97 HN LYS 97 -0.146 10.083 5.433 792 HA LYS 97 HA LYS 97 1.825 10.384 3.283 793 HB2 LYS 97 HB2 LYS 97 2.294 9.633 6.123 794 HB3 LYS 97 HB1 LYS 97 3.216 8.777 4.896 795 HG2 LYS 97 HG2 LYS 97 3.887 11.043 4.003 796 HG3 LYS 97 HG1 LYS 97 3.192 11.721 5.478 797 HD2 LYS 97 HD2 LYS 97 5.199 9.505 5.634 798 HD3 LYS 97 HD1 LYS 97 5.732 11.170 5.392 799 HE2 LYS 97 HE2 LYS 97 5.204 11.782 7.497 800 HE3 LYS 97 HE1 LYS 97 3.754 10.779 7.534 801 HZ1 LYS 97 HZ1 LYS 97 4.870 9.044 8.398 802 HZ2 LYS 97 HZ2 LYS 97 5.947 10.236 8.928 803 HZ3 LYS 97 HZ3 LYS 97 6.286 9.355 7.524 804 H MET 98 HN MET 98 1.918 8.703 1.900 805 HA MET 98 HA MET 98 -0.035 6.653 2.064 806 HB2 MET 98 HB2 MET 98 2.303 6.337 0.241 807 HB3 MET 98 HB1 MET 98 0.595 6.029 -0.054 808 HG2 MET 98 HG2 MET 98 0.613 7.912 -1.224 809 HG3 MET 98 HG1 MET 98 0.657 8.742 0.330 810 HE1 MET 98 HE1 MET 98 2.541 10.781 -1.983 811 HE2 MET 98 HE2 MET 98 1.299 9.602 -2.404 812 HE3 MET 98 HE3 MET 98 2.938 9.416 -3.026 813 H VAL 99 HN VAL 99 0.054 5.068 3.476 814 HA VAL 99 HA VAL 99 2.264 4.175 4.888 815 HB VAL 99 HB VAL 99 -0.091 2.424 4.198 816 HG11 VAL 99 HG11 VAL 99 1.499 2.580 6.750 817 HG12 VAL 99 HG12 VAL 99 1.886 1.472 5.433 818 HG13 VAL 99 HG13 VAL 99 0.337 1.344 6.267 819 HG21 VAL 99 HG21 VAL 99 -1.019 3.434 6.384 820 HG22 VAL 99 HG22 VAL 99 -1.166 4.371 4.896 821 HG23 VAL 99 HG23 VAL 99 0.096 4.760 6.064 822 H ASN 100 HN ASN 100 0.869 2.884 1.892 823 HA ASN 100 HA ASN 100 2.331 0.577 1.581 824 HB2 ASN 100 HB2 ASN 100 1.656 2.525 -0.632 825 HB3 ASN 100 HB1 ASN 100 1.969 0.799 -0.808 826 HD21 ASN 100 HD21 ASN 100 -0.137 0.817 -1.849 827 HD22 ASN 100 HD22 ASN 100 -1.556 0.700 -0.874 828 H GLU 101 HN GLU 101 3.279 3.858 0.581 829 HA GLU 101 HA GLU 101 5.739 3.232 -0.561 830 HB2 GLU 101 HB2 GLU 101 4.480 5.471 -0.529 831 HB3 GLU 101 HB1 GLU 101 5.260 5.748 1.022 832 HG2 GLU 101 HG2 GLU 101 7.157 4.919 -0.996 833 HG3 GLU 101 HG1 GLU 101 6.266 6.360 -1.483 834 H ALA 102 HN ALA 102 4.910 3.926 2.809 835 HA ALA 102 HA ALA 102 7.471 4.017 3.894 836 HB1 ALA 102 HB1 ALA 102 4.895 3.039 5.115 837 HB2 ALA 102 HB2 ALA 102 5.577 4.662 5.210 838 HB3 ALA 102 HB3 ALA 102 6.380 3.320 6.023 839 H LEU 103 HN LEU 103 5.297 1.193 3.708 840 HA LEU 103 HA LEU 103 7.068 -0.701 4.719 841 HB2 LEU 103 HB2 LEU 103 4.740 -0.883 2.833 842 HB3 LEU 103 HB1 LEU 103 5.684 -2.306 3.230 843 HG LEU 103 HG LEU 103 5.153 -1.376 5.715 844 HD11 LEU 103 HD11 LEU 103 2.725 -0.719 4.052 845 HD12 LEU 103 HD12 LEU 103 3.773 0.456 4.844 846 HD13 LEU 103 HD13 LEU 103 2.829 -0.677 5.812 847 HD21 LEU 103 HD21 LEU 103 3.716 -3.203 5.931 848 HD22 LEU 103 HD22 LEU 103 4.781 -3.654 4.599 849 HD23 LEU 103 HD23 LEU 103 3.150 -3.073 4.265 850 H VAL 104 HN VAL 104 6.651 0.566 1.474 851 HA VAL 104 HA VAL 104 8.360 -1.279 0.160 852 HB VAL 104 HB VAL 104 7.695 1.534 -0.717 853 HG11 VAL 104 HG11 VAL 104 9.038 -0.768 -1.962 854 HG12 VAL 104 HG12 VAL 104 9.195 0.957 -2.293 855 HG13 VAL 104 HG13 VAL 104 7.841 0.050 -2.966 856 HG21 VAL 104 HG21 VAL 104 5.608 0.925 -1.217 857 HG22 VAL 104 HG22 VAL 104 5.878 -0.492 -0.203 858 HG23 VAL 104 HG23 VAL 104 6.144 -0.590 -1.943 859 H ARG 105 HN ARG 105 8.854 1.956 1.528 860 HA ARG 105 HA ARG 105 11.612 2.040 0.731 861 HB2 ARG 105 HB2 ARG 105 11.706 4.174 1.742 862 HB3 ARG 105 HB1 ARG 105 10.106 4.056 1.026 863 HG2 ARG 105 HG2 ARG 105 9.206 4.566 2.977 864 HG3 ARG 105 HG1 ARG 105 9.906 3.108 3.678 865 HD2 ARG 105 HD2 ARG 105 11.612 5.532 3.348 866 HD3 ARG 105 HD1 ARG 105 10.454 5.469 4.676 867 HE ARG 105 HE ARG 105 11.773 3.112 4.882 868 HH11 ARG 105 HH11 ARG 105 12.820 6.436 4.687 869 HH12 ARG 105 HH12 ARG 105 14.250 6.172 5.628 870 HH21 ARG 105 HH21 ARG 105 13.653 2.763 6.120 871 HH22 ARG 105 HH22 ARG 105 14.723 4.087 6.442 872 H GLN 106 HN GLN 106 9.846 0.956 3.534 873 HA GLN 106 HA GLN 106 12.126 0.961 5.287 874 HB2 GLN 106 HB2 GLN 106 9.315 0.449 5.527 875 HB3 GLN 106 HB1 GLN 106 10.204 -0.891 6.231 876 HG2 GLN 106 HG2 GLN 106 10.453 0.312 8.064 877 HG3 GLN 106 HG1 GLN 106 11.486 1.410 7.151 878 HE21 GLN 106 HE21 GLN 106 9.974 2.849 5.627 879 HE22 GLN 106 HE22 GLN 106 8.740 3.687 6.496 880 H GLY 107 HN GLY 107 10.247 -1.647 3.742 881 HA2 GLY 107 HA2 GLY 107 11.979 -3.219 2.573 882 HA3 GLY 107 HA1 GLY 107 12.471 -3.491 4.237 883 H LEU 108 HN LEU 108 9.481 -3.092 4.917 884 HA LEU 108 HA LEU 108 8.816 -5.783 5.203 885 HB2 LEU 108 HB2 LEU 108 6.755 -3.604 4.997 886 HB3 LEU 108 HB1 LEU 108 6.701 -5.066 5.963 887 HG LEU 108 HG LEU 108 8.398 -2.623 6.464 888 HD11 LEU 108 HD11 LEU 108 7.074 -2.924 8.707 889 HD12 LEU 108 HD12 LEU 108 5.937 -3.785 7.670 890 HD13 LEU 108 HD13 LEU 108 6.343 -2.103 7.329 891 HD21 LEU 108 HD21 LEU 108 8.664 -5.398 7.408 892 HD22 LEU 108 HD22 LEU 108 8.726 -4.158 8.661 893 HD23 LEU 108 HD23 LEU 108 9.862 -4.109 7.313 894 H ALA 109 HN ALA 109 8.399 -3.638 2.510 895 HA ALA 109 HA ALA 109 7.269 -5.848 0.964 896 HB1 ALA 109 HB1 ALA 109 5.260 -4.795 1.394 897 HB2 ALA 109 HB2 ALA 109 5.746 -4.055 -0.131 898 HB3 ALA 109 HB3 ALA 109 5.981 -3.186 1.385 899 H LYS 110 HN LYS 110 7.292 -5.369 -1.405 900 HA LYS 110 HA LYS 110 9.354 -3.433 -2.175 901 HB2 LYS 110 HB2 LYS 110 9.314 -6.315 -3.089 902 HB3 LYS 110 HB1 LYS 110 10.452 -5.081 -3.609 903 HG2 LYS 110 HG2 LYS 110 11.776 -5.483 -1.882 904 HG3 LYS 110 HG1 LYS 110 10.444 -5.273 -0.744 905 HD2 LYS 110 HD2 LYS 110 10.810 -7.453 -0.300 906 HD3 LYS 110 HD1 LYS 110 9.855 -7.711 -1.762 907 HE2 LYS 110 HE2 LYS 110 12.862 -7.496 -1.677 908 HE3 LYS 110 HE1 LYS 110 11.962 -9.012 -1.722 909 HZ1 LYS 110 HZ1 LYS 110 11.529 -6.965 -3.798 910 HZ2 LYS 110 HZ2 LYS 110 11.273 -8.635 -3.878 911 HZ3 LYS 110 HZ3 LYS 110 12.848 -8.020 -3.907 912 H VAL 111 HN VAL 111 9.363 -2.966 -4.498 913 HA VAL 111 HA VAL 111 6.693 -2.707 -5.494 914 HB VAL 111 HB VAL 111 9.377 -1.913 -6.609 915 HG11 VAL 111 HG11 VAL 111 8.026 -2.436 -8.525 916 HG12 VAL 111 HG12 VAL 111 8.117 -0.683 -8.362 917 HG13 VAL 111 HG13 VAL 111 6.660 -1.540 -7.861 918 HG21 VAL 111 HG21 VAL 111 8.498 -0.623 -4.712 919 HG22 VAL 111 HG22 VAL 111 7.034 -0.283 -5.635 920 HG23 VAL 111 HG23 VAL 111 8.589 0.342 -6.185 921 H ALA 112 HN ALA 112 5.704 -4.451 -6.293 922 HA ALA 112 HA ALA 112 6.979 -5.868 -8.507 923 HB1 ALA 112 HB1 ALA 112 5.919 -7.203 -6.026 924 HB2 ALA 112 HB2 ALA 112 7.540 -7.314 -6.714 925 HB3 ALA 112 HB3 ALA 112 6.174 -8.056 -7.548 926 H TYR 113 HN TYR 113 5.382 -7.308 -9.646 927 HA TYR 113 HA TYR 113 3.440 -7.537 -10.808 928 HB2 TYR 113 HB2 TYR 113 2.223 -6.636 -8.188 929 HB3 TYR 113 HB1 TYR 113 1.328 -7.349 -9.525 930 HD1 TYR 113 HD2 TYR 113 3.964 -8.024 -7.010 931 HD2 TYR 113 HD1 TYR 113 1.216 -9.694 -9.795 932 HE1 TYR 113 HE2 TYR 113 4.418 -10.264 -6.105 933 HE2 TYR 113 HE1 TYR 113 1.662 -11.939 -8.897 934 HH TYR 113 HH TYR 113 2.490 -12.967 -6.836 935 H VAL 114 HN VAL 114 4.820 -5.128 -11.167 936 HA VAL 114 HA VAL 114 2.858 -2.987 -11.169 937 HB VAL 114 HB VAL 114 5.157 -2.426 -10.604 938 HG11 VAL 114 HG11 VAL 114 6.901 -3.314 -11.641 939 HG12 VAL 114 HG12 VAL 114 6.407 -2.589 -13.170 940 HG13 VAL 114 HG13 VAL 114 5.798 -4.179 -12.711 941 HG21 VAL 114 HG21 VAL 114 3.705 -1.208 -12.811 942 HG22 VAL 114 HG22 VAL 114 5.436 -0.877 -12.873 943 HG23 VAL 114 HG23 VAL 114 4.509 -0.457 -11.433 944 H TYR 115 HN TYR 115 1.326 -3.182 -12.688 945 HA TYR 115 HA TYR 115 2.158 -3.856 -15.432 946 HB2 TYR 115 HB2 TYR 115 -0.401 -4.264 -15.688 947 HB3 TYR 115 HB1 TYR 115 0.582 -5.473 -14.873 948 HD1 TYR 115 HD2 TYR 115 -1.438 -2.441 -14.084 949 HD2 TYR 115 HD1 TYR 115 -0.162 -6.300 -12.846 950 HE1 TYR 115 HE2 TYR 115 -2.907 -2.284 -12.117 951 HE2 TYR 115 HE1 TYR 115 -1.626 -6.159 -10.874 952 HH TYR 115 HH TYR 115 -2.665 -4.300 -9.480 953 H LYS 116 HN LYS 116 1.617 -2.524 -17.116 954 HA LYS 116 HA LYS 116 0.610 0.124 -16.359 955 HB2 LYS 116 HB2 LYS 116 2.100 -0.712 -18.852 956 HB3 LYS 116 HB1 LYS 116 1.684 0.934 -18.395 957 HG2 LYS 116 HG2 LYS 116 3.560 -0.903 -16.928 958 HG3 LYS 116 HG1 LYS 116 4.009 0.489 -17.916 959 HD2 LYS 116 HD2 LYS 116 2.280 0.638 -15.448 960 HD3 LYS 116 HD1 LYS 116 4.021 0.928 -15.459 961 HE2 LYS 116 HE2 LYS 116 3.487 2.656 -17.303 962 HE3 LYS 116 HE1 LYS 116 1.830 2.542 -16.712 963 HZ1 LYS 116 HZ1 LYS 116 2.337 3.623 -14.820 964 HZ2 LYS 116 HZ2 LYS 116 3.616 4.242 -15.736 965 HZ3 LYS 116 HZ3 LYS 116 3.879 2.939 -14.691 966 HA PRO 117 HA PRO 117 0.208 1.888 -17.674 967 HB2 PRO 117 HB2 PRO 117 -1.778 3.593 -18.160 968 HB3 PRO 117 HB1 PRO 117 -0.878 2.851 -19.489 969 HG2 PRO 117 HG2 PRO 117 -3.586 2.183 -18.426 970 HG3 PRO 117 HG1 PRO 117 -3.010 2.198 -20.101 971 HD2 PRO 117 HD2 PRO 117 -3.252 -0.062 -18.476 972 HD3 PRO 117 HD1 PRO 117 -2.307 0.040 -19.973 973 H ASN 118 HN ASN 118 0.438 1.805 -15.488 974 HA ASN 118 HA ASN 118 -1.687 2.877 -13.862 975 HB2 ASN 118 HB2 ASN 118 -0.611 0.125 -13.209 976 HB3 ASN 118 HB1 ASN 118 -1.809 1.029 -12.291 977 HD21 ASN 118 HD21 ASN 118 -1.192 -0.606 -15.337 978 HD22 ASN 118 HD22 ASN 118 -2.851 -0.933 -15.704 979 H ASN 119 HN ASN 119 -0.729 2.301 -11.367 980 HA ASN 119 HA ASN 119 0.834 2.839 -9.817 981 HB2 ASN 119 HB2 ASN 119 2.812 2.568 -12.090 982 HB3 ASN 119 HB1 ASN 119 3.214 2.649 -10.378 983 HD21 ASN 119 HD21 ASN 119 1.845 0.711 -12.914 984 HD22 ASN 119 HD22 ASN 119 1.867 -0.788 -12.056 985 H THR 120 HN THR 120 -0.571 4.938 -10.690 986 HA THR 120 HA THR 120 0.563 7.102 -11.887 987 HB THR 120 HB THR 120 -0.801 7.685 -9.318 988 HG1 THR 120 HG1 THR 120 -2.151 6.106 -9.677 989 HG21 THR 120 HG21 THR 120 -1.285 9.547 -10.389 990 HG22 THR 120 HG22 THR 120 -2.235 8.622 -11.552 991 HG23 THR 120 HG23 THR 120 -0.525 8.930 -11.854 992 H HIS 121 HN HIS 121 1.339 5.819 -8.725 993 HA HIS 121 HA HIS 121 3.225 8.026 -8.264 994 HB2 HIS 121 HB2 HIS 121 1.997 6.000 -6.395 995 HB3 HIS 121 HB1 HIS 121 3.330 7.047 -5.921 996 HD1 HIS 121 HD1 HIS 121 2.797 9.667 -5.941 997 HD2 HIS 121 HD2 HIS 121 -0.488 7.141 -6.243 998 HE1 HIS 121 HE1 HIS 121 0.799 11.097 -5.403 999 HE2 HIS 121 HE2 HIS 121 -1.168 9.526 -5.508 1000 H GLU 122 HN GLU 122 3.693 5.799 -10.126 1001 HA GLU 122 HA GLU 122 5.389 3.846 -9.085 1002 HB2 GLU 122 HB2 GLU 122 4.419 3.874 -11.389 1003 HB3 GLU 122 HB1 GLU 122 5.586 5.117 -11.820 1004 HG2 GLU 122 HG2 GLU 122 7.408 3.628 -11.529 1005 HG3 GLU 122 HG1 GLU 122 6.376 2.411 -10.779 1006 H GLN 123 HN GLN 123 6.166 7.045 -10.421 1007 HA GLN 123 HA GLN 123 8.938 6.909 -10.235 1008 HB2 GLN 123 HB2 GLN 123 7.175 9.335 -9.850 1009 HB3 GLN 123 HB1 GLN 123 8.895 9.366 -10.210 1010 HG2 GLN 123 HG2 GLN 123 6.957 7.997 -12.033 1011 HG3 GLN 123 HG1 GLN 123 7.230 9.737 -12.123 1012 HE21 GLN 123 HE21 GLN 123 8.273 6.713 -13.126 1013 HE22 GLN 123 HE22 GLN 123 9.781 7.179 -13.828 1014 H LEU 124 HN LEU 124 6.567 7.263 -7.741 1015 HA LEU 124 HA LEU 124 8.413 8.300 -5.782 1016 HB2 LEU 124 HB2 LEU 124 6.078 8.920 -5.645 1017 HB3 LEU 124 HB1 LEU 124 5.600 7.236 -5.543 1018 HG LEU 124 HG LEU 124 7.103 7.262 -3.379 1019 HD11 LEU 124 HD11 LEU 124 6.124 10.023 -3.052 1020 HD12 LEU 124 HD12 LEU 124 7.537 9.817 -4.087 1021 HD13 LEU 124 HD13 LEU 124 7.574 9.247 -2.418 1022 HD21 LEU 124 HD21 LEU 124 4.986 8.226 -2.173 1023 HD22 LEU 124 HD22 LEU 124 4.907 6.691 -3.038 1024 HD23 LEU 124 HD23 LEU 124 4.291 8.161 -3.793 1025 H LEU 125 HN LEU 125 6.803 5.199 -6.409 1026 HA LEU 125 HA LEU 125 8.150 3.888 -4.233 1027 HB2 LEU 125 HB2 LEU 125 6.317 2.987 -6.428 1028 HB3 LEU 125 HB1 LEU 125 7.160 1.814 -5.432 1029 HG LEU 125 HG LEU 125 6.093 3.298 -3.480 1030 HD11 LEU 125 HD11 LEU 125 4.372 3.748 -5.890 1031 HD12 LEU 125 HD12 LEU 125 4.927 4.910 -4.684 1032 HD13 LEU 125 HD13 LEU 125 3.687 3.728 -4.265 1033 HD21 LEU 125 HD21 LEU 125 4.085 1.486 -4.565 1034 HD22 LEU 125 HD22 LEU 125 4.973 1.415 -3.044 1035 HD23 LEU 125 HD23 LEU 125 5.702 0.785 -4.522 1036 H ARG 126 HN ARG 126 8.769 4.404 -7.609 1037 HA ARG 126 HA ARG 126 10.458 2.254 -8.163 1038 HB2 ARG 126 HB2 ARG 126 9.832 4.814 -9.362 1039 HB3 ARG 126 HB1 ARG 126 11.543 4.445 -9.530 1040 HG2 ARG 126 HG2 ARG 126 10.935 2.257 -10.506 1041 HG3 ARG 126 HG1 ARG 126 9.237 2.729 -10.426 1042 HD2 ARG 126 HD2 ARG 126 9.557 4.483 -11.981 1043 HD3 ARG 126 HD1 ARG 126 11.311 4.359 -11.869 1044 HE ARG 126 HE ARG 126 10.566 1.922 -12.786 1045 HH11 ARG 126 HH11 ARG 126 9.913 5.183 -13.842 1046 HH12 ARG 126 HH12 ARG 126 9.771 4.746 -15.512 1047 HH21 ARG 126 HH21 ARG 126 10.378 1.346 -14.981 1048 HH22 ARG 126 HH22 ARG 126 10.034 2.568 -16.159 1049 H LYS 127 HN LYS 127 11.107 5.328 -6.573 1050 HA LYS 127 HA LYS 127 13.940 4.838 -6.376 1051 HB2 LYS 127 HB2 LYS 127 12.456 6.865 -4.730 1052 HB3 LYS 127 HB1 LYS 127 14.102 6.935 -5.342 1053 HG2 LYS 127 HG2 LYS 127 11.582 7.194 -6.968 1054 HG3 LYS 127 HG1 LYS 127 12.690 8.495 -6.530 1055 HD2 LYS 127 HD2 LYS 127 13.856 6.159 -7.928 1056 HD3 LYS 127 HD1 LYS 127 12.805 7.212 -8.877 1057 HE2 LYS 127 HE2 LYS 127 14.875 8.493 -7.181 1058 HE3 LYS 127 HE1 LYS 127 15.415 7.651 -8.633 1059 HZ1 LYS 127 HZ1 LYS 127 13.891 10.109 -8.373 1060 HZ2 LYS 127 HZ2 LYS 127 13.392 9.070 -9.611 1061 HZ3 LYS 127 HZ3 LYS 127 14.986 9.634 -9.574 1062 H SER 128 HN SER 128 11.200 4.894 -4.116 1063 HA SER 128 HA SER 128 12.575 4.242 -1.789 1064 HB2 SER 128 HB2 SER 128 10.376 4.917 -1.435 1065 HB3 SER 128 HB1 SER 128 9.745 3.867 -2.704 1066 HG SER 128 HG SER 128 9.211 2.838 -0.870 1067 H GLU 129 HN GLU 129 11.460 2.204 -4.408 1068 HA GLU 129 HA GLU 129 11.771 -0.281 -3.082 1069 HB2 GLU 129 HB2 GLU 129 10.404 -0.153 -5.060 1070 HB3 GLU 129 HB1 GLU 129 11.751 0.448 -6.014 1071 HG2 GLU 129 HG2 GLU 129 12.683 -1.955 -5.040 1072 HG3 GLU 129 HG1 GLU 129 10.982 -2.275 -5.369 1073 H ALA 130 HN ALA 130 13.795 1.191 -5.621 1074 HA ALA 130 HA ALA 130 15.953 -0.595 -5.236 1075 HB1 ALA 130 HB1 ALA 130 16.637 2.000 -6.401 1076 HB2 ALA 130 HB2 ALA 130 15.263 1.198 -7.167 1077 HB3 ALA 130 HB3 ALA 130 16.818 0.373 -7.060 1078 H GLN 131 HN GLN 131 15.088 2.434 -3.765 1079 HA GLN 131 HA GLN 131 17.561 3.279 -2.814 1080 HB2 GLN 131 HB2 GLN 131 14.738 3.691 -1.968 1081 HB3 GLN 131 HB1 GLN 131 16.000 4.142 -0.833 1082 HG2 GLN 131 HG2 GLN 131 16.690 5.155 -3.387 1083 HG3 GLN 131 HG1 GLN 131 15.019 5.593 -3.046 1084 HE21 GLN 131 HE21 GLN 131 17.713 5.169 -0.807 1085 HE22 GLN 131 HE22 GLN 131 17.712 6.793 -0.215 1086 H ALA 132 HN ALA 132 15.196 1.111 -1.295 1087 HA ALA 132 HA ALA 132 17.001 0.577 0.913 1088 HB1 ALA 132 HB1 ALA 132 14.797 0.709 1.638 1089 HB2 ALA 132 HB2 ALA 132 15.090 -1.028 1.557 1090 HB3 ALA 132 HB3 ALA 132 14.187 -0.224 0.272 1091 H LYS 133 HN LYS 133 16.122 -0.844 -2.115 1092 HA LYS 133 HA LYS 133 16.788 -3.528 -1.603 1093 HB2 LYS 133 HB2 LYS 133 15.935 -2.001 -3.807 1094 HB3 LYS 133 HB1 LYS 133 17.442 -2.757 -4.306 1095 HG2 LYS 133 HG2 LYS 133 16.522 -4.787 -4.431 1096 HG3 LYS 133 HG1 LYS 133 15.611 -4.574 -2.934 1097 HD2 LYS 133 HD2 LYS 133 14.046 -3.089 -4.225 1098 HD3 LYS 133 HD1 LYS 133 14.878 -3.610 -5.692 1099 HE2 LYS 133 HE2 LYS 133 14.341 -5.965 -5.072 1100 HE3 LYS 133 HE1 LYS 133 13.372 -5.342 -3.737 1101 HZ1 LYS 133 HZ1 LYS 133 12.040 -4.119 -5.400 1102 HZ2 LYS 133 HZ2 LYS 133 11.950 -5.797 -5.585 1103 HZ3 LYS 133 HZ3 LYS 133 12.911 -4.883 -6.634 1104 H LYS 134 HN LYS 134 18.716 -0.936 -3.095 1105 HA LYS 134 HA LYS 134 21.067 -2.348 -3.489 1106 HB2 LYS 134 HB2 LYS 134 22.105 -0.278 -3.851 1107 HB3 LYS 134 HB1 LYS 134 20.420 0.004 -4.256 1108 HG2 LYS 134 HG2 LYS 134 20.252 0.795 -1.776 1109 HG3 LYS 134 HG1 LYS 134 21.998 0.997 -1.937 1110 HD2 LYS 134 HD2 LYS 134 19.902 2.231 -3.726 1111 HD3 LYS 134 HD1 LYS 134 20.795 3.069 -2.455 1112 HE2 LYS 134 HE2 LYS 134 22.721 3.146 -3.670 1113 HE3 LYS 134 HE1 LYS 134 22.374 1.640 -4.519 1114 HZ1 LYS 134 HZ1 LYS 134 20.446 3.207 -5.473 1115 HZ2 LYS 134 HZ2 LYS 134 21.959 3.037 -6.212 1116 HZ3 LYS 134 HZ3 LYS 134 21.653 4.364 -5.209 1117 H GLU 135 HN GLU 135 19.899 -0.723 -0.604 1118 HA GLU 135 HA GLU 135 22.343 -1.468 0.833 1119 HB2 GLU 135 HB2 GLU 135 20.575 -0.123 2.588 1120 HB3 GLU 135 HB1 GLU 135 22.075 0.475 1.889 1121 HG2 GLU 135 HG2 GLU 135 20.867 1.376 -0.007 1122 HG3 GLU 135 HG1 GLU 135 19.358 0.710 0.615 1123 H LYS 136 HN LYS 136 19.410 -2.862 0.206 1124 HA LYS 136 HA LYS 136 18.064 -4.373 1.280 1125 HB2 LYS 136 HB2 LYS 136 20.782 -5.187 2.327 1126 HB3 LYS 136 HB1 LYS 136 19.338 -6.190 2.396 1127 HG2 LYS 136 HG2 LYS 136 19.233 -5.976 -0.121 1128 HG3 LYS 136 HG1 LYS 136 20.855 -5.289 -0.031 1129 HD2 LYS 136 HD2 LYS 136 21.438 -7.467 -0.310 1130 HD3 LYS 136 HD1 LYS 136 21.243 -7.483 1.445 1131 HE2 LYS 136 HE2 LYS 136 19.324 -8.695 1.357 1132 HE3 LYS 136 HE1 LYS 136 18.819 -7.987 -0.176 1133 HZ1 LYS 136 HZ1 LYS 136 21.156 -9.748 -0.182 1134 HZ2 LYS 136 HZ2 LYS 136 19.977 -9.516 -1.371 1135 HZ3 LYS 136 HZ3 LYS 136 19.633 -10.462 -0.013 1136 H LEU 137 HN LEU 137 17.400 -2.331 2.511 1137 HA LEU 137 HA LEU 137 18.183 -1.645 5.030 1138 HB2 LEU 137 HB2 LEU 137 15.583 -1.519 3.586 1139 HB3 LEU 137 HB1 LEU 137 15.572 -1.191 5.310 1140 HG LEU 137 HG LEU 137 17.127 0.305 3.201 1141 HD11 LEU 137 HD11 LEU 137 15.466 1.784 3.182 1142 HD12 LEU 137 HD12 LEU 137 15.366 1.810 4.943 1143 HD13 LEU 137 HD13 LEU 137 14.500 0.576 4.028 1144 HD21 LEU 137 HD21 LEU 137 17.428 1.800 5.396 1145 HD22 LEU 137 HD22 LEU 137 18.590 0.567 4.910 1146 HD23 LEU 137 HD23 LEU 137 17.387 0.204 6.146 1147 H ASN 138 HN ASN 138 14.993 -3.071 5.152 1148 HA ASN 138 HA ASN 138 16.008 -5.076 7.054 1149 HB2 ASN 138 HB2 ASN 138 13.577 -4.710 8.064 1150 HB3 ASN 138 HB1 ASN 138 14.938 -3.704 8.548 1151 HD21 ASN 138 HD21 ASN 138 11.831 -3.761 7.246 1152 HD22 ASN 138 HD22 ASN 138 11.718 -2.097 6.793 1153 H ILE 139 HN ILE 139 15.442 -7.104 6.672 1154 HA ILE 139 HA ILE 139 14.223 -8.925 6.014 1155 HB ILE 139 HB ILE 139 12.237 -7.094 4.682 1156 HG12 ILE 139 HG12 ILE 139 11.458 -8.216 7.264 1157 HG13 ILE 139 HG11 ILE 139 12.820 -7.109 7.396 1158 HG21 ILE 139 HG21 ILE 139 12.369 -9.986 5.330 1159 HG22 ILE 139 HG22 ILE 139 11.702 -9.170 3.917 1160 HG23 ILE 139 HG23 ILE 139 10.803 -9.184 5.434 1161 HD11 ILE 139 HD11 ILE 139 11.080 -5.665 7.648 1162 HD12 ILE 139 HD12 ILE 139 10.017 -6.584 6.582 1163 HD13 ILE 139 HD13 ILE 139 11.297 -5.582 5.899 1164 H TRP 140 HN TRP 140 15.667 -6.664 4.042 1165 HA TRP 140 HA TRP 140 15.057 -7.832 1.495 1166 HB2 TRP 140 HB2 TRP 140 17.400 -6.055 2.202 1167 HB3 TRP 140 HB1 TRP 140 16.746 -6.355 0.596 1168 HD1 TRP 140 HD1 TRP 140 15.732 -4.680 3.912 1169 HE1 TRP 140 HE1 TRP 140 14.098 -2.764 3.381 1170 HE3 TRP 140 HE3 TRP 140 15.227 -5.430 -1.111 1171 HZ2 TRP 140 HZ2 TRP 140 12.774 -1.713 1.130 1172 HZ3 TRP 140 HZ3 TRP 140 13.750 -3.926 -2.384 1173 HH2 TRP 140 HH2 TRP 140 12.549 -2.106 -1.287 Start of MODEL 3 1 H1 ALA 1 HT1 ALA 1 4.988 31.684 -12.022 2 H2 ALA 1 HT2 ALA 1 3.319 31.592 -12.415 3 H3 ALA 1 HT3 ALA 1 3.937 30.716 -11.075 4 HA ALA 1 HA ALA 1 4.647 32.960 -10.203 5 HB1 ALA 1 HB1 ALA 1 3.791 33.846 -12.594 6 HB2 ALA 1 HB2 ALA 1 3.834 34.843 -11.141 7 HB3 ALA 1 HB3 ALA 1 2.327 34.076 -11.639 8 H THR 2 HN THR 2 1.343 32.157 -11.294 9 HA THR 2 HA THR 2 0.631 31.661 -8.485 10 HB THR 2 HB THR 2 -1.694 32.632 -9.291 11 HG1 THR 2 HG1 THR 2 0.152 34.069 -10.891 12 HG21 THR 2 HG21 THR 2 0.377 34.715 -8.791 13 HG22 THR 2 HG22 THR 2 -0.026 33.548 -7.531 14 HG23 THR 2 HG23 THR 2 -1.277 34.604 -8.189 15 H SER 3 HN SER 3 -0.131 29.677 -8.230 16 HA SER 3 HA SER 3 -1.375 28.340 -10.541 17 HB2 SER 3 HB2 SER 3 -0.333 26.825 -8.175 18 HB3 SER 3 HB1 SER 3 -0.470 26.314 -9.858 19 HG SER 3 HG SER 3 1.678 27.147 -8.712 20 H THR 4 HN THR 4 -3.206 27.001 -10.183 21 HA THR 4 HA THR 4 -4.581 27.350 -7.619 22 HB THR 4 HB THR 4 -6.725 27.691 -9.002 23 HG1 THR 4 HG1 THR 4 -4.788 28.457 -10.926 24 HG21 THR 4 HG21 THR 4 -5.433 30.156 -9.575 25 HG22 THR 4 HG22 THR 4 -4.861 29.557 -8.018 26 HG23 THR 4 HG23 THR 4 -6.588 29.777 -8.298 27 H LYS 5 HN LYS 5 -3.805 25.108 -7.447 28 HA LYS 5 HA LYS 5 -5.291 23.194 -9.094 29 HB2 LYS 5 HB2 LYS 5 -3.770 21.510 -7.964 30 HB3 LYS 5 HB1 LYS 5 -2.984 22.661 -9.037 31 HG2 LYS 5 HG2 LYS 5 -2.107 23.898 -7.230 32 HG3 LYS 5 HG1 LYS 5 -3.143 23.070 -6.066 33 HD2 LYS 5 HD2 LYS 5 -0.881 22.216 -5.910 34 HD3 LYS 5 HD1 LYS 5 -1.952 20.965 -6.543 35 HE2 LYS 5 HE2 LYS 5 0.278 21.194 -7.701 36 HE3 LYS 5 HE1 LYS 5 -1.142 21.252 -8.745 37 HZ1 LYS 5 HZ1 LYS 5 0.815 23.025 -8.875 38 HZ2 LYS 5 HZ2 LYS 5 -0.166 23.803 -7.739 39 HZ3 LYS 5 HZ3 LYS 5 -0.788 23.406 -9.260 40 H LYS 6 HN LYS 6 -7.138 22.428 -8.331 41 HA LYS 6 HA LYS 6 -7.769 22.664 -5.509 42 HB2 LYS 6 HB2 LYS 6 -9.294 23.097 -7.636 43 HB3 LYS 6 HB1 LYS 6 -9.615 21.377 -7.465 44 HG2 LYS 6 HG2 LYS 6 -11.180 21.898 -5.986 45 HG3 LYS 6 HG1 LYS 6 -9.894 22.418 -4.896 46 HD2 LYS 6 HD2 LYS 6 -10.958 24.268 -6.997 47 HD3 LYS 6 HD1 LYS 6 -11.802 24.071 -5.460 48 HE2 LYS 6 HE2 LYS 6 -10.417 25.570 -4.578 49 HE3 LYS 6 HE1 LYS 6 -9.104 24.415 -4.800 50 HZ1 LYS 6 HZ1 LYS 6 -9.275 25.456 -7.244 51 HZ2 LYS 6 HZ2 LYS 6 -8.257 26.069 -6.041 52 HZ3 LYS 6 HZ3 LYS 6 -9.758 26.794 -6.327 53 H LEU 7 HN LEU 7 -8.963 20.759 -4.495 54 HA LEU 7 HA LEU 7 -7.244 18.602 -4.201 55 HB2 LEU 7 HB2 LEU 7 -10.161 18.954 -3.578 56 HB3 LEU 7 HB1 LEU 7 -9.331 17.448 -3.232 57 HG LEU 7 HG LEU 7 -8.123 19.959 -2.188 58 HD11 LEU 7 HD11 LEU 7 -10.733 19.792 -1.791 59 HD12 LEU 7 HD12 LEU 7 -9.631 20.332 -0.525 60 HD13 LEU 7 HD13 LEU 7 -10.220 18.670 -0.530 61 HD21 LEU 7 HD21 LEU 7 -8.478 17.532 -0.553 62 HD22 LEU 7 HD22 LEU 7 -7.067 18.572 -0.756 63 HD23 LEU 7 HD23 LEU 7 -7.455 17.362 -1.980 64 H HIS 8 HN HIS 8 -8.163 16.234 -4.467 65 HA HIS 8 HA HIS 8 -9.638 15.718 -6.861 66 HB2 HIS 8 HB2 HIS 8 -7.646 14.465 -7.924 67 HB3 HIS 8 HB1 HIS 8 -7.707 16.217 -8.091 68 HD1 HIS 8 HD1 HIS 8 -5.854 17.572 -6.984 69 HD2 HIS 8 HD2 HIS 8 -5.627 13.503 -6.179 70 HE1 HIS 8 HE1 HIS 8 -3.607 17.224 -5.912 71 HE2 HIS 8 HE2 HIS 8 -3.454 14.740 -5.520 72 H LYS 9 HN LYS 9 -7.353 14.467 -4.467 73 HA LYS 9 HA LYS 9 -8.255 11.766 -4.721 74 HB2 LYS 9 HB2 LYS 9 -6.787 11.300 -2.848 75 HB3 LYS 9 HB1 LYS 9 -5.959 12.336 -4.001 76 HG2 LYS 9 HG2 LYS 9 -7.390 13.652 -1.764 77 HG3 LYS 9 HG1 LYS 9 -5.901 12.782 -1.392 78 HD2 LYS 9 HD2 LYS 9 -5.190 14.193 -3.621 79 HD3 LYS 9 HD1 LYS 9 -6.303 15.306 -2.824 80 HE2 LYS 9 HE2 LYS 9 -4.065 15.748 -2.057 81 HE3 LYS 9 HE1 LYS 9 -5.002 15.049 -0.736 82 HZ1 LYS 9 HZ1 LYS 9 -2.714 13.970 -2.158 83 HZ2 LYS 9 HZ2 LYS 9 -3.939 12.858 -1.809 84 HZ3 LYS 9 HZ3 LYS 9 -3.208 13.729 -0.558 85 H GLU 10 HN GLU 10 -9.146 10.563 -2.888 86 HA GLU 10 HA GLU 10 -11.013 12.190 -1.293 87 HB2 GLU 10 HB2 GLU 10 -11.975 10.813 -3.260 88 HB3 GLU 10 HB1 GLU 10 -11.677 9.415 -2.237 89 HG2 GLU 10 HG2 GLU 10 -13.974 10.166 -2.044 90 HG3 GLU 10 HG1 GLU 10 -13.117 10.355 -0.514 91 HA PRO 11 HA PRO 11 -9.107 9.980 2.076 92 HB2 PRO 11 HB2 PRO 11 -10.577 10.974 4.090 93 HB3 PRO 11 HB1 PRO 11 -9.401 11.968 3.222 94 HG2 PRO 11 HG2 PRO 11 -12.374 11.844 2.906 95 HG3 PRO 11 HG1 PRO 11 -11.310 13.262 2.934 96 HD2 PRO 11 HD2 PRO 11 -12.279 12.127 0.636 97 HD3 PRO 11 HD1 PRO 11 -10.761 13.042 0.722 98 H ALA 12 HN ALA 12 -9.798 8.572 3.926 99 HA ALA 12 HA ALA 12 -12.418 7.453 3.929 100 HB1 ALA 12 HB1 ALA 12 -11.850 5.213 3.174 101 HB2 ALA 12 HB2 ALA 12 -10.197 5.730 2.839 102 HB3 ALA 12 HB3 ALA 12 -11.536 6.392 1.901 103 H THR 13 HN THR 13 -12.420 5.376 5.334 104 HA THR 13 HA THR 13 -10.388 5.628 7.452 105 HB THR 13 HB THR 13 -13.126 4.805 8.242 106 HG1 THR 13 HG1 THR 13 -13.678 6.547 6.995 107 HG21 THR 13 HG21 THR 13 -11.100 6.657 9.474 108 HG22 THR 13 HG22 THR 13 -11.421 4.986 9.939 109 HG23 THR 13 HG23 THR 13 -12.655 6.221 10.183 110 H LEU 14 HN LEU 14 -9.832 3.719 8.548 111 HA LEU 14 HA LEU 14 -10.101 1.338 6.969 112 HB2 LEU 14 HB2 LEU 14 -8.264 2.301 8.831 113 HB3 LEU 14 HB1 LEU 14 -9.002 0.922 9.625 114 HG LEU 14 HG LEU 14 -6.907 0.407 8.356 115 HD11 LEU 14 HD11 LEU 14 -8.084 -1.503 8.776 116 HD12 LEU 14 HD12 LEU 14 -8.109 -1.511 7.013 117 HD13 LEU 14 HD13 LEU 14 -9.517 -0.946 7.913 118 HD21 LEU 14 HD21 LEU 14 -8.157 1.891 6.342 119 HD22 LEU 14 HD22 LEU 14 -8.160 0.223 5.770 120 HD23 LEU 14 HD23 LEU 14 -6.643 0.994 6.231 121 H ILE 15 HN ILE 15 -11.956 0.237 7.010 122 HA ILE 15 HA ILE 15 -13.749 0.241 9.217 123 HB ILE 15 HB ILE 15 -13.672 -1.732 6.933 124 HG12 ILE 15 HG12 ILE 15 -13.712 0.611 6.130 125 HG13 ILE 15 HG11 ILE 15 -15.208 -0.244 5.763 126 HG21 ILE 15 HG21 ILE 15 -16.234 -0.912 8.104 127 HG22 ILE 15 HG22 ILE 15 -15.184 -1.829 9.183 128 HG23 ILE 15 HG23 ILE 15 -15.660 -2.510 7.628 129 HD11 ILE 15 HD11 ILE 15 -14.708 1.973 7.676 130 HD12 ILE 15 HD12 ILE 15 -16.004 0.827 8.014 131 HD13 ILE 15 HD13 ILE 15 -16.015 1.754 6.513 132 H LYS 16 HN LYS 16 -11.341 -2.031 7.991 133 HA LYS 16 HA LYS 16 -10.840 -3.109 10.559 134 HB2 LYS 16 HB2 LYS 16 -13.039 -4.260 9.290 135 HB3 LYS 16 HB1 LYS 16 -11.727 -5.390 8.987 136 HG2 LYS 16 HG2 LYS 16 -12.146 -4.359 11.751 137 HG3 LYS 16 HG1 LYS 16 -13.214 -5.615 11.119 138 HD2 LYS 16 HD2 LYS 16 -10.975 -6.775 10.441 139 HD3 LYS 16 HD1 LYS 16 -10.278 -5.716 11.668 140 HE2 LYS 16 HE2 LYS 16 -12.381 -6.674 13.035 141 HE3 LYS 16 HE1 LYS 16 -12.083 -8.038 11.958 142 HZ1 LYS 16 HZ1 LYS 16 -10.117 -6.795 13.805 143 HZ2 LYS 16 HZ2 LYS 16 -9.763 -8.040 12.717 144 HZ3 LYS 16 HZ3 LYS 16 -10.849 -8.309 13.987 145 H ALA 17 HN ALA 17 -8.792 -3.772 10.574 146 HA ALA 17 HA ALA 17 -7.322 -3.892 8.123 147 HB1 ALA 17 HB1 ALA 17 -5.423 -3.745 9.395 148 HB2 ALA 17 HB2 ALA 17 -6.111 -4.681 10.722 149 HB3 ALA 17 HB3 ALA 17 -6.600 -3.004 10.481 150 H ILE 18 HN ILE 18 -6.730 -5.639 6.997 151 HA ILE 18 HA ILE 18 -7.518 -8.265 8.018 152 HB ILE 18 HB ILE 18 -6.407 -7.871 5.271 153 HG12 ILE 18 HG12 ILE 18 -8.392 -6.200 6.068 154 HG13 ILE 18 HG11 ILE 18 -8.198 -6.773 4.422 155 HG21 ILE 18 HG21 ILE 18 -8.292 -9.601 4.874 156 HG22 ILE 18 HG22 ILE 18 -8.260 -9.776 6.629 157 HG23 ILE 18 HG23 ILE 18 -6.807 -10.102 5.682 158 HD11 ILE 18 HD11 ILE 18 -9.965 -8.243 4.591 159 HD12 ILE 18 HD12 ILE 18 -10.513 -6.886 5.575 160 HD13 ILE 18 HD13 ILE 18 -9.860 -8.330 6.349 161 H ASP 19 HN ASP 19 -4.804 -7.182 5.971 162 HA ASP 19 HA ASP 19 -2.909 -8.323 7.864 163 HB2 ASP 19 HB2 ASP 19 -3.441 -9.479 5.147 164 HB3 ASP 19 HB1 ASP 19 -1.824 -9.571 5.838 165 H GLY 20 HN GLY 20 -1.965 -8.004 4.536 166 HA2 GLY 20 HA2 GLY 20 -0.743 -5.385 5.162 167 HA3 GLY 20 HA1 GLY 20 0.126 -6.649 4.297 168 H ASP 21 HN ASP 21 -0.705 -7.304 2.198 169 HA ASP 21 HA ASP 21 -1.362 -5.087 0.569 170 HB2 ASP 21 HB2 ASP 21 -1.573 -6.788 -1.242 171 HB3 ASP 21 HB1 ASP 21 -0.064 -6.912 -0.343 172 H THR 22 HN THR 22 -3.286 -6.935 2.592 173 HA THR 22 HA THR 22 -5.698 -6.203 1.075 174 HB THR 22 HB THR 22 -6.375 -8.314 2.816 175 HG1 THR 22 HG1 THR 22 -4.199 -8.902 2.921 176 HG21 THR 22 HG21 THR 22 -7.332 -9.197 1.005 177 HG22 THR 22 HG22 THR 22 -5.857 -9.087 0.044 178 HG23 THR 22 HG23 THR 22 -6.893 -7.673 0.236 179 H VAL 23 HN VAL 23 -6.997 -4.841 2.118 180 HA VAL 23 HA VAL 23 -7.288 -4.936 4.994 181 HB VAL 23 HB VAL 23 -6.749 -2.563 5.346 182 HG11 VAL 23 HG11 VAL 23 -4.428 -2.834 5.532 183 HG12 VAL 23 HG12 VAL 23 -4.349 -3.891 4.123 184 HG13 VAL 23 HG13 VAL 23 -5.076 -4.471 5.622 185 HG21 VAL 23 HG21 VAL 23 -7.079 -1.627 3.184 186 HG22 VAL 23 HG22 VAL 23 -5.865 -2.687 2.469 187 HG23 VAL 23 HG23 VAL 23 -5.375 -1.412 3.583 188 H LYS 24 HN LYS 24 -9.185 -3.961 5.723 189 HA LYS 24 HA LYS 24 -11.119 -3.390 3.634 190 HB2 LYS 24 HB2 LYS 24 -11.622 -4.875 5.622 191 HB3 LYS 24 HB1 LYS 24 -11.597 -3.425 6.613 192 HG2 LYS 24 HG2 LYS 24 -13.864 -3.906 6.108 193 HG3 LYS 24 HG1 LYS 24 -13.398 -2.490 5.164 194 HD2 LYS 24 HD2 LYS 24 -14.668 -3.944 3.749 195 HD3 LYS 24 HD1 LYS 24 -12.983 -4.003 3.226 196 HE2 LYS 24 HE2 LYS 24 -13.132 -6.022 5.094 197 HE3 LYS 24 HE1 LYS 24 -14.697 -6.112 4.287 198 HZ1 LYS 24 HZ1 LYS 24 -13.560 -7.343 2.818 199 HZ2 LYS 24 HZ2 LYS 24 -12.055 -6.718 3.269 200 HZ3 LYS 24 HZ3 LYS 24 -13.043 -5.853 2.204 201 H LEU 25 HN LEU 25 -11.686 -1.395 3.032 202 HA LEU 25 HA LEU 25 -11.101 0.828 4.869 203 HB2 LEU 25 HB2 LEU 25 -10.091 0.331 2.225 204 HB3 LEU 25 HB1 LEU 25 -10.998 1.831 2.246 205 HG LEU 25 HG LEU 25 -9.036 1.448 4.432 206 HD11 LEU 25 HD11 LEU 25 -7.709 0.596 2.643 207 HD12 LEU 25 HD12 LEU 25 -7.205 2.260 2.938 208 HD13 LEU 25 HD13 LEU 25 -8.240 1.882 1.561 209 HD21 LEU 25 HD21 LEU 25 -10.498 3.468 4.063 210 HD22 LEU 25 HD22 LEU 25 -9.526 3.803 2.629 211 HD23 LEU 25 HD23 LEU 25 -8.770 3.788 4.222 212 H MET 26 HN MET 26 -12.473 2.652 4.746 213 HA MET 26 HA MET 26 -15.194 1.971 4.058 214 HB2 MET 26 HB2 MET 26 -14.392 3.254 6.147 215 HB3 MET 26 HB1 MET 26 -14.271 4.646 5.079 216 HG2 MET 26 HG2 MET 26 -16.523 4.849 4.851 217 HG3 MET 26 HG1 MET 26 -16.817 3.128 5.085 218 HE1 MET 26 HE1 MET 26 -19.000 4.569 7.632 219 HE2 MET 26 HE2 MET 26 -18.510 2.877 7.737 220 HE3 MET 26 HE3 MET 26 -18.743 3.632 6.161 221 H TYR 27 HN TYR 27 -15.961 2.263 2.088 222 HA TYR 27 HA TYR 27 -15.164 4.667 0.592 223 HB2 TYR 27 HB2 TYR 27 -14.017 2.689 -0.342 224 HB3 TYR 27 HB1 TYR 27 -15.577 1.910 -0.580 225 HD1 TYR 27 HD1 TYR 27 -14.655 5.448 -1.238 226 HD2 TYR 27 HD2 TYR 27 -15.715 1.682 -2.905 227 HE1 TYR 27 HE1 TYR 27 -14.828 6.488 -3.460 228 HE2 TYR 27 HE2 TYR 27 -15.891 2.709 -5.132 229 HH TYR 27 HH TYR 27 -14.649 5.102 -6.158 230 H LYS 28 HN LYS 28 -16.863 5.914 0.218 231 HA LYS 28 HA LYS 28 -18.987 6.623 -0.160 232 HB2 LYS 28 HB2 LYS 28 -19.179 3.862 -1.364 233 HB3 LYS 28 HB1 LYS 28 -20.436 5.083 -1.506 234 HG2 LYS 28 HG2 LYS 28 -18.990 6.528 -2.748 235 HG3 LYS 28 HG1 LYS 28 -17.612 5.464 -2.464 236 HD2 LYS 28 HD2 LYS 28 -18.377 3.860 -3.945 237 HD3 LYS 28 HD1 LYS 28 -20.053 4.398 -3.820 238 HE2 LYS 28 HE2 LYS 28 -19.557 6.380 -5.103 239 HE3 LYS 28 HE1 LYS 28 -17.841 5.976 -5.127 240 HZ1 LYS 28 HZ1 LYS 28 -18.297 4.066 -6.469 241 HZ2 LYS 28 HZ2 LYS 28 -19.023 5.407 -7.201 242 HZ3 LYS 28 HZ3 LYS 28 -19.968 4.299 -6.342 243 H GLY 29 HN GLY 29 -18.553 5.846 2.409 244 HA2 GLY 29 HA2 GLY 29 -19.662 5.289 4.339 245 HA3 GLY 29 HA1 GLY 29 -21.141 5.409 3.397 246 H GLN 30 HN GLN 30 -18.805 3.165 2.270 247 HA GLN 30 HA GLN 30 -20.138 0.942 3.643 248 HB2 GLN 30 HB2 GLN 30 -20.903 -0.039 1.753 249 HB3 GLN 30 HB1 GLN 30 -20.805 1.583 1.087 250 HG2 GLN 30 HG2 GLN 30 -18.354 0.832 0.491 251 HG3 GLN 30 HG1 GLN 30 -19.066 -0.777 0.606 252 HE21 GLN 30 HE21 GLN 30 -21.309 -0.844 -0.540 253 HE22 GLN 30 HE22 GLN 30 -21.319 -0.199 -2.142 254 HA PRO 31 HA PRO 31 -16.028 -0.594 3.974 255 HB2 PRO 31 HB2 PRO 31 -16.465 -3.115 4.649 256 HB3 PRO 31 HB1 PRO 31 -17.077 -1.798 5.664 257 HG2 PRO 31 HG2 PRO 31 -18.548 -3.457 3.647 258 HG3 PRO 31 HG1 PRO 31 -19.045 -2.992 5.286 259 HD2 PRO 31 HD2 PRO 31 -19.826 -1.680 2.985 260 HD3 PRO 31 HD1 PRO 31 -19.792 -0.942 4.599 261 H MET 32 HN MET 32 -14.678 -0.824 2.320 262 HA MET 32 HA MET 32 -15.225 -2.917 0.325 263 HB2 MET 32 HB2 MET 32 -15.406 -0.451 -0.399 264 HB3 MET 32 HB1 MET 32 -13.655 -0.429 -0.277 265 HG2 MET 32 HG2 MET 32 -14.335 -2.717 -1.763 266 HG3 MET 32 HG1 MET 32 -15.294 -1.384 -2.394 267 HE1 MET 32 HE1 MET 32 -14.346 0.429 -4.017 268 HE2 MET 32 HE2 MET 32 -14.360 -1.209 -4.669 269 HE3 MET 32 HE3 MET 32 -12.975 -0.156 -4.958 270 H THR 33 HN THR 33 -13.444 -4.027 -0.532 271 HA THR 33 HA THR 33 -11.228 -4.255 1.329 272 HB THR 33 HB THR 33 -10.967 -5.944 -0.995 273 HG1 THR 33 HG1 THR 33 -13.494 -5.930 0.283 274 HG21 THR 33 HG21 THR 33 -11.873 -7.418 1.235 275 HG22 THR 33 HG22 THR 33 -10.780 -6.165 1.823 276 HG23 THR 33 HG23 THR 33 -10.238 -7.296 0.584 277 H PHE 34 HN PHE 34 -9.537 -2.955 1.091 278 HA PHE 34 HA PHE 34 -8.797 -2.059 -1.602 279 HB2 PHE 34 HB2 PHE 34 -8.443 -0.932 1.136 280 HB3 PHE 34 HB1 PHE 34 -7.224 -0.550 -0.076 281 HD1 PHE 34 HD1 PHE 34 -10.888 -0.461 0.534 282 HD2 PHE 34 HD2 PHE 34 -7.581 1.164 -1.597 283 HE1 PHE 34 HE1 PHE 34 -12.343 1.306 -0.370 284 HE2 PHE 34 HE2 PHE 34 -9.030 2.936 -2.501 285 HZ PHE 34 HZ PHE 34 -11.413 3.008 -1.888 286 H ARG 35 HN ARG 35 -6.590 -2.143 -2.285 287 HA ARG 35 HA ARG 35 -4.983 -4.124 -0.823 288 HB2 ARG 35 HB2 ARG 35 -5.940 -5.200 -2.760 289 HB3 ARG 35 HB1 ARG 35 -5.411 -3.888 -3.802 290 HG2 ARG 35 HG2 ARG 35 -3.255 -5.184 -2.309 291 HG3 ARG 35 HG1 ARG 35 -4.095 -6.234 -3.451 292 HD2 ARG 35 HD2 ARG 35 -3.793 -4.177 -5.057 293 HD3 ARG 35 HD1 ARG 35 -2.478 -3.782 -3.952 294 HE ARG 35 HE ARG 35 -2.542 -5.909 -5.875 295 HH11 ARG 35 HH11 ARG 35 -1.146 -4.835 -2.863 296 HH12 ARG 35 HH12 ARG 35 0.267 -5.821 -3.022 297 HH21 ARG 35 HH21 ARG 35 -0.683 -7.208 -6.087 298 HH22 ARG 35 HH22 ARG 35 0.533 -7.167 -4.853 299 H LEU 36 HN LEU 36 -2.773 -3.836 -0.761 300 HA LEU 36 HA LEU 36 -1.822 -1.179 -1.009 301 HB2 LEU 36 HB2 LEU 36 -0.299 -3.767 -0.638 302 HB3 LEU 36 HB1 LEU 36 0.405 -2.163 -0.491 303 HG LEU 36 HG LEU 36 -1.821 -3.206 1.262 304 HD11 LEU 36 HD11 LEU 36 -0.115 -3.456 2.984 305 HD12 LEU 36 HD12 LEU 36 1.132 -2.982 1.830 306 HD13 LEU 36 HD13 LEU 36 0.237 -4.483 1.593 307 HD21 LEU 36 HD21 LEU 36 -1.466 -0.679 0.851 308 HD22 LEU 36 HD22 LEU 36 -0.022 -0.886 1.841 309 HD23 LEU 36 HD23 LEU 36 -1.611 -1.262 2.509 310 H LEU 37 HN LEU 37 -2.395 -0.756 -3.224 311 HA LEU 37 HA LEU 37 -1.780 -1.952 -5.523 312 HB2 LEU 37 HB2 LEU 37 -2.653 0.467 -4.965 313 HB3 LEU 37 HB1 LEU 37 -0.998 0.915 -5.331 314 HG LEU 37 HG LEU 37 -1.236 -0.139 -7.559 315 HD11 LEU 37 HD11 LEU 37 -4.000 -0.664 -6.540 316 HD12 LEU 37 HD12 LEU 37 -2.876 -1.768 -7.334 317 HD13 LEU 37 HD13 LEU 37 -3.677 -0.504 -8.266 318 HD21 LEU 37 HD21 LEU 37 -2.446 2.275 -6.611 319 HD22 LEU 37 HD22 LEU 37 -3.405 1.617 -7.937 320 HD23 LEU 37 HD23 LEU 37 -1.688 1.946 -8.169 321 H LEU 38 HN LEU 38 -0.115 -2.356 -6.855 322 HA LEU 38 HA LEU 38 2.019 -3.135 -7.219 323 HB2 LEU 38 HB2 LEU 38 3.564 -1.230 -7.692 324 HB3 LEU 38 HB1 LEU 38 2.008 -1.149 -8.497 325 HG LEU 38 HG LEU 38 2.195 0.280 -5.916 326 HD11 LEU 38 HD11 LEU 38 3.921 0.905 -8.252 327 HD12 LEU 38 HD12 LEU 38 4.224 1.123 -6.529 328 HD13 LEU 38 HD13 LEU 38 3.164 2.242 -7.386 329 HD21 LEU 38 HD21 LEU 38 0.296 1.056 -6.758 330 HD22 LEU 38 HD22 LEU 38 0.603 0.267 -8.303 331 HD23 LEU 38 HD23 LEU 38 1.229 1.887 -8.001 332 H VAL 39 HN VAL 39 1.686 -3.783 -4.676 333 HA VAL 39 HA VAL 39 4.231 -2.988 -3.426 334 HB VAL 39 HB VAL 39 1.641 -3.582 -1.981 335 HG11 VAL 39 HG11 VAL 39 3.592 -4.454 -0.781 336 HG12 VAL 39 HG12 VAL 39 2.865 -3.091 0.067 337 HG13 VAL 39 HG13 VAL 39 4.348 -2.864 -0.857 338 HG21 VAL 39 HG21 VAL 39 1.232 -1.403 -2.137 339 HG22 VAL 39 HG22 VAL 39 2.733 -1.158 -3.027 340 HG23 VAL 39 HG23 VAL 39 2.729 -1.074 -1.266 341 H ASP 40 HN ASP 40 5.469 -4.616 -2.579 342 HA ASP 40 HA ASP 40 4.522 -7.348 -3.118 343 HB2 ASP 40 HB2 ASP 40 6.807 -6.098 -3.999 344 HB3 ASP 40 HB1 ASP 40 7.391 -6.994 -2.599 345 H THR 41 HN THR 41 4.751 -8.966 -1.587 346 HA THR 41 HA THR 41 5.008 -8.007 1.160 347 HB THR 41 HB THR 41 4.232 -10.508 1.546 348 HG1 THR 41 HG1 THR 41 4.057 -11.429 -0.344 349 HG21 THR 41 HG21 THR 41 1.823 -9.576 0.722 350 HG22 THR 41 HG22 THR 41 2.726 -8.077 0.948 351 HG23 THR 41 HG23 THR 41 2.567 -9.221 2.282 352 HA PRO 42 HA PRO 42 9.084 -9.556 1.855 353 HB2 PRO 42 HB2 PRO 42 7.967 -10.596 4.414 354 HB3 PRO 42 HB1 PRO 42 9.384 -9.578 4.137 355 HG2 PRO 42 HG2 PRO 42 7.133 -8.532 5.095 356 HG3 PRO 42 HG1 PRO 42 8.119 -7.647 3.916 357 HD2 PRO 42 HD2 PRO 42 5.549 -9.112 3.523 358 HD3 PRO 42 HD1 PRO 42 6.127 -7.619 2.756 359 H GLU 43 HN GLU 43 9.911 -11.333 0.972 360 HA GLU 43 HA GLU 43 8.401 -13.741 0.701 361 HB2 GLU 43 HB2 GLU 43 10.392 -12.636 -0.743 362 HB3 GLU 43 HB1 GLU 43 11.318 -13.802 0.191 363 HG2 GLU 43 HG2 GLU 43 9.836 -15.589 -0.604 364 HG3 GLU 43 HG1 GLU 43 8.958 -14.409 -1.575 365 H THR 44 HN THR 44 7.987 -14.459 2.807 366 HA THR 44 HA THR 44 10.287 -15.214 4.451 367 HB THR 44 HB THR 44 7.354 -15.403 5.151 368 HG1 THR 44 HG1 THR 44 7.408 -13.374 5.727 369 HG21 THR 44 HG21 THR 44 8.422 -16.650 6.760 370 HG22 THR 44 HG22 THR 44 8.402 -15.042 7.486 371 HG23 THR 44 HG23 THR 44 9.874 -15.649 6.725 372 H LYS 45 HN LYS 45 10.463 -17.347 5.339 373 HA LYS 45 HA LYS 45 8.815 -19.492 4.481 374 HB2 LYS 45 HB2 LYS 45 10.478 -20.641 3.046 375 HB3 LYS 45 HB1 LYS 45 9.877 -19.148 2.338 376 HG2 LYS 45 HG2 LYS 45 11.990 -18.092 3.416 377 HG3 LYS 45 HG1 LYS 45 12.573 -19.757 3.463 378 HD2 LYS 45 HD2 LYS 45 11.394 -18.875 0.906 379 HD3 LYS 45 HD1 LYS 45 12.916 -18.105 1.359 380 HE2 LYS 45 HE2 LYS 45 13.786 -20.461 1.793 381 HE3 LYS 45 HE1 LYS 45 12.351 -21.026 0.937 382 HZ1 LYS 45 HZ1 LYS 45 14.469 -20.715 -0.403 383 HZ2 LYS 45 HZ2 LYS 45 14.191 -19.052 -0.267 384 HZ3 LYS 45 HZ3 LYS 45 13.055 -20.038 -1.038 385 H HIS 46 HN HIS 46 8.917 -19.896 6.722 386 HA HIS 46 HA HIS 46 11.475 -20.523 7.929 387 HB2 HIS 46 HB2 HIS 46 9.201 -19.495 8.973 388 HB3 HIS 46 HB1 HIS 46 8.978 -21.195 9.371 389 HD1 HIS 46 HD1 HIS 46 11.801 -18.652 9.696 390 HD2 HIS 46 HD2 HIS 46 10.041 -21.792 11.772 391 HE1 HIS 46 HE1 HIS 46 13.040 -18.791 11.880 392 HE2 HIS 46 HE2 HIS 46 11.896 -20.639 13.157 393 HA PRO 47 HA PRO 47 9.534 -24.910 7.908 394 HB2 PRO 47 HB2 PRO 47 7.166 -24.919 6.254 395 HB3 PRO 47 HB1 PRO 47 7.301 -25.263 7.979 396 HG2 PRO 47 HG2 PRO 47 6.028 -23.064 6.954 397 HG3 PRO 47 HG1 PRO 47 6.741 -23.132 8.575 398 HD2 PRO 47 HD2 PRO 47 7.843 -21.923 6.067 399 HD3 PRO 47 HD1 PRO 47 7.900 -21.311 7.733 400 H LYS 48 HN LYS 48 8.421 -26.423 5.825 401 HA LYS 48 HA LYS 48 9.581 -25.656 3.312 402 HB2 LYS 48 HB2 LYS 48 11.405 -26.709 4.973 403 HB3 LYS 48 HB1 LYS 48 10.742 -28.198 4.314 404 HG2 LYS 48 HG2 LYS 48 11.230 -27.399 2.047 405 HG3 LYS 48 HG1 LYS 48 11.926 -25.928 2.728 406 HD2 LYS 48 HD2 LYS 48 13.557 -27.347 3.964 407 HD3 LYS 48 HD1 LYS 48 12.913 -28.752 3.113 408 HE2 LYS 48 HE2 LYS 48 13.544 -27.760 0.977 409 HE3 LYS 48 HE1 LYS 48 14.156 -26.333 1.811 410 HZ1 LYS 48 HZ1 LYS 48 16.086 -27.451 1.667 411 HZ2 LYS 48 HZ2 LYS 48 15.346 -28.965 1.525 412 HZ3 LYS 48 HZ3 LYS 48 15.520 -28.249 3.047 413 H LYS 49 HN LYS 49 8.865 -26.923 1.601 414 HA LYS 49 HA LYS 49 7.459 -28.304 0.466 415 HB2 LYS 49 HB2 LYS 49 8.215 -29.907 2.850 416 HB3 LYS 49 HB1 LYS 49 6.823 -30.463 1.930 417 HG2 LYS 49 HG2 LYS 49 8.074 -30.928 0.055 418 HG3 LYS 49 HG1 LYS 49 9.361 -29.808 0.508 419 HD2 LYS 49 HD2 LYS 49 8.979 -31.960 2.440 420 HD3 LYS 49 HD1 LYS 49 9.409 -32.542 0.831 421 HE2 LYS 49 HE2 LYS 49 11.498 -31.728 0.960 422 HE3 LYS 49 HE1 LYS 49 10.975 -30.240 1.748 423 HZ1 LYS 49 HZ1 LYS 49 12.118 -31.209 3.439 424 HZ2 LYS 49 HZ2 LYS 49 11.782 -32.789 2.937 425 HZ3 LYS 49 HZ3 LYS 49 10.597 -31.886 3.740 426 H GLY 50 HN GLY 50 6.343 -26.160 1.927 427 HA2 GLY 50 HA2 GLY 50 3.738 -26.217 1.635 428 HA3 GLY 50 HA1 GLY 50 3.865 -27.230 3.066 429 H VAL 51 HN VAL 51 4.806 -24.038 1.819 430 HA VAL 51 HA VAL 51 4.449 -22.981 4.549 431 HB VAL 51 HB VAL 51 6.260 -21.807 2.439 432 HG11 VAL 51 HG11 VAL 51 7.213 -20.731 4.590 433 HG12 VAL 51 HG12 VAL 51 5.654 -21.158 5.296 434 HG13 VAL 51 HG13 VAL 51 5.725 -20.086 3.898 435 HG21 VAL 51 HG21 VAL 51 8.126 -22.721 3.736 436 HG22 VAL 51 HG22 VAL 51 7.092 -24.001 3.101 437 HG23 VAL 51 HG23 VAL 51 6.983 -23.541 4.800 438 H GLU 52 HN GLU 52 2.791 -21.639 4.758 439 HA GLU 52 HA GLU 52 2.169 -19.708 2.695 440 HB2 GLU 52 HB2 GLU 52 0.546 -22.122 3.154 441 HB3 GLU 52 HB1 GLU 52 -0.367 -20.620 3.137 442 HG2 GLU 52 HG2 GLU 52 0.421 -20.093 0.938 443 HG3 GLU 52 HG1 GLU 52 1.521 -21.472 0.956 444 H LYS 53 HN LYS 53 2.975 -18.478 4.579 445 HA LYS 53 HA LYS 53 0.743 -17.816 6.369 446 HB2 LYS 53 HB2 LYS 53 2.479 -19.252 7.518 447 HB3 LYS 53 HB1 LYS 53 3.614 -17.928 7.292 448 HG2 LYS 53 HG2 LYS 53 2.531 -16.562 8.805 449 HG3 LYS 53 HG1 LYS 53 1.005 -17.435 8.655 450 HD2 LYS 53 HD2 LYS 53 3.365 -18.898 9.723 451 HD3 LYS 53 HD1 LYS 53 2.569 -17.722 10.771 452 HE2 LYS 53 HE2 LYS 53 1.493 -19.739 11.252 453 HE3 LYS 53 HE1 LYS 53 0.394 -18.915 10.147 454 HZ1 LYS 53 HZ1 LYS 53 1.013 -21.403 9.786 455 HZ2 LYS 53 HZ2 LYS 53 2.391 -20.762 9.045 456 HZ3 LYS 53 HZ3 LYS 53 0.854 -20.365 8.458 457 H TYR 54 HN TYR 54 0.603 -15.655 6.991 458 HA TYR 54 HA TYR 54 1.698 -13.787 5.132 459 HB2 TYR 54 HB2 TYR 54 0.556 -12.094 6.653 460 HB3 TYR 54 HB1 TYR 54 -0.484 -13.309 5.920 461 HD1 TYR 54 HD1 TYR 54 1.422 -12.628 9.053 462 HD2 TYR 54 HD2 TYR 54 -1.940 -14.523 7.262 463 HE1 TYR 54 HE1 TYR 54 0.594 -13.253 11.283 464 HE2 TYR 54 HE2 TYR 54 -2.777 -15.152 9.487 465 HH TYR 54 HH TYR 54 -2.414 -14.105 11.954 466 H GLY 55 HN GLY 55 2.522 -11.597 6.197 467 HA2 GLY 55 HA2 GLY 55 4.866 -12.371 7.806 468 HA3 GLY 55 HA1 GLY 55 4.793 -10.989 6.725 469 HA PRO 56 HA PRO 56 2.545 -10.282 11.143 470 HB2 PRO 56 HB2 PRO 56 5.148 -10.921 12.454 471 HB3 PRO 56 HB1 PRO 56 3.502 -11.150 13.052 472 HG2 PRO 56 HG2 PRO 56 4.915 -13.219 12.160 473 HG3 PRO 56 HG1 PRO 56 3.180 -13.087 11.815 474 HD2 PRO 56 HD2 PRO 56 5.514 -12.606 10.021 475 HD3 PRO 56 HD1 PRO 56 3.916 -13.277 9.641 476 H GLU 57 HN GLU 57 5.758 -9.674 9.893 477 HA GLU 57 HA GLU 57 6.085 -7.174 11.276 478 HB2 GLU 57 HB2 GLU 57 7.686 -8.882 9.548 479 HB3 GLU 57 HB1 GLU 57 7.867 -7.181 9.140 480 HG2 GLU 57 HG2 GLU 57 9.558 -7.834 10.721 481 HG3 GLU 57 HG1 GLU 57 8.442 -6.696 11.474 482 H ALA 58 HN ALA 58 5.201 -8.185 8.002 483 HA ALA 58 HA ALA 58 4.948 -5.478 7.055 484 HB1 ALA 58 HB1 ALA 58 5.397 -7.820 5.797 485 HB2 ALA 58 HB2 ALA 58 4.781 -6.376 4.995 486 HB3 ALA 58 HB3 ALA 58 3.665 -7.637 5.518 487 H SER 59 HN SER 59 2.723 -8.091 7.947 488 HA SER 59 HA SER 59 0.340 -6.728 7.322 489 HB2 SER 59 HB2 SER 59 0.958 -9.021 9.180 490 HB3 SER 59 HB1 SER 59 -0.678 -8.391 8.987 491 HG SER 59 HG SER 59 0.976 -9.646 7.076 492 H ALA 60 HN ALA 60 2.155 -7.021 10.359 493 HA ALA 60 HA ALA 60 0.360 -5.613 11.990 494 HB1 ALA 60 HB1 ALA 60 2.214 -5.366 13.540 495 HB2 ALA 60 HB2 ALA 60 3.356 -5.807 12.271 496 HB3 ALA 60 HB3 ALA 60 2.191 -6.995 12.861 497 H PHE 61 HN PHE 61 3.380 -4.442 10.484 498 HA PHE 61 HA PHE 61 3.215 -1.801 11.224 499 HB2 PHE 61 HB2 PHE 61 5.164 -2.816 10.103 500 HB3 PHE 61 HB1 PHE 61 4.258 -2.864 8.593 501 HD1 PHE 61 HD1 PHE 61 5.719 -0.614 11.121 502 HD2 PHE 61 HD2 PHE 61 4.095 -0.974 7.208 503 HE1 PHE 61 HE1 PHE 61 6.483 1.669 10.598 504 HE2 PHE 61 HE2 PHE 61 4.852 1.303 6.674 505 HZ PHE 61 HZ PHE 61 6.049 2.630 8.370 506 H THR 62 HN THR 62 2.037 -3.182 8.148 507 HA THR 62 HA THR 62 0.932 -0.897 7.062 508 HB THR 62 HB THR 62 -0.317 -3.639 6.844 509 HG1 THR 62 HG1 THR 62 1.277 -4.234 5.576 510 HG21 THR 62 HG21 THR 62 -0.000 -1.774 4.559 511 HG22 THR 62 HG22 THR 62 -1.292 -1.475 5.722 512 HG23 THR 62 HG23 THR 62 -1.223 -3.010 4.856 513 H LYS 63 HN LYS 63 -0.471 -3.145 9.389 514 HA LYS 63 HA LYS 63 -3.011 -1.819 9.483 515 HB2 LYS 63 HB2 LYS 63 -2.868 -4.187 9.994 516 HB3 LYS 63 HB1 LYS 63 -1.739 -3.870 11.304 517 HG2 LYS 63 HG2 LYS 63 -4.298 -2.457 11.523 518 HG3 LYS 63 HG1 LYS 63 -4.406 -4.216 11.609 519 HD2 LYS 63 HD2 LYS 63 -2.548 -2.530 13.285 520 HD3 LYS 63 HD1 LYS 63 -4.119 -3.128 13.824 521 HE2 LYS 63 HE2 LYS 63 -2.976 -5.416 12.930 522 HE3 LYS 63 HE1 LYS 63 -1.558 -4.540 13.502 523 HZ1 LYS 63 HZ1 LYS 63 -3.852 -4.539 15.283 524 HZ2 LYS 63 HZ2 LYS 63 -2.207 -4.708 15.637 525 HZ3 LYS 63 HZ3 LYS 63 -3.089 -6.036 15.073 526 H LYS 64 HN LYS 64 0.026 -1.561 11.152 527 HA LYS 64 HA LYS 64 -0.819 -0.212 13.464 528 HB2 LYS 64 HB2 LYS 64 1.703 -0.765 12.101 529 HB3 LYS 64 HB1 LYS 64 1.707 0.783 12.935 530 HG2 LYS 64 HG2 LYS 64 0.745 -1.655 14.360 531 HG3 LYS 64 HG1 LYS 64 2.477 -1.373 14.164 532 HD2 LYS 64 HD2 LYS 64 2.339 0.717 15.315 533 HD3 LYS 64 HD1 LYS 64 0.576 0.656 15.326 534 HE2 LYS 64 HE2 LYS 64 1.214 0.017 17.490 535 HE3 LYS 64 HE1 LYS 64 0.819 -1.493 16.670 536 HZ1 LYS 64 HZ1 LYS 64 3.278 -1.652 16.182 537 HZ2 LYS 64 HZ2 LYS 64 2.821 -1.883 17.794 538 HZ3 LYS 64 HZ3 LYS 64 3.498 -0.411 17.310 539 H MET 65 HN MET 65 0.498 1.091 10.421 540 HA MET 65 HA MET 65 0.241 3.795 11.101 541 HB2 MET 65 HB2 MET 65 1.263 2.378 8.971 542 HB3 MET 65 HB1 MET 65 -0.090 3.240 8.251 543 HG2 MET 65 HG2 MET 65 0.804 5.350 9.045 544 HG3 MET 65 HG1 MET 65 2.136 4.506 9.834 545 HE1 MET 65 HE1 MET 65 4.034 5.541 8.933 546 HE2 MET 65 HE2 MET 65 4.714 5.194 7.343 547 HE3 MET 65 HE3 MET 65 4.448 3.883 8.493 548 H VAL 66 HN VAL 66 -1.949 1.727 9.185 549 HA VAL 66 HA VAL 66 -3.848 3.743 8.683 550 HB VAL 66 HB VAL 66 -5.425 1.857 8.211 551 HG11 VAL 66 HG11 VAL 66 -4.052 2.761 6.445 552 HG12 VAL 66 HG12 VAL 66 -4.141 1.008 6.271 553 HG13 VAL 66 HG13 VAL 66 -2.691 1.756 6.941 554 HG21 VAL 66 HG21 VAL 66 -3.323 0.381 9.608 555 HG22 VAL 66 HG22 VAL 66 -3.819 -0.356 8.084 556 HG23 VAL 66 HG23 VAL 66 -5.016 -0.034 9.339 557 H GLU 67 HN GLU 67 -3.550 1.407 11.316 558 HA GLU 67 HA GLU 67 -6.067 2.081 12.476 559 HB2 GLU 67 HB2 GLU 67 -3.700 0.565 13.575 560 HB3 GLU 67 HB1 GLU 67 -5.234 0.742 14.416 561 HG2 GLU 67 HG2 GLU 67 -5.047 -0.438 11.666 562 HG3 GLU 67 HG1 GLU 67 -4.851 -1.409 13.126 563 H ASN 68 HN ASN 68 -2.703 2.967 13.118 564 HA ASN 68 HA ASN 68 -3.312 4.534 15.425 565 HB2 ASN 68 HB2 ASN 68 -0.887 4.236 13.674 566 HB3 ASN 68 HB1 ASN 68 -0.950 5.480 14.918 567 HD21 ASN 68 HD21 ASN 68 -1.776 2.040 14.605 568 HD22 ASN 68 HD22 ASN 68 -1.028 1.553 16.084 569 H ALA 69 HN ALA 69 -3.131 5.151 11.996 570 HA ALA 69 HA ALA 69 -3.069 7.998 12.190 571 HB1 ALA 69 HB1 ALA 69 -3.843 7.799 9.741 572 HB2 ALA 69 HB2 ALA 69 -3.604 6.066 9.965 573 HB3 ALA 69 HB3 ALA 69 -2.251 7.177 10.174 574 H LYS 70 HN LYS 70 -4.676 9.251 12.843 575 HA LYS 70 HA LYS 70 -7.278 8.366 13.374 576 HB2 LYS 70 HB2 LYS 70 -5.976 11.049 13.173 577 HB3 LYS 70 HB1 LYS 70 -7.729 10.961 13.288 578 HG2 LYS 70 HG2 LYS 70 -7.684 10.401 15.455 579 HG3 LYS 70 HG1 LYS 70 -6.300 9.327 15.254 580 HD2 LYS 70 HD2 LYS 70 -5.724 12.195 14.939 581 HD3 LYS 70 HD1 LYS 70 -6.214 11.699 16.559 582 HE2 LYS 70 HE2 LYS 70 -4.195 10.030 15.171 583 HE3 LYS 70 HE1 LYS 70 -3.681 11.619 15.735 584 HZ1 LYS 70 HZ1 LYS 70 -5.177 9.978 17.622 585 HZ2 LYS 70 HZ2 LYS 70 -3.868 11.015 17.889 586 HZ3 LYS 70 HZ3 LYS 70 -3.605 9.467 17.259 587 H LYS 71 HN LYS 71 -5.823 9.538 10.458 588 HA LYS 71 HA LYS 71 -8.410 9.243 9.100 589 HB2 LYS 71 HB2 LYS 71 -7.526 11.696 9.538 590 HB3 LYS 71 HB1 LYS 71 -6.517 11.341 8.143 591 HG2 LYS 71 HG2 LYS 71 -8.781 10.599 7.067 592 HG3 LYS 71 HG1 LYS 71 -9.473 11.638 8.316 593 HD2 LYS 71 HD2 LYS 71 -7.211 12.790 6.825 594 HD3 LYS 71 HD1 LYS 71 -8.673 12.507 5.878 595 HE2 LYS 71 HE2 LYS 71 -9.324 14.506 6.656 596 HE3 LYS 71 HE1 LYS 71 -9.688 13.633 8.144 597 HZ1 LYS 71 HZ1 LYS 71 -8.362 15.577 8.608 598 HZ2 LYS 71 HZ2 LYS 71 -7.160 15.068 7.533 599 HZ3 LYS 71 HZ3 LYS 71 -7.459 14.187 8.945 600 H ILE 72 HN ILE 72 -8.342 8.279 7.121 601 HA ILE 72 HA ILE 72 -5.688 7.451 6.145 602 HB ILE 72 HB ILE 72 -8.182 5.873 5.622 603 HG12 ILE 72 HG12 ILE 72 -8.040 6.050 8.051 604 HG13 ILE 72 HG11 ILE 72 -7.599 4.423 7.540 605 HG21 ILE 72 HG21 ILE 72 -6.790 4.221 4.881 606 HG22 ILE 72 HG22 ILE 72 -5.464 4.714 5.934 607 HG23 ILE 72 HG23 ILE 72 -5.825 5.640 4.477 608 HD11 ILE 72 HD11 ILE 72 -5.575 6.561 8.128 609 HD12 ILE 72 HD12 ILE 72 -5.304 4.830 7.930 610 HD13 ILE 72 HD13 ILE 72 -6.177 5.432 9.340 611 H GLU 73 HN GLU 73 -5.317 7.514 3.940 612 HA GLU 73 HA GLU 73 -7.457 8.703 2.297 613 HB2 GLU 73 HB2 GLU 73 -4.577 9.356 1.785 614 HB3 GLU 73 HB1 GLU 73 -6.017 10.257 1.332 615 HG2 GLU 73 HG2 GLU 73 -6.346 10.964 3.612 616 HG3 GLU 73 HG1 GLU 73 -4.993 9.968 4.147 617 H VAL 74 HN VAL 74 -7.714 7.894 0.257 618 HA VAL 74 HA VAL 74 -5.844 5.771 -0.551 619 HB VAL 74 HB VAL 74 -7.871 4.764 -1.742 620 HG11 VAL 74 HG11 VAL 74 -8.425 4.403 1.098 621 HG12 VAL 74 HG12 VAL 74 -6.714 4.278 0.690 622 HG13 VAL 74 HG13 VAL 74 -7.890 3.239 -0.113 623 HG21 VAL 74 HG21 VAL 74 -9.148 7.005 -0.884 624 HG22 VAL 74 HG22 VAL 74 -9.625 5.837 0.349 625 HG23 VAL 74 HG23 VAL 74 -9.953 5.507 -1.352 626 H GLU 75 HN GLU 75 -5.328 5.581 -2.701 627 HA GLU 75 HA GLU 75 -6.458 7.568 -4.544 628 HB2 GLU 75 HB2 GLU 75 -4.343 8.481 -3.704 629 HB3 GLU 75 HB1 GLU 75 -3.507 7.011 -4.184 630 HG2 GLU 75 HG2 GLU 75 -4.472 7.609 -6.546 631 HG3 GLU 75 HG1 GLU 75 -4.561 9.229 -5.860 632 H PHE 76 HN PHE 76 -7.466 6.304 -5.982 633 HA PHE 76 HA PHE 76 -6.558 3.696 -6.684 634 HB2 PHE 76 HB2 PHE 76 -8.721 5.480 -7.803 635 HB3 PHE 76 HB1 PHE 76 -8.391 3.869 -8.428 636 HD1 PHE 76 HD2 PHE 76 -8.058 2.154 -6.226 637 HD2 PHE 76 HD1 PHE 76 -10.622 5.538 -6.549 638 HE1 PHE 76 HE2 PHE 76 -9.540 1.190 -4.518 639 HE2 PHE 76 HE1 PHE 76 -12.108 4.578 -4.840 640 HZ PHE 76 HZ PHE 76 -11.569 2.402 -3.823 641 H ASP 77 HN ASP 77 -5.732 2.989 -8.619 642 HA ASP 77 HA ASP 77 -3.783 4.566 -9.845 643 HB2 ASP 77 HB2 ASP 77 -3.566 2.747 -11.468 644 HB3 ASP 77 HB1 ASP 77 -3.742 2.104 -9.840 645 H LYS 78 HN LYS 78 -4.045 4.183 -12.582 646 HA LYS 78 HA LYS 78 -6.225 6.055 -13.208 647 HB2 LYS 78 HB2 LYS 78 -4.508 6.118 -15.378 648 HB3 LYS 78 HB1 LYS 78 -4.587 7.305 -14.086 649 HG2 LYS 78 HG2 LYS 78 -2.871 4.890 -13.748 650 HG3 LYS 78 HG1 LYS 78 -2.314 6.223 -14.757 651 HD2 LYS 78 HD2 LYS 78 -3.379 7.237 -12.291 652 HD3 LYS 78 HD1 LYS 78 -2.167 5.998 -11.960 653 HE2 LYS 78 HE2 LYS 78 -0.541 7.433 -12.441 654 HE3 LYS 78 HE1 LYS 78 -1.206 7.675 -14.055 655 HZ1 LYS 78 HZ1 LYS 78 -1.340 9.379 -11.744 656 HZ2 LYS 78 HZ2 LYS 78 -2.843 9.157 -12.490 657 HZ3 LYS 78 HZ3 LYS 78 -1.538 9.759 -13.382 658 H GLY 79 HN GLY 79 -4.880 2.952 -13.898 659 HA2 GLY 79 HA2 GLY 79 -6.560 2.635 -16.279 660 HA3 GLY 79 HA1 GLY 79 -5.312 1.522 -15.739 661 H GLN 80 HN GLN 80 -5.848 -0.166 -14.448 662 HA GLN 80 HA GLN 80 -8.330 -1.253 -14.446 663 HB2 GLN 80 HB2 GLN 80 -5.890 -1.966 -13.430 664 HB3 GLN 80 HB1 GLN 80 -6.865 -1.849 -11.975 665 HG2 GLN 80 HG2 GLN 80 -8.387 -3.458 -12.741 666 HG3 GLN 80 HG1 GLN 80 -7.728 -3.406 -14.376 667 HE21 GLN 80 HE21 GLN 80 -6.393 -4.980 -14.897 668 HE22 GLN 80 HE22 GLN 80 -5.478 -5.948 -13.797 669 H ARG 81 HN ARG 81 -7.111 -0.236 -11.282 670 HA ARG 81 HA ARG 81 -8.017 1.093 -9.651 671 HB2 ARG 81 HB2 ARG 81 -10.469 1.398 -11.381 672 HB3 ARG 81 HB1 ARG 81 -10.049 2.347 -9.966 673 HG2 ARG 81 HG2 ARG 81 -7.869 2.757 -11.520 674 HG3 ARG 81 HG1 ARG 81 -9.132 2.585 -12.741 675 HD2 ARG 81 HD2 ARG 81 -9.962 4.256 -10.512 676 HD3 ARG 81 HD1 ARG 81 -8.522 4.876 -11.317 677 HE ARG 81 HE ARG 81 -10.282 4.249 -13.333 678 HH11 ARG 81 HH11 ARG 81 -10.297 6.352 -10.547 679 HH12 ARG 81 HH12 ARG 81 -11.354 7.515 -11.275 680 HH21 ARG 81 HH21 ARG 81 -11.672 5.778 -14.292 681 HH22 ARG 81 HH22 ARG 81 -12.136 7.189 -13.400 682 H THR 82 HN THR 82 -9.543 -1.625 -11.082 683 HA THR 82 HA THR 82 -10.296 -2.644 -8.521 684 HB THR 82 HB THR 82 -12.734 -3.041 -9.498 685 HG1 THR 82 HG1 THR 82 -11.997 -0.536 -10.602 686 HG21 THR 82 HG21 THR 82 -11.953 -1.720 -7.407 687 HG22 THR 82 HG22 THR 82 -13.569 -1.460 -8.063 688 HG23 THR 82 HG23 THR 82 -12.280 -0.308 -8.410 689 H ASP 83 HN ASP 83 -9.703 -4.695 -8.632 690 HA ASP 83 HA ASP 83 -9.345 -6.024 -11.146 691 HB2 ASP 83 HB2 ASP 83 -8.183 -6.275 -8.688 692 HB3 ASP 83 HB1 ASP 83 -9.256 -7.670 -8.704 693 H LYS 84 HN LYS 84 -10.049 -8.613 -10.694 694 HA LYS 84 HA LYS 84 -12.595 -8.865 -11.629 695 HB2 LYS 84 HB2 LYS 84 -12.437 -11.137 -10.127 696 HB3 LYS 84 HB1 LYS 84 -11.738 -10.941 -11.729 697 HG2 LYS 84 HG2 LYS 84 -10.078 -10.103 -9.425 698 HG3 LYS 84 HG1 LYS 84 -10.358 -11.832 -9.633 699 HD2 LYS 84 HD2 LYS 84 -9.758 -10.958 -12.186 700 HD3 LYS 84 HD1 LYS 84 -8.673 -10.017 -11.160 701 HE2 LYS 84 HE2 LYS 84 -7.453 -11.818 -10.582 702 HE3 LYS 84 HE1 LYS 84 -8.867 -12.865 -10.472 703 HZ1 LYS 84 HZ1 LYS 84 -7.897 -11.977 -13.107 704 HZ2 LYS 84 HZ2 LYS 84 -8.778 -13.364 -12.705 705 HZ3 LYS 84 HZ3 LYS 84 -7.134 -13.268 -12.320 706 H TYR 85 HN TYR 85 -11.759 -9.493 -8.221 707 HA TYR 85 HA TYR 85 -14.446 -9.568 -7.370 708 HB2 TYR 85 HB2 TYR 85 -11.789 -9.676 -6.113 709 HB3 TYR 85 HB1 TYR 85 -13.049 -9.001 -5.086 710 HD1 TYR 85 HD1 TYR 85 -13.603 -11.620 -7.637 711 HD2 TYR 85 HD2 TYR 85 -13.156 -10.762 -3.493 712 HE1 TYR 85 HE1 TYR 85 -14.366 -13.893 -7.090 713 HE2 TYR 85 HE2 TYR 85 -13.919 -13.032 -2.936 714 HH TYR 85 HH TYR 85 -15.181 -14.839 -3.894 715 H GLY 86 HN GLY 86 -12.550 -6.974 -8.301 716 HA2 GLY 86 HA2 GLY 86 -13.222 -4.739 -8.390 717 HA3 GLY 86 HA1 GLY 86 -14.484 -5.095 -7.219 718 H ARG 87 HN ARG 87 -11.253 -6.152 -6.589 719 HA ARG 87 HA ARG 87 -11.037 -5.040 -4.085 720 HB2 ARG 87 HB2 ARG 87 -9.485 -6.690 -5.495 721 HB3 ARG 87 HB1 ARG 87 -8.540 -5.221 -5.691 722 HG2 ARG 87 HG2 ARG 87 -8.099 -5.050 -3.416 723 HG3 ARG 87 HG1 ARG 87 -9.435 -6.119 -2.981 724 HD2 ARG 87 HD2 ARG 87 -7.071 -7.070 -4.576 725 HD3 ARG 87 HD1 ARG 87 -7.075 -7.070 -2.813 726 HE ARG 87 HE ARG 87 -9.358 -8.384 -3.946 727 HH11 ARG 87 HH11 ARG 87 -6.015 -8.784 -3.024 728 HH12 ARG 87 HH12 ARG 87 -6.147 -10.498 -2.817 729 HH21 ARG 87 HH21 ARG 87 -9.532 -10.639 -3.674 730 HH22 ARG 87 HH22 ARG 87 -8.143 -11.553 -3.188 731 H GLY 88 HN GLY 88 -9.684 -3.298 -3.265 732 HA2 GLY 88 HA2 GLY 88 -10.101 -0.877 -4.806 733 HA3 GLY 88 HA1 GLY 88 -9.549 -0.974 -3.142 734 H LEU 89 HN LEU 89 -8.607 -0.980 -6.490 735 HA LEU 89 HA LEU 89 -5.822 -1.422 -6.018 736 HB2 LEU 89 HB2 LEU 89 -7.397 -0.420 -8.374 737 HB3 LEU 89 HB1 LEU 89 -5.646 -0.501 -8.397 738 HG LEU 89 HG LEU 89 -6.884 -2.438 -9.453 739 HD11 LEU 89 HD11 LEU 89 -5.272 -4.039 -8.739 740 HD12 LEU 89 HD12 LEU 89 -5.023 -3.188 -7.214 741 HD13 LEU 89 HD13 LEU 89 -4.494 -2.457 -8.730 742 HD21 LEU 89 HD21 LEU 89 -7.865 -4.102 -8.091 743 HD22 LEU 89 HD22 LEU 89 -8.576 -2.566 -7.594 744 HD23 LEU 89 HD23 LEU 89 -7.316 -3.311 -6.612 745 H ALA 90 HN ALA 90 -5.835 0.232 -4.214 746 HA ALA 90 HA ALA 90 -4.839 2.758 -5.288 747 HB1 ALA 90 HB1 ALA 90 -6.878 3.653 -4.823 748 HB2 ALA 90 HB2 ALA 90 -6.159 3.791 -3.220 749 HB3 ALA 90 HB3 ALA 90 -7.245 2.452 -3.586 750 H TYR 91 HN TYR 91 -3.894 4.109 -3.436 751 HA TYR 91 HA TYR 91 -2.342 2.296 -1.737 752 HB2 TYR 91 HB2 TYR 91 -1.709 5.207 -2.113 753 HB3 TYR 91 HB1 TYR 91 -0.623 3.886 -1.705 754 HD1 TYR 91 HD2 TYR 91 -2.697 5.252 -4.472 755 HD2 TYR 91 HD1 TYR 91 0.611 2.810 -3.383 756 HE1 TYR 91 HE2 TYR 91 -2.076 5.048 -6.841 757 HE2 TYR 91 HE1 TYR 91 1.244 2.603 -5.749 758 HH TYR 91 HH TYR 91 -0.347 4.461 -8.252 759 H ILE 92 HN ILE 92 -2.386 2.421 0.453 760 HA ILE 92 HA ILE 92 -4.495 4.084 1.615 761 HB ILE 92 HB ILE 92 -2.873 1.891 2.911 762 HG12 ILE 92 HG12 ILE 92 -5.397 0.908 2.651 763 HG13 ILE 92 HG11 ILE 92 -5.269 1.870 1.183 764 HG21 ILE 92 HG21 ILE 92 -3.788 3.415 4.542 765 HG22 ILE 92 HG22 ILE 92 -4.695 1.904 4.581 766 HG23 ILE 92 HG23 ILE 92 -5.378 3.320 3.786 767 HD11 ILE 92 HD11 ILE 92 -3.780 -0.566 1.995 768 HD12 ILE 92 HD12 ILE 92 -2.985 0.605 0.944 769 HD13 ILE 92 HD13 ILE 92 -4.501 -0.142 0.443 770 H TYR 93 HN TYR 93 -4.109 5.864 2.746 771 HA TYR 93 HA TYR 93 -1.338 6.462 3.524 772 HB2 TYR 93 HB2 TYR 93 -3.689 8.338 3.199 773 HB3 TYR 93 HB1 TYR 93 -2.059 8.816 3.631 774 HD1 TYR 93 HD2 TYR 93 -2.988 6.359 0.996 775 HD2 TYR 93 HD1 TYR 93 -1.551 10.263 1.864 776 HE1 TYR 93 HE2 TYR 93 -2.487 6.688 -1.376 777 HE2 TYR 93 HE1 TYR 93 -1.033 10.604 -0.514 778 HH TYR 93 HH TYR 93 -0.655 9.398 -2.511 779 H ALA 94 HN ALA 94 -0.987 7.582 5.554 780 HA ALA 94 HA ALA 94 -3.087 7.266 7.563 781 HB1 ALA 94 HB1 ALA 94 -2.131 5.400 8.341 782 HB2 ALA 94 HB2 ALA 94 -0.856 6.454 8.953 783 HB3 ALA 94 HB3 ALA 94 -0.666 5.655 7.394 784 H ASP 95 HN ASP 95 -3.312 9.216 8.433 785 HA ASP 95 HA ASP 95 -2.845 11.207 9.425 786 HB2 ASP 95 HB2 ASP 95 -1.069 9.586 10.553 787 HB3 ASP 95 HB1 ASP 95 0.064 10.598 9.664 788 H GLY 96 HN GLY 96 -2.084 10.489 6.455 789 HA2 GLY 96 HA2 GLY 96 -1.913 12.295 4.851 790 HA3 GLY 96 HA1 GLY 96 -0.813 13.100 5.956 791 H LYS 97 HN LYS 97 -0.240 9.764 5.734 792 HA LYS 97 HA LYS 97 1.787 10.176 3.652 793 HB2 LYS 97 HB2 LYS 97 2.162 9.267 6.456 794 HB3 LYS 97 HB1 LYS 97 3.106 8.452 5.217 795 HG2 LYS 97 HG2 LYS 97 3.878 10.715 4.457 796 HG3 LYS 97 HG1 LYS 97 3.104 11.377 5.898 797 HD2 LYS 97 HD2 LYS 97 5.084 9.134 6.101 798 HD3 LYS 97 HD1 LYS 97 5.621 10.812 5.995 799 HE2 LYS 97 HE2 LYS 97 4.992 11.272 8.099 800 HE3 LYS 97 HE1 LYS 97 3.494 10.354 7.954 801 HZ1 LYS 97 HZ1 LYS 97 4.761 8.317 8.280 802 HZ2 LYS 97 HZ2 LYS 97 4.959 9.369 9.589 803 HZ3 LYS 97 HZ3 LYS 97 6.191 9.208 8.440 804 H MET 98 HN MET 98 1.876 8.599 2.158 805 HA MET 98 HA MET 98 -0.077 6.550 2.144 806 HB2 MET 98 HB2 MET 98 2.313 6.313 0.382 807 HB3 MET 98 HB1 MET 98 0.613 6.046 0.017 808 HG2 MET 98 HG2 MET 98 0.680 7.994 -1.039 809 HG3 MET 98 HG1 MET 98 0.705 8.735 0.559 810 HE1 MET 98 HE1 MET 98 1.515 10.691 -0.003 811 HE2 MET 98 HE2 MET 98 2.415 10.870 -1.509 812 HE3 MET 98 HE3 MET 98 3.237 11.071 0.038 813 H VAL 99 HN VAL 99 -0.039 4.890 3.477 814 HA VAL 99 HA VAL 99 2.122 3.904 4.899 815 HB VAL 99 HB VAL 99 -0.221 2.213 4.037 816 HG11 VAL 99 HG11 VAL 99 1.012 0.750 5.238 817 HG12 VAL 99 HG12 VAL 99 0.263 1.577 6.604 818 HG13 VAL 99 HG13 VAL 99 1.891 2.021 6.087 819 HG21 VAL 99 HG21 VAL 99 -1.064 3.132 6.377 820 HG22 VAL 99 HG22 VAL 99 -1.407 3.978 4.867 821 HG23 VAL 99 HG23 VAL 99 -0.087 4.521 5.901 822 H ASN 100 HN ASN 100 0.794 2.747 1.814 823 HA ASN 100 HA ASN 100 2.268 0.473 1.408 824 HB2 ASN 100 HB2 ASN 100 1.659 2.555 -0.701 825 HB3 ASN 100 HB1 ASN 100 1.992 0.847 -0.980 826 HD21 ASN 100 HD21 ASN 100 -0.088 0.895 -2.073 827 HD22 ASN 100 HD22 ASN 100 -1.530 0.708 -1.146 828 H GLU 101 HN GLU 101 3.244 3.783 0.507 829 HA GLU 101 HA GLU 101 5.773 3.154 -0.493 830 HB2 GLU 101 HB2 GLU 101 4.388 5.407 -0.430 831 HB3 GLU 101 HB1 GLU 101 5.367 5.708 0.999 832 HG2 GLU 101 HG2 GLU 101 7.081 4.794 -1.071 833 HG3 GLU 101 HG1 GLU 101 6.052 6.067 -1.723 834 H ALA 102 HN ALA 102 4.650 3.603 2.793 835 HA ALA 102 HA ALA 102 7.140 3.889 4.061 836 HB1 ALA 102 HB1 ALA 102 4.677 2.599 5.223 837 HB2 ALA 102 HB2 ALA 102 4.926 4.340 5.108 838 HB3 ALA 102 HB3 ALA 102 6.002 3.360 6.102 839 H LEU 103 HN LEU 103 5.106 0.970 3.749 840 HA LEU 103 HA LEU 103 6.922 -0.852 4.811 841 HB2 LEU 103 HB2 LEU 103 4.671 -1.101 2.846 842 HB3 LEU 103 HB1 LEU 103 5.676 -2.490 3.214 843 HG LEU 103 HG LEU 103 5.034 -1.676 5.718 844 HD11 LEU 103 HD11 LEU 103 3.575 0.099 4.983 845 HD12 LEU 103 HD12 LEU 103 2.615 -1.185 5.716 846 HD13 LEU 103 HD13 LEU 103 2.673 -1.021 3.962 847 HD21 LEU 103 HD21 LEU 103 4.752 -3.912 4.353 848 HD22 LEU 103 HD22 LEU 103 3.066 -3.397 4.300 849 HD23 LEU 103 HD23 LEU 103 3.867 -3.637 5.854 850 H VAL 104 HN VAL 104 6.572 0.389 1.541 851 HA VAL 104 HA VAL 104 8.396 -1.350 0.279 852 HB VAL 104 HB VAL 104 7.777 1.488 -0.543 853 HG11 VAL 104 HG11 VAL 104 9.155 -0.787 -1.786 854 HG12 VAL 104 HG12 VAL 104 9.309 0.944 -2.093 855 HG13 VAL 104 HG13 VAL 104 7.983 0.034 -2.818 856 HG21 VAL 104 HG21 VAL 104 6.249 -0.592 -1.876 857 HG22 VAL 104 HG22 VAL 104 5.706 0.922 -1.152 858 HG23 VAL 104 HG23 VAL 104 5.910 -0.513 -0.148 859 H ARG 105 HN ARG 105 8.778 1.842 1.759 860 HA ARG 105 HA ARG 105 11.583 1.991 1.154 861 HB2 ARG 105 HB2 ARG 105 10.460 4.066 1.256 862 HB3 ARG 105 HB1 ARG 105 9.697 3.674 2.790 863 HG2 ARG 105 HG2 ARG 105 12.554 3.626 3.073 864 HG3 ARG 105 HG1 ARG 105 12.035 5.151 2.357 865 HD2 ARG 105 HD2 ARG 105 11.651 5.785 4.474 866 HD3 ARG 105 HD1 ARG 105 10.188 4.813 4.332 867 HE ARG 105 HE ARG 105 11.148 3.191 5.675 868 HH11 ARG 105 HH11 ARG 105 13.500 5.660 4.910 869 HH12 ARG 105 HH12 ARG 105 14.628 5.130 6.111 870 HH21 ARG 105 HH21 ARG 105 12.634 2.496 7.251 871 HH22 ARG 105 HH22 ARG 105 14.137 3.336 7.439 872 H GLN 106 HN GLN 106 9.627 0.883 3.828 873 HA GLN 106 HA GLN 106 11.766 0.834 5.736 874 HB2 GLN 106 HB2 GLN 106 8.937 0.310 5.725 875 HB3 GLN 106 HB1 GLN 106 9.782 -1.003 6.529 876 HG2 GLN 106 HG2 GLN 106 9.796 0.251 8.353 877 HG3 GLN 106 HG1 GLN 106 10.963 1.292 7.541 878 HE21 GLN 106 HE21 GLN 106 9.316 2.410 5.608 879 HE22 GLN 106 HE22 GLN 106 8.161 3.433 6.384 880 H GLY 107 HN GLY 107 11.129 -1.063 3.059 881 HA2 GLY 107 HA2 GLY 107 12.464 -2.856 2.345 882 HA3 GLY 107 HA1 GLY 107 12.999 -3.097 4.003 883 H LEU 108 HN LEU 108 9.680 -2.744 3.983 884 HA LEU 108 HA LEU 108 9.326 -5.624 4.290 885 HB2 LEU 108 HB2 LEU 108 7.134 -3.642 4.733 886 HB3 LEU 108 HB1 LEU 108 7.427 -5.172 5.537 887 HG LEU 108 HG LEU 108 9.363 -2.935 5.957 888 HD11 LEU 108 HD11 LEU 108 7.579 -1.646 6.525 889 HD12 LEU 108 HD12 LEU 108 7.785 -2.520 8.042 890 HD13 LEU 108 HD13 LEU 108 6.549 -3.030 6.892 891 HD21 LEU 108 HD21 LEU 108 9.206 -5.503 6.869 892 HD22 LEU 108 HD22 LEU 108 8.452 -4.601 8.183 893 HD23 LEU 108 HD23 LEU 108 10.087 -4.196 7.659 894 H ALA 109 HN ALA 109 9.390 -3.796 1.698 895 HA ALA 109 HA ALA 109 7.774 -5.478 0.127 896 HB1 ALA 109 HB1 ALA 109 5.968 -4.012 -0.496 897 HB2 ALA 109 HB2 ALA 109 6.599 -2.733 0.543 898 HB3 ALA 109 HB3 ALA 109 5.964 -4.217 1.256 899 H LYS 110 HN LYS 110 7.609 -4.711 -2.144 900 HA LYS 110 HA LYS 110 9.370 -2.541 -2.909 901 HB2 LYS 110 HB2 LYS 110 10.684 -4.021 -4.448 902 HB3 LYS 110 HB1 LYS 110 11.002 -4.285 -2.739 903 HG2 LYS 110 HG2 LYS 110 8.889 -6.012 -3.577 904 HG3 LYS 110 HG1 LYS 110 10.251 -6.174 -4.684 905 HD2 LYS 110 HD2 LYS 110 10.738 -7.732 -3.031 906 HD3 LYS 110 HD1 LYS 110 11.678 -6.323 -2.532 907 HE2 LYS 110 HE2 LYS 110 10.457 -6.019 -0.669 908 HE3 LYS 110 HE1 LYS 110 8.940 -6.396 -1.483 909 HZ1 LYS 110 HZ1 LYS 110 10.814 -8.588 -0.971 910 HZ2 LYS 110 HZ2 LYS 110 9.124 -8.600 -1.003 911 HZ3 LYS 110 HZ3 LYS 110 9.938 -7.972 0.339 912 H VAL 111 HN VAL 111 9.356 -2.262 -5.342 913 HA VAL 111 HA VAL 111 6.715 -2.147 -6.244 914 HB VAL 111 HB VAL 111 7.948 -1.962 -8.602 915 HG11 VAL 111 HG11 VAL 111 7.435 -0.075 -6.414 916 HG12 VAL 111 HG12 VAL 111 6.934 -0.027 -8.105 917 HG13 VAL 111 HG13 VAL 111 8.557 0.494 -7.650 918 HG21 VAL 111 HG21 VAL 111 10.182 -1.379 -8.554 919 HG22 VAL 111 HG22 VAL 111 10.117 -2.673 -7.357 920 HG23 VAL 111 HG23 VAL 111 10.153 -0.988 -6.835 921 H ALA 112 HN ALA 112 5.441 -3.782 -6.747 922 HA ALA 112 HA ALA 112 6.432 -5.866 -8.537 923 HB1 ALA 112 HB1 ALA 112 5.525 -6.294 -5.745 924 HB2 ALA 112 HB2 ALA 112 6.742 -7.155 -6.686 925 HB3 ALA 112 HB3 ALA 112 5.029 -7.473 -6.959 926 H TYR 113 HN TYR 113 4.846 -6.826 -9.810 927 HA TYR 113 HA TYR 113 2.887 -6.997 -10.950 928 HB2 TYR 113 HB2 TYR 113 1.570 -5.873 -8.472 929 HB3 TYR 113 HB1 TYR 113 0.800 -6.804 -9.752 930 HD1 TYR 113 HD1 TYR 113 1.215 -9.222 -9.948 931 HD2 TYR 113 HD2 TYR 113 2.834 -6.950 -6.736 932 HE1 TYR 113 HE1 TYR 113 1.667 -11.300 -8.712 933 HE2 TYR 113 HE2 TYR 113 3.291 -9.021 -5.493 934 HH TYR 113 HH TYR 113 2.031 -12.059 -6.454 935 H VAL 114 HN VAL 114 4.443 -4.695 -11.324 936 HA VAL 114 HA VAL 114 2.603 -2.443 -11.441 937 HB VAL 114 HB VAL 114 4.917 -2.002 -10.769 938 HG11 VAL 114 HG11 VAL 114 6.726 -2.766 -11.839 939 HG12 VAL 114 HG12 VAL 114 6.090 -2.321 -13.423 940 HG13 VAL 114 HG13 VAL 114 5.610 -3.844 -12.677 941 HG21 VAL 114 HG21 VAL 114 5.389 -0.157 -12.330 942 HG22 VAL 114 HG22 VAL 114 3.687 -0.222 -11.871 943 HG23 VAL 114 HG23 VAL 114 4.199 -0.817 -13.451 944 H TYR 115 HN TYR 115 1.157 -2.551 -13.050 945 HA TYR 115 HA TYR 115 2.144 -3.224 -15.744 946 HB2 TYR 115 HB2 TYR 115 -0.360 -3.825 -16.134 947 HB3 TYR 115 HB1 TYR 115 0.677 -4.970 -15.292 948 HD1 TYR 115 HD2 TYR 115 -1.269 -1.954 -14.268 949 HD2 TYR 115 HD1 TYR 115 -0.438 -6.068 -13.602 950 HE1 TYR 115 HE2 TYR 115 -2.834 -1.953 -12.370 951 HE2 TYR 115 HE1 TYR 115 -2.000 -6.083 -11.702 952 HH TYR 115 HH TYR 115 -4.155 -3.490 -11.073 953 H LYS 116 HN LYS 116 1.016 -2.176 -17.525 954 HA LYS 116 HA LYS 116 0.245 0.560 -16.806 955 HB2 LYS 116 HB2 LYS 116 1.182 -0.583 -19.442 956 HB3 LYS 116 HB1 LYS 116 0.765 1.101 -19.167 957 HG2 LYS 116 HG2 LYS 116 3.021 -0.427 -17.891 958 HG3 LYS 116 HG1 LYS 116 3.155 0.837 -19.115 959 HD2 LYS 116 HD2 LYS 116 1.980 1.242 -16.366 960 HD3 LYS 116 HD1 LYS 116 3.651 1.609 -16.798 961 HE2 LYS 116 HE2 LYS 116 1.625 2.769 -18.582 962 HE3 LYS 116 HE1 LYS 116 1.597 3.382 -16.929 963 HZ1 LYS 116 HZ1 LYS 116 3.675 3.639 -18.973 964 HZ2 LYS 116 HZ2 LYS 116 4.167 3.547 -17.358 965 HZ3 LYS 116 HZ3 LYS 116 3.117 4.777 -17.852 966 HA PRO 117 HA PRO 117 -0.434 2.210 -18.121 967 HB2 PRO 117 HB2 PRO 117 -2.454 3.929 -18.330 968 HB3 PRO 117 HB1 PRO 117 -1.876 3.040 -19.745 969 HG2 PRO 117 HG2 PRO 117 -4.300 2.570 -18.071 970 HG3 PRO 117 HG1 PRO 117 -4.095 2.400 -19.822 971 HD2 PRO 117 HD2 PRO 117 -4.007 0.323 -17.943 972 HD3 PRO 117 HD1 PRO 117 -3.433 0.237 -19.620 973 H ASN 118 HN ASN 118 0.248 2.240 -16.017 974 HA ASN 118 HA ASN 118 -1.434 3.567 -14.090 975 HB2 ASN 118 HB2 ASN 118 -0.358 0.834 -13.375 976 HB3 ASN 118 HB1 ASN 118 -1.391 1.867 -12.393 977 HD21 ASN 118 HD21 ASN 118 -1.253 -0.094 -15.298 978 HD22 ASN 118 HD22 ASN 118 -2.951 -0.402 -15.396 979 H ASN 119 HN ASN 119 -0.219 4.856 -12.835 980 HA ASN 119 HA ASN 119 2.338 4.187 -11.851 981 HB2 ASN 119 HB2 ASN 119 3.661 5.872 -13.144 982 HB3 ASN 119 HB1 ASN 119 3.122 4.498 -14.106 983 HD21 ASN 119 HD21 ASN 119 1.347 4.791 -15.535 984 HD22 ASN 119 HD22 ASN 119 0.974 6.358 -16.160 985 H THR 120 HN THR 120 -0.138 5.304 -10.906 986 HA THR 120 HA THR 120 -0.103 8.054 -10.504 987 HB THR 120 HB THR 120 -1.077 6.959 -8.113 988 HG1 THR 120 HG1 THR 120 -2.270 5.196 -8.780 989 HG21 THR 120 HG21 THR 120 -3.303 7.031 -9.599 990 HG22 THR 120 HG22 THR 120 -2.242 8.031 -10.590 991 HG23 THR 120 HG23 THR 120 -2.542 8.463 -8.907 992 H HIS 121 HN HIS 121 1.330 5.485 -8.511 993 HA HIS 121 HA HIS 121 3.081 7.524 -7.305 994 HB2 HIS 121 HB2 HIS 121 1.458 5.402 -6.032 995 HB3 HIS 121 HB1 HIS 121 3.088 5.609 -5.402 996 HD1 HIS 121 HD1 HIS 121 0.906 8.448 -6.588 997 HD2 HIS 121 HD2 HIS 121 2.403 6.861 -3.052 998 HE1 HIS 121 HE1 HIS 121 0.343 10.130 -4.805 999 HE2 HIS 121 HE2 HIS 121 1.343 9.193 -2.691 1000 H GLU 122 HN GLU 122 3.076 5.078 -9.433 1001 HA GLU 122 HA GLU 122 4.993 3.245 -8.754 1002 HB2 GLU 122 HB2 GLU 122 3.765 3.197 -10.874 1003 HB3 GLU 122 HB1 GLU 122 4.654 4.607 -11.433 1004 HG2 GLU 122 HG2 GLU 122 6.751 3.167 -11.076 1005 HG3 GLU 122 HG1 GLU 122 5.629 1.807 -11.027 1006 H GLN 123 HN GLN 123 5.553 6.461 -10.162 1007 HA GLN 123 HA GLN 123 8.344 6.339 -10.260 1008 HB2 GLN 123 HB2 GLN 123 6.611 8.776 -9.810 1009 HB3 GLN 123 HB1 GLN 123 8.277 8.784 -10.371 1010 HG2 GLN 123 HG2 GLN 123 6.055 7.420 -11.861 1011 HG3 GLN 123 HG1 GLN 123 6.512 9.101 -12.132 1012 HE21 GLN 123 HE21 GLN 123 7.654 5.783 -12.256 1013 HE22 GLN 123 HE22 GLN 123 8.891 6.055 -13.431 1014 H LEU 124 HN LEU 124 6.190 6.766 -7.596 1015 HA LEU 124 HA LEU 124 8.159 7.917 -5.833 1016 HB2 LEU 124 HB2 LEU 124 5.694 8.343 -5.668 1017 HB3 LEU 124 HB1 LEU 124 5.495 6.685 -5.135 1018 HG LEU 124 HG LEU 124 7.050 7.240 -3.211 1019 HD11 LEU 124 HD11 LEU 124 7.628 9.419 -2.713 1020 HD12 LEU 124 HD12 LEU 124 6.374 10.099 -3.750 1021 HD13 LEU 124 HD13 LEU 124 7.814 9.378 -4.466 1022 HD21 LEU 124 HD21 LEU 124 4.389 8.631 -3.471 1023 HD22 LEU 124 HD22 LEU 124 5.263 8.436 -1.953 1024 HD23 LEU 124 HD23 LEU 124 4.696 7.016 -2.832 1025 H LEU 125 HN LEU 125 6.586 4.752 -6.204 1026 HA LEU 125 HA LEU 125 8.073 3.539 -4.083 1027 HB2 LEU 125 HB2 LEU 125 6.373 2.407 -6.298 1028 HB3 LEU 125 HB1 LEU 125 7.166 1.401 -5.101 1029 HG LEU 125 HG LEU 125 5.890 2.956 -3.399 1030 HD11 LEU 125 HD11 LEU 125 3.675 3.589 -4.278 1031 HD12 LEU 125 HD12 LEU 125 4.227 3.180 -5.902 1032 HD13 LEU 125 HD13 LEU 125 4.991 4.500 -5.017 1033 HD21 LEU 125 HD21 LEU 125 3.815 1.333 -4.000 1034 HD22 LEU 125 HD22 LEU 125 5.251 0.815 -3.119 1035 HD23 LEU 125 HD23 LEU 125 5.122 0.515 -4.852 1036 H ARG 126 HN ARG 126 8.508 3.879 -7.540 1037 HA ARG 126 HA ARG 126 10.374 1.884 -8.030 1038 HB2 ARG 126 HB2 ARG 126 9.263 3.759 -9.568 1039 HB3 ARG 126 HB1 ARG 126 10.814 4.541 -9.299 1040 HG2 ARG 126 HG2 ARG 126 11.908 3.112 -10.632 1041 HG3 ARG 126 HG1 ARG 126 10.992 1.718 -10.060 1042 HD2 ARG 126 HD2 ARG 126 9.230 3.396 -11.529 1043 HD3 ARG 126 HD1 ARG 126 10.693 3.166 -12.485 1044 HE ARG 126 HE ARG 126 9.689 0.720 -11.392 1045 HH11 ARG 126 HH11 ARG 126 9.345 2.995 -14.016 1046 HH12 ARG 126 HH12 ARG 126 8.682 1.826 -15.108 1047 HH21 ARG 126 HH21 ARG 126 8.818 -0.819 -12.827 1048 HH22 ARG 126 HH22 ARG 126 8.383 -0.340 -14.434 1049 H LYS 127 HN LYS 127 10.788 5.054 -6.578 1050 HA LYS 127 HA LYS 127 13.660 4.845 -6.457 1051 HB2 LYS 127 HB2 LYS 127 12.028 6.785 -4.845 1052 HB3 LYS 127 HB1 LYS 127 13.650 6.982 -5.491 1053 HG2 LYS 127 HG2 LYS 127 11.206 6.786 -7.225 1054 HG3 LYS 127 HG1 LYS 127 11.847 8.314 -6.621 1055 HD2 LYS 127 HD2 LYS 127 13.849 6.585 -7.882 1056 HD3 LYS 127 HD1 LYS 127 12.569 7.125 -8.972 1057 HE2 LYS 127 HE2 LYS 127 14.199 8.948 -7.209 1058 HE3 LYS 127 HE1 LYS 127 14.541 8.637 -8.911 1059 HZ1 LYS 127 HZ1 LYS 127 13.027 10.648 -8.060 1060 HZ2 LYS 127 HZ2 LYS 127 11.830 9.477 -8.296 1061 HZ3 LYS 127 HZ3 LYS 127 12.839 9.925 -9.577 1062 H SER 128 HN SER 128 11.070 4.964 -4.008 1063 HA SER 128 HA SER 128 12.587 4.439 -1.766 1064 HB2 SER 128 HB2 SER 128 10.394 5.008 -1.281 1065 HB3 SER 128 HB1 SER 128 9.733 3.921 -2.501 1066 HG SER 128 HG SER 128 9.365 2.739 -0.779 1067 H GLU 129 HN GLU 129 11.569 2.254 -4.280 1068 HA GLU 129 HA GLU 129 12.157 -0.133 -2.788 1069 HB2 GLU 129 HB2 GLU 129 10.514 -0.342 -4.513 1070 HB3 GLU 129 HB1 GLU 129 11.582 0.385 -5.706 1071 HG2 GLU 129 HG2 GLU 129 12.424 -2.141 -4.377 1072 HG3 GLU 129 HG1 GLU 129 11.195 -2.203 -5.636 1073 H ALA 130 HN ALA 130 13.638 1.240 -5.732 1074 HA ALA 130 HA ALA 130 15.955 -0.354 -5.586 1075 HB1 ALA 130 HB1 ALA 130 16.502 0.557 -7.568 1076 HB2 ALA 130 HB2 ALA 130 16.153 2.201 -7.034 1077 HB3 ALA 130 HB3 ALA 130 14.836 1.132 -7.515 1078 H GLN 131 HN GLN 131 15.449 3.068 -4.711 1079 HA GLN 131 HA GLN 131 18.068 3.699 -4.054 1080 HB2 GLN 131 HB2 GLN 131 15.561 4.941 -3.843 1081 HB3 GLN 131 HB1 GLN 131 16.239 4.984 -2.224 1082 HG2 GLN 131 HG2 GLN 131 18.316 5.710 -3.917 1083 HG3 GLN 131 HG1 GLN 131 16.895 6.524 -4.559 1084 HE21 GLN 131 HE21 GLN 131 17.953 8.495 -3.935 1085 HE22 GLN 131 HE22 GLN 131 17.869 9.040 -2.299 1086 H ALA 132 HN ALA 132 15.488 2.556 -1.903 1087 HA ALA 132 HA ALA 132 17.131 2.344 0.390 1088 HB1 ALA 132 HB1 ALA 132 14.752 2.477 0.651 1089 HB2 ALA 132 HB2 ALA 132 15.292 0.922 1.287 1090 HB3 ALA 132 HB3 ALA 132 14.518 1.008 -0.296 1091 H LYS 133 HN LYS 133 16.672 0.332 -2.371 1092 HA LYS 133 HA LYS 133 17.473 -2.149 -1.274 1093 HB2 LYS 133 HB2 LYS 133 16.537 -1.249 -3.724 1094 HB3 LYS 133 HB1 LYS 133 18.182 -1.756 -4.078 1095 HG2 LYS 133 HG2 LYS 133 17.425 -3.827 -4.247 1096 HG3 LYS 133 HG1 LYS 133 17.148 -3.801 -2.504 1097 HD2 LYS 133 HD2 LYS 133 14.929 -2.535 -3.357 1098 HD3 LYS 133 HD1 LYS 133 15.231 -3.588 -4.739 1099 HE2 LYS 133 HE2 LYS 133 15.163 -5.533 -3.366 1100 HE3 LYS 133 HE1 LYS 133 15.150 -4.566 -1.893 1101 HZ1 LYS 133 HZ1 LYS 133 12.949 -4.877 -2.013 1102 HZ2 LYS 133 HZ2 LYS 133 12.972 -5.264 -3.659 1103 HZ3 LYS 133 HZ3 LYS 133 12.982 -3.644 -3.172 1104 H LYS 134 HN LYS 134 19.270 0.250 -3.195 1105 HA LYS 134 HA LYS 134 21.748 -1.030 -3.136 1106 HB2 LYS 134 HB2 LYS 134 21.337 0.758 -4.684 1107 HB3 LYS 134 HB1 LYS 134 21.044 1.895 -3.376 1108 HG2 LYS 134 HG2 LYS 134 23.288 2.065 -2.843 1109 HG3 LYS 134 HG1 LYS 134 23.693 0.534 -3.621 1110 HD2 LYS 134 HD2 LYS 134 22.659 2.856 -5.214 1111 HD3 LYS 134 HD1 LYS 134 24.369 2.726 -4.798 1112 HE2 LYS 134 HE2 LYS 134 24.581 0.665 -5.965 1113 HE3 LYS 134 HE1 LYS 134 22.835 0.528 -6.167 1114 HZ1 LYS 134 HZ1 LYS 134 24.236 2.851 -7.297 1115 HZ2 LYS 134 HZ2 LYS 134 22.812 2.101 -7.817 1116 HZ3 LYS 134 HZ3 LYS 134 24.308 1.370 -8.111 1117 H GLU 135 HN GLU 135 20.284 1.204 -0.834 1118 HA GLU 135 HA GLU 135 22.697 1.108 0.817 1119 HB2 GLU 135 HB2 GLU 135 20.806 2.655 2.171 1120 HB3 GLU 135 HB1 GLU 135 22.165 3.238 1.222 1121 HG2 GLU 135 HG2 GLU 135 20.689 3.251 -0.776 1122 HG3 GLU 135 HG1 GLU 135 19.341 2.817 0.275 1123 H LYS 136 HN LYS 136 19.873 -0.641 0.509 1124 HA LYS 136 HA LYS 136 18.614 -1.941 1.921 1125 HB2 LYS 136 HB2 LYS 136 21.320 -2.393 3.187 1126 HB3 LYS 136 HB1 LYS 136 19.947 -3.492 3.220 1127 HG2 LYS 136 HG2 LYS 136 20.120 -3.496 0.672 1128 HG3 LYS 136 HG1 LYS 136 21.710 -2.769 0.909 1129 HD2 LYS 136 HD2 LYS 136 22.292 -4.982 0.870 1130 HD3 LYS 136 HD1 LYS 136 21.983 -4.787 2.597 1131 HE2 LYS 136 HE2 LYS 136 20.176 -6.120 2.546 1132 HE3 LYS 136 HE1 LYS 136 19.609 -5.459 1.012 1133 HZ1 LYS 136 HZ1 LYS 136 20.159 -7.721 0.656 1134 HZ2 LYS 136 HZ2 LYS 136 21.660 -7.563 1.421 1135 HZ3 LYS 136 HZ3 LYS 136 21.388 -6.812 -0.070 1136 H LEU 137 HN LEU 137 17.751 0.168 2.733 1137 HA LEU 137 HA LEU 137 18.435 1.621 4.866 1138 HB2 LEU 137 HB2 LEU 137 15.812 0.734 3.814 1139 HB3 LEU 137 HB1 LEU 137 15.812 1.469 5.407 1140 HG LEU 137 HG LEU 137 16.854 2.733 2.871 1141 HD11 LEU 137 HD11 LEU 137 14.628 3.030 2.609 1142 HD12 LEU 137 HD12 LEU 137 14.922 4.367 3.720 1143 HD13 LEU 137 HD13 LEU 137 14.286 2.839 4.328 1144 HD21 LEU 137 HD21 LEU 137 18.173 3.803 4.365 1145 HD22 LEU 137 HD22 LEU 137 17.112 3.443 5.728 1146 HD23 LEU 137 HD23 LEU 137 16.708 4.753 4.618 1147 H ASN 138 HN ASN 138 15.829 -0.598 5.740 1148 HA ASN 138 HA ASN 138 17.355 -1.229 8.168 1149 HB2 ASN 138 HB2 ASN 138 14.933 -1.869 8.991 1150 HB3 ASN 138 HB1 ASN 138 15.485 -0.199 9.002 1151 HD21 ASN 138 HD21 ASN 138 12.822 -0.846 9.045 1152 HD22 ASN 138 HD22 ASN 138 12.087 -0.371 7.556 1153 H ILE 139 HN ILE 139 14.483 -2.946 7.008 1154 HA ILE 139 HA ILE 139 15.959 -5.436 7.274 1155 HB ILE 139 HB ILE 139 13.797 -6.549 7.096 1156 HG12 ILE 139 HG12 ILE 139 12.181 -4.107 7.229 1157 HG13 ILE 139 HG11 ILE 139 13.002 -4.315 5.685 1158 HG21 ILE 139 HG21 ILE 139 12.697 -5.071 9.055 1159 HG22 ILE 139 HG22 ILE 139 14.339 -4.431 9.070 1160 HG23 ILE 139 HG23 ILE 139 14.064 -6.158 9.300 1161 HD11 ILE 139 HD11 ILE 139 12.003 -6.528 5.455 1162 HD12 ILE 139 HD12 ILE 139 10.776 -5.275 5.637 1163 HD13 ILE 139 HD13 ILE 139 11.181 -6.317 7.001 1164 H TRP 140 HN TRP 140 17.136 -4.525 5.225 1165 HA TRP 140 HA TRP 140 15.760 -5.557 2.834 1166 HB2 TRP 140 HB2 TRP 140 18.000 -3.531 3.022 1167 HB3 TRP 140 HB1 TRP 140 17.302 -4.134 1.521 1168 HD1 TRP 140 HD1 TRP 140 16.193 -2.184 4.671 1169 HE1 TRP 140 HE1 TRP 140 14.315 -0.565 3.983 1170 HE3 TRP 140 HE3 TRP 140 15.685 -3.575 -0.216 1171 HZ2 TRP 140 HZ2 TRP 140 12.822 0.043 1.676 1172 HZ3 TRP 140 HZ3 TRP 140 14.001 -2.427 -1.600 1173 HH2 TRP 140 HH2 TRP 140 12.598 -0.656 -0.672 Start of MODEL 4 1 H1 ALA 1 HT1 ALA 1 -21.513 14.711 -23.178 2 H2 ALA 1 HT2 ALA 1 -22.812 14.997 -22.092 3 H3 ALA 1 HT3 ALA 1 -22.603 13.445 -22.794 4 HA ALA 1 HA ALA 1 -21.792 13.168 -20.715 5 HB1 ALA 1 HB1 ALA 1 -20.221 12.528 -22.574 6 HB2 ALA 1 HB2 ALA 1 -19.471 12.769 -20.997 7 HB3 ALA 1 HB3 ALA 1 -19.337 14.016 -22.236 8 H THR 2 HN THR 2 -21.644 14.146 -18.814 9 HA THR 2 HA THR 2 -20.441 16.834 -18.703 10 HB THR 2 HB THR 2 -22.098 17.095 -16.691 11 HG1 THR 2 HG1 THR 2 -23.227 15.320 -16.514 12 HG21 THR 2 HG21 THR 2 -23.799 18.052 -18.086 13 HG22 THR 2 HG22 THR 2 -23.196 17.169 -19.488 14 HG23 THR 2 HG23 THR 2 -22.211 18.434 -18.752 15 H SER 3 HN SER 3 -21.471 14.176 -16.553 16 HA SER 3 HA SER 3 -20.468 13.193 -14.763 17 HB2 SER 3 HB2 SER 3 -18.591 13.175 -16.707 18 HB3 SER 3 HB1 SER 3 -17.747 14.123 -15.484 19 HG SER 3 HG SER 3 -18.030 11.510 -15.574 20 H THR 4 HN THR 4 -19.279 13.621 -12.747 21 HA THR 4 HA THR 4 -18.444 16.294 -12.147 22 HB THR 4 HB THR 4 -20.760 16.794 -12.009 23 HG1 THR 4 HG1 THR 4 -19.431 17.370 -10.144 24 HG21 THR 4 HG21 THR 4 -21.077 14.074 -11.279 25 HG22 THR 4 HG22 THR 4 -22.314 15.268 -11.678 26 HG23 THR 4 HG23 THR 4 -21.773 15.081 -10.009 27 H LYS 5 HN LYS 5 -16.579 15.230 -11.448 28 HA LYS 5 HA LYS 5 -16.775 13.275 -9.312 29 HB2 LYS 5 HB2 LYS 5 -14.248 13.326 -9.467 30 HB3 LYS 5 HB1 LYS 5 -15.093 12.797 -10.915 31 HG2 LYS 5 HG2 LYS 5 -14.607 14.749 -12.069 32 HG3 LYS 5 HG1 LYS 5 -14.278 15.655 -10.590 33 HD2 LYS 5 HD2 LYS 5 -12.134 14.979 -10.511 34 HD3 LYS 5 HD1 LYS 5 -12.535 13.332 -11.000 35 HE2 LYS 5 HE2 LYS 5 -12.388 13.824 -13.251 36 HE3 LYS 5 HE1 LYS 5 -12.697 15.542 -13.001 37 HZ1 LYS 5 HZ1 LYS 5 -10.264 14.506 -11.802 38 HZ2 LYS 5 HZ2 LYS 5 -10.534 15.963 -12.616 39 HZ3 LYS 5 HZ3 LYS 5 -10.286 14.539 -13.493 40 H LYS 6 HN LYS 6 -15.263 13.559 -7.401 41 HA LYS 6 HA LYS 6 -15.777 16.188 -6.242 42 HB2 LYS 6 HB2 LYS 6 -16.251 13.841 -5.155 43 HB3 LYS 6 HB1 LYS 6 -14.552 13.925 -4.717 44 HG2 LYS 6 HG2 LYS 6 -15.211 16.286 -3.806 45 HG3 LYS 6 HG1 LYS 6 -16.834 15.593 -3.787 46 HD2 LYS 6 HD2 LYS 6 -14.417 14.367 -2.460 47 HD3 LYS 6 HD1 LYS 6 -15.640 15.333 -1.633 48 HE2 LYS 6 HE2 LYS 6 -17.292 13.714 -1.930 49 HE3 LYS 6 HE1 LYS 6 -16.404 12.913 -3.225 50 HZ1 LYS 6 HZ1 LYS 6 -14.713 12.682 -1.145 51 HZ2 LYS 6 HZ2 LYS 6 -15.816 11.492 -1.623 52 HZ3 LYS 6 HZ3 LYS 6 -16.213 12.557 -0.371 53 H LEU 7 HN LEU 7 -14.160 17.370 -7.343 54 HA LEU 7 HA LEU 7 -12.131 18.366 -7.550 55 HB2 LEU 7 HB2 LEU 7 -11.944 17.032 -4.896 56 HB3 LEU 7 HB1 LEU 7 -10.464 17.652 -5.603 57 HG LEU 7 HG LEU 7 -11.480 19.894 -5.747 58 HD11 LEU 7 HD11 LEU 7 -13.832 19.059 -5.905 59 HD12 LEU 7 HD12 LEU 7 -13.594 20.389 -4.771 60 HD13 LEU 7 HD13 LEU 7 -13.769 18.739 -4.172 61 HD21 LEU 7 HD21 LEU 7 -10.162 19.181 -3.773 62 HD22 LEU 7 HD22 LEU 7 -11.666 18.724 -2.975 63 HD23 LEU 7 HD23 LEU 7 -11.371 20.410 -3.400 64 H HIS 8 HN HIS 8 -10.896 15.405 -6.041 65 HA HIS 8 HA HIS 8 -10.244 14.024 -8.387 66 HB2 HIS 8 HB2 HIS 8 -8.684 16.227 -8.267 67 HB3 HIS 8 HB1 HIS 8 -7.692 15.105 -7.341 68 HD1 HIS 8 HD1 HIS 8 -7.555 16.334 -10.477 69 HD2 HIS 8 HD2 HIS 8 -7.991 12.427 -9.129 70 HE1 HIS 8 HE1 HIS 8 -6.772 14.878 -12.371 71 HE2 HIS 8 HE2 HIS 8 -7.128 12.517 -11.565 72 H LYS 9 HN LYS 9 -9.250 14.814 -5.094 73 HA LYS 9 HA LYS 9 -8.447 12.027 -4.670 74 HB2 LYS 9 HB2 LYS 9 -7.572 12.958 -2.466 75 HB3 LYS 9 HB1 LYS 9 -6.747 13.486 -3.926 76 HG2 LYS 9 HG2 LYS 9 -8.971 15.176 -2.946 77 HG3 LYS 9 HG1 LYS 9 -7.481 15.163 -2.001 78 HD2 LYS 9 HD2 LYS 9 -7.398 15.552 -4.971 79 HD3 LYS 9 HD1 LYS 9 -7.762 16.907 -3.900 80 HE2 LYS 9 HE2 LYS 9 -5.667 16.796 -2.861 81 HE3 LYS 9 HE1 LYS 9 -5.358 15.167 -3.458 82 HZ1 LYS 9 HZ1 LYS 9 -5.735 17.222 -5.479 83 HZ2 LYS 9 HZ2 LYS 9 -4.643 15.931 -5.437 84 HZ3 LYS 9 HZ3 LYS 9 -4.318 17.340 -4.561 85 H GLU 10 HN GLU 10 -9.090 11.026 -2.606 86 HA GLU 10 HA GLU 10 -11.522 12.047 -1.388 87 HB2 GLU 10 HB2 GLU 10 -11.972 10.510 -3.482 88 HB3 GLU 10 HB1 GLU 10 -11.625 9.218 -2.343 89 HG2 GLU 10 HG2 GLU 10 -13.376 10.251 -0.842 90 HG3 GLU 10 HG1 GLU 10 -13.824 11.255 -2.220 91 HA PRO 11 HA PRO 11 -9.418 10.114 2.036 92 HB2 PRO 11 HB2 PRO 11 -11.162 10.740 3.977 93 HB3 PRO 11 HB1 PRO 11 -10.148 11.970 3.212 94 HG2 PRO 11 HG2 PRO 11 -13.021 11.302 2.707 95 HG3 PRO 11 HG1 PRO 11 -12.248 12.892 2.836 96 HD2 PRO 11 HD2 PRO 11 -12.852 11.677 0.455 97 HD3 PRO 11 HD1 PRO 11 -11.547 12.861 0.656 98 H ALA 12 HN ALA 12 -10.065 8.604 3.903 99 HA ALA 12 HA ALA 12 -12.384 6.985 3.566 100 HB1 ALA 12 HB1 ALA 12 -11.298 5.957 1.765 101 HB2 ALA 12 HB2 ALA 12 -11.020 4.872 3.128 102 HB3 ALA 12 HB3 ALA 12 -9.740 5.960 2.591 103 H THR 13 HN THR 13 -12.332 5.062 5.055 104 HA THR 13 HA THR 13 -10.533 5.473 7.339 105 HB THR 13 HB THR 13 -13.487 4.932 7.654 106 HG1 THR 13 HG1 THR 13 -12.075 7.380 7.661 107 HG21 THR 13 HG21 THR 13 -12.502 4.302 9.644 108 HG22 THR 13 HG22 THR 13 -12.940 5.985 9.937 109 HG23 THR 13 HG23 THR 13 -11.272 5.562 9.553 110 H LEU 14 HN LEU 14 -9.927 3.622 8.420 111 HA LEU 14 HA LEU 14 -10.206 1.169 6.981 112 HB2 LEU 14 HB2 LEU 14 -8.413 2.199 8.846 113 HB3 LEU 14 HB1 LEU 14 -9.196 0.874 9.689 114 HG LEU 14 HG LEU 14 -7.119 0.175 8.581 115 HD11 LEU 14 HD11 LEU 14 -8.410 -1.577 7.009 116 HD12 LEU 14 HD12 LEU 14 -9.763 -0.979 7.970 117 HD13 LEU 14 HD13 LEU 14 -8.363 -1.698 8.768 118 HD21 LEU 14 HD21 LEU 14 -8.360 1.546 6.322 119 HD22 LEU 14 HD22 LEU 14 -7.717 -0.045 5.918 120 HD23 LEU 14 HD23 LEU 14 -6.665 1.176 6.634 121 H ILE 15 HN ILE 15 -12.075 0.088 7.016 122 HA ILE 15 HA ILE 15 -13.898 0.182 9.213 123 HB ILE 15 HB ILE 15 -13.847 -1.821 6.950 124 HG12 ILE 15 HG12 ILE 15 -13.862 0.512 6.120 125 HG13 ILE 15 HG11 ILE 15 -15.366 -0.331 5.764 126 HG21 ILE 15 HG21 ILE 15 -15.851 -1.063 9.030 127 HG22 ILE 15 HG22 ILE 15 -15.354 -2.662 8.480 128 HG23 ILE 15 HG23 ILE 15 -16.395 -1.665 7.465 129 HD11 ILE 15 HD11 ILE 15 -16.008 0.811 8.111 130 HD12 ILE 15 HD12 ILE 15 -16.280 1.565 6.540 131 HD13 ILE 15 HD13 ILE 15 -14.857 1.991 7.488 132 H LYS 16 HN LYS 16 -11.500 -2.099 8.021 133 HA LYS 16 HA LYS 16 -11.020 -3.176 10.591 134 HB2 LYS 16 HB2 LYS 16 -13.185 -4.354 9.231 135 HB3 LYS 16 HB1 LYS 16 -11.851 -5.488 9.073 136 HG2 LYS 16 HG2 LYS 16 -12.587 -4.315 11.728 137 HG3 LYS 16 HG1 LYS 16 -13.420 -5.728 11.079 138 HD2 LYS 16 HD2 LYS 16 -10.470 -5.814 11.011 139 HD3 LYS 16 HD1 LYS 16 -11.210 -5.872 12.612 140 HE2 LYS 16 HE2 LYS 16 -11.957 -7.684 10.321 141 HE3 LYS 16 HE1 LYS 16 -10.813 -8.109 11.594 142 HZ1 LYS 16 HZ1 LYS 16 -13.706 -7.531 11.905 143 HZ2 LYS 16 HZ2 LYS 16 -12.641 -7.703 13.207 144 HZ3 LYS 16 HZ3 LYS 16 -12.921 -9.006 12.166 145 H ALA 17 HN ALA 17 -9.040 -4.106 10.654 146 HA ALA 17 HA ALA 17 -7.458 -4.020 8.272 147 HB1 ALA 17 HB1 ALA 17 -6.885 -4.619 11.147 148 HB2 ALA 17 HB2 ALA 17 -6.295 -3.292 10.146 149 HB3 ALA 17 HB3 ALA 17 -5.674 -4.924 9.901 150 H ILE 18 HN ILE 18 -6.972 -5.649 6.940 151 HA ILE 18 HA ILE 18 -8.017 -8.297 7.539 152 HB ILE 18 HB ILE 18 -6.509 -7.676 5.030 153 HG12 ILE 18 HG12 ILE 18 -8.453 -5.954 5.752 154 HG13 ILE 18 HG11 ILE 18 -8.121 -6.395 4.087 155 HG21 ILE 18 HG21 ILE 18 -8.293 -9.229 4.122 156 HG22 ILE 18 HG22 ILE 18 -8.731 -9.536 5.802 157 HG23 ILE 18 HG23 ILE 18 -7.113 -9.933 5.226 158 HD11 ILE 18 HD11 ILE 18 -10.555 -6.429 5.055 159 HD12 ILE 18 HD12 ILE 18 -10.070 -8.027 5.625 160 HD13 ILE 18 HD13 ILE 18 -10.019 -7.650 3.902 161 H ASP 19 HN ASP 19 -4.992 -7.303 5.958 162 HA ASP 19 HA ASP 19 -3.428 -8.752 7.927 163 HB2 ASP 19 HB2 ASP 19 -4.041 -10.554 6.421 164 HB3 ASP 19 HB1 ASP 19 -3.513 -9.617 5.027 165 H GLY 20 HN GLY 20 -2.098 -8.369 4.745 166 HA2 GLY 20 HA2 GLY 20 -0.594 -6.025 5.725 167 HA3 GLY 20 HA1 GLY 20 0.050 -7.222 4.606 168 H ASP 21 HN ASP 21 -0.694 -7.242 2.441 169 HA ASP 21 HA ASP 21 -1.120 -4.693 1.331 170 HB2 ASP 21 HB2 ASP 21 -1.218 -7.488 0.232 171 HB3 ASP 21 HB1 ASP 21 -1.669 -6.112 -0.770 172 H THR 22 HN THR 22 -3.287 -6.983 2.674 173 HA THR 22 HA THR 22 -5.572 -5.781 1.282 174 HB THR 22 HB THR 22 -5.914 -8.075 3.149 175 HG1 THR 22 HG1 THR 22 -4.081 -8.668 1.956 176 HG21 THR 22 HG21 THR 22 -7.084 -8.557 0.654 177 HG22 THR 22 HG22 THR 22 -7.398 -6.862 1.031 178 HG23 THR 22 HG23 THR 22 -7.886 -8.123 2.163 179 H VAL 23 HN VAL 23 -6.983 -4.511 2.280 180 HA VAL 23 HA VAL 23 -7.312 -4.524 5.151 181 HB VAL 23 HB VAL 23 -6.917 -2.033 5.306 182 HG11 VAL 23 HG11 VAL 23 -4.781 -2.358 6.045 183 HG12 VAL 23 HG12 VAL 23 -4.316 -3.300 4.628 184 HG13 VAL 23 HG13 VAL 23 -5.297 -4.039 5.895 185 HG21 VAL 23 HG21 VAL 23 -6.848 -1.234 3.133 186 HG22 VAL 23 HG22 VAL 23 -5.824 -2.556 2.571 187 HG23 VAL 23 HG23 VAL 23 -5.141 -1.275 3.573 188 H LYS 24 HN LYS 24 -9.305 -3.738 5.766 189 HA LYS 24 HA LYS 24 -11.167 -3.192 3.604 190 HB2 LYS 24 HB2 LYS 24 -11.693 -4.789 5.468 191 HB3 LYS 24 HB1 LYS 24 -11.743 -3.413 6.561 192 HG2 LYS 24 HG2 LYS 24 -13.977 -3.900 5.983 193 HG3 LYS 24 HG1 LYS 24 -13.535 -2.444 5.090 194 HD2 LYS 24 HD2 LYS 24 -14.620 -3.720 3.484 195 HD3 LYS 24 HD1 LYS 24 -12.919 -4.084 3.186 196 HE2 LYS 24 HE2 LYS 24 -14.579 -5.791 5.009 197 HE3 LYS 24 HE1 LYS 24 -14.601 -6.034 3.263 198 HZ1 LYS 24 HZ1 LYS 24 -12.879 -7.379 3.707 199 HZ2 LYS 24 HZ2 LYS 24 -12.527 -6.645 5.189 200 HZ3 LYS 24 HZ3 LYS 24 -11.974 -5.949 3.749 201 H LEU 25 HN LEU 25 -11.873 -1.238 3.046 202 HA LEU 25 HA LEU 25 -11.563 0.960 4.972 203 HB2 LEU 25 HB2 LEU 25 -10.864 0.889 2.070 204 HB3 LEU 25 HB1 LEU 25 -11.246 2.402 2.856 205 HG LEU 25 HG LEU 25 -9.158 0.660 4.078 206 HD11 LEU 25 HD11 LEU 25 -9.007 1.850 1.409 207 HD12 LEU 25 HD12 LEU 25 -8.002 0.612 2.162 208 HD13 LEU 25 HD13 LEU 25 -7.690 2.316 2.486 209 HD21 LEU 25 HD21 LEU 25 -8.193 2.902 4.582 210 HD22 LEU 25 HD22 LEU 25 -9.789 2.626 5.281 211 HD23 LEU 25 HD23 LEU 25 -9.619 3.626 3.838 212 H MET 26 HN MET 26 -13.041 2.753 4.686 213 HA MET 26 HA MET 26 -15.685 1.825 4.002 214 HB2 MET 26 HB2 MET 26 -15.059 3.304 5.997 215 HB3 MET 26 HB1 MET 26 -14.947 4.622 4.840 216 HG2 MET 26 HG2 MET 26 -17.192 4.719 4.514 217 HG3 MET 26 HG1 MET 26 -17.425 3.002 4.832 218 HE1 MET 26 HE1 MET 26 -18.334 2.077 6.781 219 HE2 MET 26 HE2 MET 26 -19.579 3.295 6.502 220 HE3 MET 26 HE3 MET 26 -18.977 3.007 8.135 221 H TYR 27 HN TYR 27 -16.389 1.869 1.978 222 HA TYR 27 HA TYR 27 -15.806 4.236 0.337 223 HB2 TYR 27 HB2 TYR 27 -14.428 2.182 -0.292 224 HB3 TYR 27 HB1 TYR 27 -15.942 1.450 -0.806 225 HD1 TYR 27 HD1 TYR 27 -14.790 4.962 -1.203 226 HD2 TYR 27 HD2 TYR 27 -15.748 1.294 -3.128 227 HE1 TYR 27 HE1 TYR 27 -14.566 6.061 -3.391 228 HE2 TYR 27 HE2 TYR 27 -15.526 2.380 -5.323 229 HH TYR 27 HH TYR 27 -15.620 4.610 -6.293 230 H LYS 28 HN LYS 28 -17.579 5.185 -0.421 231 HA LYS 28 HA LYS 28 -19.751 5.596 -0.937 232 HB2 LYS 28 HB2 LYS 28 -19.485 2.725 -1.806 233 HB3 LYS 28 HB1 LYS 28 -20.960 3.650 -2.050 234 HG2 LYS 28 HG2 LYS 28 -19.757 5.258 -3.412 235 HG3 LYS 28 HG1 LYS 28 -18.250 4.385 -3.129 236 HD2 LYS 28 HD2 LYS 28 -18.767 2.752 -4.605 237 HD3 LYS 28 HD1 LYS 28 -20.482 2.778 -4.190 238 HE2 LYS 28 HE2 LYS 28 -19.104 4.900 -5.829 239 HE3 LYS 28 HE1 LYS 28 -19.964 3.524 -6.519 240 HZ1 LYS 28 HZ1 LYS 28 -21.816 4.491 -4.873 241 HZ2 LYS 28 HZ2 LYS 28 -21.673 4.965 -6.491 242 HZ3 LYS 28 HZ3 LYS 28 -21.009 5.926 -5.267 243 H GLY 29 HN GLY 29 -19.291 5.095 1.752 244 HA2 GLY 29 HA2 GLY 29 -20.453 4.702 3.691 245 HA3 GLY 29 HA1 GLY 29 -21.892 4.569 2.692 246 H GLN 30 HN GLN 30 -19.392 2.423 1.832 247 HA GLN 30 HA GLN 30 -20.497 0.271 3.489 248 HB2 GLN 30 HB2 GLN 30 -21.385 -0.831 1.755 249 HB3 GLN 30 HB1 GLN 30 -21.084 0.589 0.767 250 HG2 GLN 30 HG2 GLN 30 -18.946 -0.303 0.074 251 HG3 GLN 30 HG1 GLN 30 -19.151 -1.691 1.141 252 HE21 GLN 30 HE21 GLN 30 -20.973 -3.114 0.696 253 HE22 GLN 30 HE22 GLN 30 -21.476 -3.342 -0.941 254 HA PRO 31 HA PRO 31 -16.282 -0.869 3.929 255 HB2 PRO 31 HB2 PRO 31 -16.487 -3.378 4.758 256 HB3 PRO 31 HB1 PRO 31 -17.211 -2.060 5.696 257 HG2 PRO 31 HG2 PRO 31 -18.538 -3.939 3.770 258 HG3 PRO 31 HG1 PRO 31 -19.055 -3.467 5.402 259 HD2 PRO 31 HD2 PRO 31 -20.020 -2.311 3.114 260 HD3 PRO 31 HD1 PRO 31 -19.940 -1.477 4.679 261 H MET 32 HN MET 32 -14.903 -1.078 2.298 262 HA MET 32 HA MET 32 -15.263 -3.314 0.416 263 HB2 MET 32 HB2 MET 32 -15.574 -0.862 -0.409 264 HB3 MET 32 HB1 MET 32 -13.819 -0.794 -0.331 265 HG2 MET 32 HG2 MET 32 -14.554 -1.325 -2.570 266 HG3 MET 32 HG1 MET 32 -13.674 -2.683 -1.868 267 HE1 MET 32 HE1 MET 32 -14.333 -4.898 -2.197 268 HE2 MET 32 HE2 MET 32 -14.759 -4.368 -3.824 269 HE3 MET 32 HE3 MET 32 -15.845 -5.431 -2.931 270 H THR 33 HN THR 33 -13.393 -4.351 -0.343 271 HA THR 33 HA THR 33 -11.198 -4.306 1.555 272 HB THR 33 HB THR 33 -11.629 -6.115 -0.831 273 HG1 THR 33 HG1 THR 33 -12.217 -6.639 1.890 274 HG21 THR 33 HG21 THR 33 -9.312 -6.046 0.100 275 HG22 THR 33 HG22 THR 33 -10.100 -7.623 0.168 276 HG23 THR 33 HG23 THR 33 -9.978 -6.635 1.623 277 H PHE 34 HN PHE 34 -9.471 -3.092 1.239 278 HA PHE 34 HA PHE 34 -8.840 -2.203 -1.481 279 HB2 PHE 34 HB2 PHE 34 -8.352 -1.072 1.242 280 HB3 PHE 34 HB1 PHE 34 -7.246 -0.646 -0.062 281 HD1 PHE 34 HD1 PHE 34 -10.881 -0.745 0.763 282 HD2 PHE 34 HD2 PHE 34 -7.759 1.107 -1.470 283 HE1 PHE 34 HE1 PHE 34 -12.465 0.958 -0.042 284 HE2 PHE 34 HE2 PHE 34 -9.339 2.816 -2.268 285 HZ PHE 34 HZ PHE 34 -11.694 2.743 -1.554 286 H ARG 35 HN ARG 35 -6.635 -2.220 -2.218 287 HA ARG 35 HA ARG 35 -4.971 -4.222 -0.855 288 HB2 ARG 35 HB2 ARG 35 -5.992 -5.221 -2.821 289 HB3 ARG 35 HB1 ARG 35 -5.423 -3.892 -3.822 290 HG2 ARG 35 HG2 ARG 35 -3.333 -5.313 -2.330 291 HG3 ARG 35 HG1 ARG 35 -4.161 -6.264 -3.564 292 HD2 ARG 35 HD2 ARG 35 -3.709 -4.410 -5.177 293 HD3 ARG 35 HD1 ARG 35 -2.724 -3.641 -3.933 294 HE ARG 35 HE ARG 35 -1.649 -6.108 -4.106 295 HH11 ARG 35 HH11 ARG 35 -2.412 -3.690 -6.504 296 HH12 ARG 35 HH12 ARG 35 -1.131 -4.163 -7.569 297 HH21 ARG 35 HH21 ARG 35 0.036 -6.732 -5.506 298 HH22 ARG 35 HH22 ARG 35 0.257 -5.889 -7.003 299 H LEU 36 HN LEU 36 -2.829 -3.765 -0.636 300 HA LEU 36 HA LEU 36 -1.953 -1.099 -1.016 301 HB2 LEU 36 HB2 LEU 36 -0.472 -3.643 -0.339 302 HB3 LEU 36 HB1 LEU 36 0.335 -2.089 -0.474 303 HG LEU 36 HG LEU 36 -1.851 -2.762 1.499 304 HD11 LEU 36 HD11 LEU 36 -0.275 -3.230 3.029 305 HD12 LEU 36 HD12 LEU 36 0.830 -1.996 2.424 306 HD13 LEU 36 HD13 LEU 36 0.733 -3.564 1.621 307 HD21 LEU 36 HD21 LEU 36 -0.196 -0.261 1.176 308 HD22 LEU 36 HD22 LEU 36 -1.338 -0.583 2.480 309 HD23 LEU 36 HD23 LEU 36 -1.916 -0.420 0.823 310 H LEU 37 HN LEU 37 -2.451 -0.814 -3.264 311 HA LEU 37 HA LEU 37 -1.694 -2.149 -5.460 312 HB2 LEU 37 HB2 LEU 37 -2.660 0.306 -5.046 313 HB3 LEU 37 HB1 LEU 37 -1.034 0.736 -5.539 314 HG LEU 37 HG LEU 37 -1.435 -0.716 -7.601 315 HD11 LEU 37 HD11 LEU 37 -3.280 -2.015 -7.143 316 HD12 LEU 37 HD12 LEU 37 -3.969 -0.732 -8.136 317 HD13 LEU 37 HD13 LEU 37 -4.158 -0.688 -6.383 318 HD21 LEU 37 HD21 LEU 37 -1.667 1.893 -7.254 319 HD22 LEU 37 HD22 LEU 37 -3.360 1.547 -7.608 320 HD23 LEU 37 HD23 LEU 37 -2.109 1.120 -8.776 321 H LEU 38 HN LEU 38 0.045 -2.435 -6.780 322 HA LEU 38 HA LEU 38 2.211 -3.088 -7.102 323 HB2 LEU 38 HB2 LEU 38 3.762 -1.018 -7.143 324 HB3 LEU 38 HB1 LEU 38 2.445 -1.146 -8.291 325 HG LEU 38 HG LEU 38 2.015 0.354 -5.743 326 HD11 LEU 38 HD11 LEU 38 3.732 1.701 -6.238 327 HD12 LEU 38 HD12 LEU 38 2.681 2.311 -7.516 328 HD13 LEU 38 HD13 LEU 38 3.883 1.071 -7.877 329 HD21 LEU 38 HD21 LEU 38 0.353 -0.279 -7.723 330 HD22 LEU 38 HD22 LEU 38 1.020 1.209 -8.393 331 HD23 LEU 38 HD23 LEU 38 0.225 1.228 -6.821 332 H VAL 39 HN VAL 39 1.517 -3.567 -4.400 333 HA VAL 39 HA VAL 39 4.122 -3.069 -3.119 334 HB VAL 39 HB VAL 39 1.479 -3.430 -1.694 335 HG11 VAL 39 HG11 VAL 39 3.299 -4.315 -0.390 336 HG12 VAL 39 HG12 VAL 39 2.775 -2.784 0.312 337 HG13 VAL 39 HG13 VAL 39 4.247 -2.852 -0.656 338 HG21 VAL 39 HG21 VAL 39 2.553 -0.943 -1.054 339 HG22 VAL 39 HG22 VAL 39 1.160 -1.259 -2.088 340 HG23 VAL 39 HG23 VAL 39 2.764 -1.086 -2.799 341 H ASP 40 HN ASP 40 5.162 -4.804 -2.201 342 HA ASP 40 HA ASP 40 3.998 -7.429 -2.805 343 HB2 ASP 40 HB2 ASP 40 6.420 -6.465 -3.513 344 HB3 ASP 40 HB1 ASP 40 6.836 -7.242 -1.987 345 H THR 41 HN THR 41 3.905 -9.065 -1.292 346 HA THR 41 HA THR 41 4.246 -8.204 1.503 347 HB THR 41 HB THR 41 2.647 -10.347 1.750 348 HG1 THR 41 HG1 THR 41 1.355 -10.622 0.043 349 HG21 THR 41 HG21 THR 41 1.520 -8.680 2.686 350 HG22 THR 41 HG22 THR 41 0.759 -8.468 1.109 351 HG23 THR 41 HG23 THR 41 2.161 -7.492 1.550 352 HA PRO 42 HA PRO 42 7.377 -11.318 1.889 353 HB2 PRO 42 HB2 PRO 42 7.436 -11.576 4.580 354 HB3 PRO 42 HB1 PRO 42 8.071 -10.150 3.750 355 HG2 PRO 42 HG2 PRO 42 5.436 -10.528 5.120 356 HG3 PRO 42 HG1 PRO 42 6.541 -9.142 5.182 357 HD2 PRO 42 HD2 PRO 42 4.323 -9.194 3.612 358 HD3 PRO 42 HD1 PRO 42 5.790 -8.296 3.179 359 H GLU 43 HN GLU 43 7.561 -13.518 2.084 360 HA GLU 43 HA GLU 43 5.147 -14.961 2.966 361 HB2 GLU 43 HB2 GLU 43 5.798 -15.013 0.483 362 HB3 GLU 43 HB1 GLU 43 7.145 -16.025 0.983 363 HG2 GLU 43 HG2 GLU 43 5.533 -17.617 1.966 364 HG3 GLU 43 HG1 GLU 43 4.218 -16.624 1.338 365 H THR 44 HN THR 44 7.477 -14.162 4.578 366 HA THR 44 HA THR 44 8.851 -15.015 6.176 367 HB THR 44 HB THR 44 7.767 -17.748 6.077 368 HG1 THR 44 HG1 THR 44 6.073 -15.501 6.310 369 HG21 THR 44 HG21 THR 44 7.315 -15.896 8.343 370 HG22 THR 44 HG22 THR 44 8.969 -16.403 7.997 371 HG23 THR 44 HG23 THR 44 7.729 -17.610 8.340 372 H LYS 45 HN LYS 45 10.104 -17.339 6.647 373 HA LYS 45 HA LYS 45 11.287 -18.245 4.129 374 HB2 LYS 45 HB2 LYS 45 12.847 -17.073 6.435 375 HB3 LYS 45 HB1 LYS 45 13.575 -17.968 5.107 376 HG2 LYS 45 HG2 LYS 45 11.859 -15.784 4.223 377 HG3 LYS 45 HG1 LYS 45 13.221 -15.256 5.212 378 HD2 LYS 45 HD2 LYS 45 14.047 -15.228 3.021 379 HD3 LYS 45 HD1 LYS 45 14.656 -16.740 3.697 380 HE2 LYS 45 HE2 LYS 45 13.860 -17.314 1.568 381 HE3 LYS 45 HE1 LYS 45 12.593 -17.833 2.677 382 HZ1 LYS 45 HZ1 LYS 45 11.258 -16.007 2.095 383 HZ2 LYS 45 HZ2 LYS 45 11.851 -16.601 0.627 384 HZ3 LYS 45 HZ3 LYS 45 12.525 -15.208 1.308 385 H HIS 46 HN HIS 46 11.411 -18.571 7.673 386 HA HIS 46 HA HIS 46 11.394 -21.489 7.313 387 HB2 HIS 46 HB2 HIS 46 13.298 -19.817 8.886 388 HB3 HIS 46 HB1 HIS 46 12.827 -21.380 9.546 389 HD1 HIS 46 HD1 HIS 46 15.318 -19.906 7.481 390 HD2 HIS 46 HD2 HIS 46 13.257 -23.514 7.441 391 HE1 HIS 46 HE1 HIS 46 16.700 -21.454 6.059 392 HE2 HIS 46 HE2 HIS 46 15.479 -23.657 6.124 393 HA PRO 47 HA PRO 47 7.930 -20.348 10.104 394 HB2 PRO 47 HB2 PRO 47 6.330 -22.407 9.355 395 HB3 PRO 47 HB1 PRO 47 6.431 -20.894 8.446 396 HG2 PRO 47 HG2 PRO 47 7.778 -23.515 7.918 397 HG3 PRO 47 HG1 PRO 47 6.990 -22.412 6.775 398 HD2 PRO 47 HD2 PRO 47 9.678 -22.508 7.090 399 HD3 PRO 47 HD1 PRO 47 8.818 -21.014 6.668 400 H LYS 48 HN LYS 48 6.596 -21.976 11.552 401 HA LYS 48 HA LYS 48 7.738 -24.413 12.345 402 HB2 LYS 48 HB2 LYS 48 9.593 -22.935 13.076 403 HB3 LYS 48 HB1 LYS 48 8.471 -22.088 14.131 404 HG2 LYS 48 HG2 LYS 48 8.271 -23.888 15.580 405 HG3 LYS 48 HG1 LYS 48 8.858 -25.043 14.380 406 HD2 LYS 48 HD2 LYS 48 10.804 -22.963 14.980 407 HD3 LYS 48 HD1 LYS 48 10.343 -23.893 16.407 408 HE2 LYS 48 HE2 LYS 48 11.205 -25.847 15.583 409 HE3 LYS 48 HE1 LYS 48 10.955 -25.374 13.903 410 HZ1 LYS 48 HZ1 LYS 48 13.276 -25.362 14.326 411 HZ2 LYS 48 HZ2 LYS 48 13.095 -24.439 15.731 412 HZ3 LYS 48 HZ3 LYS 48 12.791 -23.744 14.220 413 H LYS 49 HN LYS 49 6.527 -21.634 14.223 414 HA LYS 49 HA LYS 49 4.702 -23.204 15.712 415 HB2 LYS 49 HB2 LYS 49 4.973 -20.231 15.296 416 HB3 LYS 49 HB1 LYS 49 3.733 -20.927 16.331 417 HG2 LYS 49 HG2 LYS 49 6.616 -21.608 16.739 418 HG3 LYS 49 HG1 LYS 49 5.937 -20.114 17.387 419 HD2 LYS 49 HD2 LYS 49 4.343 -22.524 17.916 420 HD3 LYS 49 HD1 LYS 49 5.934 -22.510 18.678 421 HE2 LYS 49 HE2 LYS 49 5.448 -20.377 19.719 422 HE3 LYS 49 HE1 LYS 49 3.892 -20.301 18.894 423 HZ1 LYS 49 HZ1 LYS 49 2.986 -21.870 20.256 424 HZ2 LYS 49 HZ2 LYS 49 4.074 -21.160 21.339 425 HZ3 LYS 49 HZ3 LYS 49 4.465 -22.623 20.588 426 H GLY 50 HN GLY 50 4.446 -21.401 12.724 427 HA2 GLY 50 HA2 GLY 50 2.389 -22.730 11.578 428 HA3 GLY 50 HA1 GLY 50 1.561 -21.590 12.627 429 H VAL 51 HN VAL 51 0.776 -21.077 10.315 430 HA VAL 51 HA VAL 51 2.268 -18.728 9.441 431 HB VAL 51 HB VAL 51 1.339 -20.790 7.440 432 HG11 VAL 51 HG11 VAL 51 3.327 -18.713 6.761 433 HG12 VAL 51 HG12 VAL 51 1.675 -18.158 7.034 434 HG13 VAL 51 HG13 VAL 51 2.004 -19.378 5.803 435 HG21 VAL 51 HG21 VAL 51 3.708 -21.304 7.085 436 HG22 VAL 51 HG22 VAL 51 3.203 -21.686 8.732 437 HG23 VAL 51 HG23 VAL 51 4.140 -20.225 8.413 438 H GLU 52 HN GLU 52 0.446 -17.715 10.510 439 HA GLU 52 HA GLU 52 -1.852 -17.490 8.701 440 HB2 GLU 52 HB2 GLU 52 -1.877 -18.367 11.519 441 HB3 GLU 52 HB1 GLU 52 -3.073 -17.147 11.105 442 HG2 GLU 52 HG2 GLU 52 -3.847 -18.605 9.258 443 HG3 GLU 52 HG1 GLU 52 -2.725 -19.844 9.818 444 H LYS 53 HN LYS 53 0.591 -15.861 9.441 445 HA LYS 53 HA LYS 53 -0.825 -13.404 10.245 446 HB2 LYS 53 HB2 LYS 53 2.113 -14.005 10.610 447 HB3 LYS 53 HB1 LYS 53 1.253 -12.584 11.185 448 HG2 LYS 53 HG2 LYS 53 -0.094 -14.024 12.659 449 HG3 LYS 53 HG1 LYS 53 0.846 -15.417 12.119 450 HD2 LYS 53 HD2 LYS 53 2.806 -13.663 12.859 451 HD3 LYS 53 HD1 LYS 53 1.534 -13.303 14.029 452 HE2 LYS 53 HE2 LYS 53 2.599 -14.994 15.131 453 HE3 LYS 53 HE1 LYS 53 1.433 -15.935 14.202 454 HZ1 LYS 53 HZ1 LYS 53 3.066 -16.553 12.662 455 HZ2 LYS 53 HZ2 LYS 53 3.817 -16.725 14.168 456 HZ3 LYS 53 HZ3 LYS 53 4.162 -15.381 13.201 457 H TYR 54 HN TYR 54 1.349 -14.905 7.972 458 HA TYR 54 HA TYR 54 2.043 -14.304 5.898 459 HB2 TYR 54 HB2 TYR 54 0.068 -12.035 6.213 460 HB3 TYR 54 HB1 TYR 54 0.858 -12.496 4.710 461 HD1 TYR 54 HD2 TYR 54 -1.554 -13.615 7.281 462 HD2 TYR 54 HD1 TYR 54 0.039 -14.291 3.394 463 HE1 TYR 54 HE2 TYR 54 -3.370 -15.207 6.820 464 HE2 TYR 54 HE1 TYR 54 -1.773 -15.885 2.922 465 HH TYR 54 HH TYR 54 -4.490 -16.053 4.335 466 H GLY 55 HN GLY 55 2.876 -12.772 8.587 467 HA2 GLY 55 HA2 GLY 55 5.230 -11.822 8.209 468 HA3 GLY 55 HA1 GLY 55 4.371 -10.624 7.253 469 HA PRO 56 HA PRO 56 3.365 -10.184 12.080 470 HB2 PRO 56 HB2 PRO 56 5.824 -10.221 13.373 471 HB3 PRO 56 HB1 PRO 56 4.636 -11.525 13.406 472 HG2 PRO 56 HG2 PRO 56 7.084 -11.231 11.724 473 HG3 PRO 56 HG1 PRO 56 6.404 -12.686 12.476 474 HD2 PRO 56 HD2 PRO 56 6.114 -12.197 9.857 475 HD3 PRO 56 HD1 PRO 56 4.822 -12.964 10.803 476 H GLU 57 HN GLU 57 6.440 -9.259 10.570 477 HA GLU 57 HA GLU 57 6.389 -6.617 11.708 478 HB2 GLU 57 HB2 GLU 57 8.187 -8.124 9.868 479 HB3 GLU 57 HB1 GLU 57 8.268 -6.368 9.847 480 HG2 GLU 57 HG2 GLU 57 8.433 -7.857 12.431 481 HG3 GLU 57 HG1 GLU 57 9.849 -7.702 11.392 482 H ALA 58 HN ALA 58 5.469 -8.120 8.680 483 HA ALA 58 HA ALA 58 5.067 -5.623 7.308 484 HB1 ALA 58 HB1 ALA 58 5.368 -8.276 6.534 485 HB2 ALA 58 HB2 ALA 58 5.044 -6.895 5.486 486 HB3 ALA 58 HB3 ALA 58 3.707 -7.868 6.101 487 H SER 59 HN SER 59 2.842 -8.223 8.357 488 HA SER 59 HA SER 59 0.473 -6.864 7.790 489 HB2 SER 59 HB2 SER 59 1.183 -9.095 9.665 490 HB3 SER 59 HB1 SER 59 -0.440 -8.406 9.698 491 HG SER 59 HG SER 59 -0.371 -8.796 7.323 492 H ALA 60 HN ALA 60 2.547 -6.739 10.621 493 HA ALA 60 HA ALA 60 0.735 -5.294 12.261 494 HB1 ALA 60 HB1 ALA 60 2.560 -6.635 13.189 495 HB2 ALA 60 HB2 ALA 60 2.631 -4.961 13.743 496 HB3 ALA 60 HB3 ALA 60 3.730 -5.520 12.482 497 H PHE 61 HN PHE 61 3.661 -4.297 10.484 498 HA PHE 61 HA PHE 61 3.601 -1.607 11.100 499 HB2 PHE 61 HB2 PHE 61 5.457 -2.774 9.929 500 HB3 PHE 61 HB1 PHE 61 4.478 -2.793 8.464 501 HD1 PHE 61 HD1 PHE 61 6.358 -0.686 10.797 502 HD2 PHE 61 HD2 PHE 61 4.149 -0.811 7.164 503 HE1 PHE 61 HE1 PHE 61 7.204 1.552 10.208 504 HE2 PHE 61 HE2 PHE 61 4.984 1.421 6.568 505 HZ PHE 61 HZ PHE 61 6.517 2.608 8.091 506 H THR 62 HN THR 62 2.219 -3.140 8.181 507 HA THR 62 HA THR 62 1.125 -0.889 7.019 508 HB THR 62 HB THR 62 -0.318 -3.531 7.024 509 HG1 THR 62 HG1 THR 62 1.153 -4.209 5.440 510 HG21 THR 62 HG21 THR 62 -0.931 -1.323 5.657 511 HG22 THR 62 HG22 THR 62 -1.190 -2.952 5.031 512 HG23 THR 62 HG23 THR 62 0.238 -2.037 4.546 513 H LYS 63 HN LYS 63 -0.274 -2.993 9.495 514 HA LYS 63 HA LYS 63 -2.731 -1.535 9.662 515 HB2 LYS 63 HB2 LYS 63 -2.604 -3.912 10.256 516 HB3 LYS 63 HB1 LYS 63 -1.498 -3.532 11.568 517 HG2 LYS 63 HG2 LYS 63 -3.989 -2.028 11.696 518 HG3 LYS 63 HG1 LYS 63 -4.217 -3.776 11.777 519 HD2 LYS 63 HD2 LYS 63 -2.350 -2.171 13.524 520 HD3 LYS 63 HD1 LYS 63 -3.939 -2.768 14.005 521 HE2 LYS 63 HE2 LYS 63 -2.765 -5.043 13.089 522 HE3 LYS 63 HE1 LYS 63 -1.378 -4.185 13.758 523 HZ1 LYS 63 HZ1 LYS 63 -2.586 -5.679 15.338 524 HZ2 LYS 63 HZ2 LYS 63 -3.894 -4.609 15.268 525 HZ3 LYS 63 HZ3 LYS 63 -2.403 -4.082 15.868 526 H LYS 64 HN LYS 64 0.395 -1.311 11.146 527 HA LYS 64 HA LYS 64 -0.265 0.113 13.470 528 HB2 LYS 64 HB2 LYS 64 2.160 -0.440 11.906 529 HB3 LYS 64 HB1 LYS 64 2.215 1.069 12.806 530 HG2 LYS 64 HG2 LYS 64 1.406 -1.490 14.132 531 HG3 LYS 64 HG1 LYS 64 3.106 -1.067 13.911 532 HD2 LYS 64 HD2 LYS 64 1.645 1.179 14.966 533 HD3 LYS 64 HD1 LYS 64 1.387 -0.246 15.974 534 HE2 LYS 64 HE2 LYS 64 3.561 -0.350 16.627 535 HE3 LYS 64 HE1 LYS 64 4.163 0.292 15.099 536 HZ1 LYS 64 HZ1 LYS 64 4.123 1.682 17.363 537 HZ2 LYS 64 HZ2 LYS 64 2.623 2.138 16.727 538 HZ3 LYS 64 HZ3 LYS 64 4.035 2.400 15.833 539 H MET 65 HN MET 65 0.897 1.329 10.334 540 HA MET 65 HA MET 65 0.677 4.051 10.968 541 HB2 MET 65 HB2 MET 65 1.353 2.463 8.678 542 HB3 MET 65 HB1 MET 65 0.294 3.776 8.182 543 HG2 MET 65 HG2 MET 65 1.844 5.351 8.563 544 HG3 MET 65 HG1 MET 65 2.466 4.543 10.001 545 HE1 MET 65 HE1 MET 65 4.831 4.885 9.735 546 HE2 MET 65 HE2 MET 65 4.748 5.861 8.270 547 HE3 MET 65 HE3 MET 65 5.835 4.475 8.345 548 H VAL 66 HN VAL 66 -1.569 1.996 9.091 549 HA VAL 66 HA VAL 66 -3.465 3.999 8.609 550 HB VAL 66 HB VAL 66 -5.080 2.121 8.247 551 HG11 VAL 66 HG11 VAL 66 -2.376 1.932 6.923 552 HG12 VAL 66 HG12 VAL 66 -3.742 2.928 6.412 553 HG13 VAL 66 HG13 VAL 66 -3.846 1.169 6.317 554 HG21 VAL 66 HG21 VAL 66 -2.945 0.660 9.626 555 HG22 VAL 66 HG22 VAL 66 -3.547 -0.129 8.167 556 HG23 VAL 66 HG23 VAL 66 -4.661 0.286 9.470 557 H GLU 67 HN GLU 67 -3.062 1.841 11.360 558 HA GLU 67 HA GLU 67 -5.560 2.602 12.541 559 HB2 GLU 67 HB2 GLU 67 -3.238 1.012 13.623 560 HB3 GLU 67 HB1 GLU 67 -4.748 1.268 14.488 561 HG2 GLU 67 HG2 GLU 67 -4.617 -0.003 11.770 562 HG3 GLU 67 HG1 GLU 67 -4.514 -0.923 13.272 563 H ASN 68 HN ASN 68 -2.136 3.286 13.167 564 HA ASN 68 HA ASN 68 -2.567 4.904 15.443 565 HB2 ASN 68 HB2 ASN 68 -0.290 4.574 13.515 566 HB3 ASN 68 HB1 ASN 68 -0.245 5.851 14.726 567 HD21 ASN 68 HD21 ASN 68 -1.143 2.419 14.590 568 HD22 ASN 68 HD22 ASN 68 -0.272 1.960 16.009 569 H ALA 69 HN ALA 69 -3.054 5.477 12.108 570 HA ALA 69 HA ALA 69 -2.873 8.365 12.338 571 HB1 ALA 69 HB1 ALA 69 -2.208 6.920 10.299 572 HB2 ALA 69 HB2 ALA 69 -3.049 8.448 10.030 573 HB3 ALA 69 HB3 ALA 69 -3.934 6.925 9.941 574 H LYS 70 HN LYS 70 -4.538 9.712 12.615 575 HA LYS 70 HA LYS 70 -7.086 8.679 13.373 576 HB2 LYS 70 HB2 LYS 70 -5.873 11.399 13.137 577 HB3 LYS 70 HB1 LYS 70 -7.622 11.262 13.265 578 HG2 LYS 70 HG2 LYS 70 -7.383 10.049 15.365 579 HG3 LYS 70 HG1 LYS 70 -5.626 10.161 15.234 580 HD2 LYS 70 HD2 LYS 70 -6.011 11.960 16.584 581 HD3 LYS 70 HD1 LYS 70 -6.177 12.744 15.011 582 HE2 LYS 70 HE2 LYS 70 -8.403 13.050 15.249 583 HE3 LYS 70 HE1 LYS 70 -8.628 11.524 16.105 584 HZ1 LYS 70 HZ1 LYS 70 -8.302 12.492 18.101 585 HZ2 LYS 70 HZ2 LYS 70 -8.817 13.882 17.287 586 HZ3 LYS 70 HZ3 LYS 70 -7.165 13.603 17.522 587 H LYS 71 HN LYS 71 -5.739 9.965 10.435 588 HA LYS 71 HA LYS 71 -8.344 9.563 9.128 589 HB2 LYS 71 HB2 LYS 71 -7.451 12.032 9.506 590 HB3 LYS 71 HB1 LYS 71 -6.501 11.657 8.074 591 HG2 LYS 71 HG2 LYS 71 -8.664 11.002 6.957 592 HG3 LYS 71 HG1 LYS 71 -9.492 11.712 8.344 593 HD2 LYS 71 HD2 LYS 71 -7.420 13.330 6.945 594 HD3 LYS 71 HD1 LYS 71 -8.992 13.122 6.168 595 HE2 LYS 71 HE2 LYS 71 -8.925 15.155 7.528 596 HE3 LYS 71 HE1 LYS 71 -10.105 14.000 8.146 597 HZ1 LYS 71 HZ1 LYS 71 -7.364 14.065 9.234 598 HZ2 LYS 71 HZ2 LYS 71 -8.783 13.495 9.957 599 HZ3 LYS 71 HZ3 LYS 71 -8.532 15.159 9.788 600 H ILE 72 HN ILE 72 -8.312 8.557 7.171 601 HA ILE 72 HA ILE 72 -5.674 7.730 6.149 602 HB ILE 72 HB ILE 72 -8.172 6.118 5.747 603 HG12 ILE 72 HG12 ILE 72 -6.210 5.868 8.039 604 HG13 ILE 72 HG11 ILE 72 -7.892 6.372 8.172 605 HG21 ILE 72 HG21 ILE 72 -5.886 5.876 4.487 606 HG22 ILE 72 HG22 ILE 72 -6.801 4.455 4.992 607 HG23 ILE 72 HG23 ILE 72 -5.423 5.003 5.948 608 HD11 ILE 72 HD11 ILE 72 -6.759 3.668 7.662 609 HD12 ILE 72 HD12 ILE 72 -8.375 4.060 7.076 610 HD13 ILE 72 HD13 ILE 72 -8.009 4.173 8.798 611 H GLU 73 HN GLU 73 -5.355 7.736 3.939 612 HA GLU 73 HA GLU 73 -7.543 8.851 2.307 613 HB2 GLU 73 HB2 GLU 73 -4.679 9.559 1.759 614 HB3 GLU 73 HB1 GLU 73 -6.140 10.401 1.267 615 HG2 GLU 73 HG2 GLU 73 -6.513 11.093 3.587 616 HG3 GLU 73 HG1 GLU 73 -5.027 10.271 4.061 617 H VAL 74 HN VAL 74 -7.763 8.062 0.239 618 HA VAL 74 HA VAL 74 -5.909 5.902 -0.519 619 HB VAL 74 HB VAL 74 -7.958 4.955 -1.766 620 HG11 VAL 74 HG11 VAL 74 -6.779 4.362 0.619 621 HG12 VAL 74 HG12 VAL 74 -8.017 3.386 -0.172 622 HG13 VAL 74 HG13 VAL 74 -8.470 4.539 1.084 623 HG21 VAL 74 HG21 VAL 74 -9.666 6.010 0.378 624 HG22 VAL 74 HG22 VAL 74 -10.029 5.707 -1.322 625 HG23 VAL 74 HG23 VAL 74 -9.196 7.187 -0.848 626 H GLU 75 HN GLU 75 -5.334 5.703 -2.651 627 HA GLU 75 HA GLU 75 -6.347 7.752 -4.502 628 HB2 GLU 75 HB2 GLU 75 -4.168 8.482 -3.679 629 HB3 GLU 75 HB1 GLU 75 -3.462 6.935 -4.121 630 HG2 GLU 75 HG2 GLU 75 -3.366 7.444 -6.322 631 HG3 GLU 75 HG1 GLU 75 -4.807 8.458 -6.267 632 H PHE 76 HN PHE 76 -7.510 6.537 -5.883 633 HA PHE 76 HA PHE 76 -6.768 3.885 -6.636 634 HB2 PHE 76 HB2 PHE 76 -8.887 5.782 -7.650 635 HB3 PHE 76 HB1 PHE 76 -8.663 4.161 -8.301 636 HD1 PHE 76 HD2 PHE 76 -8.435 2.333 -6.271 637 HD2 PHE 76 HD1 PHE 76 -10.601 5.997 -6.163 638 HE1 PHE 76 HE2 PHE 76 -9.874 1.425 -4.496 639 HE2 PHE 76 HE1 PHE 76 -12.043 5.095 -4.386 640 HZ PHE 76 HZ PHE 76 -11.682 2.807 -3.550 641 H ASP 77 HN ASP 77 -5.723 3.179 -8.385 642 HA ASP 77 HA ASP 77 -3.906 4.753 -9.745 643 HB2 ASP 77 HB2 ASP 77 -3.655 2.869 -11.303 644 HB3 ASP 77 HB1 ASP 77 -3.740 2.313 -9.635 645 H LYS 78 HN LYS 78 -3.953 4.559 -12.362 646 HA LYS 78 HA LYS 78 -6.228 6.228 -13.129 647 HB2 LYS 78 HB2 LYS 78 -3.987 5.738 -15.019 648 HB3 LYS 78 HB1 LYS 78 -4.882 7.215 -14.698 649 HG2 LYS 78 HG2 LYS 78 -2.678 6.022 -13.033 650 HG3 LYS 78 HG1 LYS 78 -2.630 7.518 -13.968 651 HD2 LYS 78 HD2 LYS 78 -4.595 8.257 -12.472 652 HD3 LYS 78 HD1 LYS 78 -4.098 6.930 -11.419 653 HE2 LYS 78 HE2 LYS 78 -3.081 9.022 -10.704 654 HE3 LYS 78 HE1 LYS 78 -1.852 7.893 -11.271 655 HZ1 LYS 78 HZ1 LYS 78 -1.990 10.429 -12.051 656 HZ2 LYS 78 HZ2 LYS 78 -2.918 9.709 -13.270 657 HZ3 LYS 78 HZ3 LYS 78 -1.327 9.200 -13.007 658 H GLY 79 HN GLY 79 -5.128 3.031 -13.456 659 HA2 GLY 79 HA2 GLY 79 -6.459 2.574 -16.004 660 HA3 GLY 79 HA1 GLY 79 -5.566 1.388 -15.067 661 H GLN 80 HN GLN 80 -6.778 -0.189 -14.319 662 HA GLN 80 HA GLN 80 -9.544 -0.301 -14.434 663 HB2 GLN 80 HB2 GLN 80 -9.260 -2.207 -12.729 664 HB3 GLN 80 HB1 GLN 80 -8.475 -2.361 -14.291 665 HG2 GLN 80 HG2 GLN 80 -6.580 -1.123 -12.684 666 HG3 GLN 80 HG1 GLN 80 -7.330 -2.335 -11.648 667 HE21 GLN 80 HE21 GLN 80 -7.662 -4.499 -12.832 668 HE22 GLN 80 HE22 GLN 80 -6.296 -5.078 -13.715 669 H ARG 81 HN ARG 81 -7.636 -0.056 -11.444 670 HA ARG 81 HA ARG 81 -7.997 1.132 -9.524 671 HB2 ARG 81 HB2 ARG 81 -10.584 2.109 -10.731 672 HB3 ARG 81 HB1 ARG 81 -9.751 2.771 -9.335 673 HG2 ARG 81 HG2 ARG 81 -7.839 3.324 -10.862 674 HG3 ARG 81 HG1 ARG 81 -8.885 2.876 -12.210 675 HD2 ARG 81 HD2 ARG 81 -10.461 4.582 -10.730 676 HD3 ARG 81 HD1 ARG 81 -8.856 5.295 -10.586 677 HE ARG 81 HE ARG 81 -9.543 4.588 -13.279 678 HH11 ARG 81 HH11 ARG 81 -9.832 7.049 -10.822 679 HH12 ARG 81 HH12 ARG 81 -10.066 8.334 -11.959 680 HH21 ARG 81 HH21 ARG 81 -9.849 6.277 -14.776 681 HH22 ARG 81 HH22 ARG 81 -10.076 7.896 -14.204 682 H THR 82 HN THR 82 -9.956 -1.245 -10.838 683 HA THR 82 HA THR 82 -10.664 -2.239 -8.255 684 HB THR 82 HB THR 82 -13.180 -2.380 -9.101 685 HG1 THR 82 HG1 THR 82 -12.563 -1.117 -11.014 686 HG21 THR 82 HG21 THR 82 -12.119 -1.178 -7.039 687 HG22 THR 82 HG22 THR 82 -13.767 -0.814 -7.553 688 HG23 THR 82 HG23 THR 82 -12.446 0.273 -7.986 689 H ASP 83 HN ASP 83 -10.195 -4.308 -8.465 690 HA ASP 83 HA ASP 83 -10.082 -5.627 -10.983 691 HB2 ASP 83 HB2 ASP 83 -9.541 -6.330 -8.157 692 HB3 ASP 83 HB1 ASP 83 -9.946 -7.673 -9.222 693 H LYS 84 HN LYS 84 -11.083 -8.055 -10.805 694 HA LYS 84 HA LYS 84 -13.685 -7.942 -11.587 695 HB2 LYS 84 HB2 LYS 84 -13.668 -10.382 -10.334 696 HB3 LYS 84 HB1 LYS 84 -13.102 -10.074 -11.972 697 HG2 LYS 84 HG2 LYS 84 -11.172 -9.689 -9.750 698 HG3 LYS 84 HG1 LYS 84 -11.634 -11.340 -10.167 699 HD2 LYS 84 HD2 LYS 84 -11.020 -9.683 -12.493 700 HD3 LYS 84 HD1 LYS 84 -9.658 -9.874 -11.387 701 HE2 LYS 84 HE2 LYS 84 -9.706 -12.226 -11.578 702 HE3 LYS 84 HE1 LYS 84 -11.293 -12.206 -12.348 703 HZ1 LYS 84 HZ1 LYS 84 -9.175 -10.758 -13.719 704 HZ2 LYS 84 HZ2 LYS 84 -10.413 -11.722 -14.351 705 HZ3 LYS 84 HZ3 LYS 84 -9.029 -12.443 -13.699 706 H TYR 85 HN TYR 85 -12.708 -8.982 -8.320 707 HA TYR 85 HA TYR 85 -15.332 -8.956 -7.293 708 HB2 TYR 85 HB2 TYR 85 -12.615 -9.345 -6.240 709 HB3 TYR 85 HB1 TYR 85 -13.750 -8.676 -5.073 710 HD1 TYR 85 HD1 TYR 85 -14.479 -11.088 -7.799 711 HD2 TYR 85 HD2 TYR 85 -14.070 -10.485 -3.609 712 HE1 TYR 85 HE1 TYR 85 -15.375 -13.342 -7.395 713 HE2 TYR 85 HE2 TYR 85 -14.963 -12.737 -3.192 714 HH TYR 85 HH TYR 85 -16.660 -14.453 -5.249 715 H GLY 86 HN GLY 86 -13.322 -6.414 -8.126 716 HA2 GLY 86 HA2 GLY 86 -13.886 -4.144 -7.997 717 HA3 GLY 86 HA1 GLY 86 -15.043 -4.526 -6.728 718 H ARG 87 HN ARG 87 -11.853 -5.823 -6.497 719 HA ARG 87 HA ARG 87 -11.312 -4.918 -3.963 720 HB2 ARG 87 HB2 ARG 87 -10.020 -6.535 -5.651 721 HB3 ARG 87 HB1 ARG 87 -9.000 -5.114 -5.822 722 HG2 ARG 87 HG2 ARG 87 -7.913 -6.099 -4.104 723 HG3 ARG 87 HG1 ARG 87 -9.111 -5.204 -3.165 724 HD2 ARG 87 HD2 ARG 87 -8.862 -7.586 -2.483 725 HD3 ARG 87 HD1 ARG 87 -10.497 -7.142 -2.965 726 HE ARG 87 HE ARG 87 -10.289 -8.466 -4.863 727 HH11 ARG 87 HH11 ARG 87 -7.282 -8.387 -3.084 728 HH12 ARG 87 HH12 ARG 87 -6.612 -9.746 -3.922 729 HH21 ARG 87 HH21 ARG 87 -9.402 -10.248 -5.963 730 HH22 ARG 87 HH22 ARG 87 -7.812 -10.800 -5.555 731 H GLY 88 HN GLY 88 -9.785 -3.321 -3.158 732 HA2 GLY 88 HA2 GLY 88 -10.164 -0.779 -4.519 733 HA3 GLY 88 HA1 GLY 88 -9.541 -1.007 -2.893 734 H LEU 89 HN LEU 89 -8.772 -0.808 -6.268 735 HA LEU 89 HA LEU 89 -5.976 -1.398 -5.934 736 HB2 LEU 89 HB2 LEU 89 -7.619 -0.330 -8.213 737 HB3 LEU 89 HB1 LEU 89 -5.879 -0.506 -8.314 738 HG LEU 89 HG LEU 89 -7.261 -2.368 -9.313 739 HD11 LEU 89 HD11 LEU 89 -5.133 -2.844 -7.261 740 HD12 LEU 89 HD12 LEU 89 -4.986 -2.809 -9.017 741 HD13 LEU 89 HD13 LEU 89 -5.803 -4.158 -8.228 742 HD21 LEU 89 HD21 LEU 89 -8.278 -3.980 -7.914 743 HD22 LEU 89 HD22 LEU 89 -8.885 -2.409 -7.391 744 HD23 LEU 89 HD23 LEU 89 -7.630 -3.224 -6.458 745 H ALA 90 HN ALA 90 -5.839 0.255 -4.139 746 HA ALA 90 HA ALA 90 -4.772 2.720 -5.254 747 HB1 ALA 90 HB1 ALA 90 -6.022 4.111 -3.612 748 HB2 ALA 90 HB2 ALA 90 -7.000 2.695 -3.227 749 HB3 ALA 90 HB3 ALA 90 -7.039 3.379 -4.849 750 H TYR 91 HN TYR 91 -3.926 4.121 -3.331 751 HA TYR 91 HA TYR 91 -2.413 2.311 -1.587 752 HB2 TYR 91 HB2 TYR 91 -1.752 5.208 -2.048 753 HB3 TYR 91 HB1 TYR 91 -0.690 3.916 -1.508 754 HD1 TYR 91 HD2 TYR 91 -2.627 5.092 -4.459 755 HD2 TYR 91 HD1 TYR 91 0.656 2.785 -3.044 756 HE1 TYR 91 HE2 TYR 91 -1.865 4.769 -6.773 757 HE2 TYR 91 HE1 TYR 91 1.429 2.459 -5.356 758 HH TYR 91 HH TYR 91 -0.499 3.289 -8.074 759 H ILE 92 HN ILE 92 -2.520 2.488 0.604 760 HA ILE 92 HA ILE 92 -4.611 4.241 1.667 761 HB ILE 92 HB ILE 92 -3.090 2.021 3.041 762 HG12 ILE 92 HG12 ILE 92 -5.632 1.118 2.795 763 HG13 ILE 92 HG11 ILE 92 -5.503 2.074 1.321 764 HG21 ILE 92 HG21 ILE 92 -4.027 3.764 4.540 765 HG22 ILE 92 HG22 ILE 92 -4.747 2.172 4.776 766 HG23 ILE 92 HG23 ILE 92 -5.625 3.412 3.883 767 HD11 ILE 92 HD11 ILE 92 -3.573 0.791 0.631 768 HD12 ILE 92 HD12 ILE 92 -4.938 -0.275 0.965 769 HD13 ILE 92 HD13 ILE 92 -3.625 -0.130 2.134 770 H TYR 93 HN TYR 93 -4.159 6.082 2.659 771 HA TYR 93 HA TYR 93 -1.390 6.635 3.443 772 HB2 TYR 93 HB2 TYR 93 -3.730 8.526 3.124 773 HB3 TYR 93 HB1 TYR 93 -2.088 8.999 3.521 774 HD1 TYR 93 HD2 TYR 93 -2.995 6.463 0.963 775 HD2 TYR 93 HD1 TYR 93 -1.687 10.440 1.703 776 HE1 TYR 93 HE2 TYR 93 -2.530 6.744 -1.426 777 HE2 TYR 93 HE1 TYR 93 -1.208 10.730 -0.690 778 HH TYR 93 HH TYR 93 -2.263 8.487 -3.060 779 H ALA 94 HN ALA 94 -1.001 7.838 5.426 780 HA ALA 94 HA ALA 94 -3.045 7.558 7.498 781 HB1 ALA 94 HB1 ALA 94 -0.835 6.822 8.903 782 HB2 ALA 94 HB2 ALA 94 -0.539 6.038 7.352 783 HB3 ALA 94 HB3 ALA 94 -2.023 5.699 8.241 784 H ASP 95 HN ASP 95 -3.281 9.532 8.308 785 HA ASP 95 HA ASP 95 -2.828 11.569 9.207 786 HB2 ASP 95 HB2 ASP 95 -0.836 9.927 10.185 787 HB3 ASP 95 HB1 ASP 95 0.069 11.271 9.495 788 H GLY 96 HN GLY 96 -2.123 10.760 6.258 789 HA2 GLY 96 HA2 GLY 96 -1.988 12.498 4.585 790 HA3 GLY 96 HA1 GLY 96 -0.881 13.359 5.641 791 H LYS 97 HN LYS 97 -0.250 10.034 5.564 792 HA LYS 97 HA LYS 97 1.750 10.390 3.441 793 HB2 LYS 97 HB2 LYS 97 2.132 9.553 6.265 794 HB3 LYS 97 HB1 LYS 97 3.071 8.702 5.046 795 HG2 LYS 97 HG2 LYS 97 3.783 10.998 4.218 796 HG3 LYS 97 HG1 LYS 97 3.106 11.621 5.725 797 HD2 LYS 97 HD2 LYS 97 5.235 9.491 5.536 798 HD3 LYS 97 HD1 LYS 97 5.542 11.198 5.857 799 HE2 LYS 97 HE2 LYS 97 4.564 11.111 7.958 800 HE3 LYS 97 HE1 LYS 97 3.633 9.664 7.573 801 HZ1 LYS 97 HZ1 LYS 97 5.543 8.323 7.756 802 HZ2 LYS 97 HZ2 LYS 97 5.584 9.347 9.102 803 HZ3 LYS 97 HZ3 LYS 97 6.588 9.653 7.776 804 H MET 98 HN MET 98 1.827 8.785 1.978 805 HA MET 98 HA MET 98 -0.125 6.737 2.016 806 HB2 MET 98 HB2 MET 98 2.272 6.498 0.253 807 HB3 MET 98 HB1 MET 98 0.580 6.169 -0.100 808 HG2 MET 98 HG2 MET 98 0.573 8.095 -1.194 809 HG3 MET 98 HG1 MET 98 0.599 8.875 0.386 810 HE1 MET 98 HE1 MET 98 2.785 10.950 -1.958 811 HE2 MET 98 HE2 MET 98 2.457 11.275 -0.256 812 HE3 MET 98 HE3 MET 98 1.181 10.643 -1.295 813 H VAL 99 HN VAL 99 -0.081 5.110 3.390 814 HA VAL 99 HA VAL 99 2.121 4.138 4.782 815 HB VAL 99 HB VAL 99 -0.335 2.534 4.072 816 HG11 VAL 99 HG11 VAL 99 0.113 1.253 6.005 817 HG12 VAL 99 HG12 VAL 99 1.338 2.391 6.567 818 HG13 VAL 99 HG13 VAL 99 1.649 1.388 5.150 819 HG21 VAL 99 HG21 VAL 99 -1.150 4.580 4.946 820 HG22 VAL 99 HG22 VAL 99 0.096 4.623 6.192 821 HG23 VAL 99 HG23 VAL 99 -1.193 3.423 6.277 822 H ASN 100 HN ASN 100 0.770 3.131 1.690 823 HA ASN 100 HA ASN 100 2.065 0.726 1.281 824 HB2 ASN 100 HB2 ASN 100 1.729 2.798 -0.887 825 HB3 ASN 100 HB1 ASN 100 1.706 1.045 -1.050 826 HD21 ASN 100 HD21 ASN 100 -0.232 0.203 -1.285 827 HD22 ASN 100 HD22 ASN 100 -1.712 0.856 -0.687 828 H GLU 101 HN GLU 101 3.255 3.987 0.495 829 HA GLU 101 HA GLU 101 5.740 3.220 -0.536 830 HB2 GLU 101 HB2 GLU 101 4.448 5.575 -0.309 831 HB3 GLU 101 HB1 GLU 101 5.617 5.756 0.991 832 HG2 GLU 101 HG2 GLU 101 7.135 4.813 -1.106 833 HG3 GLU 101 HG1 GLU 101 5.984 5.900 -1.882 834 H ALA 102 HN ALA 102 4.676 3.814 2.767 835 HA ALA 102 HA ALA 102 7.149 3.889 4.051 836 HB1 ALA 102 HB1 ALA 102 5.015 4.439 5.138 837 HB2 ALA 102 HB2 ALA 102 5.957 3.277 6.074 838 HB3 ALA 102 HB3 ALA 102 4.578 2.731 5.120 839 H LEU 103 HN LEU 103 5.038 1.078 3.471 840 HA LEU 103 HA LEU 103 6.805 -0.833 4.559 841 HB2 LEU 103 HB2 LEU 103 4.478 -0.991 2.667 842 HB3 LEU 103 HB1 LEU 103 5.428 -2.416 3.039 843 HG LEU 103 HG LEU 103 4.860 -1.454 5.539 844 HD11 LEU 103 HD11 LEU 103 3.212 0.050 4.012 845 HD12 LEU 103 HD12 LEU 103 2.873 -0.417 5.678 846 HD13 LEU 103 HD13 LEU 103 2.180 -1.341 4.344 847 HD21 LEU 103 HD21 LEU 103 4.571 -3.768 4.260 848 HD22 LEU 103 HD22 LEU 103 2.879 -3.280 4.311 849 HD23 LEU 103 HD23 LEU 103 3.795 -3.441 5.810 850 H VAL 104 HN VAL 104 6.318 0.418 1.304 851 HA VAL 104 HA VAL 104 8.020 -1.352 -0.064 852 HB VAL 104 HB VAL 104 7.421 1.524 -0.778 853 HG11 VAL 104 HG11 VAL 104 8.965 -0.539 -2.059 854 HG12 VAL 104 HG12 VAL 104 8.751 1.151 -2.518 855 HG13 VAL 104 HG13 VAL 104 7.600 -0.066 -3.070 856 HG21 VAL 104 HG21 VAL 104 5.561 -0.445 -0.393 857 HG22 VAL 104 HG22 VAL 104 5.892 -0.576 -2.120 858 HG23 VAL 104 HG23 VAL 104 5.358 0.960 -1.438 859 H ARG 105 HN ARG 105 8.605 1.747 1.521 860 HA ARG 105 HA ARG 105 11.368 1.852 0.743 861 HB2 ARG 105 HB2 ARG 105 10.396 3.961 1.042 862 HB3 ARG 105 HB1 ARG 105 9.602 3.490 2.537 863 HG2 ARG 105 HG2 ARG 105 12.489 3.334 2.753 864 HG3 ARG 105 HG1 ARG 105 11.940 4.945 2.286 865 HD2 ARG 105 HD2 ARG 105 11.656 5.240 4.496 866 HD3 ARG 105 HD1 ARG 105 10.162 4.340 4.242 867 HE ARG 105 HE ARG 105 11.083 2.533 5.336 868 HH11 ARG 105 HH11 ARG 105 13.561 4.920 4.726 869 HH12 ARG 105 HH12 ARG 105 14.718 4.166 5.769 870 HH21 ARG 105 HH21 ARG 105 12.608 1.545 6.711 871 HH22 ARG 105 HH22 ARG 105 14.178 2.251 6.894 872 H GLN 106 HN GLN 106 9.545 0.685 3.490 873 HA GLN 106 HA GLN 106 11.694 0.495 5.319 874 HB2 GLN 106 HB2 GLN 106 8.925 -0.487 5.155 875 HB3 GLN 106 HB1 GLN 106 10.001 -1.485 6.121 876 HG2 GLN 106 HG2 GLN 106 9.796 1.479 6.524 877 HG3 GLN 106 HG1 GLN 106 8.698 0.347 7.310 878 HE21 GLN 106 HE21 GLN 106 9.673 -1.325 8.653 879 HE22 GLN 106 HE22 GLN 106 11.126 -0.962 9.514 880 H GLY 107 HN GLY 107 10.194 -1.969 3.219 881 HA2 GLY 107 HA2 GLY 107 12.062 -3.297 2.056 882 HA3 GLY 107 HA1 GLY 107 12.534 -3.697 3.700 883 H LEU 108 HN LEU 108 9.978 -4.071 4.819 884 HA LEU 108 HA LEU 108 9.481 -6.730 4.355 885 HB2 LEU 108 HB2 LEU 108 6.990 -5.911 5.064 886 HB3 LEU 108 HB1 LEU 108 8.299 -6.213 6.189 887 HG LEU 108 HG LEU 108 8.153 -3.469 5.090 888 HD11 LEU 108 HD11 LEU 108 6.342 -3.912 7.359 889 HD12 LEU 108 HD12 LEU 108 5.766 -4.518 5.807 890 HD13 LEU 108 HD13 LEU 108 6.199 -2.818 5.983 891 HD21 LEU 108 HD21 LEU 108 8.878 -2.878 7.277 892 HD22 LEU 108 HD22 LEU 108 9.798 -4.303 6.794 893 HD23 LEU 108 HD23 LEU 108 8.447 -4.465 7.916 894 H ALA 109 HN ALA 109 8.413 -3.992 2.511 895 HA ALA 109 HA ALA 109 7.055 -5.825 0.652 896 HB1 ALA 109 HB1 ALA 109 5.321 -4.309 0.261 897 HB2 ALA 109 HB2 ALA 109 6.199 -2.971 1.002 898 HB3 ALA 109 HB3 ALA 109 5.541 -4.260 2.011 899 H LYS 110 HN LYS 110 7.257 -5.331 -1.565 900 HA LYS 110 HA LYS 110 9.200 -3.237 -2.245 901 HB2 LYS 110 HB2 LYS 110 10.133 -4.904 -3.954 902 HB3 LYS 110 HB1 LYS 110 10.585 -5.129 -2.270 903 HG2 LYS 110 HG2 LYS 110 8.911 -6.881 -2.040 904 HG3 LYS 110 HG1 LYS 110 8.420 -6.642 -3.719 905 HD2 LYS 110 HD2 LYS 110 9.874 -8.518 -3.695 906 HD3 LYS 110 HD1 LYS 110 10.798 -7.173 -4.369 907 HE2 LYS 110 HE2 LYS 110 11.396 -6.885 -1.764 908 HE3 LYS 110 HE1 LYS 110 11.137 -8.629 -1.821 909 HZ1 LYS 110 HZ1 LYS 110 13.246 -7.025 -3.019 910 HZ2 LYS 110 HZ2 LYS 110 12.670 -8.309 -3.958 911 HZ3 LYS 110 HZ3 LYS 110 13.296 -8.605 -2.415 912 H VAL 111 HN VAL 111 9.240 -2.781 -4.619 913 HA VAL 111 HA VAL 111 6.550 -2.451 -5.552 914 HB VAL 111 HB VAL 111 9.218 -1.701 -6.745 915 HG11 VAL 111 HG11 VAL 111 7.948 -0.372 -8.384 916 HG12 VAL 111 HG12 VAL 111 6.457 -1.114 -7.803 917 HG13 VAL 111 HG13 VAL 111 7.692 -2.106 -8.577 918 HG21 VAL 111 HG21 VAL 111 7.011 -0.018 -5.568 919 HG22 VAL 111 HG22 VAL 111 8.562 0.562 -6.176 920 HG23 VAL 111 HG23 VAL 111 8.505 -0.465 -4.744 921 H ALA 112 HN ALA 112 5.529 -4.177 -6.367 922 HA ALA 112 HA ALA 112 6.764 -5.557 -8.628 923 HB1 ALA 112 HB1 ALA 112 6.708 -7.661 -7.768 924 HB2 ALA 112 HB2 ALA 112 5.355 -7.307 -6.694 925 HB3 ALA 112 HB3 ALA 112 6.981 -6.768 -6.271 926 H TYR 113 HN TYR 113 5.190 -6.851 -9.864 927 HA TYR 113 HA TYR 113 3.252 -6.995 -11.045 928 HB2 TYR 113 HB2 TYR 113 2.167 -6.613 -8.256 929 HB3 TYR 113 HB1 TYR 113 1.130 -6.928 -9.643 930 HD1 TYR 113 HD2 TYR 113 3.945 -8.329 -7.674 931 HD2 TYR 113 HD1 TYR 113 0.785 -9.123 -10.407 932 HE1 TYR 113 HE2 TYR 113 4.313 -10.744 -7.388 933 HE2 TYR 113 HE1 TYR 113 1.142 -11.540 -10.129 934 HH TYR 113 HH TYR 113 3.149 -12.829 -7.663 935 H VAL 114 HN VAL 114 4.292 -4.726 -11.664 936 HA VAL 114 HA VAL 114 2.271 -2.635 -11.217 937 HB VAL 114 HB VAL 114 4.528 -1.978 -10.560 938 HG11 VAL 114 HG11 VAL 114 5.700 -1.777 -13.197 939 HG12 VAL 114 HG12 VAL 114 5.341 -3.449 -12.768 940 HG13 VAL 114 HG13 VAL 114 6.362 -2.470 -11.716 941 HG21 VAL 114 HG21 VAL 114 4.720 0.077 -11.914 942 HG22 VAL 114 HG22 VAL 114 3.064 -0.246 -11.401 943 HG23 VAL 114 HG23 VAL 114 3.557 -0.593 -13.058 944 H TYR 115 HN TYR 115 0.766 -3.081 -12.768 945 HA TYR 115 HA TYR 115 1.675 -3.314 -15.547 946 HB2 TYR 115 HB2 TYR 115 -0.797 -3.929 -15.920 947 HB3 TYR 115 HB1 TYR 115 0.215 -5.090 -15.071 948 HD1 TYR 115 HD2 TYR 115 -1.875 -2.125 -14.200 949 HD2 TYR 115 HD1 TYR 115 -0.772 -6.120 -13.262 950 HE1 TYR 115 HE2 TYR 115 -3.470 -2.115 -12.326 951 HE2 TYR 115 HE1 TYR 115 -2.361 -6.127 -11.385 952 HH TYR 115 HH TYR 115 -3.439 -4.328 -9.878 953 H LYS 116 HN LYS 116 0.575 -2.107 -17.209 954 HA LYS 116 HA LYS 116 -0.213 0.557 -16.267 955 HB2 LYS 116 HB2 LYS 116 0.521 -0.211 -19.088 956 HB3 LYS 116 HB1 LYS 116 0.487 1.398 -18.383 957 HG2 LYS 116 HG2 LYS 116 2.428 -0.801 -17.716 958 HG3 LYS 116 HG1 LYS 116 2.765 0.651 -18.659 959 HD2 LYS 116 HD2 LYS 116 1.660 0.986 -15.918 960 HD3 LYS 116 HD1 LYS 116 3.346 0.491 -16.078 961 HE2 LYS 116 HE2 LYS 116 3.033 2.951 -15.912 962 HE3 LYS 116 HE1 LYS 116 3.859 2.434 -17.382 963 HZ1 LYS 116 HZ1 LYS 116 1.909 2.774 -18.648 964 HZ2 LYS 116 HZ2 LYS 116 2.096 4.158 -17.692 965 HZ3 LYS 116 HZ3 LYS 116 0.949 2.988 -17.270 966 HA PRO 117 HA PRO 117 -0.884 2.321 -17.638 967 HB2 PRO 117 HB2 PRO 117 -3.300 3.816 -17.501 968 HB3 PRO 117 HB1 PRO 117 -2.214 3.655 -18.881 969 HG2 PRO 117 HG2 PRO 117 -4.809 2.667 -18.749 970 HG3 PRO 117 HG1 PRO 117 -3.568 2.146 -19.900 971 HD2 PRO 117 HD2 PRO 117 -4.469 0.852 -17.364 972 HD3 PRO 117 HD1 PRO 117 -3.964 0.107 -18.896 973 H ASN 118 HN ASN 118 -0.082 2.334 -15.602 974 HA ASN 118 HA ASN 118 -1.670 3.536 -13.521 975 HB2 ASN 118 HB2 ASN 118 -0.511 0.786 -13.025 976 HB3 ASN 118 HB1 ASN 118 -1.418 1.770 -11.882 977 HD21 ASN 118 HD21 ASN 118 -1.618 -0.071 -14.854 978 HD22 ASN 118 HD22 ASN 118 -3.322 -0.355 -14.786 979 H ASN 119 HN ASN 119 -0.294 5.117 -12.988 980 HA ASN 119 HA ASN 119 2.317 4.395 -11.955 981 HB2 ASN 119 HB2 ASN 119 3.352 6.304 -13.349 982 HB3 ASN 119 HB1 ASN 119 3.061 4.763 -14.148 983 HD21 ASN 119 HD21 ASN 119 1.641 4.650 -15.806 984 HD22 ASN 119 HD22 ASN 119 0.818 6.019 -16.467 985 H THR 120 HN THR 120 -0.136 5.442 -10.837 986 HA THR 120 HA THR 120 -0.093 8.190 -10.379 987 HB THR 120 HB THR 120 -0.900 6.297 -8.203 988 HG1 THR 120 HG1 THR 120 -1.875 5.223 -9.764 989 HG21 THR 120 HG21 THR 120 -2.998 7.947 -8.671 990 HG22 THR 120 HG22 THR 120 -1.632 8.990 -9.070 991 HG23 THR 120 HG23 THR 120 -1.730 8.237 -7.479 992 H HIS 121 HN HIS 121 1.440 5.566 -8.541 993 HA HIS 121 HA HIS 121 3.175 7.591 -7.283 994 HB2 HIS 121 HB2 HIS 121 1.736 5.267 -6.088 995 HB3 HIS 121 HB1 HIS 121 3.321 5.681 -5.445 996 HD1 HIS 121 HD1 HIS 121 3.050 8.782 -5.621 997 HD2 HIS 121 HD2 HIS 121 0.181 6.221 -4.046 998 HE1 HIS 121 HE1 HIS 121 1.678 10.191 -4.054 999 HE2 HIS 121 HE2 HIS 121 0.002 8.602 -3.050 1000 H GLU 122 HN GLU 122 3.406 5.725 -9.707 1001 HA GLU 122 HA GLU 122 5.302 3.733 -9.163 1002 HB2 GLU 122 HB2 GLU 122 4.074 3.836 -11.273 1003 HB3 GLU 122 HB1 GLU 122 4.886 5.337 -11.692 1004 HG2 GLU 122 HG2 GLU 122 6.638 3.049 -11.087 1005 HG3 GLU 122 HG1 GLU 122 5.666 2.920 -12.552 1006 H GLN 123 HN GLN 123 5.790 7.046 -10.385 1007 HA GLN 123 HA GLN 123 8.585 6.993 -10.398 1008 HB2 GLN 123 HB2 GLN 123 6.725 9.340 -9.978 1009 HB3 GLN 123 HB1 GLN 123 8.437 9.468 -10.356 1010 HG2 GLN 123 HG2 GLN 123 6.585 7.958 -12.154 1011 HG3 GLN 123 HG1 GLN 123 6.711 9.715 -12.249 1012 HE21 GLN 123 HE21 GLN 123 8.520 6.713 -12.489 1013 HE22 GLN 123 HE22 GLN 123 9.773 7.331 -13.505 1014 H LEU 124 HN LEU 124 6.329 7.384 -7.791 1015 HA LEU 124 HA LEU 124 8.276 8.448 -5.945 1016 HB2 LEU 124 HB2 LEU 124 5.961 9.097 -5.704 1017 HB3 LEU 124 HB1 LEU 124 5.466 7.423 -5.559 1018 HG LEU 124 HG LEU 124 7.090 7.476 -3.467 1019 HD11 LEU 124 HD11 LEU 124 6.834 9.691 -2.325 1020 HD12 LEU 124 HD12 LEU 124 6.308 10.355 -3.872 1021 HD13 LEU 124 HD13 LEU 124 7.932 9.688 -3.705 1022 HD21 LEU 124 HD21 LEU 124 4.709 6.943 -3.416 1023 HD22 LEU 124 HD22 LEU 124 4.317 8.661 -3.468 1024 HD23 LEU 124 HD23 LEU 124 5.156 7.991 -2.069 1025 H LEU 125 HN LEU 125 6.695 5.341 -6.539 1026 HA LEU 125 HA LEU 125 8.030 4.040 -4.350 1027 HB2 LEU 125 HB2 LEU 125 6.085 3.284 -6.445 1028 HB3 LEU 125 HB1 LEU 125 7.102 1.993 -5.837 1029 HG LEU 125 HG LEU 125 6.296 3.021 -3.496 1030 HD11 LEU 125 HD11 LEU 125 3.887 3.412 -5.248 1031 HD12 LEU 125 HD12 LEU 125 4.939 4.738 -4.755 1032 HD13 LEU 125 HD13 LEU 125 4.072 3.801 -3.539 1033 HD21 LEU 125 HD21 LEU 125 5.902 0.798 -3.639 1034 HD22 LEU 125 HD22 LEU 125 5.265 0.903 -5.279 1035 HD23 LEU 125 HD23 LEU 125 4.249 1.348 -3.908 1036 H ARG 126 HN ARG 126 8.600 4.460 -7.771 1037 HA ARG 126 HA ARG 126 10.382 2.378 -8.252 1038 HB2 ARG 126 HB2 ARG 126 9.396 4.104 -9.891 1039 HB3 ARG 126 HB1 ARG 126 10.752 5.123 -9.430 1040 HG2 ARG 126 HG2 ARG 126 12.192 3.061 -10.047 1041 HG3 ARG 126 HG1 ARG 126 10.753 2.537 -10.924 1042 HD2 ARG 126 HD2 ARG 126 10.886 5.052 -11.806 1043 HD3 ARG 126 HD1 ARG 126 12.596 4.796 -11.457 1044 HE ARG 126 HE ARG 126 11.135 3.733 -13.642 1045 HH11 ARG 126 HH11 ARG 126 13.681 2.943 -11.389 1046 HH12 ARG 126 HH12 ARG 126 14.455 1.828 -12.463 1047 HH21 ARG 126 HH21 ARG 126 12.152 2.265 -15.056 1048 HH22 ARG 126 HH22 ARG 126 13.589 1.443 -14.544 1049 H LYS 127 HN LYS 127 10.852 5.422 -6.604 1050 HA LYS 127 HA LYS 127 13.723 5.186 -6.518 1051 HB2 LYS 127 HB2 LYS 127 12.107 6.980 -4.730 1052 HB3 LYS 127 HB1 LYS 127 13.731 7.225 -5.355 1053 HG2 LYS 127 HG2 LYS 127 11.219 7.280 -7.011 1054 HG3 LYS 127 HG1 LYS 127 12.067 8.701 -6.397 1055 HD2 LYS 127 HD2 LYS 127 13.300 8.673 -8.251 1056 HD3 LYS 127 HD1 LYS 127 14.025 7.171 -7.679 1057 HE2 LYS 127 HE2 LYS 127 12.769 5.876 -9.065 1058 HE3 LYS 127 HE1 LYS 127 11.392 6.976 -9.023 1059 HZ1 LYS 127 HZ1 LYS 127 13.015 6.713 -11.117 1060 HZ2 LYS 127 HZ2 LYS 127 13.774 7.999 -10.323 1061 HZ3 LYS 127 HZ3 LYS 127 12.150 8.129 -10.778 1062 H SER 128 HN SER 128 11.108 4.993 -4.109 1063 HA SER 128 HA SER 128 12.624 4.302 -1.898 1064 HB2 SER 128 HB2 SER 128 10.415 4.805 -1.398 1065 HB3 SER 128 HB1 SER 128 9.783 3.801 -2.704 1066 HG SER 128 HG SER 128 10.231 1.981 -1.491 1067 H GLU 129 HN GLU 129 11.271 2.214 -4.413 1068 HA GLU 129 HA GLU 129 11.909 -0.251 -3.239 1069 HB2 GLU 129 HB2 GLU 129 10.390 -0.092 -5.134 1070 HB3 GLU 129 HB1 GLU 129 11.691 0.496 -6.160 1071 HG2 GLU 129 HG2 GLU 129 12.600 -1.929 -5.106 1072 HG3 GLU 129 HG1 GLU 129 10.916 -2.199 -5.551 1073 H ALA 130 HN ALA 130 13.724 1.644 -5.650 1074 HA ALA 130 HA ALA 130 15.955 -0.120 -5.631 1075 HB1 ALA 130 HB1 ALA 130 15.070 1.788 -7.341 1076 HB2 ALA 130 HB2 ALA 130 16.677 1.063 -7.390 1077 HB3 ALA 130 HB3 ALA 130 16.432 2.609 -6.578 1078 H GLN 131 HN GLN 131 15.173 2.859 -3.936 1079 HA GLN 131 HA GLN 131 17.733 3.507 -3.015 1080 HB2 GLN 131 HB2 GLN 131 14.993 4.281 -2.391 1081 HB3 GLN 131 HB1 GLN 131 16.028 4.295 -0.972 1082 HG2 GLN 131 HG2 GLN 131 16.717 6.301 -1.590 1083 HG3 GLN 131 HG1 GLN 131 17.533 5.535 -2.952 1084 HE21 GLN 131 HE21 GLN 131 17.233 6.988 -4.525 1085 HE22 GLN 131 HE22 GLN 131 15.693 7.535 -5.087 1086 H ALA 132 HN ALA 132 15.158 1.682 -1.374 1087 HA ALA 132 HA ALA 132 16.798 0.970 0.840 1088 HB1 ALA 132 HB1 ALA 132 14.901 -0.721 1.230 1089 HB2 ALA 132 HB2 ALA 132 14.113 0.067 -0.137 1090 HB3 ALA 132 HB3 ALA 132 14.516 0.998 1.304 1091 H LYS 133 HN LYS 133 16.319 -0.366 -2.315 1092 HA LYS 133 HA LYS 133 17.049 -3.039 -1.824 1093 HB2 LYS 133 HB2 LYS 133 16.338 -1.498 -4.048 1094 HB3 LYS 133 HB1 LYS 133 17.954 -2.085 -4.409 1095 HG2 LYS 133 HG2 LYS 133 17.233 -4.157 -4.780 1096 HG3 LYS 133 HG1 LYS 133 16.232 -4.160 -3.327 1097 HD2 LYS 133 HD2 LYS 133 14.607 -2.701 -4.635 1098 HD3 LYS 133 HD1 LYS 133 15.541 -3.137 -6.069 1099 HE2 LYS 133 HE2 LYS 133 15.169 -5.579 -5.134 1100 HE3 LYS 133 HE1 LYS 133 13.781 -4.819 -4.356 1101 HZ1 LYS 133 HZ1 LYS 133 14.154 -4.251 -7.186 1102 HZ2 LYS 133 HZ2 LYS 133 12.730 -4.523 -6.315 1103 HZ3 LYS 133 HZ3 LYS 133 13.688 -5.830 -6.796 1104 H LYS 134 HN LYS 134 19.012 -0.307 -2.993 1105 HA LYS 134 HA LYS 134 21.454 -1.591 -3.177 1106 HB2 LYS 134 HB2 LYS 134 21.219 0.600 -4.078 1107 HB3 LYS 134 HB1 LYS 134 20.768 1.269 -2.517 1108 HG2 LYS 134 HG2 LYS 134 23.042 0.805 -1.692 1109 HG3 LYS 134 HG1 LYS 134 23.481 0.224 -3.300 1110 HD2 LYS 134 HD2 LYS 134 22.377 2.980 -2.808 1111 HD3 LYS 134 HD1 LYS 134 24.104 2.623 -2.760 1112 HE2 LYS 134 HE2 LYS 134 24.254 2.557 -4.988 1113 HE3 LYS 134 HE1 LYS 134 22.808 1.558 -5.136 1114 HZ1 LYS 134 HZ1 LYS 134 23.098 4.437 -5.334 1115 HZ2 LYS 134 HZ2 LYS 134 21.730 3.904 -4.496 1116 HZ3 LYS 134 HZ3 LYS 134 21.992 3.405 -6.090 1117 H GLU 135 HN GLU 135 19.798 -0.401 -0.341 1118 HA GLU 135 HA GLU 135 22.134 -1.050 1.316 1119 HB2 GLU 135 HB2 GLU 135 20.264 0.023 3.038 1120 HB3 GLU 135 HB1 GLU 135 21.603 0.894 2.297 1121 HG2 GLU 135 HG2 GLU 135 20.204 1.750 0.582 1122 HG3 GLU 135 HG1 GLU 135 18.881 0.678 1.040 1123 H LYS 136 HN LYS 136 19.340 -2.511 0.256 1124 HA LYS 136 HA LYS 136 17.953 -4.143 1.074 1125 HB2 LYS 136 HB2 LYS 136 20.596 -5.038 2.241 1126 HB3 LYS 136 HB1 LYS 136 19.185 -6.063 2.006 1127 HG2 LYS 136 HG2 LYS 136 19.349 -5.427 -0.458 1128 HG3 LYS 136 HG1 LYS 136 20.958 -4.822 -0.065 1129 HD2 LYS 136 HD2 LYS 136 21.577 -6.938 -0.571 1130 HD3 LYS 136 HD1 LYS 136 21.060 -7.263 1.085 1131 HE2 LYS 136 HE2 LYS 136 19.234 -8.412 0.429 1132 HE3 LYS 136 HE1 LYS 136 18.925 -7.340 -0.937 1133 HZ1 LYS 136 HZ1 LYS 136 20.436 -8.489 -2.269 1134 HZ2 LYS 136 HZ2 LYS 136 19.609 -9.715 -1.449 1135 HZ3 LYS 136 HZ3 LYS 136 21.166 -9.271 -0.957 1136 H LEU 137 HN LEU 137 17.105 -2.327 2.453 1137 HA LEU 137 HA LEU 137 17.726 -1.857 5.065 1138 HB2 LEU 137 HB2 LEU 137 15.276 -1.592 3.435 1139 HB3 LEU 137 HB1 LEU 137 15.058 -1.529 5.175 1140 HG LEU 137 HG LEU 137 16.819 0.276 3.521 1141 HD11 LEU 137 HD11 LEU 137 15.068 1.847 4.893 1142 HD12 LEU 137 HD12 LEU 137 14.073 0.440 4.522 1143 HD13 LEU 137 HD13 LEU 137 14.865 1.328 3.220 1144 HD21 LEU 137 HD21 LEU 137 16.500 -0.052 6.482 1145 HD22 LEU 137 HD22 LEU 137 16.961 1.500 5.782 1146 HD23 LEU 137 HD23 LEU 137 17.978 0.081 5.530 1147 H ASN 138 HN ASN 138 14.625 -3.500 4.672 1148 HA ASN 138 HA ASN 138 15.152 -4.988 7.080 1149 HB2 ASN 138 HB2 ASN 138 12.712 -4.796 5.317 1150 HB3 ASN 138 HB1 ASN 138 12.782 -5.774 6.780 1151 HD21 ASN 138 HD21 ASN 138 11.279 -3.288 5.923 1152 HD22 ASN 138 HD22 ASN 138 11.506 -2.186 7.232 1153 H ILE 139 HN ILE 139 13.133 -6.723 4.912 1154 HA ILE 139 HA ILE 139 15.064 -8.903 4.911 1155 HB ILE 139 HB ILE 139 13.186 -10.307 4.166 1156 HG12 ILE 139 HG12 ILE 139 11.280 -8.058 4.651 1157 HG13 ILE 139 HG11 ILE 139 12.079 -8.151 3.085 1158 HG21 ILE 139 HG21 ILE 139 12.093 -8.777 6.467 1159 HG22 ILE 139 HG22 ILE 139 13.694 -9.499 6.627 1160 HG23 ILE 139 HG23 ILE 139 12.301 -10.516 6.260 1161 HD11 ILE 139 HD11 ILE 139 10.607 -10.481 4.261 1162 HD12 ILE 139 HD12 ILE 139 11.090 -10.214 2.586 1163 HD13 ILE 139 HD13 ILE 139 9.803 -9.242 3.298 1164 H TRP 140 HN TRP 140 15.753 -6.843 3.136 1165 HA TRP 140 HA TRP 140 14.872 -7.423 0.486 1166 HB2 TRP 140 HB2 TRP 140 17.300 -5.926 1.483 1167 HB3 TRP 140 HB1 TRP 140 16.779 -5.976 -0.199 1168 HD1 TRP 140 HD1 TRP 140 15.671 -4.641 3.221 1169 HE1 TRP 140 HE1 TRP 140 14.027 -2.701 2.841 1170 HE3 TRP 140 HE3 TRP 140 15.199 -4.967 -1.852 1171 HZ2 TRP 140 HZ2 TRP 140 12.718 -1.468 0.686 1172 HZ3 TRP 140 HZ3 TRP 140 13.725 -3.365 -3.002 1173 HH2 TRP 140 HH2 TRP 140 12.507 -1.651 -1.759 Start of MODEL 5 1 H1 ALA 1 HT1 ALA 1 -7.978 32.769 1.229 2 H2 ALA 1 HT2 ALA 1 -7.919 31.227 1.982 3 H3 ALA 1 HT3 ALA 1 -7.540 32.639 2.882 4 HA ALA 1 HA ALA 1 -9.681 33.344 2.961 5 HB1 ALA 1 HB1 ALA 1 -10.184 31.424 0.697 6 HB2 ALA 1 HB2 ALA 1 -10.286 33.184 0.667 7 HB3 ALA 1 HB3 ALA 1 -11.469 32.247 1.580 8 H THR 2 HN THR 2 -11.725 32.160 3.772 9 HA THR 2 HA THR 2 -10.817 29.853 5.352 10 HB THR 2 HB THR 2 -12.779 30.448 6.831 11 HG1 THR 2 HG1 THR 2 -13.987 31.692 5.430 12 HG21 THR 2 HG21 THR 2 -11.064 32.867 6.675 13 HG22 THR 2 HG22 THR 2 -10.322 31.316 7.071 14 HG23 THR 2 HG23 THR 2 -11.618 31.958 8.082 15 H SER 3 HN SER 3 -11.761 29.648 2.610 16 HA SER 3 HA SER 3 -14.420 28.502 2.795 17 HB2 SER 3 HB2 SER 3 -12.777 28.180 0.333 18 HB3 SER 3 HB1 SER 3 -14.483 28.592 0.504 19 HG SER 3 HG SER 3 -13.879 30.683 1.078 20 H THR 4 HN THR 4 -14.518 26.351 1.300 21 HA THR 4 HA THR 4 -12.970 24.400 2.814 22 HB THR 4 HB THR 4 -15.321 23.958 2.722 23 HG1 THR 4 HG1 THR 4 -14.079 22.235 0.849 24 HG21 THR 4 HG21 THR 4 -16.231 25.053 0.911 25 HG22 THR 4 HG22 THR 4 -16.314 23.361 0.418 26 HG23 THR 4 HG23 THR 4 -15.038 24.402 -0.214 27 H LYS 5 HN LYS 5 -13.405 25.546 -0.474 28 HA LYS 5 HA LYS 5 -12.221 25.212 -2.387 29 HB2 LYS 5 HB2 LYS 5 -10.290 24.920 -0.216 30 HB3 LYS 5 HB1 LYS 5 -9.823 24.033 -1.660 31 HG2 LYS 5 HG2 LYS 5 -10.726 26.625 -2.429 32 HG3 LYS 5 HG1 LYS 5 -9.545 26.788 -1.129 33 HD2 LYS 5 HD2 LYS 5 -8.148 26.745 -2.945 34 HD3 LYS 5 HD1 LYS 5 -8.217 25.023 -2.566 35 HE2 LYS 5 HE2 LYS 5 -8.755 24.788 -4.732 36 HE3 LYS 5 HE1 LYS 5 -10.362 25.293 -4.211 37 HZ1 LYS 5 HZ1 LYS 5 -10.064 26.828 -5.809 38 HZ2 LYS 5 HZ2 LYS 5 -8.376 26.738 -5.759 39 HZ3 LYS 5 HZ3 LYS 5 -9.208 27.655 -4.607 40 H LYS 6 HN LYS 6 -11.452 23.568 -3.873 41 HA LYS 6 HA LYS 6 -12.699 21.003 -3.317 42 HB2 LYS 6 HB2 LYS 6 -12.810 22.430 -5.521 43 HB3 LYS 6 HB1 LYS 6 -11.285 21.630 -5.880 44 HG2 LYS 6 HG2 LYS 6 -12.275 19.676 -6.335 45 HG3 LYS 6 HG1 LYS 6 -13.407 19.821 -4.989 46 HD2 LYS 6 HD2 LYS 6 -14.647 19.845 -7.049 47 HD3 LYS 6 HD1 LYS 6 -14.707 21.458 -6.333 48 HE2 LYS 6 HE2 LYS 6 -14.304 21.760 -8.649 49 HE3 LYS 6 HE1 LYS 6 -12.776 22.071 -7.826 50 HZ1 LYS 6 HZ1 LYS 6 -11.890 20.600 -9.210 51 HZ2 LYS 6 HZ2 LYS 6 -13.400 20.101 -9.785 52 HZ3 LYS 6 HZ3 LYS 6 -12.745 19.387 -8.398 53 H LEU 7 HN LEU 7 -11.480 19.041 -4.300 54 HA LEU 7 HA LEU 7 -8.616 19.165 -3.687 55 HB2 LEU 7 HB2 LEU 7 -10.689 17.572 -2.294 56 HB3 LEU 7 HB1 LEU 7 -9.184 16.750 -2.651 57 HG LEU 7 HG LEU 7 -8.227 19.029 -1.548 58 HD11 LEU 7 HD11 LEU 7 -10.530 19.826 -1.094 59 HD12 LEU 7 HD12 LEU 7 -9.547 19.646 0.360 60 HD13 LEU 7 HD13 LEU 7 -10.765 18.434 -0.038 61 HD21 LEU 7 HD21 LEU 7 -7.496 17.676 0.127 62 HD22 LEU 7 HD22 LEU 7 -8.051 16.437 -0.998 63 HD23 LEU 7 HD23 LEU 7 -9.072 16.918 0.357 64 H HIS 8 HN HIS 8 -7.846 16.633 -4.060 65 HA HIS 8 HA HIS 8 -8.883 15.889 -6.712 66 HB2 HIS 8 HB2 HIS 8 -6.472 17.019 -6.407 67 HB3 HIS 8 HB1 HIS 8 -6.027 15.348 -6.079 68 HD1 HIS 8 HD1 HIS 8 -6.684 17.679 -8.805 69 HD2 HIS 8 HD2 HIS 8 -6.654 13.555 -8.296 70 HE1 HIS 8 HE1 HIS 8 -6.586 16.716 -11.126 71 HE2 HIS 8 HE2 HIS 8 -6.479 14.221 -10.789 72 H LYS 9 HN LYS 9 -7.558 14.879 -3.641 73 HA LYS 9 HA LYS 9 -8.026 12.080 -4.350 74 HB2 LYS 9 HB2 LYS 9 -6.422 13.316 -2.110 75 HB3 LYS 9 HB1 LYS 9 -6.712 11.588 -2.267 76 HG2 LYS 9 HG2 LYS 9 -4.655 11.767 -3.243 77 HG3 LYS 9 HG1 LYS 9 -5.698 11.945 -4.655 78 HD2 LYS 9 HD2 LYS 9 -5.553 14.500 -4.009 79 HD3 LYS 9 HD1 LYS 9 -4.056 13.982 -3.233 80 HE2 LYS 9 HE2 LYS 9 -3.310 13.008 -5.363 81 HE3 LYS 9 HE1 LYS 9 -4.796 13.570 -6.128 82 HZ1 LYS 9 HZ1 LYS 9 -3.237 15.587 -4.731 83 HZ2 LYS 9 HZ2 LYS 9 -4.062 15.683 -6.206 84 HZ3 LYS 9 HZ3 LYS 9 -2.535 14.957 -6.136 85 H GLU 10 HN GLU 10 -8.984 10.700 -2.659 86 HA GLU 10 HA GLU 10 -10.980 12.179 -1.075 87 HB2 GLU 10 HB2 GLU 10 -11.542 10.534 -3.168 88 HB3 GLU 10 HB1 GLU 10 -11.623 9.401 -1.827 89 HG2 GLU 10 HG2 GLU 10 -13.552 10.235 -1.089 90 HG3 GLU 10 HG1 GLU 10 -13.024 11.902 -1.310 91 HA PRO 11 HA PRO 11 -9.117 9.959 2.313 92 HB2 PRO 11 HB2 PRO 11 -10.620 10.934 4.300 93 HB3 PRO 11 HB1 PRO 11 -9.458 11.954 3.441 94 HG2 PRO 11 HG2 PRO 11 -12.426 11.775 3.115 95 HG3 PRO 11 HG1 PRO 11 -11.385 13.209 3.125 96 HD2 PRO 11 HD2 PRO 11 -12.338 11.988 0.844 97 HD3 PRO 11 HD1 PRO 11 -10.880 12.997 0.907 98 H ALA 12 HN ALA 12 -9.752 8.445 4.031 99 HA ALA 12 HA ALA 12 -12.382 7.353 4.090 100 HB1 ALA 12 HB1 ALA 12 -11.979 6.194 2.139 101 HB2 ALA 12 HB2 ALA 12 -11.462 5.026 3.356 102 HB3 ALA 12 HB3 ALA 12 -10.263 5.988 2.493 103 H THR 13 HN THR 13 -12.422 5.299 5.451 104 HA THR 13 HA THR 13 -10.310 5.447 7.502 105 HB THR 13 HB THR 13 -13.022 4.473 8.240 106 HG1 THR 13 HG1 THR 13 -12.422 7.228 7.958 107 HG21 THR 13 HG21 THR 13 -11.000 6.212 9.628 108 HG22 THR 13 HG22 THR 13 -11.340 4.513 9.954 109 HG23 THR 13 HG23 THR 13 -12.561 5.736 10.297 110 H LEU 14 HN LEU 14 -10.079 3.428 8.798 111 HA LEU 14 HA LEU 14 -10.103 1.137 6.995 112 HB2 LEU 14 HB2 LEU 14 -8.293 2.079 8.897 113 HB3 LEU 14 HB1 LEU 14 -8.985 0.643 9.626 114 HG LEU 14 HG LEU 14 -6.870 0.272 8.326 115 HD11 LEU 14 HD11 LEU 14 -9.417 -1.184 7.970 116 HD12 LEU 14 HD12 LEU 14 -7.880 -1.726 8.644 117 HD13 LEU 14 HD13 LEU 14 -8.089 -1.625 6.896 118 HD21 LEU 14 HD21 LEU 14 -7.972 1.853 6.437 119 HD22 LEU 14 HD22 LEU 14 -8.364 0.260 5.791 120 HD23 LEU 14 HD23 LEU 14 -6.687 0.689 6.121 121 H ILE 15 HN ILE 15 -11.923 -0.019 6.996 122 HA ILE 15 HA ILE 15 -13.709 -0.152 9.206 123 HB ILE 15 HB ILE 15 -13.578 -2.033 6.846 124 HG12 ILE 15 HG12 ILE 15 -13.701 0.354 6.159 125 HG13 ILE 15 HG11 ILE 15 -15.146 -0.555 5.728 126 HG21 ILE 15 HG21 ILE 15 -14.957 -2.778 8.749 127 HG22 ILE 15 HG22 ILE 15 -15.913 -2.453 7.303 128 HG23 ILE 15 HG23 ILE 15 -15.893 -1.288 8.627 129 HD11 ILE 15 HD11 ILE 15 -16.088 0.359 7.954 130 HD12 ILE 15 HD12 ILE 15 -16.004 1.419 6.547 131 HD13 ILE 15 HD13 ILE 15 -14.787 1.543 7.818 132 H LYS 16 HN LYS 16 -11.211 -2.283 7.912 133 HA LYS 16 HA LYS 16 -10.711 -3.457 10.440 134 HB2 LYS 16 HB2 LYS 16 -12.677 -4.757 8.730 135 HB3 LYS 16 HB1 LYS 16 -11.329 -5.819 9.109 136 HG2 LYS 16 HG2 LYS 16 -11.968 -4.645 11.536 137 HG3 LYS 16 HG1 LYS 16 -13.529 -4.952 10.772 138 HD2 LYS 16 HD2 LYS 16 -12.267 -7.281 10.250 139 HD3 LYS 16 HD1 LYS 16 -11.499 -6.842 11.778 140 HE2 LYS 16 HE2 LYS 16 -13.279 -7.827 12.720 141 HE3 LYS 16 HE1 LYS 16 -14.120 -6.331 12.314 142 HZ1 LYS 16 HZ1 LYS 16 -15.397 -8.189 11.550 143 HZ2 LYS 16 HZ2 LYS 16 -14.076 -8.828 10.709 144 HZ3 LYS 16 HZ3 LYS 16 -14.781 -7.378 10.199 145 H ALA 17 HN ALA 17 -8.635 -4.029 10.464 146 HA ALA 17 HA ALA 17 -7.130 -4.022 8.029 147 HB1 ALA 17 HB1 ALA 17 -6.030 -4.779 10.712 148 HB2 ALA 17 HB2 ALA 17 -6.397 -3.103 10.306 149 HB3 ALA 17 HB3 ALA 17 -5.210 -4.000 9.360 150 H ILE 18 HN ILE 18 -6.636 -5.727 6.811 151 HA ILE 18 HA ILE 18 -7.337 -8.390 7.751 152 HB ILE 18 HB ILE 18 -6.124 -7.883 5.064 153 HG12 ILE 18 HG12 ILE 18 -8.176 -6.295 5.820 154 HG13 ILE 18 HG11 ILE 18 -7.929 -6.843 4.171 155 HG21 ILE 18 HG21 ILE 18 -8.199 -9.809 6.087 156 HG22 ILE 18 HG22 ILE 18 -6.515 -10.169 5.706 157 HG23 ILE 18 HG23 ILE 18 -7.633 -9.718 4.419 158 HD11 ILE 18 HD11 ILE 18 -10.248 -7.079 4.867 159 HD12 ILE 18 HD12 ILE 18 -9.750 -8.122 6.199 160 HD13 ILE 18 HD13 ILE 18 -9.522 -8.651 4.532 161 H ASP 19 HN ASP 19 -4.570 -7.251 5.819 162 HA ASP 19 HA ASP 19 -2.740 -8.448 7.756 163 HB2 ASP 19 HB2 ASP 19 -3.227 -9.507 5.011 164 HB3 ASP 19 HB1 ASP 19 -1.574 -9.515 5.619 165 H GLY 20 HN GLY 20 -1.767 -7.875 4.454 166 HA2 GLY 20 HA2 GLY 20 -0.587 -5.294 5.264 167 HA3 GLY 20 HA1 GLY 20 0.372 -6.511 4.429 168 H ASP 21 HN ASP 21 -0.379 -7.175 2.276 169 HA ASP 21 HA ASP 21 -0.890 -4.946 0.628 170 HB2 ASP 21 HB2 ASP 21 -0.649 -7.891 0.209 171 HB3 ASP 21 HB1 ASP 21 -1.363 -6.922 -1.076 172 H THR 22 HN THR 22 -2.973 -6.855 2.490 173 HA THR 22 HA THR 22 -5.286 -5.905 0.940 174 HB THR 22 HB THR 22 -5.675 -8.300 2.629 175 HG1 THR 22 HG1 THR 22 -4.037 -8.314 0.328 176 HG21 THR 22 HG21 THR 22 -6.653 -8.980 0.251 177 HG22 THR 22 HG22 THR 22 -6.701 -7.225 0.079 178 HG23 THR 22 HG23 THR 22 -7.552 -8.004 1.413 179 H VAL 23 HN VAL 23 -6.705 -4.703 2.040 180 HA VAL 23 HA VAL 23 -7.039 -4.976 4.899 181 HB VAL 23 HB VAL 23 -6.598 -2.593 5.379 182 HG11 VAL 23 HG11 VAL 23 -4.295 -2.827 5.671 183 HG12 VAL 23 HG12 VAL 23 -4.108 -3.774 4.195 184 HG13 VAL 23 HG13 VAL 23 -4.883 -4.488 5.610 185 HG21 VAL 23 HG21 VAL 23 -4.939 -1.643 3.477 186 HG22 VAL 23 HG22 VAL 23 -6.665 -1.284 3.539 187 HG23 VAL 23 HG23 VAL 23 -6.066 -2.561 2.479 188 H LYS 24 HN LYS 24 -8.981 -4.086 5.651 189 HA LYS 24 HA LYS 24 -10.901 -3.480 3.555 190 HB2 LYS 24 HB2 LYS 24 -11.376 -5.070 5.473 191 HB3 LYS 24 HB1 LYS 24 -11.432 -3.660 6.520 192 HG2 LYS 24 HG2 LYS 24 -13.666 -4.207 5.951 193 HG3 LYS 24 HG1 LYS 24 -13.240 -2.744 5.059 194 HD2 LYS 24 HD2 LYS 24 -14.434 -4.230 3.592 195 HD3 LYS 24 HD1 LYS 24 -12.747 -4.156 3.079 196 HE2 LYS 24 HE2 LYS 24 -13.602 -6.448 3.030 197 HE3 LYS 24 HE1 LYS 24 -12.298 -6.269 4.203 198 HZ1 LYS 24 HZ1 LYS 24 -13.834 -6.286 5.979 199 HZ2 LYS 24 HZ2 LYS 24 -14.273 -7.572 4.972 200 HZ3 LYS 24 HZ3 LYS 24 -15.165 -6.135 4.943 201 H LEU 25 HN LEU 25 -11.707 -1.504 3.119 202 HA LEU 25 HA LEU 25 -11.177 0.660 5.035 203 HB2 LEU 25 HB2 LEU 25 -10.072 0.343 2.416 204 HB3 LEU 25 HB1 LEU 25 -11.102 1.761 2.432 205 HG LEU 25 HG LEU 25 -9.440 1.775 4.773 206 HD11 LEU 25 HD11 LEU 25 -8.124 0.405 2.860 207 HD12 LEU 25 HD12 LEU 25 -7.337 1.437 4.053 208 HD13 LEU 25 HD13 LEU 25 -7.675 2.058 2.437 209 HD21 LEU 25 HD21 LEU 25 -8.588 3.843 3.279 210 HD22 LEU 25 HD22 LEU 25 -10.081 3.865 4.219 211 HD23 LEU 25 HD23 LEU 25 -10.131 3.510 2.492 212 H MET 26 HN MET 26 -12.578 2.516 4.830 213 HA MET 26 HA MET 26 -15.279 1.717 4.133 214 HB2 MET 26 HB2 MET 26 -14.572 2.963 6.270 215 HB3 MET 26 HB1 MET 26 -14.463 4.391 5.251 216 HG2 MET 26 HG2 MET 26 -16.733 4.478 4.891 217 HG3 MET 26 HG1 MET 26 -16.961 2.765 5.238 218 HE1 MET 26 HE1 MET 26 -18.546 5.539 6.344 219 HE2 MET 26 HE2 MET 26 -18.992 4.945 7.944 220 HE3 MET 26 HE3 MET 26 -19.169 3.899 6.534 221 H TYR 27 HN TYR 27 -16.090 2.082 2.195 222 HA TYR 27 HA TYR 27 -15.336 4.537 0.763 223 HB2 TYR 27 HB2 TYR 27 -14.182 2.506 -0.174 224 HB3 TYR 27 HB1 TYR 27 -15.771 1.858 -0.564 225 HD1 TYR 27 HD1 TYR 27 -14.486 5.333 -0.901 226 HD2 TYR 27 HD2 TYR 27 -15.858 1.836 -2.892 227 HE1 TYR 27 HE1 TYR 27 -14.440 6.544 -3.042 228 HE2 TYR 27 HE2 TYR 27 -15.816 3.033 -5.039 229 HH TYR 27 HH TYR 27 -14.241 5.425 -5.782 230 H LYS 28 HN LYS 28 -17.060 5.755 0.382 231 HA LYS 28 HA LYS 28 -19.206 6.419 0.032 232 HB2 LYS 28 HB2 LYS 28 -19.349 3.662 -1.188 233 HB3 LYS 28 HB1 LYS 28 -20.628 4.862 -1.317 234 HG2 LYS 28 HG2 LYS 28 -19.221 6.333 -2.569 235 HG3 LYS 28 HG1 LYS 28 -17.817 5.300 -2.290 236 HD2 LYS 28 HD2 LYS 28 -18.392 3.872 -3.930 237 HD3 LYS 28 HD1 LYS 28 -20.108 3.938 -3.520 238 HE2 LYS 28 HE2 LYS 28 -19.992 6.321 -4.541 239 HE3 LYS 28 HE1 LYS 28 -18.511 5.740 -5.299 240 HZ1 LYS 28 HZ1 LYS 28 -21.276 5.018 -5.834 241 HZ2 LYS 28 HZ2 LYS 28 -20.160 3.748 -5.884 242 HZ3 LYS 28 HZ3 LYS 28 -19.952 5.095 -6.885 243 H GLY 29 HN GLY 29 -18.704 5.583 2.591 244 HA2 GLY 29 HA2 GLY 29 -19.776 4.957 4.523 245 HA3 GLY 29 HA1 GLY 29 -21.271 5.091 3.608 246 H GLN 30 HN GLN 30 -18.902 2.915 2.400 247 HA GLN 30 HA GLN 30 -20.220 0.629 3.684 248 HB2 GLN 30 HB2 GLN 30 -20.829 -0.382 1.725 249 HB3 GLN 30 HB1 GLN 30 -20.956 1.293 1.210 250 HG2 GLN 30 HG2 GLN 30 -19.657 0.728 -0.494 251 HG3 GLN 30 HG1 GLN 30 -18.329 0.664 0.661 252 HE21 GLN 30 HE21 GLN 30 -21.094 -1.479 0.093 253 HE22 GLN 30 HE22 GLN 30 -20.154 -2.903 -0.185 254 HA PRO 31 HA PRO 31 -16.088 -0.850 4.025 255 HB2 PRO 31 HB2 PRO 31 -16.497 -3.385 4.663 256 HB3 PRO 31 HB1 PRO 31 -17.142 -2.092 5.687 257 HG2 PRO 31 HG2 PRO 31 -18.561 -3.754 3.638 258 HG3 PRO 31 HG1 PRO 31 -19.091 -3.300 5.268 259 HD2 PRO 31 HD2 PRO 31 -19.838 -1.991 2.946 260 HD3 PRO 31 HD1 PRO 31 -19.875 -1.272 4.569 261 H MET 32 HN MET 32 -14.696 -1.061 2.406 262 HA MET 32 HA MET 32 -15.185 -3.142 0.382 263 HB2 MET 32 HB2 MET 32 -15.359 -0.597 -0.274 264 HB3 MET 32 HB1 MET 32 -13.604 -0.691 -0.277 265 HG2 MET 32 HG2 MET 32 -14.148 -1.107 -2.478 266 HG3 MET 32 HG1 MET 32 -13.933 -2.727 -1.816 267 HE1 MET 32 HE1 MET 32 -17.964 -0.669 -2.179 268 HE2 MET 32 HE2 MET 32 -16.921 -0.376 -3.570 269 HE3 MET 32 HE3 MET 32 -16.379 0.070 -1.953 270 H THR 33 HN THR 33 -13.363 -4.235 -0.416 271 HA THR 33 HA THR 33 -11.175 -4.364 1.482 272 HB THR 33 HB THR 33 -10.570 -6.183 -0.483 273 HG1 THR 33 HG1 THR 33 -13.388 -6.214 -0.228 274 HG21 THR 33 HG21 THR 33 -10.633 -7.463 1.311 275 HG22 THR 33 HG22 THR 33 -12.392 -7.506 1.190 276 HG23 THR 33 HG23 THR 33 -11.605 -6.270 2.172 277 H PHE 34 HN PHE 34 -9.516 -3.036 1.245 278 HA PHE 34 HA PHE 34 -8.743 -2.182 -1.451 279 HB2 PHE 34 HB2 PHE 34 -8.440 -0.994 1.273 280 HB3 PHE 34 HB1 PHE 34 -7.244 -0.590 0.044 281 HD1 PHE 34 HD1 PHE 34 -10.900 -0.608 0.702 282 HD2 PHE 34 HD2 PHE 34 -7.680 1.068 -1.526 283 HE1 PHE 34 HE1 PHE 34 -12.424 1.089 -0.223 284 HE2 PHE 34 HE2 PHE 34 -9.198 2.768 -2.449 285 HZ PHE 34 HZ PHE 34 -11.572 2.780 -1.799 286 H ARG 35 HN ARG 35 -6.480 -2.169 -2.040 287 HA ARG 35 HA ARG 35 -4.855 -4.037 -0.471 288 HB2 ARG 35 HB2 ARG 35 -4.348 -5.385 -2.291 289 HB3 ARG 35 HB1 ARG 35 -6.043 -5.010 -2.565 290 HG2 ARG 35 HG2 ARG 35 -5.248 -4.631 -4.652 291 HG3 ARG 35 HG1 ARG 35 -5.000 -3.022 -3.968 292 HD2 ARG 35 HD2 ARG 35 -2.769 -3.194 -4.085 293 HD3 ARG 35 HD1 ARG 35 -2.773 -4.856 -3.497 294 HE ARG 35 HE ARG 35 -2.726 -3.980 -6.238 295 HH11 ARG 35 HH11 ARG 35 -3.518 -6.604 -4.078 296 HH12 ARG 35 HH12 ARG 35 -3.370 -7.820 -5.301 297 HH21 ARG 35 HH21 ARG 35 -2.531 -5.579 -7.848 298 HH22 ARG 35 HH22 ARG 35 -2.810 -7.238 -7.441 299 H LEU 36 HN LEU 36 -2.631 -3.737 -0.529 300 HA LEU 36 HA LEU 36 -1.749 -1.081 -0.932 301 HB2 LEU 36 HB2 LEU 36 -0.142 -3.617 -0.554 302 HB3 LEU 36 HB1 LEU 36 0.508 -1.988 -0.458 303 HG LEU 36 HG LEU 36 -1.586 -3.133 1.392 304 HD11 LEU 36 HD11 LEU 36 0.144 -3.227 3.053 305 HD12 LEU 36 HD12 LEU 36 1.314 -2.523 1.937 306 HD13 LEU 36 HD13 LEU 36 0.670 -4.138 1.637 307 HD21 LEU 36 HD21 LEU 36 -1.930 -1.075 2.148 308 HD22 LEU 36 HD22 LEU 36 -0.983 -0.468 0.789 309 HD23 LEU 36 HD23 LEU 36 -0.198 -0.796 2.333 310 H LEU 37 HN LEU 37 -2.338 -0.660 -3.107 311 HA LEU 37 HA LEU 37 -1.838 -1.925 -5.410 312 HB2 LEU 37 HB2 LEU 37 -2.695 0.484 -4.924 313 HB3 LEU 37 HB1 LEU 37 -1.033 0.946 -5.235 314 HG LEU 37 HG LEU 37 -1.230 -0.200 -7.467 315 HD11 LEU 37 HD11 LEU 37 -3.698 -1.038 -6.365 316 HD12 LEU 37 HD12 LEU 37 -3.023 -1.401 -7.954 317 HD13 LEU 37 HD13 LEU 37 -4.048 0.017 -7.733 318 HD21 LEU 37 HD21 LEU 37 -3.303 1.853 -7.596 319 HD22 LEU 37 HD22 LEU 37 -1.717 1.791 -8.364 320 HD23 LEU 37 HD23 LEU 37 -1.868 2.343 -6.696 321 H LEU 38 HN LEU 38 -0.224 -2.328 -6.818 322 HA LEU 38 HA LEU 38 1.888 -3.128 -7.267 323 HB2 LEU 38 HB2 LEU 38 3.397 -1.311 -7.874 324 HB3 LEU 38 HB1 LEU 38 1.762 -1.015 -8.430 325 HG LEU 38 HG LEU 38 2.404 0.170 -5.814 326 HD11 LEU 38 HD11 LEU 38 3.460 2.117 -7.308 327 HD12 LEU 38 HD12 LEU 38 4.031 0.718 -8.218 328 HD13 LEU 38 HD13 LEU 38 4.434 0.883 -6.509 329 HD21 LEU 38 HD21 LEU 38 1.468 2.082 -7.607 330 HD22 LEU 38 HD22 LEU 38 0.522 1.190 -6.416 331 HD23 LEU 38 HD23 LEU 38 0.649 0.590 -8.068 332 H VAL 39 HN VAL 39 1.602 -3.802 -4.707 333 HA VAL 39 HA VAL 39 4.209 -3.096 -3.531 334 HB VAL 39 HB VAL 39 1.644 -3.605 -2.013 335 HG11 VAL 39 HG11 VAL 39 2.897 -4.172 -0.272 336 HG12 VAL 39 HG12 VAL 39 3.668 -2.588 -0.331 337 HG13 VAL 39 HG13 VAL 39 4.365 -3.941 -1.220 338 HG21 VAL 39 HG21 VAL 39 2.811 -1.141 -1.310 339 HG22 VAL 39 HG22 VAL 39 1.304 -1.414 -2.182 340 HG23 VAL 39 HG23 VAL 39 2.812 -1.214 -3.071 341 H ASP 40 HN ASP 40 5.416 -4.758 -2.732 342 HA ASP 40 HA ASP 40 4.412 -7.456 -3.301 343 HB2 ASP 40 HB2 ASP 40 6.716 -6.291 -4.137 344 HB3 ASP 40 HB1 ASP 40 7.275 -7.081 -2.665 345 H THR 41 HN THR 41 4.707 -9.149 -1.803 346 HA THR 41 HA THR 41 4.840 -8.218 0.973 347 HB THR 41 HB THR 41 4.003 -10.811 1.135 348 HG1 THR 41 HG1 THR 41 2.832 -9.759 -1.219 349 HG21 THR 41 HG21 THR 41 2.793 -8.242 1.372 350 HG22 THR 41 HG22 THR 41 2.368 -9.756 2.171 351 HG23 THR 41 HG23 THR 41 1.663 -9.357 0.604 352 HA PRO 42 HA PRO 42 8.793 -9.994 1.780 353 HB2 PRO 42 HB2 PRO 42 7.578 -11.030 4.291 354 HB3 PRO 42 HB1 PRO 42 9.022 -10.036 4.065 355 HG2 PRO 42 HG2 PRO 42 6.764 -8.965 4.986 356 HG3 PRO 42 HG1 PRO 42 7.801 -8.075 3.857 357 HD2 PRO 42 HD2 PRO 42 5.220 -9.492 3.350 358 HD3 PRO 42 HD1 PRO 42 5.836 -7.981 2.650 359 H GLU 43 HN GLU 43 6.233 -12.122 3.077 360 HA GLU 43 HA GLU 43 7.027 -14.263 1.307 361 HB2 GLU 43 HB2 GLU 43 7.555 -15.861 3.069 362 HB3 GLU 43 HB1 GLU 43 8.650 -14.488 3.139 363 HG2 GLU 43 HG2 GLU 43 7.101 -13.543 4.917 364 HG3 GLU 43 HG1 GLU 43 6.369 -15.145 4.970 365 H THR 44 HN THR 44 5.118 -13.320 4.143 366 HA THR 44 HA THR 44 3.217 -15.295 4.196 367 HB THR 44 HB THR 44 3.266 -13.555 5.868 368 HG1 THR 44 HG1 THR 44 0.822 -13.339 4.453 369 HG21 THR 44 HG21 THR 44 3.196 -11.770 3.624 370 HG22 THR 44 HG22 THR 44 3.559 -11.436 5.317 371 HG23 THR 44 HG23 THR 44 1.889 -11.405 4.752 372 H LYS 45 HN LYS 45 2.375 -16.128 2.368 373 HA LYS 45 HA LYS 45 0.408 -14.596 0.952 374 HB2 LYS 45 HB2 LYS 45 3.083 -14.944 -0.177 375 HB3 LYS 45 HB1 LYS 45 1.810 -15.531 -1.239 376 HG2 LYS 45 HG2 LYS 45 1.840 -12.783 -0.014 377 HG3 LYS 45 HG1 LYS 45 2.473 -13.162 -1.617 378 HD2 LYS 45 HD2 LYS 45 0.368 -13.637 -2.475 379 HD3 LYS 45 HD1 LYS 45 -0.325 -13.930 -0.878 380 HE2 LYS 45 HE2 LYS 45 -1.216 -11.869 -1.409 381 HE3 LYS 45 HE1 LYS 45 0.212 -11.416 -0.481 382 HZ1 LYS 45 HZ1 LYS 45 1.215 -10.546 -2.282 383 HZ2 LYS 45 HZ2 LYS 45 -0.367 -10.399 -2.861 384 HZ3 LYS 45 HZ3 LYS 45 0.592 -11.704 -3.347 385 H HIS 46 HN HIS 46 2.394 -17.536 0.950 386 HA HIS 46 HA HIS 46 0.523 -19.142 -0.438 387 HB2 HIS 46 HB2 HIS 46 3.031 -19.578 1.063 388 HB3 HIS 46 HB1 HIS 46 1.944 -20.961 0.989 389 HD1 HIS 46 HD1 HIS 46 0.909 -20.518 -1.922 390 HD2 HIS 46 HD2 HIS 46 4.897 -20.408 -0.760 391 HE1 HIS 46 HE1 HIS 46 2.230 -21.021 -4.002 392 HE2 HIS 46 HE2 HIS 46 4.636 -21.037 -3.254 393 HA PRO 47 HA PRO 47 -2.361 -19.850 2.869 394 HB2 PRO 47 HB2 PRO 47 -3.792 -21.848 1.763 395 HB3 PRO 47 HB1 PRO 47 -3.898 -20.183 1.180 396 HG2 PRO 47 HG2 PRO 47 -2.356 -22.489 0.058 397 HG3 PRO 47 HG1 PRO 47 -3.312 -21.262 -0.792 398 HD2 PRO 47 HD2 PRO 47 -0.590 -21.171 -0.580 399 HD3 PRO 47 HD1 PRO 47 -1.608 -19.727 -0.749 400 H LYS 48 HN LYS 48 -0.888 -22.729 1.368 401 HA LYS 48 HA LYS 48 -0.075 -24.662 2.245 402 HB2 LYS 48 HB2 LYS 48 1.262 -22.958 3.567 403 HB3 LYS 48 HB1 LYS 48 0.108 -23.192 4.873 404 HG2 LYS 48 HG2 LYS 48 0.948 -25.205 5.440 405 HG3 LYS 48 HG1 LYS 48 1.322 -25.641 3.771 406 HD2 LYS 48 HD2 LYS 48 3.421 -24.852 3.912 407 HD3 LYS 48 HD1 LYS 48 2.922 -23.420 4.816 408 HE2 LYS 48 HE2 LYS 48 3.304 -24.390 6.819 409 HE3 LYS 48 HE1 LYS 48 2.752 -25.973 6.275 410 HZ1 LYS 48 HZ1 LYS 48 5.299 -25.387 6.767 411 HZ2 LYS 48 HZ2 LYS 48 5.242 -25.040 5.112 412 HZ3 LYS 48 HZ3 LYS 48 4.815 -26.580 5.668 413 H LYS 49 HN LYS 49 -0.581 -26.465 3.668 414 HA LYS 49 HA LYS 49 -3.374 -26.746 4.066 415 HB2 LYS 49 HB2 LYS 49 -1.017 -28.464 4.832 416 HB3 LYS 49 HB1 LYS 49 -2.676 -28.923 5.190 417 HG2 LYS 49 HG2 LYS 49 -2.667 -29.922 3.204 418 HG3 LYS 49 HG1 LYS 49 -2.781 -28.300 2.517 419 HD2 LYS 49 HD2 LYS 49 -0.974 -29.384 1.421 420 HD3 LYS 49 HD1 LYS 49 -0.263 -28.228 2.549 421 HE2 LYS 49 HE2 LYS 49 -0.509 -30.534 4.050 422 HE3 LYS 49 HE1 LYS 49 -0.041 -31.128 2.457 423 HZ1 LYS 49 HZ1 LYS 49 1.401 -29.040 4.000 424 HZ2 LYS 49 HZ2 LYS 49 1.859 -29.651 2.491 425 HZ3 LYS 49 HZ3 LYS 49 1.882 -30.656 3.850 426 H GLY 50 HN GLY 50 -0.642 -26.355 6.296 427 HA2 GLY 50 HA2 GLY 50 -2.390 -26.355 8.606 428 HA3 GLY 50 HA1 GLY 50 -0.648 -26.123 8.613 429 H VAL 51 HN VAL 51 -0.917 -24.001 6.515 430 HA VAL 51 HA VAL 51 -1.133 -21.738 6.379 431 HB VAL 51 HB VAL 51 -3.241 -21.995 8.527 432 HG11 VAL 51 HG11 VAL 51 -2.625 -19.722 8.281 433 HG12 VAL 51 HG12 VAL 51 -4.124 -19.928 7.374 434 HG13 VAL 51 HG13 VAL 51 -2.581 -19.849 6.522 435 HG21 VAL 51 HG21 VAL 51 -3.340 -23.274 6.138 436 HG22 VAL 51 HG22 VAL 51 -4.077 -21.728 5.721 437 HG23 VAL 51 HG23 VAL 51 -4.757 -22.705 7.021 438 H GLU 52 HN GLU 52 0.137 -20.177 7.173 439 HA GLU 52 HA GLU 52 1.175 -20.512 9.889 440 HB2 GLU 52 HB2 GLU 52 2.183 -19.109 7.432 441 HB3 GLU 52 HB1 GLU 52 2.828 -18.704 9.017 442 HG2 GLU 52 HG2 GLU 52 3.959 -20.645 9.210 443 HG3 GLU 52 HG1 GLU 52 2.735 -21.573 8.342 444 H LYS 53 HN LYS 53 1.951 -18.162 10.728 445 HA LYS 53 HA LYS 53 -0.528 -16.759 11.222 446 HB2 LYS 53 HB2 LYS 53 1.895 -17.161 12.625 447 HB3 LYS 53 HB1 LYS 53 1.755 -15.430 12.353 448 HG2 LYS 53 HG2 LYS 53 0.605 -15.546 14.291 449 HG3 LYS 53 HG1 LYS 53 -0.728 -15.916 13.194 450 HD2 LYS 53 HD2 LYS 53 0.984 -18.115 14.289 451 HD3 LYS 53 HD1 LYS 53 -0.319 -17.432 15.263 452 HE2 LYS 53 HE2 LYS 53 -1.312 -17.937 12.640 453 HE3 LYS 53 HE1 LYS 53 -0.483 -19.384 13.215 454 HZ1 LYS 53 HZ1 LYS 53 -3.006 -18.855 13.784 455 HZ2 LYS 53 HZ2 LYS 53 -2.280 -18.072 15.095 456 HZ3 LYS 53 HZ3 LYS 53 -2.000 -19.720 14.834 457 H TYR 54 HN TYR 54 -0.873 -14.526 10.869 458 HA TYR 54 HA TYR 54 -0.248 -13.558 8.366 459 HB2 TYR 54 HB2 TYR 54 -1.212 -11.494 9.026 460 HB3 TYR 54 HB1 TYR 54 -2.044 -12.730 9.962 461 HD1 TYR 54 HD2 TYR 54 -0.346 -13.250 12.216 462 HD2 TYR 54 HD1 TYR 54 -1.093 -9.550 10.254 463 HE1 TYR 54 HE2 TYR 54 0.206 -12.048 14.287 464 HE2 TYR 54 HE1 TYR 54 -0.543 -8.337 12.320 465 HH TYR 54 HH TYR 54 0.921 -9.864 15.016 466 H GLY 55 HN GLY 55 0.942 -11.465 7.887 467 HA2 GLY 55 HA2 GLY 55 3.680 -11.820 8.318 468 HA3 GLY 55 HA1 GLY 55 2.938 -10.346 7.714 469 HA PRO 56 HA PRO 56 4.198 -9.926 12.289 470 HB2 PRO 56 HB2 PRO 56 6.912 -9.864 12.351 471 HB3 PRO 56 HB1 PRO 56 5.968 -11.336 12.589 472 HG2 PRO 56 HG2 PRO 56 7.559 -10.476 10.257 473 HG3 PRO 56 HG1 PRO 56 7.125 -12.107 10.787 474 HD2 PRO 56 HD2 PRO 56 5.926 -10.613 8.706 475 HD3 PRO 56 HD1 PRO 56 5.362 -12.153 9.378 476 H GLU 57 HN GLU 57 6.942 -8.682 10.407 477 HA GLU 57 HA GLU 57 6.463 -6.025 11.388 478 HB2 GLU 57 HB2 GLU 57 8.514 -7.150 9.479 479 HB3 GLU 57 HB1 GLU 57 8.465 -5.462 9.970 480 HG2 GLU 57 HG2 GLU 57 10.099 -6.622 11.281 481 HG3 GLU 57 HG1 GLU 57 8.745 -6.168 12.315 482 H ALA 58 HN ALA 58 5.712 -7.799 8.507 483 HA ALA 58 HA ALA 58 5.285 -5.473 6.865 484 HB1 ALA 58 HB1 ALA 58 5.022 -8.405 6.520 485 HB2 ALA 58 HB2 ALA 58 5.820 -7.208 5.499 486 HB3 ALA 58 HB3 ALA 58 4.064 -7.369 5.462 487 H SER 59 HN SER 59 3.110 -7.978 8.177 488 HA SER 59 HA SER 59 0.732 -6.642 7.471 489 HB2 SER 59 HB2 SER 59 1.399 -9.123 8.530 490 HB3 SER 59 HB1 SER 59 0.456 -8.358 9.809 491 HG SER 59 HG SER 59 -0.299 -8.940 7.155 492 H ALA 60 HN ALA 60 2.431 -6.868 10.592 493 HA ALA 60 HA ALA 60 0.668 -5.371 12.125 494 HB1 ALA 60 HB1 ALA 60 2.395 -5.156 13.718 495 HB2 ALA 60 HB2 ALA 60 3.651 -5.298 12.488 496 HB3 ALA 60 HB3 ALA 60 2.668 -6.700 12.911 497 H PHE 61 HN PHE 61 3.645 -4.181 10.545 498 HA PHE 61 HA PHE 61 3.409 -1.514 11.174 499 HB2 PHE 61 HB2 PHE 61 5.376 -2.525 10.074 500 HB3 PHE 61 HB1 PHE 61 4.459 -2.644 8.575 501 HD1 PHE 61 HD1 PHE 61 5.901 -0.284 11.012 502 HD2 PHE 61 HD2 PHE 61 4.218 -0.795 7.141 503 HE1 PHE 61 HE1 PHE 61 6.594 2.003 10.412 504 HE2 PHE 61 HE2 PHE 61 4.903 1.485 6.530 505 HZ PHE 61 HZ PHE 61 6.095 2.890 8.168 506 H THR 62 HN THR 62 2.232 -3.070 8.187 507 HA THR 62 HA THR 62 1.070 -0.870 6.995 508 HB THR 62 HB THR 62 -0.166 -3.622 6.938 509 HG1 THR 62 HG1 THR 62 1.347 -4.115 5.342 510 HG21 THR 62 HG21 THR 62 -1.061 -3.108 4.918 511 HG22 THR 62 HG22 THR 62 0.191 -1.926 4.536 512 HG23 THR 62 HG23 THR 62 -1.096 -1.512 5.668 513 H LYS 63 HN LYS 63 -0.306 -3.036 9.430 514 HA LYS 63 HA LYS 63 -2.841 -1.692 9.482 515 HB2 LYS 63 HB2 LYS 63 -2.683 -4.059 10.058 516 HB3 LYS 63 HB1 LYS 63 -1.606 -3.681 11.397 517 HG2 LYS 63 HG2 LYS 63 -4.172 -2.268 11.471 518 HG3 LYS 63 HG1 LYS 63 -4.292 -4.024 11.601 519 HD2 LYS 63 HD2 LYS 63 -2.408 -2.384 13.283 520 HD3 LYS 63 HD1 LYS 63 -4.060 -2.754 13.781 521 HE2 LYS 63 HE2 LYS 63 -2.689 -5.133 12.890 522 HE3 LYS 63 HE1 LYS 63 -1.782 -4.323 14.167 523 HZ1 LYS 63 HZ1 LYS 63 -4.136 -4.220 15.271 524 HZ2 LYS 63 HZ2 LYS 63 -3.183 -5.611 15.394 525 HZ3 LYS 63 HZ3 LYS 63 -4.441 -5.548 14.267 526 H LYS 64 HN LYS 64 0.207 -1.374 11.105 527 HA LYS 64 HA LYS 64 -0.629 0.024 13.396 528 HB2 LYS 64 HB2 LYS 64 1.909 -0.452 11.974 529 HB3 LYS 64 HB1 LYS 64 1.864 1.016 12.938 530 HG2 LYS 64 HG2 LYS 64 0.880 -1.447 14.237 531 HG3 LYS 64 HG1 LYS 64 2.612 -1.353 13.908 532 HD2 LYS 64 HD2 LYS 64 1.164 0.913 15.237 533 HD3 LYS 64 HD1 LYS 64 1.731 -0.474 16.169 534 HE2 LYS 64 HE2 LYS 64 4.007 -0.083 15.391 535 HE3 LYS 64 HE1 LYS 64 3.452 1.276 14.414 536 HZ1 LYS 64 HZ1 LYS 64 4.471 1.784 16.672 537 HZ2 LYS 64 HZ2 LYS 64 3.025 1.208 17.337 538 HZ3 LYS 64 HZ3 LYS 64 3.004 2.543 16.299 539 H MET 65 HN MET 65 0.766 1.273 10.368 540 HA MET 65 HA MET 65 0.456 3.983 10.958 541 HB2 MET 65 HB2 MET 65 0.814 2.422 8.438 542 HB3 MET 65 HB1 MET 65 0.427 4.134 8.333 543 HG2 MET 65 HG2 MET 65 2.780 2.952 9.791 544 HG3 MET 65 HG1 MET 65 2.828 3.731 8.210 545 HE1 MET 65 HE1 MET 65 4.740 4.930 9.094 546 HE2 MET 65 HE2 MET 65 4.654 6.445 9.996 547 HE3 MET 65 HE3 MET 65 3.986 6.349 8.366 548 H VAL 66 HN VAL 66 -1.668 1.879 9.002 549 HA VAL 66 HA VAL 66 -3.561 3.855 8.398 550 HB VAL 66 HB VAL 66 -5.125 1.957 7.960 551 HG11 VAL 66 HG11 VAL 66 -3.696 2.749 6.194 552 HG12 VAL 66 HG12 VAL 66 -3.765 0.989 6.122 553 HG13 VAL 66 HG13 VAL 66 -2.347 1.788 6.799 554 HG21 VAL 66 HG21 VAL 66 -4.759 0.147 9.241 555 HG22 VAL 66 HG22 VAL 66 -3.053 0.530 9.471 556 HG23 VAL 66 HG23 VAL 66 -3.584 -0.282 7.998 557 H GLU 67 HN GLU 67 -3.334 1.639 11.138 558 HA GLU 67 HA GLU 67 -5.877 2.406 12.197 559 HB2 GLU 67 HB2 GLU 67 -3.607 0.825 13.401 560 HB3 GLU 67 HB1 GLU 67 -5.169 1.061 14.175 561 HG2 GLU 67 HG2 GLU 67 -4.866 -0.184 11.460 562 HG3 GLU 67 HG1 GLU 67 -4.840 -1.118 12.957 563 H ASN 68 HN ASN 68 -2.499 3.017 13.143 564 HA ASN 68 HA ASN 68 -3.131 4.684 15.332 565 HB2 ASN 68 HB2 ASN 68 -0.649 4.309 13.674 566 HB3 ASN 68 HB1 ASN 68 -0.719 5.523 14.947 567 HD21 ASN 68 HD21 ASN 68 -1.203 2.081 14.322 568 HD22 ASN 68 HD22 ASN 68 -0.713 1.548 15.890 569 H ALA 69 HN ALA 69 -2.880 5.274 11.912 570 HA ALA 69 HA ALA 69 -2.611 8.100 12.049 571 HB1 ALA 69 HB1 ALA 69 -3.485 7.942 9.642 572 HB2 ALA 69 HB2 ALA 69 -3.421 6.196 9.881 573 HB3 ALA 69 HB3 ALA 69 -1.951 7.160 10.021 574 H LYS 70 HN LYS 70 -4.075 9.595 12.485 575 HA LYS 70 HA LYS 70 -6.666 9.010 13.347 576 HB2 LYS 70 HB2 LYS 70 -5.453 11.609 12.404 577 HB3 LYS 70 HB1 LYS 70 -7.044 11.490 13.141 578 HG2 LYS 70 HG2 LYS 70 -5.833 10.371 15.105 579 HG3 LYS 70 HG1 LYS 70 -4.361 11.024 14.383 580 HD2 LYS 70 HD2 LYS 70 -5.603 13.272 14.374 581 HD3 LYS 70 HD1 LYS 70 -6.727 12.500 15.494 582 HE2 LYS 70 HE2 LYS 70 -3.986 12.029 16.274 583 HE3 LYS 70 HE1 LYS 70 -4.314 13.754 16.118 584 HZ1 LYS 70 HZ1 LYS 70 -4.979 13.410 18.249 585 HZ2 LYS 70 HZ2 LYS 70 -5.447 11.807 17.984 586 HZ3 LYS 70 HZ3 LYS 70 -6.444 13.074 17.471 587 H LYS 71 HN LYS 71 -5.421 9.601 10.162 588 HA LYS 71 HA LYS 71 -8.083 9.108 9.066 589 HB2 LYS 71 HB2 LYS 71 -7.426 11.651 9.238 590 HB3 LYS 71 HB1 LYS 71 -6.469 11.286 7.810 591 HG2 LYS 71 HG2 LYS 71 -8.825 10.187 7.101 592 HG3 LYS 71 HG1 LYS 71 -9.382 11.511 8.127 593 HD2 LYS 71 HD2 LYS 71 -7.510 11.765 5.773 594 HD3 LYS 71 HD1 LYS 71 -9.222 12.195 5.781 595 HE2 LYS 71 HE2 LYS 71 -8.759 13.844 7.565 596 HE3 LYS 71 HE1 LYS 71 -7.045 13.452 7.448 597 HZ1 LYS 71 HZ1 LYS 71 -7.055 15.165 6.016 598 HZ2 LYS 71 HZ2 LYS 71 -8.706 15.036 5.674 599 HZ3 LYS 71 HZ3 LYS 71 -7.602 14.010 4.907 600 H ILE 72 HN ILE 72 -8.103 8.197 7.010 601 HA ILE 72 HA ILE 72 -5.473 7.399 5.949 602 HB ILE 72 HB ILE 72 -7.946 5.728 5.632 603 HG12 ILE 72 HG12 ILE 72 -5.887 5.533 7.842 604 HG13 ILE 72 HG11 ILE 72 -7.581 5.973 8.040 605 HG21 ILE 72 HG21 ILE 72 -6.579 4.115 4.783 606 HG22 ILE 72 HG22 ILE 72 -5.184 4.646 5.722 607 HG23 ILE 72 HG23 ILE 72 -5.683 5.552 4.293 608 HD11 ILE 72 HD11 ILE 72 -8.294 3.783 7.470 609 HD12 ILE 72 HD12 ILE 72 -7.008 3.629 8.667 610 HD13 ILE 72 HD13 ILE 72 -6.670 3.321 6.964 611 H GLU 73 HN GLU 73 -5.222 7.406 3.726 612 HA GLU 73 HA GLU 73 -7.478 8.504 2.176 613 HB2 GLU 73 HB2 GLU 73 -4.613 9.184 1.566 614 HB3 GLU 73 HB1 GLU 73 -6.073 10.001 1.027 615 HG2 GLU 73 HG2 GLU 73 -6.470 10.817 3.282 616 HG3 GLU 73 HG1 GLU 73 -5.034 9.967 3.852 617 H VAL 74 HN VAL 74 -7.724 7.781 0.062 618 HA VAL 74 HA VAL 74 -5.929 5.606 -0.769 619 HB VAL 74 HB VAL 74 -8.020 4.608 -1.870 620 HG11 VAL 74 HG11 VAL 74 -7.556 3.094 -0.318 621 HG12 VAL 74 HG12 VAL 74 -8.629 3.955 0.785 622 HG13 VAL 74 HG13 VAL 74 -6.906 4.330 0.760 623 HG21 VAL 74 HG21 VAL 74 -9.236 6.846 -0.884 624 HG22 VAL 74 HG22 VAL 74 -9.676 5.627 0.311 625 HG23 VAL 74 HG23 VAL 74 -10.066 5.374 -1.391 626 H GLU 75 HN GLU 75 -5.243 5.659 -2.818 627 HA GLU 75 HA GLU 75 -6.536 7.567 -4.656 628 HB2 GLU 75 HB2 GLU 75 -4.391 8.464 -3.915 629 HB3 GLU 75 HB1 GLU 75 -3.585 6.973 -4.376 630 HG2 GLU 75 HG2 GLU 75 -3.590 7.482 -6.580 631 HG3 GLU 75 HG1 GLU 75 -5.111 8.369 -6.485 632 H PHE 76 HN PHE 76 -7.620 6.334 -6.065 633 HA PHE 76 HA PHE 76 -6.776 3.710 -6.805 634 HB2 PHE 76 HB2 PHE 76 -8.959 5.518 -7.836 635 HB3 PHE 76 HB1 PHE 76 -8.671 3.906 -8.477 636 HD1 PHE 76 HD2 PHE 76 -8.339 2.118 -6.394 637 HD2 PHE 76 HD1 PHE 76 -10.723 5.648 -6.401 638 HE1 PHE 76 HE2 PHE 76 -9.749 1.170 -4.610 639 HE2 PHE 76 HE1 PHE 76 -12.136 4.702 -4.622 640 HZ PHE 76 HZ PHE 76 -11.650 2.461 -3.729 641 H ASP 77 HN ASP 77 -5.564 3.066 -8.424 642 HA ASP 77 HA ASP 77 -3.886 4.737 -9.857 643 HB2 ASP 77 HB2 ASP 77 -3.359 2.775 -11.222 644 HB3 ASP 77 HB1 ASP 77 -3.478 2.342 -9.520 645 H LYS 78 HN LYS 78 -3.736 5.130 -12.133 646 HA LYS 78 HA LYS 78 -6.110 6.236 -13.216 647 HB2 LYS 78 HB2 LYS 78 -4.543 6.334 -15.346 648 HB3 LYS 78 HB1 LYS 78 -4.292 7.406 -13.976 649 HG2 LYS 78 HG2 LYS 78 -2.861 4.869 -13.754 650 HG3 LYS 78 HG1 LYS 78 -2.382 5.842 -15.145 651 HD2 LYS 78 HD2 LYS 78 -2.680 7.340 -12.638 652 HD3 LYS 78 HD1 LYS 78 -1.387 6.139 -12.633 653 HE2 LYS 78 HE2 LYS 78 -1.741 8.215 -14.787 654 HE3 LYS 78 HE1 LYS 78 -0.703 8.433 -13.379 655 HZ1 LYS 78 HZ1 LYS 78 -0.306 5.997 -14.925 656 HZ2 LYS 78 HZ2 LYS 78 0.831 7.002 -14.176 657 HZ3 LYS 78 HZ3 LYS 78 0.168 7.442 -15.668 658 H GLY 79 HN GLY 79 -4.481 3.174 -13.624 659 HA2 GLY 79 HA2 GLY 79 -6.137 2.456 -15.915 660 HA3 GLY 79 HA1 GLY 79 -4.862 1.477 -15.205 661 H GLN 80 HN GLN 80 -5.759 -0.398 -14.591 662 HA GLN 80 HA GLN 80 -8.463 -0.720 -13.878 663 HB2 GLN 80 HB2 GLN 80 -6.118 -2.395 -14.084 664 HB3 GLN 80 HB1 GLN 80 -7.041 -2.795 -12.642 665 HG2 GLN 80 HG2 GLN 80 -9.075 -2.897 -14.149 666 HG3 GLN 80 HG1 GLN 80 -7.942 -2.864 -15.500 667 HE21 GLN 80 HE21 GLN 80 -8.894 -4.950 -16.004 668 HE22 GLN 80 HE22 GLN 80 -8.289 -6.365 -15.217 669 H ARG 81 HN ARG 81 -9.420 0.064 -12.150 670 HA ARG 81 HA ARG 81 -7.862 0.485 -9.706 671 HB2 ARG 81 HB2 ARG 81 -10.522 1.607 -10.580 672 HB3 ARG 81 HB1 ARG 81 -9.762 1.943 -9.028 673 HG2 ARG 81 HG2 ARG 81 -7.918 3.039 -10.103 674 HG3 ARG 81 HG1 ARG 81 -8.510 2.561 -11.695 675 HD2 ARG 81 HD2 ARG 81 -10.299 4.138 -9.911 676 HD3 ARG 81 HD1 ARG 81 -8.978 4.963 -10.734 677 HE ARG 81 HE ARG 81 -10.011 4.561 -12.777 678 HH11 ARG 81 HH11 ARG 81 -11.806 3.074 -10.175 679 HH12 ARG 81 HH12 ARG 81 -13.223 2.823 -11.135 680 HH21 ARG 81 HH21 ARG 81 -11.876 4.227 -14.036 681 HH22 ARG 81 HH22 ARG 81 -13.264 3.475 -13.324 682 H THR 82 HN THR 82 -9.535 -1.966 -10.886 683 HA THR 82 HA THR 82 -10.178 -3.010 -8.294 684 HB THR 82 HB THR 82 -12.573 -3.611 -9.169 685 HG1 THR 82 HG1 THR 82 -12.880 -2.698 -11.042 686 HG21 THR 82 HG21 THR 82 -12.282 -0.753 -8.363 687 HG22 THR 82 HG22 THR 82 -11.899 -2.053 -7.234 688 HG23 THR 82 HG23 THR 82 -13.520 -1.926 -7.916 689 H ASP 83 HN ASP 83 -9.589 -5.063 -8.318 690 HA ASP 83 HA ASP 83 -9.083 -6.402 -10.823 691 HB2 ASP 83 HB2 ASP 83 -8.271 -6.711 -8.044 692 HB3 ASP 83 HB1 ASP 83 -8.679 -8.256 -8.784 693 H LYS 84 HN LYS 84 -9.599 -9.009 -10.361 694 HA LYS 84 HA LYS 84 -12.133 -9.462 -11.228 695 HB2 LYS 84 HB2 LYS 84 -11.780 -11.690 -9.685 696 HB3 LYS 84 HB1 LYS 84 -11.143 -11.477 -11.311 697 HG2 LYS 84 HG2 LYS 84 -9.484 -10.480 -9.068 698 HG3 LYS 84 HG1 LYS 84 -9.640 -12.228 -9.249 699 HD2 LYS 84 HD2 LYS 84 -8.704 -12.199 -11.405 700 HD3 LYS 84 HD1 LYS 84 -8.915 -10.454 -11.562 701 HE2 LYS 84 HE2 LYS 84 -7.025 -9.989 -10.417 702 HE3 LYS 84 HE1 LYS 84 -7.244 -11.338 -9.303 703 HZ1 LYS 84 HZ1 LYS 84 -6.310 -12.829 -10.829 704 HZ2 LYS 84 HZ2 LYS 84 -5.299 -11.475 -10.886 705 HZ3 LYS 84 HZ3 LYS 84 -6.425 -11.739 -12.118 706 H TYR 85 HN TYR 85 -11.198 -9.971 -7.825 707 HA TYR 85 HA TYR 85 -13.862 -10.219 -6.930 708 HB2 TYR 85 HB2 TYR 85 -11.183 -10.101 -5.698 709 HB3 TYR 85 HB1 TYR 85 -12.503 -9.561 -4.667 710 HD1 TYR 85 HD1 TYR 85 -12.629 -12.228 -7.242 711 HD2 TYR 85 HD2 TYR 85 -12.613 -11.302 -3.092 712 HE1 TYR 85 HE1 TYR 85 -13.172 -14.571 -6.726 713 HE2 TYR 85 HE2 TYR 85 -13.155 -13.641 -2.561 714 HH TYR 85 HH TYR 85 -12.792 -16.127 -4.623 715 H GLY 86 HN GLY 86 -12.162 -7.515 -7.921 716 HA2 GLY 86 HA2 GLY 86 -12.980 -5.331 -8.020 717 HA3 GLY 86 HA1 GLY 86 -14.199 -5.759 -6.826 718 H ARG 87 HN ARG 87 -10.904 -6.598 -6.219 719 HA ARG 87 HA ARG 87 -10.750 -5.391 -3.739 720 HB2 ARG 87 HB2 ARG 87 -9.106 -6.992 -5.218 721 HB3 ARG 87 HB1 ARG 87 -8.193 -5.491 -5.191 722 HG2 ARG 87 HG2 ARG 87 -7.377 -6.474 -3.311 723 HG3 ARG 87 HG1 ARG 87 -8.746 -5.603 -2.614 724 HD2 ARG 87 HD2 ARG 87 -8.556 -7.968 -1.858 725 HD3 ARG 87 HD1 ARG 87 -10.092 -7.579 -2.627 726 HE ARG 87 HE ARG 87 -9.498 -8.894 -4.460 727 HH11 ARG 87 HH11 ARG 87 -6.927 -8.807 -2.092 728 HH12 ARG 87 HH12 ARG 87 -6.103 -10.174 -2.760 729 HH21 ARG 87 HH21 ARG 87 -8.410 -10.687 -5.334 730 HH22 ARG 87 HH22 ARG 87 -6.942 -11.240 -4.599 731 H GLY 88 HN GLY 88 -9.266 -3.619 -3.047 732 HA2 GLY 88 HA2 GLY 88 -9.840 -1.258 -4.646 733 HA3 GLY 88 HA1 GLY 88 -9.221 -1.274 -3.004 734 H LEU 89 HN LEU 89 -8.473 -0.993 -6.302 735 HA LEU 89 HA LEU 89 -5.642 -1.506 -6.006 736 HB2 LEU 89 HB2 LEU 89 -7.353 -0.559 -8.286 737 HB3 LEU 89 HB1 LEU 89 -5.611 -0.677 -8.406 738 HG LEU 89 HG LEU 89 -6.999 -2.606 -9.327 739 HD11 LEU 89 HD11 LEU 89 -4.967 -3.456 -7.297 740 HD12 LEU 89 HD12 LEU 89 -4.517 -2.573 -8.755 741 HD13 LEU 89 HD13 LEU 89 -5.299 -4.148 -8.885 742 HD21 LEU 89 HD21 LEU 89 -7.118 -3.450 -6.449 743 HD22 LEU 89 HD22 LEU 89 -7.845 -4.238 -7.849 744 HD23 LEU 89 HD23 LEU 89 -8.475 -2.690 -7.282 745 H ALA 90 HN ALA 90 -5.697 0.223 -4.215 746 HA ALA 90 HA ALA 90 -4.723 2.710 -5.395 747 HB1 ALA 90 HB1 ALA 90 -7.002 3.278 -4.972 748 HB2 ALA 90 HB2 ALA 90 -6.024 4.041 -3.721 749 HB3 ALA 90 HB3 ALA 90 -6.936 2.577 -3.357 750 H TYR 91 HN TYR 91 -3.720 4.131 -3.666 751 HA TYR 91 HA TYR 91 -2.125 2.430 -1.913 752 HB2 TYR 91 HB2 TYR 91 -1.714 5.386 -2.294 753 HB3 TYR 91 HB1 TYR 91 -0.539 4.170 -1.818 754 HD1 TYR 91 HD2 TYR 91 -2.603 5.315 -4.695 755 HD2 TYR 91 HD1 TYR 91 0.843 3.172 -3.419 756 HE1 TYR 91 HE2 TYR 91 -1.855 5.143 -7.029 757 HE2 TYR 91 HE1 TYR 91 1.605 2.999 -5.750 758 HH TYR 91 HH TYR 91 1.297 4.059 -7.873 759 H ILE 92 HN ILE 92 -2.223 2.494 0.272 760 HA ILE 92 HA ILE 92 -4.382 4.080 1.458 761 HB ILE 92 HB ILE 92 -2.706 1.924 2.747 762 HG12 ILE 92 HG12 ILE 92 -4.915 0.612 2.435 763 HG13 ILE 92 HG11 ILE 92 -5.295 1.821 1.213 764 HG21 ILE 92 HG21 ILE 92 -3.778 3.486 4.310 765 HG22 ILE 92 HG22 ILE 92 -4.456 1.862 4.426 766 HG23 ILE 92 HG23 ILE 92 -5.342 3.129 3.577 767 HD11 ILE 92 HD11 ILE 92 -3.920 0.900 -0.276 768 HD12 ILE 92 HD12 ILE 92 -3.952 -0.511 0.782 769 HD13 ILE 92 HD13 ILE 92 -2.640 0.661 0.913 770 H TYR 93 HN TYR 93 -4.002 5.889 2.551 771 HA TYR 93 HA TYR 93 -1.240 6.505 3.329 772 HB2 TYR 93 HB2 TYR 93 -3.605 8.370 3.059 773 HB3 TYR 93 HB1 TYR 93 -1.955 8.845 3.417 774 HD1 TYR 93 HD2 TYR 93 -3.097 6.404 0.845 775 HD2 TYR 93 HD1 TYR 93 -1.426 10.232 1.622 776 HE1 TYR 93 HE2 TYR 93 -2.699 6.703 -1.553 777 HE2 TYR 93 HE1 TYR 93 -1.012 10.542 -0.780 778 HH TYR 93 HH TYR 93 -1.376 7.966 -3.059 779 H ALA 94 HN ALA 94 -0.878 7.643 5.342 780 HA ALA 94 HA ALA 94 -2.937 7.340 7.386 781 HB1 ALA 94 HB1 ALA 94 -0.641 5.610 7.141 782 HB2 ALA 94 HB2 ALA 94 -2.018 5.499 8.237 783 HB3 ALA 94 HB3 ALA 94 -0.618 6.478 8.675 784 H ASP 95 HN ASP 95 -3.102 9.299 8.260 785 HA ASP 95 HA ASP 95 -2.553 11.245 9.305 786 HB2 ASP 95 HB2 ASP 95 -0.788 9.670 10.378 787 HB3 ASP 95 HB1 ASP 95 0.352 10.483 9.310 788 H GLY 96 HN GLY 96 -1.877 10.525 6.264 789 HA2 GLY 96 HA2 GLY 96 -1.858 12.391 4.692 790 HA3 GLY 96 HA1 GLY 96 -0.692 13.177 5.741 791 H LYS 97 HN LYS 97 -0.086 9.863 5.449 792 HA LYS 97 HA LYS 97 1.732 10.294 3.191 793 HB2 LYS 97 HB2 LYS 97 2.428 9.494 5.970 794 HB3 LYS 97 HB1 LYS 97 3.291 8.700 4.661 795 HG2 LYS 97 HG2 LYS 97 4.022 10.859 3.811 796 HG3 LYS 97 HG1 LYS 97 3.125 11.675 5.094 797 HD2 LYS 97 HD2 LYS 97 5.012 9.598 5.989 798 HD3 LYS 97 HD1 LYS 97 5.747 11.022 5.250 799 HE2 LYS 97 HE2 LYS 97 4.641 12.471 6.821 800 HE3 LYS 97 HE1 LYS 97 3.727 11.118 7.487 801 HZ1 LYS 97 HZ1 LYS 97 5.979 12.027 8.553 802 HZ2 LYS 97 HZ2 LYS 97 6.620 10.846 7.527 803 HZ3 LYS 97 HZ3 LYS 97 5.475 10.418 8.696 804 H MET 98 HN MET 98 1.904 8.586 1.804 805 HA MET 98 HA MET 98 -0.029 6.524 1.978 806 HB2 MET 98 HB2 MET 98 2.219 6.002 0.156 807 HB3 MET 98 HB1 MET 98 0.489 6.028 -0.155 808 HG2 MET 98 HG2 MET 98 0.749 8.599 0.052 809 HG3 MET 98 HG1 MET 98 2.457 8.271 -0.230 810 HE1 MET 98 HE1 MET 98 1.955 6.137 -3.644 811 HE2 MET 98 HE2 MET 98 1.631 5.485 -2.038 812 HE3 MET 98 HE3 MET 98 3.083 6.445 -2.323 813 H VAL 99 HN VAL 99 0.040 4.927 3.355 814 HA VAL 99 HA VAL 99 2.248 4.052 4.806 815 HB VAL 99 HB VAL 99 -0.011 2.185 4.157 816 HG11 VAL 99 HG11 VAL 99 1.661 2.719 6.604 817 HG12 VAL 99 HG12 VAL 99 1.678 1.282 5.582 818 HG13 VAL 99 HG13 VAL 99 0.267 1.638 6.579 819 HG21 VAL 99 HG21 VAL 99 -0.890 3.551 6.369 820 HG22 VAL 99 HG22 VAL 99 -1.485 3.776 4.722 821 HG23 VAL 99 HG23 VAL 99 -0.229 4.838 5.360 822 H ASN 100 HN ASN 100 1.120 3.130 1.644 823 HA ASN 100 HA ASN 100 2.404 0.667 1.352 824 HB2 ASN 100 HB2 ASN 100 1.887 2.749 -0.782 825 HB3 ASN 100 HB1 ASN 100 2.195 1.035 -1.054 826 HD21 ASN 100 HD21 ASN 100 0.166 0.928 -2.135 827 HD22 ASN 100 HD22 ASN 100 -1.304 0.837 -1.238 828 H GLU 101 HN GLU 101 3.570 3.899 0.330 829 HA GLU 101 HA GLU 101 6.074 3.077 -0.568 830 HB2 GLU 101 HB2 GLU 101 6.802 5.415 -0.160 831 HB3 GLU 101 HB1 GLU 101 5.292 5.302 -1.050 832 HG2 GLU 101 HG2 GLU 101 4.062 6.173 0.659 833 HG3 GLU 101 HG1 GLU 101 5.169 5.596 1.901 834 H ALA 102 HN ALA 102 4.953 3.824 2.673 835 HA ALA 102 HA ALA 102 7.380 3.975 4.022 836 HB1 ALA 102 HB1 ALA 102 4.789 2.802 5.029 837 HB2 ALA 102 HB2 ALA 102 5.231 4.509 5.060 838 HB3 ALA 102 HB3 ALA 102 6.136 3.344 6.027 839 H LEU 103 HN LEU 103 5.311 1.093 3.632 840 HA LEU 103 HA LEU 103 7.083 -0.747 4.762 841 HB2 LEU 103 HB2 LEU 103 4.815 -0.970 2.819 842 HB3 LEU 103 HB1 LEU 103 5.805 -2.375 3.161 843 HG LEU 103 HG LEU 103 5.193 -1.507 5.681 844 HD11 LEU 103 HD11 LEU 103 3.090 -0.589 3.816 845 HD12 LEU 103 HD12 LEU 103 3.572 0.047 5.389 846 HD13 LEU 103 HD13 LEU 103 2.554 -1.390 5.293 847 HD21 LEU 103 HD21 LEU 103 4.216 -3.537 5.880 848 HD22 LEU 103 HD22 LEU 103 4.938 -3.781 4.288 849 HD23 LEU 103 HD23 LEU 103 3.238 -3.330 4.426 850 H VAL 104 HN VAL 104 6.706 0.394 1.451 851 HA VAL 104 HA VAL 104 8.451 -1.356 0.159 852 HB VAL 104 HB VAL 104 8.049 1.552 -0.550 853 HG11 VAL 104 HG11 VAL 104 9.376 -0.692 -1.825 854 HG12 VAL 104 HG12 VAL 104 9.450 1.030 -2.200 855 HG13 VAL 104 HG13 VAL 104 8.148 0.040 -2.859 856 HG21 VAL 104 HG21 VAL 104 5.929 1.164 -1.100 857 HG22 VAL 104 HG22 VAL 104 6.059 -0.391 -0.279 858 HG23 VAL 104 HG23 VAL 104 6.370 -0.280 -2.011 859 H ARG 105 HN ARG 105 9.068 1.755 1.731 860 HA ARG 105 HA ARG 105 11.879 1.697 1.145 861 HB2 ARG 105 HB2 ARG 105 10.990 3.856 1.273 862 HB3 ARG 105 HB1 ARG 105 10.078 3.500 2.731 863 HG2 ARG 105 HG2 ARG 105 12.761 3.162 3.446 864 HG3 ARG 105 HG1 ARG 105 12.719 4.605 2.435 865 HD2 ARG 105 HD2 ARG 105 12.365 4.885 4.963 866 HD3 ARG 105 HD1 ARG 105 11.264 5.719 3.869 867 HE ARG 105 HE ARG 105 10.376 3.116 4.782 868 HH11 ARG 105 HH11 ARG 105 10.333 6.565 5.337 869 HH12 ARG 105 HH12 ARG 105 8.857 6.526 6.240 870 HH21 ARG 105 HH21 ARG 105 8.428 3.069 5.962 871 HH22 ARG 105 HH22 ARG 105 7.777 4.545 6.595 872 H GLN 106 HN GLN 106 9.834 0.862 3.900 873 HA GLN 106 HA GLN 106 12.012 0.519 5.714 874 HB2 GLN 106 HB2 GLN 106 9.189 0.533 5.867 875 HB3 GLN 106 HB1 GLN 106 9.729 -1.006 6.512 876 HG2 GLN 106 HG2 GLN 106 10.121 0.032 8.423 877 HG3 GLN 106 HG1 GLN 106 11.454 0.853 7.615 878 HE21 GLN 106 HE21 GLN 106 11.408 2.978 7.544 879 HE22 GLN 106 HE22 GLN 106 10.027 3.970 7.844 880 H GLY 107 HN GLY 107 11.103 -1.295 3.077 881 HA2 GLY 107 HA2 GLY 107 12.145 -3.272 2.379 882 HA3 GLY 107 HA1 GLY 107 12.678 -3.554 4.032 883 H LEU 108 HN LEU 108 9.426 -2.768 4.043 884 HA LEU 108 HA LEU 108 8.708 -5.557 4.466 885 HB2 LEU 108 HB2 LEU 108 6.794 -3.274 4.743 886 HB3 LEU 108 HB1 LEU 108 6.829 -4.797 5.609 887 HG LEU 108 HG LEU 108 9.014 -2.782 6.005 888 HD11 LEU 108 HD11 LEU 108 7.366 -1.348 6.616 889 HD12 LEU 108 HD12 LEU 108 7.478 -2.270 8.116 890 HD13 LEU 108 HD13 LEU 108 6.211 -2.639 6.946 891 HD21 LEU 108 HD21 LEU 108 8.623 -5.338 6.927 892 HD22 LEU 108 HD22 LEU 108 8.023 -4.346 8.255 893 HD23 LEU 108 HD23 LEU 108 9.670 -4.125 7.663 894 H ALA 109 HN ALA 109 9.072 -3.949 1.779 895 HA ALA 109 HA ALA 109 7.345 -5.508 0.234 896 HB1 ALA 109 HB1 ALA 109 5.406 -4.433 0.553 897 HB2 ALA 109 HB2 ALA 109 6.081 -3.213 -0.526 898 HB3 ALA 109 HB3 ALA 109 6.195 -3.004 1.221 899 H LYS 110 HN LYS 110 7.295 -4.788 -2.076 900 HA LYS 110 HA LYS 110 9.291 -2.831 -2.845 901 HB2 LYS 110 HB2 LYS 110 10.367 -4.598 -4.381 902 HB3 LYS 110 HB1 LYS 110 10.802 -4.612 -2.676 903 HG2 LYS 110 HG2 LYS 110 9.111 -6.405 -2.329 904 HG3 LYS 110 HG1 LYS 110 8.876 -6.451 -4.078 905 HD2 LYS 110 HD2 LYS 110 11.543 -6.854 -2.733 906 HD3 LYS 110 HD1 LYS 110 10.459 -8.175 -3.178 907 HE2 LYS 110 HE2 LYS 110 10.656 -6.620 -5.476 908 HE3 LYS 110 HE1 LYS 110 12.292 -6.650 -4.819 909 HZ1 LYS 110 HZ1 LYS 110 12.392 -8.577 -5.945 910 HZ2 LYS 110 HZ2 LYS 110 10.715 -8.800 -5.962 911 HZ3 LYS 110 HZ3 LYS 110 11.607 -9.213 -4.586 912 H VAL 111 HN VAL 111 9.376 -2.620 -5.284 913 HA VAL 111 HA VAL 111 6.773 -2.287 -6.268 914 HB VAL 111 HB VAL 111 8.130 -2.281 -8.591 915 HG11 VAL 111 HG11 VAL 111 7.114 -0.311 -8.193 916 HG12 VAL 111 HG12 VAL 111 8.754 0.190 -7.775 917 HG13 VAL 111 HG13 VAL 111 7.618 -0.262 -6.503 918 HG21 VAL 111 HG21 VAL 111 10.269 -1.231 -6.816 919 HG22 VAL 111 HG22 VAL 111 10.371 -1.888 -8.450 920 HG23 VAL 111 HG23 VAL 111 10.182 -2.974 -7.073 921 H ALA 112 HN ALA 112 5.400 -3.869 -6.708 922 HA ALA 112 HA ALA 112 6.262 -6.020 -8.488 923 HB1 ALA 112 HB1 ALA 112 5.498 -7.781 -7.133 924 HB2 ALA 112 HB2 ALA 112 4.687 -6.683 -6.017 925 HB3 ALA 112 HB3 ALA 112 6.448 -6.755 -6.059 926 H TYR 113 HN TYR 113 4.572 -7.002 -9.654 927 HA TYR 113 HA TYR 113 2.618 -7.061 -10.804 928 HB2 TYR 113 HB2 TYR 113 1.676 -6.129 -8.109 929 HB3 TYR 113 HB1 TYR 113 0.546 -6.263 -9.452 930 HD1 TYR 113 HD1 TYR 113 0.037 -8.463 -10.430 931 HD2 TYR 113 HD2 TYR 113 2.562 -8.082 -7.028 932 HE1 TYR 113 HE1 TYR 113 -0.227 -10.865 -9.972 933 HE2 TYR 113 HE2 TYR 113 2.305 -10.482 -6.560 934 HH TYR 113 HH TYR 113 1.736 -12.590 -8.008 935 H VAL 114 HN VAL 114 4.286 -4.844 -11.242 936 HA VAL 114 HA VAL 114 2.559 -2.509 -11.404 937 HB VAL 114 HB VAL 114 4.902 -2.148 -10.802 938 HG11 VAL 114 HG11 VAL 114 5.455 -4.102 -12.665 939 HG12 VAL 114 HG12 VAL 114 6.639 -3.083 -11.847 940 HG13 VAL 114 HG13 VAL 114 6.035 -2.628 -13.441 941 HG21 VAL 114 HG21 VAL 114 5.469 -0.472 -12.605 942 HG22 VAL 114 HG22 VAL 114 3.873 -0.302 -11.874 943 HG23 VAL 114 HG23 VAL 114 4.038 -1.041 -13.467 944 H TYR 115 HN TYR 115 1.037 -2.712 -12.951 945 HA TYR 115 HA TYR 115 1.907 -3.576 -15.626 946 HB2 TYR 115 HB2 TYR 115 -0.678 -3.846 -15.929 947 HB3 TYR 115 HB1 TYR 115 0.239 -5.080 -15.077 948 HD1 TYR 115 HD2 TYR 115 -1.012 -1.772 -13.909 949 HD2 TYR 115 HD1 TYR 115 -1.205 -5.999 -13.511 950 HE1 TYR 115 HE2 TYR 115 -2.492 -1.513 -11.961 951 HE2 TYR 115 HE1 TYR 115 -2.686 -5.757 -11.564 952 HH TYR 115 HH TYR 115 -4.309 -3.024 -10.817 953 H LYS 116 HN LYS 116 0.844 -2.546 -17.462 954 HA LYS 116 HA LYS 116 0.485 0.322 -16.970 955 HB2 LYS 116 HB2 LYS 116 1.141 -1.155 -19.522 956 HB3 LYS 116 HB1 LYS 116 0.995 0.591 -19.370 957 HG2 LYS 116 HG2 LYS 116 3.027 -1.154 -17.999 958 HG3 LYS 116 HG1 LYS 116 3.322 -0.073 -19.364 959 HD2 LYS 116 HD2 LYS 116 2.324 0.814 -16.657 960 HD3 LYS 116 HD1 LYS 116 4.014 0.866 -17.166 961 HE2 LYS 116 HE2 LYS 116 2.095 2.128 -19.009 962 HE3 LYS 116 HE1 LYS 116 2.278 2.924 -17.447 963 HZ1 LYS 116 HZ1 LYS 116 4.419 2.335 -19.415 964 HZ2 LYS 116 HZ2 LYS 116 4.709 2.921 -17.855 965 HZ3 LYS 116 HZ3 LYS 116 3.839 3.859 -18.961 966 HA PRO 117 HA PRO 117 -0.103 1.966 -17.950 967 HB2 PRO 117 HB2 PRO 117 -1.902 3.896 -18.289 968 HB3 PRO 117 HB1 PRO 117 -1.336 2.944 -19.666 969 HG2 PRO 117 HG2 PRO 117 -3.929 2.829 -18.227 970 HG3 PRO 117 HG1 PRO 117 -3.567 2.473 -19.923 971 HD2 PRO 117 HD2 PRO 117 -3.840 0.615 -17.770 972 HD3 PRO 117 HD1 PRO 117 -3.383 0.267 -19.448 973 H ASN 118 HN ASN 118 0.385 1.822 -15.762 974 HA ASN 118 HA ASN 118 -1.381 3.279 -13.970 975 HB2 ASN 118 HB2 ASN 118 -0.411 0.530 -13.187 976 HB3 ASN 118 HB1 ASN 118 -1.530 1.567 -12.308 977 HD21 ASN 118 HD21 ASN 118 -1.134 -0.170 -15.362 978 HD22 ASN 118 HD22 ASN 118 -2.810 -0.536 -15.570 979 H ASN 119 HN ASN 119 -0.034 4.813 -13.282 980 HA ASN 119 HA ASN 119 2.307 4.060 -11.776 981 HB2 ASN 119 HB2 ASN 119 2.573 5.721 -14.287 982 HB3 ASN 119 HB1 ASN 119 3.829 5.568 -13.062 983 HD21 ASN 119 HD21 ASN 119 1.959 3.856 -15.469 984 HD22 ASN 119 HD22 ASN 119 3.059 2.541 -15.663 985 H THR 120 HN THR 120 -0.208 5.363 -11.216 986 HA THR 120 HA THR 120 -0.207 8.100 -11.073 987 HB THR 120 HB THR 120 -1.074 6.718 -8.601 988 HG1 THR 120 HG1 THR 120 -1.872 5.121 -9.705 989 HG21 THR 120 HG21 THR 120 -2.260 8.593 -8.558 990 HG22 THR 120 HG22 THR 120 -3.265 7.849 -9.802 991 HG23 THR 120 HG23 THR 120 -1.948 8.929 -10.261 992 H HIS 121 HN HIS 121 1.255 5.863 -8.724 993 HA HIS 121 HA HIS 121 2.909 8.105 -7.765 994 HB2 HIS 121 HB2 HIS 121 1.365 6.063 -6.255 995 HB3 HIS 121 HB1 HIS 121 2.948 6.496 -5.619 996 HD1 HIS 121 HD1 HIS 121 3.273 9.010 -4.894 997 HD2 HIS 121 HD2 HIS 121 -0.623 7.937 -5.863 998 HE1 HIS 121 HE1 HIS 121 1.823 10.851 -3.984 999 HE2 HIS 121 HE2 HIS 121 -0.521 10.225 -4.661 1000 H GLU 122 HN GLU 122 3.378 6.023 -9.856 1001 HA GLU 122 HA GLU 122 5.117 4.031 -8.962 1002 HB2 GLU 122 HB2 GLU 122 4.171 4.084 -11.228 1003 HB3 GLU 122 HB1 GLU 122 5.148 5.495 -11.607 1004 HG2 GLU 122 HG2 GLU 122 6.312 3.730 -12.562 1005 HG3 GLU 122 HG1 GLU 122 7.161 4.026 -11.045 1006 H GLN 123 HN GLN 123 5.889 7.264 -10.241 1007 HA GLN 123 HA GLN 123 8.637 7.176 -10.048 1008 HB2 GLN 123 HB2 GLN 123 6.858 9.556 -9.496 1009 HB3 GLN 123 HB1 GLN 123 8.569 9.626 -9.895 1010 HG2 GLN 123 HG2 GLN 123 6.436 8.508 -11.700 1011 HG3 GLN 123 HG1 GLN 123 7.084 10.144 -11.797 1012 HE21 GLN 123 HE21 GLN 123 7.582 6.829 -12.523 1013 HE22 GLN 123 HE22 GLN 123 9.072 7.008 -13.379 1014 H LEU 124 HN LEU 124 6.315 7.362 -7.489 1015 HA LEU 124 HA LEU 124 8.198 8.312 -5.520 1016 HB2 LEU 124 HB2 LEU 124 5.722 8.771 -5.477 1017 HB3 LEU 124 HB1 LEU 124 5.487 7.087 -5.047 1018 HG LEU 124 HG LEU 124 7.268 7.835 -3.142 1019 HD11 LEU 124 HD11 LEU 124 5.819 10.273 -4.045 1020 HD12 LEU 124 HD12 LEU 124 7.469 10.094 -3.449 1021 HD13 LEU 124 HD13 LEU 124 6.114 10.044 -2.322 1022 HD21 LEU 124 HD21 LEU 124 5.481 7.700 -1.629 1023 HD22 LEU 124 HD22 LEU 124 4.989 6.699 -2.996 1024 HD23 LEU 124 HD23 LEU 124 4.324 8.321 -2.806 1025 H LEU 125 HN LEU 125 6.571 5.234 -6.235 1026 HA LEU 125 HA LEU 125 7.984 3.837 -4.158 1027 HB2 LEU 125 HB2 LEU 125 6.189 2.910 -6.393 1028 HB3 LEU 125 HB1 LEU 125 6.934 1.811 -5.248 1029 HG LEU 125 HG LEU 125 5.739 3.579 -3.556 1030 HD11 LEU 125 HD11 LEU 125 4.532 4.886 -5.025 1031 HD12 LEU 125 HD12 LEU 125 3.354 3.655 -4.569 1032 HD13 LEU 125 HD13 LEU 125 4.197 3.540 -6.114 1033 HD21 LEU 125 HD21 LEU 125 5.624 0.936 -4.017 1034 HD22 LEU 125 HD22 LEU 125 4.001 1.402 -4.530 1035 HD23 LEU 125 HD23 LEU 125 4.552 1.775 -2.896 1036 H ARG 126 HN ARG 126 8.361 4.270 -7.621 1037 HA ARG 126 HA ARG 126 10.098 2.191 -8.214 1038 HB2 ARG 126 HB2 ARG 126 9.069 4.256 -9.630 1039 HB3 ARG 126 HB1 ARG 126 10.735 4.792 -9.471 1040 HG2 ARG 126 HG2 ARG 126 11.562 2.976 -10.663 1041 HG3 ARG 126 HG1 ARG 126 10.094 2.027 -10.421 1042 HD2 ARG 126 HD2 ARG 126 9.248 4.324 -11.750 1043 HD3 ARG 126 HD1 ARG 126 10.768 3.888 -12.531 1044 HE ARG 126 HE ARG 126 8.278 2.454 -12.654 1045 HH11 ARG 126 HH11 ARG 126 11.745 2.202 -12.967 1046 HH12 ARG 126 HH12 ARG 126 11.676 0.806 -13.989 1047 HH21 ARG 126 HH21 ARG 126 8.186 0.619 -13.997 1048 HH22 ARG 126 HH22 ARG 126 9.656 -0.092 -14.575 1049 H LYS 127 HN LYS 127 10.809 5.369 -6.845 1050 HA LYS 127 HA LYS 127 13.648 4.877 -6.763 1051 HB2 LYS 127 HB2 LYS 127 12.277 7.042 -5.201 1052 HB3 LYS 127 HB1 LYS 127 13.878 7.048 -5.926 1053 HG2 LYS 127 HG2 LYS 127 11.349 7.010 -7.543 1054 HG3 LYS 127 HG1 LYS 127 12.154 8.497 -7.040 1055 HD2 LYS 127 HD2 LYS 127 14.009 6.625 -8.247 1056 HD3 LYS 127 HD1 LYS 127 12.675 7.016 -9.334 1057 HE2 LYS 127 HE2 LYS 127 14.723 8.509 -9.459 1058 HE3 LYS 127 HE1 LYS 127 13.167 9.316 -9.279 1059 HZ1 LYS 127 HZ1 LYS 127 14.613 8.663 -6.831 1060 HZ2 LYS 127 HZ2 LYS 127 13.664 10.014 -7.199 1061 HZ3 LYS 127 HZ3 LYS 127 15.247 9.910 -7.783 1062 H SER 128 HN SER 128 10.989 4.996 -4.434 1063 HA SER 128 HA SER 128 12.378 4.677 -2.071 1064 HB2 SER 128 HB2 SER 128 10.133 5.080 -1.746 1065 HB3 SER 128 HB1 SER 128 9.637 3.952 -3.005 1066 HG SER 128 HG SER 128 9.804 3.534 -0.381 1067 H GLU 129 HN GLU 129 11.271 2.140 -4.311 1068 HA GLU 129 HA GLU 129 12.150 -0.014 -2.689 1069 HB2 GLU 129 HB2 GLU 129 10.479 -0.372 -4.434 1070 HB3 GLU 129 HB1 GLU 129 11.639 0.107 -5.669 1071 HG2 GLU 129 HG2 GLU 129 11.311 -2.333 -5.514 1072 HG3 GLU 129 HG1 GLU 129 12.979 -1.831 -5.259 1073 H ALA 130 HN ALA 130 13.518 1.223 -5.742 1074 HA ALA 130 HA ALA 130 15.913 -0.206 -5.624 1075 HB1 ALA 130 HB1 ALA 130 16.383 0.822 -7.558 1076 HB2 ALA 130 HB2 ALA 130 16.127 2.430 -6.877 1077 HB3 ALA 130 HB3 ALA 130 14.750 1.475 -7.427 1078 H GLN 131 HN GLN 131 14.951 2.740 -4.053 1079 HA GLN 131 HA GLN 131 17.441 3.846 -3.468 1080 HB2 GLN 131 HB2 GLN 131 14.709 4.060 -2.337 1081 HB3 GLN 131 HB1 GLN 131 16.023 4.600 -1.308 1082 HG2 GLN 131 HG2 GLN 131 16.421 5.653 -3.910 1083 HG3 GLN 131 HG1 GLN 131 14.764 5.980 -3.415 1084 HE21 GLN 131 HE21 GLN 131 18.121 6.246 -2.356 1085 HE22 GLN 131 HE22 GLN 131 17.896 7.670 -1.403 1086 H ALA 132 HN ALA 132 15.476 1.583 -1.554 1087 HA ALA 132 HA ALA 132 17.628 1.273 0.369 1088 HB1 ALA 132 HB1 ALA 132 15.891 -0.420 1.329 1089 HB2 ALA 132 HB2 ALA 132 14.783 0.406 0.234 1090 HB3 ALA 132 HB3 ALA 132 15.626 1.316 1.487 1091 H LYS 133 HN LYS 133 16.363 -0.391 -2.392 1092 HA LYS 133 HA LYS 133 17.103 -3.009 -1.887 1093 HB2 LYS 133 HB2 LYS 133 16.809 -1.365 -4.357 1094 HB3 LYS 133 HB1 LYS 133 17.575 -2.940 -4.502 1095 HG2 LYS 133 HG2 LYS 133 14.784 -2.319 -3.582 1096 HG3 LYS 133 HG1 LYS 133 15.287 -3.241 -4.998 1097 HD2 LYS 133 HD2 LYS 133 15.565 -4.034 -2.105 1098 HD3 LYS 133 HD1 LYS 133 14.519 -4.773 -3.317 1099 HE2 LYS 133 HE2 LYS 133 17.055 -4.893 -4.437 1100 HE3 LYS 133 HE1 LYS 133 17.317 -5.261 -2.732 1101 HZ1 LYS 133 HZ1 LYS 133 15.189 -6.769 -3.237 1102 HZ2 LYS 133 HZ2 LYS 133 16.779 -7.322 -3.410 1103 HZ3 LYS 133 HZ3 LYS 133 15.918 -6.790 -4.765 1104 H LYS 134 HN LYS 134 19.109 -0.301 -2.870 1105 HA LYS 134 HA LYS 134 21.409 -1.985 -3.284 1106 HB2 LYS 134 HB2 LYS 134 21.274 -0.187 -4.795 1107 HB3 LYS 134 HB1 LYS 134 20.910 0.967 -3.520 1108 HG2 LYS 134 HG2 LYS 134 23.195 0.730 -2.667 1109 HG3 LYS 134 HG1 LYS 134 23.556 -0.399 -3.975 1110 HD2 LYS 134 HD2 LYS 134 22.416 2.215 -4.760 1111 HD3 LYS 134 HD1 LYS 134 24.060 2.233 -4.121 1112 HE2 LYS 134 HE2 LYS 134 24.908 1.235 -5.946 1113 HE3 LYS 134 HE1 LYS 134 23.554 0.114 -6.078 1114 HZ1 LYS 134 HZ1 LYS 134 23.141 2.937 -6.774 1115 HZ2 LYS 134 HZ2 LYS 134 22.364 1.559 -7.373 1116 HZ3 LYS 134 HZ3 LYS 134 23.935 1.930 -7.878 1117 H GLU 135 HN GLU 135 20.097 -0.019 -0.740 1118 HA GLU 135 HA GLU 135 22.606 -0.281 0.770 1119 HB2 GLU 135 HB2 GLU 135 20.897 1.385 2.232 1120 HB3 GLU 135 HB1 GLU 135 22.297 1.865 1.282 1121 HG2 GLU 135 HG2 GLU 135 20.947 2.348 -0.614 1122 HG3 GLU 135 HG1 GLU 135 19.531 1.607 0.132 1123 H LYS 136 HN LYS 136 19.665 -1.807 0.513 1124 HA LYS 136 HA LYS 136 18.342 -3.034 1.932 1125 HB2 LYS 136 HB2 LYS 136 21.054 -3.683 3.102 1126 HB3 LYS 136 HB1 LYS 136 19.600 -4.663 3.248 1127 HG2 LYS 136 HG2 LYS 136 19.611 -4.773 0.708 1128 HG3 LYS 136 HG1 LYS 136 21.252 -4.133 0.802 1129 HD2 LYS 136 HD2 LYS 136 21.759 -6.349 0.848 1130 HD3 LYS 136 HD1 LYS 136 21.474 -6.121 2.575 1131 HE2 LYS 136 HE2 LYS 136 19.566 -7.325 2.552 1132 HE3 LYS 136 HE1 LYS 136 19.085 -6.728 0.964 1133 HZ1 LYS 136 HZ1 LYS 136 21.073 -8.222 0.202 1134 HZ2 LYS 136 HZ2 LYS 136 19.547 -8.895 0.484 1135 HZ3 LYS 136 HZ3 LYS 136 20.762 -9.032 1.654 1136 H LEU 137 HN LEU 137 17.666 -0.846 2.784 1137 HA LEU 137 HA LEU 137 18.482 0.500 4.935 1138 HB2 LEU 137 HB2 LEU 137 15.808 -0.132 3.863 1139 HB3 LEU 137 HB1 LEU 137 15.837 0.490 5.503 1140 HG LEU 137 HG LEU 137 16.929 1.849 3.039 1141 HD11 LEU 137 HD11 LEU 137 15.207 3.591 3.970 1142 HD12 LEU 137 HD12 LEU 137 14.484 2.163 4.712 1143 HD13 LEU 137 HD13 LEU 137 14.672 2.247 2.961 1144 HD21 LEU 137 HD21 LEU 137 17.122 3.764 4.821 1145 HD22 LEU 137 HD22 LEU 137 18.421 2.588 4.619 1146 HD23 LEU 137 HD23 LEU 137 17.272 2.414 5.946 1147 H ASN 138 HN ASN 138 15.707 -1.474 5.841 1148 HA ASN 138 HA ASN 138 17.228 -2.306 8.211 1149 HB2 ASN 138 HB2 ASN 138 14.771 -2.697 9.095 1150 HB3 ASN 138 HB1 ASN 138 15.510 -1.103 9.125 1151 HD21 ASN 138 HD21 ASN 138 12.706 -1.849 9.084 1152 HD22 ASN 138 HD22 ASN 138 12.021 -1.102 7.684 1153 H ILE 139 HN ILE 139 14.158 -3.678 7.103 1154 HA ILE 139 HA ILE 139 15.318 -6.322 7.350 1155 HB ILE 139 HB ILE 139 13.032 -7.154 7.069 1156 HG12 ILE 139 HG12 ILE 139 11.782 -4.498 7.229 1157 HG13 ILE 139 HG11 ILE 139 12.570 -4.829 5.689 1158 HG21 ILE 139 HG21 ILE 139 12.433 -6.683 9.206 1159 HG22 ILE 139 HG22 ILE 139 12.675 -4.948 9.010 1160 HG23 ILE 139 HG23 ILE 139 14.063 -6.010 9.242 1161 HD11 ILE 139 HD11 ILE 139 10.522 -6.615 6.977 1162 HD12 ILE 139 HD12 ILE 139 11.230 -6.794 5.371 1163 HD13 ILE 139 HD13 ILE 139 10.180 -5.422 5.725 1164 H TRP 140 HN TRP 140 16.622 -5.425 5.306 1165 HA TRP 140 HA TRP 140 15.219 -6.363 2.895 1166 HB2 TRP 140 HB2 TRP 140 17.617 -4.534 3.129 1167 HB3 TRP 140 HB1 TRP 140 16.899 -5.075 1.613 1168 HD1 TRP 140 HD1 TRP 140 15.828 -3.091 4.766 1169 HE1 TRP 140 HE1 TRP 140 14.132 -1.299 4.034 1170 HE3 TRP 140 HE3 TRP 140 15.459 -4.306 -0.181 1171 HZ2 TRP 140 HZ2 TRP 140 12.817 -0.508 1.670 1172 HZ3 TRP 140 HZ3 TRP 140 13.955 -2.984 -1.613 1173 HH2 TRP 140 HH2 TRP 140 12.660 -1.123 -0.703 Start of MODEL 6 1 H1 ALA 1 HT1 ALA 1 1.693 33.412 -4.187 2 H2 ALA 1 HT2 ALA 1 1.659 32.548 -5.669 3 H3 ALA 1 HT3 ALA 1 2.591 31.961 -4.353 4 HA ALA 1 HA ALA 1 0.406 30.864 -4.828 5 HB1 ALA 1 HB1 ALA 1 1.874 30.848 -2.694 6 HB2 ALA 1 HB2 ALA 1 0.212 30.266 -2.600 7 HB3 ALA 1 HB3 ALA 1 0.614 31.883 -2.024 8 H THR 2 HN THR 2 -1.739 31.102 -5.036 9 HA THR 2 HA THR 2 -3.185 33.232 -3.766 10 HB THR 2 HB THR 2 -3.169 33.256 -6.779 11 HG1 THR 2 HG1 THR 2 -1.177 33.963 -6.400 12 HG21 THR 2 HG21 THR 2 -4.510 34.809 -4.695 13 HG22 THR 2 HG22 THR 2 -4.946 34.548 -6.384 14 HG23 THR 2 HG23 THR 2 -3.747 35.770 -5.960 15 H SER 3 HN SER 3 -3.218 30.794 -6.344 16 HA SER 3 HA SER 3 -6.004 30.167 -5.641 17 HB2 SER 3 HB2 SER 3 -4.607 29.105 -8.081 18 HB3 SER 3 HB1 SER 3 -6.331 29.360 -7.814 19 HG SER 3 HG SER 3 -5.818 31.652 -7.778 20 H THR 4 HN THR 4 -6.494 27.730 -6.115 21 HA THR 4 HA THR 4 -4.388 25.882 -5.506 22 HB THR 4 HB THR 4 -6.510 25.803 -3.431 23 HG1 THR 4 HG1 THR 4 -6.099 27.853 -3.033 24 HG21 THR 4 HG21 THR 4 -3.673 25.666 -2.701 25 HG22 THR 4 HG22 THR 4 -4.241 24.395 -3.784 26 HG23 THR 4 HG23 THR 4 -5.027 24.641 -2.225 27 H LYS 5 HN LYS 5 -5.575 25.502 -7.659 28 HA LYS 5 HA LYS 5 -8.100 24.099 -7.407 29 HB2 LYS 5 HB2 LYS 5 -6.485 25.211 -9.597 30 HB3 LYS 5 HB1 LYS 5 -7.298 23.703 -9.994 31 HG2 LYS 5 HG2 LYS 5 -8.706 26.090 -8.827 32 HG3 LYS 5 HG1 LYS 5 -8.561 25.785 -10.559 33 HD2 LYS 5 HD2 LYS 5 -10.398 24.536 -10.420 34 HD3 LYS 5 HD1 LYS 5 -9.475 23.382 -9.458 35 HE2 LYS 5 HE2 LYS 5 -11.378 23.892 -8.171 36 HE3 LYS 5 HE1 LYS 5 -10.059 24.811 -7.446 37 HZ1 LYS 5 HZ1 LYS 5 -12.439 25.842 -8.153 38 HZ2 LYS 5 HZ2 LYS 5 -11.500 26.227 -9.506 39 HZ3 LYS 5 HZ3 LYS 5 -11.019 26.745 -7.970 40 H LYS 6 HN LYS 6 -7.777 22.197 -6.340 41 HA LYS 6 HA LYS 6 -5.586 20.450 -7.039 42 HB2 LYS 6 HB2 LYS 6 -6.782 20.814 -4.717 43 HB3 LYS 6 HB1 LYS 6 -7.870 19.576 -5.324 44 HG2 LYS 6 HG2 LYS 6 -6.386 18.230 -4.279 45 HG3 LYS 6 HG1 LYS 6 -5.558 18.359 -5.833 46 HD2 LYS 6 HD2 LYS 6 -4.957 20.459 -3.838 47 HD3 LYS 6 HD1 LYS 6 -4.358 18.838 -3.479 48 HE2 LYS 6 HE2 LYS 6 -2.890 18.847 -5.214 49 HE3 LYS 6 HE1 LYS 6 -3.930 19.847 -6.228 50 HZ1 LYS 6 HZ1 LYS 6 -2.826 21.138 -3.871 51 HZ2 LYS 6 HZ2 LYS 6 -3.033 21.738 -5.438 52 HZ3 LYS 6 HZ3 LYS 6 -1.712 20.742 -5.082 53 H LEU 7 HN LEU 7 -5.847 18.285 -7.806 54 HA LEU 7 HA LEU 7 -7.612 18.078 -10.005 55 HB2 LEU 7 HB2 LEU 7 -5.715 16.205 -8.644 56 HB3 LEU 7 HB1 LEU 7 -6.817 15.590 -9.863 57 HG LEU 7 HG LEU 7 -5.874 17.178 -11.500 58 HD11 LEU 7 HD11 LEU 7 -4.355 18.059 -9.106 59 HD12 LEU 7 HD12 LEU 7 -5.027 19.006 -10.433 60 HD13 LEU 7 HD13 LEU 7 -3.540 18.089 -10.670 61 HD21 LEU 7 HD21 LEU 7 -3.664 15.593 -10.220 62 HD22 LEU 7 HD22 LEU 7 -3.895 15.968 -11.928 63 HD23 LEU 7 HD23 LEU 7 -4.982 14.840 -11.117 64 H HIS 8 HN HIS 8 -7.409 15.688 -7.379 65 HA HIS 8 HA HIS 8 -10.062 15.915 -6.501 66 HB2 HIS 8 HB2 HIS 8 -10.969 13.805 -7.536 67 HB3 HIS 8 HB1 HIS 8 -10.776 15.152 -8.653 68 HD1 HIS 8 HD1 HIS 8 -8.979 14.920 -10.492 69 HD2 HIS 8 HD2 HIS 8 -9.290 11.609 -8.001 70 HE1 HIS 8 HE1 HIS 8 -7.677 13.097 -11.633 71 HE2 HIS 8 HE2 HIS 8 -7.800 11.132 -10.060 72 H LYS 9 HN LYS 9 -9.781 15.259 -4.482 73 HA LYS 9 HA LYS 9 -8.180 12.835 -3.995 74 HB2 LYS 9 HB2 LYS 9 -7.793 13.807 -1.707 75 HB3 LYS 9 HB1 LYS 9 -7.034 14.687 -3.027 76 HG2 LYS 9 HG2 LYS 9 -9.724 15.517 -2.033 77 HG3 LYS 9 HG1 LYS 9 -8.267 15.980 -1.151 78 HD2 LYS 9 HD2 LYS 9 -7.651 16.559 -3.786 79 HD3 LYS 9 HD1 LYS 9 -9.349 17.018 -3.644 80 HE2 LYS 9 HE2 LYS 9 -8.063 18.936 -3.087 81 HE3 LYS 9 HE1 LYS 9 -8.728 18.305 -1.581 82 HZ1 LYS 9 HZ1 LYS 9 -6.176 18.947 -1.888 83 HZ2 LYS 9 HZ2 LYS 9 -6.099 17.318 -2.337 84 HZ3 LYS 9 HZ3 LYS 9 -6.699 17.746 -0.815 85 H GLU 10 HN GLU 10 -8.815 11.597 -2.053 86 HA GLU 10 HA GLU 10 -11.527 11.950 -1.108 87 HB2 GLU 10 HB2 GLU 10 -10.778 9.915 -3.109 88 HB3 GLU 10 HB1 GLU 10 -11.719 9.316 -1.750 89 HG2 GLU 10 HG2 GLU 10 -13.410 11.065 -2.213 90 HG3 GLU 10 HG1 GLU 10 -12.489 11.522 -3.645 91 HA PRO 11 HA PRO 11 -9.402 10.115 2.361 92 HB2 PRO 11 HB2 PRO 11 -11.331 10.382 4.188 93 HB3 PRO 11 HB1 PRO 11 -10.494 11.794 3.531 94 HG2 PRO 11 HG2 PRO 11 -13.189 10.698 2.841 95 HG3 PRO 11 HG1 PRO 11 -12.683 12.385 3.041 96 HD2 PRO 11 HD2 PRO 11 -12.948 11.096 0.609 97 HD3 PRO 11 HD1 PRO 11 -11.947 12.534 0.887 98 H ALA 12 HN ALA 12 -10.094 8.479 4.176 99 HA ALA 12 HA ALA 12 -12.056 6.534 3.480 100 HB1 ALA 12 HB1 ALA 12 -10.873 5.136 2.227 101 HB2 ALA 12 HB2 ALA 12 -9.672 4.981 3.511 102 HB3 ALA 12 HB3 ALA 12 -9.502 6.244 2.292 103 H THR 13 HN THR 13 -12.227 4.824 5.050 104 HA THR 13 HA THR 13 -10.718 5.309 7.529 105 HB THR 13 HB THR 13 -13.675 4.696 7.371 106 HG1 THR 13 HG1 THR 13 -12.283 7.109 7.866 107 HG21 THR 13 HG21 THR 13 -13.317 3.992 9.466 108 HG22 THR 13 HG22 THR 13 -13.277 5.718 9.828 109 HG23 THR 13 HG23 THR 13 -11.770 4.830 9.599 110 H LEU 14 HN LEU 14 -9.830 3.535 8.385 111 HA LEU 14 HA LEU 14 -9.973 1.048 7.059 112 HB2 LEU 14 HB2 LEU 14 -8.358 2.218 9.030 113 HB3 LEU 14 HB1 LEU 14 -9.047 0.789 9.782 114 HG LEU 14 HG LEU 14 -6.855 0.357 8.745 115 HD11 LEU 14 HD11 LEU 14 -8.352 -1.310 6.965 116 HD12 LEU 14 HD12 LEU 14 -9.217 -1.148 8.494 117 HD13 LEU 14 HD13 LEU 14 -7.553 -1.728 8.481 118 HD21 LEU 14 HD21 LEU 14 -8.241 1.481 6.376 119 HD22 LEU 14 HD22 LEU 14 -7.127 0.140 6.113 120 HD23 LEU 14 HD23 LEU 14 -6.556 1.621 6.880 121 H ILE 15 HN ILE 15 -11.748 -0.160 7.026 122 HA ILE 15 HA ILE 15 -13.638 -0.210 9.181 123 HB ILE 15 HB ILE 15 -13.419 -2.122 6.849 124 HG12 ILE 15 HG12 ILE 15 -13.589 0.241 6.119 125 HG13 ILE 15 HG11 ILE 15 -15.017 -0.697 5.694 126 HG21 ILE 15 HG21 ILE 15 -15.406 -1.688 9.001 127 HG22 ILE 15 HG22 ILE 15 -14.928 -3.173 8.181 128 HG23 ILE 15 HG23 ILE 15 -16.024 -2.042 7.389 129 HD11 ILE 15 HD11 ILE 15 -14.705 1.501 7.662 130 HD12 ILE 15 HD12 ILE 15 -15.912 0.253 7.972 131 HD13 ILE 15 HD13 ILE 15 -15.986 1.202 6.488 132 H LYS 16 HN LYS 16 -11.159 -2.374 7.905 133 HA LYS 16 HA LYS 16 -10.553 -3.448 10.446 134 HB2 LYS 16 HB2 LYS 16 -12.543 -4.868 8.812 135 HB3 LYS 16 HB1 LYS 16 -11.206 -5.877 9.347 136 HG2 LYS 16 HG2 LYS 16 -12.106 -4.299 11.545 137 HG3 LYS 16 HG1 LYS 16 -13.493 -5.086 10.793 138 HD2 LYS 16 HD2 LYS 16 -11.200 -6.862 11.066 139 HD3 LYS 16 HD1 LYS 16 -11.760 -6.227 12.615 140 HE2 LYS 16 HE2 LYS 16 -13.937 -7.080 10.877 141 HE3 LYS 16 HE1 LYS 16 -12.817 -8.384 11.264 142 HZ1 LYS 16 HZ1 LYS 16 -13.233 -8.172 13.528 143 HZ2 LYS 16 HZ2 LYS 16 -14.764 -7.981 12.833 144 HZ3 LYS 16 HZ3 LYS 16 -13.907 -6.628 13.374 145 H ALA 17 HN ALA 17 -8.497 -4.124 10.407 146 HA ALA 17 HA ALA 17 -7.078 -4.124 7.923 147 HB1 ALA 17 HB1 ALA 17 -5.708 -5.046 10.368 148 HB2 ALA 17 HB2 ALA 17 -6.362 -3.407 10.399 149 HB3 ALA 17 HB3 ALA 17 -5.200 -3.871 9.156 150 H ILE 18 HN ILE 18 -6.578 -5.819 6.686 151 HA ILE 18 HA ILE 18 -7.320 -8.488 7.592 152 HB ILE 18 HB ILE 18 -6.132 -7.958 4.898 153 HG12 ILE 18 HG12 ILE 18 -8.171 -6.367 5.713 154 HG13 ILE 18 HG11 ILE 18 -7.916 -6.862 4.049 155 HG21 ILE 18 HG21 ILE 18 -7.677 -9.763 4.244 156 HG22 ILE 18 HG22 ILE 18 -8.218 -9.873 5.919 157 HG23 ILE 18 HG23 ILE 18 -6.545 -10.248 5.505 158 HD11 ILE 18 HD11 ILE 18 -9.737 -8.250 6.004 159 HD12 ILE 18 HD12 ILE 18 -9.539 -8.634 4.294 160 HD13 ILE 18 HD13 ILE 18 -10.250 -7.093 4.775 161 H ASP 19 HN ASP 19 -4.562 -7.326 5.660 162 HA ASP 19 HA ASP 19 -2.718 -8.586 7.537 163 HB2 ASP 19 HB2 ASP 19 -3.196 -9.553 4.741 164 HB3 ASP 19 HB1 ASP 19 -1.581 -9.673 5.434 165 H GLY 20 HN GLY 20 -1.710 -8.014 4.259 166 HA2 GLY 20 HA2 GLY 20 -0.513 -5.449 5.098 167 HA3 GLY 20 HA1 GLY 20 0.408 -6.656 4.209 168 H ASP 21 HN ASP 21 -0.426 -7.260 2.058 169 HA ASP 21 HA ASP 21 -0.924 -4.958 0.495 170 HB2 ASP 21 HB2 ASP 21 -0.429 -7.805 0.029 171 HB3 ASP 21 HB1 ASP 21 -1.532 -7.095 -1.146 172 H THR 22 HN THR 22 -3.000 -6.896 2.320 173 HA THR 22 HA THR 22 -5.315 -5.902 0.798 174 HB THR 22 HB THR 22 -5.351 -8.448 2.412 175 HG1 THR 22 HG1 THR 22 -3.956 -9.017 0.879 176 HG21 THR 22 HG21 THR 22 -7.058 -7.664 0.070 177 HG22 THR 22 HG22 THR 22 -7.509 -7.361 1.748 178 HG23 THR 22 HG23 THR 22 -7.284 -9.015 1.180 179 H VAL 23 HN VAL 23 -6.730 -4.725 1.927 180 HA VAL 23 HA VAL 23 -7.044 -5.038 4.784 181 HB VAL 23 HB VAL 23 -6.667 -2.586 5.208 182 HG11 VAL 23 HG11 VAL 23 -5.026 -4.566 5.617 183 HG12 VAL 23 HG12 VAL 23 -4.457 -2.906 5.788 184 HG13 VAL 23 HG13 VAL 23 -4.093 -3.816 4.322 185 HG21 VAL 23 HG21 VAL 23 -5.527 -1.230 3.689 186 HG22 VAL 23 HG22 VAL 23 -6.698 -2.089 2.688 187 HG23 VAL 23 HG23 VAL 23 -5.011 -2.602 2.708 188 H LYS 24 HN LYS 24 -8.968 -4.135 5.568 189 HA LYS 24 HA LYS 24 -10.920 -3.539 3.500 190 HB2 LYS 24 HB2 LYS 24 -11.343 -5.130 5.435 191 HB3 LYS 24 HB1 LYS 24 -11.414 -3.712 6.471 192 HG2 LYS 24 HG2 LYS 24 -13.642 -4.314 5.914 193 HG3 LYS 24 HG1 LYS 24 -13.252 -2.840 5.027 194 HD2 LYS 24 HD2 LYS 24 -14.432 -4.378 3.580 195 HD3 LYS 24 HD1 LYS 24 -12.765 -4.202 3.030 196 HE2 LYS 24 HE2 LYS 24 -12.511 -6.404 3.147 197 HE3 LYS 24 HE1 LYS 24 -12.816 -6.337 4.883 198 HZ1 LYS 24 HZ1 LYS 24 -15.230 -6.432 4.330 199 HZ2 LYS 24 HZ2 LYS 24 -14.370 -7.833 3.934 200 HZ3 LYS 24 HZ3 LYS 24 -14.806 -6.738 2.721 201 H LEU 25 HN LEU 25 -11.637 -1.566 3.013 202 HA LEU 25 HA LEU 25 -11.123 0.617 4.916 203 HB2 LEU 25 HB2 LEU 25 -10.221 0.295 2.181 204 HB3 LEU 25 HB1 LEU 25 -11.117 1.784 2.395 205 HG LEU 25 HG LEU 25 -8.790 2.249 2.691 206 HD11 LEU 25 HD11 LEU 25 -9.955 2.136 5.459 207 HD12 LEU 25 HD12 LEU 25 -10.482 3.297 4.242 208 HD13 LEU 25 HD13 LEU 25 -8.810 3.304 4.804 209 HD21 LEU 25 HD21 LEU 25 -7.397 1.123 4.292 210 HD22 LEU 25 HD22 LEU 25 -8.122 -0.078 3.222 211 HD23 LEU 25 HD23 LEU 25 -8.757 0.150 4.852 212 H MET 26 HN MET 26 -12.565 2.453 4.735 213 HA MET 26 HA MET 26 -15.270 1.600 4.118 214 HB2 MET 26 HB2 MET 26 -14.500 2.881 6.231 215 HB3 MET 26 HB1 MET 26 -14.509 4.301 5.196 216 HG2 MET 26 HG2 MET 26 -16.762 4.381 5.081 217 HG3 MET 26 HG1 MET 26 -16.940 2.629 5.160 218 HE1 MET 26 HE1 MET 26 -18.736 2.568 8.345 219 HE2 MET 26 HE2 MET 26 -17.724 1.399 7.497 220 HE3 MET 26 HE3 MET 26 -18.798 2.460 6.585 221 H TYR 27 HN TYR 27 -16.057 1.886 2.148 222 HA TYR 27 HA TYR 27 -15.446 4.392 0.735 223 HB2 TYR 27 HB2 TYR 27 -14.159 2.443 -0.200 224 HB3 TYR 27 HB1 TYR 27 -15.699 1.701 -0.614 225 HD1 TYR 27 HD1 TYR 27 -14.734 5.276 -0.900 226 HD2 TYR 27 HD2 TYR 27 -15.652 1.669 -2.957 227 HE1 TYR 27 HE1 TYR 27 -14.740 6.502 -3.032 228 HE2 TYR 27 HE2 TYR 27 -15.661 2.883 -5.095 229 HH TYR 27 HH TYR 27 -15.618 6.307 -5.267 230 H LYS 28 HN LYS 28 -17.210 5.494 0.209 231 HA LYS 28 HA LYS 28 -19.381 6.042 -0.165 232 HB2 LYS 28 HB2 LYS 28 -19.306 3.272 -1.349 233 HB3 LYS 28 HB1 LYS 28 -20.712 4.320 -1.458 234 HG2 LYS 28 HG2 LYS 28 -19.417 5.976 -2.673 235 HG3 LYS 28 HG1 LYS 28 -17.974 4.970 -2.525 236 HD2 LYS 28 HD2 LYS 28 -18.649 3.532 -4.140 237 HD3 LYS 28 HD1 LYS 28 -20.351 3.669 -3.698 238 HE2 LYS 28 HE2 LYS 28 -20.713 5.416 -5.095 239 HE3 LYS 28 HE1 LYS 28 -19.097 6.079 -4.858 240 HZ1 LYS 28 HZ1 LYS 28 -19.251 3.548 -6.281 241 HZ2 LYS 28 HZ2 LYS 28 -18.264 4.892 -6.566 242 HZ3 LYS 28 HZ3 LYS 28 -19.869 4.894 -7.099 243 H GLY 29 HN GLY 29 -18.888 5.305 2.423 244 HA2 GLY 29 HA2 GLY 29 -19.964 4.692 4.356 245 HA3 GLY 29 HA1 GLY 29 -21.448 4.734 3.415 246 H GLN 30 HN GLN 30 -19.019 2.614 2.263 247 HA GLN 30 HA GLN 30 -20.208 0.324 3.655 248 HB2 GLN 30 HB2 GLN 30 -21.008 -0.651 1.790 249 HB3 GLN 30 HB1 GLN 30 -20.898 0.950 1.073 250 HG2 GLN 30 HG2 GLN 30 -18.695 0.399 0.173 251 HG3 GLN 30 HG1 GLN 30 -18.802 -1.205 0.896 252 HE21 GLN 30 HE21 GLN 30 -21.317 -1.980 0.353 253 HE22 GLN 30 HE22 GLN 30 -21.571 -2.085 -1.352 254 HA PRO 31 HA PRO 31 -16.024 -1.000 3.926 255 HB2 PRO 31 HB2 PRO 31 -16.321 -3.550 4.567 256 HB3 PRO 31 HB1 PRO 31 -16.990 -2.284 5.610 257 HG2 PRO 31 HG2 PRO 31 -18.394 -3.977 3.573 258 HG3 PRO 31 HG1 PRO 31 -18.893 -3.582 5.229 259 HD2 PRO 31 HD2 PRO 31 -19.788 -2.257 2.987 260 HD3 PRO 31 HD1 PRO 31 -19.740 -1.546 4.612 261 H MET 32 HN MET 32 -14.685 -1.128 2.256 262 HA MET 32 HA MET 32 -15.140 -3.218 0.229 263 HB2 MET 32 HB2 MET 32 -15.390 -0.707 -0.426 264 HB3 MET 32 HB1 MET 32 -13.632 -0.692 -0.365 265 HG2 MET 32 HG2 MET 32 -13.910 -1.177 -2.555 266 HG3 MET 32 HG1 MET 32 -13.921 -2.817 -1.908 267 HE1 MET 32 HE1 MET 32 -14.732 -3.465 -4.073 268 HE2 MET 32 HE2 MET 32 -16.416 -3.441 -4.597 269 HE3 MET 32 HE3 MET 32 -15.933 -4.438 -3.225 270 H THR 33 HN THR 33 -13.295 -4.259 -0.618 271 HA THR 33 HA THR 33 -11.113 -4.416 1.280 272 HB THR 33 HB THR 33 -11.312 -5.978 -1.282 273 HG1 THR 33 HG1 THR 33 -12.564 -6.664 1.163 274 HG21 THR 33 HG21 THR 33 -10.531 -7.713 0.627 275 HG22 THR 33 HG22 THR 33 -9.805 -6.219 1.220 276 HG23 THR 33 HG23 THR 33 -9.427 -6.800 -0.401 277 H PHE 34 HN PHE 34 -9.479 -3.042 1.113 278 HA PHE 34 HA PHE 34 -8.687 -2.080 -1.541 279 HB2 PHE 34 HB2 PHE 34 -8.470 -0.968 1.217 280 HB3 PHE 34 HB1 PHE 34 -7.234 -0.518 0.046 281 HD1 PHE 34 HD1 PHE 34 -10.917 -0.604 0.545 282 HD2 PHE 34 HD2 PHE 34 -7.625 1.194 -1.470 283 HE1 PHE 34 HE1 PHE 34 -12.425 1.098 -0.396 284 HE2 PHE 34 HE2 PHE 34 -9.128 2.902 -2.409 285 HZ PHE 34 HZ PHE 34 -11.530 2.853 -1.873 286 H ARG 35 HN ARG 35 -6.420 -2.030 -2.111 287 HA ARG 35 HA ARG 35 -4.788 -3.914 -0.566 288 HB2 ARG 35 HB2 ARG 35 -4.273 -5.231 -2.402 289 HB3 ARG 35 HB1 ARG 35 -5.960 -4.835 -2.702 290 HG2 ARG 35 HG2 ARG 35 -5.257 -4.278 -4.742 291 HG3 ARG 35 HG1 ARG 35 -4.692 -2.795 -3.972 292 HD2 ARG 35 HD2 ARG 35 -2.570 -3.312 -4.388 293 HD3 ARG 35 HD1 ARG 35 -2.757 -4.900 -3.645 294 HE ARG 35 HE ARG 35 -3.906 -5.211 -6.075 295 HH11 ARG 35 HH11 ARG 35 -0.799 -4.009 -5.034 296 HH12 ARG 35 HH12 ARG 35 0.020 -4.520 -6.471 297 HH21 ARG 35 HH21 ARG 35 -2.829 -5.886 -7.966 298 HH22 ARG 35 HH22 ARG 35 -1.131 -5.587 -8.135 299 H LEU 36 HN LEU 36 -2.553 -3.619 -0.641 300 HA LEU 36 HA LEU 36 -1.698 -0.929 -1.011 301 HB2 LEU 36 HB2 LEU 36 -0.171 -3.473 -0.444 302 HB3 LEU 36 HB1 LEU 36 0.584 -1.890 -0.524 303 HG LEU 36 HG LEU 36 -1.626 -2.567 1.413 304 HD11 LEU 36 HD11 LEU 36 0.413 -3.973 1.735 305 HD12 LEU 36 HD12 LEU 36 0.030 -2.914 3.093 306 HD13 LEU 36 HD13 LEU 36 1.329 -2.486 1.980 307 HD21 LEU 36 HD21 LEU 36 -0.838 -0.567 2.572 308 HD22 LEU 36 HD22 LEU 36 -1.352 -0.193 0.927 309 HD23 LEU 36 HD23 LEU 36 0.366 -0.305 1.309 310 H LEU 37 HN LEU 37 -2.256 -0.620 -3.247 311 HA LEU 37 HA LEU 37 -1.550 -1.970 -5.464 312 HB2 LEU 37 HB2 LEU 37 -2.610 0.403 -5.127 313 HB3 LEU 37 HB1 LEU 37 -0.974 0.956 -5.433 314 HG LEU 37 HG LEU 37 -1.039 -0.336 -7.593 315 HD11 LEU 37 HD11 LEU 37 -3.077 -1.127 -8.465 316 HD12 LEU 37 HD12 LEU 37 -4.005 -0.389 -7.161 317 HD13 LEU 37 HD13 LEU 37 -2.972 -1.776 -6.827 318 HD21 LEU 37 HD21 LEU 37 -1.609 2.179 -7.157 319 HD22 LEU 37 HD22 LEU 37 -3.238 1.676 -7.607 320 HD23 LEU 37 HD23 LEU 37 -1.903 1.458 -8.739 321 H LEU 38 HN LEU 38 0.184 -2.339 -6.735 322 HA LEU 38 HA LEU 38 2.366 -2.868 -7.136 323 HB2 LEU 38 HB2 LEU 38 3.763 -0.989 -7.578 324 HB3 LEU 38 HB1 LEU 38 2.121 -0.567 -8.025 325 HG LEU 38 HG LEU 38 3.022 0.203 -5.301 326 HD11 LEU 38 HD11 LEU 38 4.469 0.949 -7.672 327 HD12 LEU 38 HD12 LEU 38 4.791 1.354 -5.986 328 HD13 LEU 38 HD13 LEU 38 3.704 2.361 -6.943 329 HD21 LEU 38 HD21 LEU 38 1.724 2.184 -6.972 330 HD22 LEU 38 HD22 LEU 38 1.234 1.525 -5.411 331 HD23 LEU 38 HD23 LEU 38 0.807 0.678 -6.899 332 H VAL 39 HN VAL 39 1.707 -3.563 -4.535 333 HA VAL 39 HA VAL 39 4.298 -3.174 -3.205 334 HB VAL 39 HB VAL 39 1.684 -3.254 -1.696 335 HG11 VAL 39 HG11 VAL 39 4.273 -2.267 -0.596 336 HG12 VAL 39 HG12 VAL 39 3.985 -4.003 -0.709 337 HG13 VAL 39 HG13 VAL 39 2.897 -2.990 0.237 338 HG21 VAL 39 HG21 VAL 39 2.865 -0.756 -1.318 339 HG22 VAL 39 HG22 VAL 39 1.399 -1.112 -2.231 340 HG23 VAL 39 HG23 VAL 39 2.957 -1.047 -3.054 341 H ASP 40 HN ASP 40 5.131 -4.978 -2.211 342 HA ASP 40 HA ASP 40 3.505 -7.432 -2.385 343 HB2 ASP 40 HB2 ASP 40 6.316 -6.875 -3.227 344 HB3 ASP 40 HB1 ASP 40 5.932 -8.479 -2.604 345 H THR 41 HN THR 41 3.103 -8.277 -0.450 346 HA THR 41 HA THR 41 5.021 -7.770 1.726 347 HB THR 41 HB THR 41 2.765 -6.809 2.067 348 HG1 THR 41 HG1 THR 41 3.242 -8.981 3.821 349 HG21 THR 41 HG21 THR 41 1.895 -9.657 1.778 350 HG22 THR 41 HG22 THR 41 1.236 -8.209 1.018 351 HG23 THR 41 HG23 THR 41 0.973 -8.500 2.737 352 HA PRO 42 HA PRO 42 6.041 -12.049 2.059 353 HB2 PRO 42 HB2 PRO 42 5.731 -11.734 4.995 354 HB3 PRO 42 HB1 PRO 42 7.128 -12.284 4.065 355 HG2 PRO 42 HG2 PRO 42 7.090 -9.860 5.178 356 HG3 PRO 42 HG1 PRO 42 7.824 -10.127 3.585 357 HD2 PRO 42 HD2 PRO 42 5.181 -8.914 4.277 358 HD3 PRO 42 HD1 PRO 42 6.335 -8.458 3.008 359 H GLU 43 HN GLU 43 4.026 -12.785 1.170 360 HA GLU 43 HA GLU 43 1.593 -13.038 2.391 361 HB2 GLU 43 HB2 GLU 43 3.002 -14.874 0.464 362 HB3 GLU 43 HB1 GLU 43 1.351 -15.168 0.992 363 HG2 GLU 43 HG2 GLU 43 2.256 -12.616 -0.313 364 HG3 GLU 43 HG1 GLU 43 1.572 -13.983 -1.192 365 H THR 44 HN THR 44 0.518 -14.718 3.518 366 HA THR 44 HA THR 44 2.031 -16.876 4.687 367 HB THR 44 HB THR 44 2.716 -15.226 6.252 368 HG1 THR 44 HG1 THR 44 1.615 -15.908 8.150 369 HG21 THR 44 HG21 THR 44 -0.021 -14.392 7.012 370 HG22 THR 44 HG22 THR 44 0.691 -13.683 5.563 371 HG23 THR 44 HG23 THR 44 1.507 -13.516 7.118 372 H LYS 45 HN LYS 45 -0.938 -14.944 5.010 373 HA LYS 45 HA LYS 45 -3.135 -15.521 4.993 374 HB2 LYS 45 HB2 LYS 45 -2.213 -18.276 4.161 375 HB3 LYS 45 HB1 LYS 45 -3.836 -17.619 4.005 376 HG2 LYS 45 HG2 LYS 45 -1.443 -16.433 2.627 377 HG3 LYS 45 HG1 LYS 45 -2.471 -17.669 1.901 378 HD2 LYS 45 HD2 LYS 45 -3.998 -16.151 1.328 379 HD3 LYS 45 HD1 LYS 45 -4.073 -15.531 2.978 380 HE2 LYS 45 HE2 LYS 45 -1.695 -14.519 2.121 381 HE3 LYS 45 HE1 LYS 45 -2.639 -14.503 0.632 382 HZ1 LYS 45 HZ1 LYS 45 -3.665 -13.374 3.169 383 HZ2 LYS 45 HZ2 LYS 45 -4.253 -13.124 1.603 384 HZ3 LYS 45 HZ3 LYS 45 -2.770 -12.454 2.066 385 H HIS 46 HN HIS 46 -1.441 -18.461 6.107 386 HA HIS 46 HA HIS 46 -2.356 -18.076 8.801 387 HB2 HIS 46 HB2 HIS 46 -3.916 -19.694 6.970 388 HB3 HIS 46 HB1 HIS 46 -3.335 -20.654 8.326 389 HD1 HIS 46 HD1 HIS 46 -6.348 -19.863 7.860 390 HD2 HIS 46 HD2 HIS 46 -3.706 -17.951 10.435 391 HE1 HIS 46 HE1 HIS 46 -7.789 -18.725 9.578 392 HE2 HIS 46 HE2 HIS 46 -6.166 -17.644 11.173 393 HA PRO 47 HA PRO 47 1.361 -20.476 9.267 394 HB2 PRO 47 HB2 PRO 47 1.451 -20.584 11.945 395 HB3 PRO 47 HB1 PRO 47 1.728 -19.072 11.070 396 HG2 PRO 47 HG2 PRO 47 -0.741 -20.030 12.464 397 HG3 PRO 47 HG1 PRO 47 -0.009 -18.415 12.469 398 HD2 PRO 47 HD2 PRO 47 -2.140 -19.126 10.894 399 HD3 PRO 47 HD1 PRO 47 -0.997 -17.832 10.487 400 H LYS 48 HN LYS 48 1.260 -22.567 8.676 401 HA LYS 48 HA LYS 48 -0.381 -24.398 10.293 402 HB2 LYS 48 HB2 LYS 48 -0.486 -25.862 8.384 403 HB3 LYS 48 HB1 LYS 48 -0.950 -24.245 7.875 404 HG2 LYS 48 HG2 LYS 48 1.595 -24.067 7.246 405 HG3 LYS 48 HG1 LYS 48 1.474 -25.826 7.201 406 HD2 LYS 48 HD2 LYS 48 -0.690 -24.375 5.829 407 HD3 LYS 48 HD1 LYS 48 0.911 -24.208 5.105 408 HE2 LYS 48 HE2 LYS 48 0.829 -26.877 5.603 409 HE3 LYS 48 HE1 LYS 48 -0.866 -26.543 5.255 410 HZ1 LYS 48 HZ1 LYS 48 0.364 -27.136 3.257 411 HZ2 LYS 48 HZ2 LYS 48 1.421 -25.836 3.496 412 HZ3 LYS 48 HZ3 LYS 48 -0.211 -25.547 3.161 413 H LYS 49 HN LYS 49 0.737 -26.802 9.591 414 HA LYS 49 HA LYS 49 3.012 -26.885 11.298 415 HB2 LYS 49 HB2 LYS 49 2.114 -29.100 9.463 416 HB3 LYS 49 HB1 LYS 49 2.973 -29.240 10.990 417 HG2 LYS 49 HG2 LYS 49 0.993 -29.645 11.908 418 HG3 LYS 49 HG1 LYS 49 0.659 -27.926 11.693 419 HD2 LYS 49 HD2 LYS 49 -0.601 -28.279 9.779 420 HD3 LYS 49 HD1 LYS 49 0.147 -29.844 9.455 421 HE2 LYS 49 HE2 LYS 49 -1.258 -30.953 10.840 422 HE3 LYS 49 HE1 LYS 49 -1.352 -29.617 11.987 423 HZ1 LYS 49 HZ1 LYS 49 -2.635 -28.568 9.911 424 HZ2 LYS 49 HZ2 LYS 49 -3.413 -29.438 11.136 425 HZ3 LYS 49 HZ3 LYS 49 -3.016 -30.200 9.680 426 H GLY 50 HN GLY 50 4.045 -25.174 9.758 427 HA2 GLY 50 HA2 GLY 50 6.410 -25.655 8.872 428 HA3 GLY 50 HA1 GLY 50 5.547 -26.540 7.622 429 H VAL 51 HN VAL 51 5.914 -23.332 9.077 430 HA VAL 51 HA VAL 51 4.676 -22.039 6.803 431 HB VAL 51 HB VAL 51 6.164 -20.727 9.078 432 HG11 VAL 51 HG11 VAL 51 5.859 -19.008 7.634 433 HG12 VAL 51 HG12 VAL 51 4.263 -18.984 8.381 434 HG13 VAL 51 HG13 VAL 51 4.496 -19.781 6.825 435 HG21 VAL 51 HG21 VAL 51 4.311 -22.248 9.829 436 HG22 VAL 51 HG22 VAL 51 3.197 -21.222 8.924 437 HG23 VAL 51 HG23 VAL 51 4.114 -20.553 10.274 438 H GLU 52 HN GLU 52 5.729 -20.538 5.425 439 HA GLU 52 HA GLU 52 8.648 -20.893 5.239 440 HB2 GLU 52 HB2 GLU 52 6.934 -21.935 3.444 441 HB3 GLU 52 HB1 GLU 52 7.131 -20.330 2.754 442 HG2 GLU 52 HG2 GLU 52 9.651 -20.772 2.976 443 HG3 GLU 52 HG1 GLU 52 9.188 -22.461 3.177 444 H LYS 53 HN LYS 53 6.038 -18.836 3.937 445 HA LYS 53 HA LYS 53 7.827 -16.522 4.209 446 HB2 LYS 53 HB2 LYS 53 6.119 -15.399 2.710 447 HB3 LYS 53 HB1 LYS 53 7.048 -16.700 1.977 448 HG2 LYS 53 HG2 LYS 53 4.501 -17.501 3.211 449 HG3 LYS 53 HG1 LYS 53 4.376 -16.461 1.791 450 HD2 LYS 53 HD2 LYS 53 6.150 -18.163 0.824 451 HD3 LYS 53 HD1 LYS 53 5.439 -19.230 2.037 452 HE2 LYS 53 HE2 LYS 53 3.186 -18.615 1.072 453 HE3 LYS 53 HE1 LYS 53 4.060 -17.854 -0.256 454 HZ1 LYS 53 HZ1 LYS 53 3.279 -20.388 -0.286 455 HZ2 LYS 53 HZ2 LYS 53 4.822 -20.586 0.376 456 HZ3 LYS 53 HZ3 LYS 53 4.637 -19.833 -1.128 457 H TYR 54 HN TYR 54 7.267 -14.754 5.411 458 HA TYR 54 HA TYR 54 4.672 -14.264 6.428 459 HB2 TYR 54 HB2 TYR 54 5.268 -14.660 8.861 460 HB3 TYR 54 HB1 TYR 54 4.999 -16.108 7.896 461 HD1 TYR 54 HD2 TYR 54 6.972 -17.439 7.111 462 HD2 TYR 54 HD1 TYR 54 7.357 -14.256 9.906 463 HE1 TYR 54 HE2 TYR 54 9.177 -18.298 7.775 464 HE2 TYR 54 HE1 TYR 54 9.563 -15.105 10.579 465 HH TYR 54 HH TYR 54 11.240 -17.473 8.809 466 H GLY 55 HN GLY 55 4.512 -12.245 7.374 467 HA2 GLY 55 HA2 GLY 55 7.042 -10.790 7.794 468 HA3 GLY 55 HA1 GLY 55 5.762 -10.095 6.812 469 HA PRO 56 HA PRO 56 4.315 -10.291 11.520 470 HB2 PRO 56 HB2 PRO 56 6.483 -9.832 13.170 471 HB3 PRO 56 HB1 PRO 56 5.753 -11.415 12.885 472 HG2 PRO 56 HG2 PRO 56 8.179 -10.192 11.638 473 HG3 PRO 56 HG1 PRO 56 7.912 -11.863 12.171 474 HD2 PRO 56 HD2 PRO 56 7.790 -11.182 9.580 475 HD3 PRO 56 HD1 PRO 56 6.703 -12.408 10.268 476 H GLU 57 HN GLU 57 7.235 -8.437 10.677 477 HA GLU 57 HA GLU 57 6.241 -6.042 11.923 478 HB2 GLU 57 HB2 GLU 57 8.594 -6.426 10.062 479 HB3 GLU 57 HB1 GLU 57 8.262 -4.986 11.015 480 HG2 GLU 57 HG2 GLU 57 9.423 -5.839 12.683 481 HG3 GLU 57 HG1 GLU 57 8.275 -7.170 12.798 482 H ALA 58 HN ALA 58 6.187 -7.455 8.748 483 HA ALA 58 HA ALA 58 5.562 -5.060 7.330 484 HB1 ALA 58 HB1 ALA 58 6.490 -7.367 6.483 485 HB2 ALA 58 HB2 ALA 58 5.487 -6.356 5.442 486 HB3 ALA 58 HB3 ALA 58 4.777 -7.734 6.283 487 H SER 59 HN SER 59 3.574 -7.902 8.187 488 HA SER 59 HA SER 59 1.126 -6.826 7.366 489 HB2 SER 59 HB2 SER 59 2.001 -9.088 9.055 490 HB3 SER 59 HB1 SER 59 0.365 -8.504 9.365 491 HG SER 59 HG SER 59 1.451 -9.485 6.944 492 H ALA 60 HN ALA 60 2.743 -6.731 10.514 493 HA ALA 60 HA ALA 60 0.667 -5.469 11.933 494 HB1 ALA 60 HB1 ALA 60 2.670 -4.718 13.417 495 HB2 ALA 60 HB2 ALA 60 3.603 -5.788 12.372 496 HB3 ALA 60 HB3 ALA 60 2.251 -6.428 13.307 497 H PHE 61 HN PHE 61 3.634 -4.089 10.514 498 HA PHE 61 HA PHE 61 3.298 -1.450 11.125 499 HB2 PHE 61 HB2 PHE 61 5.266 -2.366 9.966 500 HB3 PHE 61 HB1 PHE 61 4.314 -2.545 8.498 501 HD1 PHE 61 HD1 PHE 61 5.674 -0.068 10.877 502 HD2 PHE 61 HD2 PHE 61 3.993 -0.749 7.032 503 HE1 PHE 61 HE1 PHE 61 6.243 2.238 10.223 504 HE2 PHE 61 HE2 PHE 61 4.550 1.549 6.368 505 HZ PHE 61 HZ PHE 61 5.682 3.049 7.965 506 H THR 62 HN THR 62 2.025 -3.083 8.233 507 HA THR 62 HA THR 62 0.816 -0.940 6.993 508 HB THR 62 HB THR 62 -0.308 -3.746 7.147 509 HG1 THR 62 HG1 THR 62 1.606 -4.134 6.317 510 HG21 THR 62 HG21 THR 62 -0.672 -1.541 5.147 511 HG22 THR 62 HG22 THR 62 -1.908 -2.410 6.057 512 HG23 THR 62 HG23 THR 62 -1.005 -3.234 4.786 513 H LYS 63 HN LYS 63 -0.596 -3.083 9.458 514 HA LYS 63 HA LYS 63 -3.045 -1.594 9.596 515 HB2 LYS 63 HB2 LYS 63 -3.040 -3.971 10.106 516 HB3 LYS 63 HB1 LYS 63 -1.884 -3.720 11.405 517 HG2 LYS 63 HG2 LYS 63 -4.359 -2.158 11.628 518 HG3 LYS 63 HG1 LYS 63 -4.556 -3.907 11.747 519 HD2 LYS 63 HD2 LYS 63 -2.597 -2.289 13.373 520 HD3 LYS 63 HD1 LYS 63 -4.191 -2.797 13.939 521 HE2 LYS 63 HE2 LYS 63 -3.451 -5.170 13.402 522 HE3 LYS 63 HE1 LYS 63 -1.822 -4.514 13.240 523 HZ1 LYS 63 HZ1 LYS 63 -1.910 -3.758 15.510 524 HZ2 LYS 63 HZ2 LYS 63 -2.265 -5.411 15.462 525 HZ3 LYS 63 HZ3 LYS 63 -3.509 -4.286 15.674 526 H LYS 64 HN LYS 64 0.022 -1.565 11.234 527 HA LYS 64 HA LYS 64 -0.673 -0.168 13.558 528 HB2 LYS 64 HB2 LYS 64 1.513 -1.357 12.979 529 HB3 LYS 64 HB1 LYS 64 1.953 0.105 12.107 530 HG2 LYS 64 HG2 LYS 64 1.212 0.065 15.021 531 HG3 LYS 64 HG1 LYS 64 2.866 -0.073 14.418 532 HD2 LYS 64 HD2 LYS 64 2.070 2.118 13.079 533 HD3 LYS 64 HD1 LYS 64 1.070 2.271 14.524 534 HE2 LYS 64 HE2 LYS 64 3.877 1.578 15.035 535 HE3 LYS 64 HE1 LYS 64 3.629 3.164 14.306 536 HZ1 LYS 64 HZ1 LYS 64 1.778 2.711 16.413 537 HZ2 LYS 64 HZ2 LYS 64 2.902 3.960 16.228 538 HZ3 LYS 64 HZ3 LYS 64 3.365 2.510 16.963 539 H MET 65 HN MET 65 0.626 1.057 10.476 540 HA MET 65 HA MET 65 0.574 3.771 11.187 541 HB2 MET 65 HB2 MET 65 0.889 2.218 8.694 542 HB3 MET 65 HB1 MET 65 0.359 3.884 8.496 543 HG2 MET 65 HG2 MET 65 2.456 3.992 10.332 544 HG3 MET 65 HG1 MET 65 2.972 2.845 9.098 545 HE1 MET 65 HE1 MET 65 2.314 6.169 10.269 546 HE2 MET 65 HE2 MET 65 2.586 7.303 8.944 547 HE3 MET 65 HE3 MET 65 3.950 6.457 9.677 548 H VAL 66 HN VAL 66 -1.744 1.909 9.205 549 HA VAL 66 HA VAL 66 -3.521 4.004 8.726 550 HB VAL 66 HB VAL 66 -5.244 2.222 8.359 551 HG11 VAL 66 HG11 VAL 66 -2.547 1.980 7.043 552 HG12 VAL 66 HG12 VAL 66 -3.938 2.918 6.498 553 HG13 VAL 66 HG13 VAL 66 -3.991 1.155 6.458 554 HG21 VAL 66 HG21 VAL 66 -4.883 0.410 9.670 555 HG22 VAL 66 HG22 VAL 66 -3.131 0.604 9.647 556 HG23 VAL 66 HG23 VAL 66 -3.954 -0.124 8.268 557 H GLU 67 HN GLU 67 -3.589 1.565 11.320 558 HA GLU 67 HA GLU 67 -5.955 2.519 12.519 559 HB2 GLU 67 HB2 GLU 67 -3.687 0.944 13.744 560 HB3 GLU 67 HB1 GLU 67 -5.279 1.159 14.460 561 HG2 GLU 67 HG2 GLU 67 -4.932 -0.056 11.744 562 HG3 GLU 67 HG1 GLU 67 -4.800 -1.018 13.217 563 H ASN 68 HN ASN 68 -2.531 3.129 13.250 564 HA ASN 68 HA ASN 68 -3.016 4.802 15.478 565 HB2 ASN 68 HB2 ASN 68 -0.657 4.355 13.677 566 HB3 ASN 68 HB1 ASN 68 -0.628 5.649 14.871 567 HD21 ASN 68 HD21 ASN 68 -1.570 2.231 14.695 568 HD22 ASN 68 HD22 ASN 68 -0.819 1.772 16.182 569 H ALA 69 HN ALA 69 -2.987 5.359 12.048 570 HA ALA 69 HA ALA 69 -2.746 8.200 12.179 571 HB1 ALA 69 HB1 ALA 69 -3.191 6.179 10.094 572 HB2 ALA 69 HB2 ALA 69 -2.174 7.620 10.086 573 HB3 ALA 69 HB3 ALA 69 -3.903 7.759 9.771 574 H LYS 70 HN LYS 70 -4.246 9.653 12.640 575 HA LYS 70 HA LYS 70 -6.840 8.947 13.475 576 HB2 LYS 70 HB2 LYS 70 -5.334 11.462 13.068 577 HB3 LYS 70 HB1 LYS 70 -7.086 11.602 13.040 578 HG2 LYS 70 HG2 LYS 70 -7.185 10.510 15.243 579 HG3 LYS 70 HG1 LYS 70 -5.421 10.459 15.272 580 HD2 LYS 70 HD2 LYS 70 -5.488 12.977 14.958 581 HD3 LYS 70 HD1 LYS 70 -7.215 12.875 15.305 582 HE2 LYS 70 HE2 LYS 70 -5.367 11.540 17.197 583 HE3 LYS 70 HE1 LYS 70 -5.386 13.303 17.199 584 HZ1 LYS 70 HZ1 LYS 70 -7.421 11.427 18.071 585 HZ2 LYS 70 HZ2 LYS 70 -7.994 12.774 17.224 586 HZ3 LYS 70 HZ3 LYS 70 -7.074 12.986 18.628 587 H LYS 71 HN LYS 71 -5.552 9.633 10.356 588 HA LYS 71 HA LYS 71 -8.216 9.314 9.207 589 HB2 LYS 71 HB2 LYS 71 -7.370 11.817 9.466 590 HB3 LYS 71 HB1 LYS 71 -6.494 11.420 7.995 591 HG2 LYS 71 HG2 LYS 71 -8.655 10.718 6.975 592 HG3 LYS 71 HG1 LYS 71 -9.471 11.331 8.415 593 HD2 LYS 71 HD2 LYS 71 -9.596 13.090 6.868 594 HD3 LYS 71 HD1 LYS 71 -8.268 13.537 7.941 595 HE2 LYS 71 HE2 LYS 71 -7.704 12.000 5.444 596 HE3 LYS 71 HE1 LYS 71 -7.992 13.736 5.351 597 HZ1 LYS 71 HZ1 LYS 71 -6.229 13.589 7.359 598 HZ2 LYS 71 HZ2 LYS 71 -5.804 13.853 5.744 599 HZ3 LYS 71 HZ3 LYS 71 -5.713 12.296 6.397 600 H ILE 72 HN ILE 72 -8.250 8.238 7.290 601 HA ILE 72 HA ILE 72 -5.643 7.454 6.167 602 HB ILE 72 HB ILE 72 -8.125 5.808 5.834 603 HG12 ILE 72 HG12 ILE 72 -7.790 6.142 8.267 604 HG13 ILE 72 HG11 ILE 72 -7.518 4.472 7.780 605 HG21 ILE 72 HG21 ILE 72 -5.335 4.769 6.028 606 HG22 ILE 72 HG22 ILE 72 -5.875 5.558 4.546 607 HG23 ILE 72 HG23 ILE 72 -6.715 4.126 5.139 608 HD11 ILE 72 HD11 ILE 72 -5.843 6.025 9.311 609 HD12 ILE 72 HD12 ILE 72 -5.086 6.047 7.719 610 HD13 ILE 72 HD13 ILE 72 -5.425 4.510 8.514 611 H GLU 73 HN GLU 73 -5.403 7.451 3.941 612 HA GLU 73 HA GLU 73 -7.672 8.516 2.391 613 HB2 GLU 73 HB2 GLU 73 -4.829 9.305 1.816 614 HB3 GLU 73 HB1 GLU 73 -6.310 10.066 1.255 615 HG2 GLU 73 HG2 GLU 73 -6.729 10.585 3.739 616 HG3 GLU 73 HG1 GLU 73 -5.015 10.222 3.947 617 H VAL 74 HN VAL 74 -7.908 7.770 0.299 618 HA VAL 74 HA VAL 74 -6.039 5.651 -0.527 619 HB VAL 74 HB VAL 74 -8.072 4.617 -1.672 620 HG11 VAL 74 HG11 VAL 74 -7.565 3.162 -0.067 621 HG12 VAL 74 HG12 VAL 74 -8.820 3.935 0.903 622 HG13 VAL 74 HG13 VAL 74 -7.139 4.445 1.065 623 HG21 VAL 74 HG21 VAL 74 -10.145 5.375 -1.297 624 HG22 VAL 74 HG22 VAL 74 -9.351 6.862 -0.776 625 HG23 VAL 74 HG23 VAL 74 -9.832 5.654 0.417 626 H GLU 75 HN GLU 75 -5.402 5.613 -2.619 627 HA GLU 75 HA GLU 75 -6.652 7.537 -4.465 628 HB2 GLU 75 HB2 GLU 75 -4.561 8.503 -3.641 629 HB3 GLU 75 HB1 GLU 75 -3.687 7.053 -4.115 630 HG2 GLU 75 HG2 GLU 75 -4.957 7.838 -6.436 631 HG3 GLU 75 HG1 GLU 75 -4.464 9.357 -5.689 632 H PHE 76 HN PHE 76 -7.628 6.279 -5.932 633 HA PHE 76 HA PHE 76 -6.675 3.694 -6.656 634 HB2 PHE 76 HB2 PHE 76 -8.867 5.453 -7.750 635 HB3 PHE 76 HB1 PHE 76 -8.508 3.860 -8.404 636 HD1 PHE 76 HD2 PHE 76 -8.090 2.153 -6.181 637 HD2 PHE 76 HD1 PHE 76 -10.806 5.411 -6.542 638 HE1 PHE 76 HE2 PHE 76 -9.542 1.127 -4.482 639 HE2 PHE 76 HE1 PHE 76 -12.262 4.390 -4.840 640 HZ PHE 76 HZ PHE 76 -11.631 2.245 -3.810 641 H ASP 77 HN ASP 77 -6.003 3.016 -8.715 642 HA ASP 77 HA ASP 77 -4.040 4.673 -9.896 643 HB2 ASP 77 HB2 ASP 77 -3.717 2.852 -11.492 644 HB3 ASP 77 HB1 ASP 77 -3.857 2.219 -9.854 645 H LYS 78 HN LYS 78 -4.091 4.554 -12.528 646 HA LYS 78 HA LYS 78 -6.523 6.032 -13.266 647 HB2 LYS 78 HB2 LYS 78 -3.845 6.212 -14.628 648 HB3 LYS 78 HB1 LYS 78 -5.202 7.321 -14.760 649 HG2 LYS 78 HG2 LYS 78 -3.391 6.913 -12.395 650 HG3 LYS 78 HG1 LYS 78 -3.552 8.357 -13.395 651 HD2 LYS 78 HD2 LYS 78 -5.774 8.746 -12.579 652 HD3 LYS 78 HD1 LYS 78 -5.787 7.193 -11.741 653 HE2 LYS 78 HE2 LYS 78 -5.415 9.038 -10.185 654 HE3 LYS 78 HE1 LYS 78 -4.015 7.970 -10.257 655 HZ1 LYS 78 HZ1 LYS 78 -4.208 10.748 -10.881 656 HZ2 LYS 78 HZ2 LYS 78 -3.532 9.876 -12.163 657 HZ3 LYS 78 HZ3 LYS 78 -2.831 9.799 -10.625 658 H GLY 79 HN GLY 79 -5.465 3.037 -13.561 659 HA2 GLY 79 HA2 GLY 79 -6.143 2.793 -16.423 660 HA3 GLY 79 HA1 GLY 79 -5.191 1.627 -15.521 661 H GLN 80 HN GLN 80 -6.331 0.434 -13.787 662 HA GLN 80 HA GLN 80 -9.056 -0.204 -14.661 663 HB2 GLN 80 HB2 GLN 80 -8.747 -2.324 -13.436 664 HB3 GLN 80 HB1 GLN 80 -7.541 -2.081 -14.686 665 HG2 GLN 80 HG2 GLN 80 -6.139 -1.099 -12.697 666 HG3 GLN 80 HG1 GLN 80 -7.231 -2.095 -11.737 667 HE21 GLN 80 HE21 GLN 80 -6.815 -4.197 -11.556 668 HE22 GLN 80 HE22 GLN 80 -5.617 -5.058 -12.456 669 H ARG 81 HN ARG 81 -7.215 0.113 -11.646 670 HA ARG 81 HA ARG 81 -7.774 1.030 -9.638 671 HB2 ARG 81 HB2 ARG 81 -10.442 1.778 -10.828 672 HB3 ARG 81 HB1 ARG 81 -9.668 2.476 -9.413 673 HG2 ARG 81 HG2 ARG 81 -7.815 3.216 -10.981 674 HG3 ARG 81 HG1 ARG 81 -8.913 2.798 -12.297 675 HD2 ARG 81 HD2 ARG 81 -10.504 4.306 -10.652 676 HD3 ARG 81 HD1 ARG 81 -8.933 5.089 -10.484 677 HE ARG 81 HE ARG 81 -9.753 4.548 -13.203 678 HH11 ARG 81 HH11 ARG 81 -9.738 6.855 -10.580 679 HH12 ARG 81 HH12 ARG 81 -9.961 8.223 -11.618 680 HH21 ARG 81 HH21 ARG 81 -10.042 6.348 -14.567 681 HH22 ARG 81 HH22 ARG 81 -10.133 7.935 -13.880 682 H THR 82 HN THR 82 -9.344 -1.504 -11.132 683 HA THR 82 HA THR 82 -10.027 -2.697 -8.627 684 HB THR 82 HB THR 82 -12.460 -3.132 -9.499 685 HG1 THR 82 HG1 THR 82 -11.911 -0.603 -10.655 686 HG21 THR 82 HG21 THR 82 -11.657 -1.739 -7.467 687 HG22 THR 82 HG22 THR 82 -13.305 -1.552 -8.067 688 HG23 THR 82 HG23 THR 82 -12.074 -0.359 -8.483 689 H ASP 83 HN ASP 83 -9.514 -4.762 -8.820 690 HA ASP 83 HA ASP 83 -9.126 -5.930 -11.431 691 HB2 ASP 83 HB2 ASP 83 -8.811 -7.254 -8.732 692 HB3 ASP 83 HB1 ASP 83 -8.133 -7.792 -10.265 693 H LYS 84 HN LYS 84 -9.733 -8.533 -11.170 694 HA LYS 84 HA LYS 84 -12.327 -8.806 -11.957 695 HB2 LYS 84 HB2 LYS 84 -11.972 -11.192 -10.664 696 HB3 LYS 84 HB1 LYS 84 -11.438 -10.838 -12.301 697 HG2 LYS 84 HG2 LYS 84 -9.596 -10.134 -10.090 698 HG3 LYS 84 HG1 LYS 84 -9.832 -11.846 -10.443 699 HD2 LYS 84 HD2 LYS 84 -9.090 -11.581 -12.680 700 HD3 LYS 84 HD1 LYS 84 -9.147 -9.821 -12.562 701 HE2 LYS 84 HE2 LYS 84 -7.433 -11.097 -10.563 702 HE3 LYS 84 HE1 LYS 84 -6.912 -11.362 -12.225 703 HZ1 LYS 84 HZ1 LYS 84 -7.600 -8.672 -11.983 704 HZ2 LYS 84 HZ2 LYS 84 -6.060 -9.333 -12.216 705 HZ3 LYS 84 HZ3 LYS 84 -6.630 -9.052 -10.649 706 H TYR 85 HN TYR 85 -11.203 -9.589 -8.666 707 HA TYR 85 HA TYR 85 -13.814 -9.926 -7.645 708 HB2 TYR 85 HB2 TYR 85 -11.082 -9.999 -6.612 709 HB3 TYR 85 HB1 TYR 85 -12.237 -9.370 -5.443 710 HD1 TYR 85 HD1 TYR 85 -11.657 -12.243 -7.731 711 HD2 TYR 85 HD2 TYR 85 -13.550 -10.836 -4.192 712 HE1 TYR 85 HE1 TYR 85 -12.352 -14.542 -7.196 713 HE2 TYR 85 HE2 TYR 85 -14.250 -13.129 -3.646 714 HH TYR 85 HH TYR 85 -13.097 -15.655 -4.487 715 H GLY 86 HN GLY 86 -12.268 -7.147 -8.592 716 HA2 GLY 86 HA2 GLY 86 -13.016 -4.958 -8.434 717 HA3 GLY 86 HA1 GLY 86 -14.228 -5.490 -7.276 718 H ARG 87 HN ARG 87 -10.930 -6.376 -6.756 719 HA ARG 87 HA ARG 87 -10.769 -5.378 -4.182 720 HB2 ARG 87 HB2 ARG 87 -9.159 -6.917 -5.682 721 HB3 ARG 87 HB1 ARG 87 -8.254 -5.412 -5.760 722 HG2 ARG 87 HG2 ARG 87 -7.301 -6.168 -3.882 723 HG3 ARG 87 HG1 ARG 87 -8.760 -5.548 -3.109 724 HD2 ARG 87 HD2 ARG 87 -8.215 -8.382 -3.980 725 HD3 ARG 87 HD1 ARG 87 -8.367 -7.784 -2.329 726 HE ARG 87 HE ARG 87 -10.700 -7.358 -3.966 727 HH11 ARG 87 HH11 ARG 87 -9.060 -9.554 -1.804 728 HH12 ARG 87 HH12 ARG 87 -10.509 -10.388 -1.353 729 HH21 ARG 87 HH21 ARG 87 -12.605 -8.453 -3.372 730 HH22 ARG 87 HH22 ARG 87 -12.523 -9.762 -2.242 731 H GLY 88 HN GLY 88 -9.308 -3.654 -3.350 732 HA2 GLY 88 HA2 GLY 88 -9.864 -1.193 -4.796 733 HA3 GLY 88 HA1 GLY 88 -9.298 -1.315 -3.142 734 H LEU 89 HN LEU 89 -8.432 -0.935 -6.433 735 HA LEU 89 HA LEU 89 -5.607 -1.364 -6.025 736 HB2 LEU 89 HB2 LEU 89 -7.236 -0.369 -8.350 737 HB3 LEU 89 HB1 LEU 89 -5.484 -0.447 -8.386 738 HG LEU 89 HG LEU 89 -6.757 -2.370 -9.449 739 HD11 LEU 89 HD11 LEU 89 -4.691 -2.898 -7.327 740 HD12 LEU 89 HD12 LEU 89 -4.401 -2.527 -9.028 741 HD13 LEU 89 HD13 LEU 89 -5.163 -4.053 -8.574 742 HD21 LEU 89 HD21 LEU 89 -7.074 -3.302 -6.612 743 HD22 LEU 89 HD22 LEU 89 -7.672 -4.068 -8.084 744 HD23 LEU 89 HD23 LEU 89 -8.380 -2.551 -7.530 745 H ALA 90 HN ALA 90 -5.543 0.237 -4.225 746 HA ALA 90 HA ALA 90 -4.726 2.825 -5.275 747 HB1 ALA 90 HB1 ALA 90 -6.071 3.849 -3.260 748 HB2 ALA 90 HB2 ALA 90 -7.074 2.417 -3.490 749 HB3 ALA 90 HB3 ALA 90 -6.851 3.557 -4.813 750 H TYR 91 HN TYR 91 -3.957 4.235 -3.317 751 HA TYR 91 HA TYR 91 -2.245 2.510 -1.668 752 HB2 TYR 91 HB2 TYR 91 -1.856 5.473 -1.962 753 HB3 TYR 91 HB1 TYR 91 -0.672 4.246 -1.549 754 HD1 TYR 91 HD2 TYR 91 -2.872 5.267 -4.396 755 HD2 TYR 91 HD1 TYR 91 0.836 3.591 -3.159 756 HE1 TYR 91 HE2 TYR 91 -2.118 5.226 -6.734 757 HE2 TYR 91 HE1 TYR 91 1.605 3.557 -5.493 758 HH TYR 91 HH TYR 91 -0.123 5.140 -8.020 759 H ILE 92 HN ILE 92 -2.341 2.580 0.528 760 HA ILE 92 HA ILE 92 -4.531 4.132 1.702 761 HB ILE 92 HB ILE 92 -2.820 1.993 2.980 762 HG12 ILE 92 HG12 ILE 92 -5.260 0.866 2.722 763 HG13 ILE 92 HG11 ILE 92 -5.253 1.888 1.288 764 HG21 ILE 92 HG21 ILE 92 -3.830 3.522 4.590 765 HG22 ILE 92 HG22 ILE 92 -4.575 1.926 4.682 766 HG23 ILE 92 HG23 ILE 92 -5.417 3.245 3.868 767 HD11 ILE 92 HD11 ILE 92 -3.110 -0.108 1.964 768 HD12 ILE 92 HD12 ILE 92 -3.271 0.817 0.471 769 HD13 ILE 92 HD13 ILE 92 -4.465 -0.415 0.879 770 H TYR 93 HN TYR 93 -4.170 5.959 2.777 771 HA TYR 93 HA TYR 93 -1.412 6.628 3.516 772 HB2 TYR 93 HB2 TYR 93 -3.832 8.431 3.304 773 HB3 TYR 93 HB1 TYR 93 -2.197 8.952 3.664 774 HD1 TYR 93 HD2 TYR 93 -3.172 6.478 1.066 775 HD2 TYR 93 HD1 TYR 93 -1.815 10.422 1.880 776 HE1 TYR 93 HE2 TYR 93 -2.794 6.829 -1.328 777 HE2 TYR 93 HE1 TYR 93 -1.417 10.784 -0.519 778 HH TYR 93 HH TYR 93 -1.434 8.249 -2.785 779 H ALA 94 HN ALA 94 -0.966 7.621 5.547 780 HA ALA 94 HA ALA 94 -2.988 7.272 7.634 781 HB1 ALA 94 HB1 ALA 94 -1.140 6.281 9.094 782 HB2 ALA 94 HB2 ALA 94 -0.276 5.983 7.587 783 HB3 ALA 94 HB3 ALA 94 -1.847 5.234 7.865 784 H ASP 95 HN ASP 95 -3.178 9.201 8.564 785 HA ASP 95 HA ASP 95 -2.654 11.134 9.645 786 HB2 ASP 95 HB2 ASP 95 -0.719 9.509 10.499 787 HB3 ASP 95 HB1 ASP 95 0.280 10.629 9.577 788 H GLY 96 HN GLY 96 -2.068 10.522 6.572 789 HA2 GLY 96 HA2 GLY 96 -2.133 12.408 5.040 790 HA3 GLY 96 HA1 GLY 96 -0.980 13.219 6.084 791 H LYS 97 HN LYS 97 -0.294 9.923 5.667 792 HA LYS 97 HA LYS 97 1.498 10.487 3.419 793 HB2 LYS 97 HB2 LYS 97 2.228 9.565 6.154 794 HB3 LYS 97 HB1 LYS 97 3.108 8.877 4.797 795 HG2 LYS 97 HG2 LYS 97 3.587 11.230 4.054 796 HG3 LYS 97 HG1 LYS 97 2.925 11.765 5.601 797 HD2 LYS 97 HD2 LYS 97 5.120 9.721 5.449 798 HD3 LYS 97 HD1 LYS 97 5.467 11.451 5.425 799 HE2 LYS 97 HE2 LYS 97 4.857 11.742 7.600 800 HE3 LYS 97 HE1 LYS 97 3.651 10.457 7.547 801 HZ1 LYS 97 HZ1 LYS 97 6.578 10.209 7.888 802 HZ2 LYS 97 HZ2 LYS 97 5.625 8.892 7.420 803 HZ3 LYS 97 HZ3 LYS 97 5.348 9.649 8.908 804 H MET 98 HN MET 98 1.675 8.852 1.954 805 HA MET 98 HA MET 98 -0.205 6.736 2.073 806 HB2 MET 98 HB2 MET 98 2.092 6.533 0.193 807 HB3 MET 98 HB1 MET 98 0.383 6.222 -0.075 808 HG2 MET 98 HG2 MET 98 0.357 8.145 -1.177 809 HG3 MET 98 HG1 MET 98 0.431 8.919 0.404 810 HE1 MET 98 HE1 MET 98 1.273 9.776 -2.578 811 HE2 MET 98 HE2 MET 98 2.870 10.521 -2.510 812 HE3 MET 98 HE3 MET 98 1.595 11.068 -1.422 813 H VAL 99 HN VAL 99 -0.035 5.150 3.464 814 HA VAL 99 HA VAL 99 2.239 4.254 4.769 815 HB VAL 99 HB VAL 99 -0.121 2.490 4.126 816 HG11 VAL 99 HG11 VAL 99 0.558 1.151 5.819 817 HG12 VAL 99 HG12 VAL 99 1.191 2.493 6.771 818 HG13 VAL 99 HG13 VAL 99 2.133 1.844 5.429 819 HG21 VAL 99 HG21 VAL 99 -1.184 4.411 4.916 820 HG22 VAL 99 HG22 VAL 99 0.114 4.776 6.052 821 HG23 VAL 99 HG23 VAL 99 -0.980 3.429 6.367 822 H ASN 100 HN ASN 100 0.983 3.387 1.634 823 HA ASN 100 HA ASN 100 2.259 0.967 1.178 824 HB2 ASN 100 HB2 ASN 100 1.918 3.121 -0.911 825 HB3 ASN 100 HB1 ASN 100 1.947 1.376 -1.156 826 HD21 ASN 100 HD21 ASN 100 0.061 0.384 -1.284 827 HD22 ASN 100 HD22 ASN 100 -1.454 1.012 -0.744 828 H GLU 101 HN GLU 101 3.479 4.215 0.278 829 HA GLU 101 HA GLU 101 5.980 3.377 -0.620 830 HB2 GLU 101 HB2 GLU 101 6.735 5.699 -0.138 831 HB3 GLU 101 HB1 GLU 101 5.245 5.622 -1.067 832 HG2 GLU 101 HG2 GLU 101 3.978 6.453 0.642 833 HG3 GLU 101 HG1 GLU 101 5.072 5.862 1.890 834 H ALA 102 HN ALA 102 4.817 4.056 2.617 835 HA ALA 102 HA ALA 102 7.235 4.141 3.997 836 HB1 ALA 102 HB1 ALA 102 4.652 2.960 5.007 837 HB2 ALA 102 HB2 ALA 102 5.020 4.684 4.965 838 HB3 ALA 102 HB3 ALA 102 5.975 3.602 5.978 839 H LEU 103 HN LEU 103 5.103 1.304 3.557 840 HA LEU 103 HA LEU 103 6.843 -0.581 4.671 841 HB2 LEU 103 HB2 LEU 103 4.880 -1.093 2.438 842 HB3 LEU 103 HB1 LEU 103 5.501 -2.263 3.585 843 HG LEU 103 HG LEU 103 4.285 -0.248 5.131 844 HD11 LEU 103 HD11 LEU 103 2.263 0.263 4.221 845 HD12 LEU 103 HD12 LEU 103 2.205 -1.203 3.243 846 HD13 LEU 103 HD13 LEU 103 3.214 0.154 2.740 847 HD21 LEU 103 HD21 LEU 103 4.466 -2.798 5.392 848 HD22 LEU 103 HD22 LEU 103 3.000 -2.861 4.414 849 HD23 LEU 103 HD23 LEU 103 2.993 -2.007 5.957 850 H VAL 104 HN VAL 104 6.469 0.567 1.362 851 HA VAL 104 HA VAL 104 8.247 -1.219 0.119 852 HB VAL 104 HB VAL 104 7.694 1.623 -0.738 853 HG11 VAL 104 HG11 VAL 104 9.382 0.811 -2.112 854 HG12 VAL 104 HG12 VAL 104 7.915 0.450 -3.024 855 HG13 VAL 104 HG13 VAL 104 8.726 -0.827 -2.116 856 HG21 VAL 104 HG21 VAL 104 5.589 1.105 -1.238 857 HG22 VAL 104 HG22 VAL 104 5.802 -0.386 -0.319 858 HG23 VAL 104 HG23 VAL 104 6.084 -0.374 -2.060 859 H ARG 105 HN ARG 105 8.745 1.983 1.545 860 HA ARG 105 HA ARG 105 11.533 2.052 0.868 861 HB2 ARG 105 HB2 ARG 105 10.388 4.141 0.988 862 HB3 ARG 105 HB1 ARG 105 9.792 3.796 2.606 863 HG2 ARG 105 HG2 ARG 105 12.676 3.714 2.519 864 HG3 ARG 105 HG1 ARG 105 12.056 5.254 1.921 865 HD2 ARG 105 HD2 ARG 105 12.047 5.789 4.112 866 HD3 ARG 105 HD1 ARG 105 10.503 4.939 4.094 867 HE ARG 105 HE ARG 105 11.448 3.235 5.313 868 HH11 ARG 105 HH11 ARG 105 13.964 5.360 4.149 869 HH12 ARG 105 HH12 ARG 105 15.195 4.643 5.132 870 HH21 ARG 105 HH21 ARG 105 13.070 2.290 6.603 871 HH22 ARG 105 HH22 ARG 105 14.690 2.900 6.524 872 H GLN 106 HN GLN 106 9.640 1.212 3.727 873 HA GLN 106 HA GLN 106 11.802 1.139 5.547 874 HB2 GLN 106 HB2 GLN 106 8.996 0.468 5.570 875 HB3 GLN 106 HB1 GLN 106 9.925 -0.764 6.409 876 HG2 GLN 106 HG2 GLN 106 9.886 0.544 8.190 877 HG3 GLN 106 HG1 GLN 106 10.968 1.637 7.328 878 HE21 GLN 106 HE21 GLN 106 9.509 2.875 5.537 879 HE22 GLN 106 HE22 GLN 106 8.183 3.723 6.246 880 H GLY 107 HN GLY 107 10.211 -1.472 3.721 881 HA2 GLY 107 HA2 GLY 107 11.950 -3.023 2.708 882 HA3 GLY 107 HA1 GLY 107 12.519 -3.199 4.359 883 H LEU 108 HN LEU 108 9.321 -2.914 4.755 884 HA LEU 108 HA LEU 108 8.985 -5.789 4.945 885 HB2 LEU 108 HB2 LEU 108 6.565 -4.665 5.684 886 HB3 LEU 108 HB1 LEU 108 7.844 -5.188 6.757 887 HG LEU 108 HG LEU 108 7.774 -2.387 5.665 888 HD11 LEU 108 HD11 LEU 108 6.661 -3.089 8.347 889 HD12 LEU 108 HD12 LEU 108 5.635 -3.145 6.914 890 HD13 LEU 108 HD13 LEU 108 6.420 -1.636 7.377 891 HD21 LEU 108 HD21 LEU 108 9.865 -3.045 6.652 892 HD22 LEU 108 HD22 LEU 108 9.042 -3.685 8.072 893 HD23 LEU 108 HD23 LEU 108 9.039 -1.949 7.758 894 H ALA 109 HN ALA 109 8.892 -4.011 2.377 895 HA ALA 109 HA ALA 109 7.030 -5.652 0.998 896 HB1 ALA 109 HB1 ALA 109 5.216 -4.403 1.511 897 HB2 ALA 109 HB2 ALA 109 5.819 -3.397 0.194 898 HB3 ALA 109 HB3 ALA 109 6.173 -2.965 1.865 899 H LYS 110 HN LYS 110 7.260 -5.511 -1.255 900 HA LYS 110 HA LYS 110 9.283 -3.602 -2.209 901 HB2 LYS 110 HB2 LYS 110 10.279 -5.333 -3.603 902 HB3 LYS 110 HB1 LYS 110 10.335 -5.799 -1.909 903 HG2 LYS 110 HG2 LYS 110 8.610 -7.382 -2.186 904 HG3 LYS 110 HG1 LYS 110 8.175 -6.738 -3.771 905 HD2 LYS 110 HD2 LYS 110 10.932 -7.789 -3.325 906 HD3 LYS 110 HD1 LYS 110 9.604 -8.923 -3.574 907 HE2 LYS 110 HE2 LYS 110 9.079 -7.922 -5.697 908 HE3 LYS 110 HE1 LYS 110 10.262 -6.642 -5.432 909 HZ1 LYS 110 HZ1 LYS 110 10.932 -9.527 -5.658 910 HZ2 LYS 110 HZ2 LYS 110 12.026 -8.243 -5.547 911 HZ3 LYS 110 HZ3 LYS 110 11.057 -8.411 -6.924 912 H VAL 111 HN VAL 111 9.179 -3.070 -4.452 913 HA VAL 111 HA VAL 111 6.479 -2.928 -5.416 914 HB VAL 111 HB VAL 111 9.084 -1.910 -6.548 915 HG11 VAL 111 HG11 VAL 111 6.328 -1.886 -7.685 916 HG12 VAL 111 HG12 VAL 111 7.879 -2.122 -8.492 917 HG13 VAL 111 HG13 VAL 111 7.394 -0.509 -7.966 918 HG21 VAL 111 HG21 VAL 111 6.744 -0.462 -5.314 919 HG22 VAL 111 HG22 VAL 111 8.235 0.272 -5.904 920 HG23 VAL 111 HG23 VAL 111 8.275 -0.806 -4.509 921 H ALA 112 HN ALA 112 5.631 -4.700 -6.306 922 HA ALA 112 HA ALA 112 7.010 -5.896 -8.585 923 HB1 ALA 112 HB1 ALA 112 7.215 -7.980 -7.758 924 HB2 ALA 112 HB2 ALA 112 5.718 -7.873 -6.831 925 HB3 ALA 112 HB3 ALA 112 7.199 -7.153 -6.201 926 H TYR 113 HN TYR 113 5.601 -7.077 -10.005 927 HA TYR 113 HA TYR 113 3.690 -7.341 -11.210 928 HB2 TYR 113 HB2 TYR 113 2.558 -7.337 -8.415 929 HB3 TYR 113 HB1 TYR 113 1.555 -7.593 -9.836 930 HD1 TYR 113 HD2 TYR 113 4.787 -8.871 -8.475 931 HD2 TYR 113 HD1 TYR 113 1.083 -9.788 -10.348 932 HE1 TYR 113 HE2 TYR 113 5.367 -11.262 -8.433 933 HE2 TYR 113 HE1 TYR 113 1.648 -12.181 -10.313 934 HH TYR 113 HH TYR 113 4.782 -13.319 -9.596 935 H VAL 114 HN VAL 114 4.263 -5.111 -11.954 936 HA VAL 114 HA VAL 114 2.114 -3.221 -11.246 937 HB VAL 114 HB VAL 114 4.246 -2.350 -10.476 938 HG11 VAL 114 HG11 VAL 114 6.161 -2.629 -11.561 939 HG12 VAL 114 HG12 VAL 114 5.519 -1.859 -13.013 940 HG13 VAL 114 HG13 VAL 114 5.281 -3.588 -12.752 941 HG21 VAL 114 HG21 VAL 114 3.958 -0.626 -12.824 942 HG22 VAL 114 HG22 VAL 114 3.761 -0.255 -11.112 943 HG23 VAL 114 HG23 VAL 114 2.439 -0.999 -12.012 944 H TYR 115 HN TYR 115 0.687 -3.114 -12.839 945 HA TYR 115 HA TYR 115 1.622 -3.418 -15.613 946 HB2 TYR 115 HB2 TYR 115 -0.954 -3.740 -15.981 947 HB3 TYR 115 HB1 TYR 115 0.016 -5.063 -15.350 948 HD1 TYR 115 HD2 TYR 115 -1.949 -2.152 -14.090 949 HD2 TYR 115 HD1 TYR 115 -0.799 -6.205 -13.517 950 HE1 TYR 115 HE2 TYR 115 -3.431 -2.287 -12.130 951 HE2 TYR 115 HE1 TYR 115 -2.276 -6.354 -11.556 952 HH TYR 115 HH TYR 115 -3.319 -4.875 -9.919 953 H LYS 116 HN LYS 116 1.228 -1.873 -17.117 954 HA LYS 116 HA LYS 116 0.129 0.657 -16.121 955 HB2 LYS 116 HB2 LYS 116 1.867 0.118 -18.532 956 HB3 LYS 116 HB1 LYS 116 1.351 1.704 -17.977 957 HG2 LYS 116 HG2 LYS 116 3.099 -0.216 -16.457 958 HG3 LYS 116 HG1 LYS 116 3.638 1.235 -17.302 959 HD2 LYS 116 HD2 LYS 116 1.632 1.246 -15.051 960 HD3 LYS 116 HD1 LYS 116 3.365 1.501 -14.825 961 HE2 LYS 116 HE2 LYS 116 3.045 3.335 -16.652 962 HE3 LYS 116 HE1 LYS 116 1.350 3.246 -16.178 963 HZ1 LYS 116 HZ1 LYS 116 3.631 3.827 -14.367 964 HZ2 LYS 116 HZ2 LYS 116 2.011 3.721 -13.896 965 HZ3 LYS 116 HZ3 LYS 116 2.506 4.955 -14.940 966 HA PRO 117 HA PRO 117 -0.148 2.584 -17.322 967 HB2 PRO 117 HB2 PRO 117 -2.487 4.121 -17.768 968 HB3 PRO 117 HB1 PRO 117 -1.028 4.092 -18.757 969 HG2 PRO 117 HG2 PRO 117 -3.547 3.175 -19.534 970 HG3 PRO 117 HG1 PRO 117 -2.014 2.805 -20.340 971 HD2 PRO 117 HD2 PRO 117 -3.592 1.160 -18.413 972 HD3 PRO 117 HD1 PRO 117 -2.617 0.646 -19.808 973 H ASN 118 HN ASN 118 -0.060 2.328 -15.153 974 HA ASN 118 HA ASN 118 -2.315 3.201 -13.582 975 HB2 ASN 118 HB2 ASN 118 -1.219 0.410 -13.178 976 HB3 ASN 118 HB1 ASN 118 -2.412 1.205 -12.159 977 HD21 ASN 118 HD21 ASN 118 -1.802 -0.072 -15.370 978 HD22 ASN 118 HD22 ASN 118 -3.460 -0.350 -15.773 979 H ASN 119 HN ASN 119 -1.736 3.181 -11.204 980 HA ASN 119 HA ASN 119 -0.379 3.816 -9.505 981 HB2 ASN 119 HB2 ASN 119 1.980 2.726 -11.022 982 HB3 ASN 119 HB1 ASN 119 1.746 2.817 -9.279 983 HD21 ASN 119 HD21 ASN 119 1.219 1.004 -12.137 984 HD22 ASN 119 HD22 ASN 119 0.460 -0.361 -11.399 985 H THR 120 HN THR 120 -0.961 5.968 -10.559 986 HA THR 120 HA THR 120 0.804 7.397 -12.161 987 HB THR 120 HB THR 120 -0.526 8.991 -10.077 988 HG1 THR 120 HG1 THR 120 -2.106 7.516 -10.077 989 HG21 THR 120 HG21 THR 120 -0.511 10.447 -11.733 990 HG22 THR 120 HG22 THR 120 -1.639 9.424 -12.623 991 HG23 THR 120 HG23 THR 120 0.098 9.219 -12.843 992 H HIS 121 HN HIS 121 1.022 6.561 -8.809 993 HA HIS 121 HA HIS 121 3.219 8.452 -8.387 994 HB2 HIS 121 HB2 HIS 121 1.767 6.661 -6.427 995 HB3 HIS 121 HB1 HIS 121 3.051 7.790 -6.008 996 HD1 HIS 121 HD1 HIS 121 1.148 9.486 -8.461 997 HD2 HIS 121 HD2 HIS 121 0.583 8.643 -4.431 998 HE1 HIS 121 HE1 HIS 121 -0.567 11.142 -7.662 999 HE2 HIS 121 HE2 HIS 121 -0.828 10.671 -5.200 1000 H GLU 122 HN GLU 122 3.396 6.016 -10.077 1001 HA GLU 122 HA GLU 122 4.804 3.968 -8.786 1002 HB2 GLU 122 HB2 GLU 122 3.835 3.854 -11.091 1003 HB3 GLU 122 HB1 GLU 122 5.157 4.872 -11.649 1004 HG2 GLU 122 HG2 GLU 122 5.655 2.270 -10.248 1005 HG3 GLU 122 HG1 GLU 122 5.362 2.355 -11.985 1006 H GLN 123 HN GLN 123 5.891 6.990 -10.237 1007 HA GLN 123 HA GLN 123 8.649 6.538 -10.148 1008 HB2 GLN 123 HB2 GLN 123 7.225 9.177 -9.766 1009 HB3 GLN 123 HB1 GLN 123 8.892 8.955 -10.278 1010 HG2 GLN 123 HG2 GLN 123 6.773 7.672 -11.903 1011 HG3 GLN 123 HG1 GLN 123 6.932 9.427 -11.991 1012 HE21 GLN 123 HE21 GLN 123 8.556 6.374 -12.516 1013 HE22 GLN 123 HE22 GLN 123 9.765 6.981 -13.591 1014 H LEU 124 HN LEU 124 6.384 7.330 -7.636 1015 HA LEU 124 HA LEU 124 8.289 8.273 -5.736 1016 HB2 LEU 124 HB2 LEU 124 5.957 8.873 -5.527 1017 HB3 LEU 124 HB1 LEU 124 5.494 7.187 -5.405 1018 HG LEU 124 HG LEU 124 6.969 7.162 -3.276 1019 HD11 LEU 124 HD11 LEU 124 6.622 9.619 -2.277 1020 HD12 LEU 124 HD12 LEU 124 6.888 10.031 -3.970 1021 HD13 LEU 124 HD13 LEU 124 8.103 9.107 -3.087 1022 HD21 LEU 124 HD21 LEU 124 4.268 8.403 -3.600 1023 HD22 LEU 124 HD22 LEU 124 5.011 8.298 -2.006 1024 HD23 LEU 124 HD23 LEU 124 4.705 6.830 -2.934 1025 H LEU 125 HN LEU 125 6.625 5.163 -6.186 1026 HA LEU 125 HA LEU 125 8.127 3.897 -4.084 1027 HB2 LEU 125 HB2 LEU 125 6.282 2.770 -6.188 1028 HB3 LEU 125 HB1 LEU 125 6.994 1.831 -4.890 1029 HG LEU 125 HG LEU 125 5.798 3.868 -3.504 1030 HD11 LEU 125 HD11 LEU 125 3.512 3.178 -5.146 1031 HD12 LEU 125 HD12 LEU 125 4.720 4.101 -6.039 1032 HD13 LEU 125 HD13 LEU 125 4.043 4.749 -4.546 1033 HD21 LEU 125 HD21 LEU 125 4.112 1.515 -4.121 1034 HD22 LEU 125 HD22 LEU 125 4.582 2.200 -2.565 1035 HD23 LEU 125 HD23 LEU 125 5.720 1.200 -3.468 1036 H ARG 126 HN ARG 126 8.446 4.291 -7.519 1037 HA ARG 126 HA ARG 126 10.032 2.135 -8.211 1038 HB2 ARG 126 HB2 ARG 126 9.118 3.945 -9.732 1039 HB3 ARG 126 HB1 ARG 126 10.476 4.940 -9.227 1040 HG2 ARG 126 HG2 ARG 126 11.971 3.056 -10.027 1041 HG3 ARG 126 HG1 ARG 126 10.530 2.377 -10.786 1042 HD2 ARG 126 HD2 ARG 126 10.236 4.376 -12.109 1043 HD3 ARG 126 HD1 ARG 126 11.582 5.159 -11.282 1044 HE ARG 126 HE ARG 126 12.304 2.699 -12.581 1045 HH11 ARG 126 HH11 ARG 126 11.877 6.137 -13.008 1046 HH12 ARG 126 HH12 ARG 126 12.955 6.228 -14.360 1047 HH21 ARG 126 HH21 ARG 126 13.722 2.818 -14.358 1048 HH22 ARG 126 HH22 ARG 126 14.002 4.344 -15.127 1049 H LYS 127 HN LYS 127 10.977 5.195 -6.713 1050 HA LYS 127 HA LYS 127 13.771 4.494 -6.659 1051 HB2 LYS 127 HB2 LYS 127 12.555 6.685 -5.008 1052 HB3 LYS 127 HB1 LYS 127 14.155 6.606 -5.729 1053 HG2 LYS 127 HG2 LYS 127 11.547 7.044 -7.160 1054 HG3 LYS 127 HG1 LYS 127 12.834 8.223 -6.905 1055 HD2 LYS 127 HD2 LYS 127 14.292 6.432 -8.149 1056 HD3 LYS 127 HD1 LYS 127 12.729 5.890 -8.764 1057 HE2 LYS 127 HE2 LYS 127 13.713 7.460 -10.313 1058 HE3 LYS 127 HE1 LYS 127 12.283 8.175 -9.570 1059 HZ1 LYS 127 HZ1 LYS 127 14.823 8.695 -8.250 1060 HZ2 LYS 127 HZ2 LYS 127 13.503 9.722 -8.501 1061 HZ3 LYS 127 HZ3 LYS 127 14.602 9.437 -9.754 1062 H SER 128 HN SER 128 11.174 4.816 -4.259 1063 HA SER 128 HA SER 128 12.613 4.180 -1.976 1064 HB2 SER 128 HB2 SER 128 10.462 4.950 -1.553 1065 HB3 SER 128 HB1 SER 128 9.734 3.886 -2.756 1066 HG SER 128 HG SER 128 9.248 2.835 -0.962 1067 H GLU 129 HN GLU 129 11.348 2.086 -4.476 1068 HA GLU 129 HA GLU 129 11.615 -0.358 -3.054 1069 HB2 GLU 129 HB2 GLU 129 10.169 -0.336 -4.945 1070 HB3 GLU 129 HB1 GLU 129 11.427 0.307 -5.991 1071 HG2 GLU 129 HG2 GLU 129 12.363 -2.148 -4.940 1072 HG3 GLU 129 HG1 GLU 129 10.712 -2.398 -5.499 1073 H ALA 130 HN ALA 130 13.602 0.949 -5.720 1074 HA ALA 130 HA ALA 130 15.701 -0.910 -5.309 1075 HB1 ALA 130 HB1 ALA 130 16.531 -0.111 -7.229 1076 HB2 ALA 130 HB2 ALA 130 16.411 1.567 -6.698 1077 HB3 ALA 130 HB3 ALA 130 14.991 0.743 -7.344 1078 H GLN 131 HN GLN 131 15.069 2.307 -4.097 1079 HA GLN 131 HA GLN 131 17.624 3.053 -3.294 1080 HB2 GLN 131 HB2 GLN 131 14.876 3.725 -2.320 1081 HB3 GLN 131 HB1 GLN 131 16.271 4.285 -1.414 1082 HG2 GLN 131 HG2 GLN 131 16.697 4.858 -4.155 1083 HG3 GLN 131 HG1 GLN 131 15.090 5.423 -3.709 1084 HE21 GLN 131 HE21 GLN 131 15.800 7.571 -3.988 1085 HE22 GLN 131 HE22 GLN 131 16.772 8.354 -2.793 1086 H ALA 132 HN ALA 132 15.150 1.259 -1.488 1087 HA ALA 132 HA ALA 132 16.959 0.816 0.727 1088 HB1 ALA 132 HB1 ALA 132 14.717 1.176 1.360 1089 HB2 ALA 132 HB2 ALA 132 15.012 -0.542 1.616 1090 HB3 ALA 132 HB3 ALA 132 14.115 -0.003 0.196 1091 H LYS 133 HN LYS 133 15.987 -0.845 -2.147 1092 HA LYS 133 HA LYS 133 16.485 -3.503 -1.408 1093 HB2 LYS 133 HB2 LYS 133 15.764 -2.130 -3.737 1094 HB3 LYS 133 HB1 LYS 133 17.261 -2.952 -4.145 1095 HG2 LYS 133 HG2 LYS 133 16.303 -4.977 -4.122 1096 HG3 LYS 133 HG1 LYS 133 15.296 -4.601 -2.722 1097 HD2 LYS 133 HD2 LYS 133 14.190 -2.985 -4.595 1098 HD3 LYS 133 HD1 LYS 133 14.723 -4.337 -5.597 1099 HE2 LYS 133 HE2 LYS 133 12.815 -5.324 -5.005 1100 HE3 LYS 133 HE1 LYS 133 13.574 -5.588 -3.436 1101 HZ1 LYS 133 HZ1 LYS 133 12.626 -3.068 -3.226 1102 HZ2 LYS 133 HZ2 LYS 133 11.838 -4.449 -2.651 1103 HZ3 LYS 133 HZ3 LYS 133 11.428 -3.810 -4.163 1104 H LYS 134 HN LYS 134 18.628 -1.185 -3.054 1105 HA LYS 134 HA LYS 134 20.873 -2.834 -3.206 1106 HB2 LYS 134 HB2 LYS 134 20.752 -0.852 -4.540 1107 HB3 LYS 134 HB1 LYS 134 20.616 0.170 -3.117 1108 HG2 LYS 134 HG2 LYS 134 22.901 -0.409 -2.480 1109 HG3 LYS 134 HG1 LYS 134 23.038 -1.436 -3.909 1110 HD2 LYS 134 HD2 LYS 134 22.431 1.516 -4.007 1111 HD3 LYS 134 HD1 LYS 134 24.054 0.840 -4.155 1112 HE2 LYS 134 HE2 LYS 134 23.721 0.220 -6.279 1113 HE3 LYS 134 HE1 LYS 134 22.115 -0.419 -5.932 1114 HZ1 LYS 134 HZ1 LYS 134 22.710 2.471 -6.243 1115 HZ2 LYS 134 HZ2 LYS 134 21.185 1.751 -6.124 1116 HZ3 LYS 134 HZ3 LYS 134 22.139 1.486 -7.495 1117 H GLU 135 HN GLU 135 19.734 -0.802 -0.578 1118 HA GLU 135 HA GLU 135 22.177 -1.361 0.936 1119 HB2 GLU 135 HB2 GLU 135 20.397 0.182 2.511 1120 HB3 GLU 135 HB1 GLU 135 21.902 0.690 1.755 1121 HG2 GLU 135 HG2 GLU 135 20.620 1.223 -0.305 1122 HG3 GLU 135 HG1 GLU 135 19.139 0.848 0.577 1123 H LYS 136 HN LYS 136 19.099 -2.678 0.573 1124 HA LYS 136 HA LYS 136 17.792 -4.058 1.852 1125 HB2 LYS 136 HB2 LYS 136 20.535 -4.857 2.849 1126 HB3 LYS 136 HB1 LYS 136 19.065 -5.789 3.104 1127 HG2 LYS 136 HG2 LYS 136 18.823 -5.965 0.636 1128 HG3 LYS 136 HG1 LYS 136 20.396 -5.181 0.475 1129 HD2 LYS 136 HD2 LYS 136 21.042 -7.375 0.402 1130 HD3 LYS 136 HD1 LYS 136 21.125 -7.096 2.143 1131 HE2 LYS 136 HE2 LYS 136 19.182 -8.280 2.557 1132 HE3 LYS 136 HE1 LYS 136 18.580 -8.063 0.914 1133 HZ1 LYS 136 HZ1 LYS 136 21.029 -9.626 1.319 1134 HZ2 LYS 136 HZ2 LYS 136 19.838 -9.782 0.129 1135 HZ3 LYS 136 HZ3 LYS 136 19.543 -10.344 1.697 1136 H LEU 137 HN LEU 137 17.203 -1.925 2.898 1137 HA LEU 137 HA LEU 137 18.157 -0.970 5.274 1138 HB2 LEU 137 HB2 LEU 137 15.517 -0.923 3.921 1139 HB3 LEU 137 HB1 LEU 137 15.532 -0.487 5.624 1140 HG LEU 137 HG LEU 137 17.101 0.846 3.419 1141 HD11 LEU 137 HD11 LEU 137 15.572 2.747 4.636 1142 HD12 LEU 137 HD12 LEU 137 14.508 1.342 4.682 1143 HD13 LEU 137 HD13 LEU 137 15.151 1.911 3.142 1144 HD21 LEU 137 HD21 LEU 137 17.367 2.496 5.511 1145 HD22 LEU 137 HD22 LEU 137 18.538 1.236 5.123 1146 HD23 LEU 137 HD23 LEU 137 17.318 0.954 6.364 1147 H ASN 138 HN ASN 138 14.971 -2.367 5.690 1148 HA ASN 138 HA ASN 138 16.083 -4.149 7.753 1149 HB2 ASN 138 HB2 ASN 138 13.756 -3.767 8.868 1150 HB3 ASN 138 HB1 ASN 138 15.015 -2.552 9.060 1151 HD21 ASN 138 HD21 ASN 138 11.933 -3.293 7.721 1152 HD22 ASN 138 HD22 ASN 138 11.559 -1.707 7.147 1153 H ILE 139 HN ILE 139 15.233 -6.170 7.936 1154 HA ILE 139 HA ILE 139 14.324 -8.121 7.257 1155 HB ILE 139 HB ILE 139 12.272 -6.830 8.006 1156 HG12 ILE 139 HG12 ILE 139 11.888 -9.028 5.965 1157 HG13 ILE 139 HG11 ILE 139 12.318 -9.268 7.656 1158 HG21 ILE 139 HG21 ILE 139 11.620 -5.307 6.469 1159 HG22 ILE 139 HG22 ILE 139 10.661 -6.667 5.887 1160 HG23 ILE 139 HG23 ILE 139 12.188 -6.267 5.104 1161 HD11 ILE 139 HD11 ILE 139 10.090 -9.604 7.810 1162 HD12 ILE 139 HD12 ILE 139 9.723 -8.561 6.436 1163 HD13 ILE 139 HD13 ILE 139 10.100 -7.851 8.006 1164 H TRP 140 HN TRP 140 15.726 -6.299 5.169 1165 HA TRP 140 HA TRP 140 14.538 -7.195 2.690 1166 HB2 TRP 140 HB2 TRP 140 17.094 -5.688 3.283 1167 HB3 TRP 140 HB1 TRP 140 16.595 -6.148 1.657 1168 HD1 TRP 140 HD1 TRP 140 15.583 -3.890 4.560 1169 HE1 TRP 140 HE1 TRP 140 14.093 -2.000 3.658 1170 HE3 TRP 140 HE3 TRP 140 15.043 -5.520 -0.246 1171 HZ2 TRP 140 HZ2 TRP 140 12.869 -1.290 1.244 1172 HZ3 TRP 140 HZ3 TRP 140 13.680 -4.173 -1.793 1173 HH2 TRP 140 HH2 TRP 140 12.614 -2.102 -1.065 Start of MODEL 7 1 H1 ALA 1 HT1 ALA 1 3.587 19.160 4.058 2 H2 ALA 1 HT2 ALA 1 4.127 20.780 4.238 3 H3 ALA 1 HT3 ALA 1 3.823 20.142 2.673 4 HA ALA 1 HA ALA 1 1.584 20.150 2.942 5 HB1 ALA 1 HB1 ALA 1 1.952 19.174 5.357 6 HB2 ALA 1 HB2 ALA 1 0.442 19.974 4.916 7 HB3 ALA 1 HB3 ALA 1 1.668 20.849 5.832 8 H THR 2 HN THR 2 0.261 21.973 2.773 9 HA THR 2 HA THR 2 1.219 24.526 3.762 10 HB THR 2 HB THR 2 1.352 25.593 1.604 11 HG1 THR 2 HG1 THR 2 1.091 24.334 -0.300 12 HG21 THR 2 HG21 THR 2 2.890 23.013 1.465 13 HG22 THR 2 HG22 THR 2 3.405 24.474 2.307 14 HG23 THR 2 HG23 THR 2 3.225 24.484 0.553 15 H SER 3 HN SER 3 -0.345 26.260 2.427 16 HA SER 3 HA SER 3 -3.016 25.434 3.264 17 HB2 SER 3 HB2 SER 3 -3.580 27.821 3.120 18 HB3 SER 3 HB1 SER 3 -2.146 27.570 4.114 19 HG SER 3 HG SER 3 -2.209 28.414 1.405 20 H THR 4 HN THR 4 -1.528 24.796 0.607 21 HA THR 4 HA THR 4 -3.870 24.857 -1.024 22 HB THR 4 HB THR 4 -1.678 26.245 -2.434 23 HG1 THR 4 HG1 THR 4 -2.290 28.259 -1.516 24 HG21 THR 4 HG21 THR 4 -3.609 27.679 -3.171 25 HG22 THR 4 HG22 THR 4 -4.658 26.556 -2.305 26 HG23 THR 4 HG23 THR 4 -3.673 25.984 -3.651 27 H LYS 5 HN LYS 5 -3.677 22.717 -1.428 28 HA LYS 5 HA LYS 5 -1.130 21.731 -2.508 29 HB2 LYS 5 HB2 LYS 5 -2.258 19.454 -2.110 30 HB3 LYS 5 HB1 LYS 5 -1.730 20.369 -0.704 31 HG2 LYS 5 HG2 LYS 5 -4.501 20.852 -1.574 32 HG3 LYS 5 HG1 LYS 5 -4.158 19.240 -0.941 33 HD2 LYS 5 HD2 LYS 5 -2.984 20.535 0.984 34 HD3 LYS 5 HD1 LYS 5 -3.958 21.896 0.424 35 HE2 LYS 5 HE2 LYS 5 -5.892 20.988 1.162 36 HE3 LYS 5 HE1 LYS 5 -5.388 19.342 0.782 37 HZ1 LYS 5 HZ1 LYS 5 -4.891 20.922 3.208 38 HZ2 LYS 5 HZ2 LYS 5 -3.783 19.722 2.768 39 HZ3 LYS 5 HZ3 LYS 5 -5.398 19.314 3.059 40 H LYS 6 HN LYS 6 -1.085 20.461 -4.397 41 HA LYS 6 HA LYS 6 -3.147 21.181 -6.318 42 HB2 LYS 6 HB2 LYS 6 -0.515 21.204 -6.603 43 HB3 LYS 6 HB1 LYS 6 -0.770 19.519 -7.032 44 HG2 LYS 6 HG2 LYS 6 -0.722 20.815 -9.034 45 HG3 LYS 6 HG1 LYS 6 -2.377 20.265 -8.773 46 HD2 LYS 6 HD2 LYS 6 -2.565 22.525 -9.408 47 HD3 LYS 6 HD1 LYS 6 -2.785 22.518 -7.659 48 HE2 LYS 6 HE2 LYS 6 -1.197 24.079 -7.577 49 HE3 LYS 6 HE1 LYS 6 -0.052 22.800 -7.980 50 HZ1 LYS 6 HZ1 LYS 6 0.397 24.248 -9.646 51 HZ2 LYS 6 HZ2 LYS 6 -1.161 24.904 -9.674 52 HZ3 LYS 6 HZ3 LYS 6 -0.862 23.407 -10.400 53 H LEU 7 HN LEU 7 -3.856 19.484 -7.901 54 HA LEU 7 HA LEU 7 -4.791 17.476 -8.431 55 HB2 LEU 7 HB2 LEU 7 -2.577 16.751 -6.801 56 HB3 LEU 7 HB1 LEU 7 -3.942 15.772 -6.298 57 HG LEU 7 HG LEU 7 -4.138 15.464 -8.966 58 HD11 LEU 7 HD11 LEU 7 -2.145 16.861 -9.366 59 HD12 LEU 7 HD12 LEU 7 -1.949 15.207 -9.946 60 HD13 LEU 7 HD13 LEU 7 -1.181 15.711 -8.440 61 HD21 LEU 7 HD21 LEU 7 -4.024 13.713 -7.214 62 HD22 LEU 7 HD22 LEU 7 -2.267 13.869 -7.221 63 HD23 LEU 7 HD23 LEU 7 -3.109 13.311 -8.667 64 H HIS 8 HN HIS 8 -5.859 15.467 -6.842 65 HA HIS 8 HA HIS 8 -7.339 16.606 -4.660 66 HB2 HIS 8 HB2 HIS 8 -9.574 16.088 -5.804 67 HB3 HIS 8 HB1 HIS 8 -8.739 17.557 -6.297 68 HD1 HIS 8 HD1 HIS 8 -8.108 17.767 -8.727 69 HD2 HIS 8 HD2 HIS 8 -9.423 13.954 -7.729 70 HE1 HIS 8 HE1 HIS 8 -8.351 16.546 -10.913 71 HE2 HIS 8 HE2 HIS 8 -9.225 14.267 -10.289 72 H LYS 9 HN LYS 9 -7.173 14.988 -3.263 73 HA LYS 9 HA LYS 9 -7.621 12.244 -4.227 74 HB2 LYS 9 HB2 LYS 9 -6.385 11.578 -2.120 75 HB3 LYS 9 HB1 LYS 9 -5.421 12.381 -3.351 76 HG2 LYS 9 HG2 LYS 9 -6.647 14.004 -1.175 77 HG3 LYS 9 HG1 LYS 9 -5.201 13.051 -0.842 78 HD2 LYS 9 HD2 LYS 9 -5.097 14.637 -3.314 79 HD3 LYS 9 HD1 LYS 9 -5.188 15.584 -1.827 80 HE2 LYS 9 HE2 LYS 9 -3.327 13.707 -1.170 81 HE3 LYS 9 HE1 LYS 9 -3.008 13.930 -2.889 82 HZ1 LYS 9 HZ1 LYS 9 -3.141 16.440 -2.215 83 HZ2 LYS 9 HZ2 LYS 9 -1.712 15.562 -2.001 84 HZ3 LYS 9 HZ3 LYS 9 -2.736 15.841 -0.685 85 H GLU 10 HN GLU 10 -8.647 10.771 -2.642 86 HA GLU 10 HA GLU 10 -10.667 12.203 -1.046 87 HB2 GLU 10 HB2 GLU 10 -11.169 10.617 -3.191 88 HB3 GLU 10 HB1 GLU 10 -11.262 9.437 -1.890 89 HG2 GLU 10 HG2 GLU 10 -13.103 10.421 -0.941 90 HG3 GLU 10 HG1 GLU 10 -12.740 12.006 -1.621 91 HA PRO 11 HA PRO 11 -8.901 9.890 2.335 92 HB2 PRO 11 HB2 PRO 11 -10.400 10.878 4.310 93 HB3 PRO 11 HB1 PRO 11 -9.218 11.888 3.468 94 HG2 PRO 11 HG2 PRO 11 -12.187 11.758 3.129 95 HG3 PRO 11 HG1 PRO 11 -11.122 13.174 3.143 96 HD2 PRO 11 HD2 PRO 11 -12.091 11.950 0.859 97 HD3 PRO 11 HD1 PRO 11 -10.643 12.971 0.922 98 H ALA 12 HN ALA 12 -9.653 8.440 4.104 99 HA ALA 12 HA ALA 12 -12.293 7.378 4.037 100 HB1 ALA 12 HB1 ALA 12 -11.476 6.330 2.009 101 HB2 ALA 12 HB2 ALA 12 -11.702 5.117 3.270 102 HB3 ALA 12 HB3 ALA 12 -10.082 5.690 2.878 103 H THR 13 HN THR 13 -12.384 5.293 5.405 104 HA THR 13 HA THR 13 -10.381 5.459 7.560 105 HB THR 13 HB THR 13 -12.535 4.621 8.927 106 HG1 THR 13 HG1 THR 13 -14.067 4.762 7.395 107 HG21 THR 13 HG21 THR 13 -12.632 7.523 8.536 108 HG22 THR 13 HG22 THR 13 -11.051 6.875 8.976 109 HG23 THR 13 HG23 THR 13 -12.448 6.575 10.012 110 H LEU 14 HN LEU 14 -9.831 3.527 8.599 111 HA LEU 14 HA LEU 14 -10.081 1.186 6.960 112 HB2 LEU 14 HB2 LEU 14 -8.268 2.099 8.867 113 HB3 LEU 14 HB1 LEU 14 -9.022 0.707 9.623 114 HG LEU 14 HG LEU 14 -6.914 0.207 8.376 115 HD11 LEU 14 HD11 LEU 14 -8.030 -1.737 8.674 116 HD12 LEU 14 HD12 LEU 14 -8.187 -1.637 6.920 117 HD13 LEU 14 HD13 LEU 14 -9.520 -1.124 7.956 118 HD21 LEU 14 HD21 LEU 14 -7.938 1.813 6.432 119 HD22 LEU 14 HD22 LEU 14 -8.287 0.209 5.787 120 HD23 LEU 14 HD23 LEU 14 -6.631 0.654 6.196 121 H ILE 15 HN ILE 15 -11.939 0.089 6.945 122 HA ILE 15 HA ILE 15 -13.773 0.042 9.114 123 HB ILE 15 HB ILE 15 -13.615 -1.830 6.745 124 HG12 ILE 15 HG12 ILE 15 -13.793 0.575 6.133 125 HG13 ILE 15 HG11 ILE 15 -15.210 -0.357 5.663 126 HG21 ILE 15 HG21 ILE 15 -14.995 -2.780 8.457 127 HG22 ILE 15 HG22 ILE 15 -16.045 -2.145 7.189 128 HG23 ILE 15 HG23 ILE 15 -15.838 -1.249 8.694 129 HD11 ILE 15 HD11 ILE 15 -16.095 0.481 8.003 130 HD12 ILE 15 HD12 ILE 15 -16.220 1.471 6.549 131 HD13 ILE 15 HD13 ILE 15 -14.923 1.766 7.708 132 H LYS 16 HN LYS 16 -11.346 -2.217 7.893 133 HA LYS 16 HA LYS 16 -10.888 -3.334 10.453 134 HB2 LYS 16 HB2 LYS 16 -12.868 -4.643 8.731 135 HB3 LYS 16 HB1 LYS 16 -11.586 -5.720 9.269 136 HG2 LYS 16 HG2 LYS 16 -12.327 -4.311 11.550 137 HG3 LYS 16 HG1 LYS 16 -13.845 -4.670 10.723 138 HD2 LYS 16 HD2 LYS 16 -13.344 -7.015 10.691 139 HD3 LYS 16 HD1 LYS 16 -11.715 -6.724 11.303 140 HE2 LYS 16 HE2 LYS 16 -12.416 -6.524 13.432 141 HE3 LYS 16 HE1 LYS 16 -13.875 -5.646 12.974 142 HZ1 LYS 16 HZ1 LYS 16 -14.723 -7.616 13.752 143 HZ2 LYS 16 HZ2 LYS 16 -13.438 -8.547 13.165 144 HZ3 LYS 16 HZ3 LYS 16 -14.609 -7.957 12.098 145 H ALA 17 HN ALA 17 -8.869 -4.115 10.505 146 HA ALA 17 HA ALA 17 -7.325 -4.131 8.096 147 HB1 ALA 17 HB1 ALA 17 -6.630 -3.385 10.490 148 HB2 ALA 17 HB2 ALA 17 -5.452 -4.172 9.439 149 HB3 ALA 17 HB3 ALA 17 -6.256 -5.095 10.710 150 H ILE 18 HN ILE 18 -6.856 -5.821 6.846 151 HA ILE 18 HA ILE 18 -7.755 -8.472 7.659 152 HB ILE 18 HB ILE 18 -6.420 -7.939 5.034 153 HG12 ILE 18 HG12 ILE 18 -8.441 -6.287 5.805 154 HG13 ILE 18 HG11 ILE 18 -8.104 -6.729 4.141 155 HG21 ILE 18 HG21 ILE 18 -8.094 -9.638 4.291 156 HG22 ILE 18 HG22 ILE 18 -8.578 -9.808 5.978 157 HG23 ILE 18 HG23 ILE 18 -6.934 -10.213 5.488 158 HD11 ILE 18 HD11 ILE 18 -10.109 -8.069 5.943 159 HD12 ILE 18 HD12 ILE 18 -9.791 -8.480 4.257 160 HD13 ILE 18 HD13 ILE 18 -10.474 -6.906 4.668 161 H ASP 19 HN ASP 19 -4.863 -7.344 5.918 162 HA ASP 19 HA ASP 19 -3.153 -8.734 7.819 163 HB2 ASP 19 HB2 ASP 19 -3.682 -10.526 6.285 164 HB3 ASP 19 HB1 ASP 19 -3.286 -9.516 4.899 165 H GLY 20 HN GLY 20 -1.939 -8.163 4.616 166 HA2 GLY 20 HA2 GLY 20 -0.675 -5.669 5.572 167 HA3 GLY 20 HA1 GLY 20 0.205 -6.883 4.653 168 H ASP 21 HN ASP 21 -0.550 -7.327 2.451 169 HA ASP 21 HA ASP 21 -0.967 -4.926 1.007 170 HB2 ASP 21 HB2 ASP 21 -0.593 -7.791 0.350 171 HB3 ASP 21 HB1 ASP 21 -1.434 -6.821 -0.856 172 H THR 22 HN THR 22 -3.117 -6.859 2.688 173 HA THR 22 HA THR 22 -5.369 -5.872 1.072 174 HB THR 22 HB THR 22 -5.337 -8.446 2.655 175 HG1 THR 22 HG1 THR 22 -5.054 -9.486 0.733 176 HG21 THR 22 HG21 THR 22 -7.563 -8.015 2.468 177 HG22 THR 22 HG22 THR 22 -7.281 -8.848 0.940 178 HG23 THR 22 HG23 THR 22 -7.374 -7.087 0.980 179 H VAL 23 HN VAL 23 -6.789 -4.642 2.134 180 HA VAL 23 HA VAL 23 -7.245 -4.952 4.972 181 HB VAL 23 HB VAL 23 -6.760 -2.605 5.525 182 HG11 VAL 23 HG11 VAL 23 -4.272 -3.811 4.358 183 HG12 VAL 23 HG12 VAL 23 -5.081 -4.519 5.755 184 HG13 VAL 23 HG13 VAL 23 -4.455 -2.873 5.840 185 HG21 VAL 23 HG21 VAL 23 -6.105 -2.503 2.640 186 HG22 VAL 23 HG22 VAL 23 -5.067 -1.581 3.727 187 HG23 VAL 23 HG23 VAL 23 -6.802 -1.270 3.691 188 H LYS 24 HN LYS 24 -9.181 -4.022 5.671 189 HA LYS 24 HA LYS 24 -11.030 -3.343 3.534 190 HB2 LYS 24 HB2 LYS 24 -11.584 -4.956 5.405 191 HB3 LYS 24 HB1 LYS 24 -11.630 -3.568 6.483 192 HG2 LYS 24 HG2 LYS 24 -13.861 -3.998 5.882 193 HG3 LYS 24 HG1 LYS 24 -13.372 -2.586 4.943 194 HD2 LYS 24 HD2 LYS 24 -14.649 -4.199 3.597 195 HD3 LYS 24 HD1 LYS 24 -13.007 -3.980 2.989 196 HE2 LYS 24 HE2 LYS 24 -12.461 -6.118 3.373 197 HE3 LYS 24 HE1 LYS 24 -13.244 -6.127 4.954 198 HZ1 LYS 24 HZ1 LYS 24 -14.267 -7.669 3.355 199 HZ2 LYS 24 HZ2 LYS 24 -14.681 -6.362 2.366 200 HZ3 LYS 24 HZ3 LYS 24 -15.356 -6.500 3.910 201 H LEU 25 HN LEU 25 -11.839 -1.356 3.139 202 HA LEU 25 HA LEU 25 -11.308 0.772 5.093 203 HB2 LEU 25 HB2 LEU 25 -10.193 0.497 2.448 204 HB3 LEU 25 HB1 LEU 25 -11.131 1.974 2.570 205 HG LEU 25 HG LEU 25 -9.372 1.601 4.859 206 HD11 LEU 25 HD11 LEU 25 -8.214 1.539 2.096 207 HD12 LEU 25 HD12 LEU 25 -7.807 0.544 3.494 208 HD13 LEU 25 HD13 LEU 25 -7.328 2.240 3.450 209 HD21 LEU 25 HD21 LEU 25 -9.402 3.806 2.816 210 HD22 LEU 25 HD22 LEU 25 -8.892 3.885 4.502 211 HD23 LEU 25 HD23 LEU 25 -10.597 3.678 4.106 212 H MET 26 HN MET 26 -12.676 2.651 4.880 213 HA MET 26 HA MET 26 -15.368 1.901 4.098 214 HB2 MET 26 HB2 MET 26 -14.639 3.116 6.277 215 HB3 MET 26 HB1 MET 26 -14.608 4.557 5.271 216 HG2 MET 26 HG2 MET 26 -16.890 4.527 4.924 217 HG3 MET 26 HG1 MET 26 -17.030 2.814 5.313 218 HE1 MET 26 HE1 MET 26 -18.819 2.748 6.721 219 HE2 MET 26 HE2 MET 26 -18.883 3.275 8.403 220 HE3 MET 26 HE3 MET 26 -17.758 2.006 7.919 221 H TYR 27 HN TYR 27 -16.136 2.328 2.158 222 HA TYR 27 HA TYR 27 -15.356 4.823 0.816 223 HB2 TYR 27 HB2 TYR 27 -14.129 2.836 -0.135 224 HB3 TYR 27 HB1 TYR 27 -15.692 2.186 -0.618 225 HD1 TYR 27 HD1 TYR 27 -14.513 5.707 -0.762 226 HD2 TYR 27 HD2 TYR 27 -15.605 2.232 -2.955 227 HE1 TYR 27 HE1 TYR 27 -14.392 6.998 -2.852 228 HE2 TYR 27 HE2 TYR 27 -15.488 3.511 -5.053 229 HH TYR 27 HH TYR 27 -14.100 5.770 -5.757 230 H LYS 28 HN LYS 28 -17.066 6.015 0.315 231 HA LYS 28 HA LYS 28 -19.208 6.649 -0.124 232 HB2 LYS 28 HB2 LYS 28 -19.304 3.858 -1.270 233 HB3 LYS 28 HB1 LYS 28 -20.561 5.067 -1.497 234 HG2 LYS 28 HG2 LYS 28 -18.830 6.539 -2.551 235 HG3 LYS 28 HG1 LYS 28 -17.728 5.161 -2.495 236 HD2 LYS 28 HD2 LYS 28 -18.643 5.087 -4.649 237 HD3 LYS 28 HD1 LYS 28 -19.559 3.882 -3.743 238 HE2 LYS 28 HE2 LYS 28 -20.690 6.586 -3.663 239 HE3 LYS 28 HE1 LYS 28 -20.652 5.859 -5.268 240 HZ1 LYS 28 HZ1 LYS 28 -22.020 4.871 -2.841 241 HZ2 LYS 28 HZ2 LYS 28 -21.704 3.852 -4.154 242 HZ3 LYS 28 HZ3 LYS 28 -22.685 5.214 -4.359 243 H GLY 29 HN GLY 29 -18.749 5.815 2.473 244 HA2 GLY 29 HA2 GLY 29 -19.865 5.181 4.378 245 HA3 GLY 29 HA1 GLY 29 -21.341 5.354 3.438 246 H GLN 30 HN GLN 30 -18.971 3.165 2.260 247 HA GLN 30 HA GLN 30 -20.346 0.872 3.460 248 HB2 GLN 30 HB2 GLN 30 -20.819 -0.153 1.435 249 HB3 GLN 30 HB1 GLN 30 -21.113 1.535 1.048 250 HG2 GLN 30 HG2 GLN 30 -19.512 1.579 -0.493 251 HG3 GLN 30 HG1 GLN 30 -18.365 0.719 0.529 252 HE21 GLN 30 HE21 GLN 30 -21.252 0.213 -1.448 253 HE22 GLN 30 HE22 GLN 30 -20.810 -1.361 -2.006 254 HA PRO 31 HA PRO 31 -16.236 -0.650 3.857 255 HB2 PRO 31 HB2 PRO 31 -16.673 -3.196 4.425 256 HB3 PRO 31 HB1 PRO 31 -17.332 -1.922 5.467 257 HG2 PRO 31 HG2 PRO 31 -18.721 -3.523 3.349 258 HG3 PRO 31 HG1 PRO 31 -19.278 -3.109 4.980 259 HD2 PRO 31 HD2 PRO 31 -19.976 -1.733 2.683 260 HD3 PRO 31 HD1 PRO 31 -20.030 -1.053 4.322 261 H MET 32 HN MET 32 -14.822 -0.823 2.252 262 HA MET 32 HA MET 32 -15.298 -2.836 0.154 263 HB2 MET 32 HB2 MET 32 -15.296 -0.210 -0.348 264 HB3 MET 32 HB1 MET 32 -13.561 -0.487 -0.416 265 HG2 MET 32 HG2 MET 32 -14.316 -0.695 -2.620 266 HG3 MET 32 HG1 MET 32 -14.059 -2.346 -2.056 267 HE1 MET 32 HE1 MET 32 -17.141 -4.077 -2.826 268 HE2 MET 32 HE2 MET 32 -16.428 -3.951 -1.218 269 HE3 MET 32 HE3 MET 32 -15.388 -4.023 -2.641 270 H THR 33 HN THR 33 -13.482 -3.970 -0.620 271 HA THR 33 HA THR 33 -11.388 -4.254 1.363 272 HB THR 33 HB THR 33 -11.328 -5.816 -1.165 273 HG1 THR 33 HG1 THR 33 -13.289 -6.241 0.838 274 HG21 THR 33 HG21 THR 33 -9.922 -6.120 1.033 275 HG22 THR 33 HG22 THR 33 -10.475 -7.506 0.093 276 HG23 THR 33 HG23 THR 33 -11.350 -7.019 1.545 277 H PHE 34 HN PHE 34 -9.688 -2.957 1.267 278 HA PHE 34 HA PHE 34 -8.739 -2.054 -1.356 279 HB2 PHE 34 HB2 PHE 34 -8.599 -0.898 1.395 280 HB3 PHE 34 HB1 PHE 34 -7.335 -0.487 0.240 281 HD1 PHE 34 HD1 PHE 34 -11.005 -0.448 0.755 282 HD2 PHE 34 HD2 PHE 34 -7.695 1.129 -1.409 283 HE1 PHE 34 HE1 PHE 34 -12.474 1.255 -0.246 284 HE2 PHE 34 HE2 PHE 34 -9.156 2.836 -2.408 285 HZ PHE 34 HZ PHE 34 -11.547 2.899 -1.829 286 H ARG 35 HN ARG 35 -6.581 -2.284 -1.957 287 HA ARG 35 HA ARG 35 -4.965 -4.011 -0.219 288 HB2 ARG 35 HB2 ARG 35 -4.563 -5.570 -1.880 289 HB3 ARG 35 HB1 ARG 35 -6.235 -5.132 -2.203 290 HG2 ARG 35 HG2 ARG 35 -5.533 -4.894 -4.310 291 HG3 ARG 35 HG1 ARG 35 -4.924 -3.335 -3.752 292 HD2 ARG 35 HD2 ARG 35 -2.766 -3.999 -3.833 293 HD3 ARG 35 HD1 ARG 35 -3.143 -5.639 -3.309 294 HE ARG 35 HE ARG 35 -4.025 -5.047 -5.980 295 HH11 ARG 35 HH11 ARG 35 -1.344 -6.138 -4.029 296 HH12 ARG 35 HH12 ARG 35 -0.580 -6.985 -5.332 297 HH21 ARG 35 HH21 ARG 35 -3.019 -6.161 -7.693 298 HH22 ARG 35 HH22 ARG 35 -1.529 -6.997 -7.412 299 H LEU 36 HN LEU 36 -2.720 -3.817 -0.386 300 HA LEU 36 HA LEU 36 -1.751 -1.245 -1.083 301 HB2 LEU 36 HB2 LEU 36 -0.266 -3.803 -0.431 302 HB3 LEU 36 HB1 LEU 36 0.495 -2.226 -0.596 303 HG LEU 36 HG LEU 36 -1.619 -2.872 1.459 304 HD11 LEU 36 HD11 LEU 36 0.718 -4.047 1.563 305 HD12 LEU 36 HD12 LEU 36 0.010 -3.332 3.010 306 HD13 LEU 36 HD13 LEU 36 1.259 -2.464 2.118 307 HD21 LEU 36 HD21 LEU 36 0.252 -0.525 1.161 308 HD22 LEU 36 HD22 LEU 36 -0.880 -0.783 2.487 309 HD23 LEU 36 HD23 LEU 36 -1.484 -0.512 0.853 310 H LEU 37 HN LEU 37 -2.493 -1.139 -3.264 311 HA LEU 37 HA LEU 37 -2.364 -2.411 -5.456 312 HB2 LEU 37 HB2 LEU 37 -2.641 0.037 -5.263 313 HB3 LEU 37 HB1 LEU 37 -0.897 0.212 -5.281 314 HG LEU 37 HG LEU 37 -0.871 -0.841 -7.530 315 HD11 LEU 37 HD11 LEU 37 -3.717 -1.123 -6.922 316 HD12 LEU 37 HD12 LEU 37 -2.689 -2.048 -8.017 317 HD13 LEU 37 HD13 LEU 37 -3.366 -0.504 -8.536 318 HD21 LEU 37 HD21 LEU 37 -1.301 1.737 -6.860 319 HD22 LEU 37 HD22 LEU 37 -2.706 1.430 -7.882 320 HD23 LEU 37 HD23 LEU 37 -1.081 1.174 -8.517 321 H LEU 38 HN LEU 38 0.585 -0.662 -5.893 322 HA LEU 38 HA LEU 38 1.864 -3.089 -6.740 323 HB2 LEU 38 HB2 LEU 38 3.649 -1.627 -7.559 324 HB3 LEU 38 HB1 LEU 38 2.070 -1.138 -8.143 325 HG LEU 38 HG LEU 38 2.863 0.233 -5.682 326 HD11 LEU 38 HD11 LEU 38 4.632 0.270 -8.079 327 HD12 LEU 38 HD12 LEU 38 5.049 0.350 -6.367 328 HD13 LEU 38 HD13 LEU 38 4.373 1.764 -7.178 329 HD21 LEU 38 HD21 LEU 38 2.328 2.172 -7.378 330 HD22 LEU 38 HD22 LEU 38 1.043 1.186 -6.682 331 HD23 LEU 38 HD23 LEU 38 1.625 0.852 -8.313 332 H VAL 39 HN VAL 39 1.794 -3.848 -4.420 333 HA VAL 39 HA VAL 39 4.366 -3.183 -3.171 334 HB VAL 39 HB VAL 39 1.800 -3.608 -1.629 335 HG11 VAL 39 HG11 VAL 39 3.090 -3.108 0.339 336 HG12 VAL 39 HG12 VAL 39 4.528 -2.798 -0.633 337 HG13 VAL 39 HG13 VAL 39 3.871 -4.430 -0.530 338 HG21 VAL 39 HG21 VAL 39 3.179 -1.179 -2.600 339 HG22 VAL 39 HG22 VAL 39 2.571 -1.138 -0.945 340 HG23 VAL 39 HG23 VAL 39 1.468 -1.463 -2.282 341 H ASP 40 HN ASP 40 5.479 -4.905 -2.335 342 HA ASP 40 HA ASP 40 4.300 -7.549 -2.844 343 HB2 ASP 40 HB2 ASP 40 6.653 -6.535 -3.769 344 HB3 ASP 40 HB1 ASP 40 7.198 -7.382 -2.325 345 H THR 41 HN THR 41 4.555 -9.231 -1.345 346 HA THR 41 HA THR 41 4.747 -8.305 1.418 347 HB THR 41 HB THR 41 4.118 -11.117 1.133 348 HG1 THR 41 HG1 THR 41 3.266 -10.681 -0.847 349 HG21 THR 41 HG21 THR 41 1.819 -9.873 1.932 350 HG22 THR 41 HG22 THR 41 3.075 -8.772 2.497 351 HG23 THR 41 HG23 THR 41 3.096 -10.464 2.993 352 HA PRO 42 HA PRO 42 8.712 -10.143 2.037 353 HB2 PRO 42 HB2 PRO 42 8.686 -10.583 4.693 354 HB3 PRO 42 HB1 PRO 42 8.731 -8.952 4.011 355 HG2 PRO 42 HG2 PRO 42 6.403 -10.486 5.102 356 HG3 PRO 42 HG1 PRO 42 6.832 -8.782 5.340 357 HD2 PRO 42 HD2 PRO 42 4.944 -9.629 3.556 358 HD3 PRO 42 HD1 PRO 42 5.891 -8.142 3.348 359 H GLU 43 HN GLU 43 7.190 -12.041 0.864 360 HA GLU 43 HA GLU 43 7.101 -14.290 0.544 361 HB2 GLU 43 HB2 GLU 43 9.374 -13.918 2.138 362 HB3 GLU 43 HB1 GLU 43 8.489 -15.232 2.902 363 HG2 GLU 43 HG2 GLU 43 8.590 -15.564 0.037 364 HG3 GLU 43 HG1 GLU 43 10.205 -15.400 0.725 365 H THR 44 HN THR 44 7.050 -13.819 4.089 366 HA THR 44 HA THR 44 5.388 -14.202 5.617 367 HB THR 44 HB THR 44 3.583 -15.323 3.494 368 HG1 THR 44 HG1 THR 44 2.940 -13.218 3.013 369 HG21 THR 44 HG21 THR 44 2.113 -13.639 5.038 370 HG22 THR 44 HG22 THR 44 3.270 -14.282 6.202 371 HG23 THR 44 HG23 THR 44 2.247 -15.380 5.276 372 H LYS 45 HN LYS 45 4.287 -16.076 6.644 373 HA LYS 45 HA LYS 45 4.284 -18.228 7.383 374 HB2 LYS 45 HB2 LYS 45 5.212 -19.082 4.647 375 HB3 LYS 45 HB1 LYS 45 4.270 -20.004 5.811 376 HG2 LYS 45 HG2 LYS 45 2.332 -18.713 5.408 377 HG3 LYS 45 HG1 LYS 45 3.244 -17.501 4.505 378 HD2 LYS 45 HD2 LYS 45 2.444 -18.647 2.726 379 HD3 LYS 45 HD1 LYS 45 3.830 -19.687 3.057 380 HE2 LYS 45 HE2 LYS 45 2.341 -21.089 4.487 381 HE3 LYS 45 HE1 LYS 45 0.980 -20.109 3.942 382 HZ1 LYS 45 HZ1 LYS 45 1.792 -20.753 1.609 383 HZ2 LYS 45 HZ2 LYS 45 0.955 -21.911 2.514 384 HZ3 LYS 45 HZ3 LYS 45 2.639 -21.990 2.393 385 H HIS 46 HN HIS 46 6.668 -16.572 7.539 386 HA HIS 46 HA HIS 46 8.703 -18.699 7.695 387 HB2 HIS 46 HB2 HIS 46 8.881 -16.509 6.083 388 HB3 HIS 46 HB1 HIS 46 9.674 -15.918 7.539 389 HD1 HIS 46 HD1 HIS 46 12.097 -16.034 7.012 390 HD2 HIS 46 HD2 HIS 46 10.087 -19.490 5.878 391 HE1 HIS 46 HE1 HIS 46 13.880 -17.621 6.222 392 HE2 HIS 46 HE2 HIS 46 12.632 -19.673 5.460 393 HA PRO 47 HA PRO 47 7.995 -17.248 11.998 394 HB2 PRO 47 HB2 PRO 47 8.587 -19.630 13.153 395 HB3 PRO 47 HB1 PRO 47 6.989 -19.253 12.500 396 HG2 PRO 47 HG2 PRO 47 9.218 -20.824 11.264 397 HG3 PRO 47 HG1 PRO 47 7.480 -21.180 11.293 398 HD2 PRO 47 HD2 PRO 47 8.710 -20.096 9.138 399 HD3 PRO 47 HD1 PRO 47 7.026 -19.726 9.562 400 H LYS 48 HN LYS 48 9.593 -16.112 12.883 401 HA LYS 48 HA LYS 48 12.276 -17.314 13.016 402 HB2 LYS 48 HB2 LYS 48 12.107 -15.502 11.290 403 HB3 LYS 48 HB1 LYS 48 11.714 -14.378 12.583 404 HG2 LYS 48 HG2 LYS 48 13.850 -14.114 13.115 405 HG3 LYS 48 HG1 LYS 48 14.116 -15.857 13.189 406 HD2 LYS 48 HD2 LYS 48 15.502 -15.377 11.451 407 HD3 LYS 48 HD1 LYS 48 14.003 -15.578 10.541 408 HE2 LYS 48 HE2 LYS 48 15.042 -12.938 11.564 409 HE3 LYS 48 HE1 LYS 48 15.293 -13.541 9.926 410 HZ1 LYS 48 HZ1 LYS 48 12.906 -12.434 11.146 411 HZ2 LYS 48 HZ2 LYS 48 12.653 -13.769 10.139 412 HZ3 LYS 48 HZ3 LYS 48 13.420 -12.389 9.534 413 H LYS 49 HN LYS 49 10.646 -14.398 14.268 414 HA LYS 49 HA LYS 49 11.780 -14.976 16.906 415 HB2 LYS 49 HB2 LYS 49 11.060 -12.543 15.440 416 HB3 LYS 49 HB1 LYS 49 10.529 -12.531 17.116 417 HG2 LYS 49 HG2 LYS 49 13.300 -13.414 16.671 418 HG3 LYS 49 HG1 LYS 49 12.960 -11.723 16.295 419 HD2 LYS 49 HD2 LYS 49 11.972 -11.459 18.545 420 HD3 LYS 49 HD1 LYS 49 12.412 -13.129 18.910 421 HE2 LYS 49 HE2 LYS 49 14.787 -12.532 18.464 422 HE3 LYS 49 HE1 LYS 49 14.286 -10.853 18.278 423 HZ1 LYS 49 HZ1 LYS 49 13.442 -12.175 20.725 424 HZ2 LYS 49 HZ2 LYS 49 14.006 -10.599 20.485 425 HZ3 LYS 49 HZ3 LYS 49 15.102 -11.883 20.580 426 H GLY 50 HN GLY 50 9.497 -16.452 15.824 427 HA2 GLY 50 HA2 GLY 50 7.945 -17.070 17.841 428 HA3 GLY 50 HA1 GLY 50 7.269 -15.492 17.467 429 H VAL 51 HN VAL 51 6.810 -18.688 17.031 430 HA VAL 51 HA VAL 51 6.117 -18.884 14.295 431 HB VAL 51 HB VAL 51 4.950 -20.511 16.554 432 HG11 VAL 51 HG11 VAL 51 4.777 -22.254 14.812 433 HG12 VAL 51 HG12 VAL 51 5.342 -21.085 13.619 434 HG13 VAL 51 HG13 VAL 51 3.808 -20.826 14.449 435 HG21 VAL 51 HG21 VAL 51 7.656 -20.482 15.377 436 HG22 VAL 51 HG22 VAL 51 6.918 -22.069 15.589 437 HG23 VAL 51 HG23 VAL 51 7.118 -20.996 16.975 438 H GLU 52 HN GLU 52 4.798 -17.216 13.641 439 HA GLU 52 HA GLU 52 2.089 -17.201 14.803 440 HB2 GLU 52 HB2 GLU 52 3.567 -14.842 13.621 441 HB3 GLU 52 HB1 GLU 52 1.937 -14.816 14.282 442 HG2 GLU 52 HG2 GLU 52 2.781 -15.306 16.488 443 HG3 GLU 52 HG1 GLU 52 4.418 -15.473 15.854 444 H LYS 53 HN LYS 53 0.555 -16.001 13.147 445 HA LYS 53 HA LYS 53 0.841 -17.469 10.631 446 HB2 LYS 53 HB2 LYS 53 -1.603 -15.981 11.578 447 HB3 LYS 53 HB1 LYS 53 -1.511 -17.244 10.358 448 HG2 LYS 53 HG2 LYS 53 -0.594 -18.635 12.427 449 HG3 LYS 53 HG1 LYS 53 -1.561 -17.451 13.310 450 HD2 LYS 53 HD2 LYS 53 -3.210 -18.955 12.932 451 HD3 LYS 53 HD1 LYS 53 -3.311 -18.114 11.384 452 HE2 LYS 53 HE2 LYS 53 -1.384 -19.931 10.842 453 HE3 LYS 53 HE1 LYS 53 -2.350 -20.826 12.013 454 HZ1 LYS 53 HZ1 LYS 53 -3.949 -21.135 10.522 455 HZ2 LYS 53 HZ2 LYS 53 -2.872 -20.573 9.345 456 HZ3 LYS 53 HZ3 LYS 53 -3.970 -19.506 10.064 457 H TYR 54 HN TYR 54 0.748 -16.489 8.628 458 HA TYR 54 HA TYR 54 1.095 -14.869 7.068 459 HB2 TYR 54 HB2 TYR 54 -0.466 -13.255 9.088 460 HB3 TYR 54 HB1 TYR 54 -0.004 -12.641 7.504 461 HD1 TYR 54 HD1 TYR 54 -0.976 -13.645 5.459 462 HD2 TYR 54 HD2 TYR 54 -2.279 -14.789 9.345 463 HE1 TYR 54 HE1 TYR 54 -2.999 -14.644 4.480 464 HE2 TYR 54 HE2 TYR 54 -4.305 -15.791 8.376 465 HH TYR 54 HH TYR 54 -5.540 -15.145 5.621 466 H GLY 55 HN GLY 55 1.904 -12.389 6.933 467 HA2 GLY 55 HA2 GLY 55 4.532 -12.447 8.045 468 HA3 GLY 55 HA1 GLY 55 3.833 -11.141 7.101 469 HA PRO 56 HA PRO 56 3.200 -10.504 11.911 470 HB2 PRO 56 HB2 PRO 56 5.618 -10.676 13.146 471 HB3 PRO 56 HB1 PRO 56 4.487 -12.030 13.043 472 HG2 PRO 56 HG2 PRO 56 6.894 -11.440 11.361 473 HG3 PRO 56 HG1 PRO 56 6.363 -12.985 12.051 474 HD2 PRO 56 HD2 PRO 56 5.931 -12.338 9.466 475 HD3 PRO 56 HD1 PRO 56 4.787 -13.325 10.398 476 H GLU 57 HN GLU 57 6.227 -9.727 10.220 477 HA GLU 57 HA GLU 57 6.392 -7.107 11.394 478 HB2 GLU 57 HB2 GLU 57 8.267 -8.719 10.397 479 HB3 GLU 57 HB1 GLU 57 7.933 -7.793 8.941 480 HG2 GLU 57 HG2 GLU 57 9.495 -6.413 9.749 481 HG3 GLU 57 HG1 GLU 57 8.178 -5.803 10.751 482 H ALA 58 HN ALA 58 5.063 -8.489 8.487 483 HA ALA 58 HA ALA 58 4.819 -5.979 7.103 484 HB1 ALA 58 HB1 ALA 58 5.037 -8.258 6.018 485 HB2 ALA 58 HB2 ALA 58 3.792 -7.194 5.364 486 HB3 ALA 58 HB3 ALA 58 3.345 -8.515 6.445 487 H SER 59 HN SER 59 2.427 -8.258 8.467 488 HA SER 59 HA SER 59 0.214 -6.558 8.150 489 HB2 SER 59 HB2 SER 59 0.789 -9.037 9.682 490 HB3 SER 59 HB1 SER 59 -0.592 -8.081 10.217 491 HG SER 59 HG SER 59 -0.212 -8.808 7.510 492 H ALA 60 HN ALA 60 2.621 -6.807 10.672 493 HA ALA 60 HA ALA 60 1.266 -5.366 12.675 494 HB1 ALA 60 HB1 ALA 60 4.154 -5.946 12.146 495 HB2 ALA 60 HB2 ALA 60 3.109 -6.571 13.423 496 HB3 ALA 60 HB3 ALA 60 3.666 -4.898 13.477 497 H PHE 61 HN PHE 61 3.831 -4.266 10.445 498 HA PHE 61 HA PHE 61 3.659 -1.564 11.158 499 HB2 PHE 61 HB2 PHE 61 5.581 -2.590 9.975 500 HB3 PHE 61 HB1 PHE 61 4.585 -2.722 8.526 501 HD1 PHE 61 HD1 PHE 61 6.117 -0.350 10.881 502 HD2 PHE 61 HD2 PHE 61 4.256 -0.883 7.101 503 HE1 PHE 61 HE1 PHE 61 6.752 1.947 10.250 504 HE2 PHE 61 HE2 PHE 61 4.878 1.403 6.455 505 HZ PHE 61 HZ PHE 61 6.133 2.826 8.032 506 H THR 62 HN THR 62 2.389 -3.201 8.248 507 HA THR 62 HA THR 62 1.122 -1.047 7.083 508 HB THR 62 HB THR 62 0.132 -3.906 7.123 509 HG1 THR 62 HG1 THR 62 2.053 -4.122 6.239 510 HG21 THR 62 HG21 THR 62 -1.199 -1.811 6.055 511 HG22 THR 62 HG22 THR 62 -1.271 -3.463 5.441 512 HG23 THR 62 HG23 THR 62 -0.180 -2.294 4.699 513 H LYS 63 HN LYS 63 -0.068 -3.202 9.609 514 HA LYS 63 HA LYS 63 -2.647 -1.943 9.758 515 HB2 LYS 63 HB2 LYS 63 -2.337 -4.310 10.348 516 HB3 LYS 63 HB1 LYS 63 -1.271 -3.844 11.667 517 HG2 LYS 63 HG2 LYS 63 -3.909 -2.574 11.736 518 HG3 LYS 63 HG1 LYS 63 -3.931 -4.330 11.907 519 HD2 LYS 63 HD2 LYS 63 -2.254 -2.440 13.559 520 HD3 LYS 63 HD1 LYS 63 -3.775 -3.168 14.078 521 HE2 LYS 63 HE2 LYS 63 -2.076 -5.241 13.130 522 HE3 LYS 63 HE1 LYS 63 -1.148 -4.237 14.243 523 HZ1 LYS 63 HZ1 LYS 63 -2.423 -4.836 15.991 524 HZ2 LYS 63 HZ2 LYS 63 -2.690 -6.217 15.052 525 HZ3 LYS 63 HZ3 LYS 63 -3.840 -4.977 15.077 526 H LYS 64 HN LYS 64 0.461 -1.516 11.227 527 HA LYS 64 HA LYS 64 -0.276 -0.131 13.552 528 HB2 LYS 64 HB2 LYS 64 2.128 -0.801 12.168 529 HB3 LYS 64 HB1 LYS 64 2.188 0.909 12.570 530 HG2 LYS 64 HG2 LYS 64 1.442 -1.116 14.641 531 HG3 LYS 64 HG1 LYS 64 3.133 -0.807 14.237 532 HD2 LYS 64 HD2 LYS 64 1.218 1.393 14.970 533 HD3 LYS 64 HD1 LYS 64 2.159 0.517 16.178 534 HE2 LYS 64 HE2 LYS 64 3.466 1.804 13.804 535 HE3 LYS 64 HE1 LYS 64 3.104 2.725 15.262 536 HZ1 LYS 64 HZ1 LYS 64 5.111 0.673 14.815 537 HZ2 LYS 64 HZ2 LYS 64 4.329 0.621 16.314 538 HZ3 LYS 64 HZ3 LYS 64 5.148 2.020 15.837 539 H MET 65 HN MET 65 0.704 1.115 10.365 540 HA MET 65 HA MET 65 0.346 3.831 11.029 541 HB2 MET 65 HB2 MET 65 0.767 2.295 8.516 542 HB3 MET 65 HB1 MET 65 0.203 3.954 8.386 543 HG2 MET 65 HG2 MET 65 2.468 3.569 10.204 544 HG3 MET 65 HG1 MET 65 2.801 3.202 8.512 545 HE1 MET 65 HE1 MET 65 2.102 5.675 11.202 546 HE2 MET 65 HE2 MET 65 2.595 7.210 10.485 547 HE3 MET 65 HE3 MET 65 3.772 5.911 10.687 548 H VAL 66 HN VAL 66 -1.705 1.643 9.087 549 HA VAL 66 HA VAL 66 -3.720 3.513 8.565 550 HB VAL 66 HB VAL 66 -5.194 1.509 8.178 551 HG11 VAL 66 HG11 VAL 66 -2.488 1.490 6.840 552 HG12 VAL 66 HG12 VAL 66 -3.848 2.524 6.401 553 HG13 VAL 66 HG13 VAL 66 -3.968 0.776 6.198 554 HG21 VAL 66 HG21 VAL 66 -3.368 -0.559 8.065 555 HG22 VAL 66 HG22 VAL 66 -4.634 -0.353 9.274 556 HG23 VAL 66 HG23 VAL 66 -3.003 0.230 9.599 557 H GLU 67 HN GLU 67 -3.215 1.414 11.337 558 HA GLU 67 HA GLU 67 -5.808 1.950 12.438 559 HB2 GLU 67 HB2 GLU 67 -3.380 0.575 13.582 560 HB3 GLU 67 HB1 GLU 67 -4.914 0.724 14.432 561 HG2 GLU 67 HG2 GLU 67 -4.611 -0.593 11.746 562 HG3 GLU 67 HG1 GLU 67 -4.545 -1.459 13.282 563 H ASN 68 HN ASN 68 -2.473 2.833 13.327 564 HA ASN 68 HA ASN 68 -3.211 4.505 15.479 565 HB2 ASN 68 HB2 ASN 68 -0.718 4.248 13.818 566 HB3 ASN 68 HB1 ASN 68 -0.863 5.508 15.038 567 HD21 ASN 68 HD21 ASN 68 -1.209 2.014 14.600 568 HD22 ASN 68 HD22 ASN 68 -0.636 1.586 16.172 569 H ALA 69 HN ALA 69 -2.976 5.029 12.043 570 HA ALA 69 HA ALA 69 -2.971 7.881 12.149 571 HB1 ALA 69 HB1 ALA 69 -3.616 7.665 9.716 572 HB2 ALA 69 HB2 ALA 69 -3.554 5.919 9.946 573 HB3 ALA 69 HB3 ALA 69 -2.104 6.892 10.187 574 H LYS 70 HN LYS 70 -4.614 9.029 12.918 575 HA LYS 70 HA LYS 70 -7.213 8.102 13.332 576 HB2 LYS 70 HB2 LYS 70 -6.083 10.888 13.124 577 HB3 LYS 70 HB1 LYS 70 -7.774 10.587 13.502 578 HG2 LYS 70 HG2 LYS 70 -5.848 9.106 15.150 579 HG3 LYS 70 HG1 LYS 70 -5.817 10.859 15.343 580 HD2 LYS 70 HD2 LYS 70 -8.518 9.760 15.277 581 HD3 LYS 70 HD1 LYS 70 -7.544 9.124 16.604 582 HE2 LYS 70 HE2 LYS 70 -8.615 11.053 17.446 583 HE3 LYS 70 HE1 LYS 70 -6.942 11.517 17.142 584 HZ1 LYS 70 HZ1 LYS 70 -9.008 12.945 16.317 585 HZ2 LYS 70 HZ2 LYS 70 -8.825 11.947 14.964 586 HZ3 LYS 70 HZ3 LYS 70 -7.534 12.907 15.485 587 H LYS 71 HN LYS 71 -5.707 9.392 10.495 588 HA LYS 71 HA LYS 71 -8.267 9.146 9.075 589 HB2 LYS 71 HB2 LYS 71 -7.321 11.574 9.577 590 HB3 LYS 71 HB1 LYS 71 -6.324 11.219 8.174 591 HG2 LYS 71 HG2 LYS 71 -8.486 10.638 6.973 592 HG3 LYS 71 HG1 LYS 71 -9.313 11.402 8.333 593 HD2 LYS 71 HD2 LYS 71 -8.536 13.502 7.800 594 HD3 LYS 71 HD1 LYS 71 -7.111 12.878 6.968 595 HE2 LYS 71 HE2 LYS 71 -8.193 12.662 5.002 596 HE3 LYS 71 HE1 LYS 71 -9.694 12.144 5.768 597 HZ1 LYS 71 HZ1 LYS 71 -8.813 14.809 5.033 598 HZ2 LYS 71 HZ2 LYS 71 -9.605 14.693 6.523 599 HZ3 LYS 71 HZ3 LYS 71 -10.377 14.168 5.113 600 H ILE 72 HN ILE 72 -8.177 8.194 7.094 601 HA ILE 72 HA ILE 72 -5.518 7.345 6.151 602 HB ILE 72 HB ILE 72 -8.025 5.797 5.589 603 HG12 ILE 72 HG12 ILE 72 -7.841 5.994 8.038 604 HG13 ILE 72 HG11 ILE 72 -7.530 4.347 7.499 605 HG21 ILE 72 HG21 ILE 72 -6.655 4.160 4.808 606 HG22 ILE 72 HG22 ILE 72 -5.341 4.577 5.909 607 HG23 ILE 72 HG23 ILE 72 -5.636 5.561 4.475 608 HD11 ILE 72 HD11 ILE 72 -5.517 4.354 8.418 609 HD12 ILE 72 HD12 ILE 72 -5.949 5.888 9.173 610 HD13 ILE 72 HD13 ILE 72 -5.091 5.874 7.632 611 H GLU 73 HN GLU 73 -5.112 7.417 3.954 612 HA GLU 73 HA GLU 73 -7.213 8.643 2.286 613 HB2 GLU 73 HB2 GLU 73 -4.333 9.266 1.773 614 HB3 GLU 73 HB1 GLU 73 -5.763 10.206 1.380 615 HG2 GLU 73 HG2 GLU 73 -5.909 10.293 4.049 616 HG3 GLU 73 HG1 GLU 73 -4.165 10.127 3.857 617 H VAL 74 HN VAL 74 -7.437 7.872 0.225 618 HA VAL 74 HA VAL 74 -5.597 5.716 -0.571 619 HB VAL 74 HB VAL 74 -7.644 4.787 -1.822 620 HG11 VAL 74 HG11 VAL 74 -8.078 3.304 -0.078 621 HG12 VAL 74 HG12 VAL 74 -7.825 4.536 1.159 622 HG13 VAL 74 HG13 VAL 74 -6.450 3.889 0.263 623 HG21 VAL 74 HG21 VAL 74 -9.193 6.571 -1.556 624 HG22 VAL 74 HG22 VAL 74 -8.973 6.586 0.194 625 HG23 VAL 74 HG23 VAL 74 -9.785 5.225 -0.581 626 H GLU 75 HN GLU 75 -4.990 5.581 -2.687 627 HA GLU 75 HA GLU 75 -6.020 7.650 -4.513 628 HB2 GLU 75 HB2 GLU 75 -3.782 8.267 -3.588 629 HB3 GLU 75 HB1 GLU 75 -3.125 6.802 -4.305 630 HG2 GLU 75 HG2 GLU 75 -4.033 7.718 -6.521 631 HG3 GLU 75 HG1 GLU 75 -4.166 9.255 -5.667 632 H PHE 76 HN PHE 76 -7.170 6.478 -5.930 633 HA PHE 76 HA PHE 76 -6.461 3.829 -6.714 634 HB2 PHE 76 HB2 PHE 76 -8.535 5.775 -7.713 635 HB3 PHE 76 HB1 PHE 76 -8.325 4.172 -8.405 636 HD1 PHE 76 HD2 PHE 76 -8.080 2.321 -6.334 637 HD2 PHE 76 HD1 PHE 76 -10.339 5.933 -6.338 638 HE1 PHE 76 HE2 PHE 76 -9.566 1.396 -4.602 639 HE2 PHE 76 HE1 PHE 76 -11.826 5.010 -4.612 640 HZ PHE 76 HZ PHE 76 -11.441 2.738 -3.746 641 H ASP 77 HN ASP 77 -5.430 3.118 -8.458 642 HA ASP 77 HA ASP 77 -3.567 4.671 -9.802 643 HB2 ASP 77 HB2 ASP 77 -3.350 2.756 -11.351 644 HB3 ASP 77 HB1 ASP 77 -3.398 2.246 -9.667 645 H LYS 78 HN LYS 78 -3.658 4.301 -12.441 646 HA LYS 78 HA LYS 78 -5.900 6.003 -13.259 647 HB2 LYS 78 HB2 LYS 78 -4.283 6.098 -15.402 648 HB3 LYS 78 HB1 LYS 78 -4.123 7.185 -14.031 649 HG2 LYS 78 HG2 LYS 78 -2.638 4.682 -13.734 650 HG3 LYS 78 HG1 LYS 78 -2.119 5.675 -15.095 651 HD2 LYS 78 HD2 LYS 78 -2.542 7.345 -12.810 652 HD3 LYS 78 HD1 LYS 78 -1.495 5.997 -12.365 653 HE2 LYS 78 HE2 LYS 78 0.198 6.700 -13.690 654 HE3 LYS 78 HE1 LYS 78 -0.890 7.305 -14.937 655 HZ1 LYS 78 HZ1 LYS 78 -0.238 9.291 -14.167 656 HZ2 LYS 78 HZ2 LYS 78 0.273 8.683 -12.675 657 HZ3 LYS 78 HZ3 LYS 78 -1.365 9.016 -12.936 658 H GLY 79 HN GLY 79 -4.455 2.895 -13.763 659 HA2 GLY 79 HA2 GLY 79 -6.035 2.363 -16.153 660 HA3 GLY 79 HA1 GLY 79 -4.890 1.266 -15.394 661 H GLN 80 HN GLN 80 -5.661 -0.335 -14.144 662 HA GLN 80 HA GLN 80 -8.542 -0.499 -13.793 663 HB2 GLN 80 HB2 GLN 80 -6.366 -2.388 -14.012 664 HB3 GLN 80 HB1 GLN 80 -7.330 -2.723 -12.580 665 HG2 GLN 80 HG2 GLN 80 -9.352 -2.548 -14.147 666 HG3 GLN 80 HG1 GLN 80 -8.174 -2.713 -15.449 667 HE21 GLN 80 HE21 GLN 80 -6.565 -4.572 -15.007 668 HE22 GLN 80 HE22 GLN 80 -7.283 -6.066 -14.519 669 H ARG 81 HN ARG 81 -9.465 0.289 -12.038 670 HA ARG 81 HA ARG 81 -7.870 0.578 -9.601 671 HB2 ARG 81 HB2 ARG 81 -10.476 1.871 -10.403 672 HB3 ARG 81 HB1 ARG 81 -9.637 2.158 -8.885 673 HG2 ARG 81 HG2 ARG 81 -7.799 3.180 -9.998 674 HG3 ARG 81 HG1 ARG 81 -8.405 2.682 -11.579 675 HD2 ARG 81 HD2 ARG 81 -9.782 4.602 -9.703 676 HD3 ARG 81 HD1 ARG 81 -8.836 5.060 -11.118 677 HE ARG 81 HE ARG 81 -10.926 3.243 -11.785 678 HH11 ARG 81 HH11 ARG 81 -10.262 6.595 -11.075 679 HH12 ARG 81 HH12 ARG 81 -11.617 7.184 -11.980 680 HH21 ARG 81 HH21 ARG 81 -12.707 4.017 -12.976 681 HH22 ARG 81 HH22 ARG 81 -13.005 5.722 -13.057 682 H THR 82 HN THR 82 -9.824 -1.689 -10.838 683 HA THR 82 HA THR 82 -10.361 -2.857 -8.297 684 HB THR 82 HB THR 82 -12.922 -3.043 -9.035 685 HG1 THR 82 HG1 THR 82 -12.439 -1.573 -10.839 686 HG21 THR 82 HG21 THR 82 -11.869 -2.075 -6.897 687 HG22 THR 82 HG22 THR 82 -13.497 -1.576 -7.355 688 HG23 THR 82 HG23 THR 82 -12.127 -0.512 -7.673 689 H ASP 83 HN ASP 83 -9.719 -4.844 -8.721 690 HA ASP 83 HA ASP 83 -9.859 -6.010 -11.323 691 HB2 ASP 83 HB2 ASP 83 -8.375 -6.479 -9.036 692 HB3 ASP 83 HB1 ASP 83 -9.428 -7.888 -9.122 693 H LYS 84 HN LYS 84 -10.572 -8.601 -10.966 694 HA LYS 84 HA LYS 84 -13.249 -8.715 -11.460 695 HB2 LYS 84 HB2 LYS 84 -12.894 -11.112 -10.178 696 HB3 LYS 84 HB1 LYS 84 -12.542 -10.803 -11.874 697 HG2 LYS 84 HG2 LYS 84 -10.409 -10.206 -9.901 698 HG3 LYS 84 HG1 LYS 84 -10.785 -11.900 -10.216 699 HD2 LYS 84 HD2 LYS 84 -10.233 -9.912 -12.409 700 HD3 LYS 84 HD1 LYS 84 -8.968 -10.881 -11.651 701 HE2 LYS 84 HE2 LYS 84 -11.028 -12.670 -12.315 702 HE3 LYS 84 HE1 LYS 84 -10.837 -11.608 -13.709 703 HZ1 LYS 84 HZ1 LYS 84 -9.015 -13.590 -12.624 704 HZ2 LYS 84 HZ2 LYS 84 -8.295 -12.150 -13.146 705 HZ3 LYS 84 HZ3 LYS 84 -9.224 -13.068 -14.220 706 H TYR 85 HN TYR 85 -11.807 -9.519 -8.300 707 HA TYR 85 HA TYR 85 -14.312 -9.696 -6.998 708 HB2 TYR 85 HB2 TYR 85 -11.461 -9.772 -6.185 709 HB3 TYR 85 HB1 TYR 85 -12.624 -9.351 -4.932 710 HD1 TYR 85 HD1 TYR 85 -13.194 -11.694 -7.747 711 HD2 TYR 85 HD2 TYR 85 -12.497 -11.275 -3.572 712 HE1 TYR 85 HE1 TYR 85 -13.706 -14.079 -7.429 713 HE2 TYR 85 HE2 TYR 85 -13.006 -13.658 -3.241 714 HH TYR 85 HH TYR 85 -12.926 -15.780 -4.714 715 H GLY 86 HN GLY 86 -12.759 -7.025 -8.163 716 HA2 GLY 86 HA2 GLY 86 -13.299 -4.790 -7.924 717 HA3 GLY 86 HA1 GLY 86 -14.437 -5.240 -6.662 718 H ARG 87 HN ARG 87 -11.154 -6.318 -6.465 719 HA ARG 87 HA ARG 87 -10.708 -5.336 -3.906 720 HB2 ARG 87 HB2 ARG 87 -9.358 -7.006 -5.512 721 HB3 ARG 87 HB1 ARG 87 -8.353 -5.576 -5.701 722 HG2 ARG 87 HG2 ARG 87 -7.320 -6.107 -3.821 723 HG3 ARG 87 HG1 ARG 87 -8.828 -5.821 -2.950 724 HD2 ARG 87 HD2 ARG 87 -7.770 -8.077 -2.584 725 HD3 ARG 87 HD1 ARG 87 -9.454 -8.101 -3.103 726 HE ARG 87 HE ARG 87 -8.807 -9.146 -5.032 727 HH11 ARG 87 HH11 ARG 87 -5.991 -7.761 -3.505 728 HH12 ARG 87 HH12 ARG 87 -4.877 -8.511 -4.597 729 HH21 ARG 87 HH21 ARG 87 -7.341 -10.134 -6.470 730 HH22 ARG 87 HH22 ARG 87 -5.642 -9.858 -6.280 731 H GLY 88 HN GLY 88 -9.237 -3.664 -3.155 732 HA2 GLY 88 HA2 GLY 88 -9.632 -1.214 -4.664 733 HA3 GLY 88 HA1 GLY 88 -9.027 -1.333 -3.023 734 H LEU 89 HN LEU 89 -8.247 -0.978 -6.307 735 HA LEU 89 HA LEU 89 -5.440 -1.626 -5.996 736 HB2 LEU 89 HB2 LEU 89 -7.032 -0.516 -8.294 737 HB3 LEU 89 HB1 LEU 89 -5.316 -0.865 -8.371 738 HG LEU 89 HG LEU 89 -6.812 -2.609 -9.365 739 HD11 LEU 89 HD11 LEU 89 -4.452 -2.937 -8.388 740 HD12 LEU 89 HD12 LEU 89 -5.432 -4.359 -8.741 741 HD13 LEU 89 HD13 LEU 89 -5.284 -3.781 -7.082 742 HD21 LEU 89 HD21 LEU 89 -8.551 -2.403 -7.562 743 HD22 LEU 89 HD22 LEU 89 -7.462 -3.324 -6.524 744 HD23 LEU 89 HD23 LEU 89 -8.094 -4.050 -8.001 745 H ALA 90 HN ALA 90 -5.424 0.068 -4.194 746 HA ALA 90 HA ALA 90 -4.378 2.544 -5.323 747 HB1 ALA 90 HB1 ALA 90 -6.354 3.555 -4.916 748 HB2 ALA 90 HB2 ALA 90 -5.748 3.617 -3.264 749 HB3 ALA 90 HB3 ALA 90 -6.861 2.337 -3.748 750 H TYR 91 HN TYR 91 -3.583 3.972 -3.402 751 HA TYR 91 HA TYR 91 -2.001 2.219 -1.665 752 HB2 TYR 91 HB2 TYR 91 -1.495 5.155 -2.073 753 HB3 TYR 91 HB1 TYR 91 -0.366 3.913 -1.556 754 HD1 TYR 91 HD2 TYR 91 -2.389 4.983 -4.499 755 HD2 TYR 91 HD1 TYR 91 1.074 2.946 -3.103 756 HE1 TYR 91 HE2 TYR 91 -1.603 4.747 -6.816 757 HE2 TYR 91 HE1 TYR 91 1.873 2.709 -5.415 758 HH TYR 91 HH TYR 91 -0.117 3.381 -8.126 759 H ILE 92 HN ILE 92 -2.204 2.289 0.514 760 HA ILE 92 HA ILE 92 -4.336 3.976 1.604 761 HB ILE 92 HB ILE 92 -2.812 1.727 2.928 762 HG12 ILE 92 HG12 ILE 92 -5.335 0.799 2.592 763 HG13 ILE 92 HG11 ILE 92 -5.180 1.803 1.155 764 HG21 ILE 92 HG21 ILE 92 -3.753 3.307 4.527 765 HG22 ILE 92 HG22 ILE 92 -4.622 1.772 4.576 766 HG23 ILE 92 HG23 ILE 92 -5.331 3.161 3.754 767 HD11 ILE 92 HD11 ILE 92 -3.276 -0.387 1.942 768 HD12 ILE 92 HD12 ILE 92 -3.232 0.566 0.458 769 HD13 ILE 92 HD13 ILE 92 -4.574 -0.539 0.758 770 H TYR 93 HN TYR 93 -3.902 5.805 2.630 771 HA TYR 93 HA TYR 93 -1.161 6.326 3.516 772 HB2 TYR 93 HB2 TYR 93 -3.489 8.229 3.202 773 HB3 TYR 93 HB1 TYR 93 -1.857 8.685 3.656 774 HD1 TYR 93 HD2 TYR 93 -2.757 6.257 0.988 775 HD2 TYR 93 HD1 TYR 93 -1.349 10.162 1.905 776 HE1 TYR 93 HE2 TYR 93 -2.233 6.613 -1.378 777 HE2 TYR 93 HE1 TYR 93 -0.807 10.526 -0.464 778 HH TYR 93 HH TYR 93 -1.859 9.345 -2.794 779 H ALA 94 HN ALA 94 -0.832 7.474 5.548 780 HA ALA 94 HA ALA 94 -2.926 7.144 7.554 781 HB1 ALA 94 HB1 ALA 94 -0.674 6.287 8.915 782 HB2 ALA 94 HB2 ALA 94 -0.562 5.470 7.357 783 HB3 ALA 94 HB3 ALA 94 -2.004 5.274 8.351 784 H ASP 95 HN ASP 95 -3.119 9.091 8.441 785 HA ASP 95 HA ASP 95 -2.622 11.068 9.446 786 HB2 ASP 95 HB2 ASP 95 -0.321 9.373 10.045 787 HB3 ASP 95 HB1 ASP 95 0.092 11.084 10.007 788 H GLY 96 HN GLY 96 -1.893 10.369 6.476 789 HA2 GLY 96 HA2 GLY 96 -1.675 12.164 4.877 790 HA3 GLY 96 HA1 GLY 96 -0.578 12.959 5.991 791 H LYS 97 HN LYS 97 -0.041 9.613 5.755 792 HA LYS 97 HA LYS 97 2.018 10.018 3.703 793 HB2 LYS 97 HB2 LYS 97 2.343 9.094 6.503 794 HB3 LYS 97 HB1 LYS 97 3.278 8.250 5.278 795 HG2 LYS 97 HG2 LYS 97 4.233 10.382 4.547 796 HG3 LYS 97 HG1 LYS 97 3.309 11.213 5.801 797 HD2 LYS 97 HD2 LYS 97 5.163 8.962 6.495 798 HD3 LYS 97 HD1 LYS 97 5.779 10.600 6.267 799 HE2 LYS 97 HE2 LYS 97 4.858 11.355 8.185 800 HE3 LYS 97 HE1 LYS 97 3.411 10.366 8.000 801 HZ1 LYS 97 HZ1 LYS 97 4.851 8.425 8.631 802 HZ2 LYS 97 HZ2 LYS 97 4.558 9.542 9.867 803 HZ3 LYS 97 HZ3 LYS 97 6.047 9.540 9.068 804 H MET 98 HN MET 98 2.108 8.456 2.194 805 HA MET 98 HA MET 98 0.123 6.435 2.131 806 HB2 MET 98 HB2 MET 98 2.534 6.203 0.392 807 HB3 MET 98 HB1 MET 98 0.837 5.947 0.003 808 HG2 MET 98 HG2 MET 98 0.917 7.909 -1.022 809 HG3 MET 98 HG1 MET 98 0.936 8.630 0.586 810 HE1 MET 98 HE1 MET 98 2.024 10.513 0.640 811 HE2 MET 98 HE2 MET 98 3.673 10.906 0.150 812 HE3 MET 98 HE3 MET 98 3.390 9.915 1.581 813 H VAL 99 HN VAL 99 0.116 4.706 3.366 814 HA VAL 99 HA VAL 99 2.288 3.682 4.793 815 HB VAL 99 HB VAL 99 -0.087 2.018 3.978 816 HG11 VAL 99 HG11 VAL 99 0.289 0.814 5.954 817 HG12 VAL 99 HG12 VAL 99 1.340 2.065 6.619 818 HG13 VAL 99 HG13 VAL 99 1.895 1.069 5.273 819 HG21 VAL 99 HG21 VAL 99 -0.559 3.264 6.482 820 HG22 VAL 99 HG22 VAL 99 -1.485 3.418 4.989 821 HG23 VAL 99 HG23 VAL 99 -0.157 4.529 5.320 822 H ASN 100 HN ASN 100 1.105 2.947 1.583 823 HA ASN 100 HA ASN 100 2.394 0.502 1.141 824 HB2 ASN 100 HB2 ASN 100 2.050 2.614 -0.985 825 HB3 ASN 100 HB1 ASN 100 2.016 0.862 -1.171 826 HD21 ASN 100 HD21 ASN 100 0.084 -0.026 -1.319 827 HD22 ASN 100 HD22 ASN 100 -1.399 0.658 -0.765 828 H GLU 101 HN GLU 101 3.487 3.768 0.197 829 HA GLU 101 HA GLU 101 6.021 3.037 -0.700 830 HB2 GLU 101 HB2 GLU 101 4.605 5.397 -0.472 831 HB3 GLU 101 HB1 GLU 101 5.956 5.644 0.625 832 HG2 GLU 101 HG2 GLU 101 7.057 4.535 -1.695 833 HG3 GLU 101 HG1 GLU 101 5.888 5.736 -2.241 834 H ALA 102 HN ALA 102 4.827 3.621 2.536 835 HA ALA 102 HA ALA 102 7.283 3.898 3.867 836 HB1 ALA 102 HB1 ALA 102 5.405 4.496 5.114 837 HB2 ALA 102 HB2 ALA 102 5.936 2.988 5.858 838 HB3 ALA 102 HB3 ALA 102 4.565 2.989 4.749 839 H LEU 103 HN LEU 103 5.237 1.001 3.490 840 HA LEU 103 HA LEU 103 7.037 -0.814 4.643 841 HB2 LEU 103 HB2 LEU 103 4.738 -1.077 2.742 842 HB3 LEU 103 HB1 LEU 103 5.746 -2.470 3.081 843 HG LEU 103 HG LEU 103 5.186 -1.636 5.603 844 HD11 LEU 103 HD11 LEU 103 3.081 -0.593 3.810 845 HD12 LEU 103 HD12 LEU 103 3.615 -0.022 5.391 846 HD13 LEU 103 HD13 LEU 103 2.541 -1.416 5.274 847 HD21 LEU 103 HD21 LEU 103 4.000 -3.591 5.788 848 HD22 LEU 103 HD22 LEU 103 4.887 -3.888 4.293 849 HD23 LEU 103 HD23 LEU 103 3.199 -3.380 4.231 850 H VAL 104 HN VAL 104 6.568 0.252 1.321 851 HA VAL 104 HA VAL 104 8.327 -1.487 0.031 852 HB VAL 104 HB VAL 104 7.772 1.391 -0.707 853 HG11 VAL 104 HG11 VAL 104 9.266 -0.749 -1.977 854 HG12 VAL 104 HG12 VAL 104 9.214 0.976 -2.353 855 HG13 VAL 104 HG13 VAL 104 7.991 -0.110 -3.015 856 HG21 VAL 104 HG21 VAL 104 6.261 -0.692 -2.092 857 HG22 VAL 104 HG22 VAL 104 5.720 0.845 -1.416 858 HG23 VAL 104 HG23 VAL 104 5.886 -0.567 -0.374 859 H ARG 105 HN ARG 105 8.890 1.694 1.482 860 HA ARG 105 HA ARG 105 11.684 1.690 0.831 861 HB2 ARG 105 HB2 ARG 105 10.521 3.797 0.948 862 HB3 ARG 105 HB1 ARG 105 10.024 3.483 2.603 863 HG2 ARG 105 HG2 ARG 105 12.930 3.582 1.924 864 HG3 ARG 105 HG1 ARG 105 12.019 5.080 2.105 865 HD2 ARG 105 HD2 ARG 105 12.625 2.974 4.147 866 HD3 ARG 105 HD1 ARG 105 12.880 4.714 4.233 867 HE ARG 105 HE ARG 105 10.528 3.290 4.982 868 HH11 ARG 105 HH11 ARG 105 11.679 6.323 3.691 869 HH12 ARG 105 HH12 ARG 105 10.311 7.225 4.247 870 HH21 ARG 105 HH21 ARG 105 8.718 4.481 5.709 871 HH22 ARG 105 HH22 ARG 105 8.630 6.180 5.391 872 H GLN 106 HN GLN 106 9.775 1.144 3.793 873 HA GLN 106 HA GLN 106 11.859 0.992 5.611 874 HB2 GLN 106 HB2 GLN 106 9.119 0.443 5.665 875 HB3 GLN 106 HB1 GLN 106 9.887 -1.047 6.173 876 HG2 GLN 106 HG2 GLN 106 10.141 -0.202 8.197 877 HG3 GLN 106 HG1 GLN 106 11.208 1.028 7.526 878 HE21 GLN 106 HE21 GLN 106 9.201 2.327 5.959 879 HE22 GLN 106 HE22 GLN 106 8.175 3.167 7.059 880 H GLY 107 HN GLY 107 10.446 -1.693 3.732 881 HA2 GLY 107 HA2 GLY 107 12.309 -3.104 2.722 882 HA3 GLY 107 HA1 GLY 107 12.853 -3.277 4.380 883 H LEU 108 HN LEU 108 9.549 -3.216 4.517 884 HA LEU 108 HA LEU 108 9.466 -6.137 4.629 885 HB2 LEU 108 HB2 LEU 108 6.992 -4.916 5.433 886 HB3 LEU 108 HB1 LEU 108 8.092 -5.912 6.362 887 HG LEU 108 HG LEU 108 9.394 -3.522 6.439 888 HD11 LEU 108 HD11 LEU 108 8.022 -1.716 6.435 889 HD12 LEU 108 HD12 LEU 108 6.616 -2.642 6.962 890 HD13 LEU 108 HD13 LEU 108 7.138 -2.712 5.278 891 HD21 LEU 108 HD21 LEU 108 7.245 -4.480 8.323 892 HD22 LEU 108 HD22 LEU 108 8.513 -3.316 8.706 893 HD23 LEU 108 HD23 LEU 108 8.933 -4.987 8.332 894 H ALA 109 HN ALA 109 9.331 -4.365 2.158 895 HA ALA 109 HA ALA 109 7.546 -5.946 0.672 896 HB1 ALA 109 HB1 ALA 109 6.548 -3.146 1.194 897 HB2 ALA 109 HB2 ALA 109 5.848 -4.618 1.868 898 HB3 ALA 109 HB3 ALA 109 5.813 -4.342 0.126 899 H LYS 110 HN LYS 110 7.575 -5.419 -1.590 900 HA LYS 110 HA LYS 110 9.469 -3.309 -2.348 901 HB2 LYS 110 HB2 LYS 110 10.579 -4.791 -3.930 902 HB3 LYS 110 HB1 LYS 110 10.700 -5.436 -2.299 903 HG2 LYS 110 HG2 LYS 110 9.134 -7.127 -2.734 904 HG3 LYS 110 HG1 LYS 110 8.573 -6.341 -4.211 905 HD2 LYS 110 HD2 LYS 110 9.920 -7.896 -5.168 906 HD3 LYS 110 HD1 LYS 110 11.145 -6.664 -4.858 907 HE2 LYS 110 HE2 LYS 110 11.292 -7.911 -2.531 908 HE3 LYS 110 HE1 LYS 110 10.654 -9.254 -3.480 909 HZ1 LYS 110 HZ1 LYS 110 12.584 -8.480 -5.087 910 HZ2 LYS 110 HZ2 LYS 110 12.854 -9.574 -3.826 911 HZ3 LYS 110 HZ3 LYS 110 13.257 -7.944 -3.630 912 H VAL 111 HN VAL 111 9.417 -2.875 -4.735 913 HA VAL 111 HA VAL 111 6.705 -2.474 -5.540 914 HB VAL 111 HB VAL 111 9.352 -1.864 -6.841 915 HG11 VAL 111 HG11 VAL 111 6.598 -1.348 -7.951 916 HG12 VAL 111 HG12 VAL 111 7.864 -2.346 -8.667 917 HG13 VAL 111 HG13 VAL 111 8.078 -0.600 -8.551 918 HG21 VAL 111 HG21 VAL 111 7.165 -0.070 -5.801 919 HG22 VAL 111 HG22 VAL 111 8.738 0.436 -6.417 920 HG23 VAL 111 HG23 VAL 111 8.634 -0.494 -4.922 921 H ALA 112 HN ALA 112 5.558 -4.172 -6.219 922 HA ALA 112 HA ALA 112 6.562 -5.695 -8.500 923 HB1 ALA 112 HB1 ALA 112 7.142 -7.335 -7.042 924 HB2 ALA 112 HB2 ALA 112 5.433 -7.740 -7.213 925 HB3 ALA 112 HB3 ALA 112 5.984 -6.812 -5.819 926 H TYR 113 HN TYR 113 4.786 -7.103 -9.429 927 HA TYR 113 HA TYR 113 2.731 -7.284 -10.384 928 HB2 TYR 113 HB2 TYR 113 1.808 -6.065 -7.774 929 HB3 TYR 113 HB1 TYR 113 0.760 -6.832 -8.962 930 HD1 TYR 113 HD1 TYR 113 0.959 -9.283 -9.376 931 HD2 TYR 113 HD2 TYR 113 3.058 -7.355 -6.217 932 HE1 TYR 113 HE1 TYR 113 1.329 -11.462 -8.300 933 HE2 TYR 113 HE2 TYR 113 3.436 -9.530 -5.134 934 HH TYR 113 HH TYR 113 1.788 -12.330 -6.004 935 H VAL 114 HN VAL 114 4.241 -5.054 -11.099 936 HA VAL 114 HA VAL 114 2.367 -2.813 -11.193 937 HB VAL 114 HB VAL 114 4.687 -2.289 -10.629 938 HG11 VAL 114 HG11 VAL 114 6.459 -3.134 -11.678 939 HG12 VAL 114 HG12 VAL 114 5.836 -2.677 -13.264 940 HG13 VAL 114 HG13 VAL 114 5.336 -4.198 -12.524 941 HG21 VAL 114 HG21 VAL 114 4.974 -0.874 -12.999 942 HG22 VAL 114 HG22 VAL 114 4.112 -0.344 -11.554 943 HG23 VAL 114 HG23 VAL 114 3.236 -1.141 -12.860 944 H TYR 115 HN TYR 115 0.837 -3.180 -12.701 945 HA TYR 115 HA TYR 115 1.717 -4.016 -15.382 946 HB2 TYR 115 HB2 TYR 115 -0.864 -4.418 -15.628 947 HB3 TYR 115 HB1 TYR 115 0.137 -5.596 -14.791 948 HD1 TYR 115 HD2 TYR 115 -1.555 -2.408 -13.839 949 HD2 TYR 115 HD1 TYR 115 -0.907 -6.513 -12.956 950 HE1 TYR 115 HE2 TYR 115 -2.992 -2.197 -11.855 951 HE2 TYR 115 HE1 TYR 115 -2.343 -6.320 -10.968 952 HH TYR 115 HH TYR 115 -4.311 -3.574 -10.385 953 H LYS 116 HN LYS 116 0.718 -3.007 -17.223 954 HA LYS 116 HA LYS 116 0.108 -0.184 -16.710 955 HB2 LYS 116 HB2 LYS 116 0.911 -1.509 -19.304 956 HB3 LYS 116 HB1 LYS 116 0.769 0.219 -19.014 957 HG2 LYS 116 HG2 LYS 116 2.768 -1.652 -17.767 958 HG3 LYS 116 HG1 LYS 116 3.088 -0.424 -18.994 959 HD2 LYS 116 HD2 LYS 116 2.013 0.164 -16.238 960 HD3 LYS 116 HD1 LYS 116 3.719 0.257 -16.680 961 HE2 LYS 116 HE2 LYS 116 1.475 1.861 -17.903 962 HE3 LYS 116 HE1 LYS 116 2.666 2.459 -16.749 963 HZ1 LYS 116 HZ1 LYS 116 3.316 3.094 -18.947 964 HZ2 LYS 116 HZ2 LYS 116 3.196 1.502 -19.509 965 HZ3 LYS 116 HZ3 LYS 116 4.402 1.918 -18.396 966 HA PRO 117 HA PRO 117 -0.463 1.413 -18.111 967 HB2 PRO 117 HB2 PRO 117 -2.375 3.230 -18.452 968 HB3 PRO 117 HB1 PRO 117 -1.831 2.229 -19.804 969 HG2 PRO 117 HG2 PRO 117 -4.301 1.998 -18.147 970 HG3 PRO 117 HG1 PRO 117 -4.083 1.715 -19.881 971 HD2 PRO 117 HD2 PRO 117 -4.141 -0.252 -17.887 972 HD3 PRO 117 HD1 PRO 117 -3.552 -0.467 -19.546 973 H ASN 118 HN ASN 118 0.204 1.596 -16.022 974 HA ASN 118 HA ASN 118 -1.469 3.071 -14.191 975 HB2 ASN 118 HB2 ASN 118 -0.440 0.363 -13.326 976 HB3 ASN 118 HB1 ASN 118 -1.425 1.475 -12.383 977 HD21 ASN 118 HD21 ASN 118 -1.397 -0.652 -15.170 978 HD22 ASN 118 HD22 ASN 118 -3.104 -0.909 -15.228 979 H ASN 119 HN ASN 119 -0.255 4.398 -12.968 980 HA ASN 119 HA ASN 119 2.271 3.788 -11.912 981 HB2 ASN 119 HB2 ASN 119 3.623 5.391 -13.339 982 HB3 ASN 119 HB1 ASN 119 3.181 3.870 -14.109 983 HD21 ASN 119 HD21 ASN 119 1.655 3.863 -15.752 984 HD22 ASN 119 HD22 ASN 119 1.178 5.308 -16.571 985 H THR 120 HN THR 120 -0.160 5.011 -11.080 986 HA THR 120 HA THR 120 -0.173 7.774 -10.959 987 HB THR 120 HB THR 120 -1.195 7.261 -8.558 988 HG1 THR 120 HG1 THR 120 -1.584 4.763 -9.798 989 HG21 THR 120 HG21 THR 120 -3.299 7.116 -9.474 990 HG22 THR 120 HG22 THR 120 -2.753 6.146 -10.842 991 HG23 THR 120 HG23 THR 120 -2.377 7.867 -10.777 992 H HIS 121 HN HIS 121 1.405 5.494 -8.734 993 HA HIS 121 HA HIS 121 3.106 7.719 -7.817 994 HB2 HIS 121 HB2 HIS 121 1.483 5.843 -6.283 995 HB3 HIS 121 HB1 HIS 121 3.167 5.843 -5.771 996 HD1 HIS 121 HD1 HIS 121 1.099 6.889 -3.834 997 HD2 HIS 121 HD2 HIS 121 3.055 9.310 -6.588 998 HE1 HIS 121 HE1 HIS 121 0.960 9.218 -2.899 999 HE2 HIS 121 HE2 HIS 121 2.229 10.652 -4.537 1000 H GLU 122 HN GLU 122 3.417 5.589 -9.942 1001 HA GLU 122 HA GLU 122 5.257 3.645 -9.148 1002 HB2 GLU 122 HB2 GLU 122 4.136 3.596 -11.318 1003 HB3 GLU 122 HB1 GLU 122 5.002 5.041 -11.817 1004 HG2 GLU 122 HG2 GLU 122 6.806 3.885 -12.411 1005 HG3 GLU 122 HG1 GLU 122 6.778 2.918 -10.936 1006 H GLN 123 HN GLN 123 5.828 6.894 -10.476 1007 HA GLN 123 HA GLN 123 8.623 6.804 -10.451 1008 HB2 GLN 123 HB2 GLN 123 6.765 9.166 -10.132 1009 HB3 GLN 123 HB1 GLN 123 8.493 9.292 -10.433 1010 HG2 GLN 123 HG2 GLN 123 6.695 7.775 -12.285 1011 HG3 GLN 123 HG1 GLN 123 6.892 9.521 -12.414 1012 HE21 GLN 123 HE21 GLN 123 8.634 6.462 -12.433 1013 HE22 GLN 123 HE22 GLN 123 9.940 7.001 -13.428 1014 H LEU 124 HN LEU 124 6.352 7.183 -7.875 1015 HA LEU 124 HA LEU 124 8.248 8.332 -6.028 1016 HB2 LEU 124 HB2 LEU 124 5.834 8.827 -5.900 1017 HB3 LEU 124 HB1 LEU 124 5.518 7.142 -5.529 1018 HG LEU 124 HG LEU 124 7.183 7.615 -3.530 1019 HD11 LEU 124 HD11 LEU 124 7.552 9.967 -4.429 1020 HD12 LEU 124 HD12 LEU 124 7.181 9.813 -2.712 1021 HD13 LEU 124 HD13 LEU 124 5.927 10.324 -3.844 1022 HD21 LEU 124 HD21 LEU 124 4.454 8.772 -3.209 1023 HD22 LEU 124 HD22 LEU 124 5.344 7.679 -2.152 1024 HD23 LEU 124 HD23 LEU 124 4.626 7.071 -3.643 1025 H LEU 125 HN LEU 125 6.702 5.168 -6.492 1026 HA LEU 125 HA LEU 125 8.166 3.964 -4.328 1027 HB2 LEU 125 HB2 LEU 125 6.375 2.852 -6.477 1028 HB3 LEU 125 HB1 LEU 125 7.188 1.833 -5.307 1029 HG LEU 125 HG LEU 125 5.983 3.558 -3.627 1030 HD11 LEU 125 HD11 LEU 125 4.394 3.548 -6.158 1031 HD12 LEU 125 HD12 LEU 125 4.774 4.891 -5.081 1032 HD13 LEU 125 HD13 LEU 125 3.589 3.678 -4.595 1033 HD21 LEU 125 HD21 LEU 125 5.841 0.920 -4.134 1034 HD22 LEU 125 HD22 LEU 125 4.213 1.411 -4.599 1035 HD23 LEU 125 HD23 LEU 125 4.804 1.748 -2.972 1036 H ARG 126 HN ARG 126 8.566 4.292 -7.779 1037 HA ARG 126 HA ARG 126 10.326 2.228 -8.336 1038 HB2 ARG 126 HB2 ARG 126 9.699 4.846 -9.510 1039 HB3 ARG 126 HB1 ARG 126 11.331 4.288 -9.849 1040 HG2 ARG 126 HG2 ARG 126 9.976 2.046 -10.405 1041 HG3 ARG 126 HG1 ARG 126 8.737 3.244 -10.782 1042 HD2 ARG 126 HD2 ARG 126 10.850 4.372 -11.999 1043 HD3 ARG 126 HD1 ARG 126 11.307 2.674 -12.126 1044 HE ARG 126 HE ARG 126 8.604 3.195 -12.941 1045 HH11 ARG 126 HH11 ARG 126 11.937 3.157 -13.973 1046 HH12 ARG 126 HH12 ARG 126 11.547 2.943 -15.647 1047 HH21 ARG 126 HH21 ARG 126 8.088 2.914 -15.141 1048 HH22 ARG 126 HH22 ARG 126 9.361 2.807 -16.311 1049 H LYS 127 HN LYS 127 10.896 5.289 -6.734 1050 HA LYS 127 HA LYS 127 13.758 4.975 -6.680 1051 HB2 LYS 127 HB2 LYS 127 12.207 6.860 -4.927 1052 HB3 LYS 127 HB1 LYS 127 13.831 7.045 -5.573 1053 HG2 LYS 127 HG2 LYS 127 11.259 7.198 -7.127 1054 HG3 LYS 127 HG1 LYS 127 12.311 8.546 -6.691 1055 HD2 LYS 127 HD2 LYS 127 14.135 7.417 -7.997 1056 HD3 LYS 127 HD1 LYS 127 12.922 6.269 -8.568 1057 HE2 LYS 127 HE2 LYS 127 12.700 7.738 -10.262 1058 HE3 LYS 127 HE1 LYS 127 11.679 8.601 -9.113 1059 HZ1 LYS 127 HZ1 LYS 127 13.251 10.109 -10.082 1060 HZ2 LYS 127 HZ2 LYS 127 14.552 9.117 -9.656 1061 HZ3 LYS 127 HZ3 LYS 127 13.650 9.892 -8.452 1062 H SER 128 HN SER 128 11.179 4.934 -4.220 1063 HA SER 128 HA SER 128 12.700 4.261 -2.014 1064 HB2 SER 128 HB2 SER 128 10.507 4.819 -1.501 1065 HB3 SER 128 HB1 SER 128 9.840 3.795 -2.772 1066 HG SER 128 HG SER 128 9.517 2.919 -0.674 1067 H GLU 129 HN GLU 129 11.437 2.187 -4.556 1068 HA GLU 129 HA GLU 129 11.903 -0.295 -3.333 1069 HB2 GLU 129 HB2 GLU 129 10.542 -0.084 -5.345 1070 HB3 GLU 129 HB1 GLU 129 11.941 0.453 -6.264 1071 HG2 GLU 129 HG2 GLU 129 12.931 -1.853 -5.509 1072 HG3 GLU 129 HG1 GLU 129 11.231 -2.270 -5.298 1073 H ALA 130 HN ALA 130 13.938 1.484 -5.657 1074 HA ALA 130 HA ALA 130 16.126 -0.322 -5.338 1075 HB1 ALA 130 HB1 ALA 130 16.716 2.276 -6.542 1076 HB2 ALA 130 HB2 ALA 130 15.380 1.405 -7.293 1077 HB3 ALA 130 HB3 ALA 130 16.968 0.647 -7.169 1078 H GLN 131 HN GLN 131 15.246 2.770 -3.952 1079 HA GLN 131 HA GLN 131 17.748 3.566 -3.004 1080 HB2 GLN 131 HB2 GLN 131 14.982 4.321 -2.562 1081 HB3 GLN 131 HB1 GLN 131 15.921 4.433 -1.081 1082 HG2 GLN 131 HG2 GLN 131 16.664 6.396 -1.764 1083 HG3 GLN 131 HG1 GLN 131 17.519 5.572 -3.067 1084 HE21 GLN 131 HE21 GLN 131 17.265 6.910 -4.734 1085 HE22 GLN 131 HE22 GLN 131 15.747 7.445 -5.358 1086 H ALA 132 HN ALA 132 15.201 1.734 -1.331 1087 HA ALA 132 HA ALA 132 16.826 1.268 0.977 1088 HB1 ALA 132 HB1 ALA 132 14.508 1.335 1.365 1089 HB2 ALA 132 HB2 ALA 132 14.964 -0.358 1.556 1090 HB3 ALA 132 HB3 ALA 132 14.176 0.181 0.073 1091 H LYS 133 HN LYS 133 16.374 -0.331 -2.056 1092 HA LYS 133 HA LYS 133 17.140 -2.943 -1.328 1093 HB2 LYS 133 HB2 LYS 133 16.410 -1.593 -3.686 1094 HB3 LYS 133 HB1 LYS 133 18.000 -2.274 -3.999 1095 HG2 LYS 133 HG2 LYS 133 17.199 -4.345 -4.140 1096 HG3 LYS 133 HG1 LYS 133 16.221 -4.157 -2.684 1097 HD2 LYS 133 HD2 LYS 133 14.559 -2.897 -4.029 1098 HD3 LYS 133 HD1 LYS 133 15.514 -3.245 -5.470 1099 HE2 LYS 133 HE2 LYS 133 14.887 -5.424 -5.527 1100 HE3 LYS 133 HE1 LYS 133 14.771 -5.550 -3.773 1101 HZ1 LYS 133 HZ1 LYS 133 12.582 -5.491 -4.116 1102 HZ2 LYS 133 HZ2 LYS 133 12.736 -4.918 -5.699 1103 HZ3 LYS 133 HZ3 LYS 133 12.772 -3.833 -4.402 1104 H LYS 134 HN LYS 134 19.049 -0.303 -2.771 1105 HA LYS 134 HA LYS 134 21.507 -1.595 -2.837 1106 HB2 LYS 134 HB2 LYS 134 22.447 0.483 -3.299 1107 HB3 LYS 134 HB1 LYS 134 20.777 0.688 -3.806 1108 HG2 LYS 134 HG2 LYS 134 20.299 1.776 -1.631 1109 HG3 LYS 134 HG1 LYS 134 22.019 1.676 -1.251 1110 HD2 LYS 134 HD2 LYS 134 21.064 2.978 -3.778 1111 HD3 LYS 134 HD1 LYS 134 21.103 3.867 -2.254 1112 HE2 LYS 134 HE2 LYS 134 23.444 3.621 -2.058 1113 HE3 LYS 134 HE1 LYS 134 23.495 2.398 -3.328 1114 HZ1 LYS 134 HZ1 LYS 134 22.458 4.447 -4.663 1115 HZ2 LYS 134 HZ2 LYS 134 24.121 4.151 -4.567 1116 HZ3 LYS 134 HZ3 LYS 134 23.405 5.293 -3.544 1117 H GLU 135 HN GLU 135 19.932 0.110 -0.210 1118 HA GLU 135 HA GLU 135 22.257 -0.292 1.520 1119 HB2 GLU 135 HB2 GLU 135 20.352 0.869 3.123 1120 HB3 GLU 135 HB1 GLU 135 21.602 1.732 2.234 1121 HG2 GLU 135 HG2 GLU 135 20.102 2.257 0.471 1122 HG3 GLU 135 HG1 GLU 135 18.876 1.160 1.103 1123 H LYS 136 HN LYS 136 19.503 -1.997 0.690 1124 HA LYS 136 HA LYS 136 18.231 -3.598 1.714 1125 HB2 LYS 136 HB2 LYS 136 20.939 -4.207 2.915 1126 HB3 LYS 136 HB1 LYS 136 19.582 -5.325 2.850 1127 HG2 LYS 136 HG2 LYS 136 19.651 -5.006 0.326 1128 HG3 LYS 136 HG1 LYS 136 21.225 -4.252 0.584 1129 HD2 LYS 136 HD2 LYS 136 21.955 -6.380 0.307 1130 HD3 LYS 136 HD1 LYS 136 21.555 -6.499 2.022 1131 HE2 LYS 136 HE2 LYS 136 19.770 -7.832 1.648 1132 HE3 LYS 136 HE1 LYS 136 19.332 -7.003 0.155 1133 HZ1 LYS 136 HZ1 LYS 136 21.785 -8.559 0.076 1134 HZ2 LYS 136 HZ2 LYS 136 20.565 -8.401 -1.085 1135 HZ3 LYS 136 HZ3 LYS 136 20.355 -9.451 0.224 1136 H LEU 137 HN LEU 137 17.313 -1.671 2.890 1137 HA LEU 137 HA LEU 137 17.940 -0.871 5.417 1138 HB2 LEU 137 HB2 LEU 137 15.457 -0.932 3.814 1139 HB3 LEU 137 HB1 LEU 137 15.257 -0.676 5.540 1140 HG LEU 137 HG LEU 137 16.893 1.015 3.654 1141 HD11 LEU 137 HD11 LEU 137 15.109 2.674 4.791 1142 HD12 LEU 137 HD12 LEU 137 14.167 1.185 4.762 1143 HD13 LEU 137 HD13 LEU 137 14.830 1.838 3.264 1144 HD21 LEU 137 HD21 LEU 137 16.923 2.495 5.802 1145 HD22 LEU 137 HD22 LEU 137 18.099 1.195 5.609 1146 HD23 LEU 137 HD23 LEU 137 16.682 0.958 6.631 1147 H ASN 138 HN ASN 138 14.927 -2.704 5.286 1148 HA ASN 138 HA ASN 138 15.569 -3.887 7.830 1149 HB2 ASN 138 HB2 ASN 138 13.098 -4.137 6.109 1150 HB3 ASN 138 HB1 ASN 138 13.257 -4.766 7.746 1151 HD21 ASN 138 HD21 ASN 138 11.325 -2.906 6.864 1152 HD22 ASN 138 HD22 ASN 138 11.584 -1.429 7.721 1153 H ILE 139 HN ILE 139 13.607 -5.992 6.016 1154 HA ILE 139 HA ILE 139 15.660 -8.040 6.158 1155 HB ILE 139 HB ILE 139 13.772 -9.571 5.494 1156 HG12 ILE 139 HG12 ILE 139 12.047 -7.149 6.036 1157 HG13 ILE 139 HG11 ILE 139 12.425 -7.724 4.416 1158 HG21 ILE 139 HG21 ILE 139 14.536 -8.823 7.882 1159 HG22 ILE 139 HG22 ILE 139 13.077 -9.791 7.672 1160 HG23 ILE 139 HG23 ILE 139 12.951 -8.050 7.922 1161 HD11 ILE 139 HD11 ILE 139 10.203 -8.413 5.509 1162 HD12 ILE 139 HD12 ILE 139 11.187 -9.553 6.426 1163 HD13 ILE 139 HD13 ILE 139 11.152 -9.637 4.666 1164 H TRP 140 HN TRP 140 16.291 -6.219 4.180 1165 HA TRP 140 HA TRP 140 15.356 -7.113 1.620 1166 HB2 TRP 140 HB2 TRP 140 17.693 -5.355 2.384 1167 HB3 TRP 140 HB1 TRP 140 17.156 -5.637 0.730 1168 HD1 TRP 140 HD1 TRP 140 16.011 -3.978 3.991 1169 HE1 TRP 140 HE1 TRP 140 14.241 -2.201 3.423 1170 HE3 TRP 140 HE3 TRP 140 15.489 -4.927 -0.998 1171 HZ2 TRP 140 HZ2 TRP 140 12.826 -1.311 1.167 1172 HZ3 TRP 140 HZ3 TRP 140 13.897 -3.567 -2.296 1173 HH2 TRP 140 HH2 TRP 140 12.592 -1.795 -1.234 Start of MODEL 8 1 H1 ALA 1 HT1 ALA 1 -17.189 24.481 -17.340 2 H2 ALA 1 HT2 ALA 1 -18.659 24.565 -18.222 3 H3 ALA 1 HT3 ALA 1 -18.014 25.977 -17.490 4 HA ALA 1 HA ALA 1 -16.553 24.454 -19.520 5 HB1 ALA 1 HB1 ALA 1 -18.292 24.977 -20.873 6 HB2 ALA 1 HB2 ALA 1 -17.463 26.533 -20.929 7 HB3 ALA 1 HB3 ALA 1 -18.837 26.304 -19.847 8 H THR 2 HN THR 2 -15.269 26.208 -20.802 9 HA THR 2 HA THR 2 -13.654 27.812 -20.834 10 HB THR 2 HB THR 2 -14.512 29.066 -18.283 11 HG1 THR 2 HG1 THR 2 -16.439 29.666 -18.992 12 HG21 THR 2 HG21 THR 2 -14.147 30.265 -21.015 13 HG22 THR 2 HG22 THR 2 -12.859 30.109 -19.819 14 HG23 THR 2 HG23 THR 2 -14.268 31.111 -19.472 15 H SER 3 HN SER 3 -14.201 27.337 -17.339 16 HA SER 3 HA SER 3 -11.414 27.196 -16.782 17 HB2 SER 3 HB2 SER 3 -12.109 26.627 -14.493 18 HB3 SER 3 HB1 SER 3 -13.038 27.991 -15.114 19 HG SER 3 HG SER 3 -14.603 26.739 -14.365 20 H THR 4 HN THR 4 -10.439 25.313 -15.595 21 HA THR 4 HA THR 4 -11.471 22.717 -16.459 22 HB THR 4 HB THR 4 -8.551 23.161 -16.822 23 HG1 THR 4 HG1 THR 4 -10.443 23.943 -18.779 24 HG21 THR 4 HG21 THR 4 -9.263 21.815 -18.970 25 HG22 THR 4 HG22 THR 4 -10.643 21.396 -17.956 26 HG23 THR 4 HG23 THR 4 -9.006 21.020 -17.417 27 H LYS 5 HN LYS 5 -11.874 22.089 -14.370 28 HA LYS 5 HA LYS 5 -10.037 22.459 -12.231 29 HB2 LYS 5 HB2 LYS 5 -12.307 20.471 -12.433 30 HB3 LYS 5 HB1 LYS 5 -11.513 21.001 -10.956 31 HG2 LYS 5 HG2 LYS 5 -12.467 23.131 -11.069 32 HG3 LYS 5 HG1 LYS 5 -12.909 22.939 -12.766 33 HD2 LYS 5 HD2 LYS 5 -14.275 20.883 -11.685 34 HD3 LYS 5 HD1 LYS 5 -14.284 22.008 -10.326 35 HE2 LYS 5 HE2 LYS 5 -15.175 23.757 -11.831 36 HE3 LYS 5 HE1 LYS 5 -15.247 22.565 -13.130 37 HZ1 LYS 5 HZ1 LYS 5 -16.604 21.299 -11.230 38 HZ2 LYS 5 HZ2 LYS 5 -17.334 22.315 -12.367 39 HZ3 LYS 5 HZ3 LYS 5 -16.976 22.899 -10.820 40 H LYS 6 HN LYS 6 -8.709 20.935 -11.196 41 HA LYS 6 HA LYS 6 -7.673 18.884 -12.983 42 HB2 LYS 6 HB2 LYS 6 -6.381 20.686 -11.490 43 HB3 LYS 6 HB1 LYS 6 -6.478 19.389 -10.311 44 HG2 LYS 6 HG2 LYS 6 -4.575 18.673 -11.237 45 HG3 LYS 6 HG1 LYS 6 -5.607 18.062 -12.530 46 HD2 LYS 6 HD2 LYS 6 -4.659 20.888 -12.635 47 HD3 LYS 6 HD1 LYS 6 -3.549 19.589 -13.077 48 HE2 LYS 6 HE2 LYS 6 -5.529 18.773 -14.558 49 HE3 LYS 6 HE1 LYS 6 -6.103 20.432 -14.386 50 HZ1 LYS 6 HZ1 LYS 6 -4.444 19.653 -16.302 51 HZ2 LYS 6 HZ2 LYS 6 -3.312 20.115 -15.134 52 HZ3 LYS 6 HZ3 LYS 6 -4.462 21.227 -15.684 53 H LEU 7 HN LEU 7 -6.673 16.980 -11.414 54 HA LEU 7 HA LEU 7 -8.866 15.359 -10.793 55 HB2 LEU 7 HB2 LEU 7 -5.997 15.147 -10.770 56 HB3 LEU 7 HB1 LEU 7 -6.658 14.393 -9.332 57 HG LEU 7 HG LEU 7 -7.888 13.706 -11.956 58 HD11 LEU 7 HD11 LEU 7 -5.518 13.571 -12.448 59 HD12 LEU 7 HD12 LEU 7 -6.208 11.954 -12.314 60 HD13 LEU 7 HD13 LEU 7 -5.249 12.615 -10.990 61 HD21 LEU 7 HD21 LEU 7 -8.974 12.608 -10.264 62 HD22 LEU 7 HD22 LEU 7 -7.523 12.475 -9.271 63 HD23 LEU 7 HD23 LEU 7 -7.733 11.422 -10.670 64 H HIS 8 HN HIS 8 -8.558 14.144 -8.432 65 HA HIS 8 HA HIS 8 -8.202 15.867 -6.212 66 HB2 HIS 8 HB2 HIS 8 -10.693 15.767 -5.532 67 HB3 HIS 8 HB1 HIS 8 -10.202 16.972 -6.718 68 HD1 HIS 8 HD1 HIS 8 -11.735 17.110 -8.640 69 HD2 HIS 8 HD2 HIS 8 -11.667 13.291 -7.006 70 HE1 HIS 8 HE1 HIS 8 -13.389 15.776 -9.984 71 HE2 HIS 8 HE2 HIS 8 -13.402 13.496 -8.913 72 H LYS 9 HN LYS 9 -7.901 14.673 -4.426 73 HA LYS 9 HA LYS 9 -8.372 11.807 -4.624 74 HB2 LYS 9 HB2 LYS 9 -6.741 13.486 -2.722 75 HB3 LYS 9 HB1 LYS 9 -6.972 11.755 -2.516 76 HG2 LYS 9 HG2 LYS 9 -4.900 12.011 -3.587 77 HG3 LYS 9 HG1 LYS 9 -6.024 11.477 -4.837 78 HD2 LYS 9 HD2 LYS 9 -5.884 13.421 -5.975 79 HD3 LYS 9 HD1 LYS 9 -5.808 14.394 -4.505 80 HE2 LYS 9 HE2 LYS 9 -3.479 12.689 -5.269 81 HE3 LYS 9 HE1 LYS 9 -3.738 14.225 -6.094 82 HZ1 LYS 9 HZ1 LYS 9 -2.354 13.992 -3.844 83 HZ2 LYS 9 HZ2 LYS 9 -3.886 14.298 -3.194 84 HZ3 LYS 9 HZ3 LYS 9 -3.190 15.401 -4.271 85 H GLU 10 HN GLU 10 -9.125 10.651 -2.697 86 HA GLU 10 HA GLU 10 -11.009 12.205 -1.070 87 HB2 GLU 10 HB2 GLU 10 -11.964 10.834 -3.122 88 HB3 GLU 10 HB1 GLU 10 -11.827 9.491 -1.995 89 HG2 GLU 10 HG2 GLU 10 -13.219 10.733 -0.388 90 HG3 GLU 10 HG1 GLU 10 -13.401 12.022 -1.578 91 HA PRO 11 HA PRO 11 -9.033 9.817 2.135 92 HB2 PRO 11 HB2 PRO 11 -11.027 10.797 3.999 93 HB3 PRO 11 HB1 PRO 11 -9.321 11.225 3.879 94 HG2 PRO 11 HG2 PRO 11 -11.353 12.943 3.275 95 HG3 PRO 11 HG1 PRO 11 -9.739 13.038 2.550 96 HD2 PRO 11 HD2 PRO 11 -12.263 11.900 1.418 97 HD3 PRO 11 HD1 PRO 11 -10.994 12.852 0.619 98 H ALA 12 HN ALA 12 -9.799 8.389 4.025 99 HA ALA 12 HA ALA 12 -12.359 7.161 3.823 100 HB1 ALA 12 HB1 ALA 12 -9.973 5.651 2.776 101 HB2 ALA 12 HB2 ALA 12 -11.431 6.095 1.888 102 HB3 ALA 12 HB3 ALA 12 -11.518 4.905 3.188 103 H THR 13 HN THR 13 -12.497 5.209 5.291 104 HA THR 13 HA THR 13 -10.610 5.508 7.538 105 HB THR 13 HB THR 13 -13.547 4.811 7.724 106 HG1 THR 13 HG1 THR 13 -12.268 7.239 8.426 107 HG21 THR 13 HG21 THR 13 -11.439 5.289 9.797 108 HG22 THR 13 HG22 THR 13 -12.538 3.920 9.633 109 HG23 THR 13 HG23 THR 13 -13.157 5.492 10.138 110 H LEU 14 HN LEU 14 -10.105 3.618 8.734 111 HA LEU 14 HA LEU 14 -10.080 1.233 7.117 112 HB2 LEU 14 HB2 LEU 14 -8.490 2.296 9.186 113 HB3 LEU 14 HB1 LEU 14 -9.156 0.797 9.809 114 HG LEU 14 HG LEU 14 -6.893 0.647 8.680 115 HD11 LEU 14 HD11 LEU 14 -7.341 -1.515 8.456 116 HD12 LEU 14 HD12 LEU 14 -8.446 -1.222 7.114 117 HD13 LEU 14 HD13 LEU 14 -9.029 -1.120 8.774 118 HD21 LEU 14 HD21 LEU 14 -8.240 1.980 6.620 119 HD22 LEU 14 HD22 LEU 14 -7.964 0.342 6.030 120 HD23 LEU 14 HD23 LEU 14 -6.605 1.321 6.585 121 H ILE 15 HN ILE 15 -11.868 0.034 7.019 122 HA ILE 15 HA ILE 15 -13.787 -0.082 9.133 123 HB ILE 15 HB ILE 15 -13.511 -1.898 6.732 124 HG12 ILE 15 HG12 ILE 15 -13.732 0.503 6.141 125 HG13 ILE 15 HG11 ILE 15 -15.124 -0.449 5.636 126 HG21 ILE 15 HG21 ILE 15 -14.915 -2.750 8.610 127 HG22 ILE 15 HG22 ILE 15 -15.795 -2.510 7.101 128 HG23 ILE 15 HG23 ILE 15 -15.950 -1.336 8.408 129 HD11 ILE 15 HD11 ILE 15 -14.911 1.664 7.697 130 HD12 ILE 15 HD12 ILE 15 -16.050 0.348 7.982 131 HD13 ILE 15 HD13 ILE 15 -16.192 1.338 6.530 132 H LYS 16 HN LYS 16 -11.286 -2.246 7.883 133 HA LYS 16 HA LYS 16 -10.794 -3.386 10.423 134 HB2 LYS 16 HB2 LYS 16 -12.763 -4.714 8.707 135 HB3 LYS 16 HB1 LYS 16 -11.448 -5.773 9.201 136 HG2 LYS 16 HG2 LYS 16 -12.610 -4.146 11.353 137 HG3 LYS 16 HG1 LYS 16 -13.693 -5.343 10.639 138 HD2 LYS 16 HD2 LYS 16 -11.374 -6.766 10.939 139 HD3 LYS 16 HD1 LYS 16 -11.344 -5.707 12.351 140 HE2 LYS 16 HE2 LYS 16 -13.786 -6.448 12.691 141 HE3 LYS 16 HE1 LYS 16 -13.395 -7.754 11.571 142 HZ1 LYS 16 HZ1 LYS 16 -11.579 -7.305 13.817 143 HZ2 LYS 16 HZ2 LYS 16 -12.029 -8.751 13.064 144 HZ3 LYS 16 HZ3 LYS 16 -13.081 -8.005 14.158 145 H ALA 17 HN ALA 17 -8.728 -3.982 10.439 146 HA ALA 17 HA ALA 17 -7.243 -4.037 7.993 147 HB1 ALA 17 HB1 ALA 17 -5.444 -3.633 9.270 148 HB2 ALA 17 HB2 ALA 17 -5.860 -4.895 10.429 149 HB3 ALA 17 HB3 ALA 17 -6.629 -3.312 10.536 150 H ILE 18 HN ILE 18 -6.758 -5.762 6.804 151 HA ILE 18 HA ILE 18 -7.476 -8.409 7.778 152 HB ILE 18 HB ILE 18 -6.246 -7.939 5.090 153 HG12 ILE 18 HG12 ILE 18 -8.308 -6.345 5.825 154 HG13 ILE 18 HG11 ILE 18 -8.037 -6.892 4.181 155 HG21 ILE 18 HG21 ILE 18 -8.004 -9.726 4.546 156 HG22 ILE 18 HG22 ILE 18 -8.134 -9.919 6.294 157 HG23 ILE 18 HG23 ILE 18 -6.590 -10.195 5.491 158 HD11 ILE 18 HD11 ILE 18 -9.668 -8.624 4.427 159 HD12 ILE 18 HD12 ILE 18 -10.380 -7.103 4.964 160 HD13 ILE 18 HD13 ILE 18 -9.832 -8.288 6.150 161 H ASP 19 HN ASP 19 -4.695 -7.298 5.851 162 HA ASP 19 HA ASP 19 -2.871 -8.449 7.810 163 HB2 ASP 19 HB2 ASP 19 -3.322 -9.582 5.080 164 HB3 ASP 19 HB1 ASP 19 -1.698 -9.620 5.759 165 H GLY 20 HN GLY 20 -1.816 -8.043 4.523 166 HA2 GLY 20 HA2 GLY 20 -0.637 -5.434 5.255 167 HA3 GLY 20 HA1 GLY 20 0.283 -6.672 4.410 168 H ASP 21 HN ASP 21 -0.478 -7.317 2.272 169 HA ASP 21 HA ASP 21 -1.017 -5.086 0.635 170 HB2 ASP 21 HB2 ASP 21 -1.136 -6.712 -1.203 171 HB3 ASP 21 HB1 ASP 21 0.256 -7.018 -0.169 172 H THR 22 HN THR 22 -3.088 -6.978 2.516 173 HA THR 22 HA THR 22 -5.403 -6.063 0.947 174 HB THR 22 HB THR 22 -6.104 -8.310 2.587 175 HG1 THR 22 HG1 THR 22 -4.021 -9.048 2.428 176 HG21 THR 22 HG21 THR 22 -7.488 -8.341 0.846 177 HG22 THR 22 HG22 THR 22 -6.203 -9.228 0.026 178 HG23 THR 22 HG23 THR 22 -6.351 -7.484 -0.196 179 H VAL 23 HN VAL 23 -6.804 -4.821 2.020 180 HA VAL 23 HA VAL 23 -7.146 -5.043 4.883 181 HB VAL 23 HB VAL 23 -6.746 -2.568 5.211 182 HG11 VAL 23 HG11 VAL 23 -4.367 -2.833 5.578 183 HG12 VAL 23 HG12 VAL 23 -4.330 -4.227 4.499 184 HG13 VAL 23 HG13 VAL 23 -5.213 -4.315 6.024 185 HG21 VAL 23 HG21 VAL 23 -6.651 -2.281 2.614 186 HG22 VAL 23 HG22 VAL 23 -4.947 -2.683 2.832 187 HG23 VAL 23 HG23 VAL 23 -5.635 -1.283 3.655 188 H LYS 24 HN LYS 24 -9.069 -4.124 5.622 189 HA LYS 24 HA LYS 24 -10.993 -3.519 3.529 190 HB2 LYS 24 HB2 LYS 24 -11.440 -5.078 5.508 191 HB3 LYS 24 HB1 LYS 24 -11.543 -3.624 6.491 192 HG2 LYS 24 HG2 LYS 24 -13.753 -4.282 5.889 193 HG3 LYS 24 HG1 LYS 24 -13.355 -2.810 5.000 194 HD2 LYS 24 HD2 LYS 24 -14.510 -4.477 3.599 195 HD3 LYS 24 HD1 LYS 24 -12.894 -4.098 3.003 196 HE2 LYS 24 HE2 LYS 24 -12.181 -6.201 3.294 197 HE3 LYS 24 HE1 LYS 24 -12.930 -6.326 4.885 198 HZ1 LYS 24 HZ1 LYS 24 -14.670 -6.389 2.531 199 HZ2 LYS 24 HZ2 LYS 24 -14.844 -7.169 4.021 200 HZ3 LYS 24 HZ3 LYS 24 -13.752 -7.769 2.876 201 H LEU 25 HN LEU 25 -11.766 -1.531 3.077 202 HA LEU 25 HA LEU 25 -11.191 0.637 4.972 203 HB2 LEU 25 HB2 LEU 25 -10.275 0.321 2.223 204 HB3 LEU 25 HB1 LEU 25 -11.050 1.866 2.516 205 HG LEU 25 HG LEU 25 -8.891 0.887 4.349 206 HD11 LEU 25 HD11 LEU 25 -7.354 2.312 2.889 207 HD12 LEU 25 HD12 LEU 25 -8.570 2.106 1.628 208 HD13 LEU 25 HD13 LEU 25 -7.761 0.695 2.313 209 HD21 LEU 25 HD21 LEU 25 -10.262 3.444 3.732 210 HD22 LEU 25 HD22 LEU 25 -8.563 3.511 4.198 211 HD23 LEU 25 HD23 LEU 25 -9.745 2.779 5.281 212 H MET 26 HN MET 26 -12.558 2.517 4.760 213 HA MET 26 HA MET 26 -15.272 1.763 4.038 214 HB2 MET 26 HB2 MET 26 -14.526 2.944 6.222 215 HB3 MET 26 HB1 MET 26 -14.476 4.400 5.237 216 HG2 MET 26 HG2 MET 26 -16.747 4.459 4.957 217 HG3 MET 26 HG1 MET 26 -16.932 2.722 5.194 218 HE1 MET 26 HE1 MET 26 -17.987 2.061 8.286 219 HE2 MET 26 HE2 MET 26 -18.332 2.159 6.559 220 HE3 MET 26 HE3 MET 26 -19.123 3.266 7.680 221 H TYR 27 HN TYR 27 -16.005 2.167 2.073 222 HA TYR 27 HA TYR 27 -15.238 4.688 0.766 223 HB2 TYR 27 HB2 TYR 27 -14.050 2.706 -0.226 224 HB3 TYR 27 HB1 TYR 27 -15.623 2.067 -0.685 225 HD1 TYR 27 HD1 TYR 27 -14.447 5.588 -0.825 226 HD2 TYR 27 HD2 TYR 27 -15.559 2.122 -3.026 227 HE1 TYR 27 HE1 TYR 27 -14.356 6.891 -2.909 228 HE2 TYR 27 HE2 TYR 27 -15.472 3.414 -5.117 229 HH TYR 27 HH TYR 27 -14.417 5.442 -5.986 230 H LYS 28 HN LYS 28 -16.936 5.909 0.297 231 HA LYS 28 HA LYS 28 -19.063 6.590 -0.103 232 HB2 LYS 28 HB2 LYS 28 -19.166 3.838 -1.330 233 HB3 LYS 28 HB1 LYS 28 -20.489 4.990 -1.437 234 HG2 LYS 28 HG2 LYS 28 -19.066 6.556 -2.622 235 HG3 LYS 28 HG1 LYS 28 -17.700 5.452 -2.467 236 HD2 LYS 28 HD2 LYS 28 -18.321 4.654 -4.461 237 HD3 LYS 28 HD1 LYS 28 -19.644 3.868 -3.597 238 HE2 LYS 28 HE2 LYS 28 -20.593 5.042 -5.440 239 HE3 LYS 28 HE1 LYS 28 -21.003 5.935 -3.975 240 HZ1 LYS 28 HZ1 LYS 28 -20.260 7.657 -5.195 241 HZ2 LYS 28 HZ2 LYS 28 -19.288 6.699 -6.193 242 HZ3 LYS 28 HZ3 LYS 28 -18.741 7.143 -4.655 243 H GLY 29 HN GLY 29 -18.598 5.747 2.470 244 HA2 GLY 29 HA2 GLY 29 -19.719 5.188 4.392 245 HA3 GLY 29 HA1 GLY 29 -21.195 5.327 3.452 246 H GLN 30 HN GLN 30 -18.882 3.083 2.287 247 HA GLN 30 HA GLN 30 -20.218 0.852 3.647 248 HB2 GLN 30 HB2 GLN 30 -21.062 -0.052 1.767 249 HB3 GLN 30 HB1 GLN 30 -20.840 1.542 1.062 250 HG2 GLN 30 HG2 GLN 30 -18.670 0.855 0.180 251 HG3 GLN 30 HG1 GLN 30 -18.885 -0.743 0.894 252 HE21 GLN 30 HE21 GLN 30 -19.221 -2.118 -0.700 253 HE22 GLN 30 HE22 GLN 30 -20.326 -1.903 -2.011 254 HA PRO 31 HA PRO 31 -16.131 -0.734 3.960 255 HB2 PRO 31 HB2 PRO 31 -16.597 -3.279 4.538 256 HB3 PRO 31 HB1 PRO 31 -17.201 -1.993 5.598 257 HG2 PRO 31 HG2 PRO 31 -18.677 -3.544 3.500 258 HG3 PRO 31 HG1 PRO 31 -19.173 -3.165 5.160 259 HD2 PRO 31 HD2 PRO 31 -19.961 -1.726 2.954 260 HD3 PRO 31 HD1 PRO 31 -19.871 -1.057 4.596 261 H MET 32 HN MET 32 -14.744 -0.944 2.335 262 HA MET 32 HA MET 32 -15.290 -2.961 0.260 263 HB2 MET 32 HB2 MET 32 -15.368 -0.373 -0.302 264 HB3 MET 32 HB1 MET 32 -13.622 -0.567 -0.366 265 HG2 MET 32 HG2 MET 32 -14.236 -0.901 -2.556 266 HG3 MET 32 HG1 MET 32 -14.138 -2.550 -1.938 267 HE1 MET 32 HE1 MET 32 -17.844 -0.128 -1.764 268 HE2 MET 32 HE2 MET 32 -17.333 -0.001 -3.448 269 HE3 MET 32 HE3 MET 32 -16.226 0.458 -2.154 270 H THR 33 HN THR 33 -13.491 -4.068 -0.585 271 HA THR 33 HA THR 33 -11.327 -4.350 1.318 272 HB THR 33 HB THR 33 -10.651 -6.260 -0.129 273 HG1 THR 33 HG1 THR 33 -13.016 -5.711 -1.583 274 HG21 THR 33 HG21 THR 33 -13.088 -6.065 1.360 275 HG22 THR 33 HG22 THR 33 -11.990 -7.432 1.180 276 HG23 THR 33 HG23 THR 33 -13.285 -7.180 0.009 277 H PHE 34 HN PHE 34 -9.630 -3.048 1.177 278 HA PHE 34 HA PHE 34 -8.768 -2.116 -1.470 279 HB2 PHE 34 HB2 PHE 34 -8.590 -0.980 1.281 280 HB3 PHE 34 HB1 PHE 34 -7.296 -0.595 0.150 281 HD1 PHE 34 HD1 PHE 34 -10.983 -0.493 0.569 282 HD2 PHE 34 HD2 PHE 34 -7.575 1.070 -1.452 283 HE1 PHE 34 HE1 PHE 34 -12.389 1.251 -0.451 284 HE2 PHE 34 HE2 PHE 34 -8.976 2.819 -2.469 285 HZ PHE 34 HZ PHE 34 -11.385 2.908 -1.971 286 H ARG 35 HN ARG 35 -6.523 -2.203 -2.037 287 HA ARG 35 HA ARG 35 -4.944 -4.069 -0.412 288 HB2 ARG 35 HB2 ARG 35 -4.438 -5.456 -2.209 289 HB3 ARG 35 HB1 ARG 35 -6.132 -5.071 -2.485 290 HG2 ARG 35 HG2 ARG 35 -5.343 -4.738 -4.581 291 HG3 ARG 35 HG1 ARG 35 -5.071 -3.121 -3.928 292 HD2 ARG 35 HD2 ARG 35 -2.862 -3.308 -4.151 293 HD3 ARG 35 HD1 ARG 35 -2.845 -4.889 -3.372 294 HE ARG 35 HE ARG 35 -2.849 -4.341 -6.200 295 HH11 ARG 35 HH11 ARG 35 -3.550 -6.705 -3.729 296 HH12 ARG 35 HH12 ARG 35 -3.385 -8.056 -4.800 297 HH21 ARG 35 HH21 ARG 35 -2.632 -6.117 -7.609 298 HH22 ARG 35 HH22 ARG 35 -2.864 -7.722 -7.001 299 H LEU 36 HN LEU 36 -2.700 -3.840 -0.501 300 HA LEU 36 HA LEU 36 -1.766 -1.200 -0.939 301 HB2 LEU 36 HB2 LEU 36 -0.176 -3.738 -0.515 302 HB3 LEU 36 HB1 LEU 36 0.455 -2.104 -0.390 303 HG LEU 36 HG LEU 36 -1.682 -3.264 1.399 304 HD11 LEU 36 HD11 LEU 36 0.044 -3.340 3.107 305 HD12 LEU 36 HD12 LEU 36 1.239 -2.759 1.948 306 HD13 LEU 36 HD13 LEU 36 0.493 -4.342 1.728 307 HD21 LEU 36 HD21 LEU 36 -1.209 -0.636 0.846 308 HD22 LEU 36 HD22 LEU 36 -0.177 -0.904 2.250 309 HD23 LEU 36 HD23 LEU 36 -1.904 -1.247 2.347 310 H LEU 37 HN LEU 37 -2.342 -0.842 -3.145 311 HA LEU 37 HA LEU 37 -1.766 -2.212 -5.386 312 HB2 LEU 37 HB2 LEU 37 -2.795 0.115 -5.106 313 HB3 LEU 37 HB1 LEU 37 -1.153 0.719 -5.225 314 HG LEU 37 HG LEU 37 -0.951 -0.350 -7.445 315 HD11 LEU 37 HD11 LEU 37 -3.281 -0.876 -8.479 316 HD12 LEU 37 HD12 LEU 37 -3.736 -1.185 -6.803 317 HD13 LEU 37 HD13 LEU 37 -2.427 -2.105 -7.545 318 HD21 LEU 37 HD21 LEU 37 -1.782 1.474 -8.486 319 HD22 LEU 37 HD22 LEU 37 -2.018 2.033 -6.830 320 HD23 LEU 37 HD23 LEU 37 -3.364 1.322 -7.720 321 H LEU 38 HN LEU 38 -0.098 -2.501 -6.800 322 HA LEU 38 HA LEU 38 2.047 -3.211 -7.208 323 HB2 LEU 38 HB2 LEU 38 3.561 -1.318 -7.628 324 HB3 LEU 38 HB1 LEU 38 1.967 -1.097 -8.323 325 HG LEU 38 HG LEU 38 2.342 0.081 -5.644 326 HD11 LEU 38 HD11 LEU 38 3.664 1.342 -8.036 327 HD12 LEU 38 HD12 LEU 38 4.532 0.492 -6.758 328 HD13 LEU 38 HD13 LEU 38 3.623 1.956 -6.384 329 HD21 LEU 38 HD21 LEU 38 1.399 1.972 -7.420 330 HD22 LEU 38 HD22 LEU 38 0.420 0.938 -6.383 331 HD23 LEU 38 HD23 LEU 38 0.752 0.456 -8.045 332 H VAL 39 HN VAL 39 1.617 -3.927 -4.647 333 HA VAL 39 HA VAL 39 4.226 -3.375 -3.406 334 HB VAL 39 HB VAL 39 1.635 -3.663 -1.874 335 HG11 VAL 39 HG11 VAL 39 2.944 -3.200 0.099 336 HG12 VAL 39 HG12 VAL 39 4.404 -3.014 -0.873 337 HG13 VAL 39 HG13 VAL 39 3.627 -4.591 -0.742 338 HG21 VAL 39 HG21 VAL 39 2.858 -1.366 -3.077 339 HG22 VAL 39 HG22 VAL 39 2.877 -1.198 -1.322 340 HG23 VAL 39 HG23 VAL 39 1.353 -1.477 -2.165 341 H ASP 40 HN ASP 40 5.258 -5.124 -2.527 342 HA ASP 40 HA ASP 40 3.925 -7.720 -2.917 343 HB2 ASP 40 HB2 ASP 40 6.544 -6.734 -3.655 344 HB3 ASP 40 HB1 ASP 40 6.682 -8.168 -2.640 345 H THR 41 HN THR 41 3.366 -8.759 -1.139 346 HA THR 41 HA THR 41 4.820 -8.178 1.354 347 HB THR 41 HB THR 41 2.653 -9.223 2.371 348 HG1 THR 41 HG1 THR 41 0.868 -9.060 1.094 349 HG21 THR 41 HG21 THR 41 2.522 -6.506 1.085 350 HG22 THR 41 HG22 THR 41 3.244 -6.872 2.652 351 HG23 THR 41 HG23 THR 41 1.511 -7.089 2.408 352 HA PRO 42 HA PRO 42 6.325 -12.308 1.595 353 HB2 PRO 42 HB2 PRO 42 6.019 -12.806 4.286 354 HB3 PRO 42 HB1 PRO 42 7.348 -11.875 3.589 355 HG2 PRO 42 HG2 PRO 42 4.823 -10.910 4.870 356 HG3 PRO 42 HG1 PRO 42 6.473 -10.278 5.026 357 HD2 PRO 42 HD2 PRO 42 4.648 -9.085 3.459 358 HD3 PRO 42 HD1 PRO 42 6.365 -9.148 3.007 359 H GLU 43 HN GLU 43 5.642 -14.430 3.040 360 HA GLU 43 HA GLU 43 3.321 -15.406 1.839 361 HB2 GLU 43 HB2 GLU 43 4.591 -16.430 4.382 362 HB3 GLU 43 HB1 GLU 43 3.554 -17.335 3.289 363 HG2 GLU 43 HG2 GLU 43 5.593 -16.429 1.661 364 HG3 GLU 43 HG1 GLU 43 6.405 -16.847 3.169 365 H THR 44 HN THR 44 1.407 -14.427 2.143 366 HA THR 44 HA THR 44 0.146 -14.646 4.717 367 HB THR 44 HB THR 44 1.304 -12.536 5.046 368 HG1 THR 44 HG1 THR 44 -0.608 -12.376 6.008 369 HG21 THR 44 HG21 THR 44 -0.207 -11.087 2.981 370 HG22 THR 44 HG22 THR 44 1.141 -12.073 2.414 371 HG23 THR 44 HG23 THR 44 1.416 -10.811 3.614 372 H LYS 45 HN LYS 45 -1.602 -15.694 3.998 373 HA LYS 45 HA LYS 45 -3.596 -14.319 2.531 374 HB2 LYS 45 HB2 LYS 45 -3.652 -16.043 0.631 375 HB3 LYS 45 HB1 LYS 45 -2.445 -14.768 0.540 376 HG2 LYS 45 HG2 LYS 45 -0.872 -16.467 1.657 377 HG3 LYS 45 HG1 LYS 45 -2.074 -17.667 1.180 378 HD2 LYS 45 HD2 LYS 45 -1.872 -16.892 -1.156 379 HD3 LYS 45 HD1 LYS 45 -0.609 -15.769 -0.651 380 HE2 LYS 45 HE2 LYS 45 0.292 -18.128 0.379 381 HE3 LYS 45 HE1 LYS 45 -0.494 -18.662 -1.105 382 HZ1 LYS 45 HZ1 LYS 45 0.881 -16.563 -1.992 383 HZ2 LYS 45 HZ2 LYS 45 1.489 -18.141 -1.992 384 HZ3 LYS 45 HZ3 LYS 45 1.907 -17.074 -0.749 385 H HIS 46 HN HIS 46 -2.342 -17.494 3.473 386 HA HIS 46 HA HIS 46 -4.919 -18.707 3.666 387 HB2 HIS 46 HB2 HIS 46 -2.214 -19.559 3.815 388 HB3 HIS 46 HB1 HIS 46 -3.002 -20.063 5.307 389 HD1 HIS 46 HD1 HIS 46 -2.679 -20.915 1.762 390 HD2 HIS 46 HD2 HIS 46 -5.307 -21.768 4.866 391 HE1 HIS 46 HE1 HIS 46 -4.003 -22.909 0.993 392 HE2 HIS 46 HE2 HIS 46 -5.524 -23.463 2.924 393 HA PRO 47 HA PRO 47 -4.412 -18.113 8.402 394 HB2 PRO 47 HB2 PRO 47 -2.298 -16.731 9.352 395 HB3 PRO 47 HB1 PRO 47 -2.214 -18.462 9.006 396 HG2 PRO 47 HG2 PRO 47 -1.267 -16.152 7.354 397 HG3 PRO 47 HG1 PRO 47 -0.462 -17.697 7.682 398 HD2 PRO 47 HD2 PRO 47 -1.812 -17.181 5.375 399 HD3 PRO 47 HD1 PRO 47 -1.664 -18.807 6.068 400 H LYS 48 HN LYS 48 -6.130 -16.676 7.505 401 HA LYS 48 HA LYS 48 -5.726 -13.897 7.199 402 HB2 LYS 48 HB2 LYS 48 -7.697 -15.356 6.403 403 HB3 LYS 48 HB1 LYS 48 -8.342 -15.130 8.023 404 HG2 LYS 48 HG2 LYS 48 -8.708 -12.874 7.709 405 HG3 LYS 48 HG1 LYS 48 -7.526 -12.759 6.404 406 HD2 LYS 48 HD2 LYS 48 -9.655 -12.596 5.383 407 HD3 LYS 48 HD1 LYS 48 -9.072 -14.227 5.045 408 HE2 LYS 48 HE2 LYS 48 -10.719 -15.188 6.227 409 HE3 LYS 48 HE1 LYS 48 -10.606 -14.001 7.526 410 HZ1 LYS 48 HZ1 LYS 48 -12.094 -12.609 6.507 411 HZ2 LYS 48 HZ2 LYS 48 -12.715 -14.113 6.044 412 HZ3 LYS 48 HZ3 LYS 48 -11.789 -13.210 4.955 413 H LYS 49 HN LYS 49 -7.432 -15.614 9.824 414 HA LYS 49 HA LYS 49 -7.177 -13.313 11.549 415 HB2 LYS 49 HB2 LYS 49 -8.959 -15.450 11.358 416 HB3 LYS 49 HB1 LYS 49 -8.096 -15.737 12.861 417 HG2 LYS 49 HG2 LYS 49 -8.808 -12.978 12.715 418 HG3 LYS 49 HG1 LYS 49 -10.233 -13.965 12.380 419 HD2 LYS 49 HD2 LYS 49 -10.374 -13.938 14.649 420 HD3 LYS 49 HD1 LYS 49 -9.283 -15.314 14.477 421 HE2 LYS 49 HE2 LYS 49 -7.962 -14.188 15.894 422 HE3 LYS 49 HE1 LYS 49 -7.537 -13.222 14.482 423 HZ1 LYS 49 HZ1 LYS 49 -8.778 -11.476 15.187 424 HZ2 LYS 49 HZ2 LYS 49 -8.409 -12.133 16.700 425 HZ3 LYS 49 HZ3 LYS 49 -9.914 -12.438 15.991 426 H GLY 50 HN GLY 50 -4.744 -13.492 11.334 427 HA2 GLY 50 HA2 GLY 50 -2.711 -13.916 12.312 428 HA3 GLY 50 HA1 GLY 50 -3.627 -14.293 13.763 429 H VAL 51 HN VAL 51 -3.020 -16.184 14.556 430 HA VAL 51 HA VAL 51 -2.539 -18.405 14.722 431 HB VAL 51 HB VAL 51 -3.502 -18.682 11.876 432 HG11 VAL 51 HG11 VAL 51 -3.230 -20.617 14.168 433 HG12 VAL 51 HG12 VAL 51 -2.377 -20.648 12.624 434 HG13 VAL 51 HG13 VAL 51 -4.110 -20.973 12.681 435 HG21 VAL 51 HG21 VAL 51 -4.976 -18.160 14.372 436 HG22 VAL 51 HG22 VAL 51 -5.608 -19.467 13.370 437 HG23 VAL 51 HG23 VAL 51 -5.430 -17.846 12.697 438 H GLU 52 HN GLU 52 -0.621 -19.394 14.638 439 HA GLU 52 HA GLU 52 1.511 -19.907 14.041 440 HB2 GLU 52 HB2 GLU 52 0.017 -19.871 11.497 441 HB3 GLU 52 HB1 GLU 52 1.762 -19.731 11.340 442 HG2 GLU 52 HG2 GLU 52 2.100 -21.869 11.873 443 HG3 GLU 52 HG1 GLU 52 0.927 -21.825 13.188 444 H LYS 53 HN LYS 53 3.366 -19.030 12.392 445 HA LYS 53 HA LYS 53 3.618 -16.220 13.108 446 HB2 LYS 53 HB2 LYS 53 5.429 -18.433 12.713 447 HB3 LYS 53 HB1 LYS 53 5.933 -17.053 11.746 448 HG2 LYS 53 HG2 LYS 53 6.174 -15.681 13.637 449 HG3 LYS 53 HG1 LYS 53 5.280 -16.803 14.664 450 HD2 LYS 53 HD2 LYS 53 7.104 -18.464 14.326 451 HD3 LYS 53 HD1 LYS 53 8.010 -17.225 13.454 452 HE2 LYS 53 HE2 LYS 53 8.697 -17.434 15.817 453 HE3 LYS 53 HE1 LYS 53 8.078 -15.831 15.421 454 HZ1 LYS 53 HZ1 LYS 53 6.253 -17.856 16.523 455 HZ2 LYS 53 HZ2 LYS 53 6.170 -16.170 16.629 456 HZ3 LYS 53 HZ3 LYS 53 7.294 -17.020 17.565 457 H TYR 54 HN TYR 54 2.143 -15.328 11.600 458 HA TYR 54 HA TYR 54 3.326 -14.933 8.964 459 HB2 TYR 54 HB2 TYR 54 0.516 -15.948 9.419 460 HB3 TYR 54 HB1 TYR 54 1.054 -15.238 7.900 461 HD1 TYR 54 HD1 TYR 54 1.766 -18.016 10.271 462 HD2 TYR 54 HD2 TYR 54 2.114 -16.562 6.288 463 HE1 TYR 54 HE1 TYR 54 2.599 -20.213 9.548 464 HE2 TYR 54 HE2 TYR 54 2.946 -18.756 5.554 465 HH TYR 54 HH TYR 54 2.570 -21.348 6.707 466 H GLY 55 HN GLY 55 3.416 -12.817 8.597 467 HA2 GLY 55 HA2 GLY 55 2.640 -10.647 8.368 468 HA3 GLY 55 HA1 GLY 55 1.157 -11.118 9.182 469 HA PRO 56 HA PRO 56 3.805 -10.333 12.993 470 HB2 PRO 56 HB2 PRO 56 6.523 -10.451 12.865 471 HB3 PRO 56 HB1 PRO 56 5.503 -11.860 13.168 472 HG2 PRO 56 HG2 PRO 56 6.846 -11.001 10.649 473 HG3 PRO 56 HG1 PRO 56 6.597 -12.631 11.291 474 HD2 PRO 56 HD2 PRO 56 5.081 -11.520 9.297 475 HD3 PRO 56 HD1 PRO 56 4.511 -12.799 10.384 476 H GLU 57 HN GLU 57 6.618 -9.251 11.163 477 HA GLU 57 HA GLU 57 6.195 -6.545 12.028 478 HB2 GLU 57 HB2 GLU 57 8.425 -7.963 11.569 479 HB3 GLU 57 HB1 GLU 57 8.277 -7.168 10.007 480 HG2 GLU 57 HG2 GLU 57 7.872 -5.268 12.114 481 HG3 GLU 57 HG1 GLU 57 9.382 -6.142 12.367 482 H ALA 58 HN ALA 58 5.522 -8.394 9.180 483 HA ALA 58 HA ALA 58 5.390 -6.173 7.378 484 HB1 ALA 58 HB1 ALA 58 5.030 -7.707 5.762 485 HB2 ALA 58 HB2 ALA 58 3.877 -8.621 6.734 486 HB3 ALA 58 HB3 ALA 58 5.608 -8.822 7.000 487 H SER 59 HN SER 59 2.865 -8.289 8.768 488 HA SER 59 HA SER 59 0.728 -6.653 7.872 489 HB2 SER 59 HB2 SER 59 1.039 -9.141 9.209 490 HB3 SER 59 HB1 SER 59 -0.081 -8.163 10.154 491 HG SER 59 HG SER 59 -0.461 -9.390 7.773 492 H ALA 60 HN ALA 60 2.410 -6.918 10.980 493 HA ALA 60 HA ALA 60 0.790 -5.263 12.511 494 HB1 ALA 60 HB1 ALA 60 2.715 -4.944 13.960 495 HB2 ALA 60 HB2 ALA 60 3.786 -5.542 12.694 496 HB3 ALA 60 HB3 ALA 60 2.605 -6.624 13.434 497 H PHE 61 HN PHE 61 3.779 -4.324 10.796 498 HA PHE 61 HA PHE 61 3.727 -1.627 11.319 499 HB2 PHE 61 HB2 PHE 61 5.592 -2.794 10.202 500 HB3 PHE 61 HB1 PHE 61 4.619 -2.927 8.740 501 HD1 PHE 61 HD1 PHE 61 6.252 -0.537 11.025 502 HD2 PHE 61 HD2 PHE 61 4.454 -1.144 7.221 503 HE1 PHE 61 HE1 PHE 61 7.051 1.678 10.299 504 HE2 PHE 61 HE2 PHE 61 5.245 1.064 6.484 505 HZ PHE 61 HZ PHE 61 6.547 2.481 8.024 506 H THR 62 HN THR 62 2.346 -3.229 8.444 507 HA THR 62 HA THR 62 1.294 -1.012 7.185 508 HB THR 62 HB THR 62 0.009 -3.748 7.329 509 HG1 THR 62 HG1 THR 62 1.950 -4.181 6.539 510 HG21 THR 62 HG21 THR 62 -0.078 -2.290 4.809 511 HG22 THR 62 HG22 THR 62 -1.008 -1.537 6.104 512 HG23 THR 62 HG23 THR 62 -1.334 -3.207 5.640 513 H LYS 63 HN LYS 63 -0.072 -2.904 9.827 514 HA LYS 63 HA LYS 63 -2.535 -1.420 9.888 515 HB2 LYS 63 HB2 LYS 63 -1.608 -3.839 10.969 516 HB3 LYS 63 HB1 LYS 63 -1.929 -2.807 12.356 517 HG2 LYS 63 HG2 LYS 63 -4.178 -2.352 11.052 518 HG3 LYS 63 HG1 LYS 63 -3.800 -3.924 10.344 519 HD2 LYS 63 HD2 LYS 63 -4.004 -3.325 13.295 520 HD3 LYS 63 HD1 LYS 63 -5.230 -4.143 12.324 521 HE2 LYS 63 HE2 LYS 63 -3.126 -5.683 11.738 522 HE3 LYS 63 HE1 LYS 63 -2.626 -5.130 13.336 523 HZ1 LYS 63 HZ1 LYS 63 -4.447 -6.121 14.337 524 HZ2 LYS 63 HZ2 LYS 63 -4.015 -7.256 13.160 525 HZ3 LYS 63 HZ3 LYS 63 -5.330 -6.226 12.897 526 H LYS 64 HN LYS 64 0.556 -1.339 11.512 527 HA LYS 64 HA LYS 64 0.004 0.277 13.691 528 HB2 LYS 64 HB2 LYS 64 2.247 -0.843 12.620 529 HB3 LYS 64 HB1 LYS 64 2.541 0.862 12.312 530 HG2 LYS 64 HG2 LYS 64 1.717 -0.063 15.033 531 HG3 LYS 64 HG1 LYS 64 3.395 -0.199 14.502 532 HD2 LYS 64 HD2 LYS 64 2.500 2.402 13.827 533 HD3 LYS 64 HD1 LYS 64 2.006 2.091 15.492 534 HE2 LYS 64 HE2 LYS 64 4.281 1.513 16.092 535 HE3 LYS 64 HE1 LYS 64 4.798 1.706 14.418 536 HZ1 LYS 64 HZ1 LYS 64 5.383 3.667 15.593 537 HZ2 LYS 64 HZ2 LYS 64 3.834 3.827 16.253 538 HZ3 LYS 64 HZ3 LYS 64 4.075 4.067 14.596 539 H MET 65 HN MET 65 0.582 1.194 10.332 540 HA MET 65 HA MET 65 0.616 3.996 10.911 541 HB2 MET 65 HB2 MET 65 0.317 2.664 8.223 542 HB3 MET 65 HB1 MET 65 0.832 4.316 8.536 543 HG2 MET 65 HG2 MET 65 2.609 2.753 9.982 544 HG3 MET 65 HG1 MET 65 2.373 1.873 8.473 545 HE1 MET 65 HE1 MET 65 3.128 4.941 10.269 546 HE2 MET 65 HE2 MET 65 3.647 6.139 9.084 547 HE3 MET 65 HE3 MET 65 4.813 4.998 9.754 548 H VAL 66 HN VAL 66 -1.661 1.859 9.180 549 HA VAL 66 HA VAL 66 -3.606 3.878 8.791 550 HB VAL 66 HB VAL 66 -5.171 1.936 8.360 551 HG11 VAL 66 HG11 VAL 66 -4.137 2.950 6.498 552 HG12 VAL 66 HG12 VAL 66 -3.884 1.217 6.297 553 HG13 VAL 66 HG13 VAL 66 -2.571 2.238 6.881 554 HG21 VAL 66 HG21 VAL 66 -4.611 -0.076 9.112 555 HG22 VAL 66 HG22 VAL 66 -3.034 0.517 9.630 556 HG23 VAL 66 HG23 VAL 66 -3.252 -0.090 7.990 557 H GLU 67 HN GLU 67 -3.137 1.489 11.351 558 HA GLU 67 HA GLU 67 -5.641 1.922 12.605 559 HB2 GLU 67 HB2 GLU 67 -3.064 0.800 13.709 560 HB3 GLU 67 HB1 GLU 67 -4.604 0.774 14.555 561 HG2 GLU 67 HG2 GLU 67 -4.242 -0.471 11.849 562 HG3 GLU 67 HG1 GLU 67 -3.912 -1.341 13.347 563 H ASN 68 HN ASN 68 -2.362 3.060 13.419 564 HA ASN 68 HA ASN 68 -3.222 4.719 15.551 565 HB2 ASN 68 HB2 ASN 68 -0.679 4.594 13.940 566 HB3 ASN 68 HB1 ASN 68 -0.915 5.782 15.217 567 HD21 ASN 68 HD21 ASN 68 -0.850 2.333 14.529 568 HD22 ASN 68 HD22 ASN 68 -0.384 1.840 16.119 569 H ALA 69 HN ALA 69 -2.861 5.214 12.110 570 HA ALA 69 HA ALA 69 -2.913 8.038 12.117 571 HB1 ALA 69 HB1 ALA 69 -3.523 5.969 10.036 572 HB2 ALA 69 HB2 ALA 69 -2.154 7.076 10.138 573 HB3 ALA 69 HB3 ALA 69 -3.752 7.689 9.715 574 H LYS 70 HN LYS 70 -4.504 9.337 12.705 575 HA LYS 70 HA LYS 70 -7.102 8.447 13.338 576 HB2 LYS 70 HB2 LYS 70 -5.827 11.146 13.047 577 HB3 LYS 70 HB1 LYS 70 -7.564 11.014 13.286 578 HG2 LYS 70 HG2 LYS 70 -7.144 10.994 15.464 579 HG3 LYS 70 HG1 LYS 70 -6.508 9.365 15.235 580 HD2 LYS 70 HD2 LYS 70 -4.627 11.527 14.590 581 HD3 LYS 70 HD1 LYS 70 -5.103 11.442 16.287 582 HE2 LYS 70 HE2 LYS 70 -3.842 9.277 14.614 583 HE3 LYS 70 HE1 LYS 70 -3.146 10.103 16.008 584 HZ1 LYS 70 HZ1 LYS 70 -3.881 8.266 17.058 585 HZ2 LYS 70 HZ2 LYS 70 -5.079 7.933 15.912 586 HZ3 LYS 70 HZ3 LYS 70 -5.348 9.109 17.097 587 H LYS 71 HN LYS 71 -5.672 9.571 10.393 588 HA LYS 71 HA LYS 71 -8.269 9.266 9.062 589 HB2 LYS 71 HB2 LYS 71 -7.363 11.729 9.481 590 HB3 LYS 71 HB1 LYS 71 -6.417 11.365 8.046 591 HG2 LYS 71 HG2 LYS 71 -8.469 10.865 6.818 592 HG3 LYS 71 HG1 LYS 71 -9.417 11.244 8.257 593 HD2 LYS 71 HD2 LYS 71 -8.492 13.535 8.221 594 HD3 LYS 71 HD1 LYS 71 -7.631 13.139 6.731 595 HE2 LYS 71 HE2 LYS 71 -9.477 13.343 5.472 596 HE3 LYS 71 HE1 LYS 71 -10.493 12.527 6.659 597 HZ1 LYS 71 HZ1 LYS 71 -9.552 15.279 7.139 598 HZ2 LYS 71 HZ2 LYS 71 -10.904 14.490 7.780 599 HZ3 LYS 71 HZ3 LYS 71 -10.908 14.997 6.166 600 H ILE 72 HN ILE 72 -8.213 8.262 7.111 601 HA ILE 72 HA ILE 72 -5.563 7.498 6.074 602 HB ILE 72 HB ILE 72 -8.014 5.804 5.722 603 HG12 ILE 72 HG12 ILE 72 -5.991 5.624 7.965 604 HG13 ILE 72 HG11 ILE 72 -7.688 6.059 8.138 605 HG21 ILE 72 HG21 ILE 72 -5.746 5.643 4.409 606 HG22 ILE 72 HG22 ILE 72 -6.608 4.192 4.921 607 HG23 ILE 72 HG23 ILE 72 -5.230 4.773 5.855 608 HD11 ILE 72 HD11 ILE 72 -8.375 3.856 7.512 609 HD12 ILE 72 HD12 ILE 72 -7.163 3.728 8.786 610 HD13 ILE 72 HD13 ILE 72 -6.719 3.404 7.111 611 H GLU 73 HN GLU 73 -5.278 7.502 3.857 612 HA GLU 73 HA GLU 73 -7.523 8.556 2.261 613 HB2 GLU 73 HB2 GLU 73 -4.659 9.315 1.732 614 HB3 GLU 73 HB1 GLU 73 -6.123 10.083 1.134 615 HG2 GLU 73 HG2 GLU 73 -6.602 11.012 3.271 616 HG3 GLU 73 HG1 GLU 73 -5.321 10.066 4.030 617 H VAL 74 HN VAL 74 -7.747 7.772 0.176 618 HA VAL 74 HA VAL 74 -5.846 5.671 -0.615 619 HB VAL 74 HB VAL 74 -7.865 4.596 -1.764 620 HG11 VAL 74 HG11 VAL 74 -7.533 3.081 -0.189 621 HG12 VAL 74 HG12 VAL 74 -8.479 4.034 0.955 622 HG13 VAL 74 HG13 VAL 74 -6.741 4.299 0.811 623 HG21 VAL 74 HG21 VAL 74 -9.946 5.305 -1.365 624 HG22 VAL 74 HG22 VAL 74 -9.185 6.799 -0.817 625 HG23 VAL 74 HG23 VAL 74 -9.629 5.555 0.353 626 H GLU 75 HN GLU 75 -5.283 5.540 -2.735 627 HA GLU 75 HA GLU 75 -6.532 7.450 -4.591 628 HB2 GLU 75 HB2 GLU 75 -4.424 8.419 -3.835 629 HB3 GLU 75 HB1 GLU 75 -3.569 6.942 -4.257 630 HG2 GLU 75 HG2 GLU 75 -3.595 7.391 -6.483 631 HG3 GLU 75 HG1 GLU 75 -5.105 8.298 -6.396 632 H PHE 76 HN PHE 76 -7.548 6.168 -6.012 633 HA PHE 76 HA PHE 76 -6.640 3.553 -6.687 634 HB2 PHE 76 HB2 PHE 76 -8.827 5.321 -7.778 635 HB3 PHE 76 HB1 PHE 76 -8.487 3.726 -8.438 636 HD1 PHE 76 HD2 PHE 76 -8.117 1.968 -6.272 637 HD2 PHE 76 HD1 PHE 76 -10.713 5.335 -6.504 638 HE1 PHE 76 HE2 PHE 76 -9.577 0.958 -4.568 639 HE2 PHE 76 HE1 PHE 76 -12.175 4.330 -4.802 640 HZ PHE 76 HZ PHE 76 -11.610 2.139 -3.834 641 H ASP 77 HN ASP 77 -6.081 2.831 -8.791 642 HA ASP 77 HA ASP 77 -4.104 4.456 -10.035 643 HB2 ASP 77 HB2 ASP 77 -3.767 2.576 -11.540 644 HB3 ASP 77 HB1 ASP 77 -3.941 1.988 -9.891 645 H LYS 78 HN LYS 78 -4.374 3.938 -12.741 646 HA LYS 78 HA LYS 78 -6.762 5.517 -13.435 647 HB2 LYS 78 HB2 LYS 78 -4.850 5.771 -15.501 648 HB3 LYS 78 HB1 LYS 78 -5.402 7.010 -14.384 649 HG2 LYS 78 HG2 LYS 78 -3.173 5.102 -13.731 650 HG3 LYS 78 HG1 LYS 78 -2.911 6.656 -14.522 651 HD2 LYS 78 HD2 LYS 78 -4.533 7.262 -12.355 652 HD3 LYS 78 HD1 LYS 78 -3.406 6.057 -11.729 653 HE2 LYS 78 HE2 LYS 78 -2.095 7.867 -11.403 654 HE3 LYS 78 HE1 LYS 78 -1.698 7.612 -13.100 655 HZ1 LYS 78 HZ1 LYS 78 -3.719 9.503 -12.026 656 HZ2 LYS 78 HZ2 LYS 78 -3.457 9.211 -13.672 657 HZ3 LYS 78 HZ3 LYS 78 -2.235 9.907 -12.732 658 H GLY 79 HN GLY 79 -5.331 2.520 -13.758 659 HA2 GLY 79 HA2 GLY 79 -6.285 2.023 -16.462 660 HA3 GLY 79 HA1 GLY 79 -5.399 0.898 -15.447 661 H GLN 80 HN GLN 80 -6.533 -0.332 -13.890 662 HA GLN 80 HA GLN 80 -9.343 -0.723 -14.598 663 HB2 GLN 80 HB2 GLN 80 -9.135 -2.916 -13.625 664 HB3 GLN 80 HB1 GLN 80 -7.790 -2.642 -14.721 665 HG2 GLN 80 HG2 GLN 80 -6.391 -2.050 -12.749 666 HG3 GLN 80 HG1 GLN 80 -7.734 -2.546 -11.720 667 HE21 GLN 80 HE21 GLN 80 -6.308 -4.111 -10.815 668 HE22 GLN 80 HE22 GLN 80 -6.002 -5.598 -11.641 669 H ARG 81 HN ARG 81 -7.311 -0.464 -11.706 670 HA ARG 81 HA ARG 81 -7.757 0.499 -9.670 671 HB2 ARG 81 HB2 ARG 81 -10.601 0.892 -10.604 672 HB3 ARG 81 HB1 ARG 81 -9.838 1.633 -9.208 673 HG2 ARG 81 HG2 ARG 81 -8.174 2.572 -10.998 674 HG3 ARG 81 HG1 ARG 81 -9.517 2.261 -12.099 675 HD2 ARG 81 HD2 ARG 81 -10.648 3.514 -9.865 676 HD3 ARG 81 HD1 ARG 81 -9.159 4.397 -10.198 677 HE ARG 81 HE ARG 81 -10.677 3.951 -12.567 678 HH11 ARG 81 HH11 ARG 81 -10.459 5.970 -9.728 679 HH12 ARG 81 HH12 ARG 81 -11.249 7.319 -10.473 680 HH21 ARG 81 HH21 ARG 81 -11.715 5.726 -13.549 681 HH22 ARG 81 HH22 ARG 81 -11.963 7.179 -12.641 682 H THR 82 HN THR 82 -9.525 -2.065 -11.087 683 HA THR 82 HA THR 82 -9.734 -3.364 -8.484 684 HB THR 82 HB THR 82 -12.044 -4.260 -9.378 685 HG1 THR 82 HG1 THR 82 -13.147 -2.620 -10.527 686 HG21 THR 82 HG21 THR 82 -11.907 -3.046 -7.316 687 HG22 THR 82 HG22 THR 82 -13.251 -2.422 -8.273 688 HG23 THR 82 HG23 THR 82 -11.739 -1.519 -8.183 689 H ASP 83 HN ASP 83 -8.935 -5.365 -8.613 690 HA ASP 83 HA ASP 83 -7.974 -6.407 -11.059 691 HB2 ASP 83 HB2 ASP 83 -8.170 -7.499 -8.265 692 HB3 ASP 83 HB1 ASP 83 -7.615 -8.516 -9.592 693 H LYS 84 HN LYS 84 -9.685 -8.721 -9.096 694 HA LYS 84 HA LYS 84 -11.598 -9.122 -11.302 695 HB2 LYS 84 HB2 LYS 84 -11.275 -11.518 -9.767 696 HB3 LYS 84 HB1 LYS 84 -10.960 -11.257 -11.477 697 HG2 LYS 84 HG2 LYS 84 -8.961 -10.519 -9.365 698 HG3 LYS 84 HG1 LYS 84 -9.052 -12.142 -10.052 699 HD2 LYS 84 HD2 LYS 84 -8.625 -11.286 -12.260 700 HD3 LYS 84 HD1 LYS 84 -8.701 -9.624 -11.674 701 HE2 LYS 84 HE2 LYS 84 -6.570 -9.663 -11.024 702 HE3 LYS 84 HE1 LYS 84 -6.781 -11.199 -10.186 703 HZ1 LYS 84 HZ1 LYS 84 -6.532 -12.328 -12.331 704 HZ2 LYS 84 HZ2 LYS 84 -5.160 -11.425 -11.931 705 HZ3 LYS 84 HZ3 LYS 84 -6.248 -10.840 -13.086 706 H TYR 85 HN TYR 85 -11.106 -10.009 -7.891 707 HA TYR 85 HA TYR 85 -13.838 -10.339 -7.310 708 HB2 TYR 85 HB2 TYR 85 -11.311 -10.248 -5.810 709 HB3 TYR 85 HB1 TYR 85 -12.707 -9.703 -4.889 710 HD1 TYR 85 HD1 TYR 85 -12.668 -12.323 -7.512 711 HD2 TYR 85 HD2 TYR 85 -12.953 -11.473 -3.354 712 HE1 TYR 85 HE1 TYR 85 -13.280 -14.666 -7.082 713 HE2 TYR 85 HE2 TYR 85 -13.566 -13.813 -2.911 714 HH TYR 85 HH TYR 85 -13.134 -16.272 -5.098 715 H GLY 86 HN GLY 86 -11.926 -7.547 -7.743 716 HA2 GLY 86 HA2 GLY 86 -12.988 -5.412 -8.004 717 HA3 GLY 86 HA1 GLY 86 -14.138 -5.875 -6.760 718 H ARG 87 HN ARG 87 -10.887 -6.729 -6.143 719 HA ARG 87 HA ARG 87 -10.665 -5.414 -3.737 720 HB2 ARG 87 HB2 ARG 87 -9.057 -7.074 -5.248 721 HB3 ARG 87 HB1 ARG 87 -8.109 -5.598 -5.147 722 HG2 ARG 87 HG2 ARG 87 -7.368 -6.577 -3.255 723 HG3 ARG 87 HG1 ARG 87 -8.813 -5.821 -2.580 724 HD2 ARG 87 HD2 ARG 87 -8.510 -8.226 -1.964 725 HD3 ARG 87 HD1 ARG 87 -10.045 -7.853 -2.743 726 HE ARG 87 HE ARG 87 -9.377 -9.050 -4.616 727 HH11 ARG 87 HH11 ARG 87 -6.776 -8.878 -2.287 728 HH12 ARG 87 HH12 ARG 87 -5.849 -10.124 -3.050 729 HH21 ARG 87 HH21 ARG 87 -8.154 -10.685 -5.614 730 HH22 ARG 87 HH22 ARG 87 -6.630 -11.149 -4.936 731 H GLY 88 HN GLY 88 -9.299 -3.592 -3.097 732 HA2 GLY 88 HA2 GLY 88 -9.758 -1.342 -4.879 733 HA3 GLY 88 HA1 GLY 88 -9.274 -1.252 -3.197 734 H LEU 89 HN LEU 89 -8.266 -1.090 -6.420 735 HA LEU 89 HA LEU 89 -5.465 -1.579 -5.891 736 HB2 LEU 89 HB2 LEU 89 -6.992 -0.670 -8.316 737 HB3 LEU 89 HB1 LEU 89 -5.243 -0.769 -8.288 738 HG LEU 89 HG LEU 89 -6.530 -2.726 -9.296 739 HD11 LEU 89 HD11 LEU 89 -4.181 -2.881 -8.854 740 HD12 LEU 89 HD12 LEU 89 -4.953 -4.376 -8.324 741 HD13 LEU 89 HD13 LEU 89 -4.479 -3.159 -7.139 742 HD21 LEU 89 HD21 LEU 89 -6.874 -3.520 -6.420 743 HD22 LEU 89 HD22 LEU 89 -7.459 -4.357 -7.857 744 HD23 LEU 89 HD23 LEU 89 -8.168 -2.812 -7.385 745 H ALA 90 HN ALA 90 -5.588 0.137 -4.145 746 HA ALA 90 HA ALA 90 -4.667 2.664 -5.293 747 HB1 ALA 90 HB1 ALA 90 -6.890 2.390 -3.285 748 HB2 ALA 90 HB2 ALA 90 -6.925 3.205 -4.847 749 HB3 ALA 90 HB3 ALA 90 -5.991 3.889 -3.519 750 H TYR 91 HN TYR 91 -3.815 4.111 -3.452 751 HA TYR 91 HA TYR 91 -2.146 2.423 -1.734 752 HB2 TYR 91 HB2 TYR 91 -1.702 5.360 -2.189 753 HB3 TYR 91 HB1 TYR 91 -0.535 4.132 -1.718 754 HD1 TYR 91 HD2 TYR 91 -2.677 5.211 -4.569 755 HD2 TYR 91 HD1 TYR 91 0.819 3.130 -3.330 756 HE1 TYR 91 HE2 TYR 91 -1.995 4.972 -6.919 757 HE2 TYR 91 HE1 TYR 91 1.513 2.889 -5.675 758 HH TYR 91 HH TYR 91 1.135 3.905 -7.823 759 H ILE 92 HN ILE 92 -2.250 2.535 0.443 760 HA ILE 92 HA ILE 92 -4.395 4.159 1.594 761 HB ILE 92 HB ILE 92 -2.727 2.025 2.928 762 HG12 ILE 92 HG12 ILE 92 -4.960 0.724 2.627 763 HG13 ILE 92 HG11 ILE 92 -5.281 1.892 1.347 764 HG21 ILE 92 HG21 ILE 92 -4.533 1.979 4.573 765 HG22 ILE 92 HG22 ILE 92 -5.352 3.282 3.713 766 HG23 ILE 92 HG23 ILE 92 -3.791 3.577 4.480 767 HD11 ILE 92 HD11 ILE 92 -3.932 -0.479 1.078 768 HD12 ILE 92 HD12 ILE 92 -2.636 0.714 1.153 769 HD13 ILE 92 HD13 ILE 92 -3.905 0.866 -0.062 770 H TYR 93 HN TYR 93 -4.039 5.941 2.751 771 HA TYR 93 HA TYR 93 -1.269 6.584 3.486 772 HB2 TYR 93 HB2 TYR 93 -3.642 8.435 3.191 773 HB3 TYR 93 HB1 TYR 93 -2.005 8.927 3.583 774 HD1 TYR 93 HD2 TYR 93 -3.006 6.452 0.989 775 HD2 TYR 93 HD1 TYR 93 -1.515 10.349 1.794 776 HE1 TYR 93 HE2 TYR 93 -2.565 6.761 -1.399 777 HE2 TYR 93 HE1 TYR 93 -1.055 10.669 -0.599 778 HH TYR 93 HH TYR 93 -0.726 9.431 -2.596 779 H ALA 94 HN ALA 94 -0.864 7.646 5.503 780 HA ALA 94 HA ALA 94 -2.931 7.381 7.553 781 HB1 ALA 94 HB1 ALA 94 -0.691 6.507 8.894 782 HB2 ALA 94 HB2 ALA 94 -0.557 5.706 7.329 783 HB3 ALA 94 HB3 ALA 94 -2.007 5.489 8.308 784 H ASP 95 HN ASP 95 -3.085 9.335 8.434 785 HA ASP 95 HA ASP 95 -2.542 11.302 9.435 786 HB2 ASP 95 HB2 ASP 95 0.296 10.266 9.546 787 HB3 ASP 95 HB1 ASP 95 -0.402 11.553 10.524 788 H GLY 96 HN GLY 96 -1.895 10.580 6.431 789 HA2 GLY 96 HA2 GLY 96 -1.768 12.388 4.826 790 HA3 GLY 96 HA1 GLY 96 -0.630 13.188 5.895 791 H LYS 97 HN LYS 97 -0.100 9.840 5.612 792 HA LYS 97 HA LYS 97 1.841 10.248 3.456 793 HB2 LYS 97 HB2 LYS 97 2.372 9.414 6.254 794 HB3 LYS 97 HB1 LYS 97 3.251 8.561 4.993 795 HG2 LYS 97 HG2 LYS 97 4.242 10.569 4.208 796 HG3 LYS 97 HG1 LYS 97 3.184 11.555 5.221 797 HD2 LYS 97 HD2 LYS 97 4.743 9.570 6.706 798 HD3 LYS 97 HD1 LYS 97 5.726 10.778 5.876 799 HE2 LYS 97 HE2 LYS 97 4.871 12.520 7.109 800 HE3 LYS 97 HE1 LYS 97 3.360 11.677 7.448 801 HZ1 LYS 97 HZ1 LYS 97 4.915 10.106 8.784 802 HZ2 LYS 97 HZ2 LYS 97 4.413 11.571 9.463 803 HZ3 LYS 97 HZ3 LYS 97 5.960 11.438 8.792 804 H MET 98 HN MET 98 1.964 8.602 2.021 805 HA MET 98 HA MET 98 -0.006 6.562 2.116 806 HB2 MET 98 HB2 MET 98 2.302 6.269 0.264 807 HB3 MET 98 HB1 MET 98 0.583 6.033 -0.026 808 HG2 MET 98 HG2 MET 98 0.671 7.954 -1.131 809 HG3 MET 98 HG1 MET 98 0.725 8.720 0.456 810 HE1 MET 98 HE1 MET 98 2.565 10.549 -2.108 811 HE2 MET 98 HE2 MET 98 3.043 11.100 -0.503 812 HE3 MET 98 HE3 MET 98 1.383 10.587 -0.800 813 H VAL 99 HN VAL 99 0.075 4.943 3.476 814 HA VAL 99 HA VAL 99 2.254 3.972 4.868 815 HB VAL 99 HB VAL 99 -0.046 2.206 4.055 816 HG11 VAL 99 HG11 VAL 99 1.842 1.235 5.342 817 HG12 VAL 99 HG12 VAL 99 0.298 1.167 6.193 818 HG13 VAL 99 HG13 VAL 99 1.497 2.381 6.637 819 HG21 VAL 99 HG21 VAL 99 -1.350 3.914 4.785 820 HG22 VAL 99 HG22 VAL 99 -0.055 4.638 5.738 821 HG23 VAL 99 HG23 VAL 99 -0.930 3.239 6.360 822 H ASN 100 HN ASN 100 0.915 2.817 1.793 823 HA ASN 100 HA ASN 100 2.405 0.537 1.401 824 HB2 ASN 100 HB2 ASN 100 1.735 2.566 -0.741 825 HB3 ASN 100 HB1 ASN 100 2.049 0.848 -0.977 826 HD21 ASN 100 HD21 ASN 100 -0.035 0.850 -2.028 827 HD22 ASN 100 HD22 ASN 100 -1.469 0.716 -1.075 828 H GLU 101 HN GLU 101 3.340 3.891 0.744 829 HA GLU 101 HA GLU 101 5.807 3.367 -0.476 830 HB2 GLU 101 HB2 GLU 101 4.388 5.612 0.010 831 HB3 GLU 101 HB1 GLU 101 5.623 5.766 1.251 832 HG2 GLU 101 HG2 GLU 101 6.382 5.184 -1.580 833 HG3 GLU 101 HG1 GLU 101 6.011 6.829 -1.067 834 H ALA 102 HN ALA 102 4.929 3.801 2.923 835 HA ALA 102 HA ALA 102 7.489 3.826 4.030 836 HB1 ALA 102 HB1 ALA 102 4.794 3.076 5.062 837 HB2 ALA 102 HB2 ALA 102 5.858 4.397 5.544 838 HB3 ALA 102 HB3 ALA 102 6.219 2.746 6.045 839 H LEU 103 HN LEU 103 5.296 1.029 3.691 840 HA LEU 103 HA LEU 103 7.060 -0.925 4.597 841 HB2 LEU 103 HB2 LEU 103 4.831 -1.127 2.572 842 HB3 LEU 103 HB1 LEU 103 5.655 -2.510 3.266 843 HG LEU 103 HG LEU 103 4.602 -0.699 5.297 844 HD11 LEU 103 HD11 LEU 103 2.802 -1.757 3.166 845 HD12 LEU 103 HD12 LEU 103 2.763 -0.206 4.004 846 HD13 LEU 103 HD13 LEU 103 2.229 -1.670 4.832 847 HD21 LEU 103 HD21 LEU 103 4.234 -3.634 4.713 848 HD22 LEU 103 HD22 LEU 103 3.712 -2.812 6.182 849 HD23 LEU 103 HD23 LEU 103 5.429 -2.923 5.797 850 H VAL 104 HN VAL 104 6.633 0.480 1.407 851 HA VAL 104 HA VAL 104 8.309 -1.320 0.005 852 HB VAL 104 HB VAL 104 7.584 1.537 -0.667 853 HG11 VAL 104 HG11 VAL 104 9.505 0.908 -1.946 854 HG12 VAL 104 HG12 VAL 104 8.096 0.832 -3.004 855 HG13 VAL 104 HG13 VAL 104 8.789 -0.652 -2.349 856 HG21 VAL 104 HG21 VAL 104 5.639 0.814 -1.547 857 HG22 VAL 104 HG22 VAL 104 5.855 -0.515 -0.408 858 HG23 VAL 104 HG23 VAL 104 6.332 -0.713 -2.095 859 H ARG 105 HN ARG 105 8.888 1.847 1.500 860 HA ARG 105 HA ARG 105 11.650 1.875 0.726 861 HB2 ARG 105 HB2 ARG 105 11.799 3.974 1.809 862 HB3 ARG 105 HB1 ARG 105 10.212 3.923 1.058 863 HG2 ARG 105 HG2 ARG 105 9.264 4.373 3.002 864 HG3 ARG 105 HG1 ARG 105 9.958 2.907 3.692 865 HD2 ARG 105 HD2 ARG 105 11.737 5.262 3.415 866 HD3 ARG 105 HD1 ARG 105 10.485 5.334 4.654 867 HE ARG 105 HE ARG 105 11.754 2.889 4.942 868 HH11 ARG 105 HH11 ARG 105 12.602 6.267 5.157 869 HH12 ARG 105 HH12 ARG 105 13.851 6.009 6.329 870 HH21 ARG 105 HH21 ARG 105 13.395 2.546 6.483 871 HH22 ARG 105 HH22 ARG 105 14.302 3.895 7.081 872 H GLN 106 HN GLN 106 9.847 0.794 3.523 873 HA GLN 106 HA GLN 106 12.119 0.703 5.271 874 HB2 GLN 106 HB2 GLN 106 9.306 0.247 5.493 875 HB3 GLN 106 HB1 GLN 106 10.150 -1.145 6.148 876 HG2 GLN 106 HG2 GLN 106 10.428 -0.019 8.026 877 HG3 GLN 106 HG1 GLN 106 11.501 1.077 7.157 878 HE21 GLN 106 HE21 GLN 106 9.905 2.519 5.605 879 HE22 GLN 106 HE22 GLN 106 8.748 3.404 6.534 880 H GLY 107 HN GLY 107 10.355 -1.742 3.387 881 HA2 GLY 107 HA2 GLY 107 11.959 -3.339 2.263 882 HA3 GLY 107 HA1 GLY 107 12.594 -3.612 3.876 883 H LEU 108 HN LEU 108 9.636 -3.323 4.789 884 HA LEU 108 HA LEU 108 9.081 -6.031 5.091 885 HB2 LEU 108 HB2 LEU 108 6.900 -3.971 4.956 886 HB3 LEU 108 HB1 LEU 108 6.990 -5.404 5.961 887 HG LEU 108 HG LEU 108 8.493 -2.815 6.312 888 HD11 LEU 108 HD11 LEU 108 6.552 -2.455 7.417 889 HD12 LEU 108 HD12 LEU 108 7.391 -3.354 8.682 890 HD13 LEU 108 HD13 LEU 108 6.229 -4.175 7.641 891 HD21 LEU 108 HD21 LEU 108 9.505 -3.927 8.308 892 HD22 LEU 108 HD22 LEU 108 10.090 -4.532 6.760 893 HD23 LEU 108 HD23 LEU 108 8.912 -5.466 7.682 894 H ALA 109 HN ALA 109 8.504 -3.915 2.422 895 HA ALA 109 HA ALA 109 7.415 -6.153 0.892 896 HB1 ALA 109 HB1 ALA 109 5.363 -5.225 1.187 897 HB2 ALA 109 HB2 ALA 109 5.895 -4.231 -0.168 898 HB3 ALA 109 HB3 ALA 109 6.011 -3.612 1.479 899 H LYS 110 HN LYS 110 7.235 -5.406 -1.523 900 HA LYS 110 HA LYS 110 9.367 -3.533 -2.222 901 HB2 LYS 110 HB2 LYS 110 10.236 -5.219 -3.900 902 HB3 LYS 110 HB1 LYS 110 10.588 -5.565 -2.212 903 HG2 LYS 110 HG2 LYS 110 8.274 -6.910 -2.494 904 HG3 LYS 110 HG1 LYS 110 8.910 -7.025 -4.137 905 HD2 LYS 110 HD2 LYS 110 10.677 -8.317 -3.508 906 HD3 LYS 110 HD1 LYS 110 10.790 -7.575 -1.912 907 HE2 LYS 110 HE2 LYS 110 9.014 -8.873 -1.068 908 HE3 LYS 110 HE1 LYS 110 8.506 -9.368 -2.683 909 HZ1 LYS 110 HZ1 LYS 110 10.064 -10.975 -2.778 910 HZ2 LYS 110 HZ2 LYS 110 9.971 -10.895 -1.091 911 HZ3 LYS 110 HZ3 LYS 110 11.214 -10.092 -1.908 912 H VAL 111 HN VAL 111 9.310 -2.841 -4.451 913 HA VAL 111 HA VAL 111 6.623 -2.580 -5.412 914 HB VAL 111 HB VAL 111 9.267 -1.570 -6.450 915 HG11 VAL 111 HG11 VAL 111 7.882 -1.919 -8.385 916 HG12 VAL 111 HG12 VAL 111 7.948 -0.193 -8.031 917 HG13 VAL 111 HG13 VAL 111 6.516 -1.128 -7.601 918 HG21 VAL 111 HG21 VAL 111 8.164 -0.623 -4.355 919 HG22 VAL 111 HG22 VAL 111 6.932 0.023 -5.438 920 HG23 VAL 111 HG23 VAL 111 8.614 0.522 -5.617 921 H ALA 112 HN ALA 112 5.722 -4.289 -6.382 922 HA ALA 112 HA ALA 112 7.051 -5.396 -8.734 923 HB1 ALA 112 HB1 ALA 112 6.059 -7.693 -7.791 924 HB2 ALA 112 HB2 ALA 112 6.433 -6.897 -6.262 925 HB3 ALA 112 HB3 ALA 112 7.704 -7.150 -7.458 926 H TYR 113 HN TYR 113 5.517 -6.846 -9.974 927 HA TYR 113 HA TYR 113 3.604 -6.997 -11.196 928 HB2 TYR 113 HB2 TYR 113 2.442 -6.739 -8.419 929 HB3 TYR 113 HB1 TYR 113 1.491 -7.159 -9.840 930 HD1 TYR 113 HD2 TYR 113 4.168 -8.297 -7.576 931 HD2 TYR 113 HD1 TYR 113 1.576 -9.359 -10.777 932 HE1 TYR 113 HE2 TYR 113 4.755 -10.664 -7.257 933 HE2 TYR 113 HE1 TYR 113 2.155 -11.729 -10.468 934 HH TYR 113 HH TYR 113 4.044 -13.055 -9.516 935 H VAL 114 HN VAL 114 4.416 -4.730 -11.883 936 HA VAL 114 HA VAL 114 2.288 -2.763 -11.347 937 HB VAL 114 HB VAL 114 4.421 -1.925 -10.573 938 HG11 VAL 114 HG11 VAL 114 5.441 -3.286 -12.838 939 HG12 VAL 114 HG12 VAL 114 6.332 -2.475 -11.549 940 HG13 VAL 114 HG13 VAL 114 5.866 -1.582 -12.997 941 HG21 VAL 114 HG21 VAL 114 3.518 -0.631 -13.143 942 HG22 VAL 114 HG22 VAL 114 4.607 0.120 -11.975 943 HG23 VAL 114 HG23 VAL 114 2.952 -0.272 -11.512 944 H TYR 115 HN TYR 115 0.882 -3.284 -12.971 945 HA TYR 115 HA TYR 115 1.902 -3.387 -15.715 946 HB2 TYR 115 HB2 TYR 115 -0.538 -4.081 -16.188 947 HB3 TYR 115 HB1 TYR 115 0.501 -5.227 -15.353 948 HD1 TYR 115 HD2 TYR 115 -1.716 -2.376 -14.414 949 HD2 TYR 115 HD1 TYR 115 -0.505 -6.372 -13.629 950 HE1 TYR 115 HE2 TYR 115 -3.353 -2.502 -12.581 951 HE2 TYR 115 HE1 TYR 115 -2.136 -6.515 -11.793 952 HH TYR 115 HH TYR 115 -3.306 -4.826 -10.235 953 H LYS 116 HN LYS 116 0.741 -2.242 -17.405 954 HA LYS 116 HA LYS 116 -0.125 0.402 -16.479 955 HB2 LYS 116 HB2 LYS 116 0.641 -0.375 -19.290 956 HB3 LYS 116 HB1 LYS 116 0.542 1.243 -18.612 957 HG2 LYS 116 HG2 LYS 116 2.550 -0.867 -17.859 958 HG3 LYS 116 HG1 LYS 116 2.851 0.544 -18.876 959 HD2 LYS 116 HD2 LYS 116 1.894 0.704 -16.022 960 HD3 LYS 116 HD1 LYS 116 3.594 0.784 -16.492 961 HE2 LYS 116 HE2 LYS 116 1.450 2.655 -17.493 962 HE3 LYS 116 HE1 LYS 116 2.536 3.010 -16.149 963 HZ1 LYS 116 HZ1 LYS 116 4.357 2.467 -17.891 964 HZ2 LYS 116 HZ2 LYS 116 3.613 3.985 -17.909 965 HZ3 LYS 116 HZ3 LYS 116 3.141 2.799 -19.019 966 HA PRO 117 HA PRO 117 -0.846 2.133 -17.823 967 HB2 PRO 117 HB2 PRO 117 -2.929 3.793 -17.876 968 HB3 PRO 117 HB1 PRO 117 -2.358 3.002 -19.351 969 HG2 PRO 117 HG2 PRO 117 -4.708 2.341 -17.634 970 HG3 PRO 117 HG1 PRO 117 -4.562 2.300 -19.399 971 HD2 PRO 117 HD2 PRO 117 -4.354 0.098 -17.707 972 HD3 PRO 117 HD1 PRO 117 -3.770 0.168 -19.380 973 H ASN 118 HN ASN 118 -0.076 2.162 -15.771 974 HA ASN 118 HA ASN 118 -1.717 3.332 -13.715 975 HB2 ASN 118 HB2 ASN 118 -0.503 0.610 -13.194 976 HB3 ASN 118 HB1 ASN 118 -1.459 1.573 -12.073 977 HD21 ASN 118 HD21 ASN 118 -1.544 -0.305 -15.024 978 HD22 ASN 118 HD22 ASN 118 -3.243 -0.621 -14.997 979 H ASN 119 HN ASN 119 -0.373 4.943 -13.160 980 HA ASN 119 HA ASN 119 2.225 4.269 -12.079 981 HB2 ASN 119 HB2 ASN 119 3.360 6.034 -13.495 982 HB3 ASN 119 HB1 ASN 119 2.911 4.555 -14.339 983 HD21 ASN 119 HD21 ASN 119 2.231 4.980 -16.298 984 HD22 ASN 119 HD22 ASN 119 1.233 6.309 -16.770 985 H THR 120 HN THR 120 -0.280 5.387 -11.072 986 HA THR 120 HA THR 120 -0.266 8.126 -10.697 987 HB THR 120 HB THR 120 -0.953 6.441 -8.344 988 HG1 THR 120 HG1 THR 120 -1.881 5.055 -9.631 989 HG21 THR 120 HG21 THR 120 -3.085 7.990 -9.489 990 HG22 THR 120 HG22 THR 120 -1.650 8.981 -9.224 991 HG23 THR 120 HG23 THR 120 -2.359 8.080 -7.885 992 H HIS 121 HN HIS 121 1.347 5.639 -8.735 993 HA HIS 121 HA HIS 121 3.093 7.753 -7.658 994 HB2 HIS 121 HB2 HIS 121 1.594 5.612 -6.274 995 HB3 HIS 121 HB1 HIS 121 3.249 5.865 -5.728 996 HD1 HIS 121 HD1 HIS 121 1.692 8.953 -6.886 997 HD2 HIS 121 HD2 HIS 121 1.901 6.821 -3.325 998 HE1 HIS 121 HE1 HIS 121 0.988 10.568 -5.093 999 HE2 HIS 121 HE2 HIS 121 1.228 9.288 -2.938 1000 H GLU 122 HN GLU 122 3.285 5.692 -9.943 1001 HA GLU 122 HA GLU 122 5.156 3.728 -9.333 1002 HB2 GLU 122 HB2 GLU 122 4.007 3.789 -11.474 1003 HB3 GLU 122 HB1 GLU 122 4.810 5.295 -11.896 1004 HG2 GLU 122 HG2 GLU 122 6.953 4.164 -11.951 1005 HG3 GLU 122 HG1 GLU 122 6.189 2.657 -11.450 1006 H GLN 123 HN GLN 123 5.785 6.975 -10.671 1007 HA GLN 123 HA GLN 123 8.577 6.839 -10.530 1008 HB2 GLN 123 HB2 GLN 123 6.851 9.309 -10.286 1009 HB3 GLN 123 HB1 GLN 123 8.547 9.266 -10.746 1010 HG2 GLN 123 HG2 GLN 123 6.591 7.713 -12.359 1011 HG3 GLN 123 HG1 GLN 123 6.647 9.466 -12.542 1012 HE21 GLN 123 HE21 GLN 123 8.643 6.558 -12.627 1013 HE22 GLN 123 HE22 GLN 123 9.779 7.154 -13.783 1014 H LEU 124 HN LEU 124 6.198 7.354 -8.080 1015 HA LEU 124 HA LEU 124 7.988 8.566 -6.183 1016 HB2 LEU 124 HB2 LEU 124 5.620 9.066 -6.083 1017 HB3 LEU 124 HB1 LEU 124 5.235 7.368 -5.880 1018 HG LEU 124 HG LEU 124 6.775 7.651 -3.730 1019 HD11 LEU 124 HD11 LEU 124 5.611 10.403 -4.121 1020 HD12 LEU 124 HD12 LEU 124 7.323 9.991 -4.223 1021 HD13 LEU 124 HD13 LEU 124 6.465 9.819 -2.692 1022 HD21 LEU 124 HD21 LEU 124 4.849 7.547 -2.504 1023 HD22 LEU 124 HD22 LEU 124 4.216 7.142 -4.099 1024 HD23 LEU 124 HD23 LEU 124 4.035 8.779 -3.468 1025 H LEU 125 HN LEU 125 6.457 5.370 -6.524 1026 HA LEU 125 HA LEU 125 7.879 4.250 -4.310 1027 HB2 LEU 125 HB2 LEU 125 6.027 3.239 -6.404 1028 HB3 LEU 125 HB1 LEU 125 7.057 2.067 -5.602 1029 HG LEU 125 HG LEU 125 6.044 3.427 -3.465 1030 HD11 LEU 125 HD11 LEU 125 3.476 3.213 -4.220 1031 HD12 LEU 125 HD12 LEU 125 4.194 3.760 -5.735 1032 HD13 LEU 125 HD13 LEU 125 4.386 4.724 -4.270 1033 HD21 LEU 125 HD21 LEU 125 6.178 1.033 -3.613 1034 HD22 LEU 125 HD22 LEU 125 4.938 0.998 -4.865 1035 HD23 LEU 125 HD23 LEU 125 4.518 1.484 -3.224 1036 H ARG 126 HN ARG 126 8.455 4.526 -7.737 1037 HA ARG 126 HA ARG 126 10.305 2.503 -8.148 1038 HB2 ARG 126 HB2 ARG 126 9.596 5.022 -9.451 1039 HB3 ARG 126 HB1 ARG 126 11.286 4.590 -9.671 1040 HG2 ARG 126 HG2 ARG 126 10.120 2.225 -10.211 1041 HG3 ARG 126 HG1 ARG 126 8.853 3.333 -10.742 1042 HD2 ARG 126 HD2 ARG 126 10.988 4.530 -11.840 1043 HD3 ARG 126 HD1 ARG 126 11.557 2.861 -11.842 1044 HE ARG 126 HE ARG 126 8.911 3.122 -12.894 1045 HH11 ARG 126 HH11 ARG 126 12.298 3.422 -13.675 1046 HH12 ARG 126 HH12 ARG 126 12.061 3.146 -15.368 1047 HH21 ARG 126 HH21 ARG 126 8.597 2.758 -15.119 1048 HH22 ARG 126 HH22 ARG 126 9.960 2.771 -16.189 1049 H LYS 127 HN LYS 127 10.680 5.603 -6.579 1050 HA LYS 127 HA LYS 127 13.554 5.426 -6.425 1051 HB2 LYS 127 HB2 LYS 127 11.863 7.246 -4.734 1052 HB3 LYS 127 HB1 LYS 127 13.496 7.503 -5.328 1053 HG2 LYS 127 HG2 LYS 127 11.090 7.383 -7.123 1054 HG3 LYS 127 HG1 LYS 127 11.711 8.878 -6.422 1055 HD2 LYS 127 HD2 LYS 127 13.005 9.005 -8.243 1056 HD3 LYS 127 HD1 LYS 127 13.964 7.726 -7.498 1057 HE2 LYS 127 HE2 LYS 127 13.451 6.353 -9.165 1058 HE3 LYS 127 HE1 LYS 127 11.735 6.529 -8.799 1059 HZ1 LYS 127 HZ1 LYS 127 12.624 7.182 -11.122 1060 HZ2 LYS 127 HZ2 LYS 127 13.111 8.610 -10.358 1061 HZ3 LYS 127 HZ3 LYS 127 11.478 8.172 -10.366 1062 H SER 128 HN SER 128 10.881 5.247 -4.087 1063 HA SER 128 HA SER 128 12.315 4.684 -1.798 1064 HB2 SER 128 HB2 SER 128 10.075 5.084 -1.397 1065 HB3 SER 128 HB1 SER 128 9.544 4.058 -2.728 1066 HG SER 128 HG SER 128 9.163 2.710 -1.143 1067 H GLU 129 HN GLU 129 11.106 2.413 -4.248 1068 HA GLU 129 HA GLU 129 11.947 0.067 -2.924 1069 HB2 GLU 129 HB2 GLU 129 10.308 -0.024 -4.723 1070 HB3 GLU 129 HB1 GLU 129 11.489 0.600 -5.866 1071 HG2 GLU 129 HG2 GLU 129 12.794 -1.583 -4.973 1072 HG3 GLU 129 HG1 GLU 129 11.123 -2.118 -4.808 1073 H ALA 130 HN ALA 130 13.387 1.690 -5.749 1074 HA ALA 130 HA ALA 130 15.744 0.223 -5.848 1075 HB1 ALA 130 HB1 ALA 130 16.036 3.039 -6.600 1076 HB2 ALA 130 HB2 ALA 130 14.657 2.222 -7.334 1077 HB3 ALA 130 HB3 ALA 130 16.284 1.575 -7.552 1078 H GLN 131 HN GLN 131 14.949 3.052 -3.908 1079 HA GLN 131 HA GLN 131 17.529 3.729 -3.069 1080 HB2 GLN 131 HB2 GLN 131 14.804 4.365 -2.268 1081 HB3 GLN 131 HB1 GLN 131 15.892 4.300 -0.892 1082 HG2 GLN 131 HG2 GLN 131 16.607 6.327 -1.377 1083 HG3 GLN 131 HG1 GLN 131 17.224 5.733 -2.919 1084 HE21 GLN 131 HE21 GLN 131 16.758 7.580 -4.049 1085 HE22 GLN 131 HE22 GLN 131 15.146 8.091 -4.405 1086 H ALA 132 HN ALA 132 15.124 1.629 -1.498 1087 HA ALA 132 HA ALA 132 16.954 0.842 0.566 1088 HB1 ALA 132 HB1 ALA 132 14.193 -0.051 -0.200 1089 HB2 ALA 132 HB2 ALA 132 14.697 0.883 1.207 1090 HB3 ALA 132 HB3 ALA 132 15.108 -0.827 1.092 1091 H LYS 133 HN LYS 133 16.048 -0.375 -2.567 1092 HA LYS 133 HA LYS 133 16.728 -3.041 -2.405 1093 HB2 LYS 133 HB2 LYS 133 16.795 -1.011 -4.593 1094 HB3 LYS 133 HB1 LYS 133 17.532 -2.580 -4.886 1095 HG2 LYS 133 HG2 LYS 133 14.661 -2.017 -4.186 1096 HG3 LYS 133 HG1 LYS 133 15.297 -2.625 -5.714 1097 HD2 LYS 133 HD2 LYS 133 15.441 -4.056 -3.070 1098 HD3 LYS 133 HD1 LYS 133 14.273 -4.396 -4.346 1099 HE2 LYS 133 HE2 LYS 133 16.771 -4.464 -5.594 1100 HE3 LYS 133 HE1 LYS 133 17.000 -5.297 -4.058 1101 HZ1 LYS 133 HZ1 LYS 133 14.832 -6.503 -4.731 1102 HZ2 LYS 133 HZ2 LYS 133 16.294 -6.979 -5.437 1103 HZ3 LYS 133 HZ3 LYS 133 15.223 -5.994 -6.298 1104 H LYS 134 HN LYS 134 18.881 -0.355 -3.304 1105 HA LYS 134 HA LYS 134 21.196 -1.925 -3.562 1106 HB2 LYS 134 HB2 LYS 134 22.290 0.038 -4.030 1107 HB3 LYS 134 HB1 LYS 134 20.628 0.503 -4.348 1108 HG2 LYS 134 HG2 LYS 134 21.090 2.264 -3.065 1109 HG3 LYS 134 HG1 LYS 134 20.859 1.150 -1.721 1110 HD2 LYS 134 HD2 LYS 134 23.534 0.917 -2.739 1111 HD3 LYS 134 HD1 LYS 134 23.173 2.606 -2.380 1112 HE2 LYS 134 HE2 LYS 134 22.295 1.773 -0.139 1113 HE3 LYS 134 HE1 LYS 134 23.075 0.240 -0.528 1114 HZ1 LYS 134 HZ1 LYS 134 24.804 1.200 0.512 1115 HZ2 LYS 134 HZ2 LYS 134 24.256 2.777 0.241 1116 HZ3 LYS 134 HZ3 LYS 134 25.067 1.943 -0.986 1117 H GLU 135 HN GLU 135 19.779 -0.342 -0.783 1118 HA GLU 135 HA GLU 135 22.132 -1.025 0.828 1119 HB2 GLU 135 HB2 GLU 135 20.444 0.236 2.574 1120 HB3 GLU 135 HB1 GLU 135 21.714 1.022 1.643 1121 HG2 GLU 135 HG2 GLU 135 20.184 1.802 0.030 1122 HG3 GLU 135 HG1 GLU 135 18.906 0.742 0.621 1123 H LYS 136 HN LYS 136 19.300 -2.516 -0.005 1124 HA LYS 136 HA LYS 136 17.892 -4.021 1.019 1125 HB2 LYS 136 HB2 LYS 136 20.566 -4.912 2.115 1126 HB3 LYS 136 HB1 LYS 136 19.121 -5.909 2.005 1127 HG2 LYS 136 HG2 LYS 136 19.205 -5.406 -0.507 1128 HG3 LYS 136 HG1 LYS 136 20.858 -4.874 -0.201 1129 HD2 LYS 136 HD2 LYS 136 21.322 -7.050 -0.627 1130 HD3 LYS 136 HD1 LYS 136 20.897 -7.239 1.075 1131 HE2 LYS 136 HE2 LYS 136 19.010 -8.364 0.604 1132 HE3 LYS 136 HE1 LYS 136 18.612 -7.321 -0.760 1133 HZ1 LYS 136 HZ1 LYS 136 20.290 -9.740 -0.703 1134 HZ2 LYS 136 HZ2 LYS 136 20.548 -8.570 -1.897 1135 HZ3 LYS 136 HZ3 LYS 136 19.042 -9.329 -1.770 1136 H LEU 137 HN LEU 137 17.217 -2.043 2.320 1137 HA LEU 137 HA LEU 137 17.999 -1.453 4.859 1138 HB2 LEU 137 HB2 LEU 137 15.465 -1.169 3.358 1139 HB3 LEU 137 HB1 LEU 137 15.366 -0.976 5.101 1140 HG LEU 137 HG LEU 137 17.091 0.624 3.212 1141 HD11 LEU 137 HD11 LEU 137 15.121 1.694 2.984 1142 HD12 LEU 137 HD12 LEU 137 15.567 2.403 4.537 1143 HD13 LEU 137 HD13 LEU 137 14.462 1.029 4.478 1144 HD21 LEU 137 HD21 LEU 137 18.436 0.728 5.029 1145 HD22 LEU 137 HD22 LEU 137 17.144 0.294 6.149 1146 HD23 LEU 137 HD23 LEU 137 17.262 1.943 5.537 1147 H ASN 138 HN ASN 138 14.778 -2.851 4.880 1148 HA ASN 138 HA ASN 138 15.437 -4.282 7.279 1149 HB2 ASN 138 HB2 ASN 138 12.852 -4.063 5.732 1150 HB3 ASN 138 HB1 ASN 138 13.017 -4.899 7.271 1151 HD21 ASN 138 HD21 ASN 138 11.349 -2.651 6.649 1152 HD22 ASN 138 HD22 ASN 138 11.837 -1.360 7.686 1153 H ILE 139 HN ILE 139 13.109 -6.009 5.487 1154 HA ILE 139 HA ILE 139 14.875 -8.305 5.401 1155 HB ILE 139 HB ILE 139 12.819 -9.563 4.783 1156 HG12 ILE 139 HG12 ILE 139 11.391 -6.948 5.302 1157 HG13 ILE 139 HG11 ILE 139 11.692 -7.593 3.692 1158 HG21 ILE 139 HG21 ILE 139 12.239 -9.782 6.955 1159 HG22 ILE 139 HG22 ILE 139 12.015 -8.047 7.184 1160 HG23 ILE 139 HG23 ILE 139 13.639 -8.737 7.201 1161 HD11 ILE 139 HD11 ILE 139 10.200 -9.338 3.979 1162 HD12 ILE 139 HD12 ILE 139 9.406 -7.991 4.793 1163 HD13 ILE 139 HD13 ILE 139 10.246 -9.220 5.737 1164 H TRP 140 HN TRP 140 15.897 -6.716 3.563 1165 HA TRP 140 HA TRP 140 14.718 -7.297 0.966 1166 HB2 TRP 140 HB2 TRP 140 17.202 -5.738 1.710 1167 HB3 TRP 140 HB1 TRP 140 16.555 -5.894 0.079 1168 HD1 TRP 140 HD1 TRP 140 15.767 -4.284 3.461 1169 HE1 TRP 140 HE1 TRP 140 14.090 -2.369 3.081 1170 HE3 TRP 140 HE3 TRP 140 14.785 -5.046 -1.488 1171 HZ2 TRP 140 HZ2 TRP 140 12.570 -1.316 0.967 1172 HZ3 TRP 140 HZ3 TRP 140 13.201 -3.539 -2.622 1173 HH2 TRP 140 HH2 TRP 140 12.114 -1.712 -1.418 Start of MODEL 9 1 H1 ALA 1 HT1 ALA 1 -16.613 29.545 -0.831 2 H2 ALA 1 HT2 ALA 1 -18.249 29.803 -1.279 3 H3 ALA 1 HT3 ALA 1 -16.983 30.490 -2.213 4 HA ALA 1 HA ALA 1 -16.214 28.115 -2.514 5 HB1 ALA 1 HB1 ALA 1 -17.596 26.410 -1.988 6 HB2 ALA 1 HB2 ALA 1 -19.054 27.349 -2.306 7 HB3 ALA 1 HB3 ALA 1 -18.189 27.551 -0.783 8 H THR 2 HN THR 2 -16.206 27.709 -4.653 9 HA THR 2 HA THR 2 -18.430 28.412 -6.345 10 HB THR 2 HB THR 2 -16.600 29.771 -7.778 11 HG1 THR 2 HG1 THR 2 -15.996 30.418 -5.087 12 HG21 THR 2 HG21 THR 2 -17.578 31.820 -7.056 13 HG22 THR 2 HG22 THR 2 -18.131 31.085 -5.551 14 HG23 THR 2 HG23 THR 2 -18.840 30.588 -7.088 15 H SER 3 HN SER 3 -17.817 28.012 -8.718 16 HA SER 3 HA SER 3 -16.837 25.377 -8.942 17 HB2 SER 3 HB2 SER 3 -17.232 27.423 -11.139 18 HB3 SER 3 HB1 SER 3 -17.098 25.678 -11.355 19 HG SER 3 HG SER 3 -19.260 26.197 -11.331 20 H THR 4 HN THR 4 -14.922 24.553 -9.709 21 HA THR 4 HA THR 4 -12.837 26.170 -10.779 22 HB THR 4 HB THR 4 -12.541 26.913 -8.515 23 HG1 THR 4 HG1 THR 4 -10.630 24.877 -8.986 24 HG21 THR 4 HG21 THR 4 -11.789 24.981 -6.865 25 HG22 THR 4 HG22 THR 4 -12.948 24.067 -7.832 26 HG23 THR 4 HG23 THR 4 -13.462 25.528 -6.987 27 H LYS 5 HN LYS 5 -11.469 24.933 -11.929 28 HA LYS 5 HA LYS 5 -11.874 22.059 -11.873 29 HB2 LYS 5 HB2 LYS 5 -10.342 22.116 -13.879 30 HB3 LYS 5 HB1 LYS 5 -11.848 23.007 -14.053 31 HG2 LYS 5 HG2 LYS 5 -9.741 24.689 -13.014 32 HG3 LYS 5 HG1 LYS 5 -9.283 23.942 -14.546 33 HD2 LYS 5 HD2 LYS 5 -11.428 24.739 -15.513 34 HD3 LYS 5 HD1 LYS 5 -11.754 25.584 -13.999 35 HE2 LYS 5 HE2 LYS 5 -9.383 26.053 -15.803 36 HE3 LYS 5 HE1 LYS 5 -10.813 27.079 -15.703 37 HZ1 LYS 5 HZ1 LYS 5 -8.850 26.565 -13.535 38 HZ2 LYS 5 HZ2 LYS 5 -10.274 27.455 -13.344 39 HZ3 LYS 5 HZ3 LYS 5 -9.062 28.014 -14.383 40 H LYS 6 HN LYS 6 -10.784 22.521 -9.552 41 HA LYS 6 HA LYS 6 -7.880 22.185 -9.798 42 HB2 LYS 6 HB2 LYS 6 -9.082 23.879 -8.197 43 HB3 LYS 6 HB1 LYS 6 -9.300 22.465 -7.176 44 HG2 LYS 6 HG2 LYS 6 -7.246 22.700 -6.396 45 HG3 LYS 6 HG1 LYS 6 -6.594 22.516 -8.025 46 HD2 LYS 6 HD2 LYS 6 -7.695 25.144 -7.089 47 HD3 LYS 6 HD1 LYS 6 -6.041 24.663 -6.704 48 HE2 LYS 6 HE2 LYS 6 -5.346 24.803 -8.877 49 HE3 LYS 6 HE1 LYS 6 -6.942 24.425 -9.525 50 HZ1 LYS 6 HZ1 LYS 6 -7.675 26.609 -9.150 51 HZ2 LYS 6 HZ2 LYS 6 -6.136 26.776 -9.831 52 HZ3 LYS 6 HZ3 LYS 6 -6.351 26.990 -8.168 53 H LEU 7 HN LEU 7 -6.842 20.577 -8.377 54 HA LEU 7 HA LEU 7 -7.853 18.005 -8.799 55 HB2 LEU 7 HB2 LEU 7 -5.695 19.115 -7.042 56 HB3 LEU 7 HB1 LEU 7 -6.121 17.416 -6.947 57 HG LEU 7 HG LEU 7 -5.733 18.123 -9.698 58 HD11 LEU 7 HD11 LEU 7 -3.761 19.202 -9.809 59 HD12 LEU 7 HD12 LEU 7 -3.143 18.449 -8.339 60 HD13 LEU 7 HD13 LEU 7 -4.244 19.823 -8.230 61 HD21 LEU 7 HD21 LEU 7 -4.131 16.375 -7.834 62 HD22 LEU 7 HD22 LEU 7 -4.092 16.333 -9.597 63 HD23 LEU 7 HD23 LEU 7 -5.562 15.875 -8.736 64 H HIS 8 HN HIS 8 -7.963 16.414 -6.797 65 HA HIS 8 HA HIS 8 -9.057 17.281 -4.370 66 HB2 HIS 8 HB2 HIS 8 -11.443 16.559 -4.765 67 HB3 HIS 8 HB1 HIS 8 -10.977 18.060 -5.558 68 HD1 HIS 8 HD1 HIS 8 -11.489 18.203 -7.982 69 HD2 HIS 8 HD2 HIS 8 -11.391 14.272 -6.639 70 HE1 HIS 8 HE1 HIS 8 -12.215 16.805 -9.942 71 HE2 HIS 8 HE2 HIS 8 -12.072 14.424 -9.130 72 H LYS 9 HN LYS 9 -8.868 15.647 -2.978 73 HA LYS 9 HA LYS 9 -8.741 12.914 -4.069 74 HB2 LYS 9 HB2 LYS 9 -7.336 14.137 -1.692 75 HB3 LYS 9 HB1 LYS 9 -7.349 12.412 -2.031 76 HG2 LYS 9 HG2 LYS 9 -5.349 13.052 -2.954 77 HG3 LYS 9 HG1 LYS 9 -6.422 13.137 -4.352 78 HD2 LYS 9 HD2 LYS 9 -6.715 15.633 -3.400 79 HD3 LYS 9 HD1 LYS 9 -5.071 15.298 -2.856 80 HE2 LYS 9 HE2 LYS 9 -5.945 14.791 -5.684 81 HE3 LYS 9 HE1 LYS 9 -5.363 16.370 -5.158 82 HZ1 LYS 9 HZ1 LYS 9 -3.255 15.640 -5.012 83 HZ2 LYS 9 HZ2 LYS 9 -3.778 14.459 -6.103 84 HZ3 LYS 9 HZ3 LYS 9 -3.690 14.104 -4.451 85 H GLU 10 HN GLU 10 -9.417 11.192 -2.557 86 HA GLU 10 HA GLU 10 -11.628 12.101 -0.834 87 HB2 GLU 10 HB2 GLU 10 -11.479 9.948 -2.875 88 HB3 GLU 10 HB1 GLU 10 -12.414 9.611 -1.424 89 HG2 GLU 10 HG2 GLU 10 -13.990 10.455 -2.886 90 HG3 GLU 10 HG1 GLU 10 -13.569 11.855 -1.901 91 HA PRO 11 HA PRO 11 -9.378 9.859 2.297 92 HB2 PRO 11 HB2 PRO 11 -10.992 10.353 4.369 93 HB3 PRO 11 HB1 PRO 11 -10.032 11.641 3.629 94 HG2 PRO 11 HG2 PRO 11 -12.932 10.999 3.281 95 HG3 PRO 11 HG1 PRO 11 -12.145 12.580 3.443 96 HD2 PRO 11 HD2 PRO 11 -12.917 11.451 1.044 97 HD3 PRO 11 HD1 PRO 11 -11.661 12.692 1.215 98 H ALA 12 HN ALA 12 -10.119 8.314 4.197 99 HA ALA 12 HA ALA 12 -12.414 6.701 3.703 100 HB1 ALA 12 HB1 ALA 12 -11.144 5.787 1.911 101 HB2 ALA 12 HB2 ALA 12 -11.117 4.606 3.222 102 HB3 ALA 12 HB3 ALA 12 -9.711 5.630 2.928 103 H THR 13 HN THR 13 -12.640 4.951 5.248 104 HA THR 13 HA THR 13 -10.915 5.287 7.615 105 HB THR 13 HB THR 13 -13.775 4.466 7.904 106 HG1 THR 13 HG1 THR 13 -14.197 6.284 6.855 107 HG21 THR 13 HG21 THR 13 -13.077 6.347 9.824 108 HG22 THR 13 HG22 THR 13 -11.654 5.320 9.647 109 HG23 THR 13 HG23 THR 13 -13.218 4.602 10.038 110 H LEU 14 HN LEU 14 -10.044 3.477 8.427 111 HA LEU 14 HA LEU 14 -10.257 1.028 7.038 112 HB2 LEU 14 HB2 LEU 14 -8.577 2.126 8.995 113 HB3 LEU 14 HB1 LEU 14 -9.266 0.691 9.732 114 HG LEU 14 HG LEU 14 -7.070 0.343 8.571 115 HD11 LEU 14 HD11 LEU 14 -8.043 -1.675 8.880 116 HD12 LEU 14 HD12 LEU 14 -8.146 -1.624 7.120 117 HD13 LEU 14 HD13 LEU 14 -9.550 -1.195 8.098 118 HD21 LEU 14 HD21 LEU 14 -8.100 1.842 6.575 119 HD22 LEU 14 HD22 LEU 14 -8.399 0.220 5.949 120 HD23 LEU 14 HD23 LEU 14 -6.759 0.714 6.373 121 H ILE 15 HN ILE 15 -12.065 -0.149 7.027 122 HA ILE 15 HA ILE 15 -13.932 -0.182 9.185 123 HB ILE 15 HB ILE 15 -13.722 -2.114 6.869 124 HG12 ILE 15 HG12 ILE 15 -13.893 0.265 6.158 125 HG13 ILE 15 HG11 ILE 15 -15.301 -0.691 5.702 126 HG21 ILE 15 HG21 ILE 15 -15.268 -3.180 8.110 127 HG22 ILE 15 HG22 ILE 15 -16.351 -1.947 7.466 128 HG23 ILE 15 HG23 ILE 15 -15.640 -1.747 9.068 129 HD11 ILE 15 HD11 ILE 15 -16.198 1.300 6.481 130 HD12 ILE 15 HD12 ILE 15 -15.056 1.403 7.822 131 HD13 ILE 15 HD13 ILE 15 -16.354 0.210 7.859 132 H LYS 16 HN LYS 16 -11.459 -2.391 7.976 133 HA LYS 16 HA LYS 16 -10.920 -3.451 10.541 134 HB2 LYS 16 HB2 LYS 16 -12.972 -4.782 8.981 135 HB3 LYS 16 HB1 LYS 16 -11.616 -5.858 9.290 136 HG2 LYS 16 HG2 LYS 16 -12.930 -4.285 11.481 137 HG3 LYS 16 HG1 LYS 16 -13.519 -5.868 10.970 138 HD2 LYS 16 HD2 LYS 16 -11.510 -6.930 11.609 139 HD3 LYS 16 HD1 LYS 16 -10.657 -5.393 11.764 140 HE2 LYS 16 HE2 LYS 16 -11.138 -6.167 13.965 141 HE3 LYS 16 HE1 LYS 16 -12.219 -4.814 13.631 142 HZ1 LYS 16 HZ1 LYS 16 -13.726 -6.845 12.826 143 HZ2 LYS 16 HZ2 LYS 16 -13.749 -6.249 14.408 144 HZ3 LYS 16 HZ3 LYS 16 -12.837 -7.624 14.036 145 H ALA 17 HN ALA 17 -8.912 -4.313 10.574 146 HA ALA 17 HA ALA 17 -7.380 -4.229 8.158 147 HB1 ALA 17 HB1 ALA 17 -6.388 -3.425 10.203 148 HB2 ALA 17 HB2 ALA 17 -5.479 -4.820 9.618 149 HB3 ALA 17 HB3 ALA 17 -6.605 -5.001 10.964 150 H ILE 18 HN ILE 18 -6.705 -5.884 6.912 151 HA ILE 18 HA ILE 18 -7.712 -8.550 7.559 152 HB ILE 18 HB ILE 18 -6.305 -7.917 4.993 153 HG12 ILE 18 HG12 ILE 18 -8.279 -6.252 5.762 154 HG13 ILE 18 HG11 ILE 18 -7.989 -6.696 4.090 155 HG21 ILE 18 HG21 ILE 18 -6.842 -10.200 5.300 156 HG22 ILE 18 HG22 ILE 18 -8.009 -9.555 4.146 157 HG23 ILE 18 HG23 ILE 18 -8.481 -9.815 5.825 158 HD11 ILE 18 HD11 ILE 18 -9.845 -8.349 5.731 159 HD12 ILE 18 HD12 ILE 18 -9.839 -8.048 3.993 160 HD13 ILE 18 HD13 ILE 18 -10.388 -6.792 5.103 161 H ASP 19 HN ASP 19 -4.768 -7.525 5.838 162 HA ASP 19 HA ASP 19 -3.156 -9.023 7.776 163 HB2 ASP 19 HB2 ASP 19 -3.549 -9.737 4.921 164 HB3 ASP 19 HB1 ASP 19 -1.905 -9.845 5.540 165 H GLY 20 HN GLY 20 -1.882 -8.122 4.655 166 HA2 GLY 20 HA2 GLY 20 -0.461 -5.880 5.952 167 HA3 GLY 20 HA1 GLY 20 0.257 -6.909 4.717 168 H ASP 21 HN ASP 21 -0.533 -6.760 2.549 169 HA ASP 21 HA ASP 21 -1.112 -4.099 1.756 170 HB2 ASP 21 HB2 ASP 21 -1.297 -5.108 -0.533 171 HB3 ASP 21 HB1 ASP 21 0.210 -5.484 0.294 172 H THR 22 HN THR 22 -3.025 -6.813 2.636 173 HA THR 22 HA THR 22 -5.413 -5.752 1.334 174 HB THR 22 HB THR 22 -6.279 -7.920 2.738 175 HG1 THR 22 HG1 THR 22 -3.647 -8.561 1.915 176 HG21 THR 22 HG21 THR 22 -5.058 -8.897 0.342 177 HG22 THR 22 HG22 THR 22 -5.802 -7.324 0.049 178 HG23 THR 22 HG23 THR 22 -6.764 -8.646 0.712 179 H VAL 23 HN VAL 23 -6.800 -4.508 2.352 180 HA VAL 23 HA VAL 23 -7.264 -4.746 5.199 181 HB VAL 23 HB VAL 23 -6.955 -2.297 5.580 182 HG11 VAL 23 HG11 VAL 23 -5.243 -4.160 6.075 183 HG12 VAL 23 HG12 VAL 23 -4.701 -2.482 6.124 184 HG13 VAL 23 HG13 VAL 23 -4.343 -3.484 4.717 185 HG21 VAL 23 HG21 VAL 23 -6.135 -2.449 2.749 186 HG22 VAL 23 HG22 VAL 23 -5.141 -1.433 3.793 187 HG23 VAL 23 HG23 VAL 23 -6.871 -1.122 3.651 188 H LYS 24 HN LYS 24 -9.282 -3.986 5.814 189 HA LYS 24 HA LYS 24 -11.106 -3.455 3.618 190 HB2 LYS 24 HB2 LYS 24 -11.628 -5.093 5.452 191 HB3 LYS 24 HB1 LYS 24 -11.744 -3.733 6.558 192 HG2 LYS 24 HG2 LYS 24 -13.948 -4.205 5.957 193 HG3 LYS 24 HG1 LYS 24 -13.509 -2.805 4.977 194 HD2 LYS 24 HD2 LYS 24 -14.623 -4.277 3.511 195 HD3 LYS 24 HD1 LYS 24 -12.907 -4.461 3.147 196 HE2 LYS 24 HE2 LYS 24 -13.014 -6.398 4.873 197 HE3 LYS 24 HE1 LYS 24 -14.751 -6.331 4.581 198 HZ1 LYS 24 HZ1 LYS 24 -13.089 -7.808 3.139 199 HZ2 LYS 24 HZ2 LYS 24 -13.056 -6.389 2.219 200 HZ3 LYS 24 HZ3 LYS 24 -14.527 -7.169 2.517 201 H LEU 25 HN LEU 25 -11.696 -1.472 3.031 202 HA LEU 25 HA LEU 25 -11.460 0.693 5.004 203 HB2 LEU 25 HB2 LEU 25 -10.725 0.592 2.127 204 HB3 LEU 25 HB1 LEU 25 -11.214 2.118 2.824 205 HG LEU 25 HG LEU 25 -9.031 0.496 4.087 206 HD11 LEU 25 HD11 LEU 25 -7.823 0.700 2.222 207 HD12 LEU 25 HD12 LEU 25 -7.728 2.414 2.625 208 HD13 LEU 25 HD13 LEU 25 -8.959 1.840 1.501 209 HD21 LEU 25 HD21 LEU 25 -9.724 3.429 4.029 210 HD22 LEU 25 HD22 LEU 25 -8.292 2.749 4.801 211 HD23 LEU 25 HD23 LEU 25 -9.898 2.324 5.393 212 H MET 26 HN MET 26 -12.951 2.473 4.780 213 HA MET 26 HA MET 26 -15.591 1.547 4.030 214 HB2 MET 26 HB2 MET 26 -15.011 2.872 6.146 215 HB3 MET 26 HB1 MET 26 -14.898 4.278 5.097 216 HG2 MET 26 HG2 MET 26 -17.127 4.425 4.817 217 HG3 MET 26 HG1 MET 26 -17.355 2.677 4.840 218 HE1 MET 26 HE1 MET 26 -19.505 3.487 5.856 219 HE2 MET 26 HE2 MET 26 -19.750 3.662 7.593 220 HE3 MET 26 HE3 MET 26 -19.276 2.100 6.922 221 H TYR 27 HN TYR 27 -16.159 1.682 1.966 222 HA TYR 27 HA TYR 27 -15.568 4.177 0.515 223 HB2 TYR 27 HB2 TYR 27 -14.289 2.068 -0.225 224 HB3 TYR 27 HB1 TYR 27 -15.835 1.507 -0.846 225 HD1 TYR 27 HD1 TYR 27 -14.366 4.925 -0.882 226 HD2 TYR 27 HD2 TYR 27 -15.621 1.564 -3.164 227 HE1 TYR 27 HE1 TYR 27 -13.985 6.198 -2.952 228 HE2 TYR 27 HE2 TYR 27 -15.244 2.824 -5.241 229 HH TYR 27 HH TYR 27 -13.805 4.796 -5.964 230 H LYS 28 HN LYS 28 -17.347 5.263 0.017 231 HA LYS 28 HA LYS 28 -19.507 5.778 -0.455 232 HB2 LYS 28 HB2 LYS 28 -19.362 3.024 -1.675 233 HB3 LYS 28 HB1 LYS 28 -20.738 4.099 -1.865 234 HG2 LYS 28 HG2 LYS 28 -19.267 5.763 -2.923 235 HG3 LYS 28 HG1 LYS 28 -17.921 4.630 -2.782 236 HD2 LYS 28 HD2 LYS 28 -18.555 4.059 -4.877 237 HD3 LYS 28 HD1 LYS 28 -19.723 3.057 -4.014 238 HE2 LYS 28 HE2 LYS 28 -21.479 4.451 -4.493 239 HE3 LYS 28 HE1 LYS 28 -20.449 5.877 -4.626 240 HZ1 LYS 28 HZ1 LYS 28 -20.900 5.532 -6.806 241 HZ2 LYS 28 HZ2 LYS 28 -21.105 3.862 -6.636 242 HZ3 LYS 28 HZ3 LYS 28 -19.548 4.522 -6.684 243 H GLY 29 HN GLY 29 -19.143 5.030 2.135 244 HA2 GLY 29 HA2 GLY 29 -20.300 4.362 4.001 245 HA3 GLY 29 HA1 GLY 29 -21.730 4.355 2.981 246 H GLN 30 HN GLN 30 -19.137 2.339 1.984 247 HA GLN 30 HA GLN 30 -20.341 -0.003 3.272 248 HB2 GLN 30 HB2 GLN 30 -20.911 -1.033 1.343 249 HB3 GLN 30 HB1 GLN 30 -20.901 0.592 0.676 250 HG2 GLN 30 HG2 GLN 30 -18.378 0.060 0.219 251 HG3 GLN 30 HG1 GLN 30 -18.928 -1.610 0.340 252 HE21 GLN 30 HE21 GLN 30 -17.864 -0.365 -1.977 253 HE22 GLN 30 HE22 GLN 30 -19.098 -0.365 -3.186 254 HA PRO 31 HA PRO 31 -16.129 -1.163 3.827 255 HB2 PRO 31 HB2 PRO 31 -16.389 -3.695 4.543 256 HB3 PRO 31 HB1 PRO 31 -17.164 -2.417 5.492 257 HG2 PRO 31 HG2 PRO 31 -18.376 -4.248 3.453 258 HG3 PRO 31 HG1 PRO 31 -19.005 -3.773 5.042 259 HD2 PRO 31 HD2 PRO 31 -19.739 -2.606 2.640 260 HD3 PRO 31 HD1 PRO 31 -19.900 -1.836 4.230 261 H MET 32 HN MET 32 -14.666 -1.326 2.260 262 HA MET 32 HA MET 32 -14.915 -3.529 0.321 263 HB2 MET 32 HB2 MET 32 -15.280 -1.023 -0.446 264 HB3 MET 32 HB1 MET 32 -13.522 -1.001 -0.442 265 HG2 MET 32 HG2 MET 32 -14.205 -1.517 -2.642 266 HG3 MET 32 HG1 MET 32 -13.581 -3.006 -1.935 267 HE1 MET 32 HE1 MET 32 -15.743 -5.444 -2.743 268 HE2 MET 32 HE2 MET 32 -16.081 -5.136 -1.040 269 HE3 MET 32 HE3 MET 32 -14.457 -4.880 -1.677 270 H THR 33 HN THR 33 -12.975 -4.471 -0.402 271 HA THR 33 HA THR 33 -10.822 -4.299 1.543 272 HB THR 33 HB THR 33 -11.027 -6.168 -0.820 273 HG1 THR 33 HG1 THR 33 -12.721 -6.856 0.234 274 HG21 THR 33 HG21 THR 33 -9.597 -6.483 1.806 275 HG22 THR 33 HG22 THR 33 -8.834 -6.094 0.265 276 HG23 THR 33 HG23 THR 33 -9.639 -7.648 0.484 277 H PHE 34 HN PHE 34 -9.117 -3.051 1.227 278 HA PHE 34 HA PHE 34 -8.508 -2.152 -1.496 279 HB2 PHE 34 HB2 PHE 34 -8.057 -0.998 1.226 280 HB3 PHE 34 HB1 PHE 34 -6.973 -0.535 -0.084 281 HD1 PHE 34 HD1 PHE 34 -10.604 -0.781 0.734 282 HD2 PHE 34 HD2 PHE 34 -7.550 1.213 -1.469 283 HE1 PHE 34 HE1 PHE 34 -12.252 0.861 -0.069 284 HE2 PHE 34 HE2 PHE 34 -9.195 2.861 -2.266 285 HZ PHE 34 HZ PHE 34 -11.549 2.685 -1.565 286 H ARG 35 HN ARG 35 -6.345 -2.152 -2.270 287 HA ARG 35 HA ARG 35 -4.573 -4.046 -0.877 288 HB2 ARG 35 HB2 ARG 35 -5.489 -5.205 -2.754 289 HB3 ARG 35 HB1 ARG 35 -5.208 -3.834 -3.817 290 HG2 ARG 35 HG2 ARG 35 -2.803 -4.922 -2.528 291 HG3 ARG 35 HG1 ARG 35 -3.612 -6.006 -3.659 292 HD2 ARG 35 HD2 ARG 35 -3.613 -3.595 -4.986 293 HD3 ARG 35 HD1 ARG 35 -2.056 -3.594 -4.162 294 HE ARG 35 HE ARG 35 -2.947 -5.461 -6.220 295 HH11 ARG 35 HH11 ARG 35 -0.452 -4.466 -3.984 296 HH12 ARG 35 HH12 ARG 35 0.789 -5.372 -4.779 297 HH21 ARG 35 HH21 ARG 35 -1.312 -6.651 -7.258 298 HH22 ARG 35 HH22 ARG 35 0.303 -6.612 -6.635 299 H LEU 36 HN LEU 36 -2.434 -3.525 -0.743 300 HA LEU 36 HA LEU 36 -1.669 -0.830 -1.106 301 HB2 LEU 36 HB2 LEU 36 -0.159 -3.353 -0.472 302 HB3 LEU 36 HB1 LEU 36 0.702 -1.854 -0.785 303 HG LEU 36 HG LEU 36 -1.358 -2.226 1.389 304 HD11 LEU 36 HD11 LEU 36 1.617 -1.930 1.708 305 HD12 LEU 36 HD12 LEU 36 0.811 -3.498 1.650 306 HD13 LEU 36 HD13 LEU 36 0.423 -2.354 2.936 307 HD21 LEU 36 HD21 LEU 36 0.481 0.062 0.713 308 HD22 LEU 36 HD22 LEU 36 -0.462 -0.066 2.197 309 HD23 LEU 36 HD23 LEU 36 -1.281 0.058 0.641 310 H LEU 37 HN LEU 37 -2.261 -0.485 -3.317 311 HA LEU 37 HA LEU 37 -1.631 -1.678 -5.600 312 HB2 LEU 37 HB2 LEU 37 -2.530 0.738 -5.077 313 HB3 LEU 37 HB1 LEU 37 -0.881 1.199 -5.455 314 HG LEU 37 HG LEU 37 -1.119 0.083 -7.662 315 HD11 LEU 37 HD11 LEU 37 -3.542 -0.279 -8.377 316 HD12 LEU 37 HD12 LEU 37 -3.908 -0.344 -6.653 317 HD13 LEU 37 HD13 LEU 37 -2.797 -1.514 -7.362 318 HD21 LEU 37 HD21 LEU 37 -3.357 2.004 -7.601 319 HD22 LEU 37 HD22 LEU 37 -1.905 1.980 -8.601 320 HD23 LEU 37 HD23 LEU 37 -1.823 2.570 -6.941 321 H LEU 38 HN LEU 38 0.031 -2.105 -6.916 322 HA LEU 38 HA LEU 38 2.162 -2.740 -7.412 323 HB2 LEU 38 HB2 LEU 38 3.652 -0.909 -7.835 324 HB3 LEU 38 HB1 LEU 38 2.021 -0.443 -8.274 325 HG LEU 38 HG LEU 38 2.970 0.296 -5.555 326 HD11 LEU 38 HD11 LEU 38 4.831 1.231 -6.389 327 HD12 LEU 38 HD12 LEU 38 3.727 2.476 -6.973 328 HD13 LEU 38 HD13 LEU 38 4.240 1.177 -8.050 329 HD21 LEU 38 HD21 LEU 38 1.103 1.493 -5.640 330 HD22 LEU 38 HD22 LEU 38 0.797 0.906 -7.275 331 HD23 LEU 38 HD23 LEU 38 1.724 2.385 -7.027 332 H VAL 39 HN VAL 39 1.543 -3.324 -4.682 333 HA VAL 39 HA VAL 39 4.255 -3.124 -3.556 334 HB VAL 39 HB VAL 39 1.753 -3.096 -1.868 335 HG11 VAL 39 HG11 VAL 39 3.303 -3.802 -0.389 336 HG12 VAL 39 HG12 VAL 39 3.708 -2.087 -0.324 337 HG13 VAL 39 HG13 VAL 39 4.652 -3.177 -1.338 338 HG21 VAL 39 HG21 VAL 39 3.028 -0.936 -3.307 339 HG22 VAL 39 HG22 VAL 39 3.055 -0.652 -1.567 340 HG23 VAL 39 HG23 VAL 39 1.523 -0.941 -2.389 341 H ASP 40 HN ASP 40 5.072 -4.957 -2.643 342 HA ASP 40 HA ASP 40 3.446 -7.384 -2.972 343 HB2 ASP 40 HB2 ASP 40 6.145 -6.724 -3.673 344 HB3 ASP 40 HB1 ASP 40 6.168 -8.050 -2.514 345 H THR 41 HN THR 41 3.204 -8.844 -1.313 346 HA THR 41 HA THR 41 4.121 -7.921 1.327 347 HB THR 41 HB THR 41 2.136 -9.733 1.860 348 HG1 THR 41 HG1 THR 41 0.439 -9.163 0.429 349 HG21 THR 41 HG21 THR 41 1.145 -7.019 1.339 350 HG22 THR 41 HG22 THR 41 2.531 -7.137 2.424 351 HG23 THR 41 HG23 THR 41 1.045 -8.013 2.792 352 HA PRO 42 HA PRO 42 6.521 -11.636 1.606 353 HB2 PRO 42 HB2 PRO 42 7.003 -11.670 4.255 354 HB3 PRO 42 HB1 PRO 42 7.742 -10.474 3.184 355 HG2 PRO 42 HG2 PRO 42 5.366 -10.193 4.984 356 HG3 PRO 42 HG1 PRO 42 6.707 -9.064 4.718 357 HD2 PRO 42 HD2 PRO 42 4.268 -8.801 3.525 358 HD3 PRO 42 HD1 PRO 42 5.778 -8.219 2.796 359 H GLU 43 HN GLU 43 6.062 -13.753 1.764 360 HA GLU 43 HA GLU 43 4.031 -14.646 3.676 361 HB2 GLU 43 HB2 GLU 43 3.515 -14.356 0.937 362 HB3 GLU 43 HB1 GLU 43 3.768 -16.080 1.173 363 HG2 GLU 43 HG2 GLU 43 1.570 -16.046 1.633 364 HG3 GLU 43 HG1 GLU 43 2.136 -15.588 3.238 365 H THR 44 HN THR 44 4.850 -16.241 4.842 366 HA THR 44 HA THR 44 6.497 -18.279 3.548 367 HB THR 44 HB THR 44 8.196 -18.192 5.289 368 HG1 THR 44 HG1 THR 44 6.890 -17.393 6.979 369 HG21 THR 44 HG21 THR 44 7.864 -15.353 4.390 370 HG22 THR 44 HG22 THR 44 8.366 -16.637 3.289 371 HG23 THR 44 HG23 THR 44 9.350 -16.250 4.700 372 H LYS 45 HN LYS 45 6.664 -20.257 4.773 373 HA LYS 45 HA LYS 45 5.786 -21.965 5.991 374 HB2 LYS 45 HB2 LYS 45 4.827 -19.818 7.889 375 HB3 LYS 45 HB1 LYS 45 5.087 -21.517 8.258 376 HG2 LYS 45 HG2 LYS 45 7.331 -19.774 7.312 377 HG3 LYS 45 HG1 LYS 45 6.853 -19.824 9.010 378 HD2 LYS 45 HD2 LYS 45 7.282 -22.414 7.623 379 HD3 LYS 45 HD1 LYS 45 8.707 -21.447 8.007 380 HE2 LYS 45 HE2 LYS 45 7.222 -21.348 10.329 381 HE3 LYS 45 HE1 LYS 45 6.973 -22.997 9.757 382 HZ1 LYS 45 HZ1 LYS 45 9.598 -22.754 9.426 383 HZ2 LYS 45 HZ2 LYS 45 8.893 -23.341 10.847 384 HZ3 LYS 45 HZ3 LYS 45 9.385 -21.725 10.752 385 H HIS 46 HN HIS 46 4.206 -22.789 4.722 386 HA HIS 46 HA HIS 46 1.677 -21.494 4.360 387 HB2 HIS 46 HB2 HIS 46 2.946 -23.142 2.778 388 HB3 HIS 46 HB1 HIS 46 2.151 -24.389 3.732 389 HD1 HIS 46 HD1 HIS 46 0.770 -25.102 1.643 390 HD2 HIS 46 HD2 HIS 46 0.085 -21.207 2.916 391 HE1 HIS 46 HE1 HIS 46 -1.320 -24.365 0.455 392 HE2 HIS 46 HE2 HIS 46 -1.766 -22.038 1.312 393 HA PRO 47 HA PRO 47 -0.078 -22.854 8.268 394 HB2 PRO 47 HB2 PRO 47 -2.578 -22.306 6.736 395 HB3 PRO 47 HB1 PRO 47 -2.108 -21.769 8.353 396 HG2 PRO 47 HG2 PRO 47 -2.020 -20.089 6.293 397 HG3 PRO 47 HG1 PRO 47 -0.757 -20.066 7.539 398 HD2 PRO 47 HD2 PRO 47 -0.668 -21.164 4.765 399 HD3 PRO 47 HD1 PRO 47 0.608 -20.364 5.706 400 H LYS 48 HN LYS 48 -2.146 -24.282 8.754 401 HA LYS 48 HA LYS 48 -2.149 -26.555 6.881 402 HB2 LYS 48 HB2 LYS 48 -0.793 -26.973 8.948 403 HB3 LYS 48 HB1 LYS 48 -2.260 -26.765 9.894 404 HG2 LYS 48 HG2 LYS 48 -3.073 -28.790 9.332 405 HG3 LYS 48 HG1 LYS 48 -2.409 -28.726 7.699 406 HD2 LYS 48 HD2 LYS 48 -0.314 -28.847 9.694 407 HD3 LYS 48 HD1 LYS 48 -1.433 -30.203 9.848 408 HE2 LYS 48 HE2 LYS 48 0.420 -30.740 8.347 409 HE3 LYS 48 HE1 LYS 48 -1.122 -30.744 7.494 410 HZ1 LYS 48 HZ1 LYS 48 -0.578 -28.425 6.788 411 HZ2 LYS 48 HZ2 LYS 48 0.432 -29.616 6.137 412 HZ3 LYS 48 HZ3 LYS 48 0.977 -28.652 7.417 413 H LYS 49 HN LYS 49 -3.886 -25.434 9.793 414 HA LYS 49 HA LYS 49 -6.408 -25.914 8.348 415 HB2 LYS 49 HB2 LYS 49 -5.514 -26.850 11.007 416 HB3 LYS 49 HB1 LYS 49 -7.161 -26.240 10.929 417 HG2 LYS 49 HG2 LYS 49 -6.442 -28.099 8.778 418 HG3 LYS 49 HG1 LYS 49 -6.426 -28.794 10.401 419 HD2 LYS 49 HD2 LYS 49 -8.743 -27.374 10.455 420 HD3 LYS 49 HD1 LYS 49 -8.682 -27.868 8.761 421 HE2 LYS 49 HE2 LYS 49 -8.015 -29.992 10.666 422 HE3 LYS 49 HE1 LYS 49 -9.663 -29.384 10.808 423 HZ1 LYS 49 HZ1 LYS 49 -9.956 -29.792 8.428 424 HZ2 LYS 49 HZ2 LYS 49 -9.572 -31.213 9.260 425 HZ3 LYS 49 HZ3 LYS 49 -8.392 -30.430 8.336 426 H GLY 50 HN GLY 50 -4.867 -23.450 8.616 427 HA2 GLY 50 HA2 GLY 50 -6.778 -21.555 8.896 428 HA3 GLY 50 HA1 GLY 50 -6.257 -21.818 10.553 429 H VAL 51 HN VAL 51 -5.872 -19.814 8.050 430 HA VAL 51 HA VAL 51 -3.011 -19.473 8.097 431 HB VAL 51 HB VAL 51 -5.068 -17.567 6.978 432 HG11 VAL 51 HG11 VAL 51 -2.106 -17.874 6.711 433 HG12 VAL 51 HG12 VAL 51 -3.061 -16.419 6.996 434 HG13 VAL 51 HG13 VAL 51 -3.044 -17.163 5.397 435 HG21 VAL 51 HG21 VAL 51 -5.595 -19.431 5.758 436 HG22 VAL 51 HG22 VAL 51 -3.984 -20.129 5.919 437 HG23 VAL 51 HG23 VAL 51 -4.261 -18.802 4.791 438 H GLU 52 HN GLU 52 -1.879 -17.691 8.935 439 HA GLU 52 HA GLU 52 -3.025 -15.551 10.335 440 HB2 GLU 52 HB2 GLU 52 -3.536 -17.669 11.805 441 HB3 GLU 52 HB1 GLU 52 -1.858 -17.483 12.297 442 HG2 GLU 52 HG2 GLU 52 -3.709 -15.147 12.411 443 HG3 GLU 52 HG1 GLU 52 -3.750 -16.372 13.678 444 H LYS 53 HN LYS 53 -0.302 -17.780 10.107 445 HA LYS 53 HA LYS 53 1.565 -15.645 10.803 446 HB2 LYS 53 HB2 LYS 53 3.276 -17.436 10.737 447 HB3 LYS 53 HB1 LYS 53 1.968 -17.782 11.860 448 HG2 LYS 53 HG2 LYS 53 1.189 -18.913 9.422 449 HG3 LYS 53 HG1 LYS 53 2.898 -19.306 9.614 450 HD2 LYS 53 HD2 LYS 53 1.284 -19.640 12.043 451 HD3 LYS 53 HD1 LYS 53 0.845 -20.715 10.715 452 HE2 LYS 53 HE2 LYS 53 2.617 -21.992 11.112 453 HE3 LYS 53 HE1 LYS 53 3.694 -20.606 10.942 454 HZ1 LYS 53 HZ1 LYS 53 3.680 -21.867 13.149 455 HZ2 LYS 53 HZ2 LYS 53 2.215 -21.077 13.452 456 HZ3 LYS 53 HZ3 LYS 53 3.626 -20.176 13.205 457 H TYR 54 HN TYR 54 2.086 -14.322 9.188 458 HA TYR 54 HA TYR 54 2.980 -15.505 6.663 459 HB2 TYR 54 HB2 TYR 54 1.820 -13.191 5.767 460 HB3 TYR 54 HB1 TYR 54 1.092 -14.788 5.660 461 HD1 TYR 54 HD1 TYR 54 -0.655 -15.464 7.260 462 HD2 TYR 54 HD2 TYR 54 0.966 -11.530 7.277 463 HE1 TYR 54 HE1 TYR 54 -2.557 -14.692 8.613 464 HE2 TYR 54 HE2 TYR 54 -0.931 -10.748 8.632 465 HH TYR 54 HH TYR 54 -2.601 -11.897 10.300 466 H GLY 55 HN GLY 55 2.587 -12.317 8.233 467 HA2 GLY 55 HA2 GLY 55 5.437 -11.904 8.257 468 HA3 GLY 55 HA1 GLY 55 4.606 -10.922 7.062 469 HA PRO 56 HA PRO 56 3.090 -9.682 11.596 470 HB2 PRO 56 HB2 PRO 56 5.253 -9.840 13.320 471 HB3 PRO 56 HB1 PRO 56 3.919 -10.996 13.258 472 HG2 PRO 56 HG2 PRO 56 6.638 -11.169 12.033 473 HG3 PRO 56 HG1 PRO 56 5.671 -12.439 12.805 474 HD2 PRO 56 HD2 PRO 56 5.878 -12.266 10.139 475 HD3 PRO 56 HD1 PRO 56 4.360 -12.761 10.917 476 H GLU 57 HN GLU 57 6.562 -9.337 10.857 477 HA GLU 57 HA GLU 57 6.887 -6.716 11.716 478 HB2 GLU 57 HB2 GLU 57 8.329 -8.571 9.959 479 HB3 GLU 57 HB1 GLU 57 8.597 -6.877 9.573 480 HG2 GLU 57 HG2 GLU 57 8.848 -7.844 12.389 481 HG3 GLU 57 HG1 GLU 57 10.167 -8.069 11.240 482 H ALA 58 HN ALA 58 5.825 -7.937 8.571 483 HA ALA 58 HA ALA 58 5.611 -5.303 7.429 484 HB1 ALA 58 HB1 ALA 58 6.129 -6.925 5.848 485 HB2 ALA 58 HB2 ALA 58 4.409 -6.639 5.580 486 HB3 ALA 58 HB3 ALA 58 4.938 -8.062 6.478 487 H SER 59 HN SER 59 3.232 -7.847 8.226 488 HA SER 59 HA SER 59 0.932 -6.387 7.710 489 HB2 SER 59 HB2 SER 59 1.563 -8.729 9.452 490 HB3 SER 59 HB1 SER 59 -0.013 -7.956 9.623 491 HG SER 59 HG SER 59 -0.590 -8.935 7.870 492 H ALA 60 HN ALA 60 2.891 -6.508 10.646 493 HA ALA 60 HA ALA 60 1.143 -5.085 12.323 494 HB1 ALA 60 HB1 ALA 60 4.152 -5.134 12.468 495 HB2 ALA 60 HB2 ALA 60 3.093 -6.391 13.108 496 HB3 ALA 60 HB3 ALA 60 3.032 -4.761 13.778 497 H PHE 61 HN PHE 61 3.981 -3.927 10.497 498 HA PHE 61 HA PHE 61 3.858 -1.261 11.166 499 HB2 PHE 61 HB2 PHE 61 5.681 -2.317 9.863 500 HB3 PHE 61 HB1 PHE 61 4.617 -2.370 8.460 501 HD1 PHE 61 HD1 PHE 61 6.460 -0.156 10.743 502 HD2 PHE 61 HD2 PHE 61 4.203 -0.438 7.151 503 HE1 PHE 61 HE1 PHE 61 7.175 2.117 10.119 504 HE2 PHE 61 HE2 PHE 61 4.906 1.831 6.518 505 HZ PHE 61 HZ PHE 61 6.397 3.113 8.004 506 H THR 62 HN THR 62 2.362 -2.759 8.282 507 HA THR 62 HA THR 62 1.119 -0.517 7.254 508 HB THR 62 HB THR 62 -0.205 -3.224 7.261 509 HG1 THR 62 HG1 THR 62 1.169 -3.703 5.481 510 HG21 THR 62 HG21 THR 62 -0.105 -0.954 5.306 511 HG22 THR 62 HG22 THR 62 -1.515 -1.693 6.064 512 HG23 THR 62 HG23 THR 62 -0.600 -2.584 4.849 513 H LYS 63 HN LYS 63 -0.121 -2.797 9.668 514 HA LYS 63 HA LYS 63 -2.590 -1.430 10.067 515 HB2 LYS 63 HB2 LYS 63 -2.549 -3.727 10.640 516 HB3 LYS 63 HB1 LYS 63 -1.088 -3.546 11.599 517 HG2 LYS 63 HG2 LYS 63 -2.291 -3.256 13.430 518 HG3 LYS 63 HG1 LYS 63 -3.119 -1.881 12.705 519 HD2 LYS 63 HD2 LYS 63 -4.882 -3.296 13.156 520 HD3 LYS 63 HD1 LYS 63 -4.509 -3.720 11.484 521 HE2 LYS 63 HE2 LYS 63 -2.882 -5.435 12.713 522 HE3 LYS 63 HE1 LYS 63 -4.097 -5.267 13.980 523 HZ1 LYS 63 HZ1 LYS 63 -5.786 -5.990 12.493 524 HZ2 LYS 63 HZ2 LYS 63 -4.517 -7.103 12.382 525 HZ3 LYS 63 HZ3 LYS 63 -4.739 -5.950 11.164 526 H LYS 64 HN LYS 64 0.620 -1.143 11.341 527 HA LYS 64 HA LYS 64 0.096 0.249 13.718 528 HB2 LYS 64 HB2 LYS 64 2.337 -0.674 12.374 529 HB3 LYS 64 HB1 LYS 64 2.546 1.071 12.365 530 HG2 LYS 64 HG2 LYS 64 2.130 -0.661 14.791 531 HG3 LYS 64 HG1 LYS 64 3.645 0.087 14.278 532 HD2 LYS 64 HD2 LYS 64 2.802 2.272 14.695 533 HD3 LYS 64 HD1 LYS 64 1.160 1.666 14.914 534 HE2 LYS 64 HE2 LYS 64 3.416 0.790 16.689 535 HE3 LYS 64 HE1 LYS 64 2.506 2.266 17.010 536 HZ1 LYS 64 HZ1 LYS 64 1.705 -0.508 17.305 537 HZ2 LYS 64 HZ2 LYS 64 0.526 0.521 16.664 538 HZ3 LYS 64 HZ3 LYS 64 1.213 0.861 18.171 539 H MET 65 HN MET 65 0.586 1.395 10.405 540 HA MET 65 HA MET 65 0.464 4.151 11.182 541 HB2 MET 65 HB2 MET 65 0.856 2.663 8.643 542 HB3 MET 65 HB1 MET 65 0.283 4.322 8.536 543 HG2 MET 65 HG2 MET 65 2.533 4.012 10.353 544 HG3 MET 65 HG1 MET 65 2.900 3.513 8.704 545 HE1 MET 65 HE1 MET 65 4.112 5.528 7.176 546 HE2 MET 65 HE2 MET 65 2.802 6.557 6.598 547 HE3 MET 65 HE3 MET 65 2.573 4.812 6.700 548 H VAL 66 HN VAL 66 -1.635 2.043 9.204 549 HA VAL 66 HA VAL 66 -3.624 3.935 8.718 550 HB VAL 66 HB VAL 66 -5.148 1.911 8.427 551 HG11 VAL 66 HG11 VAL 66 -4.246 1.430 6.308 552 HG12 VAL 66 HG12 VAL 66 -2.598 1.760 6.844 553 HG13 VAL 66 HG13 VAL 66 -3.748 3.084 6.661 554 HG21 VAL 66 HG21 VAL 66 -3.171 -0.056 8.138 555 HG22 VAL 66 HG22 VAL 66 -4.490 -0.019 9.308 556 HG23 VAL 66 HG23 VAL 66 -2.918 0.655 9.732 557 H GLU 67 HN GLU 67 -3.329 1.622 11.393 558 HA GLU 67 HA GLU 67 -5.844 2.288 12.530 559 HB2 GLU 67 HB2 GLU 67 -3.450 0.911 13.747 560 HB3 GLU 67 HB1 GLU 67 -5.042 1.005 14.488 561 HG2 GLU 67 HG2 GLU 67 -4.319 -0.382 11.920 562 HG3 GLU 67 HG1 GLU 67 -4.777 -1.135 13.449 563 H ASN 68 HN ASN 68 -2.503 3.234 13.294 564 HA ASN 68 HA ASN 68 -3.168 4.829 15.531 565 HB2 ASN 68 HB2 ASN 68 -0.779 4.681 13.719 566 HB3 ASN 68 HB1 ASN 68 -0.896 5.952 14.931 567 HD21 ASN 68 HD21 ASN 68 -1.530 2.459 14.771 568 HD22 ASN 68 HD22 ASN 68 -0.686 2.069 16.225 569 H ALA 69 HN ALA 69 -3.068 5.447 12.095 570 HA ALA 69 HA ALA 69 -3.311 8.295 12.333 571 HB1 ALA 69 HB1 ALA 69 -4.011 7.948 9.822 572 HB2 ALA 69 HB2 ALA 69 -3.355 6.333 10.095 573 HB3 ALA 69 HB3 ALA 69 -2.335 7.752 10.334 574 H LYS 70 HN LYS 70 -5.094 9.212 13.102 575 HA LYS 70 HA LYS 70 -7.590 8.004 13.362 576 HB2 LYS 70 HB2 LYS 70 -6.855 10.932 13.238 577 HB3 LYS 70 HB1 LYS 70 -8.445 10.338 13.698 578 HG2 LYS 70 HG2 LYS 70 -7.697 9.492 15.706 579 HG3 LYS 70 HG1 LYS 70 -6.027 9.362 15.149 580 HD2 LYS 70 HD2 LYS 70 -7.170 12.085 15.223 581 HD3 LYS 70 HD1 LYS 70 -6.902 11.310 16.785 582 HE2 LYS 70 HE2 LYS 70 -4.796 11.473 14.641 583 HE3 LYS 70 HE1 LYS 70 -4.989 12.696 15.897 584 HZ1 LYS 70 HZ1 LYS 70 -4.710 9.862 16.644 585 HZ2 LYS 70 HZ2 LYS 70 -4.316 11.245 17.533 586 HZ3 LYS 70 HZ3 LYS 70 -3.334 10.763 16.244 587 H LYS 71 HN LYS 71 -6.119 9.478 10.614 588 HA LYS 71 HA LYS 71 -8.634 9.142 9.125 589 HB2 LYS 71 HB2 LYS 71 -7.724 11.586 9.672 590 HB3 LYS 71 HB1 LYS 71 -6.731 11.258 8.260 591 HG2 LYS 71 HG2 LYS 71 -8.821 10.722 7.007 592 HG3 LYS 71 HG1 LYS 71 -9.733 11.286 8.408 593 HD2 LYS 71 HD2 LYS 71 -7.692 13.183 7.589 594 HD3 LYS 71 HD1 LYS 71 -8.835 12.833 6.291 595 HE2 LYS 71 HE2 LYS 71 -9.997 13.301 8.965 596 HE3 LYS 71 HE1 LYS 71 -9.252 14.697 8.187 597 HZ1 LYS 71 HZ1 LYS 71 -11.767 13.962 7.771 598 HZ2 LYS 71 HZ2 LYS 71 -11.019 13.102 6.522 599 HZ3 LYS 71 HZ3 LYS 71 -10.842 14.781 6.615 600 H ILE 72 HN ILE 72 -8.483 8.184 7.159 601 HA ILE 72 HA ILE 72 -5.786 7.482 6.205 602 HB ILE 72 HB ILE 72 -8.182 5.751 5.713 603 HG12 ILE 72 HG12 ILE 72 -7.966 5.996 8.158 604 HG13 ILE 72 HG11 ILE 72 -7.558 4.366 7.632 605 HG21 ILE 72 HG21 ILE 72 -6.723 4.234 4.883 606 HG22 ILE 72 HG22 ILE 72 -5.444 4.684 6.010 607 HG23 ILE 72 HG23 ILE 72 -5.764 5.685 4.594 608 HD11 ILE 72 HD11 ILE 72 -5.233 6.080 7.714 609 HD12 ILE 72 HD12 ILE 72 -5.518 4.519 8.483 610 HD13 ILE 72 HD13 ILE 72 -6.057 6.001 9.271 611 H GLU 73 HN GLU 73 -5.433 7.560 3.993 612 HA GLU 73 HA GLU 73 -7.651 8.650 2.383 613 HB2 GLU 73 HB2 GLU 73 -4.781 9.368 1.866 614 HB3 GLU 73 HB1 GLU 73 -6.235 10.195 1.328 615 HG2 GLU 73 HG2 GLU 73 -6.641 10.646 3.829 616 HG3 GLU 73 HG1 GLU 73 -4.939 10.228 4.022 617 H VAL 74 HN VAL 74 -7.883 7.905 0.302 618 HA VAL 74 HA VAL 74 -6.017 5.790 -0.536 619 HB VAL 74 HB VAL 74 -8.077 4.791 -1.712 620 HG11 VAL 74 HG11 VAL 74 -7.043 3.523 -0.039 621 HG12 VAL 74 HG12 VAL 74 -8.734 3.611 0.451 622 HG13 VAL 74 HG13 VAL 74 -7.535 4.639 1.235 623 HG21 VAL 74 HG21 VAL 74 -9.739 5.786 0.498 624 HG22 VAL 74 HG22 VAL 74 -10.157 5.470 -1.186 625 HG23 VAL 74 HG23 VAL 74 -9.352 6.976 -0.744 626 H GLU 75 HN GLU 75 -5.289 5.867 -2.572 627 HA GLU 75 HA GLU 75 -6.530 7.810 -4.408 628 HB2 GLU 75 HB2 GLU 75 -4.306 8.531 -3.468 629 HB3 GLU 75 HB1 GLU 75 -3.585 7.149 -4.278 630 HG2 GLU 75 HG2 GLU 75 -5.122 8.545 -6.194 631 HG3 GLU 75 HG1 GLU 75 -4.161 9.732 -5.313 632 H PHE 76 HN PHE 76 -7.612 6.562 -5.822 633 HA PHE 76 HA PHE 76 -6.714 3.975 -6.621 634 HB2 PHE 76 HB2 PHE 76 -8.929 5.762 -7.628 635 HB3 PHE 76 HB1 PHE 76 -8.613 4.160 -8.284 636 HD1 PHE 76 HD2 PHE 76 -8.268 2.356 -6.228 637 HD2 PHE 76 HD1 PHE 76 -10.692 5.856 -6.184 638 HE1 PHE 76 HE2 PHE 76 -9.668 1.360 -4.468 639 HE2 PHE 76 HE1 PHE 76 -12.095 4.865 -4.423 640 HZ PHE 76 HZ PHE 76 -11.584 2.614 -3.563 641 H ASP 77 HN ASP 77 -5.638 3.352 -8.374 642 HA ASP 77 HA ASP 77 -3.910 5.058 -9.717 643 HB2 ASP 77 HB2 ASP 77 -3.466 3.184 -11.216 644 HB3 ASP 77 HB1 ASP 77 -3.608 2.615 -9.557 645 H LYS 78 HN LYS 78 -4.015 4.607 -12.382 646 HA LYS 78 HA LYS 78 -6.427 6.084 -13.181 647 HB2 LYS 78 HB2 LYS 78 -4.740 6.412 -15.289 648 HB3 LYS 78 HB1 LYS 78 -4.876 7.534 -13.944 649 HG2 LYS 78 HG2 LYS 78 -2.967 5.296 -13.628 650 HG3 LYS 78 HG1 LYS 78 -2.549 6.555 -14.788 651 HD2 LYS 78 HD2 LYS 78 -3.526 7.770 -12.390 652 HD3 LYS 78 HD1 LYS 78 -2.268 6.603 -11.980 653 HE2 LYS 78 HE2 LYS 78 -0.688 7.989 -12.706 654 HE3 LYS 78 HE1 LYS 78 -1.465 8.106 -14.283 655 HZ1 LYS 78 HZ1 LYS 78 -3.035 9.694 -12.844 656 HZ2 LYS 78 HZ2 LYS 78 -1.674 10.248 -13.683 657 HZ3 LYS 78 HZ3 LYS 78 -1.573 9.927 -12.026 658 H GLY 79 HN GLY 79 -4.694 3.155 -13.591 659 HA2 GLY 79 HA2 GLY 79 -5.940 2.505 -16.134 660 HA3 GLY 79 HA1 GLY 79 -4.841 1.486 -15.219 661 H GLN 80 HN GLN 80 -5.674 -0.191 -14.160 662 HA GLN 80 HA GLN 80 -8.300 -1.007 -14.458 663 HB2 GLN 80 HB2 GLN 80 -7.728 -2.492 -12.378 664 HB3 GLN 80 HB1 GLN 80 -6.908 -2.751 -13.909 665 HG2 GLN 80 HG2 GLN 80 -5.461 -0.830 -12.352 666 HG3 GLN 80 HG1 GLN 80 -5.768 -2.275 -11.392 667 HE21 GLN 80 HE21 GLN 80 -4.040 -3.513 -11.430 668 HE22 GLN 80 HE22 GLN 80 -3.087 -3.893 -12.821 669 H ARG 81 HN ARG 81 -6.936 -0.142 -11.277 670 HA ARG 81 HA ARG 81 -7.766 1.148 -9.583 671 HB2 ARG 81 HB2 ARG 81 -10.222 1.580 -11.290 672 HB3 ARG 81 HB1 ARG 81 -9.819 2.431 -9.809 673 HG2 ARG 81 HG2 ARG 81 -7.656 3.088 -11.101 674 HG3 ARG 81 HG1 ARG 81 -8.621 2.687 -12.524 675 HD2 ARG 81 HD2 ARG 81 -10.339 4.220 -11.019 676 HD3 ARG 81 HD1 ARG 81 -8.777 4.988 -10.740 677 HE ARG 81 HE ARG 81 -9.362 4.431 -13.507 678 HH11 ARG 81 HH11 ARG 81 -9.642 6.745 -10.909 679 HH12 ARG 81 HH12 ARG 81 -9.809 8.104 -11.970 680 HH21 ARG 81 HH21 ARG 81 -9.582 6.218 -14.903 681 HH22 ARG 81 HH22 ARG 81 -9.776 7.805 -14.236 682 H THR 82 HN THR 82 -9.276 -1.576 -10.933 683 HA THR 82 HA THR 82 -10.078 -2.513 -8.363 684 HB THR 82 HB THR 82 -12.500 -2.948 -9.329 685 HG1 THR 82 HG1 THR 82 -11.825 -0.479 -10.544 686 HG21 THR 82 HG21 THR 82 -13.334 -1.335 -7.959 687 HG22 THR 82 HG22 THR 82 -12.122 -0.145 -8.435 688 HG23 THR 82 HG23 THR 82 -11.688 -1.454 -7.336 689 H ASP 83 HN ASP 83 -9.525 -4.575 -8.385 690 HA ASP 83 HA ASP 83 -9.064 -5.987 -10.831 691 HB2 ASP 83 HB2 ASP 83 -9.037 -6.980 -7.972 692 HB3 ASP 83 HB1 ASP 83 -8.425 -7.865 -9.366 693 H LYS 84 HN LYS 84 -9.863 -8.497 -10.550 694 HA LYS 84 HA LYS 84 -12.388 -8.671 -11.530 695 HB2 LYS 84 HB2 LYS 84 -12.287 -11.001 -10.088 696 HB3 LYS 84 HB1 LYS 84 -11.604 -10.767 -11.692 697 HG2 LYS 84 HG2 LYS 84 -9.901 -10.038 -9.379 698 HG3 LYS 84 HG1 LYS 84 -10.215 -11.753 -9.647 699 HD2 LYS 84 HD2 LYS 84 -9.312 -11.649 -11.855 700 HD3 LYS 84 HD1 LYS 84 -9.214 -9.888 -11.793 701 HE2 LYS 84 HE2 LYS 84 -7.545 -10.045 -10.012 702 HE3 LYS 84 HE1 LYS 84 -7.650 -11.804 -10.065 703 HZ1 LYS 84 HZ1 LYS 84 -5.931 -11.587 -11.469 704 HZ2 LYS 84 HZ2 LYS 84 -6.287 -9.978 -11.853 705 HZ3 LYS 84 HZ3 LYS 84 -7.121 -11.234 -12.620 706 H TYR 85 HN TYR 85 -11.641 -9.429 -8.125 707 HA TYR 85 HA TYR 85 -14.344 -9.511 -7.334 708 HB2 TYR 85 HB2 TYR 85 -11.718 -9.670 -6.029 709 HB3 TYR 85 HB1 TYR 85 -12.980 -8.986 -5.011 710 HD1 TYR 85 HD1 TYR 85 -13.331 -11.622 -7.603 711 HD2 TYR 85 HD2 TYR 85 -13.361 -10.694 -3.453 712 HE1 TYR 85 HE1 TYR 85 -14.149 -13.889 -7.109 713 HE2 TYR 85 HE2 TYR 85 -14.179 -12.958 -2.945 714 HH TYR 85 HH TYR 85 -15.407 -14.774 -4.102 715 H GLY 86 HN GLY 86 -12.380 -6.901 -8.113 716 HA2 GLY 86 HA2 GLY 86 -13.125 -4.670 -8.211 717 HA3 GLY 86 HA1 GLY 86 -14.342 -5.047 -6.999 718 H ARG 87 HN ARG 87 -11.114 -6.121 -6.440 719 HA ARG 87 HA ARG 87 -10.808 -5.018 -3.953 720 HB2 ARG 87 HB2 ARG 87 -9.296 -6.652 -5.372 721 HB3 ARG 87 HB1 ARG 87 -8.395 -5.179 -5.706 722 HG2 ARG 87 HG2 ARG 87 -7.307 -5.517 -3.807 723 HG3 ARG 87 HG1 ARG 87 -8.807 -5.145 -2.955 724 HD2 ARG 87 HD2 ARG 87 -7.833 -7.863 -3.822 725 HD3 ARG 87 HD1 ARG 87 -7.949 -7.256 -2.171 726 HE ARG 87 HE ARG 87 -10.452 -7.260 -3.589 727 HH11 ARG 87 HH11 ARG 87 -8.270 -9.144 -1.621 728 HH12 ARG 87 HH12 ARG 87 -9.506 -10.215 -1.055 729 HH21 ARG 87 HH21 ARG 87 -12.079 -8.669 -2.845 730 HH22 ARG 87 HH22 ARG 87 -11.669 -9.946 -1.750 731 H GLY 88 HN GLY 88 -9.442 -3.269 -3.158 732 HA2 GLY 88 HA2 GLY 88 -9.932 -0.837 -4.672 733 HA3 GLY 88 HA1 GLY 88 -9.364 -0.936 -3.013 734 H LEU 89 HN LEU 89 -8.474 -0.730 -6.340 735 HA LEU 89 HA LEU 89 -5.661 -1.168 -5.881 736 HB2 LEU 89 HB2 LEU 89 -7.262 -0.250 -8.252 737 HB3 LEU 89 HB1 LEU 89 -5.511 -0.316 -8.274 738 HG LEU 89 HG LEU 89 -6.758 -2.286 -9.280 739 HD11 LEU 89 HD11 LEU 89 -4.712 -2.723 -7.117 740 HD12 LEU 89 HD12 LEU 89 -4.406 -2.410 -8.826 741 HD13 LEU 89 HD13 LEU 89 -5.162 -3.924 -8.327 742 HD21 LEU 89 HD21 LEU 89 -7.698 -3.927 -7.881 743 HD22 LEU 89 HD22 LEU 89 -8.389 -2.395 -7.346 744 HD23 LEU 89 HD23 LEU 89 -7.086 -3.145 -6.423 745 H ALA 90 HN ALA 90 -5.589 0.493 -4.144 746 HA ALA 90 HA ALA 90 -4.725 3.031 -5.282 747 HB1 ALA 90 HB1 ALA 90 -6.976 3.594 -4.799 748 HB2 ALA 90 HB2 ALA 90 -6.004 4.279 -3.499 749 HB3 ALA 90 HB3 ALA 90 -6.914 2.793 -3.230 750 H TYR 91 HN TYR 91 -3.894 4.471 -3.378 751 HA TYR 91 HA TYR 91 -2.139 2.763 -1.776 752 HB2 TYR 91 HB2 TYR 91 -1.895 5.743 -2.179 753 HB3 TYR 91 HB1 TYR 91 -0.665 4.638 -1.586 754 HD1 TYR 91 HD2 TYR 91 -2.715 5.383 -4.608 755 HD2 TYR 91 HD1 TYR 91 0.901 3.758 -3.065 756 HE1 TYR 91 HE2 TYR 91 -1.858 5.132 -6.898 757 HE2 TYR 91 HE1 TYR 91 1.769 3.507 -5.351 758 HH TYR 91 HH TYR 91 1.363 4.558 -7.603 759 H ILE 92 HN ILE 92 -2.205 2.744 0.418 760 HA ILE 92 HA ILE 92 -4.418 4.188 1.681 761 HB ILE 92 HB ILE 92 -2.626 2.026 2.802 762 HG12 ILE 92 HG12 ILE 92 -5.068 0.897 2.623 763 HG13 ILE 92 HG11 ILE 92 -5.155 1.996 1.250 764 HG21 ILE 92 HG21 ILE 92 -4.669 1.889 4.418 765 HG22 ILE 92 HG22 ILE 92 -4.927 3.561 3.920 766 HG23 ILE 92 HG23 ILE 92 -3.409 3.094 4.687 767 HD11 ILE 92 HD11 ILE 92 -4.392 -0.221 0.595 768 HD12 ILE 92 HD12 ILE 92 -3.025 -0.081 1.701 769 HD13 ILE 92 HD13 ILE 92 -3.151 0.998 0.310 770 H TYR 93 HN TYR 93 -4.105 5.995 2.789 771 HA TYR 93 HA TYR 93 -1.373 6.693 3.606 772 HB2 TYR 93 HB2 TYR 93 -3.780 8.500 3.327 773 HB3 TYR 93 HB1 TYR 93 -2.144 9.010 3.700 774 HD1 TYR 93 HD2 TYR 93 -3.163 6.554 1.095 775 HD2 TYR 93 HD1 TYR 93 -1.690 10.453 1.919 776 HE1 TYR 93 HE2 TYR 93 -2.768 6.897 -1.296 777 HE2 TYR 93 HE1 TYR 93 -1.275 10.806 -0.478 778 HH TYR 93 HH TYR 93 -2.556 9.422 -2.789 779 H ALA 94 HN ALA 94 -1.044 7.753 5.644 780 HA ALA 94 HA ALA 94 -3.145 7.392 7.644 781 HB1 ALA 94 HB1 ALA 94 -2.020 5.365 7.968 782 HB2 ALA 94 HB2 ALA 94 -1.344 6.436 9.196 783 HB3 ALA 94 HB3 ALA 94 -0.437 6.101 7.721 784 H ASP 95 HN ASP 95 -3.384 9.329 8.543 785 HA ASP 95 HA ASP 95 -2.929 11.295 9.587 786 HB2 ASP 95 HB2 ASP 95 -0.558 9.676 10.113 787 HB3 ASP 95 HB1 ASP 95 -0.205 11.401 10.088 788 H GLY 96 HN GLY 96 -2.156 10.629 6.583 789 HA2 GLY 96 HA2 GLY 96 -2.077 12.490 5.023 790 HA3 GLY 96 HA1 GLY 96 -0.971 13.290 6.125 791 H LYS 97 HN LYS 97 -0.318 9.976 5.810 792 HA LYS 97 HA LYS 97 1.630 10.482 3.675 793 HB2 LYS 97 HB2 LYS 97 2.132 9.554 6.454 794 HB3 LYS 97 HB1 LYS 97 3.066 8.795 5.171 795 HG2 LYS 97 HG2 LYS 97 3.771 11.060 4.428 796 HG3 LYS 97 HG1 LYS 97 2.953 11.725 5.843 797 HD2 LYS 97 HD2 LYS 97 5.023 9.571 6.114 798 HD3 LYS 97 HD1 LYS 97 5.484 11.269 5.993 799 HE2 LYS 97 HE2 LYS 97 5.197 11.379 8.200 800 HE3 LYS 97 HE1 LYS 97 3.466 11.266 7.884 801 HZ1 LYS 97 HZ1 LYS 97 5.335 9.086 8.604 802 HZ2 LYS 97 HZ2 LYS 97 3.804 8.779 7.954 803 HZ3 LYS 97 HZ3 LYS 97 3.948 9.590 9.430 804 H MET 98 HN MET 98 1.783 8.890 2.182 805 HA MET 98 HA MET 98 -0.121 6.779 2.234 806 HB2 MET 98 HB2 MET 98 2.148 6.637 0.321 807 HB3 MET 98 HB1 MET 98 0.431 6.362 0.059 808 HG2 MET 98 HG2 MET 98 0.431 8.327 -0.966 809 HG3 MET 98 HG1 MET 98 0.519 9.036 0.644 810 HE1 MET 98 HE1 MET 98 2.271 11.044 -1.858 811 HE2 MET 98 HE2 MET 98 2.737 11.496 -0.217 812 HE3 MET 98 HE3 MET 98 1.090 10.959 -0.550 813 H VAL 99 HN VAL 99 0.045 5.080 3.467 814 HA VAL 99 HA VAL 99 2.335 4.150 4.754 815 HB VAL 99 HB VAL 99 0.077 2.294 4.069 816 HG11 VAL 99 HG11 VAL 99 1.293 1.047 5.467 817 HG12 VAL 99 HG12 VAL 99 0.656 2.084 6.744 818 HG13 VAL 99 HG13 VAL 99 2.231 2.431 6.029 819 HG21 VAL 99 HG21 VAL 99 -0.686 3.503 6.432 820 HG22 VAL 99 HG22 VAL 99 -1.408 3.775 4.845 821 HG23 VAL 99 HG23 VAL 99 -0.145 4.854 5.436 822 H ASN 100 HN ASN 100 1.076 3.437 1.581 823 HA ASN 100 HA ASN 100 2.293 1.027 0.989 824 HB2 ASN 100 HB2 ASN 100 2.086 3.335 -0.948 825 HB3 ASN 100 HB1 ASN 100 2.082 1.614 -1.324 826 HD21 ASN 100 HD21 ASN 100 0.185 0.661 -1.554 827 HD22 ASN 100 HD22 ASN 100 -1.334 1.287 -1.029 828 H GLU 101 HN GLU 101 3.636 4.259 0.256 829 HA GLU 101 HA GLU 101 6.153 3.354 -0.563 830 HB2 GLU 101 HB2 GLU 101 6.909 5.695 -0.044 831 HB3 GLU 101 HB1 GLU 101 5.510 5.586 -1.103 832 HG2 GLU 101 HG2 GLU 101 4.084 6.444 0.460 833 HG3 GLU 101 HG1 GLU 101 5.059 5.884 1.818 834 H ALA 102 HN ALA 102 4.878 4.091 2.621 835 HA ALA 102 HA ALA 102 7.260 4.192 4.070 836 HB1 ALA 102 HB1 ALA 102 4.604 3.121 5.012 837 HB2 ALA 102 HB2 ALA 102 5.062 4.823 4.976 838 HB3 ALA 102 HB3 ALA 102 5.922 3.700 6.029 839 H LEU 103 HN LEU 103 5.220 1.406 3.257 840 HA LEU 103 HA LEU 103 6.898 -0.477 4.605 841 HB2 LEU 103 HB2 LEU 103 4.557 -0.666 2.750 842 HB3 LEU 103 HB1 LEU 103 5.506 -2.099 3.096 843 HG LEU 103 HG LEU 103 5.045 -1.225 5.611 844 HD11 LEU 103 HD11 LEU 103 2.602 -0.637 5.667 845 HD12 LEU 103 HD12 LEU 103 2.713 -0.336 3.932 846 HD13 LEU 103 HD13 LEU 103 3.672 0.626 5.058 847 HD21 LEU 103 HD21 LEU 103 3.738 -3.092 5.833 848 HD22 LEU 103 HD22 LEU 103 4.541 -3.448 4.304 849 HD23 LEU 103 HD23 LEU 103 2.893 -2.818 4.309 850 H VAL 104 HN VAL 104 6.557 0.687 1.310 851 HA VAL 104 HA VAL 104 8.205 -1.234 0.057 852 HB VAL 104 HB VAL 104 7.793 1.625 -0.825 853 HG11 VAL 104 HG11 VAL 104 8.485 0.984 -2.928 854 HG12 VAL 104 HG12 VAL 104 8.132 -0.720 -2.641 855 HG13 VAL 104 HG13 VAL 104 9.547 0.025 -1.896 856 HG21 VAL 104 HG21 VAL 104 6.115 -0.376 -2.101 857 HG22 VAL 104 HG22 VAL 104 5.685 1.190 -1.414 858 HG23 VAL 104 HG23 VAL 104 5.795 -0.229 -0.373 859 H ARG 105 HN ARG 105 8.869 1.914 1.506 860 HA ARG 105 HA ARG 105 11.658 1.865 0.815 861 HB2 ARG 105 HB2 ARG 105 10.723 4.020 0.974 862 HB3 ARG 105 HB1 ARG 105 9.932 3.662 2.501 863 HG2 ARG 105 HG2 ARG 105 12.711 3.356 2.922 864 HG3 ARG 105 HG1 ARG 105 12.480 4.852 2.021 865 HD2 ARG 105 HD2 ARG 105 12.409 4.919 4.604 866 HD3 ARG 105 HD1 ARG 105 11.197 5.814 3.690 867 HE ARG 105 HE ARG 105 10.434 3.134 4.488 868 HH11 ARG 105 HH11 ARG 105 10.392 6.535 5.285 869 HH12 ARG 105 HH12 ARG 105 9.008 6.402 6.316 870 HH21 ARG 105 HH21 ARG 105 8.607 2.964 5.838 871 HH22 ARG 105 HH22 ARG 105 7.998 4.377 6.633 872 H GLN 106 HN GLN 106 9.718 1.145 3.678 873 HA GLN 106 HA GLN 106 11.812 0.887 5.522 874 HB2 GLN 106 HB2 GLN 106 8.989 0.070 5.376 875 HB3 GLN 106 HB1 GLN 106 9.986 -0.936 6.412 876 HG2 GLN 106 HG2 GLN 106 10.073 2.037 6.667 877 HG3 GLN 106 HG1 GLN 106 8.775 1.107 7.416 878 HE21 GLN 106 HE21 GLN 106 9.615 -0.845 8.681 879 HE22 GLN 106 HE22 GLN 106 10.968 -0.547 9.713 880 H GLY 107 HN GLY 107 10.197 -1.632 3.584 881 HA2 GLY 107 HA2 GLY 107 11.873 -3.184 2.515 882 HA3 GLY 107 HA1 GLY 107 12.506 -3.390 4.136 883 H LEU 108 HN LEU 108 9.136 -3.093 4.179 884 HA LEU 108 HA LEU 108 8.892 -6.012 4.408 885 HB2 LEU 108 HB2 LEU 108 6.512 -4.923 5.347 886 HB3 LEU 108 HB1 LEU 108 7.817 -5.584 6.306 887 HG LEU 108 HG LEU 108 8.014 -2.720 5.523 888 HD11 LEU 108 HD11 LEU 108 6.464 -3.326 7.968 889 HD12 LEU 108 HD12 LEU 108 5.621 -3.448 6.424 890 HD13 LEU 108 HD13 LEU 108 6.391 -1.931 6.890 891 HD21 LEU 108 HD21 LEU 108 9.618 -4.243 6.954 892 HD22 LEU 108 HD22 LEU 108 8.484 -3.831 8.240 893 HD23 LEU 108 HD23 LEU 108 9.341 -2.554 7.379 894 H ALA 109 HN ALA 109 8.864 -4.361 1.933 895 HA ALA 109 HA ALA 109 6.884 -5.743 0.524 896 HB1 ALA 109 HB1 ALA 109 5.070 -4.432 0.474 897 HB2 ALA 109 HB2 ALA 109 6.026 -2.957 0.340 898 HB3 ALA 109 HB3 ALA 109 5.742 -3.683 1.922 899 H LYS 110 HN LYS 110 7.078 -5.448 -1.708 900 HA LYS 110 HA LYS 110 9.060 -3.457 -2.575 901 HB2 LYS 110 HB2 LYS 110 9.803 -5.271 -4.256 902 HB3 LYS 110 HB1 LYS 110 10.373 -5.380 -2.598 903 HG2 LYS 110 HG2 LYS 110 9.519 -7.409 -2.407 904 HG3 LYS 110 HG1 LYS 110 7.913 -6.801 -2.809 905 HD2 LYS 110 HD2 LYS 110 8.029 -7.546 -4.930 906 HD3 LYS 110 HD1 LYS 110 9.723 -7.084 -5.102 907 HE2 LYS 110 HE2 LYS 110 10.345 -9.068 -3.747 908 HE3 LYS 110 HE1 LYS 110 8.649 -9.546 -3.732 909 HZ1 LYS 110 HZ1 LYS 110 9.767 -9.018 -6.354 910 HZ2 LYS 110 HZ2 LYS 110 8.748 -10.267 -5.842 911 HZ3 LYS 110 HZ3 LYS 110 10.412 -10.365 -5.557 912 H VAL 111 HN VAL 111 8.900 -2.776 -4.760 913 HA VAL 111 HA VAL 111 6.187 -2.688 -5.699 914 HB VAL 111 HB VAL 111 8.714 -1.506 -6.859 915 HG11 VAL 111 HG11 VAL 111 7.252 -0.116 -8.217 916 HG12 VAL 111 HG12 VAL 111 5.839 -0.943 -7.564 917 HG13 VAL 111 HG13 VAL 111 6.992 -1.825 -8.566 918 HG21 VAL 111 HG21 VAL 111 7.947 0.585 -5.900 919 HG22 VAL 111 HG22 VAL 111 8.104 -0.638 -4.640 920 HG23 VAL 111 HG23 VAL 111 6.509 -0.212 -5.260 921 H ALA 112 HN ALA 112 5.335 -4.230 -6.941 922 HA ALA 112 HA ALA 112 6.931 -5.319 -9.136 923 HB1 ALA 112 HB1 ALA 112 5.345 -7.344 -7.698 924 HB2 ALA 112 HB2 ALA 112 6.792 -6.764 -6.872 925 HB3 ALA 112 HB3 ALA 112 6.920 -7.475 -8.480 926 H TYR 113 HN TYR 113 5.683 -6.368 -10.781 927 HA TYR 113 HA TYR 113 3.969 -6.467 -12.262 928 HB2 TYR 113 HB2 TYR 113 2.429 -6.602 -9.673 929 HB3 TYR 113 HB1 TYR 113 1.655 -6.748 -11.247 930 HD1 TYR 113 HD2 TYR 113 4.432 -8.233 -9.255 931 HD2 TYR 113 HD1 TYR 113 1.422 -8.850 -12.193 932 HE1 TYR 113 HE2 TYR 113 4.960 -10.636 -9.279 933 HE2 TYR 113 HE1 TYR 113 1.939 -11.255 -12.228 934 HH TYR 113 HH TYR 113 3.773 -12.752 -11.678 935 H VAL 114 HN VAL 114 4.977 -3.899 -11.778 936 HA VAL 114 HA VAL 114 2.705 -2.101 -11.563 937 HB VAL 114 HB VAL 114 4.828 -1.408 -10.564 938 HG11 VAL 114 HG11 VAL 114 6.815 -1.522 -11.581 939 HG12 VAL 114 HG12 VAL 114 6.197 -0.800 -13.066 940 HG13 VAL 114 HG13 VAL 114 6.000 -2.529 -12.778 941 HG21 VAL 114 HG21 VAL 114 3.848 0.216 -12.901 942 HG22 VAL 114 HG22 VAL 114 5.050 0.819 -11.758 943 HG23 VAL 114 HG23 VAL 114 3.433 0.391 -11.195 944 H TYR 115 HN TYR 115 1.545 -1.400 -13.252 945 HA TYR 115 HA TYR 115 2.786 -1.433 -15.908 946 HB2 TYR 115 HB2 TYR 115 0.410 -2.953 -15.019 947 HB3 TYR 115 HB1 TYR 115 0.277 -2.150 -16.581 948 HD1 TYR 115 HD2 TYR 115 2.689 -2.428 -17.945 949 HD2 TYR 115 HD1 TYR 115 0.958 -5.175 -15.190 950 HE1 TYR 115 HE2 TYR 115 3.944 -4.268 -18.994 951 HE2 TYR 115 HE1 TYR 115 2.210 -7.018 -16.226 952 HH TYR 115 HH TYR 115 4.611 -7.008 -17.710 953 H LYS 116 HN LYS 116 1.257 -0.369 -17.536 954 HA LYS 116 HA LYS 116 0.388 2.180 -16.380 955 HB2 LYS 116 HB2 LYS 116 0.560 1.984 -19.306 956 HB3 LYS 116 HB1 LYS 116 1.210 3.203 -18.218 957 HG2 LYS 116 HG2 LYS 116 2.876 1.240 -17.610 958 HG3 LYS 116 HG1 LYS 116 2.448 0.711 -19.237 959 HD2 LYS 116 HD2 LYS 116 4.438 2.104 -19.274 960 HD3 LYS 116 HD1 LYS 116 3.109 2.899 -20.116 961 HE2 LYS 116 HE2 LYS 116 3.106 3.606 -17.334 962 HE3 LYS 116 HE1 LYS 116 4.686 3.927 -18.043 963 HZ1 LYS 116 HZ1 LYS 116 3.730 5.829 -18.687 964 HZ2 LYS 116 HZ2 LYS 116 2.155 5.240 -18.509 965 HZ3 LYS 116 HZ3 LYS 116 3.031 4.899 -19.916 966 HA PRO 117 HA PRO 117 -0.580 3.987 -17.776 967 HB2 PRO 117 HB2 PRO 117 -2.718 5.476 -17.095 968 HB3 PRO 117 HB1 PRO 117 -2.450 4.912 -18.749 969 HG2 PRO 117 HG2 PRO 117 -4.245 3.786 -16.634 970 HG3 PRO 117 HG1 PRO 117 -4.575 4.048 -18.356 971 HD2 PRO 117 HD2 PRO 117 -3.894 1.622 -17.320 972 HD3 PRO 117 HD1 PRO 117 -3.509 2.112 -18.982 973 H ASN 118 HN ASN 118 -1.607 1.985 -15.387 974 HA ASN 118 HA ASN 118 -1.921 3.610 -13.137 975 HB2 ASN 118 HB2 ASN 118 -0.472 0.995 -12.914 976 HB3 ASN 118 HB1 ASN 118 -1.674 1.700 -11.840 977 HD21 ASN 118 HD21 ASN 118 -1.153 -0.007 -14.838 978 HD22 ASN 118 HD22 ASN 118 -2.774 -0.580 -15.020 979 H ASN 119 HN ASN 119 -0.553 5.180 -12.606 980 HA ASN 119 HA ASN 119 2.050 4.609 -11.687 981 HB2 ASN 119 HB2 ASN 119 3.171 6.190 -13.442 982 HB3 ASN 119 HB1 ASN 119 2.916 4.492 -13.835 983 HD21 ASN 119 HD21 ASN 119 2.364 4.300 -15.880 984 HD22 ASN 119 HD22 ASN 119 1.254 5.312 -16.733 985 H THR 120 HN THR 120 -0.356 6.006 -10.873 986 HA THR 120 HA THR 120 -0.106 8.790 -10.983 987 HB THR 120 HB THR 120 -1.162 7.947 -8.431 988 HG1 THR 120 HG1 THR 120 -1.548 5.953 -9.267 989 HG21 THR 120 HG21 THR 120 -1.798 9.902 -10.043 990 HG22 THR 120 HG22 THR 120 -3.015 9.141 -9.018 991 HG23 THR 120 HG23 THR 120 -2.898 8.701 -10.722 992 H HIS 121 HN HIS 121 1.135 6.462 -8.610 993 HA HIS 121 HA HIS 121 2.973 8.555 -7.648 994 HB2 HIS 121 HB2 HIS 121 1.480 6.448 -6.098 995 HB3 HIS 121 HB1 HIS 121 2.927 7.218 -5.455 996 HD1 HIS 121 HD1 HIS 121 2.128 10.093 -6.667 997 HD2 HIS 121 HD2 HIS 121 -0.199 7.657 -4.234 998 HE1 HIS 121 HE1 HIS 121 0.485 11.633 -5.549 999 HE2 HIS 121 HE2 HIS 121 -0.851 10.150 -4.011 1000 H GLU 122 HN GLU 122 3.278 6.467 -9.750 1001 HA GLU 122 HA GLU 122 4.876 4.350 -8.839 1002 HB2 GLU 122 HB2 GLU 122 3.884 4.355 -11.064 1003 HB3 GLU 122 HB1 GLU 122 4.866 5.738 -11.524 1004 HG2 GLU 122 HG2 GLU 122 6.871 4.432 -11.392 1005 HG3 GLU 122 HG1 GLU 122 5.982 3.059 -10.736 1006 H GLN 123 HN GLN 123 5.776 7.554 -10.085 1007 HA GLN 123 HA GLN 123 8.531 7.283 -10.048 1008 HB2 GLN 123 HB2 GLN 123 6.853 9.725 -9.455 1009 HB3 GLN 123 HB1 GLN 123 8.586 9.762 -9.752 1010 HG2 GLN 123 HG2 GLN 123 6.453 8.885 -11.684 1011 HG3 GLN 123 HG1 GLN 123 7.390 10.378 -11.748 1012 HE21 GLN 123 HE21 GLN 123 9.908 9.523 -11.242 1013 HE22 GLN 123 HE22 GLN 123 10.442 8.455 -12.490 1014 H LEU 124 HN LEU 124 6.338 7.556 -7.387 1015 HA LEU 124 HA LEU 124 8.350 8.367 -5.485 1016 HB2 LEU 124 HB2 LEU 124 6.061 9.076 -5.156 1017 HB3 LEU 124 HB1 LEU 124 5.511 7.411 -5.133 1018 HG LEU 124 HG LEU 124 7.088 7.176 -3.075 1019 HD11 LEU 124 HD11 LEU 124 7.858 9.022 -2.035 1020 HD12 LEU 124 HD12 LEU 124 6.480 10.008 -2.525 1021 HD13 LEU 124 HD13 LEU 124 7.791 9.699 -3.662 1022 HD21 LEU 124 HD21 LEU 124 4.564 7.119 -3.158 1023 HD22 LEU 124 HD22 LEU 124 4.601 8.830 -2.734 1024 HD23 LEU 124 HD23 LEU 124 5.277 7.634 -1.629 1025 H LEU 125 HN LEU 125 6.507 5.390 -6.133 1026 HA LEU 125 HA LEU 125 7.980 3.892 -4.170 1027 HB2 LEU 125 HB2 LEU 125 6.029 3.034 -6.303 1028 HB3 LEU 125 HB1 LEU 125 6.726 1.950 -5.115 1029 HG LEU 125 HG LEU 125 5.709 3.725 -3.422 1030 HD11 LEU 125 HD11 LEU 125 4.766 5.323 -4.794 1031 HD12 LEU 125 HD12 LEU 125 3.388 4.282 -4.437 1032 HD13 LEU 125 HD13 LEU 125 4.226 4.138 -5.982 1033 HD21 LEU 125 HD21 LEU 125 3.639 1.959 -4.560 1034 HD22 LEU 125 HD22 LEU 125 4.228 2.102 -2.903 1035 HD23 LEU 125 HD23 LEU 125 5.151 1.181 -4.090 1036 H ARG 126 HN ARG 126 8.250 4.508 -7.577 1037 HA ARG 126 HA ARG 126 9.732 2.322 -8.430 1038 HB2 ARG 126 HB2 ARG 126 8.811 4.225 -9.830 1039 HB3 ARG 126 HB1 ARG 126 10.218 5.158 -9.338 1040 HG2 ARG 126 HG2 ARG 126 11.647 3.342 -10.300 1041 HG3 ARG 126 HG1 ARG 126 10.174 2.626 -10.957 1042 HD2 ARG 126 HD2 ARG 126 9.865 5.132 -11.839 1043 HD3 ARG 126 HD1 ARG 126 11.626 5.076 -11.765 1044 HE ARG 126 HE ARG 126 9.960 3.799 -13.682 1045 HH11 ARG 126 HH11 ARG 126 12.941 3.417 -11.906 1046 HH12 ARG 126 HH12 ARG 126 13.669 2.399 -13.103 1047 HH21 ARG 126 HH21 ARG 126 10.916 2.461 -15.256 1048 HH22 ARG 126 HH22 ARG 126 12.520 1.856 -15.005 1049 H LYS 127 HN LYS 127 10.846 5.320 -6.903 1050 HA LYS 127 HA LYS 127 13.608 4.499 -6.961 1051 HB2 LYS 127 HB2 LYS 127 12.572 6.716 -5.227 1052 HB3 LYS 127 HB1 LYS 127 14.118 6.585 -6.051 1053 HG2 LYS 127 HG2 LYS 127 11.444 7.138 -7.314 1054 HG3 LYS 127 HG1 LYS 127 12.778 8.275 -7.109 1055 HD2 LYS 127 HD2 LYS 127 13.742 5.952 -8.464 1056 HD3 LYS 127 HD1 LYS 127 12.283 6.520 -9.275 1057 HE2 LYS 127 HE2 LYS 127 13.784 8.817 -8.702 1058 HE3 LYS 127 HE1 LYS 127 14.938 7.626 -9.299 1059 HZ1 LYS 127 HZ1 LYS 127 13.486 9.193 -10.881 1060 HZ2 LYS 127 HZ2 LYS 127 12.464 7.848 -10.800 1061 HZ3 LYS 127 HZ3 LYS 127 14.053 7.669 -11.351 1062 H SER 128 HN SER 128 11.060 4.783 -4.521 1063 HA SER 128 HA SER 128 12.532 4.145 -2.255 1064 HB2 SER 128 HB2 SER 128 10.378 4.891 -1.806 1065 HB3 SER 128 HB1 SER 128 9.649 3.834 -3.012 1066 HG SER 128 HG SER 128 9.376 3.239 -0.717 1067 H GLU 129 HN GLU 129 11.141 2.032 -4.703 1068 HA GLU 129 HA GLU 129 11.499 -0.399 -3.303 1069 HB2 GLU 129 HB2 GLU 129 9.991 -0.284 -5.194 1070 HB3 GLU 129 HB1 GLU 129 11.309 0.170 -6.266 1071 HG2 GLU 129 HG2 GLU 129 11.630 -2.377 -4.817 1072 HG3 GLU 129 HG1 GLU 129 10.360 -2.325 -6.038 1073 H ALA 130 HN ALA 130 13.406 0.984 -5.984 1074 HA ALA 130 HA ALA 130 15.515 -0.895 -5.696 1075 HB1 ALA 130 HB1 ALA 130 16.251 -0.063 -7.636 1076 HB2 ALA 130 HB2 ALA 130 16.202 1.600 -7.047 1077 HB3 ALA 130 HB3 ALA 130 14.732 0.836 -7.656 1078 H GLN 131 HN GLN 131 14.849 2.200 -4.274 1079 HA GLN 131 HA GLN 131 17.454 2.967 -3.586 1080 HB2 GLN 131 HB2 GLN 131 14.731 3.631 -2.562 1081 HB3 GLN 131 HB1 GLN 131 16.123 4.113 -1.608 1082 HG2 GLN 131 HG2 GLN 131 16.597 4.829 -4.308 1083 HG3 GLN 131 HG1 GLN 131 14.994 5.400 -3.850 1084 HE21 GLN 131 HE21 GLN 131 15.275 7.512 -3.543 1085 HE22 GLN 131 HE22 GLN 131 16.430 8.221 -2.472 1086 H ALA 132 HN ALA 132 14.995 1.343 -1.588 1087 HA ALA 132 HA ALA 132 16.821 0.801 0.533 1088 HB1 ALA 132 HB1 ALA 132 14.635 0.928 1.268 1089 HB2 ALA 132 HB2 ALA 132 14.896 -0.815 1.214 1090 HB3 ALA 132 HB3 ALA 132 14.013 -0.015 -0.085 1091 H LYS 133 HN LYS 133 15.989 -0.805 -2.412 1092 HA LYS 133 HA LYS 133 16.602 -3.455 -1.818 1093 HB2 LYS 133 HB2 LYS 133 15.718 -2.228 -4.007 1094 HB3 LYS 133 HB1 LYS 133 17.414 -2.337 -4.457 1095 HG2 LYS 133 HG2 LYS 133 16.857 -4.335 -5.278 1096 HG3 LYS 133 HG1 LYS 133 16.923 -4.870 -3.597 1097 HD2 LYS 133 HD2 LYS 133 14.427 -3.968 -3.621 1098 HD3 LYS 133 HD1 LYS 133 14.578 -4.339 -5.339 1099 HE2 LYS 133 HE2 LYS 133 15.674 -6.519 -3.906 1100 HE3 LYS 133 HE1 LYS 133 14.132 -6.119 -3.151 1101 HZ1 LYS 133 HZ1 LYS 133 13.665 -7.654 -4.852 1102 HZ2 LYS 133 HZ2 LYS 133 14.633 -6.845 -5.978 1103 HZ3 LYS 133 HZ3 LYS 133 13.180 -6.151 -5.462 1104 H LYS 134 HN LYS 134 18.739 -0.950 -3.180 1105 HA LYS 134 HA LYS 134 21.065 -2.447 -3.336 1106 HB2 LYS 134 HB2 LYS 134 20.909 -0.284 -4.381 1107 HB3 LYS 134 HB1 LYS 134 20.692 0.505 -2.825 1108 HG2 LYS 134 HG2 LYS 134 22.912 0.299 -2.258 1109 HG3 LYS 134 HG1 LYS 134 23.174 -1.063 -3.349 1110 HD2 LYS 134 HD2 LYS 134 22.640 1.771 -4.235 1111 HD3 LYS 134 HD1 LYS 134 24.242 1.038 -4.125 1112 HE2 LYS 134 HE2 LYS 134 22.980 -0.812 -5.616 1113 HE3 LYS 134 HE1 LYS 134 22.095 0.630 -6.110 1114 HZ1 LYS 134 HZ1 LYS 134 24.902 -0.065 -6.538 1115 HZ2 LYS 134 HZ2 LYS 134 24.527 1.570 -6.320 1116 HZ3 LYS 134 HZ3 LYS 134 23.807 0.698 -7.578 1117 H GLU 135 HN GLU 135 19.740 -0.682 -0.587 1118 HA GLU 135 HA GLU 135 22.029 -1.457 1.056 1119 HB2 GLU 135 HB2 GLU 135 20.243 -0.136 2.726 1120 HB3 GLU 135 HB1 GLU 135 21.662 0.559 1.951 1121 HG2 GLU 135 HG2 GLU 135 20.330 1.358 0.116 1122 HG3 GLU 135 HG1 GLU 135 18.902 0.539 0.748 1123 H LYS 136 HN LYS 136 19.123 -2.810 0.196 1124 HA LYS 136 HA LYS 136 17.644 -4.253 1.193 1125 HB2 LYS 136 HB2 LYS 136 20.251 -5.318 2.293 1126 HB3 LYS 136 HB1 LYS 136 18.756 -6.229 2.110 1127 HG2 LYS 136 HG2 LYS 136 18.937 -5.611 -0.380 1128 HG3 LYS 136 HG1 LYS 136 20.615 -5.221 -0.004 1129 HD2 LYS 136 HD2 LYS 136 20.865 -7.416 -0.584 1130 HD3 LYS 136 HD1 LYS 136 20.515 -7.618 1.135 1131 HE2 LYS 136 HE2 LYS 136 18.565 -8.638 0.729 1132 HE3 LYS 136 HE1 LYS 136 18.117 -7.479 -0.523 1133 HZ1 LYS 136 HZ1 LYS 136 20.227 -9.357 -1.212 1134 HZ2 LYS 136 HZ2 LYS 136 18.939 -8.782 -2.147 1135 HZ3 LYS 136 HZ3 LYS 136 18.681 -10.021 -1.024 1136 H LEU 137 HN LEU 137 16.982 -2.344 2.516 1137 HA LEU 137 HA LEU 137 17.801 -1.779 5.060 1138 HB2 LEU 137 HB2 LEU 137 15.270 -1.438 3.569 1139 HB3 LEU 137 HB1 LEU 137 15.175 -1.265 5.313 1140 HG LEU 137 HG LEU 137 16.947 0.318 3.454 1141 HD11 LEU 137 HD11 LEU 137 14.296 0.766 4.669 1142 HD12 LEU 137 HD12 LEU 137 14.984 1.395 3.172 1143 HD13 LEU 137 HD13 LEU 137 15.419 2.125 4.716 1144 HD21 LEU 137 HD21 LEU 137 17.060 1.631 5.793 1145 HD22 LEU 137 HD22 LEU 137 18.245 0.422 5.300 1146 HD23 LEU 137 HD23 LEU 137 16.930 -0.025 6.385 1147 H ASN 138 HN ASN 138 14.585 -3.244 4.930 1148 HA ASN 138 HA ASN 138 15.142 -4.627 7.387 1149 HB2 ASN 138 HB2 ASN 138 12.649 -4.517 5.685 1150 HB3 ASN 138 HB1 ASN 138 12.751 -5.328 7.244 1151 HD21 ASN 138 HD21 ASN 138 11.109 -3.075 6.374 1152 HD22 ASN 138 HD22 ASN 138 11.458 -1.781 7.463 1153 H ILE 139 HN ILE 139 13.010 -6.410 5.366 1154 HA ILE 139 HA ILE 139 14.927 -8.618 5.359 1155 HB ILE 139 HB ILE 139 12.908 -10.012 4.793 1156 HG12 ILE 139 HG12 ILE 139 11.385 -7.514 5.561 1157 HG13 ILE 139 HG11 ILE 139 11.576 -8.072 3.902 1158 HG21 ILE 139 HG21 ILE 139 12.486 -10.348 6.997 1159 HG22 ILE 139 HG22 ILE 139 12.272 -8.630 7.332 1160 HG23 ILE 139 HG23 ILE 139 13.895 -9.299 7.162 1161 HD11 ILE 139 HD11 ILE 139 10.219 -9.916 4.236 1162 HD12 ILE 139 HD12 ILE 139 9.423 -8.654 5.177 1163 HD13 ILE 139 HD13 ILE 139 10.413 -9.867 5.987 1164 H TRP 140 HN TRP 140 15.486 -6.726 3.431 1165 HA TRP 140 HA TRP 140 14.297 -7.348 0.915 1166 HB2 TRP 140 HB2 TRP 140 16.886 -5.951 1.600 1167 HB3 TRP 140 HB1 TRP 140 16.198 -6.029 -0.018 1168 HD1 TRP 140 HD1 TRP 140 15.537 -4.493 3.430 1169 HE1 TRP 140 HE1 TRP 140 13.948 -2.494 3.138 1170 HE3 TRP 140 HE3 TRP 140 14.462 -5.026 -1.535 1171 HZ2 TRP 140 HZ2 TRP 140 12.452 -1.297 1.091 1172 HZ3 TRP 140 HZ3 TRP 140 12.930 -3.407 -2.587 1173 HH2 TRP 140 HH2 TRP 140 11.947 -1.581 -1.300 Start of MODEL 10 1 H1 ALA 1 HT1 ALA 1 -25.955 30.280 -5.236 2 H2 ALA 1 HT2 ALA 1 -27.029 30.096 -6.563 3 H3 ALA 1 HT3 ALA 1 -25.606 31.040 -6.731 4 HA ALA 1 HA ALA 1 -25.913 28.141 -6.542 5 HB1 ALA 1 HB1 ALA 1 -24.047 28.595 -8.401 6 HB2 ALA 1 HB2 ALA 1 -24.916 30.126 -8.494 7 HB3 ALA 1 HB3 ALA 1 -25.775 28.607 -8.753 8 H THR 2 HN THR 2 -24.298 26.873 -5.774 9 HA THR 2 HA THR 2 -21.821 28.159 -4.869 10 HB THR 2 HB THR 2 -22.984 26.078 -3.094 11 HG1 THR 2 HG1 THR 2 -23.934 28.747 -3.194 12 HG21 THR 2 HG21 THR 2 -22.160 28.341 -1.666 13 HG22 THR 2 HG22 THR 2 -20.960 28.086 -2.932 14 HG23 THR 2 HG23 THR 2 -21.341 26.786 -1.803 15 H SER 3 HN SER 3 -20.567 27.193 -6.412 16 HA SER 3 HA SER 3 -20.219 24.296 -6.129 17 HB2 SER 3 HB2 SER 3 -21.632 24.754 -8.142 18 HB3 SER 3 HB1 SER 3 -20.300 25.698 -8.810 19 HG SER 3 HG SER 3 -20.483 22.928 -8.377 20 H THR 4 HN THR 4 -18.286 24.458 -5.080 21 HA THR 4 HA THR 4 -15.986 25.079 -6.679 22 HB THR 4 HB THR 4 -15.179 26.625 -4.660 23 HG1 THR 4 HG1 THR 4 -17.947 27.197 -4.829 24 HG21 THR 4 HG21 THR 4 -16.974 27.845 -6.725 25 HG22 THR 4 HG22 THR 4 -15.370 27.220 -7.113 26 HG23 THR 4 HG23 THR 4 -15.548 28.539 -5.954 27 H LYS 5 HN LYS 5 -16.997 22.761 -5.390 28 HA LYS 5 HA LYS 5 -15.627 22.288 -2.936 29 HB2 LYS 5 HB2 LYS 5 -16.267 19.933 -3.287 30 HB3 LYS 5 HB1 LYS 5 -17.627 21.026 -3.503 31 HG2 LYS 5 HG2 LYS 5 -16.774 20.870 -6.039 32 HG3 LYS 5 HG1 LYS 5 -16.263 19.286 -5.450 33 HD2 LYS 5 HD2 LYS 5 -18.450 18.651 -4.916 34 HD3 LYS 5 HD1 LYS 5 -19.038 20.315 -4.953 35 HE2 LYS 5 HE2 LYS 5 -17.877 19.315 -7.469 36 HE3 LYS 5 HE1 LYS 5 -19.375 18.536 -6.961 37 HZ1 LYS 5 HZ1 LYS 5 -19.538 20.601 -8.421 38 HZ2 LYS 5 HZ2 LYS 5 -19.130 21.477 -7.034 39 HZ3 LYS 5 HZ3 LYS 5 -20.534 20.533 -7.054 40 H LYS 6 HN LYS 6 -13.492 23.039 -3.568 41 HA LYS 6 HA LYS 6 -11.945 21.814 -5.571 42 HB2 LYS 6 HB2 LYS 6 -11.453 23.983 -4.351 43 HB3 LYS 6 HB1 LYS 6 -10.872 23.001 -3.013 44 HG2 LYS 6 HG2 LYS 6 -9.158 22.036 -4.421 45 HG3 LYS 6 HG1 LYS 6 -9.768 22.933 -5.812 46 HD2 LYS 6 HD2 LYS 6 -8.818 24.279 -3.293 47 HD3 LYS 6 HD1 LYS 6 -7.743 23.912 -4.643 48 HE2 LYS 6 HE2 LYS 6 -8.800 25.411 -6.059 49 HE3 LYS 6 HE1 LYS 6 -10.288 25.408 -5.114 50 HZ1 LYS 6 HZ1 LYS 6 -7.871 26.977 -4.760 51 HZ2 LYS 6 HZ2 LYS 6 -8.581 26.401 -3.336 52 HZ3 LYS 6 HZ3 LYS 6 -9.479 27.365 -4.397 53 H LEU 7 HN LEU 7 -11.821 19.637 -5.604 54 HA LEU 7 HA LEU 7 -10.413 18.353 -3.398 55 HB2 LEU 7 HB2 LEU 7 -13.143 17.572 -4.375 56 HB3 LEU 7 HB1 LEU 7 -12.073 16.394 -3.641 57 HG LEU 7 HG LEU 7 -12.216 18.700 -1.945 58 HD11 LEU 7 HD11 LEU 7 -14.353 19.170 -2.991 59 HD12 LEU 7 HD12 LEU 7 -14.590 18.590 -1.343 60 HD13 LEU 7 HD13 LEU 7 -14.878 17.510 -2.708 61 HD21 LEU 7 HD21 LEU 7 -13.164 15.853 -1.648 62 HD22 LEU 7 HD22 LEU 7 -13.047 17.022 -0.332 63 HD23 LEU 7 HD23 LEU 7 -11.591 16.499 -1.179 64 H HIS 8 HN HIS 8 -9.581 16.219 -3.970 65 HA HIS 8 HA HIS 8 -9.510 15.605 -6.821 66 HB2 HIS 8 HB2 HIS 8 -7.540 17.154 -5.978 67 HB3 HIS 8 HB1 HIS 8 -6.891 15.629 -5.382 68 HD1 HIS 8 HD1 HIS 8 -6.148 17.636 -7.981 69 HD2 HIS 8 HD2 HIS 8 -7.494 13.706 -7.916 70 HE1 HIS 8 HE1 HIS 8 -5.443 16.647 -10.182 71 HE2 HIS 8 HE2 HIS 8 -6.194 14.245 -10.085 72 H LYS 9 HN LYS 9 -8.354 14.708 -3.587 73 HA LYS 9 HA LYS 9 -8.575 11.879 -4.353 74 HB2 LYS 9 HB2 LYS 9 -7.127 11.423 -2.404 75 HB3 LYS 9 HB1 LYS 9 -6.357 12.486 -3.574 76 HG2 LYS 9 HG2 LYS 9 -7.837 13.755 -1.344 77 HG3 LYS 9 HG1 LYS 9 -6.304 12.963 -0.970 78 HD2 LYS 9 HD2 LYS 9 -6.375 14.766 -3.326 79 HD3 LYS 9 HD1 LYS 9 -6.451 15.513 -1.728 80 HE2 LYS 9 HE2 LYS 9 -4.442 13.706 -1.393 81 HE3 LYS 9 HE1 LYS 9 -4.226 14.161 -3.083 82 HZ1 LYS 9 HZ1 LYS 9 -4.555 16.217 -0.991 83 HZ2 LYS 9 HZ2 LYS 9 -3.852 16.365 -2.522 84 HZ3 LYS 9 HZ3 LYS 9 -3.040 15.529 -1.299 85 H GLU 10 HN GLU 10 -9.425 10.400 -2.720 86 HA GLU 10 HA GLU 10 -11.478 11.694 -1.050 87 HB2 GLU 10 HB2 GLU 10 -12.050 10.136 -3.127 88 HB3 GLU 10 HB1 GLU 10 -11.793 8.868 -1.938 89 HG2 GLU 10 HG2 GLU 10 -13.577 9.575 -0.619 90 HG3 GLU 10 HG1 GLU 10 -13.628 11.165 -1.378 91 HA PRO 11 HA PRO 11 -9.371 9.598 2.278 92 HB2 PRO 11 HB2 PRO 11 -10.855 10.500 4.308 93 HB3 PRO 11 HB1 PRO 11 -9.798 11.585 3.397 94 HG2 PRO 11 HG2 PRO 11 -12.757 11.214 3.199 95 HG3 PRO 11 HG1 PRO 11 -11.809 12.711 3.141 96 HD2 PRO 11 HD2 PRO 11 -12.782 11.367 0.925 97 HD3 PRO 11 HD1 PRO 11 -11.420 12.504 0.903 98 H ALA 12 HN ALA 12 -9.930 8.114 4.099 99 HA ALA 12 HA ALA 12 -12.484 6.852 4.150 100 HB1 ALA 12 HB1 ALA 12 -11.377 4.568 3.518 101 HB2 ALA 12 HB2 ALA 12 -10.255 5.593 2.624 102 HB3 ALA 12 HB3 ALA 12 -11.980 5.646 2.259 103 H THR 13 HN THR 13 -12.294 4.710 5.479 104 HA THR 13 HA THR 13 -10.240 5.039 7.561 105 HB THR 13 HB THR 13 -13.042 4.196 8.243 106 HG1 THR 13 HG1 THR 13 -13.672 6.243 8.434 107 HG21 THR 13 HG21 THR 13 -11.143 5.765 9.940 108 HG22 THR 13 HG22 THR 13 -11.080 4.004 9.862 109 HG23 THR 13 HG23 THR 13 -12.544 4.811 10.428 110 H LEU 14 HN LEU 14 -9.608 3.124 8.642 111 HA LEU 14 HA LEU 14 -9.754 0.779 7.000 112 HB2 LEU 14 HB2 LEU 14 -8.003 1.759 8.941 113 HB3 LEU 14 HB1 LEU 14 -8.697 0.317 9.661 114 HG LEU 14 HG LEU 14 -6.550 -0.051 8.430 115 HD11 LEU 14 HD11 LEU 14 -7.587 -2.046 8.709 116 HD12 LEU 14 HD12 LEU 14 -7.690 -1.947 6.951 117 HD13 LEU 14 HD13 LEU 14 -9.080 -1.507 7.942 118 HD21 LEU 14 HD21 LEU 14 -7.904 -0.084 5.831 119 HD22 LEU 14 HD22 LEU 14 -6.273 0.432 6.258 120 HD23 LEU 14 HD23 LEU 14 -7.634 1.527 6.497 121 H ILE 15 HN ILE 15 -11.565 -0.394 6.969 122 HA ILE 15 HA ILE 15 -13.381 -0.547 9.160 123 HB ILE 15 HB ILE 15 -13.198 -2.354 6.742 124 HG12 ILE 15 HG12 ILE 15 -13.445 0.062 6.187 125 HG13 ILE 15 HG11 ILE 15 -14.835 -0.902 5.700 126 HG21 ILE 15 HG21 ILE 15 -15.026 -3.414 7.457 127 HG22 ILE 15 HG22 ILE 15 -15.827 -1.907 7.900 128 HG23 ILE 15 HG23 ILE 15 -14.709 -2.678 9.027 129 HD11 ILE 15 HD11 ILE 15 -15.838 0.940 6.621 130 HD12 ILE 15 HD12 ILE 15 -14.599 1.131 7.861 131 HD13 ILE 15 HD13 ILE 15 -15.797 -0.154 8.002 132 H LYS 16 HN LYS 16 -10.993 -2.757 7.761 133 HA LYS 16 HA LYS 16 -10.320 -3.877 10.268 134 HB2 LYS 16 HB2 LYS 16 -12.435 -5.195 8.717 135 HB3 LYS 16 HB1 LYS 16 -11.110 -6.266 9.149 136 HG2 LYS 16 HG2 LYS 16 -12.080 -4.577 11.340 137 HG3 LYS 16 HG1 LYS 16 -13.253 -5.740 10.721 138 HD2 LYS 16 HD2 LYS 16 -11.623 -7.543 11.039 139 HD3 LYS 16 HD1 LYS 16 -10.456 -6.376 11.665 140 HE2 LYS 16 HE2 LYS 16 -11.676 -6.014 13.612 141 HE3 LYS 16 HE1 LYS 16 -13.166 -6.647 12.912 142 HZ1 LYS 16 HZ1 LYS 16 -10.961 -8.059 14.164 143 HZ2 LYS 16 HZ2 LYS 16 -11.607 -8.798 12.788 144 HZ3 LYS 16 HZ3 LYS 16 -12.607 -8.450 14.108 145 H ALA 17 HN ALA 17 -8.326 -4.747 10.157 146 HA ALA 17 HA ALA 17 -6.956 -4.697 7.643 147 HB1 ALA 17 HB1 ALA 17 -5.431 -5.892 9.781 148 HB2 ALA 17 HB2 ALA 17 -6.216 -4.404 10.310 149 HB3 ALA 17 HB3 ALA 17 -5.152 -4.387 8.904 150 H ILE 18 HN ILE 18 -6.277 -6.400 6.411 151 HA ILE 18 HA ILE 18 -7.269 -9.043 7.221 152 HB ILE 18 HB ILE 18 -6.322 -8.519 4.443 153 HG12 ILE 18 HG12 ILE 18 -8.119 -6.771 5.509 154 HG13 ILE 18 HG11 ILE 18 -8.049 -7.201 3.809 155 HG21 ILE 18 HG21 ILE 18 -8.515 -10.226 5.603 156 HG22 ILE 18 HG22 ILE 18 -6.916 -10.774 5.096 157 HG23 ILE 18 HG23 ILE 18 -8.057 -10.157 3.901 158 HD11 ILE 18 HD11 ILE 18 -10.325 -7.243 4.824 159 HD12 ILE 18 HD12 ILE 18 -9.797 -8.603 5.815 160 HD13 ILE 18 HD13 ILE 18 -9.836 -8.754 4.059 161 H ASP 19 HN ASP 19 -4.608 -7.973 5.082 162 HA ASP 19 HA ASP 19 -2.734 -9.520 6.722 163 HB2 ASP 19 HB2 ASP 19 -3.128 -10.043 3.776 164 HB3 ASP 19 HB1 ASP 19 -1.893 -10.781 4.792 165 H GLY 20 HN GLY 20 -3.275 -6.669 5.366 166 HA2 GLY 20 HA2 GLY 20 -1.599 -4.958 5.391 167 HA3 GLY 20 HA1 GLY 20 -0.409 -6.173 4.934 168 H ASP 21 HN ASP 21 -0.574 -7.084 2.765 169 HA ASP 21 HA ASP 21 -0.722 -5.171 0.755 170 HB2 ASP 21 HB2 ASP 21 0.115 -7.767 0.864 171 HB3 ASP 21 HB1 ASP 21 -1.362 -7.932 -0.079 172 H THR 22 HN THR 22 -3.117 -7.157 2.245 173 HA THR 22 HA THR 22 -5.199 -5.898 0.597 174 HB THR 22 HB THR 22 -5.754 -8.538 1.854 175 HG1 THR 22 HG1 THR 22 -4.572 -9.667 0.493 176 HG21 THR 22 HG21 THR 22 -7.299 -8.814 0.210 177 HG22 THR 22 HG22 THR 22 -6.381 -7.874 -0.967 178 HG23 THR 22 HG23 THR 22 -7.278 -7.053 0.311 179 H VAL 23 HN VAL 23 -6.542 -4.691 1.776 180 HA VAL 23 HA VAL 23 -7.140 -5.427 4.531 181 HB VAL 23 HB VAL 23 -6.763 -3.071 5.294 182 HG11 VAL 23 HG11 VAL 23 -5.088 -5.153 5.337 183 HG12 VAL 23 HG12 VAL 23 -4.675 -3.580 6.019 184 HG13 VAL 23 HG13 VAL 23 -4.104 -4.022 4.410 185 HG21 VAL 23 HG21 VAL 23 -5.854 -2.834 2.498 186 HG22 VAL 23 HG22 VAL 23 -4.845 -2.043 3.709 187 HG23 VAL 23 HG23 VAL 23 -6.552 -1.623 3.572 188 H LYS 24 HN LYS 24 -9.080 -4.550 5.319 189 HA LYS 24 HA LYS 24 -10.906 -3.723 3.220 190 HB2 LYS 24 HB2 LYS 24 -11.124 -5.125 5.714 191 HB3 LYS 24 HB1 LYS 24 -12.231 -3.760 5.723 192 HG2 LYS 24 HG2 LYS 24 -12.304 -5.234 3.222 193 HG3 LYS 24 HG1 LYS 24 -12.696 -6.238 4.618 194 HD2 LYS 24 HD2 LYS 24 -14.299 -4.398 5.310 195 HD3 LYS 24 HD1 LYS 24 -14.049 -3.710 3.705 196 HE2 LYS 24 HE2 LYS 24 -15.771 -5.012 3.102 197 HE3 LYS 24 HE1 LYS 24 -14.581 -6.314 3.110 198 HZ1 LYS 24 HZ1 LYS 24 -16.638 -6.804 4.376 199 HZ2 LYS 24 HZ2 LYS 24 -16.233 -5.570 5.460 200 HZ3 LYS 24 HZ3 LYS 24 -15.228 -6.922 5.306 201 H LEU 25 HN LEU 25 -11.681 -1.705 2.945 202 HA LEU 25 HA LEU 25 -11.146 0.276 5.048 203 HB2 LEU 25 HB2 LEU 25 -10.116 0.184 2.355 204 HB3 LEU 25 HB1 LEU 25 -11.039 1.651 2.614 205 HG LEU 25 HG LEU 25 -9.208 1.110 4.812 206 HD11 LEU 25 HD11 LEU 25 -7.604 0.216 3.453 207 HD12 LEU 25 HD12 LEU 25 -7.259 1.933 3.245 208 HD13 LEU 25 HD13 LEU 25 -8.184 1.065 2.021 209 HD21 LEU 25 HD21 LEU 25 -9.632 3.413 2.914 210 HD22 LEU 25 HD22 LEU 25 -8.545 3.449 4.302 211 HD23 LEU 25 HD23 LEU 25 -10.280 3.241 4.546 212 H MET 26 HN MET 26 -12.518 2.162 5.004 213 HA MET 26 HA MET 26 -15.235 1.469 4.288 214 HB2 MET 26 HB2 MET 26 -14.401 2.615 6.470 215 HB3 MET 26 HB1 MET 26 -14.410 4.086 5.505 216 HG2 MET 26 HG2 MET 26 -16.692 4.115 5.313 217 HG3 MET 26 HG1 MET 26 -16.843 2.374 5.542 218 HE1 MET 26 HE1 MET 26 -18.819 3.840 6.566 219 HE2 MET 26 HE2 MET 26 -18.402 5.201 7.607 220 HE3 MET 26 HE3 MET 26 -18.977 3.694 8.317 221 H TYR 27 HN TYR 27 -15.942 1.862 2.307 222 HA TYR 27 HA TYR 27 -15.246 4.432 1.052 223 HB2 TYR 27 HB2 TYR 27 -14.054 2.417 0.045 224 HB3 TYR 27 HB1 TYR 27 -15.637 1.878 -0.504 225 HD1 TYR 27 HD1 TYR 27 -14.238 5.322 -0.408 226 HD2 TYR 27 HD2 TYR 27 -15.545 2.078 -2.827 227 HE1 TYR 27 HE1 TYR 27 -14.011 6.732 -2.410 228 HE2 TYR 27 HE2 TYR 27 -15.320 3.477 -4.837 229 HH TYR 27 HH TYR 27 -15.263 5.812 -5.459 230 H LYS 28 HN LYS 28 -16.972 5.627 0.620 231 HA LYS 28 HA LYS 28 -19.117 6.274 0.253 232 HB2 LYS 28 HB2 LYS 28 -19.161 3.556 -1.050 233 HB3 LYS 28 HB1 LYS 28 -20.517 4.672 -1.112 234 HG2 LYS 28 HG2 LYS 28 -19.049 6.338 -2.198 235 HG3 LYS 28 HG1 LYS 28 -17.759 5.134 -2.220 236 HD2 LYS 28 HD2 LYS 28 -18.604 4.147 -4.034 237 HD3 LYS 28 HD1 LYS 28 -20.215 4.069 -3.319 238 HE2 LYS 28 HE2 LYS 28 -20.048 6.707 -3.897 239 HE3 LYS 28 HE1 LYS 28 -19.061 6.027 -5.191 240 HZ1 LYS 28 HZ1 LYS 28 -20.837 5.070 -6.159 241 HZ2 LYS 28 HZ2 LYS 28 -21.702 6.264 -5.330 242 HZ3 LYS 28 HZ3 LYS 28 -21.597 4.700 -4.693 243 H GLY 29 HN GLY 29 -18.631 5.381 2.802 244 HA2 GLY 29 HA2 GLY 29 -19.723 4.719 4.710 245 HA3 GLY 29 HA1 GLY 29 -21.209 4.872 3.784 246 H GLN 30 HN GLN 30 -18.859 2.716 2.529 247 HA GLN 30 HA GLN 30 -20.152 0.408 3.791 248 HB2 GLN 30 HB2 GLN 30 -20.933 -0.472 1.863 249 HB3 GLN 30 HB1 GLN 30 -20.830 1.175 1.264 250 HG2 GLN 30 HG2 GLN 30 -18.410 0.491 0.594 251 HG3 GLN 30 HG1 GLN 30 -19.038 -1.151 0.735 252 HE21 GLN 30 HE21 GLN 30 -18.843 -1.573 -1.445 253 HE22 GLN 30 HE22 GLN 30 -19.869 -0.850 -2.633 254 HA PRO 31 HA PRO 31 -16.029 -1.093 4.030 255 HB2 PRO 31 HB2 PRO 31 -16.433 -3.658 4.534 256 HB3 PRO 31 HB1 PRO 31 -17.059 -2.421 5.636 257 HG2 PRO 31 HG2 PRO 31 -18.513 -3.954 3.509 258 HG3 PRO 31 HG1 PRO 31 -19.011 -3.616 5.179 259 HD2 PRO 31 HD2 PRO 31 -19.827 -2.152 2.992 260 HD3 PRO 31 HD1 PRO 31 -19.773 -1.524 4.651 261 H MET 32 HN MET 32 -14.689 -1.176 2.362 262 HA MET 32 HA MET 32 -15.190 -3.147 0.231 263 HB2 MET 32 HB2 MET 32 -15.231 -0.491 -0.173 264 HB3 MET 32 HB1 MET 32 -13.505 -0.775 -0.360 265 HG2 MET 32 HG2 MET 32 -14.615 -0.848 -2.503 266 HG3 MET 32 HG1 MET 32 -13.964 -2.434 -2.092 267 HE1 MET 32 HE1 MET 32 -15.755 -4.130 -3.635 268 HE2 MET 32 HE2 MET 32 -15.500 -2.517 -4.303 269 HE3 MET 32 HE3 MET 32 -17.131 -3.180 -4.197 270 H THR 33 HN THR 33 -13.371 -4.200 -0.656 271 HA THR 33 HA THR 33 -11.187 -4.484 1.240 272 HB THR 33 HB THR 33 -11.647 -6.015 -1.325 273 HG1 THR 33 HG1 THR 33 -12.563 -6.572 1.299 274 HG21 THR 33 HG21 THR 33 -9.761 -7.042 -0.817 275 HG22 THR 33 HG22 THR 33 -10.547 -7.658 0.637 276 HG23 THR 33 HG23 THR 33 -9.623 -6.157 0.702 277 H PHE 34 HN PHE 34 -9.502 -3.175 1.056 278 HA PHE 34 HA PHE 34 -8.718 -2.198 -1.596 279 HB2 PHE 34 HB2 PHE 34 -8.403 -1.161 1.185 280 HB3 PHE 34 HB1 PHE 34 -7.182 -0.724 -0.007 281 HD1 PHE 34 HD1 PHE 34 -10.845 -0.680 0.616 282 HD2 PHE 34 HD2 PHE 34 -7.559 1.016 -1.498 283 HE1 PHE 34 HE1 PHE 34 -12.317 1.093 -0.249 284 HE2 PHE 34 HE2 PHE 34 -9.025 2.792 -2.360 285 HZ PHE 34 HZ PHE 34 -11.408 2.830 -1.739 286 H ARG 35 HN ARG 35 -6.430 -2.137 -2.145 287 HA ARG 35 HA ARG 35 -4.831 -4.157 -0.731 288 HB2 ARG 35 HB2 ARG 35 -5.693 -5.312 -2.629 289 HB3 ARG 35 HB1 ARG 35 -5.349 -3.957 -3.695 290 HG2 ARG 35 HG2 ARG 35 -2.966 -4.964 -2.370 291 HG3 ARG 35 HG1 ARG 35 -3.784 -6.192 -3.335 292 HD2 ARG 35 HD2 ARG 35 -3.876 -4.259 -5.114 293 HD3 ARG 35 HD1 ARG 35 -2.513 -3.636 -4.183 294 HE ARG 35 HE ARG 35 -1.810 -6.201 -4.618 295 HH11 ARG 35 HH11 ARG 35 -2.909 -3.662 -6.746 296 HH12 ARG 35 HH12 ARG 35 -2.031 -4.257 -8.114 297 HH21 ARG 35 HH21 ARG 35 -0.654 -6.986 -6.416 298 HH22 ARG 35 HH22 ARG 35 -0.752 -6.145 -7.928 299 H LEU 36 HN LEU 36 -2.673 -3.735 -0.533 300 HA LEU 36 HA LEU 36 -1.782 -1.075 -0.877 301 HB2 LEU 36 HB2 LEU 36 -0.315 -3.641 -0.251 302 HB3 LEU 36 HB1 LEU 36 0.503 -2.087 -0.361 303 HG LEU 36 HG LEU 36 -1.751 -2.660 1.562 304 HD11 LEU 36 HD11 LEU 36 0.054 -2.719 3.273 305 HD12 LEU 36 HD12 LEU 36 1.233 -2.761 1.964 306 HD13 LEU 36 HD13 LEU 36 0.083 -4.082 2.157 307 HD21 LEU 36 HD21 LEU 36 -0.940 -0.621 2.662 308 HD22 LEU 36 HD22 LEU 36 -1.485 -0.309 1.013 309 HD23 LEU 36 HD23 LEU 36 0.240 -0.403 1.369 310 H LEU 37 HN LEU 37 -2.245 -0.692 -3.089 311 HA LEU 37 HA LEU 37 -1.602 -1.942 -5.348 312 HB2 LEU 37 HB2 LEU 37 -2.458 0.489 -4.856 313 HB3 LEU 37 HB1 LEU 37 -0.792 0.922 -5.181 314 HG LEU 37 HG LEU 37 -0.981 -0.161 -7.404 315 HD11 LEU 37 HD11 LEU 37 -2.632 -1.768 -7.242 316 HD12 LEU 37 HD12 LEU 37 -3.432 -0.484 -8.148 317 HD13 LEU 37 HD13 LEU 37 -3.754 -0.679 -6.425 318 HD21 LEU 37 HD21 LEU 37 -3.019 1.575 -8.017 319 HD22 LEU 37 HD22 LEU 37 -1.311 1.994 -7.892 320 HD23 LEU 37 HD23 LEU 37 -2.381 2.232 -6.511 321 H LEU 38 HN LEU 38 0.089 -2.318 -6.694 322 HA LEU 38 HA LEU 38 2.204 -3.108 -7.072 323 HB2 LEU 38 HB2 LEU 38 3.855 -1.202 -7.266 324 HB3 LEU 38 HB1 LEU 38 2.390 -1.090 -8.219 325 HG LEU 38 HG LEU 38 2.346 0.238 -5.572 326 HD11 LEU 38 HD11 LEU 38 4.614 0.645 -6.880 327 HD12 LEU 38 HD12 LEU 38 3.776 1.942 -6.029 328 HD13 LEU 38 HD13 LEU 38 3.596 1.774 -7.775 329 HD21 LEU 38 HD21 LEU 38 0.524 1.091 -6.499 330 HD22 LEU 38 HD22 LEU 38 0.871 0.241 -8.003 331 HD23 LEU 38 HD23 LEU 38 1.514 1.862 -7.736 332 H VAL 39 HN VAL 39 1.566 -3.575 -4.352 333 HA VAL 39 HA VAL 39 4.225 -3.213 -3.131 334 HB VAL 39 HB VAL 39 1.605 -3.507 -1.649 335 HG11 VAL 39 HG11 VAL 39 3.591 -4.482 -0.524 336 HG12 VAL 39 HG12 VAL 39 2.872 -3.132 0.356 337 HG13 VAL 39 HG13 VAL 39 4.351 -2.892 -0.574 338 HG21 VAL 39 HG21 VAL 39 1.361 -1.316 -1.987 339 HG22 VAL 39 HG22 VAL 39 2.955 -1.188 -2.731 340 HG23 VAL 39 HG23 VAL 39 2.788 -1.079 -0.980 341 H ASP 40 HN ASP 40 5.223 -5.001 -2.271 342 HA ASP 40 HA ASP 40 3.832 -7.568 -2.675 343 HB2 ASP 40 HB2 ASP 40 6.479 -6.628 -3.500 344 HB3 ASP 40 HB1 ASP 40 6.524 -8.181 -2.666 345 H THR 41 HN THR 41 3.629 -8.889 -0.986 346 HA THR 41 HA THR 41 4.893 -8.098 1.534 347 HB THR 41 HB THR 41 3.208 -9.928 2.386 348 HG1 THR 41 HG1 THR 41 2.671 -10.524 0.177 349 HG21 THR 41 HG21 THR 41 1.415 -8.301 2.561 350 HG22 THR 41 HG22 THR 41 2.209 -7.282 1.361 351 HG23 THR 41 HG23 THR 41 2.975 -7.565 2.924 352 HA PRO 42 HA PRO 42 7.696 -11.504 1.501 353 HB2 PRO 42 HB2 PRO 42 7.925 -11.997 4.169 354 HB3 PRO 42 HB1 PRO 42 8.680 -10.613 3.371 355 HG2 PRO 42 HG2 PRO 42 6.132 -10.737 4.938 356 HG3 PRO 42 HG1 PRO 42 7.412 -9.511 4.980 357 HD2 PRO 42 HD2 PRO 42 5.107 -9.142 3.623 358 HD3 PRO 42 HD1 PRO 42 6.652 -8.472 3.063 359 H GLU 43 HN GLU 43 6.288 -13.028 0.485 360 HA GLU 43 HA GLU 43 5.192 -15.013 0.318 361 HB2 GLU 43 HB2 GLU 43 7.117 -15.457 2.118 362 HB3 GLU 43 HB1 GLU 43 5.725 -15.717 3.160 363 HG2 GLU 43 HG2 GLU 43 4.880 -17.375 1.515 364 HG3 GLU 43 HG1 GLU 43 6.384 -17.180 0.616 365 H THR 44 HN THR 44 3.317 -13.409 0.371 366 HA THR 44 HA THR 44 1.313 -14.481 2.152 367 HB THR 44 HB THR 44 1.978 -11.531 2.209 368 HG1 THR 44 HG1 THR 44 3.329 -12.392 3.625 369 HG21 THR 44 HG21 THR 44 -0.204 -11.315 2.665 370 HG22 THR 44 HG22 THR 44 0.275 -11.900 4.258 371 HG23 THR 44 HG23 THR 44 -0.400 -13.018 3.073 372 H LYS 45 HN LYS 45 0.272 -15.201 0.307 373 HA LYS 45 HA LYS 45 -1.192 -13.141 -1.147 374 HB2 LYS 45 HB2 LYS 45 0.682 -15.124 -2.391 375 HB3 LYS 45 HB1 LYS 45 -0.735 -14.580 -3.279 376 HG2 LYS 45 HG2 LYS 45 0.988 -12.499 -2.070 377 HG3 LYS 45 HG1 LYS 45 1.621 -13.374 -3.465 378 HD2 LYS 45 HD2 LYS 45 -0.004 -12.563 -4.880 379 HD3 LYS 45 HD1 LYS 45 -1.157 -12.291 -3.572 380 HE2 LYS 45 HE2 LYS 45 -0.217 -10.277 -2.980 381 HE3 LYS 45 HE1 LYS 45 1.365 -10.704 -3.629 382 HZ1 LYS 45 HZ1 LYS 45 -0.310 -9.048 -4.845 383 HZ2 LYS 45 HZ2 LYS 45 -0.798 -10.500 -5.561 384 HZ3 LYS 45 HZ3 LYS 45 0.813 -9.998 -5.682 385 H HIS 46 HN HIS 46 -2.835 -14.037 0.300 386 HA HIS 46 HA HIS 46 -4.712 -15.264 0.662 387 HB2 HIS 46 HB2 HIS 46 -4.219 -15.459 -2.186 388 HB3 HIS 46 HB1 HIS 46 -4.999 -16.917 -1.581 389 HD1 HIS 46 HD1 HIS 46 -7.337 -16.543 -0.344 390 HD2 HIS 46 HD2 HIS 46 -5.865 -13.287 -2.465 391 HE1 HIS 46 HE1 HIS 46 -9.292 -14.987 -0.630 392 HE2 HIS 46 HE2 HIS 46 -8.355 -12.984 -1.838 393 HA PRO 47 HA PRO 47 -2.704 -18.927 2.310 394 HB2 PRO 47 HB2 PRO 47 -4.772 -19.714 3.897 395 HB3 PRO 47 HB1 PRO 47 -3.651 -18.422 4.338 396 HG2 PRO 47 HG2 PRO 47 -6.395 -18.227 3.158 397 HG3 PRO 47 HG1 PRO 47 -5.667 -17.270 4.463 398 HD2 PRO 47 HD2 PRO 47 -5.861 -16.342 1.936 399 HD3 PRO 47 HD1 PRO 47 -4.499 -15.923 2.994 400 H LYS 48 HN LYS 48 -2.567 -20.372 0.647 401 HA LYS 48 HA LYS 48 -5.020 -21.743 -0.205 402 HB2 LYS 48 HB2 LYS 48 -3.014 -20.670 -1.716 403 HB3 LYS 48 HB1 LYS 48 -2.509 -22.351 -1.619 404 HG2 LYS 48 HG2 LYS 48 -4.663 -23.062 -2.508 405 HG3 LYS 48 HG1 LYS 48 -5.194 -21.380 -2.580 406 HD2 LYS 48 HD2 LYS 48 -3.602 -20.855 -4.254 407 HD3 LYS 48 HD1 LYS 48 -2.747 -22.380 -4.017 408 HE2 LYS 48 HE2 LYS 48 -5.068 -23.416 -4.670 409 HE3 LYS 48 HE1 LYS 48 -5.325 -21.840 -5.416 410 HZ1 LYS 48 HZ1 LYS 48 -4.151 -23.872 -6.655 411 HZ2 LYS 48 HZ2 LYS 48 -2.784 -23.125 -5.995 412 HZ3 LYS 48 HZ3 LYS 48 -3.813 -22.252 -7.014 413 H LYS 49 HN LYS 49 -5.148 -24.002 -0.239 414 HA LYS 49 HA LYS 49 -4.861 -26.106 0.572 415 HB2 LYS 49 HB2 LYS 49 -2.150 -25.153 -0.036 416 HB3 LYS 49 HB1 LYS 49 -2.201 -26.461 1.136 417 HG2 LYS 49 HG2 LYS 49 -3.512 -27.807 -0.447 418 HG3 LYS 49 HG1 LYS 49 -3.395 -26.501 -1.628 419 HD2 LYS 49 HD2 LYS 49 -1.087 -26.795 -1.893 420 HD3 LYS 49 HD1 LYS 49 -0.943 -27.718 -0.396 421 HE2 LYS 49 HE2 LYS 49 -2.605 -28.741 -2.668 422 HE3 LYS 49 HE1 LYS 49 -0.855 -28.962 -2.668 423 HZ1 LYS 49 HZ1 LYS 49 -2.833 -30.402 -1.241 424 HZ2 LYS 49 HZ2 LYS 49 -1.723 -29.724 -0.159 425 HZ3 LYS 49 HZ3 LYS 49 -1.182 -30.735 -1.403 426 H GLY 50 HN GLY 50 -5.338 -23.870 2.404 427 HA2 GLY 50 HA2 GLY 50 -5.807 -23.961 4.702 428 HA3 GLY 50 HA1 GLY 50 -4.657 -25.279 4.862 429 H VAL 51 HN VAL 51 -2.440 -24.813 5.063 430 HA VAL 51 HA VAL 51 -0.738 -23.705 6.107 431 HB VAL 51 HB VAL 51 0.030 -21.700 4.978 432 HG11 VAL 51 HG11 VAL 51 -0.431 -22.639 2.512 433 HG12 VAL 51 HG12 VAL 51 -0.929 -24.040 3.458 434 HG13 VAL 51 HG13 VAL 51 0.700 -23.389 3.637 435 HG21 VAL 51 HG21 VAL 51 -2.218 -20.612 4.830 436 HG22 VAL 51 HG22 VAL 51 -2.576 -21.675 3.466 437 HG23 VAL 51 HG23 VAL 51 -1.257 -20.509 3.355 438 H GLU 52 HN GLU 52 -0.164 -21.171 6.813 439 HA GLU 52 HA GLU 52 -2.288 -20.546 8.748 440 HB2 GLU 52 HB2 GLU 52 0.696 -20.369 8.845 441 HB3 GLU 52 HB1 GLU 52 -0.256 -19.273 9.839 442 HG2 GLU 52 HG2 GLU 52 -1.256 -21.078 11.017 443 HG3 GLU 52 HG1 GLU 52 -0.589 -22.259 9.891 444 H LYS 53 HN LYS 53 -2.478 -18.241 9.381 445 HA LYS 53 HA LYS 53 -2.627 -16.604 7.006 446 HB2 LYS 53 HB2 LYS 53 -4.411 -16.730 8.808 447 HB3 LYS 53 HB1 LYS 53 -3.328 -15.790 9.824 448 HG2 LYS 53 HG2 LYS 53 -3.751 -13.874 8.733 449 HG3 LYS 53 HG1 LYS 53 -3.819 -14.666 7.156 450 HD2 LYS 53 HD2 LYS 53 -6.053 -15.665 8.125 451 HD3 LYS 53 HD1 LYS 53 -5.974 -14.248 9.174 452 HE2 LYS 53 HE2 LYS 53 -5.522 -13.006 6.896 453 HE3 LYS 53 HE1 LYS 53 -6.337 -14.416 6.221 454 HZ1 LYS 53 HZ1 LYS 53 -7.641 -13.159 8.493 455 HZ2 LYS 53 HZ2 LYS 53 -8.309 -13.794 7.075 456 HZ3 LYS 53 HZ3 LYS 53 -7.617 -12.251 7.067 457 H TYR 54 HN TYR 54 -0.844 -15.612 6.333 458 HA TYR 54 HA TYR 54 1.392 -15.001 7.911 459 HB2 TYR 54 HB2 TYR 54 0.590 -13.648 5.325 460 HB3 TYR 54 HB1 TYR 54 2.215 -13.784 5.990 461 HD1 TYR 54 HD2 TYR 54 3.406 -15.928 5.932 462 HD2 TYR 54 HD1 TYR 54 -0.434 -15.487 4.155 463 HE1 TYR 54 HE2 TYR 54 3.749 -18.020 4.689 464 HE2 TYR 54 HE1 TYR 54 -0.101 -17.580 2.905 465 HH TYR 54 HH TYR 54 2.490 -19.733 3.582 466 H GLY 55 HN GLY 55 1.905 -12.256 7.078 467 HA2 GLY 55 HA2 GLY 55 1.202 -10.063 7.532 468 HA3 GLY 55 HA1 GLY 55 -0.154 -10.709 8.439 469 HA PRO 56 HA PRO 56 3.230 -11.085 11.699 470 HB2 PRO 56 HB2 PRO 56 5.852 -11.155 11.038 471 HB3 PRO 56 HB1 PRO 56 4.825 -12.592 10.997 472 HG2 PRO 56 HG2 PRO 56 5.734 -10.851 8.745 473 HG3 PRO 56 HG1 PRO 56 5.574 -12.613 8.808 474 HD2 PRO 56 HD2 PRO 56 3.733 -10.942 7.646 475 HD3 PRO 56 HD1 PRO 56 3.352 -12.549 8.295 476 H GLU 57 HN GLU 57 5.859 -9.509 10.030 477 HA GLU 57 HA GLU 57 5.483 -7.129 11.596 478 HB2 GLU 57 HB2 GLU 57 7.678 -8.403 10.576 479 HB3 GLU 57 HB1 GLU 57 7.497 -7.063 9.453 480 HG2 GLU 57 HG2 GLU 57 8.510 -5.744 10.903 481 HG3 GLU 57 HG1 GLU 57 7.179 -5.991 12.032 482 H ALA 58 HN ALA 58 4.716 -8.172 8.388 483 HA ALA 58 HA ALA 58 4.575 -5.603 7.174 484 HB1 ALA 58 HB1 ALA 58 2.965 -7.051 5.606 485 HB2 ALA 58 HB2 ALA 58 3.805 -8.360 6.438 486 HB3 ALA 58 HB3 ALA 58 4.725 -7.156 5.535 487 H SER 59 HN SER 59 1.989 -7.843 8.224 488 HA SER 59 HA SER 59 -0.126 -6.056 7.809 489 HB2 SER 59 HB2 SER 59 0.264 -8.634 9.092 490 HB3 SER 59 HB1 SER 59 -0.947 -7.661 9.923 491 HG SER 59 HG SER 59 -2.115 -8.583 8.374 492 H ALA 60 HN ALA 60 1.881 -6.626 10.665 493 HA ALA 60 HA ALA 60 0.468 -5.080 12.502 494 HB1 ALA 60 HB1 ALA 60 3.407 -4.989 12.710 495 HB2 ALA 60 HB2 ALA 60 2.684 -6.597 12.645 496 HB3 ALA 60 HB3 ALA 60 2.196 -5.460 13.902 497 H PHE 61 HN PHE 61 3.320 -4.091 10.587 498 HA PHE 61 HA PHE 61 3.305 -1.412 11.338 499 HB2 PHE 61 HB2 PHE 61 5.185 -2.510 10.181 500 HB3 PHE 61 HB1 PHE 61 4.222 -2.583 8.706 501 HD1 PHE 61 HD1 PHE 61 5.734 -0.267 11.146 502 HD2 PHE 61 HD2 PHE 61 4.125 -0.761 7.245 503 HE1 PHE 61 HE1 PHE 61 6.512 1.994 10.543 504 HE2 PHE 61 HE2 PHE 61 4.891 1.491 6.628 505 HZ PHE 61 HZ PHE 61 6.091 2.875 8.280 506 H THR 62 HN THR 62 1.971 -2.867 8.363 507 HA THR 62 HA THR 62 0.916 -0.590 7.218 508 HB THR 62 HB THR 62 -0.401 -3.314 7.184 509 HG1 THR 62 HG1 THR 62 1.014 -3.874 5.632 510 HG21 THR 62 HG21 THR 62 -1.116 -2.729 4.945 511 HG22 THR 62 HG22 THR 62 -0.366 -1.140 5.104 512 HG23 THR 62 HG23 THR 62 -1.739 -1.573 6.122 513 H LYS 63 HN LYS 63 -0.462 -2.640 9.734 514 HA LYS 63 HA LYS 63 -2.943 -1.190 9.846 515 HB2 LYS 63 HB2 LYS 63 -2.378 -3.668 10.553 516 HB3 LYS 63 HB1 LYS 63 -1.970 -2.914 12.088 517 HG2 LYS 63 HG2 LYS 63 -4.426 -1.821 11.458 518 HG3 LYS 63 HG1 LYS 63 -4.561 -3.497 10.931 519 HD2 LYS 63 HD2 LYS 63 -3.521 -2.726 13.646 520 HD3 LYS 63 HD1 LYS 63 -5.233 -3.011 13.327 521 HE2 LYS 63 HE2 LYS 63 -3.406 -5.104 12.360 522 HE3 LYS 63 HE1 LYS 63 -3.480 -4.924 14.112 523 HZ1 LYS 63 HZ1 LYS 63 -5.817 -5.335 12.325 524 HZ2 LYS 63 HZ2 LYS 63 -5.874 -5.189 14.010 525 HZ3 LYS 63 HZ3 LYS 63 -5.107 -6.520 13.303 526 H LYS 64 HN LYS 64 0.126 -1.171 11.519 527 HA LYS 64 HA LYS 64 -0.516 0.366 13.751 528 HB2 LYS 64 HB2 LYS 64 1.699 -0.843 13.017 529 HB3 LYS 64 HB1 LYS 64 2.105 0.732 12.351 530 HG2 LYS 64 HG2 LYS 64 1.282 0.334 15.213 531 HG3 LYS 64 HG1 LYS 64 2.959 0.248 14.666 532 HD2 LYS 64 HD2 LYS 64 2.224 2.584 13.551 533 HD3 LYS 64 HD1 LYS 64 1.177 2.582 14.972 534 HE2 LYS 64 HE2 LYS 64 2.899 2.846 16.404 535 HE3 LYS 64 HE1 LYS 64 3.974 1.813 15.463 536 HZ1 LYS 64 HZ1 LYS 64 3.626 4.681 15.375 537 HZ2 LYS 64 HZ2 LYS 64 3.717 3.942 13.855 538 HZ3 LYS 64 HZ3 LYS 64 4.973 3.740 14.971 539 H MET 65 HN MET 65 0.489 1.396 10.509 540 HA MET 65 HA MET 65 0.529 4.162 11.123 541 HB2 MET 65 HB2 MET 65 1.062 2.483 8.844 542 HB3 MET 65 HB1 MET 65 0.113 3.881 8.357 543 HG2 MET 65 HG2 MET 65 1.969 5.057 9.930 544 HG3 MET 65 HG1 MET 65 2.894 3.707 9.277 545 HE1 MET 65 HE1 MET 65 3.103 7.000 8.966 546 HE2 MET 65 HE2 MET 65 1.397 7.227 8.582 547 HE3 MET 65 HE3 MET 65 2.628 7.598 7.376 548 H VAL 66 HN VAL 66 -1.819 2.180 9.300 549 HA VAL 66 HA VAL 66 -3.643 4.273 8.848 550 HB VAL 66 HB VAL 66 -5.310 2.487 8.399 551 HG11 VAL 66 HG11 VAL 66 -4.108 3.082 6.510 552 HG12 VAL 66 HG12 VAL 66 -3.851 1.339 6.590 553 HG13 VAL 66 HG13 VAL 66 -2.593 2.441 7.148 554 HG21 VAL 66 HG21 VAL 66 -4.355 0.125 8.368 555 HG22 VAL 66 HG22 VAL 66 -4.801 0.791 9.938 556 HG23 VAL 66 HG23 VAL 66 -3.107 0.739 9.451 557 H GLU 67 HN GLU 67 -3.485 1.830 11.416 558 HA GLU 67 HA GLU 67 -5.898 2.533 12.676 559 HB2 GLU 67 HB2 GLU 67 -3.406 1.240 13.790 560 HB3 GLU 67 HB1 GLU 67 -4.924 1.373 14.667 561 HG2 GLU 67 HG2 GLU 67 -4.769 0.050 11.986 562 HG3 GLU 67 HG1 GLU 67 -4.414 -0.822 13.478 563 H ASN 68 HN ASN 68 -2.541 3.448 13.468 564 HA ASN 68 HA ASN 68 -3.255 5.221 15.554 565 HB2 ASN 68 HB2 ASN 68 -0.769 4.836 13.908 566 HB3 ASN 68 HB1 ASN 68 -0.892 6.167 15.054 567 HD21 ASN 68 HD21 ASN 68 -1.371 2.663 14.848 568 HD22 ASN 68 HD22 ASN 68 -0.772 2.316 16.431 569 H ALA 69 HN ALA 69 -2.903 5.593 12.095 570 HA ALA 69 HA ALA 69 -2.863 8.422 12.024 571 HB1 ALA 69 HB1 ALA 69 -3.697 8.006 9.619 572 HB2 ALA 69 HB2 ALA 69 -3.474 6.299 10.001 573 HB3 ALA 69 HB3 ALA 69 -2.104 7.406 10.076 574 H LYS 70 HN LYS 70 -4.429 9.709 12.703 575 HA LYS 70 HA LYS 70 -7.032 8.944 13.325 576 HB2 LYS 70 HB2 LYS 70 -5.702 11.584 12.856 577 HB3 LYS 70 HB1 LYS 70 -7.447 11.521 13.063 578 HG2 LYS 70 HG2 LYS 70 -5.742 10.134 15.061 579 HG3 LYS 70 HG1 LYS 70 -5.828 11.897 15.100 580 HD2 LYS 70 HD2 LYS 70 -8.375 11.572 15.025 581 HD3 LYS 70 HD1 LYS 70 -8.036 9.896 15.461 582 HE2 LYS 70 HE2 LYS 70 -8.181 10.678 17.567 583 HE3 LYS 70 HE1 LYS 70 -6.519 11.192 17.280 584 HZ1 LYS 70 HZ1 LYS 70 -7.858 13.273 16.305 585 HZ2 LYS 70 HZ2 LYS 70 -7.339 13.172 17.911 586 HZ3 LYS 70 HZ3 LYS 70 -8.936 12.782 17.514 587 H LYS 71 HN LYS 71 -5.639 9.747 10.273 588 HA LYS 71 HA LYS 71 -8.249 9.368 9.014 589 HB2 LYS 71 HB2 LYS 71 -7.445 11.876 9.297 590 HB3 LYS 71 HB1 LYS 71 -6.482 11.485 7.880 591 HG2 LYS 71 HG2 LYS 71 -8.475 10.896 6.644 592 HG3 LYS 71 HG1 LYS 71 -9.472 11.184 8.071 593 HD2 LYS 71 HD2 LYS 71 -9.615 13.345 7.570 594 HD3 LYS 71 HD1 LYS 71 -7.858 13.492 7.586 595 HE2 LYS 71 HE2 LYS 71 -7.799 13.669 5.370 596 HE3 LYS 71 HE1 LYS 71 -8.721 12.179 5.179 597 HZ1 LYS 71 HZ1 LYS 71 -10.632 13.298 4.875 598 HZ2 LYS 71 HZ2 LYS 71 -9.608 14.565 4.418 599 HZ3 LYS 71 HZ3 LYS 71 -10.244 14.516 5.985 600 H ILE 72 HN ILE 72 -8.198 8.303 7.090 601 HA ILE 72 HA ILE 72 -5.542 7.520 6.079 602 HB ILE 72 HB ILE 72 -8.008 5.852 5.704 603 HG12 ILE 72 HG12 ILE 72 -6.030 5.642 7.985 604 HG13 ILE 72 HG11 ILE 72 -7.705 6.166 8.129 605 HG21 ILE 72 HG21 ILE 72 -5.710 5.641 4.449 606 HG22 ILE 72 HG22 ILE 72 -6.611 4.212 4.957 607 HG23 ILE 72 HG23 ILE 72 -5.246 4.782 5.917 608 HD11 ILE 72 HD11 ILE 72 -8.395 3.930 7.281 609 HD12 ILE 72 HD12 ILE 72 -7.566 3.902 8.838 610 HD13 ILE 72 HD13 ILE 72 -6.704 3.437 7.370 611 H GLU 73 HN GLU 73 -5.225 7.499 3.863 612 HA GLU 73 HA GLU 73 -7.439 8.557 2.229 613 HB2 GLU 73 HB2 GLU 73 -4.583 9.297 1.677 614 HB3 GLU 73 HB1 GLU 73 -6.052 10.104 1.152 615 HG2 GLU 73 HG2 GLU 73 -6.393 10.532 3.699 616 HG3 GLU 73 HG1 GLU 73 -4.657 10.233 3.780 617 H VAL 74 HN VAL 74 -7.691 7.711 0.206 618 HA VAL 74 HA VAL 74 -5.771 5.631 -0.601 619 HB VAL 74 HB VAL 74 -7.818 4.554 -1.735 620 HG11 VAL 74 HG11 VAL 74 -6.815 4.379 0.998 621 HG12 VAL 74 HG12 VAL 74 -7.124 3.106 -0.184 622 HG13 VAL 74 HG13 VAL 74 -8.445 3.734 0.801 623 HG21 VAL 74 HG21 VAL 74 -9.466 6.228 -1.439 624 HG22 VAL 74 HG22 VAL 74 -9.143 6.342 0.290 625 HG23 VAL 74 HG23 VAL 74 -9.913 4.900 -0.369 626 H GLU 75 HN GLU 75 -5.074 5.663 -2.657 627 HA GLU 75 HA GLU 75 -6.375 7.557 -4.505 628 HB2 GLU 75 HB2 GLU 75 -4.240 8.460 -3.783 629 HB3 GLU 75 HB1 GLU 75 -3.429 6.956 -4.193 630 HG2 GLU 75 HG2 GLU 75 -3.233 7.517 -6.336 631 HG3 GLU 75 HG1 GLU 75 -4.892 8.105 -6.429 632 H PHE 76 HN PHE 76 -7.441 6.359 -5.948 633 HA PHE 76 HA PHE 76 -6.628 3.726 -6.695 634 HB2 PHE 76 HB2 PHE 76 -8.789 5.575 -7.703 635 HB3 PHE 76 HB1 PHE 76 -8.513 3.975 -8.385 636 HD1 PHE 76 HD2 PHE 76 -8.146 2.179 -6.273 637 HD2 PHE 76 HD1 PHE 76 -10.618 5.644 -6.344 638 HE1 PHE 76 HE2 PHE 76 -9.573 1.193 -4.529 639 HE2 PHE 76 HE1 PHE 76 -12.049 4.663 -4.600 640 HZ PHE 76 HZ PHE 76 -11.528 2.435 -3.690 641 H ASP 77 HN ASP 77 -5.682 3.026 -8.524 642 HA ASP 77 HA ASP 77 -3.832 4.621 -9.844 643 HB2 ASP 77 HB2 ASP 77 -3.574 2.764 -11.417 644 HB3 ASP 77 HB1 ASP 77 -3.707 2.164 -9.768 645 H LYS 78 HN LYS 78 -3.976 4.323 -12.515 646 HA LYS 78 HA LYS 78 -6.283 5.999 -13.226 647 HB2 LYS 78 HB2 LYS 78 -4.066 5.802 -15.156 648 HB3 LYS 78 HB1 LYS 78 -4.946 7.215 -14.588 649 HG2 LYS 78 HG2 LYS 78 -2.679 5.813 -13.190 650 HG3 LYS 78 HG1 LYS 78 -2.643 7.407 -13.945 651 HD2 LYS 78 HD2 LYS 78 -4.733 7.658 -12.208 652 HD3 LYS 78 HD1 LYS 78 -3.652 6.581 -11.320 653 HE2 LYS 78 HE2 LYS 78 -2.262 8.257 -10.850 654 HE3 LYS 78 HE1 LYS 78 -2.179 8.741 -12.542 655 HZ1 LYS 78 HZ1 LYS 78 -3.105 10.585 -11.593 656 HZ2 LYS 78 HZ2 LYS 78 -3.950 9.715 -10.415 657 HZ3 LYS 78 HZ3 LYS 78 -4.510 9.741 -12.011 658 H GLY 79 HN GLY 79 -4.835 2.943 -13.745 659 HA2 GLY 79 HA2 GLY 79 -6.010 2.469 -16.334 660 HA3 GLY 79 HA1 GLY 79 -5.184 1.290 -15.331 661 H GLN 80 HN GLN 80 -6.358 -0.138 -14.178 662 HA GLN 80 HA GLN 80 -9.182 -0.265 -14.694 663 HB2 GLN 80 HB2 GLN 80 -9.108 -2.413 -13.611 664 HB3 GLN 80 HB1 GLN 80 -7.724 -2.267 -14.679 665 HG2 GLN 80 HG2 GLN 80 -6.382 -1.595 -12.655 666 HG3 GLN 80 HG1 GLN 80 -7.768 -2.092 -11.686 667 HE21 GLN 80 HE21 GLN 80 -5.594 -3.375 -11.085 668 HE22 GLN 80 HE22 GLN 80 -5.551 -4.969 -11.749 669 H ARG 81 HN ARG 81 -7.204 -0.003 -11.754 670 HA ARG 81 HA ARG 81 -7.627 1.029 -9.760 671 HB2 ARG 81 HB2 ARG 81 -10.344 1.793 -10.822 672 HB3 ARG 81 HB1 ARG 81 -9.472 2.525 -9.484 673 HG2 ARG 81 HG2 ARG 81 -7.838 3.447 -10.987 674 HG3 ARG 81 HG1 ARG 81 -8.568 2.603 -12.354 675 HD2 ARG 81 HD2 ARG 81 -9.950 4.691 -10.673 676 HD3 ARG 81 HD1 ARG 81 -9.194 4.994 -12.237 677 HE ARG 81 HE ARG 81 -11.003 2.920 -12.594 678 HH11 ARG 81 HH11 ARG 81 -11.079 6.290 -11.693 679 HH12 ARG 81 HH12 ARG 81 -12.662 6.557 -12.342 680 HH21 ARG 81 HH21 ARG 81 -13.086 3.269 -13.448 681 HH22 ARG 81 HH22 ARG 81 -13.803 4.842 -13.337 682 H THR 82 HN THR 82 -9.542 -1.403 -11.144 683 HA THR 82 HA THR 82 -10.099 -2.509 -8.533 684 HB THR 82 HB THR 82 -12.548 -2.956 -9.447 685 HG1 THR 82 HG1 THR 82 -12.011 -1.688 -11.388 686 HG21 THR 82 HG21 THR 82 -13.395 -1.319 -8.050 687 HG22 THR 82 HG22 THR 82 -12.058 -0.213 -8.368 688 HG23 THR 82 HG23 THR 82 -11.800 -1.647 -7.373 689 H ASP 83 HN ASP 83 -9.478 -4.550 -8.665 690 HA ASP 83 HA ASP 83 -9.124 -5.849 -11.195 691 HB2 ASP 83 HB2 ASP 83 -8.410 -7.797 -9.749 692 HB3 ASP 83 HB1 ASP 83 -7.497 -6.312 -9.513 693 H LYS 84 HN LYS 84 -9.784 -8.412 -10.920 694 HA LYS 84 HA LYS 84 -12.340 -8.694 -11.759 695 HB2 LYS 84 HB2 LYS 84 -12.058 -11.023 -10.330 696 HB3 LYS 84 HB1 LYS 84 -11.489 -10.756 -11.973 697 HG2 LYS 84 HG2 LYS 84 -9.692 -9.974 -9.743 698 HG3 LYS 84 HG1 LYS 84 -9.923 -11.695 -10.056 699 HD2 LYS 84 HD2 LYS 84 -9.505 -10.296 -12.531 700 HD3 LYS 84 HD1 LYS 84 -8.208 -9.914 -11.397 701 HE2 LYS 84 HE2 LYS 84 -7.863 -12.328 -11.025 702 HE3 LYS 84 HE1 LYS 84 -9.108 -12.671 -12.224 703 HZ1 LYS 84 HZ1 LYS 84 -6.863 -10.954 -12.998 704 HZ2 LYS 84 HZ2 LYS 84 -7.768 -12.031 -13.937 705 HZ3 LYS 84 HZ3 LYS 84 -6.591 -12.620 -12.874 706 H TYR 85 HN TYR 85 -11.390 -9.377 -8.387 707 HA TYR 85 HA TYR 85 -14.061 -9.607 -7.491 708 HB2 TYR 85 HB2 TYR 85 -11.377 -9.656 -6.284 709 HB3 TYR 85 HB1 TYR 85 -12.647 -9.079 -5.212 710 HD1 TYR 85 HD1 TYR 85 -12.948 -11.650 -7.871 711 HD2 TYR 85 HD2 TYR 85 -12.846 -10.859 -3.693 712 HE1 TYR 85 HE1 TYR 85 -13.612 -13.975 -7.420 713 HE2 TYR 85 HE2 TYR 85 -13.510 -13.180 -3.231 714 HH TYR 85 HH TYR 85 -13.365 -15.617 -5.483 715 H GLY 86 HN GLY 86 -12.348 -6.906 -8.408 716 HA2 GLY 86 HA2 GLY 86 -13.064 -4.697 -8.373 717 HA3 GLY 86 HA1 GLY 86 -14.325 -5.152 -7.235 718 H ARG 87 HN ARG 87 -11.071 -6.108 -6.579 719 HA ARG 87 HA ARG 87 -10.969 -5.006 -4.042 720 HB2 ARG 87 HB2 ARG 87 -9.345 -6.633 -5.482 721 HB3 ARG 87 HB1 ARG 87 -8.377 -5.166 -5.446 722 HG2 ARG 87 HG2 ARG 87 -8.019 -5.288 -3.204 723 HG3 ARG 87 HG1 ARG 87 -9.552 -6.104 -2.890 724 HD2 ARG 87 HD2 ARG 87 -7.126 -7.349 -4.181 725 HD3 ARG 87 HD1 ARG 87 -7.628 -7.580 -2.507 726 HE ARG 87 HE ARG 87 -9.687 -8.263 -4.365 727 HH11 ARG 87 HH11 ARG 87 -6.776 -9.432 -2.837 728 HH12 ARG 87 HH12 ARG 87 -7.206 -11.101 -3.010 729 HH21 ARG 87 HH21 ARG 87 -10.254 -10.457 -4.595 730 HH22 ARG 87 HH22 ARG 87 -9.181 -11.683 -4.008 731 H GLY 88 HN GLY 88 -9.457 -3.317 -3.232 732 HA2 GLY 88 HA2 GLY 88 -9.874 -0.875 -4.765 733 HA3 GLY 88 HA1 GLY 88 -9.336 -0.981 -3.095 734 H LEU 89 HN LEU 89 -8.377 -0.941 -6.430 735 HA LEU 89 HA LEU 89 -5.597 -1.440 -5.940 736 HB2 LEU 89 HB2 LEU 89 -7.133 -0.415 -8.312 737 HB3 LEU 89 HB1 LEU 89 -5.385 -0.542 -8.317 738 HG LEU 89 HG LEU 89 -6.678 -2.446 -9.379 739 HD11 LEU 89 HD11 LEU 89 -4.805 -3.198 -7.147 740 HD12 LEU 89 HD12 LEU 89 -4.296 -2.543 -8.704 741 HD13 LEU 89 HD13 LEU 89 -5.117 -4.102 -8.630 742 HD21 LEU 89 HD21 LEU 89 -7.140 -3.271 -6.523 743 HD22 LEU 89 HD22 LEU 89 -7.660 -4.108 -7.985 744 HD23 LEU 89 HD23 LEU 89 -8.384 -2.559 -7.552 745 H ALA 90 HN ALA 90 -5.641 0.237 -4.139 746 HA ALA 90 HA ALA 90 -4.562 2.726 -5.214 747 HB1 ALA 90 HB1 ALA 90 -6.835 2.607 -3.240 748 HB2 ALA 90 HB2 ALA 90 -6.848 3.330 -4.847 749 HB3 ALA 90 HB3 ALA 90 -5.881 4.054 -3.563 750 H TYR 91 HN TYR 91 -3.572 4.063 -3.429 751 HA TYR 91 HA TYR 91 -2.124 2.268 -1.632 752 HB2 TYR 91 HB2 TYR 91 -1.493 5.185 -1.962 753 HB3 TYR 91 HB1 TYR 91 -0.414 3.865 -1.535 754 HD1 TYR 91 HD2 TYR 91 -2.371 5.291 -4.356 755 HD2 TYR 91 HD1 TYR 91 0.870 2.801 -3.177 756 HE1 TYR 91 HE2 TYR 91 -1.641 5.143 -6.699 757 HE2 TYR 91 HE1 TYR 91 1.611 2.649 -5.517 758 HH TYR 91 HH TYR 91 -0.326 3.731 -8.133 759 H ILE 92 HN ILE 92 -2.245 2.404 0.564 760 HA ILE 92 HA ILE 92 -4.390 4.080 1.640 761 HB ILE 92 HB ILE 92 -2.817 1.874 2.982 762 HG12 ILE 92 HG12 ILE 92 -5.411 1.001 2.697 763 HG13 ILE 92 HG11 ILE 92 -5.147 1.878 1.192 764 HG21 ILE 92 HG21 ILE 92 -3.806 3.587 4.501 765 HG22 ILE 92 HG22 ILE 92 -4.445 1.961 4.733 766 HG23 ILE 92 HG23 ILE 92 -5.393 3.163 3.861 767 HD11 ILE 92 HD11 ILE 92 -3.358 0.479 0.582 768 HD12 ILE 92 HD12 ILE 92 -4.634 -0.586 1.169 769 HD13 ILE 92 HD13 ILE 92 -3.251 -0.218 2.199 770 H TYR 93 HN TYR 93 -3.970 5.941 2.603 771 HA TYR 93 HA TYR 93 -1.232 6.525 3.455 772 HB2 TYR 93 HB2 TYR 93 -3.582 8.395 3.109 773 HB3 TYR 93 HB1 TYR 93 -1.940 8.875 3.496 774 HD1 TYR 93 HD2 TYR 93 -2.919 6.342 0.953 775 HD2 TYR 93 HD1 TYR 93 -1.477 10.276 1.672 776 HE1 TYR 93 HE2 TYR 93 -2.469 6.603 -1.440 777 HE2 TYR 93 HE1 TYR 93 -1.008 10.545 -0.726 778 HH TYR 93 HH TYR 93 -2.252 8.992 -3.029 779 H ALA 94 HN ALA 94 -0.901 7.737 5.447 780 HA ALA 94 HA ALA 94 -2.981 7.456 7.473 781 HB1 ALA 94 HB1 ALA 94 -0.715 6.653 8.847 782 HB2 ALA 94 HB2 ALA 94 -0.614 5.785 7.316 783 HB3 ALA 94 HB3 ALA 94 -2.048 5.621 8.330 784 H ASP 95 HN ASP 95 -3.183 9.427 8.308 785 HA ASP 95 HA ASP 95 -2.688 11.427 9.271 786 HB2 ASP 95 HB2 ASP 95 -0.360 9.777 9.864 787 HB3 ASP 95 HB1 ASP 95 0.046 11.487 9.756 788 H GLY 96 HN GLY 96 -1.973 10.648 6.297 789 HA2 GLY 96 HA2 GLY 96 -1.843 12.428 4.659 790 HA3 GLY 96 HA1 GLY 96 -0.725 13.258 5.728 791 H LYS 97 HN LYS 97 -0.126 9.927 5.566 792 HA LYS 97 HA LYS 97 1.833 10.301 3.415 793 HB2 LYS 97 HB2 LYS 97 2.307 9.508 6.234 794 HB3 LYS 97 HB1 LYS 97 3.215 8.640 5.004 795 HG2 LYS 97 HG2 LYS 97 4.118 10.728 4.162 796 HG3 LYS 97 HG1 LYS 97 3.163 11.630 5.341 797 HD2 LYS 97 HD2 LYS 97 4.918 9.495 6.402 798 HD3 LYS 97 HD1 LYS 97 5.717 10.929 5.753 799 HE2 LYS 97 HE2 LYS 97 5.287 11.998 7.650 800 HE3 LYS 97 HE1 LYS 97 3.560 11.832 7.333 801 HZ1 LYS 97 HZ1 LYS 97 3.637 10.725 9.278 802 HZ2 LYS 97 HZ2 LYS 97 5.271 10.318 9.131 803 HZ3 LYS 97 HZ3 LYS 97 4.101 9.423 8.300 804 H MET 98 HN MET 98 1.949 8.652 1.988 805 HA MET 98 HA MET 98 -0.003 6.603 2.067 806 HB2 MET 98 HB2 MET 98 2.379 6.304 0.302 807 HB3 MET 98 HB1 MET 98 0.678 6.012 -0.042 808 HG2 MET 98 HG2 MET 98 0.726 7.916 -1.173 809 HG3 MET 98 HG1 MET 98 0.756 8.721 0.395 810 HE1 MET 98 HE1 MET 98 3.411 11.058 -0.572 811 HE2 MET 98 HE2 MET 98 1.817 10.720 0.101 812 HE3 MET 98 HE3 MET 98 2.053 10.723 -1.647 813 H VAL 99 HN VAL 99 0.037 4.982 3.437 814 HA VAL 99 HA VAL 99 2.213 4.051 4.892 815 HB VAL 99 HB VAL 99 -0.107 2.288 4.133 816 HG11 VAL 99 HG11 VAL 99 0.390 1.063 5.985 817 HG12 VAL 99 HG12 VAL 99 1.043 2.446 6.863 818 HG13 VAL 99 HG13 VAL 99 2.006 1.663 5.610 819 HG21 VAL 99 HG21 VAL 99 -0.245 4.858 5.384 820 HG22 VAL 99 HG22 VAL 99 -0.682 3.615 6.557 821 HG23 VAL 99 HG23 VAL 99 -1.548 3.725 5.025 822 H ASN 100 HN ASN 100 1.045 3.101 1.730 823 HA ASN 100 HA ASN 100 2.367 0.679 1.382 824 HB2 ASN 100 HB2 ASN 100 2.083 2.731 -0.811 825 HB3 ASN 100 HB1 ASN 100 2.053 0.975 -0.950 826 HD21 ASN 100 HD21 ASN 100 0.123 0.101 -1.160 827 HD22 ASN 100 HD22 ASN 100 -1.373 0.796 -0.651 828 H GLU 101 HN GLU 101 3.504 3.920 0.404 829 HA GLU 101 HA GLU 101 6.025 3.216 -0.489 830 HB2 GLU 101 HB2 GLU 101 4.792 5.504 -0.513 831 HB3 GLU 101 HB1 GLU 101 5.585 5.765 1.035 832 HG2 GLU 101 HG2 GLU 101 7.735 5.099 -0.295 833 HG3 GLU 101 HG1 GLU 101 6.763 5.562 -1.691 834 H ALA 102 HN ALA 102 4.939 3.872 2.806 835 HA ALA 102 HA ALA 102 7.417 3.954 4.082 836 HB1 ALA 102 HB1 ALA 102 4.664 3.213 4.984 837 HB2 ALA 102 HB2 ALA 102 5.645 4.612 5.417 838 HB3 ALA 102 HB3 ALA 102 6.037 3.023 6.073 839 H LEU 103 HN LEU 103 5.233 1.158 3.709 840 HA LEU 103 HA LEU 103 6.931 -0.760 4.822 841 HB2 LEU 103 HB2 LEU 103 4.883 -1.138 2.634 842 HB3 LEU 103 HB1 LEU 103 5.564 -2.411 3.631 843 HG LEU 103 HG LEU 103 4.435 -0.419 5.345 844 HD11 LEU 103 HD11 LEU 103 3.126 -0.098 3.096 845 HD12 LEU 103 HD12 LEU 103 2.277 -0.132 4.641 846 HD13 LEU 103 HD13 LEU 103 2.302 -1.568 3.618 847 HD21 LEU 103 HD21 LEU 103 3.354 -3.163 4.775 848 HD22 LEU 103 HD22 LEU 103 3.301 -2.254 6.285 849 HD23 LEU 103 HD23 LEU 103 4.833 -2.904 5.700 850 H VAL 104 HN VAL 104 6.593 0.401 1.513 851 HA VAL 104 HA VAL 104 8.292 -1.419 0.239 852 HB VAL 104 HB VAL 104 7.974 1.481 -0.532 853 HG11 VAL 104 HG11 VAL 104 8.890 0.950 -2.504 854 HG12 VAL 104 HG12 VAL 104 8.034 -0.591 -2.595 855 HG13 VAL 104 HG13 VAL 104 9.523 -0.462 -1.656 856 HG21 VAL 104 HG21 VAL 104 6.182 -0.218 -1.957 857 HG22 VAL 104 HG22 VAL 104 5.814 1.167 -0.930 858 HG23 VAL 104 HG23 VAL 104 5.927 -0.446 -0.226 859 H ARG 105 HN ARG 105 8.982 1.712 1.751 860 HA ARG 105 HA ARG 105 11.785 1.583 1.138 861 HB2 ARG 105 HB2 ARG 105 10.766 3.747 1.265 862 HB3 ARG 105 HB1 ARG 105 10.157 3.431 2.883 863 HG2 ARG 105 HG2 ARG 105 13.097 3.368 2.391 864 HG3 ARG 105 HG1 ARG 105 12.270 4.921 2.510 865 HD2 ARG 105 HD2 ARG 105 12.601 2.789 4.587 866 HD3 ARG 105 HD1 ARG 105 12.958 4.510 4.694 867 HE ARG 105 HE ARG 105 10.429 3.225 5.174 868 HH11 ARG 105 HH11 ARG 105 12.016 6.222 4.342 869 HH12 ARG 105 HH12 ARG 105 10.713 7.213 4.906 870 HH21 ARG 105 HH21 ARG 105 8.712 4.530 5.911 871 HH22 ARG 105 HH22 ARG 105 8.837 6.254 5.794 872 H GLN 106 HN GLN 106 9.764 0.864 3.949 873 HA GLN 106 HA GLN 106 11.960 0.526 5.742 874 HB2 GLN 106 HB2 GLN 106 9.108 0.474 5.902 875 HB3 GLN 106 HB1 GLN 106 9.739 -0.978 6.657 876 HG2 GLN 106 HG2 GLN 106 10.038 0.243 8.477 877 HG3 GLN 106 HG1 GLN 106 11.377 1.012 7.624 878 HE21 GLN 106 HE21 GLN 106 11.288 3.121 7.325 879 HE22 GLN 106 HE22 GLN 106 9.889 4.113 7.522 880 H GLY 107 HN GLY 107 10.957 -1.352 3.165 881 HA2 GLY 107 HA2 GLY 107 11.986 -3.344 2.481 882 HA3 GLY 107 HA1 GLY 107 12.566 -3.586 4.123 883 H LEU 108 HN LEU 108 9.530 -2.899 4.765 884 HA LEU 108 HA LEU 108 8.736 -5.515 5.339 885 HB2 LEU 108 HB2 LEU 108 6.877 -3.183 4.890 886 HB3 LEU 108 HB1 LEU 108 6.577 -4.604 5.871 887 HG LEU 108 HG LEU 108 8.764 -2.636 6.513 888 HD11 LEU 108 HD11 LEU 108 6.296 -1.758 6.428 889 HD12 LEU 108 HD12 LEU 108 7.357 -1.348 7.777 890 HD13 LEU 108 HD13 LEU 108 6.160 -2.632 7.954 891 HD21 LEU 108 HD21 LEU 108 7.855 -3.779 8.831 892 HD22 LEU 108 HD22 LEU 108 9.284 -4.281 7.929 893 HD23 LEU 108 HD23 LEU 108 7.746 -5.109 7.677 894 H ALA 109 HN ALA 109 8.397 -3.590 2.470 895 HA ALA 109 HA ALA 109 7.399 -5.906 1.030 896 HB1 ALA 109 HB1 ALA 109 5.827 -3.404 1.432 897 HB2 ALA 109 HB2 ALA 109 5.286 -5.083 1.408 898 HB3 ALA 109 HB3 ALA 109 5.699 -4.267 -0.100 899 H LYS 110 HN LYS 110 7.179 -5.275 -1.398 900 HA LYS 110 HA LYS 110 9.161 -3.262 -2.158 901 HB2 LYS 110 HB2 LYS 110 10.090 -4.954 -3.830 902 HB3 LYS 110 HB1 LYS 110 10.542 -5.168 -2.144 903 HG2 LYS 110 HG2 LYS 110 9.887 -7.276 -2.352 904 HG3 LYS 110 HG1 LYS 110 8.232 -6.669 -2.408 905 HD2 LYS 110 HD2 LYS 110 8.090 -7.597 -4.433 906 HD3 LYS 110 HD1 LYS 110 9.155 -6.308 -4.993 907 HE2 LYS 110 HE2 LYS 110 10.817 -7.742 -5.364 908 HE3 LYS 110 HE1 LYS 110 10.664 -8.432 -3.748 909 HZ1 LYS 110 HZ1 LYS 110 9.489 -9.327 -6.271 910 HZ2 LYS 110 HZ2 LYS 110 8.582 -9.561 -4.863 911 HZ3 LYS 110 HZ3 LYS 110 10.129 -10.234 -4.994 912 H VAL 111 HN VAL 111 9.096 -2.724 -4.458 913 HA VAL 111 HA VAL 111 6.397 -2.527 -5.381 914 HB VAL 111 HB VAL 111 9.013 -1.652 -6.609 915 HG11 VAL 111 HG11 VAL 111 6.197 -1.305 -7.594 916 HG12 VAL 111 HG12 VAL 111 7.587 -1.960 -8.458 917 HG13 VAL 111 HG13 VAL 111 7.515 -0.238 -8.082 918 HG21 VAL 111 HG21 VAL 111 6.796 -0.048 -5.345 919 HG22 VAL 111 HG22 VAL 111 8.335 0.567 -5.949 920 HG23 VAL 111 HG23 VAL 111 8.301 -0.499 -4.543 921 H ALA 112 HN ALA 112 5.374 -4.065 -6.468 922 HA ALA 112 HA ALA 112 6.787 -5.511 -8.576 923 HB1 ALA 112 HB1 ALA 112 5.041 -7.227 -6.942 924 HB2 ALA 112 HB2 ALA 112 6.547 -6.719 -6.177 925 HB3 ALA 112 HB3 ALA 112 6.586 -7.581 -7.715 926 H TYR 113 HN TYR 113 5.569 -5.886 -10.334 927 HA TYR 113 HA TYR 113 3.820 -5.844 -11.777 928 HB2 TYR 113 HB2 TYR 113 2.592 -6.751 -9.240 929 HB3 TYR 113 HB1 TYR 113 1.485 -6.163 -10.475 930 HD1 TYR 113 HD2 TYR 113 4.667 -8.009 -10.978 931 HD2 TYR 113 HD1 TYR 113 0.420 -8.129 -11.183 932 HE1 TYR 113 HE2 TYR 113 4.791 -10.182 -12.121 933 HE2 TYR 113 HE1 TYR 113 0.531 -10.303 -12.327 934 HH TYR 113 HH TYR 113 2.525 -11.475 -13.863 935 H VAL 114 HN VAL 114 3.912 -3.779 -12.488 936 HA VAL 114 HA VAL 114 1.787 -2.014 -11.670 937 HB VAL 114 HB VAL 114 3.507 -1.341 -10.075 938 HG11 VAL 114 HG11 VAL 114 5.310 -0.396 -12.244 939 HG12 VAL 114 HG12 VAL 114 5.356 -2.099 -11.790 940 HG13 VAL 114 HG13 VAL 114 5.684 -0.855 -10.584 941 HG21 VAL 114 HG21 VAL 114 3.000 0.600 -12.322 942 HG22 VAL 114 HG22 VAL 114 3.745 1.061 -10.790 943 HG23 VAL 114 HG23 VAL 114 2.099 0.426 -10.815 944 H TYR 115 HN TYR 115 0.932 -1.777 -13.654 945 HA TYR 115 HA TYR 115 2.749 -0.959 -15.824 946 HB2 TYR 115 HB2 TYR 115 0.317 -2.730 -15.897 947 HB3 TYR 115 HB1 TYR 115 0.949 -1.958 -17.348 948 HD1 TYR 115 HD2 TYR 115 3.279 -2.502 -18.105 949 HD2 TYR 115 HD1 TYR 115 1.338 -4.665 -14.996 950 HE1 TYR 115 HE2 TYR 115 4.896 -4.337 -18.377 951 HE2 TYR 115 HE1 TYR 115 2.950 -6.502 -15.257 952 HH TYR 115 HH TYR 115 4.471 -7.398 -16.903 953 H LYS 116 HN LYS 116 1.766 0.352 -17.507 954 HA LYS 116 HA LYS 116 0.323 2.557 -16.389 955 HB2 LYS 116 HB2 LYS 116 0.460 3.422 -18.767 956 HB3 LYS 116 HB1 LYS 116 2.000 3.085 -17.984 957 HG2 LYS 116 HG2 LYS 116 0.927 0.801 -19.436 958 HG3 LYS 116 HG1 LYS 116 1.230 2.205 -20.464 959 HD2 LYS 116 HD2 LYS 116 3.525 2.327 -19.463 960 HD3 LYS 116 HD1 LYS 116 3.194 0.795 -18.659 961 HE2 LYS 116 HE2 LYS 116 4.021 -0.171 -20.494 962 HE3 LYS 116 HE1 LYS 116 2.503 0.279 -21.269 963 HZ1 LYS 116 HZ1 LYS 116 4.883 0.989 -22.197 964 HZ2 LYS 116 HZ2 LYS 116 4.566 2.325 -21.211 965 HZ3 LYS 116 HZ3 LYS 116 3.486 1.911 -22.445 966 HA PRO 117 HA PRO 117 -0.790 4.296 -17.530 967 HB2 PRO 117 HB2 PRO 117 -3.089 5.510 -16.870 968 HB3 PRO 117 HB1 PRO 117 -2.696 5.113 -18.547 969 HG2 PRO 117 HG2 PRO 117 -4.474 3.662 -16.625 970 HG3 PRO 117 HG1 PRO 117 -4.743 4.027 -18.340 971 HD2 PRO 117 HD2 PRO 117 -3.869 1.601 -17.425 972 HD3 PRO 117 HD1 PRO 117 -3.501 2.233 -19.041 973 H ASN 118 HN ASN 118 -1.621 1.951 -15.455 974 HA ASN 118 HA ASN 118 -2.147 3.416 -13.065 975 HB2 ASN 118 HB2 ASN 118 -0.963 0.666 -13.006 976 HB3 ASN 118 HB1 ASN 118 -2.188 1.377 -11.965 977 HD21 ASN 118 HD21 ASN 118 -1.575 -0.003 -15.134 978 HD22 ASN 118 HD22 ASN 118 -3.217 -0.432 -15.467 979 H ASN 119 HN ASN 119 -0.686 4.771 -12.276 980 HA ASN 119 HA ASN 119 1.761 3.909 -11.228 981 HB2 ASN 119 HB2 ASN 119 3.223 5.379 -12.785 982 HB3 ASN 119 HB1 ASN 119 2.759 3.773 -13.335 983 HD21 ASN 119 HD21 ASN 119 2.230 3.741 -15.386 984 HD22 ASN 119 HD22 ASN 119 1.414 4.994 -16.253 985 H THR 120 HN THR 120 -0.498 5.479 -10.461 986 HA THR 120 HA THR 120 -0.245 8.206 -10.468 987 HB THR 120 HB THR 120 -0.948 6.758 -7.929 988 HG1 THR 120 HG1 THR 120 -2.120 5.575 -9.284 989 HG21 THR 120 HG21 THR 120 -2.935 8.560 -8.557 990 HG22 THR 120 HG22 THR 120 -1.450 9.387 -9.028 991 HG23 THR 120 HG23 THR 120 -1.642 8.789 -7.380 992 H HIS 121 HN HIS 121 1.298 5.951 -8.190 993 HA HIS 121 HA HIS 121 3.233 8.075 -7.542 994 HB2 HIS 121 HB2 HIS 121 1.870 6.088 -5.748 995 HB3 HIS 121 HB1 HIS 121 3.437 6.756 -5.309 996 HD1 HIS 121 HD1 HIS 121 -0.169 7.606 -5.529 997 HD2 HIS 121 HD2 HIS 121 3.419 9.521 -4.683 998 HE1 HIS 121 HE1 HIS 121 -0.810 9.806 -4.497 999 HE2 HIS 121 HE2 HIS 121 1.376 10.986 -4.077 1000 H GLU 122 HN GLU 122 3.275 5.885 -9.566 1001 HA GLU 122 HA GLU 122 4.908 3.762 -8.829 1002 HB2 GLU 122 HB2 GLU 122 3.741 3.963 -11.005 1003 HB3 GLU 122 HB1 GLU 122 4.888 5.206 -11.485 1004 HG2 GLU 122 HG2 GLU 122 6.537 3.155 -10.755 1005 HG3 GLU 122 HG1 GLU 122 5.164 2.303 -11.457 1006 H GLN 123 HN GLN 123 5.856 6.932 -10.138 1007 HA GLN 123 HA GLN 123 8.625 6.494 -10.096 1008 HB2 GLN 123 HB2 GLN 123 7.109 9.095 -9.813 1009 HB3 GLN 123 HB1 GLN 123 8.821 8.953 -10.186 1010 HG2 GLN 123 HG2 GLN 123 6.871 7.560 -11.941 1011 HG3 GLN 123 HG1 GLN 123 7.024 9.312 -12.069 1012 HE21 GLN 123 HE21 GLN 123 8.625 6.251 -12.484 1013 HE22 GLN 123 HE22 GLN 123 9.946 6.841 -13.429 1014 H LEU 124 HN LEU 124 6.383 7.347 -7.578 1015 HA LEU 124 HA LEU 124 8.270 8.361 -5.718 1016 HB2 LEU 124 HB2 LEU 124 5.840 8.773 -5.577 1017 HB3 LEU 124 HB1 LEU 124 5.587 7.079 -5.205 1018 HG LEU 124 HG LEU 124 7.042 7.434 -3.158 1019 HD11 LEU 124 HD11 LEU 124 8.164 9.457 -3.749 1020 HD12 LEU 124 HD12 LEU 124 7.132 9.795 -2.360 1021 HD13 LEU 124 HD13 LEU 124 6.634 10.304 -3.972 1022 HD21 LEU 124 HD21 LEU 124 4.694 9.216 -2.885 1023 HD22 LEU 124 HD22 LEU 124 5.190 7.833 -1.910 1024 HD23 LEU 124 HD23 LEU 124 4.395 7.577 -3.463 1025 H LEU 125 HN LEU 125 6.632 5.197 -5.900 1026 HA LEU 125 HA LEU 125 8.297 4.042 -3.879 1027 HB2 LEU 125 HB2 LEU 125 6.394 2.804 -5.864 1028 HB3 LEU 125 HB1 LEU 125 7.218 1.905 -4.609 1029 HG LEU 125 HG LEU 125 6.092 3.475 -2.943 1030 HD11 LEU 125 HD11 LEU 125 5.395 5.252 -4.352 1031 HD12 LEU 125 HD12 LEU 125 3.935 4.426 -3.809 1032 HD13 LEU 125 HD13 LEU 125 4.552 4.148 -5.437 1033 HD21 LEU 125 HD21 LEU 125 4.911 1.279 -4.512 1034 HD22 LEU 125 HD22 LEU 125 3.775 2.244 -3.568 1035 HD23 LEU 125 HD23 LEU 125 5.128 1.444 -2.770 1036 H ARG 126 HN ARG 126 8.505 4.386 -7.320 1037 HA ARG 126 HA ARG 126 10.132 2.264 -8.032 1038 HB2 ARG 126 HB2 ARG 126 9.454 4.858 -9.122 1039 HB3 ARG 126 HB1 ARG 126 11.143 4.481 -9.430 1040 HG2 ARG 126 HG2 ARG 126 9.834 2.132 -10.053 1041 HG3 ARG 126 HG1 ARG 126 8.742 3.390 -10.635 1042 HD2 ARG 126 HD2 ARG 126 11.244 4.265 -11.429 1043 HD3 ARG 126 HD1 ARG 126 11.312 2.522 -11.678 1044 HE ARG 126 HE ARG 126 8.920 3.703 -12.719 1045 HH11 ARG 126 HH11 ARG 126 12.284 3.058 -13.390 1046 HH12 ARG 126 HH12 ARG 126 12.078 3.100 -15.109 1047 HH21 ARG 126 HH21 ARG 126 8.647 3.756 -14.980 1048 HH22 ARG 126 HH22 ARG 126 10.012 3.495 -16.012 1049 H LYS 127 HN LYS 127 10.918 5.219 -6.329 1050 HA LYS 127 HA LYS 127 13.763 4.771 -6.415 1051 HB2 LYS 127 HB2 LYS 127 12.365 6.643 -4.521 1052 HB3 LYS 127 HB1 LYS 127 13.980 6.778 -5.202 1053 HG2 LYS 127 HG2 LYS 127 11.371 7.160 -6.652 1054 HG3 LYS 127 HG1 LYS 127 12.542 8.406 -6.220 1055 HD2 LYS 127 HD2 LYS 127 13.845 6.326 -7.706 1056 HD3 LYS 127 HD1 LYS 127 12.424 6.887 -8.590 1057 HE2 LYS 127 HE2 LYS 127 14.217 8.252 -9.301 1058 HE3 LYS 127 HE1 LYS 127 13.262 9.237 -8.193 1059 HZ1 LYS 127 HZ1 LYS 127 14.846 8.929 -6.485 1060 HZ2 LYS 127 HZ2 LYS 127 15.725 9.340 -7.871 1061 HZ3 LYS 127 HZ3 LYS 127 15.673 7.732 -7.350 1062 H SER 128 HN SER 128 11.358 4.852 -3.775 1063 HA SER 128 HA SER 128 12.965 3.918 -1.732 1064 HB2 SER 128 HB2 SER 128 10.884 4.655 -1.015 1065 HB3 SER 128 HB1 SER 128 10.022 3.768 -2.271 1066 HG SER 128 HG SER 128 10.195 1.932 -1.118 1067 H GLU 129 HN GLU 129 11.507 2.166 -4.362 1068 HA GLU 129 HA GLU 129 11.823 -0.436 -3.237 1069 HB2 GLU 129 HB2 GLU 129 10.197 -0.116 -4.982 1070 HB3 GLU 129 HB1 GLU 129 11.420 0.512 -6.076 1071 HG2 GLU 129 HG2 GLU 129 12.328 -2.023 -5.354 1072 HG3 GLU 129 HG1 GLU 129 10.594 -2.204 -5.601 1073 H ALA 130 HN ALA 130 13.538 1.088 -5.973 1074 HA ALA 130 HA ALA 130 15.612 -0.836 -5.977 1075 HB1 ALA 130 HB1 ALA 130 16.617 1.293 -7.382 1076 HB2 ALA 130 HB2 ALA 130 14.872 1.507 -7.530 1077 HB3 ALA 130 HB3 ALA 130 15.622 -0.006 -8.040 1078 H GLN 131 HN GLN 131 15.479 2.498 -4.736 1079 HA GLN 131 HA GLN 131 18.187 2.759 -4.117 1080 HB2 GLN 131 HB2 GLN 131 15.812 4.249 -3.683 1081 HB3 GLN 131 HB1 GLN 131 16.646 4.134 -2.143 1082 HG2 GLN 131 HG2 GLN 131 18.582 4.730 -4.090 1083 HG3 GLN 131 HG1 GLN 131 17.205 5.786 -4.391 1084 HE21 GLN 131 HE21 GLN 131 16.577 7.262 -2.806 1085 HE22 GLN 131 HE22 GLN 131 17.627 7.714 -1.511 1086 H ALA 132 HN ALA 132 15.514 1.818 -1.970 1087 HA ALA 132 HA ALA 132 17.167 1.226 0.244 1088 HB1 ALA 132 HB1 ALA 132 14.388 0.263 -0.403 1089 HB2 ALA 132 HB2 ALA 132 14.816 1.693 0.535 1090 HB3 ALA 132 HB3 ALA 132 15.185 0.086 1.160 1091 H LYS 133 HN LYS 133 16.352 -0.568 -2.596 1092 HA LYS 133 HA LYS 133 16.810 -3.177 -1.612 1093 HB2 LYS 133 HB2 LYS 133 16.158 -1.944 -4.104 1094 HB3 LYS 133 HB1 LYS 133 17.502 -3.047 -4.367 1095 HG2 LYS 133 HG2 LYS 133 16.262 -4.891 -3.907 1096 HG3 LYS 133 HG1 LYS 133 15.218 -4.040 -2.766 1097 HD2 LYS 133 HD2 LYS 133 14.476 -2.762 -4.958 1098 HD3 LYS 133 HD1 LYS 133 15.034 -4.249 -5.727 1099 HE2 LYS 133 HE2 LYS 133 12.846 -4.784 -5.338 1100 HE3 LYS 133 HE1 LYS 133 13.584 -5.381 -3.855 1101 HZ1 LYS 133 HZ1 LYS 133 12.937 -2.699 -3.455 1102 HZ2 LYS 133 HZ2 LYS 133 12.241 -4.057 -2.725 1103 HZ3 LYS 133 HZ3 LYS 133 11.582 -3.435 -4.152 1104 H LYS 134 HN LYS 134 18.905 -1.004 -3.502 1105 HA LYS 134 HA LYS 134 21.150 -2.667 -3.551 1106 HB2 LYS 134 HB2 LYS 134 22.297 -0.874 -4.479 1107 HB3 LYS 134 HB1 LYS 134 20.625 -0.519 -4.881 1108 HG2 LYS 134 HG2 LYS 134 20.487 1.094 -3.096 1109 HG3 LYS 134 HG1 LYS 134 22.115 0.681 -2.556 1110 HD2 LYS 134 HD2 LYS 134 21.732 1.546 -5.378 1111 HD3 LYS 134 HD1 LYS 134 21.665 2.769 -4.108 1112 HE2 LYS 134 HE2 LYS 134 23.866 2.333 -3.421 1113 HE3 LYS 134 HE1 LYS 134 23.920 0.798 -4.283 1114 HZ1 LYS 134 HZ1 LYS 134 23.496 3.228 -5.853 1115 HZ2 LYS 134 HZ2 LYS 134 24.331 1.813 -6.258 1116 HZ3 LYS 134 HZ3 LYS 134 25.048 2.954 -5.236 1117 H GLU 135 HN GLU 135 20.151 -0.260 -1.179 1118 HA GLU 135 HA GLU 135 22.581 -0.760 0.371 1119 HB2 GLU 135 HB2 GLU 135 21.106 1.035 1.856 1120 HB3 GLU 135 HB1 GLU 135 22.390 1.442 0.726 1121 HG2 GLU 135 HG2 GLU 135 20.749 1.775 -1.039 1122 HG3 GLU 135 HG1 GLU 135 19.455 1.322 0.069 1123 H LYS 136 HN LYS 136 19.474 -2.007 0.194 1124 HA LYS 136 HA LYS 136 18.123 -3.150 1.647 1125 HB2 LYS 136 HB2 LYS 136 20.822 -3.943 2.764 1126 HB3 LYS 136 HB1 LYS 136 19.315 -4.815 3.008 1127 HG2 LYS 136 HG2 LYS 136 19.197 -5.081 0.506 1128 HG3 LYS 136 HG1 LYS 136 20.849 -4.464 0.452 1129 HD2 LYS 136 HD2 LYS 136 21.242 -6.726 0.531 1130 HD3 LYS 136 HD1 LYS 136 21.260 -6.337 2.252 1131 HE2 LYS 136 HE2 LYS 136 19.280 -7.385 2.651 1132 HE3 LYS 136 HE1 LYS 136 18.642 -7.025 1.046 1133 HZ1 LYS 136 HZ1 LYS 136 20.895 -8.858 1.140 1134 HZ2 LYS 136 HZ2 LYS 136 19.498 -8.906 0.188 1135 HZ3 LYS 136 HZ3 LYS 136 19.447 -9.441 1.792 1136 H LEU 137 HN LEU 137 17.587 -0.932 2.450 1137 HA LEU 137 HA LEU 137 18.507 0.481 4.492 1138 HB2 LEU 137 HB2 LEU 137 15.768 -0.154 3.596 1139 HB3 LEU 137 HB1 LEU 137 15.897 0.552 5.196 1140 HG LEU 137 HG LEU 137 16.883 1.759 2.612 1141 HD11 LEU 137 HD11 LEU 137 14.572 2.077 2.711 1142 HD12 LEU 137 HD12 LEU 137 15.245 3.567 3.371 1143 HD13 LEU 137 HD13 LEU 137 14.589 2.340 4.455 1144 HD21 LEU 137 HD21 LEU 137 17.478 2.380 5.442 1145 HD22 LEU 137 HD22 LEU 137 17.124 3.746 4.383 1146 HD23 LEU 137 HD23 LEU 137 18.445 2.646 3.990 1147 H ASN 138 HN ASN 138 15.754 -1.393 5.642 1148 HA ASN 138 HA ASN 138 17.367 -2.087 7.993 1149 HB2 ASN 138 HB2 ASN 138 14.953 -2.459 8.984 1150 HB3 ASN 138 HB1 ASN 138 15.649 -0.848 8.874 1151 HD21 ASN 138 HD21 ASN 138 12.934 -1.282 9.092 1152 HD22 ASN 138 HD22 ASN 138 12.158 -0.802 7.623 1153 H ILE 139 HN ILE 139 14.281 -3.610 7.222 1154 HA ILE 139 HA ILE 139 15.568 -6.198 7.455 1155 HB ILE 139 HB ILE 139 13.295 -7.118 7.471 1156 HG12 ILE 139 HG12 ILE 139 11.996 -4.481 7.662 1157 HG13 ILE 139 HG11 ILE 139 12.585 -4.894 6.055 1158 HG21 ILE 139 HG21 ILE 139 12.608 -6.209 9.598 1159 HG22 ILE 139 HG22 ILE 139 13.569 -4.757 9.324 1160 HG23 ILE 139 HG23 ILE 139 14.368 -6.314 9.545 1161 HD11 ILE 139 HD11 ILE 139 11.180 -6.739 5.886 1162 HD12 ILE 139 HD12 ILE 139 10.183 -5.509 6.662 1163 HD13 ILE 139 HD13 ILE 139 10.898 -6.800 7.626 1164 H TRP 140 HN TRP 140 16.594 -5.357 5.242 1165 HA TRP 140 HA TRP 140 14.944 -6.352 3.024 1166 HB2 TRP 140 HB2 TRP 140 17.413 -4.605 3.012 1167 HB3 TRP 140 HB1 TRP 140 16.614 -5.204 1.561 1168 HD1 TRP 140 HD1 TRP 140 15.713 -3.065 4.666 1169 HE1 TRP 140 HE1 TRP 140 14.033 -1.263 3.921 1170 HE3 TRP 140 HE3 TRP 140 15.144 -4.466 -0.212 1171 HZ2 TRP 140 HZ2 TRP 140 12.654 -0.535 1.575 1172 HZ3 TRP 140 HZ3 TRP 140 13.621 -3.166 -1.642 1173 HH2 TRP 140 HH2 TRP 140 12.400 -1.240 -0.765 Start of MODEL 11 1 H1 ALA 1 HT1 ALA 1 2.077 18.544 0.314 2 H2 ALA 1 HT2 ALA 1 1.844 20.229 0.540 3 H3 ALA 1 HT3 ALA 1 0.848 19.104 1.370 4 HA ALA 1 HA ALA 1 2.679 20.208 2.644 5 HB1 ALA 1 HB1 ALA 1 1.521 18.411 3.631 6 HB2 ALA 1 HB2 ALA 1 3.232 18.008 3.775 7 HB3 ALA 1 HB3 ALA 1 2.244 17.236 2.533 8 H THR 2 HN THR 2 3.751 17.317 0.843 9 HA THR 2 HA THR 2 6.505 18.266 1.017 10 HB THR 2 HB THR 2 7.065 16.025 0.076 11 HG1 THR 2 HG1 THR 2 5.488 15.090 -0.930 12 HG21 THR 2 HG21 THR 2 5.901 14.691 2.024 13 HG22 THR 2 HG22 THR 2 5.536 16.319 2.598 14 HG23 THR 2 HG23 THR 2 7.210 15.833 2.333 15 H SER 3 HN SER 3 7.772 17.468 -1.129 16 HA SER 3 HA SER 3 7.017 19.321 -3.133 17 HB2 SER 3 HB2 SER 3 8.914 18.405 -4.407 18 HB3 SER 3 HB1 SER 3 9.362 18.712 -2.730 19 HG SER 3 HG SER 3 9.644 16.477 -4.024 20 H THR 4 HN THR 4 4.828 18.602 -3.556 21 HA THR 4 HA THR 4 4.703 16.910 -5.861 22 HB THR 4 HB THR 4 2.736 15.632 -4.451 23 HG1 THR 4 HG1 THR 4 4.961 15.832 -2.710 24 HG21 THR 4 HG21 THR 4 4.107 13.688 -4.441 25 HG22 THR 4 HG22 THR 4 5.576 14.658 -4.559 26 HG23 THR 4 HG23 THR 4 4.451 14.592 -5.916 27 H LYS 5 HN LYS 5 3.292 17.841 -7.175 28 HA LYS 5 HA LYS 5 1.659 19.989 -6.439 29 HB2 LYS 5 HB2 LYS 5 1.984 18.297 -8.856 30 HB3 LYS 5 HB1 LYS 5 0.489 19.215 -8.731 31 HG2 LYS 5 HG2 LYS 5 2.911 20.756 -8.145 32 HG3 LYS 5 HG1 LYS 5 2.802 20.146 -9.798 33 HD2 LYS 5 HD2 LYS 5 0.504 21.567 -8.488 34 HD3 LYS 5 HD1 LYS 5 1.796 22.453 -9.301 35 HE2 LYS 5 HE2 LYS 5 0.589 22.189 -11.162 36 HE3 LYS 5 HE1 LYS 5 1.143 20.515 -11.134 37 HZ1 LYS 5 HZ1 LYS 5 -0.840 19.830 -10.081 38 HZ2 LYS 5 HZ2 LYS 5 -1.317 20.844 -11.347 39 HZ3 LYS 5 HZ3 LYS 5 -1.322 21.420 -9.757 40 H LYS 6 HN LYS 6 -0.495 20.191 -5.972 41 HA LYS 6 HA LYS 6 -1.825 17.760 -5.071 42 HB2 LYS 6 HB2 LYS 6 -1.623 20.057 -3.804 43 HB3 LYS 6 HB1 LYS 6 -3.015 20.491 -4.786 44 HG2 LYS 6 HG2 LYS 6 -4.309 18.706 -3.856 45 HG3 LYS 6 HG1 LYS 6 -2.900 18.068 -3.005 46 HD2 LYS 6 HD2 LYS 6 -3.968 20.840 -2.524 47 HD3 LYS 6 HD1 LYS 6 -4.541 19.432 -1.626 48 HE2 LYS 6 HE2 LYS 6 -2.522 19.126 -0.554 49 HE3 LYS 6 HE1 LYS 6 -1.610 19.962 -1.810 50 HZ1 LYS 6 HZ1 LYS 6 -2.213 22.024 -0.987 51 HZ2 LYS 6 HZ2 LYS 6 -1.976 21.129 0.427 52 HZ3 LYS 6 HZ3 LYS 6 -3.544 21.427 -0.132 53 H LEU 7 HN LEU 7 -3.144 16.714 -6.392 54 HA LEU 7 HA LEU 7 -4.480 18.204 -8.542 55 HB2 LEU 7 HB2 LEU 7 -3.180 15.651 -8.411 56 HB3 LEU 7 HB1 LEU 7 -4.855 15.419 -8.877 57 HG LEU 7 HG LEU 7 -4.479 17.146 -10.687 58 HD11 LEU 7 HD11 LEU 7 -1.910 17.127 -11.291 59 HD12 LEU 7 HD12 LEU 7 -1.744 16.957 -9.544 60 HD13 LEU 7 HD13 LEU 7 -2.598 18.345 -10.217 61 HD21 LEU 7 HD21 LEU 7 -2.857 15.415 -11.924 62 HD22 LEU 7 HD22 LEU 7 -4.566 15.092 -11.635 63 HD23 LEU 7 HD23 LEU 7 -3.346 14.419 -10.554 64 H HIS 8 HN HIS 8 -5.333 15.181 -6.872 65 HA HIS 8 HA HIS 8 -7.605 16.254 -5.556 66 HB2 HIS 8 HB2 HIS 8 -9.286 14.909 -6.943 67 HB3 HIS 8 HB1 HIS 8 -8.687 16.408 -7.647 68 HD1 HIS 8 HD1 HIS 8 -7.621 16.246 -9.904 69 HD2 HIS 8 HD2 HIS 8 -8.046 12.536 -8.083 70 HE1 HIS 8 HE1 HIS 8 -6.975 14.561 -11.654 71 HE2 HIS 8 HE2 HIS 8 -7.317 12.320 -10.555 72 H LYS 9 HN LYS 9 -7.500 15.072 -3.770 73 HA LYS 9 HA LYS 9 -7.098 12.164 -4.033 74 HB2 LYS 9 HB2 LYS 9 -6.276 14.039 -1.813 75 HB3 LYS 9 HB1 LYS 9 -6.222 12.288 -1.673 76 HG2 LYS 9 HG2 LYS 9 -4.061 12.756 -2.262 77 HG3 LYS 9 HG1 LYS 9 -4.781 12.446 -3.842 78 HD2 LYS 9 HD2 LYS 9 -3.439 14.425 -4.004 79 HD3 LYS 9 HD1 LYS 9 -5.136 14.902 -4.085 80 HE2 LYS 9 HE2 LYS 9 -3.950 14.845 -1.389 81 HE3 LYS 9 HE1 LYS 9 -3.306 16.073 -2.478 82 HZ1 LYS 9 HZ1 LYS 9 -5.959 16.307 -2.859 83 HZ2 LYS 9 HZ2 LYS 9 -5.055 17.258 -1.792 84 HZ3 LYS 9 HZ3 LYS 9 -5.894 15.908 -1.216 85 H GLU 10 HN GLU 10 -8.120 10.861 -2.308 86 HA GLU 10 HA GLU 10 -10.555 12.105 -1.231 87 HB2 GLU 10 HB2 GLU 10 -10.452 10.193 -3.320 88 HB3 GLU 10 HB1 GLU 10 -11.079 9.366 -1.901 89 HG2 GLU 10 HG2 GLU 10 -12.973 10.642 -1.821 90 HG3 GLU 10 HG1 GLU 10 -12.210 12.020 -2.615 91 HA PRO 11 HA PRO 11 -9.078 10.029 2.427 92 HB2 PRO 11 HB2 PRO 11 -11.031 10.749 4.112 93 HB3 PRO 11 HB1 PRO 11 -9.861 11.924 3.500 94 HG2 PRO 11 HG2 PRO 11 -12.670 11.408 2.606 95 HG3 PRO 11 HG1 PRO 11 -11.839 12.955 2.849 96 HD2 PRO 11 HD2 PRO 11 -12.178 11.762 0.401 97 HD3 PRO 11 HD1 PRO 11 -10.861 12.890 0.781 98 H ALA 12 HN ALA 12 -9.904 8.462 4.069 99 HA ALA 12 HA ALA 12 -12.307 7.021 3.554 100 HB1 ALA 12 HB1 ALA 12 -11.360 4.926 2.836 101 HB2 ALA 12 HB2 ALA 12 -9.729 5.595 2.918 102 HB3 ALA 12 HB3 ALA 12 -10.870 6.195 1.713 103 H THR 13 HN THR 13 -12.397 4.989 4.941 104 HA THR 13 HA THR 13 -10.806 5.369 7.391 105 HB THR 13 HB THR 13 -13.720 4.574 7.217 106 HG1 THR 13 HG1 THR 13 -13.218 6.830 6.845 107 HG21 THR 13 HG21 THR 13 -12.735 3.529 9.137 108 HG22 THR 13 HG22 THR 13 -13.721 4.894 9.661 109 HG23 THR 13 HG23 THR 13 -11.965 5.042 9.613 110 H LEU 14 HN LEU 14 -10.629 3.414 8.746 111 HA LEU 14 HA LEU 14 -10.247 1.073 7.046 112 HB2 LEU 14 HB2 LEU 14 -8.824 2.192 9.206 113 HB3 LEU 14 HB1 LEU 14 -9.463 0.665 9.787 114 HG LEU 14 HG LEU 14 -7.136 0.606 8.796 115 HD11 LEU 14 HD11 LEU 14 -9.166 -1.249 8.798 116 HD12 LEU 14 HD12 LEU 14 -7.465 -1.572 8.462 117 HD13 LEU 14 HD13 LEU 14 -8.588 -1.288 7.133 118 HD21 LEU 14 HD21 LEU 14 -8.380 0.490 6.104 119 HD22 LEU 14 HD22 LEU 14 -6.740 0.933 6.577 120 HD23 LEU 14 HD23 LEU 14 -8.062 2.079 6.800 121 H ILE 15 HN ILE 15 -11.977 -0.197 6.845 122 HA ILE 15 HA ILE 15 -14.003 -0.408 8.851 123 HB ILE 15 HB ILE 15 -13.521 -2.193 6.457 124 HG12 ILE 15 HG12 ILE 15 -13.821 0.221 5.898 125 HG13 ILE 15 HG11 ILE 15 -15.103 -0.807 5.267 126 HG21 ILE 15 HG21 ILE 15 -15.470 -2.242 8.598 127 HG22 ILE 15 HG22 ILE 15 -15.136 -3.441 7.348 128 HG23 ILE 15 HG23 ILE 15 -16.237 -2.104 7.016 129 HD11 ILE 15 HD11 ILE 15 -16.411 -0.148 7.356 130 HD12 ILE 15 HD12 ILE 15 -16.199 1.071 6.099 131 HD13 ILE 15 HD13 ILE 15 -15.203 1.122 7.552 132 H LYS 16 HN LYS 16 -11.368 -2.469 7.710 133 HA LYS 16 HA LYS 16 -10.938 -3.603 10.264 134 HB2 LYS 16 HB2 LYS 16 -12.748 -5.018 8.428 135 HB3 LYS 16 HB1 LYS 16 -11.437 -6.010 9.049 136 HG2 LYS 16 HG2 LYS 16 -12.718 -4.429 11.123 137 HG3 LYS 16 HG1 LYS 16 -13.839 -5.510 10.295 138 HD2 LYS 16 HD2 LYS 16 -12.985 -6.784 12.071 139 HD3 LYS 16 HD1 LYS 16 -12.081 -7.327 10.656 140 HE2 LYS 16 HE2 LYS 16 -10.135 -6.595 11.484 141 HE3 LYS 16 HE1 LYS 16 -10.838 -5.068 12.018 142 HZ1 LYS 16 HZ1 LYS 16 -10.872 -7.662 13.455 143 HZ2 LYS 16 HZ2 LYS 16 -11.790 -6.324 13.929 144 HZ3 LYS 16 HZ3 LYS 16 -10.101 -6.233 13.929 145 H ALA 17 HN ALA 17 -8.861 -4.197 10.367 146 HA ALA 17 HA ALA 17 -7.263 -4.107 7.995 147 HB1 ALA 17 HB1 ALA 17 -6.665 -3.276 10.371 148 HB2 ALA 17 HB2 ALA 17 -5.414 -4.036 9.388 149 HB3 ALA 17 HB3 ALA 17 -6.214 -4.956 10.662 150 H ILE 18 HN ILE 18 -6.627 -5.766 6.772 151 HA ILE 18 HA ILE 18 -7.340 -8.470 7.596 152 HB ILE 18 HB ILE 18 -6.022 -7.867 4.980 153 HG12 ILE 18 HG12 ILE 18 -8.138 -6.334 5.696 154 HG13 ILE 18 HG11 ILE 18 -7.794 -6.810 4.043 155 HG21 ILE 18 HG21 ILE 18 -7.479 -9.701 4.220 156 HG22 ILE 18 HG22 ILE 18 -8.111 -9.847 5.859 157 HG23 ILE 18 HG23 ILE 18 -6.408 -10.174 5.539 158 HD11 ILE 18 HD11 ILE 18 -9.621 -8.352 5.863 159 HD12 ILE 18 HD12 ILE 18 -9.419 -8.539 4.122 160 HD13 ILE 18 HD13 ILE 18 -10.168 -7.081 4.770 161 H ASP 19 HN ASP 19 -4.515 -7.204 5.832 162 HA ASP 19 HA ASP 19 -2.742 -8.419 7.802 163 HB2 ASP 19 HB2 ASP 19 -3.012 -9.363 4.971 164 HB3 ASP 19 HB1 ASP 19 -1.444 -9.445 5.767 165 H GLY 20 HN GLY 20 -1.537 -7.787 4.607 166 HA2 GLY 20 HA2 GLY 20 -0.494 -5.184 5.539 167 HA3 GLY 20 HA1 GLY 20 0.518 -6.348 4.692 168 H ASP 21 HN ASP 21 -0.146 -6.939 2.486 169 HA ASP 21 HA ASP 21 -0.656 -4.636 0.928 170 HB2 ASP 21 HB2 ASP 21 -0.651 -6.203 -0.990 171 HB3 ASP 21 HB1 ASP 21 0.733 -6.444 0.072 172 H THR 22 HN THR 22 -2.743 -6.669 2.614 173 HA THR 22 HA THR 22 -5.012 -5.791 0.959 174 HB THR 22 HB THR 22 -4.857 -8.371 2.530 175 HG1 THR 22 HG1 THR 22 -4.471 -7.836 -0.219 176 HG21 THR 22 HG21 THR 22 -7.079 -7.016 1.519 177 HG22 THR 22 HG22 THR 22 -7.003 -8.676 2.111 178 HG23 THR 22 HG23 THR 22 -6.766 -8.339 0.396 179 H VAL 23 HN VAL 23 -6.484 -4.615 1.998 180 HA VAL 23 HA VAL 23 -6.997 -4.966 4.822 181 HB VAL 23 HB VAL 23 -6.690 -2.479 5.252 182 HG11 VAL 23 HG11 VAL 23 -5.080 -4.553 5.751 183 HG12 VAL 23 HG12 VAL 23 -4.678 -2.897 6.206 184 HG13 VAL 23 HG13 VAL 23 -4.002 -3.595 4.735 185 HG21 VAL 23 HG21 VAL 23 -6.372 -2.126 2.682 186 HG22 VAL 23 HG22 VAL 23 -4.690 -2.515 3.038 187 HG23 VAL 23 HG23 VAL 23 -5.465 -1.143 3.832 188 H LYS 24 HN LYS 24 -9.015 -4.206 5.440 189 HA LYS 24 HA LYS 24 -10.783 -3.504 3.245 190 HB2 LYS 24 HB2 LYS 24 -11.054 -4.901 5.714 191 HB3 LYS 24 HB1 LYS 24 -12.164 -3.539 5.740 192 HG2 LYS 24 HG2 LYS 24 -12.236 -4.931 3.205 193 HG3 LYS 24 HG1 LYS 24 -12.584 -6.006 4.558 194 HD2 LYS 24 HD2 LYS 24 -14.142 -4.033 5.316 195 HD3 LYS 24 HD1 LYS 24 -14.072 -3.600 3.606 196 HE2 LYS 24 HE2 LYS 24 -15.555 -5.178 3.113 197 HE3 LYS 24 HE1 LYS 24 -14.530 -6.412 3.845 198 HZ1 LYS 24 HZ1 LYS 24 -16.954 -5.801 4.739 199 HZ2 LYS 24 HZ2 LYS 24 -16.036 -4.747 5.691 200 HZ3 LYS 24 HZ3 LYS 24 -15.729 -6.409 5.735 201 H LEU 25 HN LEU 25 -11.680 -1.536 2.912 202 HA LEU 25 HA LEU 25 -11.346 0.507 4.992 203 HB2 LEU 25 HB2 LEU 25 -10.089 0.423 2.388 204 HB3 LEU 25 HB1 LEU 25 -11.063 1.868 2.575 205 HG LEU 25 HG LEU 25 -9.634 1.711 4.956 206 HD11 LEU 25 HD11 LEU 25 -7.742 1.177 2.676 207 HD12 LEU 25 HD12 LEU 25 -8.242 -0.045 3.846 208 HD13 LEU 25 HD13 LEU 25 -7.346 1.377 4.383 209 HD21 LEU 25 HD21 LEU 25 -8.205 3.490 3.503 210 HD22 LEU 25 HD22 LEU 25 -9.776 3.837 4.227 211 HD23 LEU 25 HD23 LEU 25 -9.672 3.374 2.529 212 H MET 26 HN MET 26 -12.770 2.343 4.788 213 HA MET 26 HA MET 26 -15.387 1.549 3.847 214 HB2 MET 26 HB2 MET 26 -14.931 2.700 6.064 215 HB3 MET 26 HB1 MET 26 -14.631 4.167 5.141 216 HG2 MET 26 HG2 MET 26 -16.821 4.460 4.622 217 HG3 MET 26 HG1 MET 26 -17.174 2.733 4.641 218 HE1 MET 26 HE1 MET 26 -19.139 5.046 6.050 219 HE2 MET 26 HE2 MET 26 -19.639 3.962 7.349 220 HE3 MET 26 HE3 MET 26 -19.417 3.338 5.714 221 H TYR 27 HN TYR 27 -16.127 2.003 1.897 222 HA TYR 27 HA TYR 27 -15.271 4.489 0.584 223 HB2 TYR 27 HB2 TYR 27 -14.022 2.533 -0.344 224 HB3 TYR 27 HB1 TYR 27 -15.559 1.830 -0.825 225 HD1 TYR 27 HD1 TYR 27 -13.890 5.153 -1.137 226 HD2 TYR 27 HD2 TYR 27 -16.042 2.038 -3.065 227 HE1 TYR 27 HE1 TYR 27 -13.778 6.399 -3.257 228 HE2 TYR 27 HE2 TYR 27 -15.940 3.270 -5.190 229 HH TYR 27 HH TYR 27 -15.116 6.495 -5.405 230 H LYS 28 HN LYS 28 -17.000 5.704 0.237 231 HA LYS 28 HA LYS 28 -19.108 6.384 -0.233 232 HB2 LYS 28 HB2 LYS 28 -19.057 3.789 -1.764 233 HB3 LYS 28 HB1 LYS 28 -20.399 4.919 -1.833 234 HG2 LYS 28 HG2 LYS 28 -18.931 6.641 -2.719 235 HG3 LYS 28 HG1 LYS 28 -17.559 5.538 -2.610 236 HD2 LYS 28 HD2 LYS 28 -18.074 5.119 -4.768 237 HD3 LYS 28 HD1 LYS 28 -19.264 4.031 -4.053 238 HE2 LYS 28 HE2 LYS 28 -21.015 5.371 -4.591 239 HE3 LYS 28 HE1 LYS 28 -20.080 6.853 -4.397 240 HZ1 LYS 28 HZ1 LYS 28 -20.453 5.188 -6.751 241 HZ2 LYS 28 HZ2 LYS 28 -18.899 5.819 -6.534 242 HZ3 LYS 28 HZ3 LYS 28 -20.227 6.861 -6.631 243 H GLY 29 HN GLY 29 -18.909 5.418 2.267 244 HA2 GLY 29 HA2 GLY 29 -20.183 4.684 4.026 245 HA3 GLY 29 HA1 GLY 29 -21.556 4.766 2.935 246 H GLN 30 HN GLN 30 -19.028 2.727 1.878 247 HA GLN 30 HA GLN 30 -20.292 0.362 3.067 248 HB2 GLN 30 HB2 GLN 30 -21.198 -0.221 1.105 249 HB3 GLN 30 HB1 GLN 30 -20.461 1.159 0.310 250 HG2 GLN 30 HG2 GLN 30 -18.399 -0.184 0.001 251 HG3 GLN 30 HG1 GLN 30 -19.248 -1.571 0.682 252 HE21 GLN 30 HE21 GLN 30 -18.756 0.399 -2.077 253 HE22 GLN 30 HE22 GLN 30 -19.783 -0.469 -3.161 254 HA PRO 31 HA PRO 31 -16.104 -0.878 3.583 255 HB2 PRO 31 HB2 PRO 31 -16.409 -3.419 4.248 256 HB3 PRO 31 HB1 PRO 31 -17.136 -2.144 5.240 257 HG2 PRO 31 HG2 PRO 31 -18.432 -3.883 3.172 258 HG3 PRO 31 HG1 PRO 31 -19.012 -3.458 4.795 259 HD2 PRO 31 HD2 PRO 31 -19.803 -2.185 2.481 260 HD3 PRO 31 HD1 PRO 31 -19.848 -1.446 4.094 261 H MET 32 HN MET 32 -14.689 -1.017 1.983 262 HA MET 32 HA MET 32 -15.032 -3.139 -0.030 263 HB2 MET 32 HB2 MET 32 -15.199 -0.591 -0.686 264 HB3 MET 32 HB1 MET 32 -13.443 -0.677 -0.622 265 HG2 MET 32 HG2 MET 32 -14.230 -1.019 -2.880 266 HG3 MET 32 HG1 MET 32 -13.470 -2.484 -2.262 267 HE1 MET 32 HE1 MET 32 -15.050 -4.651 -1.328 268 HE2 MET 32 HE2 MET 32 -14.294 -4.562 -2.919 269 HE3 MET 32 HE3 MET 32 -15.955 -5.133 -2.763 270 H THR 33 HN THR 33 -13.155 -4.194 -0.759 271 HA THR 33 HA THR 33 -11.068 -4.334 1.247 272 HB THR 33 HB THR 33 -11.276 -5.946 -1.296 273 HG1 THR 33 HG1 THR 33 -12.931 -6.885 -0.456 274 HG21 THR 33 HG21 THR 33 -9.181 -5.989 0.217 275 HG22 THR 33 HG22 THR 33 -9.891 -7.509 -0.328 276 HG23 THR 33 HG23 THR 33 -10.202 -6.926 1.308 277 H PHE 34 HN PHE 34 -9.394 -3.009 1.129 278 HA PHE 34 HA PHE 34 -8.514 -2.050 -1.496 279 HB2 PHE 34 HB2 PHE 34 -8.320 -0.973 1.282 280 HB3 PHE 34 HB1 PHE 34 -7.091 -0.506 0.108 281 HD1 PHE 34 HD1 PHE 34 -10.771 -0.603 0.634 282 HD2 PHE 34 HD2 PHE 34 -7.495 1.215 -1.391 283 HE1 PHE 34 HE1 PHE 34 -12.285 1.113 -0.276 284 HE2 PHE 34 HE2 PHE 34 -9.003 2.934 -2.298 285 HZ PHE 34 HZ PHE 34 -11.400 2.883 -1.743 286 H ARG 35 HN ARG 35 -6.274 -2.061 -2.053 287 HA ARG 35 HA ARG 35 -4.646 -3.919 -0.470 288 HB2 ARG 35 HB2 ARG 35 -4.120 -5.259 -2.288 289 HB3 ARG 35 HB1 ARG 35 -5.813 -4.886 -2.584 290 HG2 ARG 35 HG2 ARG 35 -5.148 -4.333 -4.635 291 HG3 ARG 35 HG1 ARG 35 -4.544 -2.850 -3.895 292 HD2 ARG 35 HD2 ARG 35 -2.419 -3.425 -4.262 293 HD3 ARG 35 HD1 ARG 35 -2.670 -5.050 -3.628 294 HE ARG 35 HE ARG 35 -3.748 -4.655 -6.263 295 HH11 ARG 35 HH11 ARG 35 -0.896 -5.500 -4.435 296 HH12 ARG 35 HH12 ARG 35 -0.167 -6.375 -5.739 297 HH21 ARG 35 HH21 ARG 35 -2.790 -5.806 -7.979 298 HH22 ARG 35 HH22 ARG 35 -1.242 -6.549 -7.751 299 H LEU 36 HN LEU 36 -2.410 -3.598 -0.533 300 HA LEU 36 HA LEU 36 -1.571 -0.918 -0.965 301 HB2 LEU 36 HB2 LEU 36 0.003 -3.440 -0.412 302 HB3 LEU 36 HB1 LEU 36 0.724 -1.840 -0.498 303 HG LEU 36 HG LEU 36 -1.405 -2.643 1.485 304 HD11 LEU 36 HD11 LEU 36 1.458 -2.115 2.163 305 HD12 LEU 36 HD12 LEU 36 0.951 -3.720 1.633 306 HD13 LEU 36 HD13 LEU 36 0.235 -2.999 3.076 307 HD21 LEU 36 HD21 LEU 36 -0.852 -0.550 2.577 308 HD22 LEU 36 HD22 LEU 36 -1.361 -0.253 0.915 309 HD23 LEU 36 HD23 LEU 36 0.350 -0.194 1.337 310 H LEU 37 HN LEU 37 -2.133 -0.588 -3.175 311 HA LEU 37 HA LEU 37 -1.535 -1.944 -5.405 312 HB2 LEU 37 HB2 LEU 37 -2.507 0.445 -5.045 313 HB3 LEU 37 HB1 LEU 37 -0.860 0.963 -5.348 314 HG LEU 37 HG LEU 37 -0.899 -0.091 -7.536 315 HD11 LEU 37 HD11 LEU 37 -3.489 -1.141 -6.551 316 HD12 LEU 37 HD12 LEU 37 -2.247 -1.921 -7.531 317 HD13 LEU 37 HD13 LEU 37 -3.347 -0.756 -8.266 318 HD21 LEU 37 HD21 LEU 37 -1.940 1.649 -8.528 319 HD22 LEU 37 HD22 LEU 37 -2.069 2.237 -6.870 320 HD23 LEU 37 HD23 LEU 37 -3.434 1.409 -7.621 321 H LEU 38 HN LEU 38 0.133 -2.348 -6.746 322 HA LEU 38 HA LEU 38 2.274 -2.999 -7.199 323 HB2 LEU 38 HB2 LEU 38 3.747 -1.171 -7.695 324 HB3 LEU 38 HB1 LEU 38 2.111 -0.742 -8.157 325 HG LEU 38 HG LEU 38 3.040 0.115 -5.466 326 HD11 LEU 38 HD11 LEU 38 4.934 0.582 -7.029 327 HD12 LEU 38 HD12 LEU 38 4.214 2.016 -6.297 328 HD13 LEU 38 HD13 LEU 38 3.835 1.593 -7.966 329 HD21 LEU 38 HD21 LEU 38 1.111 1.202 -5.625 330 HD22 LEU 38 HD22 LEU 38 0.908 0.678 -7.296 331 HD23 LEU 38 HD23 LEU 38 1.792 2.161 -6.938 332 H VAL 39 HN VAL 39 1.728 -3.648 -4.571 333 HA VAL 39 HA VAL 39 4.367 -3.229 -3.337 334 HB VAL 39 HB VAL 39 1.770 -3.407 -1.799 335 HG11 VAL 39 HG11 VAL 39 3.562 -4.342 -0.526 336 HG12 VAL 39 HG12 VAL 39 3.223 -2.735 0.117 337 HG13 VAL 39 HG13 VAL 39 4.622 -2.989 -0.926 338 HG21 VAL 39 HG21 VAL 39 3.016 -0.957 -1.289 339 HG22 VAL 39 HG22 VAL 39 1.531 -1.229 -2.197 340 HG23 VAL 39 HG23 VAL 39 3.077 -1.157 -3.039 341 H ASP 40 HN ASP 40 5.317 -5.013 -2.447 342 HA ASP 40 HA ASP 40 3.906 -7.558 -2.871 343 HB2 ASP 40 HB2 ASP 40 6.527 -6.657 -3.584 344 HB3 ASP 40 HB1 ASP 40 6.681 -8.006 -2.462 345 H THR 41 HN THR 41 3.878 -9.125 -1.283 346 HA THR 41 HA THR 41 4.214 -8.148 1.419 347 HB THR 41 HB THR 41 3.537 -10.943 1.309 348 HG1 THR 41 HG1 THR 41 2.589 -10.905 -0.579 349 HG21 THR 41 HG21 THR 41 2.550 -8.528 2.503 350 HG22 THR 41 HG22 THR 41 2.336 -10.204 3.007 351 HG23 THR 41 HG23 THR 41 1.226 -9.486 1.841 352 HA PRO 42 HA PRO 42 8.161 -9.931 2.232 353 HB2 PRO 42 HB2 PRO 42 7.911 -10.606 4.858 354 HB3 PRO 42 HB1 PRO 42 8.108 -8.940 4.301 355 HG2 PRO 42 HG2 PRO 42 5.610 -10.395 5.083 356 HG3 PRO 42 HG1 PRO 42 6.114 -8.741 5.480 357 HD2 PRO 42 HD2 PRO 42 4.329 -9.273 3.526 358 HD3 PRO 42 HD1 PRO 42 5.468 -7.915 3.423 359 H GLU 43 HN GLU 43 8.982 -11.945 3.757 360 HA GLU 43 HA GLU 43 8.343 -14.249 2.307 361 HB2 GLU 43 HB2 GLU 43 10.365 -13.628 3.917 362 HB3 GLU 43 HB1 GLU 43 9.398 -14.520 5.083 363 HG2 GLU 43 HG2 GLU 43 9.449 -16.483 3.705 364 HG3 GLU 43 HG1 GLU 43 10.258 -15.602 2.410 365 H THR 44 HN THR 44 6.200 -14.779 2.265 366 HA THR 44 HA THR 44 4.690 -15.009 4.728 367 HB THR 44 HB THR 44 3.728 -15.913 2.028 368 HG1 THR 44 HG1 THR 44 3.752 -13.243 2.980 369 HG21 THR 44 HG21 THR 44 1.598 -15.489 2.777 370 HG22 THR 44 HG22 THR 44 2.146 -14.378 4.034 371 HG23 THR 44 HG23 THR 44 2.382 -16.115 4.228 372 H LYS 45 HN LYS 45 4.060 -16.870 5.717 373 HA LYS 45 HA LYS 45 5.617 -19.211 5.249 374 HB2 LYS 45 HB2 LYS 45 3.193 -18.861 7.021 375 HB3 LYS 45 HB1 LYS 45 4.347 -20.185 7.096 376 HG2 LYS 45 HG2 LYS 45 5.122 -17.313 7.524 377 HG3 LYS 45 HG1 LYS 45 4.616 -18.385 8.830 378 HD2 LYS 45 HD2 LYS 45 6.578 -19.475 8.852 379 HD3 LYS 45 HD1 LYS 45 6.673 -19.526 7.090 380 HE2 LYS 45 HE2 LYS 45 8.427 -18.137 7.500 381 HE3 LYS 45 HE1 LYS 45 7.139 -16.937 7.416 382 HZ1 LYS 45 HZ1 LYS 45 7.274 -16.508 9.608 383 HZ2 LYS 45 HZ2 LYS 45 8.847 -17.106 9.438 384 HZ3 LYS 45 HZ3 LYS 45 7.622 -18.109 10.031 385 H HIS 46 HN HIS 46 2.452 -18.149 4.276 386 HA HIS 46 HA HIS 46 0.898 -19.039 2.875 387 HB2 HIS 46 HB2 HIS 46 3.195 -19.597 1.668 388 HB3 HIS 46 HB1 HIS 46 2.721 -21.250 2.044 389 HD1 HIS 46 HD1 HIS 46 0.572 -18.363 0.813 390 HD2 HIS 46 HD2 HIS 46 1.755 -22.186 -0.308 391 HE1 HIS 46 HE1 HIS 46 -0.716 -18.877 -1.284 392 HE2 HIS 46 HE2 HIS 46 -0.042 -21.225 -1.901 393 HA PRO 47 HA PRO 47 -0.507 -22.186 5.818 394 HB2 PRO 47 HB2 PRO 47 -3.151 -21.919 5.239 395 HB3 PRO 47 HB1 PRO 47 -2.284 -20.822 6.320 396 HG2 PRO 47 HG2 PRO 47 -2.999 -20.469 3.433 397 HG3 PRO 47 HG1 PRO 47 -3.102 -19.299 4.763 398 HD2 PRO 47 HD2 PRO 47 -1.073 -19.286 2.978 399 HD3 PRO 47 HD1 PRO 47 -0.850 -18.808 4.673 400 H LYS 48 HN LYS 48 -1.526 -24.245 5.630 401 HA LYS 48 HA LYS 48 -2.455 -25.219 3.103 402 HB2 LYS 48 HB2 LYS 48 -0.041 -25.250 2.678 403 HB3 LYS 48 HB1 LYS 48 0.212 -26.207 4.131 404 HG2 LYS 48 HG2 LYS 48 0.171 -27.937 2.714 405 HG3 LYS 48 HG1 LYS 48 -1.580 -27.750 2.818 406 HD2 LYS 48 HD2 LYS 48 -1.395 -26.168 0.851 407 HD3 LYS 48 HD1 LYS 48 0.274 -26.716 0.683 408 HE2 LYS 48 HE2 LYS 48 -0.904 -29.093 0.775 409 HE3 LYS 48 HE1 LYS 48 -2.270 -28.160 0.164 410 HZ1 LYS 48 HZ1 LYS 48 -1.273 -27.829 -1.812 411 HZ2 LYS 48 HZ2 LYS 48 -0.413 -29.226 -1.402 412 HZ3 LYS 48 HZ3 LYS 48 0.280 -27.705 -1.153 413 H LYS 49 HN LYS 49 -0.811 -26.523 5.990 414 HA LYS 49 HA LYS 49 -3.193 -28.193 6.467 415 HB2 LYS 49 HB2 LYS 49 -1.076 -29.403 5.760 416 HB3 LYS 49 HB1 LYS 49 -0.375 -28.892 7.290 417 HG2 LYS 49 HG2 LYS 49 -2.585 -30.004 8.241 418 HG3 LYS 49 HG1 LYS 49 -2.461 -30.919 6.738 419 HD2 LYS 49 HD2 LYS 49 0.011 -30.623 8.345 420 HD3 LYS 49 HD1 LYS 49 -1.248 -31.676 8.994 421 HE2 LYS 49 HE2 LYS 49 -0.311 -31.920 6.155 422 HE3 LYS 49 HE1 LYS 49 0.544 -32.715 7.475 423 HZ1 LYS 49 HZ1 LYS 49 -1.661 -33.725 8.076 424 HZ2 LYS 49 HZ2 LYS 49 -0.978 -34.276 6.630 425 HZ3 LYS 49 HZ3 LYS 49 -2.248 -33.160 6.593 426 H GLY 50 HN GLY 50 -2.696 -25.508 7.463 427 HA2 GLY 50 HA2 GLY 50 -3.559 -24.760 9.584 428 HA3 GLY 50 HA1 GLY 50 -2.770 -26.136 10.341 429 H VAL 51 HN VAL 51 -2.057 -23.144 8.560 430 HA VAL 51 HA VAL 51 0.119 -22.612 10.433 431 HB VAL 51 HB VAL 51 0.590 -22.346 7.467 432 HG11 VAL 51 HG11 VAL 51 1.910 -20.912 8.983 433 HG12 VAL 51 HG12 VAL 51 2.904 -22.072 8.102 434 HG13 VAL 51 HG13 VAL 51 2.507 -22.359 9.796 435 HG21 VAL 51 HG21 VAL 51 2.183 -24.352 7.968 436 HG22 VAL 51 HG22 VAL 51 0.480 -24.645 7.617 437 HG23 VAL 51 HG23 VAL 51 1.053 -24.671 9.284 438 H GLU 52 HN GLU 52 0.697 -20.412 10.590 439 HA GLU 52 HA GLU 52 -1.403 -18.586 10.290 440 HB2 GLU 52 HB2 GLU 52 1.545 -18.013 10.635 441 HB3 GLU 52 HB1 GLU 52 0.241 -16.866 10.908 442 HG2 GLU 52 HG2 GLU 52 -0.256 -17.713 12.921 443 HG3 GLU 52 HG1 GLU 52 0.000 -19.378 12.401 444 H LYS 53 HN LYS 53 -1.681 -16.806 8.906 445 HA LYS 53 HA LYS 53 -0.075 -16.819 6.447 446 HB2 LYS 53 HB2 LYS 53 -2.088 -16.564 5.088 447 HB3 LYS 53 HB1 LYS 53 -2.141 -18.065 6.002 448 HG2 LYS 53 HG2 LYS 53 -3.379 -15.910 7.468 449 HG3 LYS 53 HG1 LYS 53 -4.104 -16.103 5.871 450 HD2 LYS 53 HD2 LYS 53 -4.238 -18.588 6.407 451 HD3 LYS 53 HD1 LYS 53 -3.869 -18.138 8.073 452 HE2 LYS 53 HE2 LYS 53 -5.884 -17.094 8.384 453 HE3 LYS 53 HE1 LYS 53 -6.068 -16.704 6.674 454 HZ1 LYS 53 HZ1 LYS 53 -6.773 -19.146 8.111 455 HZ2 LYS 53 HZ2 LYS 53 -6.217 -19.321 6.523 456 HZ3 LYS 53 HZ3 LYS 53 -7.577 -18.367 6.843 457 H TYR 54 HN TYR 54 0.426 -15.055 8.431 458 HA TYR 54 HA TYR 54 -0.154 -12.544 7.153 459 HB2 TYR 54 HB2 TYR 54 -1.038 -11.523 9.307 460 HB3 TYR 54 HB1 TYR 54 -2.144 -12.588 8.447 461 HD1 TYR 54 HD1 TYR 54 -0.073 -12.185 11.442 462 HD2 TYR 54 HD2 TYR 54 -2.771 -14.742 9.372 463 HE1 TYR 54 HE1 TYR 54 -0.363 -13.522 13.484 464 HE2 TYR 54 HE2 TYR 54 -3.068 -16.087 11.409 465 HH TYR 54 HH TYR 54 -1.984 -15.053 14.469 466 H GLY 55 HN GLY 55 1.822 -11.704 7.066 467 HA2 GLY 55 HA2 GLY 55 3.933 -12.396 8.812 468 HA3 GLY 55 HA1 GLY 55 3.943 -11.063 7.669 469 HA PRO 56 HA PRO 56 2.579 -9.765 12.241 470 HB2 PRO 56 HB2 PRO 56 5.167 -10.679 13.357 471 HB3 PRO 56 HB1 PRO 56 3.547 -10.761 14.057 472 HG2 PRO 56 HG2 PRO 56 4.756 -12.952 13.130 473 HG3 PRO 56 HG1 PRO 56 3.011 -12.709 12.923 474 HD2 PRO 56 HD2 PRO 56 5.225 -12.360 10.940 475 HD3 PRO 56 HD1 PRO 56 3.604 -13.045 10.709 476 H GLU 57 HN GLU 57 5.617 -9.732 10.524 477 HA GLU 57 HA GLU 57 6.560 -7.292 11.716 478 HB2 GLU 57 HB2 GLU 57 7.478 -8.948 9.373 479 HB3 GLU 57 HB1 GLU 57 8.233 -7.415 9.786 480 HG2 GLU 57 HG2 GLU 57 9.586 -8.598 11.087 481 HG3 GLU 57 HG1 GLU 57 8.214 -8.751 12.183 482 H ALA 58 HN ALA 58 5.217 -8.194 8.546 483 HA ALA 58 HA ALA 58 5.149 -5.458 7.655 484 HB1 ALA 58 HB1 ALA 58 3.649 -6.711 5.828 485 HB2 ALA 58 HB2 ALA 58 4.508 -8.099 6.495 486 HB3 ALA 58 HB3 ALA 58 5.412 -6.747 5.813 487 H SER 59 HN SER 59 2.727 -7.885 8.586 488 HA SER 59 HA SER 59 0.445 -6.337 8.176 489 HB2 SER 59 HB2 SER 59 0.770 -8.874 8.847 490 HB3 SER 59 HB1 SER 59 0.539 -8.243 10.478 491 HG SER 59 HG SER 59 -1.433 -7.298 9.695 492 H ALA 60 HN ALA 60 2.722 -6.378 10.828 493 HA ALA 60 HA ALA 60 1.133 -4.970 12.696 494 HB1 ALA 60 HB1 ALA 60 4.048 -5.559 12.449 495 HB2 ALA 60 HB2 ALA 60 2.897 -6.083 13.678 496 HB3 ALA 60 HB3 ALA 60 3.480 -4.418 13.667 497 H PHE 61 HN PHE 61 3.867 -3.846 10.691 498 HA PHE 61 HA PHE 61 3.677 -1.151 11.333 499 HB2 PHE 61 HB2 PHE 61 5.587 -2.186 10.153 500 HB3 PHE 61 HB1 PHE 61 4.591 -2.342 8.710 501 HD1 PHE 61 HD1 PHE 61 6.161 0.062 11.009 502 HD2 PHE 61 HD2 PHE 61 4.258 -0.519 7.252 503 HE1 PHE 61 HE1 PHE 61 6.826 2.335 10.324 504 HE2 PHE 61 HE2 PHE 61 4.907 1.747 6.559 505 HZ PHE 61 HZ PHE 61 6.197 3.180 8.095 506 H THR 62 HN THR 62 2.377 -2.783 8.430 507 HA THR 62 HA THR 62 1.113 -0.615 7.277 508 HB THR 62 HB THR 62 0.138 -3.482 7.318 509 HG1 THR 62 HG1 THR 62 1.912 -3.775 6.250 510 HG21 THR 62 HG21 THR 62 -0.554 -1.163 5.561 511 HG22 THR 62 HG22 THR 62 -1.624 -2.305 6.372 512 HG23 THR 62 HG23 THR 62 -0.669 -2.827 4.985 513 H LYS 63 HN LYS 63 0.010 -2.717 9.867 514 HA LYS 63 HA LYS 63 -2.599 -1.535 10.047 515 HB2 LYS 63 HB2 LYS 63 -2.435 -3.794 10.747 516 HB3 LYS 63 HB1 LYS 63 -1.031 -3.466 11.748 517 HG2 LYS 63 HG2 LYS 63 -2.358 -3.252 13.501 518 HG3 LYS 63 HG1 LYS 63 -3.122 -1.859 12.739 519 HD2 LYS 63 HD2 LYS 63 -4.951 -3.198 13.040 520 HD3 LYS 63 HD1 LYS 63 -4.446 -3.727 11.433 521 HE2 LYS 63 HE2 LYS 63 -2.975 -5.292 13.217 522 HE3 LYS 63 HE1 LYS 63 -4.600 -5.219 13.900 523 HZ1 LYS 63 HZ1 LYS 63 -5.469 -6.384 12.191 524 HZ2 LYS 63 HZ2 LYS 63 -3.890 -6.976 12.057 525 HZ3 LYS 63 HZ3 LYS 63 -4.414 -5.731 11.039 526 H LYS 64 HN LYS 64 0.518 -1.092 11.558 527 HA LYS 64 HA LYS 64 -0.226 0.430 13.777 528 HB2 LYS 64 HB2 LYS 64 2.226 -0.138 12.289 529 HB3 LYS 64 HB1 LYS 64 2.224 1.460 13.020 530 HG2 LYS 64 HG2 LYS 64 1.479 -0.945 14.632 531 HG3 LYS 64 HG1 LYS 64 3.174 -0.537 14.344 532 HD2 LYS 64 HD2 LYS 64 3.083 1.342 15.634 533 HD3 LYS 64 HD1 LYS 64 1.381 1.637 15.273 534 HE2 LYS 64 HE2 LYS 64 0.671 -0.006 16.820 535 HE3 LYS 64 HE1 LYS 64 2.302 -0.655 16.988 536 HZ1 LYS 64 HZ1 LYS 64 2.962 1.458 18.014 537 HZ2 LYS 64 HZ2 LYS 64 1.750 0.675 18.895 538 HZ3 LYS 64 HZ3 LYS 64 1.362 2.002 17.922 539 H MET 65 HN MET 65 0.850 1.518 10.570 540 HA MET 65 HA MET 65 0.528 4.263 11.064 541 HB2 MET 65 HB2 MET 65 0.399 2.859 8.396 542 HB3 MET 65 HB1 MET 65 0.765 4.557 8.672 543 HG2 MET 65 HG2 MET 65 2.670 3.426 10.186 544 HG3 MET 65 HG1 MET 65 2.471 2.176 8.959 545 HE1 MET 65 HE1 MET 65 3.615 5.982 9.578 546 HE2 MET 65 HE2 MET 65 5.091 5.681 8.661 547 HE3 MET 65 HE3 MET 65 4.643 4.609 9.988 548 H VAL 66 HN VAL 66 -1.639 1.980 9.379 549 HA VAL 66 HA VAL 66 -3.613 3.916 8.807 550 HB VAL 66 HB VAL 66 -5.115 1.955 8.400 551 HG11 VAL 66 HG11 VAL 66 -3.816 2.871 6.594 552 HG12 VAL 66 HG12 VAL 66 -3.797 1.111 6.471 553 HG13 VAL 66 HG13 VAL 66 -2.392 1.967 7.106 554 HG21 VAL 66 HG21 VAL 66 -4.621 0.089 9.528 555 HG22 VAL 66 HG22 VAL 66 -2.966 0.609 9.836 556 HG23 VAL 66 HG23 VAL 66 -3.373 -0.175 8.311 557 H GLU 67 HN GLU 67 -3.255 1.643 11.501 558 HA GLU 67 HA GLU 67 -5.798 2.256 12.619 559 HB2 GLU 67 HB2 GLU 67 -3.385 0.869 13.775 560 HB3 GLU 67 HB1 GLU 67 -4.919 1.028 14.621 561 HG2 GLU 67 HG2 GLU 67 -4.469 -0.387 12.003 562 HG3 GLU 67 HG1 GLU 67 -4.731 -1.146 13.575 563 H ASN 68 HN ASN 68 -2.470 3.177 13.516 564 HA ASN 68 HA ASN 68 -3.237 4.821 15.682 565 HB2 ASN 68 HB2 ASN 68 -0.740 4.677 14.005 566 HB3 ASN 68 HB1 ASN 68 -0.922 5.867 15.289 567 HD21 ASN 68 HD21 ASN 68 -1.007 2.406 14.623 568 HD22 ASN 68 HD22 ASN 68 -0.479 1.910 16.191 569 H ALA 69 HN ALA 69 -3.098 5.353 12.252 570 HA ALA 69 HA ALA 69 -3.139 8.212 12.381 571 HB1 ALA 69 HB1 ALA 69 -2.258 7.365 10.394 572 HB2 ALA 69 HB2 ALA 69 -3.860 7.942 9.935 573 HB3 ALA 69 HB3 ALA 69 -3.582 6.219 10.186 574 H LYS 70 HN LYS 70 -4.808 9.382 13.028 575 HA LYS 70 HA LYS 70 -7.375 8.375 13.516 576 HB2 LYS 70 HB2 LYS 70 -6.006 10.904 13.753 577 HB3 LYS 70 HB1 LYS 70 -7.637 11.152 13.141 578 HG2 LYS 70 HG2 LYS 70 -8.396 9.667 15.076 579 HG3 LYS 70 HG1 LYS 70 -6.776 9.918 15.733 580 HD2 LYS 70 HD2 LYS 70 -8.614 12.170 14.939 581 HD3 LYS 70 HD1 LYS 70 -8.540 11.506 16.573 582 HE2 LYS 70 HE2 LYS 70 -5.906 11.950 16.041 583 HE3 LYS 70 HE1 LYS 70 -6.670 13.276 15.164 584 HZ1 LYS 70 HZ1 LYS 70 -6.064 13.731 17.544 585 HZ2 LYS 70 HZ2 LYS 70 -7.297 12.664 17.993 586 HZ3 LYS 70 HZ3 LYS 70 -7.668 14.068 17.126 587 H LYS 71 HN LYS 71 -5.922 9.535 10.611 588 HA LYS 71 HA LYS 71 -8.489 9.196 9.232 589 HB2 LYS 71 HB2 LYS 71 -7.631 11.672 9.668 590 HB3 LYS 71 HB1 LYS 71 -6.648 11.323 8.252 591 HG2 LYS 71 HG2 LYS 71 -8.796 10.641 7.098 592 HG3 LYS 71 HG1 LYS 71 -9.641 11.371 8.465 593 HD2 LYS 71 HD2 LYS 71 -7.584 12.857 6.850 594 HD3 LYS 71 HD1 LYS 71 -9.296 12.843 6.424 595 HE2 LYS 71 HE2 LYS 71 -9.414 13.474 9.062 596 HE3 LYS 71 HE1 LYS 71 -7.894 14.238 8.599 597 HZ1 LYS 71 HZ1 LYS 71 -8.951 15.614 7.088 598 HZ2 LYS 71 HZ2 LYS 71 -10.052 15.570 8.371 599 HZ3 LYS 71 HZ3 LYS 71 -10.331 14.639 6.987 600 H ILE 72 HN ILE 72 -8.386 8.201 7.275 601 HA ILE 72 HA ILE 72 -5.709 7.454 6.297 602 HB ILE 72 HB ILE 72 -8.141 5.774 5.811 603 HG12 ILE 72 HG12 ILE 72 -7.954 6.060 8.258 604 HG13 ILE 72 HG11 ILE 72 -7.597 4.410 7.762 605 HG21 ILE 72 HG21 ILE 72 -5.359 4.762 6.141 606 HG22 ILE 72 HG22 ILE 72 -5.806 5.593 4.651 607 HG23 ILE 72 HG23 ILE 72 -6.674 4.139 5.145 608 HD11 ILE 72 HD11 ILE 72 -5.350 6.331 8.077 609 HD12 ILE 72 HD12 ILE 72 -5.385 4.582 8.302 610 HD13 ILE 72 HD13 ILE 72 -6.105 5.641 9.514 611 H GLU 73 HN GLU 73 -5.359 7.498 4.081 612 HA GLU 73 HA GLU 73 -7.565 8.580 2.448 613 HB2 GLU 73 HB2 GLU 73 -4.708 9.334 1.921 614 HB3 GLU 73 HB1 GLU 73 -6.180 10.154 1.418 615 HG2 GLU 73 HG2 GLU 73 -6.577 10.908 3.677 616 HG3 GLU 73 HG1 GLU 73 -5.177 10.004 4.252 617 H VAL 74 HN VAL 74 -7.739 7.838 0.348 618 HA VAL 74 HA VAL 74 -5.842 5.740 -0.448 619 HB VAL 74 HB VAL 74 -7.864 4.684 -1.625 620 HG11 VAL 74 HG11 VAL 74 -7.452 3.161 -0.069 621 HG12 VAL 74 HG12 VAL 74 -8.511 4.030 1.042 622 HG13 VAL 74 HG13 VAL 74 -6.785 4.393 1.001 623 HG21 VAL 74 HG21 VAL 74 -9.518 6.346 -1.390 624 HG22 VAL 74 HG22 VAL 74 -9.228 6.500 0.343 625 HG23 VAL 74 HG23 VAL 74 -9.991 5.045 -0.298 626 H GLU 75 HN GLU 75 -5.197 5.704 -2.539 627 HA GLU 75 HA GLU 75 -6.415 7.674 -4.361 628 HB2 GLU 75 HB2 GLU 75 -4.270 8.527 -3.603 629 HB3 GLU 75 HB1 GLU 75 -3.482 7.015 -4.033 630 HG2 GLU 75 HG2 GLU 75 -3.322 7.565 -6.194 631 HG3 GLU 75 HG1 GLU 75 -4.923 8.305 -6.233 632 H PHE 76 HN PHE 76 -7.525 6.452 -5.771 633 HA PHE 76 HA PHE 76 -6.707 3.838 -6.563 634 HB2 PHE 76 HB2 PHE 76 -8.890 5.696 -7.490 635 HB3 PHE 76 HB1 PHE 76 -8.599 4.140 -8.263 636 HD1 PHE 76 HD2 PHE 76 -8.138 2.275 -6.175 637 HD2 PHE 76 HD1 PHE 76 -10.769 5.623 -6.200 638 HE1 PHE 76 HE2 PHE 76 -9.546 1.179 -4.480 639 HE2 PHE 76 HE1 PHE 76 -12.180 4.531 -4.508 640 HZ PHE 76 HZ PHE 76 -11.571 2.306 -3.648 641 H ASP 77 HN ASP 77 -5.721 3.169 -8.375 642 HA ASP 77 HA ASP 77 -3.946 4.842 -9.716 643 HB2 ASP 77 HB2 ASP 77 -3.512 2.968 -11.188 644 HB3 ASP 77 HB1 ASP 77 -3.732 2.368 -9.548 645 H LYS 78 HN LYS 78 -4.144 4.318 -12.415 646 HA LYS 78 HA LYS 78 -6.542 5.858 -13.155 647 HB2 LYS 78 HB2 LYS 78 -4.523 5.955 -15.197 648 HB3 LYS 78 HB1 LYS 78 -5.235 7.275 -14.282 649 HG2 LYS 78 HG2 LYS 78 -2.968 5.593 -13.246 650 HG3 LYS 78 HG1 LYS 78 -2.735 7.081 -14.163 651 HD2 LYS 78 HD2 LYS 78 -4.480 7.948 -12.308 652 HD3 LYS 78 HD1 LYS 78 -3.659 6.686 -11.389 653 HE2 LYS 78 HE2 LYS 78 -2.335 8.518 -10.941 654 HE3 LYS 78 HE1 LYS 78 -1.496 7.803 -12.317 655 HZ1 LYS 78 HZ1 LYS 78 -1.629 9.878 -13.122 656 HZ2 LYS 78 HZ2 LYS 78 -2.921 10.317 -12.122 657 HZ3 LYS 78 HZ3 LYS 78 -3.210 9.446 -13.542 658 H GLY 79 HN GLY 79 -4.707 2.986 -13.731 659 HA2 GLY 79 HA2 GLY 79 -5.822 2.356 -16.283 660 HA3 GLY 79 HA1 GLY 79 -4.955 1.254 -15.227 661 H GLN 80 HN GLN 80 -6.076 -0.119 -13.902 662 HA GLN 80 HA GLN 80 -8.855 -0.517 -14.578 663 HB2 GLN 80 HB2 GLN 80 -8.670 -2.587 -13.340 664 HB3 GLN 80 HB1 GLN 80 -7.293 -2.411 -14.414 665 HG2 GLN 80 HG2 GLN 80 -6.030 -1.502 -12.416 666 HG3 GLN 80 HG1 GLN 80 -7.374 -2.088 -11.437 667 HE21 GLN 80 HE21 GLN 80 -4.841 -3.018 -11.023 668 HE22 GLN 80 HE22 GLN 80 -4.735 -4.670 -11.518 669 H ARG 81 HN ARG 81 -7.025 0.020 -11.581 670 HA ARG 81 HA ARG 81 -7.598 1.065 -9.638 671 HB2 ARG 81 HB2 ARG 81 -10.223 1.748 -10.975 672 HB3 ARG 81 HB1 ARG 81 -9.585 2.457 -9.499 673 HG2 ARG 81 HG2 ARG 81 -7.644 3.292 -10.849 674 HG3 ARG 81 HG1 ARG 81 -8.512 2.762 -12.292 675 HD2 ARG 81 HD2 ARG 81 -9.717 4.627 -10.264 676 HD3 ARG 81 HD1 ARG 81 -8.770 5.202 -11.636 677 HE ARG 81 HE ARG 81 -10.865 3.438 -12.437 678 HH11 ARG 81 HH11 ARG 81 -10.172 6.731 -11.512 679 HH12 ARG 81 HH12 ARG 81 -11.519 7.390 -12.379 680 HH21 ARG 81 HH21 ARG 81 -12.635 4.302 -13.578 681 HH22 ARG 81 HH22 ARG 81 -12.918 6.011 -13.551 682 H THR 82 HN THR 82 -9.213 -1.539 -10.987 683 HA THR 82 HA THR 82 -9.848 -2.630 -8.439 684 HB THR 82 HB THR 82 -12.336 -3.015 -9.271 685 HG1 THR 82 HG1 THR 82 -12.065 -1.796 -11.183 686 HG21 THR 82 HG21 THR 82 -11.270 -1.548 -7.275 687 HG22 THR 82 HG22 THR 82 -12.998 -1.678 -7.606 688 HG23 THR 82 HG23 THR 82 -12.087 -0.295 -8.210 689 H ASP 83 HN ASP 83 -9.281 -4.676 -8.642 690 HA ASP 83 HA ASP 83 -8.995 -5.917 -11.202 691 HB2 ASP 83 HB2 ASP 83 -7.849 -6.287 -8.727 692 HB3 ASP 83 HB1 ASP 83 -8.891 -7.699 -8.876 693 H LYS 84 HN LYS 84 -9.741 -8.446 -11.045 694 HA LYS 84 HA LYS 84 -12.345 -8.579 -11.830 695 HB2 LYS 84 HB2 LYS 84 -12.069 -11.026 -10.600 696 HB3 LYS 84 HB1 LYS 84 -11.582 -10.645 -12.247 697 HG2 LYS 84 HG2 LYS 84 -9.645 -10.107 -10.058 698 HG3 LYS 84 HG1 LYS 84 -9.943 -11.784 -10.518 699 HD2 LYS 84 HD2 LYS 84 -9.447 -9.815 -12.687 700 HD3 LYS 84 HD1 LYS 84 -8.075 -10.314 -11.697 701 HE2 LYS 84 HE2 LYS 84 -8.278 -12.553 -12.337 702 HE3 LYS 84 HE1 LYS 84 -9.928 -12.331 -12.917 703 HZ1 LYS 84 HZ1 LYS 84 -7.696 -10.901 -14.206 704 HZ2 LYS 84 HZ2 LYS 84 -9.204 -11.322 -14.848 705 HZ3 LYS 84 HZ3 LYS 84 -8.023 -12.511 -14.614 706 H TYR 85 HN TYR 85 -11.251 -9.532 -8.573 707 HA TYR 85 HA TYR 85 -13.856 -9.807 -7.537 708 HB2 TYR 85 HB2 TYR 85 -11.105 -9.759 -6.425 709 HB3 TYR 85 HB1 TYR 85 -12.415 -9.424 -5.299 710 HD1 TYR 85 HD1 TYR 85 -12.478 -11.741 -8.197 711 HD2 TYR 85 HD2 TYR 85 -12.414 -11.356 -3.962 712 HE1 TYR 85 HE1 TYR 85 -12.894 -14.155 -7.978 713 HE2 TYR 85 HE2 TYR 85 -12.829 -13.768 -3.729 714 HH TYR 85 HH TYR 85 -13.758 -15.737 -6.373 715 H GLY 86 HN GLY 86 -12.167 -7.050 -8.387 716 HA2 GLY 86 HA2 GLY 86 -12.950 -4.855 -8.244 717 HA3 GLY 86 HA1 GLY 86 -14.097 -5.368 -7.013 718 H ARG 87 HN ARG 87 -10.821 -6.354 -6.641 719 HA ARG 87 HA ARG 87 -10.482 -5.334 -4.105 720 HB2 ARG 87 HB2 ARG 87 -8.956 -6.826 -5.839 721 HB3 ARG 87 HB1 ARG 87 -7.998 -5.362 -5.659 722 HG2 ARG 87 HG2 ARG 87 -7.154 -6.456 -3.890 723 HG3 ARG 87 HG1 ARG 87 -8.600 -5.845 -3.083 724 HD2 ARG 87 HD2 ARG 87 -8.303 -8.549 -4.388 725 HD3 ARG 87 HD1 ARG 87 -8.281 -8.228 -2.654 726 HE ARG 87 HE ARG 87 -10.662 -7.317 -3.994 727 HH11 ARG 87 HH11 ARG 87 -9.116 -10.000 -2.384 728 HH12 ARG 87 HH12 ARG 87 -10.609 -10.769 -1.962 729 HH21 ARG 87 HH21 ARG 87 -12.625 -8.326 -3.440 730 HH22 ARG 87 HH22 ARG 87 -12.602 -9.819 -2.562 731 H GLY 88 HN GLY 88 -9.072 -3.612 -3.310 732 HA2 GLY 88 HA2 GLY 88 -9.586 -1.159 -4.779 733 HA3 GLY 88 HA1 GLY 88 -9.004 -1.275 -3.131 734 H LEU 89 HN LEU 89 -8.184 -0.798 -6.387 735 HA LEU 89 HA LEU 89 -5.359 -1.319 -6.044 736 HB2 LEU 89 HB2 LEU 89 -7.013 -0.265 -8.323 737 HB3 LEU 89 HB1 LEU 89 -5.265 -0.371 -8.394 738 HG LEU 89 HG LEU 89 -6.600 -2.256 -9.455 739 HD11 LEU 89 HD11 LEU 89 -4.227 -2.439 -9.083 740 HD12 LEU 89 HD12 LEU 89 -5.004 -3.970 -8.678 741 HD13 LEU 89 HD13 LEU 89 -4.495 -2.872 -7.395 742 HD21 LEU 89 HD21 LEU 89 -7.526 -3.946 -8.108 743 HD22 LEU 89 HD22 LEU 89 -8.157 -2.428 -7.468 744 HD23 LEU 89 HD23 LEU 89 -6.841 -3.256 -6.638 745 H ALA 90 HN ALA 90 -5.485 0.313 -4.172 746 HA ALA 90 HA ALA 90 -4.539 2.878 -5.202 747 HB1 ALA 90 HB1 ALA 90 -5.880 4.098 -3.498 748 HB2 ALA 90 HB2 ALA 90 -6.734 2.595 -3.157 749 HB3 ALA 90 HB3 ALA 90 -6.853 3.332 -4.753 750 H TYR 91 HN TYR 91 -3.785 4.256 -3.224 751 HA TYR 91 HA TYR 91 -2.123 2.493 -1.563 752 HB2 TYR 91 HB2 TYR 91 -1.684 5.448 -1.941 753 HB3 TYR 91 HB1 TYR 91 -0.529 4.235 -1.414 754 HD1 TYR 91 HD2 TYR 91 -2.596 5.163 -4.384 755 HD2 TYR 91 HD1 TYR 91 0.995 3.400 -2.938 756 HE1 TYR 91 HE2 TYR 91 -1.780 4.949 -6.692 757 HE2 TYR 91 HE1 TYR 91 1.825 3.188 -5.241 758 HH TYR 91 HH TYR 91 1.468 4.161 -7.427 759 H ILE 92 HN ILE 92 -2.214 2.593 0.638 760 HA ILE 92 HA ILE 92 -4.408 4.157 1.782 761 HB ILE 92 HB ILE 92 -2.714 2.010 3.066 762 HG12 ILE 92 HG12 ILE 92 -5.202 0.951 2.820 763 HG13 ILE 92 HG11 ILE 92 -5.134 1.942 1.367 764 HG21 ILE 92 HG21 ILE 92 -5.282 3.305 3.972 765 HG22 ILE 92 HG22 ILE 92 -3.687 3.552 4.685 766 HG23 ILE 92 HG23 ILE 92 -4.461 1.969 4.779 767 HD11 ILE 92 HD11 ILE 92 -3.141 0.789 0.640 768 HD12 ILE 92 HD12 ILE 92 -4.426 -0.371 0.980 769 HD13 ILE 92 HD13 ILE 92 -3.111 -0.148 2.134 770 H TYR 93 HN TYR 93 -4.096 5.945 2.933 771 HA TYR 93 HA TYR 93 -1.345 6.647 3.693 772 HB2 TYR 93 HB2 TYR 93 -3.764 8.436 3.385 773 HB3 TYR 93 HB1 TYR 93 -2.149 8.973 3.807 774 HD1 TYR 93 HD2 TYR 93 -3.053 6.496 1.180 775 HD2 TYR 93 HD1 TYR 93 -1.658 10.417 2.041 776 HE1 TYR 93 HE2 TYR 93 -2.578 6.836 -1.200 777 HE2 TYR 93 HE1 TYR 93 -1.167 10.769 -0.343 778 HH TYR 93 HH TYR 93 -1.919 9.865 -2.531 779 H ALA 94 HN ALA 94 -1.008 7.756 5.721 780 HA ALA 94 HA ALA 94 -3.082 7.399 7.748 781 HB1 ALA 94 HB1 ALA 94 -2.083 5.486 8.394 782 HB2 ALA 94 HB2 ALA 94 -0.937 6.575 9.175 783 HB3 ALA 94 HB3 ALA 94 -0.563 5.886 7.595 784 H ASP 95 HN ASP 95 -3.316 9.341 8.633 785 HA ASP 95 HA ASP 95 -2.856 11.323 9.647 786 HB2 ASP 95 HB2 ASP 95 -1.016 9.705 10.703 787 HB3 ASP 95 HB1 ASP 95 0.065 10.788 9.829 788 H GLY 96 HN GLY 96 -2.136 10.643 6.657 789 HA2 GLY 96 HA2 GLY 96 -2.019 12.449 5.056 790 HA3 GLY 96 HA1 GLY 96 -0.940 13.289 6.158 791 H LYS 97 HN LYS 97 -0.310 9.952 5.861 792 HA LYS 97 HA LYS 97 1.712 10.446 3.797 793 HB2 LYS 97 HB2 LYS 97 2.125 9.516 6.591 794 HB3 LYS 97 HB1 LYS 97 3.093 8.755 5.337 795 HG2 LYS 97 HG2 LYS 97 3.832 11.016 4.618 796 HG3 LYS 97 HG1 LYS 97 2.974 11.683 6.010 797 HD2 LYS 97 HD2 LYS 97 5.100 9.562 6.249 798 HD3 LYS 97 HD1 LYS 97 5.453 11.290 6.323 799 HE2 LYS 97 HE2 LYS 97 4.304 11.568 8.321 800 HE3 LYS 97 HE1 LYS 97 3.358 10.098 8.095 801 HZ1 LYS 97 HZ1 LYS 97 4.831 9.310 9.588 802 HZ2 LYS 97 HZ2 LYS 97 6.030 10.435 9.192 803 HZ3 LYS 97 HZ3 LYS 97 5.797 9.073 8.218 804 H MET 98 HN MET 98 1.907 8.841 2.319 805 HA MET 98 HA MET 98 -0.020 6.749 2.316 806 HB2 MET 98 HB2 MET 98 2.263 6.420 0.485 807 HB3 MET 98 HB1 MET 98 0.538 6.403 0.157 808 HG2 MET 98 HG2 MET 98 0.663 8.948 0.504 809 HG3 MET 98 HG1 MET 98 2.401 8.737 0.303 810 HE1 MET 98 HE1 MET 98 1.688 6.006 -1.966 811 HE2 MET 98 HE2 MET 98 3.149 6.933 -1.623 812 HE3 MET 98 HE3 MET 98 2.446 6.960 -3.241 813 H VAL 99 HN VAL 99 0.080 5.064 3.586 814 HA VAL 99 HA VAL 99 2.326 4.142 4.960 815 HB VAL 99 HB VAL 99 -0.026 2.401 4.238 816 HG11 VAL 99 HG11 VAL 99 1.534 2.497 6.806 817 HG12 VAL 99 HG12 VAL 99 2.005 1.478 5.446 818 HG13 VAL 99 HG13 VAL 99 0.444 1.235 6.231 819 HG21 VAL 99 HG21 VAL 99 -0.966 3.330 6.446 820 HG22 VAL 99 HG22 VAL 99 -1.111 4.327 4.998 821 HG23 VAL 99 HG23 VAL 99 0.144 4.675 6.187 822 H ASN 100 HN ASN 100 1.144 3.390 1.770 823 HA ASN 100 HA ASN 100 2.422 0.952 1.312 824 HB2 ASN 100 HB2 ASN 100 2.062 3.102 -0.776 825 HB3 ASN 100 HB1 ASN 100 2.084 1.357 -1.013 826 HD21 ASN 100 HD21 ASN 100 0.189 0.392 -1.168 827 HD22 ASN 100 HD22 ASN 100 -1.320 1.021 -0.614 828 H GLU 101 HN GLU 101 3.583 4.201 0.338 829 HA GLU 101 HA GLU 101 6.082 3.428 -0.569 830 HB2 GLU 101 HB2 GLU 101 6.808 5.744 -0.114 831 HB3 GLU 101 HB1 GLU 101 5.258 5.674 -0.938 832 HG2 GLU 101 HG2 GLU 101 4.088 6.341 0.954 833 HG3 GLU 101 HG1 GLU 101 5.413 5.928 2.038 834 H ALA 102 HN ALA 102 5.003 4.098 2.708 835 HA ALA 102 HA ALA 102 7.463 4.158 4.012 836 HB1 ALA 102 HB1 ALA 102 6.088 3.237 5.987 837 HB2 ALA 102 HB2 ALA 102 4.713 3.357 4.891 838 HB3 ALA 102 HB3 ALA 102 5.637 4.800 5.305 839 H LEU 103 HN LEU 103 5.270 1.358 3.691 840 HA LEU 103 HA LEU 103 7.003 -0.557 4.745 841 HB2 LEU 103 HB2 LEU 103 4.837 -0.864 2.662 842 HB3 LEU 103 HB1 LEU 103 5.620 -2.202 3.480 843 HG LEU 103 HG LEU 103 4.492 -0.235 5.326 844 HD11 LEU 103 HD11 LEU 103 2.924 -0.331 3.236 845 HD12 LEU 103 HD12 LEU 103 2.251 -0.423 4.864 846 HD13 LEU 103 HD13 LEU 103 2.458 -1.892 3.911 847 HD21 LEU 103 HD21 LEU 103 5.349 -2.448 5.971 848 HD22 LEU 103 HD22 LEU 103 4.085 -3.205 5.003 849 HD23 LEU 103 HD23 LEU 103 3.655 -2.234 6.409 850 H VAL 104 HN VAL 104 6.589 0.616 1.447 851 HA VAL 104 HA VAL 104 8.208 -1.203 0.096 852 HB VAL 104 HB VAL 104 7.928 1.732 -0.559 853 HG11 VAL 104 HG11 VAL 104 8.084 -0.337 -2.656 854 HG12 VAL 104 HG12 VAL 104 9.562 -0.027 -1.747 855 HG13 VAL 104 HG13 VAL 104 8.765 1.288 -2.612 856 HG21 VAL 104 HG21 VAL 104 5.799 1.428 -1.143 857 HG22 VAL 104 HG22 VAL 104 5.867 -0.110 -0.283 858 HG23 VAL 104 HG23 VAL 104 6.179 -0.055 -2.018 859 H ARG 105 HN ARG 105 9.068 1.933 1.540 860 HA ARG 105 HA ARG 105 11.853 1.608 0.928 861 HB2 ARG 105 HB2 ARG 105 10.965 3.834 0.962 862 HB3 ARG 105 HB1 ARG 105 10.363 3.629 2.599 863 HG2 ARG 105 HG2 ARG 105 13.289 3.387 2.046 864 HG3 ARG 105 HG1 ARG 105 12.539 4.977 2.171 865 HD2 ARG 105 HD2 ARG 105 12.874 2.866 4.261 866 HD3 ARG 105 HD1 ARG 105 13.242 4.587 4.341 867 HE ARG 105 HE ARG 105 10.756 3.325 4.980 868 HH11 ARG 105 HH11 ARG 105 12.211 6.273 3.798 869 HH12 ARG 105 HH12 ARG 105 10.893 7.278 4.301 870 HH21 ARG 105 HH21 ARG 105 9.011 4.656 5.634 871 HH22 ARG 105 HH22 ARG 105 9.081 6.360 5.344 872 H GLN 106 HN GLN 106 9.804 1.074 3.748 873 HA GLN 106 HA GLN 106 11.877 0.823 5.638 874 HB2 GLN 106 HB2 GLN 106 9.085 0.629 5.673 875 HB3 GLN 106 HB1 GLN 106 9.660 -0.922 6.240 876 HG2 GLN 106 HG2 GLN 106 10.037 -0.054 8.233 877 HG3 GLN 106 HG1 GLN 106 11.207 1.051 7.519 878 HE21 GLN 106 HE21 GLN 106 9.359 2.493 5.924 879 HE22 GLN 106 HE22 GLN 106 8.408 3.454 6.990 880 H GLY 107 HN GLY 107 10.405 -1.496 3.425 881 HA2 GLY 107 HA2 GLY 107 11.905 -3.256 2.587 882 HA3 GLY 107 HA1 GLY 107 12.477 -3.451 4.238 883 H LEU 108 HN LEU 108 9.469 -3.040 4.967 884 HA LEU 108 HA LEU 108 8.866 -5.744 5.372 885 HB2 LEU 108 HB2 LEU 108 6.743 -3.635 5.191 886 HB3 LEU 108 HB1 LEU 108 6.810 -5.034 6.244 887 HG LEU 108 HG LEU 108 8.375 -2.471 6.493 888 HD11 LEU 108 HD11 LEU 108 6.076 -3.711 7.861 889 HD12 LEU 108 HD12 LEU 108 6.474 -2.011 7.617 890 HD13 LEU 108 HD13 LEU 108 7.272 -2.929 8.893 891 HD21 LEU 108 HD21 LEU 108 9.405 -3.516 8.495 892 HD22 LEU 108 HD22 LEU 108 9.917 -4.248 6.974 893 HD23 LEU 108 HD23 LEU 108 8.727 -5.064 7.990 894 H ALA 109 HN ALA 109 8.472 -3.734 2.616 895 HA ALA 109 HA ALA 109 7.303 -5.954 1.145 896 HB1 ALA 109 HB1 ALA 109 6.001 -3.245 1.335 897 HB2 ALA 109 HB2 ALA 109 5.315 -4.805 1.787 898 HB3 ALA 109 HB3 ALA 109 5.616 -4.433 0.090 899 H LYS 110 HN LYS 110 7.188 -5.369 -1.263 900 HA LYS 110 HA LYS 110 9.314 -3.489 -2.011 901 HB2 LYS 110 HB2 LYS 110 10.064 -5.222 -3.720 902 HB3 LYS 110 HB1 LYS 110 10.486 -5.534 -2.044 903 HG2 LYS 110 HG2 LYS 110 8.295 -6.923 -2.019 904 HG3 LYS 110 HG1 LYS 110 8.478 -6.902 -3.774 905 HD2 LYS 110 HD2 LYS 110 10.610 -7.965 -3.638 906 HD3 LYS 110 HD1 LYS 110 10.652 -7.781 -1.883 907 HE2 LYS 110 HE2 LYS 110 9.532 -9.681 -1.587 908 HE3 LYS 110 HE1 LYS 110 8.273 -9.181 -2.716 909 HZ1 LYS 110 HZ1 LYS 110 9.620 -9.972 -4.541 910 HZ2 LYS 110 HZ2 LYS 110 9.383 -11.219 -3.423 911 HZ3 LYS 110 HZ3 LYS 110 10.866 -10.409 -3.482 912 H VAL 111 HN VAL 111 9.305 -2.981 -4.358 913 HA VAL 111 HA VAL 111 6.623 -2.454 -5.219 914 HB VAL 111 HB VAL 111 9.315 -1.833 -6.424 915 HG11 VAL 111 HG11 VAL 111 7.971 -2.104 -8.336 916 HG12 VAL 111 HG12 VAL 111 7.980 -0.371 -8.012 917 HG13 VAL 111 HG13 VAL 111 6.578 -1.343 -7.565 918 HG21 VAL 111 HG21 VAL 111 8.666 0.478 -5.924 919 HG22 VAL 111 HG22 VAL 111 8.685 -0.527 -4.475 920 HG23 VAL 111 HG23 VAL 111 7.151 -0.103 -5.233 921 H ALA 112 HN ALA 112 5.444 -4.022 -6.110 922 HA ALA 112 HA ALA 112 6.563 -5.500 -8.368 923 HB1 ALA 112 HB1 ALA 112 4.935 -7.163 -6.567 924 HB2 ALA 112 HB2 ALA 112 6.532 -6.723 -5.963 925 HB3 ALA 112 HB3 ALA 112 6.374 -7.570 -7.501 926 H TYR 113 HN TYR 113 5.050 -6.163 -9.887 927 HA TYR 113 HA TYR 113 3.144 -6.041 -11.119 928 HB2 TYR 113 HB2 TYR 113 1.861 -6.125 -8.382 929 HB3 TYR 113 HB1 TYR 113 0.988 -6.294 -9.899 930 HD1 TYR 113 HD2 TYR 113 4.000 -7.784 -8.273 931 HD2 TYR 113 HD1 TYR 113 0.448 -8.443 -10.513 932 HE1 TYR 113 HE2 TYR 113 4.439 -10.205 -8.242 933 HE2 TYR 113 HE1 TYR 113 0.872 -10.865 -10.490 934 HH TYR 113 HH TYR 113 3.807 -12.210 -9.676 935 H VAL 114 HN VAL 114 3.370 -4.062 -12.060 936 HA VAL 114 HA VAL 114 1.490 -2.048 -11.321 937 HB VAL 114 HB VAL 114 3.260 -1.479 -9.716 938 HG11 VAL 114 HG11 VAL 114 5.084 -0.737 -11.962 939 HG12 VAL 114 HG12 VAL 114 5.075 -2.387 -11.341 940 HG13 VAL 114 HG13 VAL 114 5.459 -1.043 -10.266 941 HG21 VAL 114 HG21 VAL 114 3.719 0.896 -10.685 942 HG22 VAL 114 HG22 VAL 114 2.068 0.410 -10.302 943 HG23 VAL 114 HG23 VAL 114 2.631 0.378 -11.972 944 H TYR 115 HN TYR 115 0.697 -1.872 -13.340 945 HA TYR 115 HA TYR 115 2.602 -1.177 -15.473 946 HB2 TYR 115 HB2 TYR 115 0.217 -3.011 -15.581 947 HB3 TYR 115 HB1 TYR 115 0.924 -2.306 -17.029 948 HD1 TYR 115 HD2 TYR 115 3.262 -2.880 -17.665 949 HD2 TYR 115 HD1 TYR 115 1.254 -4.835 -14.462 950 HE1 TYR 115 HE2 TYR 115 4.924 -4.694 -17.734 951 HE2 TYR 115 HE1 TYR 115 2.910 -6.649 -14.518 952 HH TYR 115 HH TYR 115 4.514 -7.636 -16.000 953 H LYS 116 HN LYS 116 1.737 0.092 -17.209 954 HA LYS 116 HA LYS 116 0.198 2.295 -16.299 955 HB2 LYS 116 HB2 LYS 116 0.395 3.064 -18.663 956 HB3 LYS 116 HB1 LYS 116 1.936 2.630 -17.935 957 HG2 LYS 116 HG2 LYS 116 0.661 0.393 -19.278 958 HG3 LYS 116 HG1 LYS 116 0.976 1.754 -20.360 959 HD2 LYS 116 HD2 LYS 116 3.327 1.777 -19.544 960 HD3 LYS 116 HD1 LYS 116 2.978 0.325 -18.609 961 HE2 LYS 116 HE2 LYS 116 2.210 0.151 -21.429 962 HE3 LYS 116 HE1 LYS 116 3.940 0.366 -21.166 963 HZ1 LYS 116 HZ1 LYS 116 2.228 -1.783 -20.042 964 HZ2 LYS 116 HZ2 LYS 116 3.848 -1.540 -19.620 965 HZ3 LYS 116 HZ3 LYS 116 3.443 -1.956 -21.208 966 HA PRO 117 HA PRO 117 -0.995 3.970 -17.668 967 HB2 PRO 117 HB2 PRO 117 -3.678 4.617 -16.714 968 HB3 PRO 117 HB1 PRO 117 -2.845 5.181 -18.164 969 HG2 PRO 117 HG2 PRO 117 -4.958 3.497 -18.264 970 HG3 PRO 117 HG1 PRO 117 -3.647 3.460 -19.457 971 HD2 PRO 117 HD2 PRO 117 -4.104 1.678 -17.089 972 HD3 PRO 117 HD1 PRO 117 -3.586 1.253 -18.736 973 H ASN 118 HN ASN 118 -2.029 1.771 -15.360 974 HA ASN 118 HA ASN 118 -2.286 3.372 -13.061 975 HB2 ASN 118 HB2 ASN 118 -1.111 0.622 -12.881 976 HB3 ASN 118 HB1 ASN 118 -2.276 1.408 -11.826 977 HD21 ASN 118 HD21 ASN 118 -1.840 -0.171 -14.933 978 HD22 ASN 118 HD22 ASN 118 -3.497 -0.615 -15.146 979 H ASN 119 HN ASN 119 -0.785 4.762 -12.416 980 HA ASN 119 HA ASN 119 1.732 3.920 -11.485 981 HB2 ASN 119 HB2 ASN 119 3.020 5.461 -13.183 982 HB3 ASN 119 HB1 ASN 119 2.666 3.786 -13.595 983 HD21 ASN 119 HD21 ASN 119 2.065 3.584 -15.618 984 HD22 ASN 119 HD22 ASN 119 1.087 4.694 -16.511 985 H THR 120 HN THR 120 -0.490 5.468 -10.592 986 HA THR 120 HA THR 120 -0.196 8.214 -10.644 987 HB THR 120 HB THR 120 -0.951 6.735 -8.132 988 HG1 THR 120 HG1 THR 120 -2.171 5.680 -9.566 989 HG21 THR 120 HG21 THR 120 -2.826 8.578 -8.387 990 HG22 THR 120 HG22 THR 120 -1.543 9.397 -9.279 991 HG23 THR 120 HG23 THR 120 -1.282 8.912 -7.603 992 H HIS 121 HN HIS 121 1.293 5.904 -8.388 993 HA HIS 121 HA HIS 121 3.268 7.985 -7.714 994 HB2 HIS 121 HB2 HIS 121 1.892 5.979 -5.949 995 HB3 HIS 121 HB1 HIS 121 3.461 6.640 -5.504 996 HD1 HIS 121 HD1 HIS 121 -0.127 7.390 -5.469 997 HD2 HIS 121 HD2 HIS 121 3.431 9.500 -5.082 998 HE1 HIS 121 HE1 HIS 121 -0.767 9.609 -4.475 999 HE2 HIS 121 HE2 HIS 121 1.412 10.840 -4.176 1000 H GLU 122 HN GLU 122 3.263 5.811 -9.772 1001 HA GLU 122 HA GLU 122 4.914 3.684 -9.039 1002 HB2 GLU 122 HB2 GLU 122 3.716 3.760 -11.173 1003 HB3 GLU 122 HB1 GLU 122 4.720 5.100 -11.706 1004 HG2 GLU 122 HG2 GLU 122 6.496 3.772 -12.164 1005 HG3 GLU 122 HG1 GLU 122 6.111 2.626 -10.880 1006 H GLN 123 HN GLN 123 5.727 6.921 -10.208 1007 HA GLN 123 HA GLN 123 8.533 6.503 -10.287 1008 HB2 GLN 123 HB2 GLN 123 7.069 9.128 -9.963 1009 HB3 GLN 123 HB1 GLN 123 8.709 8.900 -10.557 1010 HG2 GLN 123 HG2 GLN 123 6.671 7.429 -12.054 1011 HG3 GLN 123 HG1 GLN 123 6.500 9.183 -12.114 1012 HE21 GLN 123 HE21 GLN 123 9.263 6.953 -12.085 1013 HE22 GLN 123 HE22 GLN 123 10.020 7.601 -13.496 1014 H LEU 124 HN LEU 124 6.302 7.225 -7.749 1015 HA LEU 124 HA LEU 124 8.194 8.354 -5.927 1016 HB2 LEU 124 HB2 LEU 124 5.829 8.835 -5.702 1017 HB3 LEU 124 HB1 LEU 124 5.470 7.132 -5.489 1018 HG LEU 124 HG LEU 124 7.146 7.446 -3.427 1019 HD11 LEU 124 HD11 LEU 124 5.739 10.016 -3.136 1020 HD12 LEU 124 HD12 LEU 124 7.089 10.002 -4.271 1021 HD13 LEU 124 HD13 LEU 124 7.343 9.527 -2.591 1022 HD21 LEU 124 HD21 LEU 124 4.221 7.710 -3.756 1023 HD22 LEU 124 HD22 LEU 124 4.890 8.214 -2.204 1024 HD23 LEU 124 HD23 LEU 124 5.159 6.573 -2.789 1025 H LEU 125 HN LEU 125 6.647 5.159 -6.193 1026 HA LEU 125 HA LEU 125 8.290 4.043 -4.111 1027 HB2 LEU 125 HB2 LEU 125 6.316 2.841 -6.043 1028 HB3 LEU 125 HB1 LEU 125 7.215 1.879 -4.884 1029 HG LEU 125 HG LEU 125 6.201 3.527 -3.128 1030 HD11 LEU 125 HD11 LEU 125 4.223 3.782 -5.387 1031 HD12 LEU 125 HD12 LEU 125 5.255 5.073 -4.770 1032 HD13 LEU 125 HD13 LEU 125 4.008 4.371 -3.739 1033 HD21 LEU 125 HD21 LEU 125 5.719 1.026 -3.634 1034 HD22 LEU 125 HD22 LEU 125 4.225 1.642 -4.338 1035 HD23 LEU 125 HD23 LEU 125 4.591 1.947 -2.640 1036 H ARG 126 HN ARG 126 8.463 4.327 -7.561 1037 HA ARG 126 HA ARG 126 10.100 2.192 -8.235 1038 HB2 ARG 126 HB2 ARG 126 9.489 4.833 -9.373 1039 HB3 ARG 126 HB1 ARG 126 11.054 4.189 -9.846 1040 HG2 ARG 126 HG2 ARG 126 9.295 2.052 -10.131 1041 HG3 ARG 126 HG1 ARG 126 8.414 3.454 -10.740 1042 HD2 ARG 126 HD2 ARG 126 10.609 3.972 -12.015 1043 HD3 ARG 126 HD1 ARG 126 11.002 2.285 -11.693 1044 HE ARG 126 HE ARG 126 9.453 1.657 -13.256 1045 HH11 ARG 126 HH11 ARG 126 8.950 5.014 -12.444 1046 HH12 ARG 126 HH12 ARG 126 7.789 5.275 -13.702 1047 HH21 ARG 126 HH21 ARG 126 7.929 2.000 -14.916 1048 HH22 ARG 126 HH22 ARG 126 7.210 3.564 -15.106 1049 H LYS 127 HN LYS 127 10.942 5.323 -6.850 1050 HA LYS 127 HA LYS 127 13.776 4.799 -6.938 1051 HB2 LYS 127 HB2 LYS 127 12.504 6.932 -5.248 1052 HB3 LYS 127 HB1 LYS 127 14.077 6.939 -6.034 1053 HG2 LYS 127 HG2 LYS 127 11.450 7.042 -7.493 1054 HG3 LYS 127 HG1 LYS 127 12.419 8.455 -7.075 1055 HD2 LYS 127 HD2 LYS 127 13.858 8.101 -8.757 1056 HD3 LYS 127 HD1 LYS 127 13.943 6.369 -8.434 1057 HE2 LYS 127 HE2 LYS 127 11.371 6.874 -9.469 1058 HE3 LYS 127 HE1 LYS 127 12.507 7.761 -10.485 1059 HZ1 LYS 127 HZ1 LYS 127 12.018 5.385 -11.132 1060 HZ2 LYS 127 HZ2 LYS 127 12.921 4.917 -9.780 1061 HZ3 LYS 127 HZ3 LYS 127 13.654 5.806 -11.018 1062 H SER 128 HN SER 128 11.281 4.975 -4.419 1063 HA SER 128 HA SER 128 12.828 4.492 -2.183 1064 HB2 SER 128 HB2 SER 128 10.635 5.026 -1.680 1065 HB3 SER 128 HB1 SER 128 9.979 3.941 -2.905 1066 HG SER 128 HG SER 128 9.619 3.069 -0.864 1067 H GLU 129 HN GLU 129 11.489 2.177 -4.496 1068 HA GLU 129 HA GLU 129 12.206 -0.155 -3.068 1069 HB2 GLU 129 HB2 GLU 129 10.561 -0.230 -4.867 1070 HB3 GLU 129 HB1 GLU 129 11.779 0.271 -6.032 1071 HG2 GLU 129 HG2 GLU 129 12.477 -2.136 -4.525 1072 HG3 GLU 129 HG1 GLU 129 11.042 -2.296 -5.538 1073 H ALA 130 HN ALA 130 13.734 1.298 -5.943 1074 HA ALA 130 HA ALA 130 16.018 -0.321 -5.925 1075 HB1 ALA 130 HB1 ALA 130 16.411 2.392 -6.964 1076 HB2 ALA 130 HB2 ALA 130 15.004 1.548 -7.612 1077 HB3 ALA 130 HB3 ALA 130 16.607 0.828 -7.757 1078 H GLN 131 HN GLN 131 15.368 2.756 -4.321 1079 HA GLN 131 HA GLN 131 18.020 3.291 -3.526 1080 HB2 GLN 131 HB2 GLN 131 15.354 4.343 -2.904 1081 HB3 GLN 131 HB1 GLN 131 16.487 4.463 -1.568 1082 HG2 GLN 131 HG2 GLN 131 17.237 6.325 -2.494 1083 HG3 GLN 131 HG1 GLN 131 17.932 5.326 -3.770 1084 HE21 GLN 131 HE21 GLN 131 15.935 7.877 -3.130 1085 HE22 GLN 131 HE22 GLN 131 15.060 7.930 -4.617 1086 H ALA 132 HN ALA 132 15.307 1.947 -1.641 1087 HA ALA 132 HA ALA 132 16.896 1.306 0.610 1088 HB1 ALA 132 HB1 ALA 132 14.444 1.623 0.678 1089 HB2 ALA 132 HB2 ALA 132 14.967 0.117 1.431 1090 HB3 ALA 132 HB3 ALA 132 14.251 0.096 -0.180 1091 H LYS 133 HN LYS 133 15.911 -0.534 -2.235 1092 HA LYS 133 HA LYS 133 16.625 -3.087 -1.493 1093 HB2 LYS 133 HB2 LYS 133 16.489 -1.616 -4.076 1094 HB3 LYS 133 HB1 LYS 133 17.318 -3.165 -4.076 1095 HG2 LYS 133 HG2 LYS 133 14.447 -2.611 -3.381 1096 HG3 LYS 133 HG1 LYS 133 15.078 -3.566 -4.722 1097 HD2 LYS 133 HD2 LYS 133 15.349 -4.240 -1.801 1098 HD3 LYS 133 HD1 LYS 133 14.202 -4.977 -2.917 1099 HE2 LYS 133 HE2 LYS 133 17.154 -5.023 -3.448 1100 HE3 LYS 133 HE1 LYS 133 16.390 -6.230 -2.415 1101 HZ1 LYS 133 HZ1 LYS 133 15.205 -7.105 -4.166 1102 HZ2 LYS 133 HZ2 LYS 133 16.660 -6.697 -4.923 1103 HZ3 LYS 133 HZ3 LYS 133 15.307 -5.698 -5.100 1104 H LYS 134 HN LYS 134 18.698 -0.590 -2.926 1105 HA LYS 134 HA LYS 134 21.020 -2.180 -3.059 1106 HB2 LYS 134 HB2 LYS 134 20.891 -0.252 -4.441 1107 HB3 LYS 134 HB1 LYS 134 20.591 0.801 -3.066 1108 HG2 LYS 134 HG2 LYS 134 22.842 0.514 -2.284 1109 HG3 LYS 134 HG1 LYS 134 23.164 -0.690 -3.534 1110 HD2 LYS 134 HD2 LYS 134 22.178 1.900 -4.518 1111 HD3 LYS 134 HD1 LYS 134 23.765 1.947 -3.751 1112 HE2 LYS 134 HE2 LYS 134 24.745 0.763 -5.403 1113 HE3 LYS 134 HE1 LYS 134 23.334 -0.268 -5.641 1114 HZ1 LYS 134 HZ1 LYS 134 22.326 1.314 -7.008 1115 HZ2 LYS 134 HZ2 LYS 134 23.943 1.318 -7.503 1116 HZ3 LYS 134 HZ3 LYS 134 23.360 2.558 -6.512 1117 H GLU 135 HN GLU 135 19.678 -0.220 -0.477 1118 HA GLU 135 HA GLU 135 22.115 -0.615 1.102 1119 HB2 GLU 135 HB2 GLU 135 20.422 0.859 2.702 1120 HB3 GLU 135 HB1 GLU 135 21.696 1.507 1.675 1121 HG2 GLU 135 HG2 GLU 135 20.154 2.010 -0.060 1122 HG3 GLU 135 HG1 GLU 135 18.867 1.110 0.740 1123 H LYS 136 HN LYS 136 19.055 -2.024 0.723 1124 HA LYS 136 HA LYS 136 17.775 -3.417 2.018 1125 HB2 LYS 136 HB2 LYS 136 20.490 -4.247 3.064 1126 HB3 LYS 136 HB1 LYS 136 19.020 -5.213 3.086 1127 HG2 LYS 136 HG2 LYS 136 19.022 -5.108 0.585 1128 HG3 LYS 136 HG1 LYS 136 20.618 -4.364 0.686 1129 HD2 LYS 136 HD2 LYS 136 21.230 -6.555 0.458 1130 HD3 LYS 136 HD1 LYS 136 21.104 -6.467 2.217 1131 HE2 LYS 136 HE2 LYS 136 19.172 -7.690 2.278 1132 HE3 LYS 136 HE1 LYS 136 18.666 -7.172 0.670 1133 HZ1 LYS 136 HZ1 LYS 136 20.379 -9.393 1.453 1134 HZ2 LYS 136 HZ2 LYS 136 20.819 -8.570 0.042 1135 HZ3 LYS 136 HZ3 LYS 136 19.284 -9.268 0.167 1136 H LEU 137 HN LEU 137 17.193 -1.309 3.118 1137 HA LEU 137 HA LEU 137 18.203 -0.358 5.461 1138 HB2 LEU 137 HB2 LEU 137 15.503 -0.378 4.234 1139 HB3 LEU 137 HB1 LEU 137 15.586 0.051 5.935 1140 HG LEU 137 HG LEU 137 16.982 1.442 3.650 1141 HD11 LEU 137 HD11 LEU 137 15.567 3.355 4.762 1142 HD12 LEU 137 HD12 LEU 137 14.572 2.004 5.303 1143 HD13 LEU 137 HD13 LEU 137 14.849 2.262 3.580 1144 HD21 LEU 137 HD21 LEU 137 18.533 1.746 5.303 1145 HD22 LEU 137 HD22 LEU 137 17.344 1.610 6.599 1146 HD23 LEU 137 HD23 LEU 137 17.444 3.091 5.646 1147 H ASN 138 HN ASN 138 15.076 -1.830 6.064 1148 HA ASN 138 HA ASN 138 16.356 -3.464 8.149 1149 HB2 ASN 138 HB2 ASN 138 14.468 -3.170 9.540 1150 HB3 ASN 138 HB1 ASN 138 14.798 -1.577 8.870 1151 HD21 ASN 138 HD21 ASN 138 13.011 -0.537 8.408 1152 HD22 ASN 138 HD22 ASN 138 11.564 -1.224 7.759 1153 H ILE 139 HN ILE 139 15.766 -5.571 8.426 1154 HA ILE 139 HA ILE 139 15.416 -7.661 7.547 1155 HB ILE 139 HB ILE 139 13.110 -8.309 7.618 1156 HG12 ILE 139 HG12 ILE 139 11.735 -5.876 8.122 1157 HG13 ILE 139 HG11 ILE 139 12.643 -5.658 6.631 1158 HG21 ILE 139 HG21 ILE 139 12.468 -7.388 9.804 1159 HG22 ILE 139 HG22 ILE 139 13.702 -6.141 9.626 1160 HG23 ILE 139 HG23 ILE 139 14.172 -7.837 9.741 1161 HD11 ILE 139 HD11 ILE 139 11.036 -8.132 6.976 1162 HD12 ILE 139 HD12 ILE 139 11.451 -7.247 5.507 1163 HD13 ILE 139 HD13 ILE 139 10.217 -6.616 6.599 1164 H TRP 140 HN TRP 140 16.153 -5.850 5.396 1165 HA TRP 140 HA TRP 140 14.418 -6.434 3.173 1166 HB2 TRP 140 HB2 TRP 140 17.073 -5.053 3.456 1167 HB3 TRP 140 HB1 TRP 140 16.472 -5.508 1.863 1168 HD1 TRP 140 HD1 TRP 140 15.596 -3.284 4.847 1169 HE1 TRP 140 HE1 TRP 140 14.048 -1.396 4.044 1170 HE3 TRP 140 HE3 TRP 140 14.867 -4.837 0.044 1171 HZ2 TRP 140 HZ2 TRP 140 12.718 -0.656 1.691 1172 HZ3 TRP 140 HZ3 TRP 140 13.432 -3.480 -1.426 1173 HH2 TRP 140 HH2 TRP 140 12.377 -1.431 -0.618 Start of MODEL 12 1 H1 ALA 1 HT1 ALA 1 -3.273 14.890 1.803 2 H2 ALA 1 HT2 ALA 1 -4.157 14.827 3.271 3 H3 ALA 1 HT3 ALA 1 -2.553 15.438 3.259 4 HA ALA 1 HA ALA 1 -3.132 17.347 2.201 5 HB1 ALA 1 HB1 ALA 1 -5.441 15.737 1.267 6 HB2 ALA 1 HB2 ALA 1 -4.396 16.845 0.377 7 HB3 ALA 1 HB3 ALA 1 -5.665 17.479 1.426 8 H THR 2 HN THR 2 -3.007 18.350 4.144 9 HA THR 2 HA THR 2 -5.487 18.469 5.729 10 HB THR 2 HB THR 2 -4.189 18.592 7.763 11 HG1 THR 2 HG1 THR 2 -1.905 18.376 7.658 12 HG21 THR 2 HG21 THR 2 -4.359 16.298 6.266 13 HG22 THR 2 HG22 THR 2 -3.879 16.405 7.960 14 HG23 THR 2 HG23 THR 2 -2.650 16.379 6.694 15 H SER 3 HN SER 3 -2.479 20.140 4.870 16 HA SER 3 HA SER 3 -3.780 22.697 5.521 17 HB2 SER 3 HB2 SER 3 -1.275 23.488 5.223 18 HB3 SER 3 HB1 SER 3 -1.810 22.742 6.728 19 HG SER 3 HG SER 3 0.127 21.807 5.971 20 H THR 4 HN THR 4 -2.222 20.858 2.992 21 HA THR 4 HA THR 4 -3.214 22.774 1.029 22 HB THR 4 HB THR 4 -0.988 23.571 1.277 23 HG1 THR 4 HG1 THR 4 -1.554 23.324 -0.884 24 HG21 THR 4 HG21 THR 4 0.348 21.018 0.643 25 HG22 THR 4 HG22 THR 4 -0.260 21.220 2.287 26 HG23 THR 4 HG23 THR 4 0.893 22.379 1.624 27 H LYS 5 HN LYS 5 -4.644 21.402 0.109 28 HA LYS 5 HA LYS 5 -4.020 18.650 -0.414 29 HB2 LYS 5 HB2 LYS 5 -6.232 18.711 -1.647 30 HB3 LYS 5 HB1 LYS 5 -6.295 19.121 0.062 31 HG2 LYS 5 HG2 LYS 5 -5.901 21.436 -1.665 32 HG3 LYS 5 HG1 LYS 5 -7.406 20.569 -1.978 33 HD2 LYS 5 HD2 LYS 5 -7.591 20.623 0.649 34 HD3 LYS 5 HD1 LYS 5 -6.508 22.005 0.476 35 HE2 LYS 5 HE2 LYS 5 -8.899 21.884 -1.281 36 HE3 LYS 5 HE1 LYS 5 -9.150 22.261 0.422 37 HZ1 LYS 5 HZ1 LYS 5 -7.659 23.785 -1.610 38 HZ2 LYS 5 HZ2 LYS 5 -7.282 23.969 0.029 39 HZ3 LYS 5 HZ3 LYS 5 -8.840 24.325 -0.525 40 H LYS 6 HN LYS 6 -2.968 17.874 -2.113 41 HA LYS 6 HA LYS 6 -2.370 19.627 -4.353 42 HB2 LYS 6 HB2 LYS 6 -0.703 18.069 -3.121 43 HB3 LYS 6 HB1 LYS 6 -1.422 16.791 -4.089 44 HG2 LYS 6 HG2 LYS 6 -0.355 17.432 -5.946 45 HG3 LYS 6 HG1 LYS 6 -0.641 19.145 -5.635 46 HD2 LYS 6 HD2 LYS 6 1.446 17.468 -4.241 47 HD3 LYS 6 HD1 LYS 6 1.762 18.530 -5.615 48 HE2 LYS 6 HE2 LYS 6 2.196 20.086 -4.064 49 HE3 LYS 6 HE1 LYS 6 0.444 20.198 -3.904 50 HZ1 LYS 6 HZ1 LYS 6 0.469 19.164 -1.921 51 HZ2 LYS 6 HZ2 LYS 6 2.067 19.715 -1.863 52 HZ3 LYS 6 HZ3 LYS 6 1.738 18.124 -2.335 53 H LEU 7 HN LEU 7 -3.521 19.629 -6.154 54 HA LEU 7 HA LEU 7 -4.912 19.011 -7.837 55 HB2 LEU 7 HB2 LEU 7 -3.486 16.527 -7.129 56 HB3 LEU 7 HB1 LEU 7 -4.974 16.307 -8.031 57 HG LEU 7 HG LEU 7 -4.074 17.890 -9.758 58 HD11 LEU 7 HD11 LEU 7 -2.433 19.159 -8.756 59 HD12 LEU 7 HD12 LEU 7 -1.476 17.976 -9.647 60 HD13 LEU 7 HD13 LEU 7 -1.731 17.779 -7.912 61 HD21 LEU 7 HD21 LEU 7 -2.279 16.192 -10.531 62 HD22 LEU 7 HD22 LEU 7 -3.956 15.664 -10.387 63 HD23 LEU 7 HD23 LEU 7 -2.792 15.263 -9.123 64 H HIS 8 HN HIS 8 -5.488 16.064 -5.963 65 HA HIS 8 HA HIS 8 -7.716 16.849 -4.512 66 HB2 HIS 8 HB2 HIS 8 -9.529 15.830 -5.978 67 HB3 HIS 8 HB1 HIS 8 -8.904 17.394 -6.491 68 HD1 HIS 8 HD1 HIS 8 -7.653 17.494 -8.721 69 HD2 HIS 8 HD2 HIS 8 -8.833 13.657 -7.647 70 HE1 HIS 8 HE1 HIS 8 -7.297 16.082 -10.771 71 HE2 HIS 8 HE2 HIS 8 -7.940 13.748 -10.071 72 H LYS 9 HN LYS 9 -7.556 15.353 -2.983 73 HA LYS 9 HA LYS 9 -7.218 12.541 -3.798 74 HB2 LYS 9 HB2 LYS 9 -6.250 13.957 -1.311 75 HB3 LYS 9 HB1 LYS 9 -6.206 12.212 -1.521 76 HG2 LYS 9 HG2 LYS 9 -4.081 12.764 -2.140 77 HG3 LYS 9 HG1 LYS 9 -4.893 12.821 -3.706 78 HD2 LYS 9 HD2 LYS 9 -3.768 14.816 -3.758 79 HD3 LYS 9 HD1 LYS 9 -5.290 15.336 -3.033 80 HE2 LYS 9 HE2 LYS 9 -3.943 16.255 -1.481 81 HE3 LYS 9 HE1 LYS 9 -3.917 14.619 -0.824 82 HZ1 LYS 9 HZ1 LYS 9 -1.835 16.080 -2.258 83 HZ2 LYS 9 HZ2 LYS 9 -1.933 14.413 -2.530 84 HZ3 LYS 9 HZ3 LYS 9 -1.702 15.001 -0.962 85 H GLU 10 HN GLU 10 -8.171 10.948 -2.291 86 HA GLU 10 HA GLU 10 -10.636 11.992 -1.060 87 HB2 GLU 10 HB2 GLU 10 -10.162 9.542 -2.727 88 HB3 GLU 10 HB1 GLU 10 -11.492 9.591 -1.580 89 HG2 GLU 10 HG2 GLU 10 -12.728 10.897 -2.894 90 HG3 GLU 10 HG1 GLU 10 -11.366 11.945 -3.290 91 HA PRO 11 HA PRO 11 -8.983 9.959 2.552 92 HB2 PRO 11 HB2 PRO 11 -10.824 10.741 4.313 93 HB3 PRO 11 HB1 PRO 11 -9.712 11.906 3.584 94 HG2 PRO 11 HG2 PRO 11 -12.574 11.356 2.935 95 HG3 PRO 11 HG1 PRO 11 -11.716 12.904 2.998 96 HD2 PRO 11 HD2 PRO 11 -12.262 11.457 0.684 97 HD3 PRO 11 HD1 PRO 11 -11.031 12.726 0.835 98 H ALA 12 HN ALA 12 -9.696 8.397 4.213 99 HA ALA 12 HA ALA 12 -12.152 6.992 3.902 100 HB1 ALA 12 HB1 ALA 12 -10.347 6.244 2.048 101 HB2 ALA 12 HB2 ALA 12 -11.569 5.164 2.717 102 HB3 ALA 12 HB3 ALA 12 -9.926 5.142 3.360 103 H THR 13 HN THR 13 -12.159 4.967 5.303 104 HA THR 13 HA THR 13 -10.320 5.281 7.581 105 HB THR 13 HB THR 13 -13.173 4.444 7.985 106 HG1 THR 13 HG1 THR 13 -13.416 6.402 6.988 107 HG21 THR 13 HG21 THR 13 -10.959 4.974 9.687 108 HG22 THR 13 HG22 THR 13 -12.584 4.431 10.108 109 HG23 THR 13 HG23 THR 13 -12.227 6.156 10.007 110 H LEU 14 HN LEU 14 -10.052 3.339 8.890 111 HA LEU 14 HA LEU 14 -9.993 0.977 7.213 112 HB2 LEU 14 HB2 LEU 14 -8.423 1.968 9.330 113 HB3 LEU 14 HB1 LEU 14 -9.159 0.490 9.927 114 HG LEU 14 HG LEU 14 -6.886 0.229 8.874 115 HD11 LEU 14 HD11 LEU 14 -9.323 -1.305 8.208 116 HD12 LEU 14 HD12 LEU 14 -7.852 -1.808 9.042 117 HD13 LEU 14 HD13 LEU 14 -7.868 -1.677 7.283 118 HD21 LEU 14 HD21 LEU 14 -7.747 1.833 6.926 119 HD22 LEU 14 HD22 LEU 14 -8.152 0.277 6.200 120 HD23 LEU 14 HD23 LEU 14 -6.490 0.621 6.676 121 H ILE 15 HN ILE 15 -11.816 -0.166 7.059 122 HA ILE 15 HA ILE 15 -13.776 -0.255 9.142 123 HB ILE 15 HB ILE 15 -13.536 -2.030 6.707 124 HG12 ILE 15 HG12 ILE 15 -13.640 0.384 6.148 125 HG13 ILE 15 HG11 ILE 15 -15.070 -0.492 5.613 126 HG21 ILE 15 HG21 ILE 15 -16.197 -1.459 7.753 127 HG22 ILE 15 HG22 ILE 15 -15.173 -2.335 8.892 128 HG23 ILE 15 HG23 ILE 15 -15.467 -2.995 7.283 129 HD11 ILE 15 HD11 ILE 15 -14.786 1.604 7.670 130 HD12 ILE 15 HD12 ILE 15 -15.953 0.321 7.989 131 HD13 ILE 15 HD13 ILE 15 -16.094 1.297 6.527 132 H LYS 16 HN LYS 16 -11.313 -2.456 7.882 133 HA LYS 16 HA LYS 16 -10.909 -3.676 10.400 134 HB2 LYS 16 HB2 LYS 16 -12.942 -4.849 8.707 135 HB3 LYS 16 HB1 LYS 16 -11.626 -5.984 8.968 136 HG2 LYS 16 HG2 LYS 16 -12.511 -4.611 11.392 137 HG3 LYS 16 HG1 LYS 16 -13.745 -5.621 10.636 138 HD2 LYS 16 HD2 LYS 16 -11.042 -6.794 10.882 139 HD3 LYS 16 HD1 LYS 16 -11.940 -6.563 12.382 140 HE2 LYS 16 HE2 LYS 16 -12.439 -8.753 11.602 141 HE3 LYS 16 HE1 LYS 16 -13.863 -7.758 11.299 142 HZ1 LYS 16 HZ1 LYS 16 -12.826 -9.339 9.469 143 HZ2 LYS 16 HZ2 LYS 16 -11.901 -7.959 9.150 144 HZ3 LYS 16 HZ3 LYS 16 -13.589 -7.882 9.070 145 H ALA 17 HN ALA 17 -8.889 -4.432 10.462 146 HA ALA 17 HA ALA 17 -7.306 -4.379 8.078 147 HB1 ALA 17 HB1 ALA 17 -5.955 -3.636 9.715 148 HB2 ALA 17 HB2 ALA 17 -5.620 -5.351 9.955 149 HB3 ALA 17 HB3 ALA 17 -6.811 -4.534 10.969 150 H ILE 18 HN ILE 18 -6.813 -6.037 6.791 151 HA ILE 18 HA ILE 18 -7.721 -8.707 7.510 152 HB ILE 18 HB ILE 18 -6.295 -8.108 4.947 153 HG12 ILE 18 HG12 ILE 18 -8.327 -6.464 5.683 154 HG13 ILE 18 HG11 ILE 18 -7.955 -6.882 4.019 155 HG21 ILE 18 HG21 ILE 18 -6.798 -10.376 5.212 156 HG22 ILE 18 HG22 ILE 18 -8.050 -9.757 4.135 157 HG23 ILE 18 HG23 ILE 18 -8.412 -10.035 5.839 158 HD11 ILE 18 HD11 ILE 18 -9.735 -8.364 3.870 159 HD12 ILE 18 HD12 ILE 18 -10.386 -7.033 4.827 160 HD13 ILE 18 HD13 ILE 18 -9.876 -8.523 5.620 161 H ASP 19 HN ASP 19 -4.771 -7.594 5.863 162 HA ASP 19 HA ASP 19 -3.113 -8.942 7.828 163 HB2 ASP 19 HB2 ASP 19 -3.615 -10.794 6.362 164 HB3 ASP 19 HB1 ASP 19 -3.203 -9.840 4.941 165 H GLY 20 HN GLY 20 -1.823 -8.510 4.636 166 HA2 GLY 20 HA2 GLY 20 -0.488 -6.045 5.567 167 HA3 GLY 20 HA1 GLY 20 0.291 -7.254 4.555 168 H ASP 21 HN ASP 21 -0.414 -7.491 2.365 169 HA ASP 21 HA ASP 21 -0.909 -5.039 1.068 170 HB2 ASP 21 HB2 ASP 21 -0.606 -7.876 0.241 171 HB3 ASP 21 HB1 ASP 21 -1.435 -6.805 -0.886 172 H THR 22 HN THR 22 -3.025 -7.186 2.615 173 HA THR 22 HA THR 22 -5.310 -6.131 1.085 174 HB THR 22 HB THR 22 -6.284 -8.265 2.554 175 HG1 THR 22 HG1 THR 22 -3.753 -8.974 1.494 176 HG21 THR 22 HG21 THR 22 -5.225 -8.852 -0.149 177 HG22 THR 22 HG22 THR 22 -6.445 -7.588 0.015 178 HG23 THR 22 HG23 THR 22 -6.794 -9.227 0.565 179 H VAL 23 HN VAL 23 -6.705 -4.858 2.122 180 HA VAL 23 HA VAL 23 -7.127 -5.073 4.974 181 HB VAL 23 HB VAL 23 -6.653 -2.671 5.401 182 HG11 VAL 23 HG11 VAL 23 -4.130 -3.947 4.419 183 HG12 VAL 23 HG12 VAL 23 -5.025 -4.647 5.767 184 HG13 VAL 23 HG13 VAL 23 -4.407 -3.000 5.880 185 HG21 VAL 23 HG21 VAL 23 -4.956 -1.690 3.689 186 HG22 VAL 23 HG22 VAL 23 -6.686 -1.577 3.367 187 HG23 VAL 23 HG23 VAL 23 -5.718 -2.816 2.566 188 H LYS 24 HN LYS 24 -9.080 -4.202 5.636 189 HA LYS 24 HA LYS 24 -10.911 -3.500 3.490 190 HB2 LYS 24 HB2 LYS 24 -11.492 -5.139 5.328 191 HB3 LYS 24 HB1 LYS 24 -11.537 -3.771 6.431 192 HG2 LYS 24 HG2 LYS 24 -13.766 -4.172 5.812 193 HG3 LYS 24 HG1 LYS 24 -13.262 -2.749 4.896 194 HD2 LYS 24 HD2 LYS 24 -14.521 -4.278 3.484 195 HD3 LYS 24 HD1 LYS 24 -12.846 -4.164 2.939 196 HE2 LYS 24 HE2 LYS 24 -12.408 -6.320 3.425 197 HE3 LYS 24 HE1 LYS 24 -13.379 -6.291 4.896 198 HZ1 LYS 24 HZ1 LYS 24 -15.254 -6.892 3.785 199 HZ2 LYS 24 HZ2 LYS 24 -14.113 -7.667 2.806 200 HZ3 LYS 24 HZ3 LYS 24 -14.772 -6.186 2.325 201 H LEU 25 HN LEU 25 -11.642 -1.491 3.079 202 HA LEU 25 HA LEU 25 -11.146 0.593 5.085 203 HB2 LEU 25 HB2 LEU 25 -10.244 0.467 2.278 204 HB3 LEU 25 HB1 LEU 25 -10.826 2.020 2.841 205 HG LEU 25 HG LEU 25 -8.710 0.488 4.329 206 HD11 LEU 25 HD11 LEU 25 -8.254 1.105 1.804 207 HD12 LEU 25 HD12 LEU 25 -7.022 1.319 3.047 208 HD13 LEU 25 HD13 LEU 25 -7.969 2.701 2.497 209 HD21 LEU 25 HD21 LEU 25 -9.323 2.150 5.743 210 HD22 LEU 25 HD22 LEU 25 -9.917 3.187 4.445 211 HD23 LEU 25 HD23 LEU 25 -8.184 3.064 4.754 212 H MET 26 HN MET 26 -12.489 2.490 4.892 213 HA MET 26 HA MET 26 -15.178 1.784 4.068 214 HB2 MET 26 HB2 MET 26 -14.436 2.976 6.267 215 HB3 MET 26 HB1 MET 26 -14.426 4.425 5.270 216 HG2 MET 26 HG2 MET 26 -16.686 4.458 5.044 217 HG3 MET 26 HG1 MET 26 -16.840 2.708 5.180 218 HE1 MET 26 HE1 MET 26 -18.808 2.960 8.329 219 HE2 MET 26 HE2 MET 26 -18.265 1.899 7.029 220 HE3 MET 26 HE3 MET 26 -19.068 3.423 6.647 221 H TYR 27 HN TYR 27 -15.880 2.209 2.103 222 HA TYR 27 HA TYR 27 -15.004 4.687 0.779 223 HB2 TYR 27 HB2 TYR 27 -13.914 2.702 -0.237 224 HB3 TYR 27 HB1 TYR 27 -15.504 2.030 -0.575 225 HD1 TYR 27 HD1 TYR 27 -14.305 5.528 -0.966 226 HD2 TYR 27 HD2 TYR 27 -15.639 1.985 -2.903 227 HE1 TYR 27 HE1 TYR 27 -14.347 6.726 -3.112 228 HE2 TYR 27 HE2 TYR 27 -15.684 3.172 -5.056 229 HH TYR 27 HH TYR 27 -14.169 6.038 -5.608 230 H LYS 28 HN LYS 28 -16.676 6.007 0.543 231 HA LYS 28 HA LYS 28 -18.771 6.802 0.186 232 HB2 LYS 28 HB2 LYS 28 -19.021 4.166 -1.260 233 HB3 LYS 28 HB1 LYS 28 -20.236 5.434 -1.312 234 HG2 LYS 28 HG2 LYS 28 -18.564 6.960 -2.285 235 HG3 LYS 28 HG1 LYS 28 -17.403 5.632 -2.302 236 HD2 LYS 28 HD2 LYS 28 -18.186 5.375 -4.412 237 HD3 LYS 28 HD1 LYS 28 -19.440 4.450 -3.583 238 HE2 LYS 28 HE2 LYS 28 -20.881 5.811 -4.620 239 HE3 LYS 28 HE1 LYS 28 -20.397 7.010 -3.420 240 HZ1 LYS 28 HZ1 LYS 28 -19.649 6.795 -6.241 241 HZ2 LYS 28 HZ2 LYS 28 -18.504 7.431 -5.170 242 HZ3 LYS 28 HZ3 LYS 28 -20.019 8.168 -5.323 243 H GLY 29 HN GLY 29 -18.427 5.846 2.682 244 HA2 GLY 29 HA2 GLY 29 -19.582 5.154 4.541 245 HA3 GLY 29 HA1 GLY 29 -21.037 5.365 3.579 246 H GLN 30 HN GLN 30 -18.673 3.171 2.379 247 HA GLN 30 HA GLN 30 -20.100 0.879 3.528 248 HB2 GLN 30 HB2 GLN 30 -20.773 0.031 1.538 249 HB3 GLN 30 HB1 GLN 30 -20.645 1.698 1.001 250 HG2 GLN 30 HG2 GLN 30 -18.158 0.955 0.481 251 HG3 GLN 30 HG1 GLN 30 -18.917 -0.632 0.395 252 HE21 GLN 30 HE21 GLN 30 -21.403 0.140 -0.622 253 HE22 GLN 30 HE22 GLN 30 -21.184 0.688 -2.245 254 HA PRO 31 HA PRO 31 -16.021 -0.739 3.923 255 HB2 PRO 31 HB2 PRO 31 -16.531 -3.273 4.482 256 HB3 PRO 31 HB1 PRO 31 -17.161 -1.989 5.527 257 HG2 PRO 31 HG2 PRO 31 -18.580 -3.552 3.402 258 HG3 PRO 31 HG1 PRO 31 -19.138 -3.112 5.027 259 HD2 PRO 31 HD2 PRO 31 -19.768 -1.730 2.707 260 HD3 PRO 31 HD1 PRO 31 -19.844 -1.051 4.344 261 H MET 32 HN MET 32 -14.604 -0.953 2.325 262 HA MET 32 HA MET 32 -15.114 -2.977 0.249 263 HB2 MET 32 HB2 MET 32 -15.159 -0.373 -0.315 264 HB3 MET 32 HB1 MET 32 -13.418 -0.611 -0.384 265 HG2 MET 32 HG2 MET 32 -14.098 -0.917 -2.574 266 HG3 MET 32 HG1 MET 32 -13.943 -2.561 -1.959 267 HE1 MET 32 HE1 MET 32 -15.599 -0.235 -3.850 268 HE2 MET 32 HE2 MET 32 -17.063 0.166 -2.951 269 HE3 MET 32 HE3 MET 32 -17.140 -0.969 -4.299 270 H THR 33 HN THR 33 -13.300 -4.091 -0.547 271 HA THR 33 HA THR 33 -11.159 -4.332 1.393 272 HB THR 33 HB THR 33 -10.462 -6.227 -0.217 273 HG1 THR 33 HG1 THR 33 -11.990 -6.873 -1.665 274 HG21 THR 33 HG21 THR 33 -12.976 -6.222 1.393 275 HG22 THR 33 HG22 THR 33 -11.429 -7.000 1.731 276 HG23 THR 33 HG23 THR 33 -12.490 -7.650 0.481 277 H PHE 34 HN PHE 34 -9.461 -3.031 1.219 278 HA PHE 34 HA PHE 34 -8.622 -2.142 -1.446 279 HB2 PHE 34 HB2 PHE 34 -8.375 -0.999 1.301 280 HB3 PHE 34 HB1 PHE 34 -7.118 -0.614 0.126 281 HD1 PHE 34 HD1 PHE 34 -10.790 -0.517 0.666 282 HD2 PHE 34 HD2 PHE 34 -7.450 1.041 -1.472 283 HE1 PHE 34 HE1 PHE 34 -12.229 1.224 -0.314 284 HE2 PHE 34 HE2 PHE 34 -8.884 2.786 -2.448 285 HZ PHE 34 HZ PHE 34 -11.275 2.877 -1.871 286 H ARG 35 HN ARG 35 -6.437 -2.284 -2.098 287 HA ARG 35 HA ARG 35 -4.833 -4.186 -0.536 288 HB2 ARG 35 HB2 ARG 35 -5.694 -5.418 -2.380 289 HB3 ARG 35 HB1 ARG 35 -5.333 -4.116 -3.505 290 HG2 ARG 35 HG2 ARG 35 -3.040 -5.261 -2.044 291 HG3 ARG 35 HG1 ARG 35 -3.815 -6.297 -3.244 292 HD2 ARG 35 HD2 ARG 35 -3.598 -4.423 -4.880 293 HD3 ARG 35 HD1 ARG 35 -2.648 -3.554 -3.678 294 HE ARG 35 HE ARG 35 -0.859 -4.835 -4.260 295 HH11 ARG 35 HH11 ARG 35 -3.761 -6.522 -5.218 296 HH12 ARG 35 HH12 ARG 35 -2.905 -7.809 -5.997 297 HH21 ARG 35 HH21 ARG 35 0.268 -6.526 -5.287 298 HH22 ARG 35 HH22 ARG 35 -0.618 -7.813 -6.037 299 H LEU 36 HN LEU 36 -2.612 -3.889 -0.495 300 HA LEU 36 HA LEU 36 -1.683 -1.234 -0.808 301 HB2 LEU 36 HB2 LEU 36 -0.215 -3.835 -0.344 302 HB3 LEU 36 HB1 LEU 36 0.590 -2.272 -0.390 303 HG LEU 36 HG LEU 36 -1.580 -3.012 1.576 304 HD11 LEU 36 HD11 LEU 36 1.265 -2.632 2.350 305 HD12 LEU 36 HD12 LEU 36 0.786 -4.171 1.635 306 HD13 LEU 36 HD13 LEU 36 0.005 -3.604 3.111 307 HD21 LEU 36 HD21 LEU 36 -1.223 -0.574 0.940 308 HD22 LEU 36 HD22 LEU 36 0.351 -0.716 1.718 309 HD23 LEU 36 HD23 LEU 36 -1.122 -0.976 2.653 310 H LEU 37 HN LEU 37 -2.254 -0.818 -3.015 311 HA LEU 37 HA LEU 37 -1.656 -2.054 -5.303 312 HB2 LEU 37 HB2 LEU 37 -2.589 0.323 -4.837 313 HB3 LEU 37 HB1 LEU 37 -0.930 0.835 -5.077 314 HG LEU 37 HG LEU 37 -0.955 -0.150 -7.325 315 HD11 LEU 37 HD11 LEU 37 -3.736 -0.914 -6.531 316 HD12 LEU 37 HD12 LEU 37 -2.469 -1.913 -7.242 317 HD13 LEU 37 HD13 LEU 37 -3.291 -0.700 -8.224 318 HD21 LEU 37 HD21 LEU 37 -1.873 1.695 -8.260 319 HD22 LEU 37 HD22 LEU 37 -1.941 2.225 -6.580 320 HD23 LEU 37 HD23 LEU 37 -3.374 1.543 -7.349 321 H LEU 38 HN LEU 38 0.008 -2.397 -6.674 322 HA LEU 38 HA LEU 38 2.131 -3.146 -7.092 323 HB2 LEU 38 HB2 LEU 38 3.718 -1.261 -7.426 324 HB3 LEU 38 HB1 LEU 38 2.166 -1.063 -8.213 325 HG LEU 38 HG LEU 38 2.421 0.163 -5.533 326 HD11 LEU 38 HD11 LEU 38 4.608 0.528 -6.926 327 HD12 LEU 38 HD12 LEU 38 3.843 1.875 -6.083 328 HD13 LEU 38 HD13 LEU 38 3.599 1.668 -7.817 329 HD21 LEU 38 HD21 LEU 38 0.512 0.996 -6.312 330 HD22 LEU 38 HD22 LEU 38 0.846 0.420 -7.944 331 HD23 LEU 38 HD23 LEU 38 1.478 1.977 -7.412 332 H VAL 39 HN VAL 39 1.617 -3.778 -4.468 333 HA VAL 39 HA VAL 39 4.264 -3.344 -3.249 334 HB VAL 39 HB VAL 39 1.675 -3.630 -1.712 335 HG11 VAL 39 HG11 VAL 39 3.580 -4.584 -0.542 336 HG12 VAL 39 HG12 VAL 39 3.053 -3.097 0.246 337 HG13 VAL 39 HG13 VAL 39 4.491 -3.092 -0.775 338 HG21 VAL 39 HG21 VAL 39 1.395 -1.446 -2.024 339 HG22 VAL 39 HG22 VAL 39 2.935 -1.315 -2.872 340 HG23 VAL 39 HG23 VAL 39 2.882 -1.179 -1.115 341 H ASP 40 HN ASP 40 5.262 -5.131 -2.405 342 HA ASP 40 HA ASP 40 3.992 -7.696 -3.026 343 HB2 ASP 40 HB2 ASP 40 6.478 -6.799 -3.651 344 HB3 ASP 40 HB1 ASP 40 6.813 -7.664 -2.154 345 H THR 41 HN THR 41 3.482 -9.164 -1.506 346 HA THR 41 HA THR 41 3.879 -8.379 1.284 347 HB THR 41 HB THR 41 2.218 -10.739 0.783 348 HG1 THR 41 HG1 THR 41 1.456 -9.828 -1.005 349 HG21 THR 41 HG21 THR 41 2.063 -9.712 2.906 350 HG22 THR 41 HG22 THR 41 0.555 -9.373 2.056 351 HG23 THR 41 HG23 THR 41 1.791 -8.123 2.190 352 HA PRO 42 HA PRO 42 7.099 -11.347 1.954 353 HB2 PRO 42 HB2 PRO 42 5.823 -11.691 4.620 354 HB3 PRO 42 HB1 PRO 42 7.498 -11.296 4.216 355 HG2 PRO 42 HG2 PRO 42 5.848 -9.427 5.152 356 HG3 PRO 42 HG1 PRO 42 7.029 -9.050 3.883 357 HD2 PRO 42 HD2 PRO 42 4.082 -9.488 3.664 358 HD3 PRO 42 HD1 PRO 42 5.123 -8.348 2.789 359 H GLU 43 HN GLU 43 7.310 -13.499 1.660 360 HA GLU 43 HA GLU 43 4.868 -15.092 1.575 361 HB2 GLU 43 HB2 GLU 43 6.927 -14.932 -0.171 362 HB3 GLU 43 HB1 GLU 43 7.450 -16.308 0.790 363 HG2 GLU 43 HG2 GLU 43 6.258 -17.374 -0.827 364 HG3 GLU 43 HG1 GLU 43 4.992 -17.125 0.374 365 H THR 44 HN THR 44 4.650 -17.098 2.616 366 HA THR 44 HA THR 44 6.281 -17.339 5.041 367 HB THR 44 HB THR 44 4.210 -19.120 5.346 368 HG1 THR 44 HG1 THR 44 3.150 -16.840 4.043 369 HG21 THR 44 HG21 THR 44 5.046 -17.173 6.832 370 HG22 THR 44 HG22 THR 44 3.376 -17.724 6.967 371 HG23 THR 44 HG23 THR 44 3.752 -16.262 6.054 372 H LYS 45 HN LYS 45 6.887 -19.481 5.787 373 HA LYS 45 HA LYS 45 7.866 -21.102 3.594 374 HB2 LYS 45 HB2 LYS 45 8.239 -21.650 6.533 375 HB3 LYS 45 HB1 LYS 45 9.246 -22.183 5.196 376 HG2 LYS 45 HG2 LYS 45 9.064 -19.297 5.317 377 HG3 LYS 45 HG1 LYS 45 9.671 -19.987 6.823 378 HD2 LYS 45 HD2 LYS 45 11.087 -21.417 5.019 379 HD3 LYS 45 HD1 LYS 45 10.900 -19.895 4.146 380 HE2 LYS 45 HE2 LYS 45 12.073 -18.689 5.733 381 HE3 LYS 45 HE1 LYS 45 11.764 -19.869 7.005 382 HZ1 LYS 45 HZ1 LYS 45 13.201 -21.385 5.469 383 HZ2 LYS 45 HZ2 LYS 45 13.943 -20.294 6.527 384 HZ3 LYS 45 HZ3 LYS 45 13.792 -19.911 4.886 385 H HIS 46 HN HIS 46 6.176 -21.857 6.645 386 HA HIS 46 HA HIS 46 4.170 -23.409 5.387 387 HB2 HIS 46 HB2 HIS 46 6.617 -24.750 5.721 388 HB3 HIS 46 HB1 HIS 46 5.573 -25.355 7.002 389 HD1 HIS 46 HD1 HIS 46 5.562 -24.948 3.230 390 HD2 HIS 46 HD2 HIS 46 3.799 -27.256 6.201 391 HE1 HIS 46 HE1 HIS 46 4.248 -26.715 2.016 392 HE2 HIS 46 HE2 HIS 46 3.263 -28.154 3.834 393 HA PRO 47 HA PRO 47 2.510 -22.410 9.392 394 HB2 PRO 47 HB2 PRO 47 0.128 -23.666 9.174 395 HB3 PRO 47 HB1 PRO 47 0.495 -22.174 8.300 396 HG2 PRO 47 HG2 PRO 47 0.555 -25.004 7.326 397 HG3 PRO 47 HG1 PRO 47 -0.084 -23.558 6.522 398 HD2 PRO 47 HD2 PRO 47 2.352 -24.622 5.944 399 HD3 PRO 47 HD1 PRO 47 1.995 -22.888 5.801 400 H LYS 48 HN LYS 48 3.435 -23.386 11.093 401 HA LYS 48 HA LYS 48 3.614 -26.245 11.320 402 HB2 LYS 48 HB2 LYS 48 5.334 -24.582 12.163 403 HB3 LYS 48 HB1 LYS 48 4.213 -24.213 13.467 404 HG2 LYS 48 HG2 LYS 48 4.403 -26.980 13.491 405 HG3 LYS 48 HG1 LYS 48 6.048 -26.424 13.175 406 HD2 LYS 48 HD2 LYS 48 5.194 -24.720 15.159 407 HD3 LYS 48 HD1 LYS 48 4.444 -26.254 15.608 408 HE2 LYS 48 HE2 LYS 48 6.492 -27.334 15.824 409 HE3 LYS 48 HE1 LYS 48 7.337 -26.137 14.843 410 HZ1 LYS 48 HZ1 LYS 48 6.722 -24.542 16.744 411 HZ2 LYS 48 HZ2 LYS 48 7.997 -25.629 16.981 412 HZ3 LYS 48 HZ3 LYS 48 6.479 -25.947 17.656 413 H LYS 49 HN LYS 49 1.823 -27.363 11.760 414 HA LYS 49 HA LYS 49 -0.048 -28.108 12.816 415 HB2 LYS 49 HB2 LYS 49 1.041 -26.383 15.046 416 HB3 LYS 49 HB1 LYS 49 -0.316 -27.487 15.226 417 HG2 LYS 49 HG2 LYS 49 1.435 -29.219 14.260 418 HG3 LYS 49 HG1 LYS 49 2.580 -28.062 14.944 419 HD2 LYS 49 HD2 LYS 49 1.526 -28.257 17.118 420 HD3 LYS 49 HD1 LYS 49 0.294 -29.331 16.451 421 HE2 LYS 49 HE2 LYS 49 1.633 -31.000 17.094 422 HE3 LYS 49 HE1 LYS 49 2.635 -30.560 15.711 423 HZ1 LYS 49 HZ1 LYS 49 3.105 -30.153 18.542 424 HZ2 LYS 49 HZ2 LYS 49 3.522 -28.848 17.551 425 HZ3 LYS 49 HZ3 LYS 49 4.211 -30.368 17.280 426 H GLY 50 HN GLY 50 -0.162 -25.706 11.168 427 HA2 GLY 50 HA2 GLY 50 -1.807 -24.243 10.503 428 HA3 GLY 50 HA1 GLY 50 -2.834 -24.929 11.752 429 H VAL 51 HN VAL 51 -1.224 -22.191 10.745 430 HA VAL 51 HA VAL 51 -1.279 -21.038 13.459 431 HB VAL 51 HB VAL 51 0.270 -19.281 12.494 432 HG11 VAL 51 HG11 VAL 51 1.404 -20.656 13.914 433 HG12 VAL 51 HG12 VAL 51 2.231 -21.065 12.410 434 HG13 VAL 51 HG13 VAL 51 0.960 -22.118 13.033 435 HG21 VAL 51 HG21 VAL 51 0.658 -21.334 10.319 436 HG22 VAL 51 HG22 VAL 51 1.507 -19.798 10.494 437 HG23 VAL 51 HG23 VAL 51 -0.217 -19.815 10.119 438 H GLU 52 HN GLU 52 -2.097 -18.917 13.713 439 HA GLU 52 HA GLU 52 -4.262 -18.308 11.897 440 HB2 GLU 52 HB2 GLU 52 -4.187 -18.157 14.525 441 HB3 GLU 52 HB1 GLU 52 -3.531 -16.556 14.208 442 HG2 GLU 52 HG2 GLU 52 -5.495 -15.892 13.048 443 HG3 GLU 52 HG1 GLU 52 -6.125 -17.539 13.051 444 H LYS 53 HN LYS 53 -1.754 -16.239 13.369 445 HA LYS 53 HA LYS 53 -2.003 -14.185 11.463 446 HB2 LYS 53 HB2 LYS 53 0.163 -13.372 12.380 447 HB3 LYS 53 HB1 LYS 53 -1.037 -13.720 13.617 448 HG2 LYS 53 HG2 LYS 53 0.752 -14.715 14.579 449 HG3 LYS 53 HG1 LYS 53 0.191 -16.073 13.603 450 HD2 LYS 53 HD2 LYS 53 2.106 -16.106 12.474 451 HD3 LYS 53 HD1 LYS 53 1.911 -14.410 12.026 452 HE2 LYS 53 HE2 LYS 53 4.015 -15.016 13.311 453 HE3 LYS 53 HE1 LYS 53 3.068 -13.665 13.934 454 HZ1 LYS 53 HZ1 LYS 53 2.361 -16.251 15.020 455 HZ2 LYS 53 HZ2 LYS 53 2.579 -14.770 15.805 456 HZ3 LYS 53 HZ3 LYS 53 3.919 -15.725 15.417 457 H TYR 54 HN TYR 54 -0.198 -13.442 10.026 458 HA TYR 54 HA TYR 54 1.236 -15.691 8.792 459 HB2 TYR 54 HB2 TYR 54 -0.448 -13.619 7.381 460 HB3 TYR 54 HB1 TYR 54 0.725 -14.634 6.550 461 HD1 TYR 54 HD1 TYR 54 0.416 -17.175 6.716 462 HD2 TYR 54 HD2 TYR 54 -2.626 -14.386 7.754 463 HE1 TYR 54 HE1 TYR 54 -1.278 -18.942 6.476 464 HE2 TYR 54 HE2 TYR 54 -4.328 -16.145 7.518 465 HH TYR 54 HH TYR 54 -3.770 -19.051 5.987 466 H GLY 55 HN GLY 55 0.874 -12.143 8.530 467 HA2 GLY 55 HA2 GLY 55 3.818 -11.975 8.334 468 HA3 GLY 55 HA1 GLY 55 2.710 -10.822 7.606 469 HA PRO 56 HA PRO 56 3.059 -10.219 12.514 470 HB2 PRO 56 HB2 PRO 56 6.018 -10.454 12.515 471 HB3 PRO 56 HB1 PRO 56 4.846 -10.978 13.728 472 HG2 PRO 56 HG2 PRO 56 6.066 -12.749 12.152 473 HG3 PRO 56 HG1 PRO 56 4.363 -12.946 12.605 474 HD2 PRO 56 HD2 PRO 56 5.544 -11.985 10.031 475 HD3 PRO 56 HD1 PRO 56 4.127 -13.021 10.306 476 H GLU 57 HN GLU 57 5.995 -9.360 10.667 477 HA GLU 57 HA GLU 57 5.879 -6.636 11.570 478 HB2 GLU 57 HB2 GLU 57 7.871 -6.320 10.163 479 HB3 GLU 57 HB1 GLU 57 8.032 -7.709 11.229 480 HG2 GLU 57 HG2 GLU 57 6.958 -8.266 8.544 481 HG3 GLU 57 HG1 GLU 57 8.640 -7.744 8.616 482 H ALA 58 HN ALA 58 4.723 -8.380 8.809 483 HA ALA 58 HA ALA 58 4.488 -6.062 7.117 484 HB1 ALA 58 HB1 ALA 58 4.671 -7.855 5.750 485 HB2 ALA 58 HB2 ALA 58 2.913 -7.855 5.899 486 HB3 ALA 58 HB3 ALA 58 3.883 -8.945 6.891 487 H SER 59 HN SER 59 2.237 -8.112 8.941 488 HA SER 59 HA SER 59 -0.050 -6.532 8.277 489 HB2 SER 59 HB2 SER 59 0.254 -9.059 9.165 490 HB3 SER 59 HB1 SER 59 -0.134 -8.254 10.687 491 HG SER 59 HG SER 59 -2.016 -7.426 9.662 492 H ALA 60 HN ALA 60 2.248 -6.601 10.921 493 HA ALA 60 HA ALA 60 0.755 -4.967 12.695 494 HB1 ALA 60 HB1 ALA 60 3.688 -5.623 12.568 495 HB2 ALA 60 HB2 ALA 60 2.464 -6.356 13.603 496 HB3 ALA 60 HB3 ALA 60 2.949 -4.680 13.861 497 H PHE 61 HN PHE 61 3.630 -4.235 10.712 498 HA PHE 61 HA PHE 61 3.757 -1.524 11.221 499 HB2 PHE 61 HB2 PHE 61 5.514 -2.804 10.054 500 HB3 PHE 61 HB1 PHE 61 4.477 -2.914 8.636 501 HD1 PHE 61 HD1 PHE 61 6.246 -0.532 10.835 502 HD2 PHE 61 HD2 PHE 61 4.400 -1.190 7.063 503 HE1 PHE 61 HE1 PHE 61 7.114 1.633 10.037 504 HE2 PHE 61 HE2 PHE 61 5.256 0.966 6.255 505 HZ PHE 61 HZ PHE 61 6.618 2.383 7.742 506 H THR 62 HN THR 62 2.179 -3.103 8.437 507 HA THR 62 HA THR 62 1.212 -0.857 7.167 508 HB THR 62 HB THR 62 1.083 -3.227 6.343 509 HG1 THR 62 HG1 THR 62 -0.279 -2.476 4.954 510 HG21 THR 62 HG21 THR 62 -0.856 -4.563 6.819 511 HG22 THR 62 HG22 THR 62 -1.448 -3.355 7.960 512 HG23 THR 62 HG23 THR 62 0.031 -4.250 8.311 513 H LYS 63 HN LYS 63 -0.354 -2.728 9.743 514 HA LYS 63 HA LYS 63 -2.637 -1.019 9.891 515 HB2 LYS 63 HB2 LYS 63 -1.879 -3.511 10.959 516 HB3 LYS 63 HB1 LYS 63 -2.148 -2.461 12.343 517 HG2 LYS 63 HG2 LYS 63 -4.346 -1.856 11.016 518 HG3 LYS 63 HG1 LYS 63 -4.065 -3.445 10.303 519 HD2 LYS 63 HD2 LYS 63 -4.292 -2.832 13.250 520 HD3 LYS 63 HD1 LYS 63 -5.525 -3.606 12.252 521 HE2 LYS 63 HE2 LYS 63 -3.122 -5.049 11.881 522 HE3 LYS 63 HE1 LYS 63 -3.308 -4.786 13.615 523 HZ1 LYS 63 HZ1 LYS 63 -4.453 -6.792 12.317 524 HZ2 LYS 63 HZ2 LYS 63 -5.690 -5.645 12.185 525 HZ3 LYS 63 HZ3 LYS 63 -5.118 -6.100 13.710 526 H LYS 64 HN LYS 64 0.496 -1.133 11.398 527 HA LYS 64 HA LYS 64 0.100 0.466 13.632 528 HB2 LYS 64 HB2 LYS 64 2.178 -0.819 12.997 529 HB3 LYS 64 HB1 LYS 64 2.567 0.493 11.894 530 HG2 LYS 64 HG2 LYS 64 2.019 1.172 14.732 531 HG3 LYS 64 HG1 LYS 64 3.548 0.383 14.336 532 HD2 LYS 64 HD2 LYS 64 4.070 2.136 12.740 533 HD3 LYS 64 HD1 LYS 64 2.510 2.903 13.040 534 HE2 LYS 64 HE2 LYS 64 4.097 2.431 15.454 535 HE3 LYS 64 HE1 LYS 64 4.852 3.530 14.302 536 HZ1 LYS 64 HZ1 LYS 64 3.083 4.305 16.124 537 HZ2 LYS 64 HZ2 LYS 64 2.035 3.991 14.834 538 HZ3 LYS 64 HZ3 LYS 64 3.298 5.100 14.646 539 H MET 65 HN MET 65 0.658 1.394 10.270 540 HA MET 65 HA MET 65 0.895 4.176 10.864 541 HB2 MET 65 HB2 MET 65 0.386 2.824 8.213 542 HB3 MET 65 HB1 MET 65 0.894 4.491 8.442 543 HG2 MET 65 HG2 MET 65 2.534 2.204 9.464 544 HG3 MET 65 HG1 MET 65 2.661 2.762 7.797 545 HE1 MET 65 HE1 MET 65 5.010 5.025 7.580 546 HE2 MET 65 HE2 MET 65 4.659 3.298 7.515 547 HE3 MET 65 HE3 MET 65 5.798 3.921 8.708 548 H VAL 66 HN VAL 66 -1.630 2.227 9.264 549 HA VAL 66 HA VAL 66 -3.454 4.369 9.004 550 HB VAL 66 HB VAL 66 -5.171 2.605 8.622 551 HG11 VAL 66 HG11 VAL 66 -3.241 1.530 6.833 552 HG12 VAL 66 HG12 VAL 66 -2.881 3.239 7.072 553 HG13 VAL 66 HG13 VAL 66 -4.481 2.744 6.520 554 HG21 VAL 66 HG21 VAL 66 -3.885 0.269 8.309 555 HG22 VAL 66 HG22 VAL 66 -4.745 0.712 9.782 556 HG23 VAL 66 HG23 VAL 66 -2.997 0.915 9.687 557 H GLU 67 HN GLU 67 -3.168 1.795 11.445 558 HA GLU 67 HA GLU 67 -5.472 2.436 12.901 559 HB2 GLU 67 HB2 GLU 67 -2.875 1.195 13.817 560 HB3 GLU 67 HB1 GLU 67 -4.323 1.283 14.808 561 HG2 GLU 67 HG2 GLU 67 -4.206 -0.084 12.133 562 HG3 GLU 67 HG1 GLU 67 -3.960 -0.903 13.675 563 H ASN 68 HN ASN 68 -2.099 3.444 13.461 564 HA ASN 68 HA ASN 68 -2.746 5.178 15.616 565 HB2 ASN 68 HB2 ASN 68 -0.315 4.876 13.864 566 HB3 ASN 68 HB1 ASN 68 -0.412 6.122 15.105 567 HD21 ASN 68 HD21 ASN 68 -0.649 2.643 14.579 568 HD22 ASN 68 HD22 ASN 68 -0.081 2.186 16.145 569 H ALA 69 HN ALA 69 -2.583 5.570 12.151 570 HA ALA 69 HA ALA 69 -2.520 8.403 12.098 571 HB1 ALA 69 HB1 ALA 69 -3.217 6.292 10.099 572 HB2 ALA 69 HB2 ALA 69 -1.876 7.436 10.098 573 HB3 ALA 69 HB3 ALA 69 -3.509 7.993 9.737 574 H LYS 70 HN LYS 70 -4.057 9.804 12.596 575 HA LYS 70 HA LYS 70 -6.635 9.018 13.430 576 HB2 LYS 70 HB2 LYS 70 -5.074 11.423 13.376 577 HB3 LYS 70 HB1 LYS 70 -6.690 11.775 12.781 578 HG2 LYS 70 HG2 LYS 70 -7.689 10.994 14.790 579 HG3 LYS 70 HG1 LYS 70 -6.159 10.324 15.361 580 HD2 LYS 70 HD2 LYS 70 -5.249 12.678 15.317 581 HD3 LYS 70 HD1 LYS 70 -6.904 13.226 15.042 582 HE2 LYS 70 HE2 LYS 70 -7.255 11.590 17.171 583 HE3 LYS 70 HE1 LYS 70 -5.626 12.190 17.482 584 HZ1 LYS 70 HZ1 LYS 70 -6.757 13.865 18.438 585 HZ2 LYS 70 HZ2 LYS 70 -8.163 13.601 17.537 586 HZ3 LYS 70 HZ3 LYS 70 -6.870 14.452 16.856 587 H LYS 71 HN LYS 71 -5.347 9.726 10.323 588 HA LYS 71 HA LYS 71 -8.004 9.391 9.161 589 HB2 LYS 71 HB2 LYS 71 -7.169 11.898 9.399 590 HB3 LYS 71 HB1 LYS 71 -6.269 11.488 7.946 591 HG2 LYS 71 HG2 LYS 71 -8.452 10.732 6.943 592 HG3 LYS 71 HG1 LYS 71 -9.247 11.467 8.336 593 HD2 LYS 71 HD2 LYS 71 -9.301 13.299 7.025 594 HD3 LYS 71 HD1 LYS 71 -7.630 13.491 7.558 595 HE2 LYS 71 HE2 LYS 71 -6.773 12.605 5.571 596 HE3 LYS 71 HE1 LYS 71 -8.313 11.870 5.128 597 HZ1 LYS 71 HZ1 LYS 71 -7.380 14.598 4.752 598 HZ2 LYS 71 HZ2 LYS 71 -9.004 14.429 5.193 599 HZ3 LYS 71 HZ3 LYS 71 -8.423 13.668 3.798 600 H ILE 72 HN ILE 72 -8.025 8.304 7.248 601 HA ILE 72 HA ILE 72 -5.409 7.499 6.156 602 HB ILE 72 HB ILE 72 -7.893 5.846 5.851 603 HG12 ILE 72 HG12 ILE 72 -5.879 5.547 8.088 604 HG13 ILE 72 HG11 ILE 72 -7.477 6.260 8.287 605 HG21 ILE 72 HG21 ILE 72 -5.117 4.790 6.046 606 HG22 ILE 72 HG22 ILE 72 -5.636 5.586 4.559 607 HG23 ILE 72 HG23 ILE 72 -6.501 4.166 5.148 608 HD11 ILE 72 HD11 ILE 72 -7.714 4.064 9.015 609 HD12 ILE 72 HD12 ILE 72 -6.754 3.420 7.683 610 HD13 ILE 72 HD13 ILE 72 -8.374 4.050 7.379 611 H GLU 73 HN GLU 73 -5.162 7.461 3.926 612 HA GLU 73 HA GLU 73 -7.423 8.520 2.357 613 HB2 GLU 73 HB2 GLU 73 -4.568 9.258 1.765 614 HB3 GLU 73 HB1 GLU 73 -6.040 10.027 1.190 615 HG2 GLU 73 HG2 GLU 73 -6.488 10.897 3.402 616 HG3 GLU 73 HG1 GLU 73 -5.073 10.063 4.040 617 H VAL 74 HN VAL 74 -7.657 7.749 0.263 618 HA VAL 74 HA VAL 74 -5.806 5.612 -0.538 619 HB VAL 74 HB VAL 74 -7.831 4.519 -1.611 620 HG11 VAL 74 HG11 VAL 74 -8.350 4.273 1.245 621 HG12 VAL 74 HG12 VAL 74 -6.638 4.174 0.829 622 HG13 VAL 74 HG13 VAL 74 -7.792 3.069 0.083 623 HG21 VAL 74 HG21 VAL 74 -9.482 6.186 -1.515 624 HG22 VAL 74 HG22 VAL 74 -9.193 6.486 0.200 625 HG23 VAL 74 HG23 VAL 74 -9.968 4.989 -0.315 626 H GLU 75 HN GLU 75 -5.223 5.530 -2.648 627 HA GLU 75 HA GLU 75 -6.537 7.389 -4.506 628 HB2 GLU 75 HB2 GLU 75 -4.353 8.287 -3.598 629 HB3 GLU 75 HB1 GLU 75 -3.553 6.950 -4.414 630 HG2 GLU 75 HG2 GLU 75 -5.311 8.324 -6.218 631 HG3 GLU 75 HG1 GLU 75 -4.190 9.456 -5.463 632 H PHE 76 HN PHE 76 -7.499 6.071 -5.931 633 HA PHE 76 HA PHE 76 -6.481 3.495 -6.613 634 HB2 PHE 76 HB2 PHE 76 -8.728 5.171 -7.736 635 HB3 PHE 76 HB1 PHE 76 -8.326 3.575 -8.356 636 HD1 PHE 76 HD2 PHE 76 -7.854 1.951 -6.048 637 HD2 PHE 76 HD1 PHE 76 -10.693 5.078 -6.579 638 HE1 PHE 76 HE2 PHE 76 -9.297 0.926 -4.342 639 HE2 PHE 76 HE1 PHE 76 -12.141 4.057 -4.873 640 HZ PHE 76 HZ PHE 76 -11.444 1.978 -3.754 641 H ASP 77 HN ASP 77 -5.564 2.815 -8.497 642 HA ASP 77 HA ASP 77 -3.742 4.498 -9.776 643 HB2 ASP 77 HB2 ASP 77 -3.362 2.654 -11.322 644 HB3 ASP 77 HB1 ASP 77 -3.537 2.034 -9.685 645 H LYS 78 HN LYS 78 -3.947 4.039 -12.483 646 HA LYS 78 HA LYS 78 -6.272 5.698 -13.181 647 HB2 LYS 78 HB2 LYS 78 -4.649 5.972 -15.332 648 HB3 LYS 78 HB1 LYS 78 -4.631 7.052 -13.946 649 HG2 LYS 78 HG2 LYS 78 -2.906 4.677 -13.722 650 HG3 LYS 78 HG1 LYS 78 -2.444 5.849 -14.954 651 HD2 LYS 78 HD2 LYS 78 -3.171 7.161 -12.485 652 HD3 LYS 78 HD1 LYS 78 -1.900 5.967 -12.223 653 HE2 LYS 78 HE2 LYS 78 -0.407 7.382 -13.060 654 HE3 LYS 78 HE1 LYS 78 -1.269 7.380 -14.596 655 HZ1 LYS 78 HZ1 LYS 78 -1.530 9.546 -14.162 656 HZ2 LYS 78 HZ2 LYS 78 -1.231 9.374 -12.507 657 HZ3 LYS 78 HZ3 LYS 78 -2.770 9.045 -13.124 658 H GLY 79 HN GLY 79 -4.612 2.727 -13.821 659 HA2 GLY 79 HA2 GLY 79 -6.192 2.204 -16.220 660 HA3 GLY 79 HA1 GLY 79 -4.917 1.185 -15.569 661 H GLN 80 HN GLN 80 -5.431 -0.488 -14.269 662 HA GLN 80 HA GLN 80 -7.881 -1.671 -14.321 663 HB2 GLN 80 HB2 GLN 80 -5.431 -2.287 -13.268 664 HB3 GLN 80 HB1 GLN 80 -6.424 -2.181 -11.824 665 HG2 GLN 80 HG2 GLN 80 -7.886 -3.848 -12.584 666 HG3 GLN 80 HG1 GLN 80 -7.205 -3.801 -14.211 667 HE21 GLN 80 HE21 GLN 80 -4.645 -4.065 -14.022 668 HE22 GLN 80 HE22 GLN 80 -4.167 -5.478 -13.152 669 H ARG 81 HN ARG 81 -6.721 -0.552 -11.170 670 HA ARG 81 HA ARG 81 -7.693 0.751 -9.554 671 HB2 ARG 81 HB2 ARG 81 -10.153 0.940 -11.287 672 HB3 ARG 81 HB1 ARG 81 -9.749 1.939 -9.901 673 HG2 ARG 81 HG2 ARG 81 -7.617 2.464 -11.399 674 HG3 ARG 81 HG1 ARG 81 -8.757 2.060 -12.684 675 HD2 ARG 81 HD2 ARG 81 -9.188 4.119 -10.521 676 HD3 ARG 81 HD1 ARG 81 -8.757 4.460 -12.197 677 HE ARG 81 HE ARG 81 -11.041 2.992 -12.385 678 HH11 ARG 81 HH11 ARG 81 -10.158 5.918 -10.701 679 HH12 ARG 81 HH12 ARG 81 -11.751 6.592 -10.777 680 HH21 ARG 81 HH21 ARG 81 -13.138 3.876 -12.486 681 HH22 ARG 81 HH22 ARG 81 -13.444 5.432 -11.789 682 H THR 82 HN THR 82 -8.818 -2.138 -10.832 683 HA THR 82 HA THR 82 -9.769 -3.019 -8.285 684 HB THR 82 HB THR 82 -11.984 -3.840 -9.432 685 HG1 THR 82 HG1 THR 82 -12.710 -2.555 -11.037 686 HG21 THR 82 HG21 THR 82 -11.712 -2.155 -7.527 687 HG22 THR 82 HG22 THR 82 -13.200 -2.114 -8.473 688 HG23 THR 82 HG23 THR 82 -11.933 -0.925 -8.772 689 H ASP 83 HN ASP 83 -9.086 -5.038 -8.072 690 HA ASP 83 HA ASP 83 -8.105 -6.484 -10.357 691 HB2 ASP 83 HB2 ASP 83 -7.501 -6.435 -7.637 692 HB3 ASP 83 HB1 ASP 83 -8.214 -8.025 -7.894 693 H LYS 84 HN LYS 84 -8.576 -9.063 -9.958 694 HA LYS 84 HA LYS 84 -10.934 -9.655 -11.184 695 HB2 LYS 84 HB2 LYS 84 -10.670 -11.865 -9.600 696 HB3 LYS 84 HB1 LYS 84 -9.824 -11.609 -11.122 697 HG2 LYS 84 HG2 LYS 84 -8.562 -10.531 -8.666 698 HG3 LYS 84 HG1 LYS 84 -8.583 -12.284 -8.870 699 HD2 LYS 84 HD2 LYS 84 -7.654 -10.456 -11.063 700 HD3 LYS 84 HD1 LYS 84 -6.563 -10.992 -9.785 701 HE2 LYS 84 HE2 LYS 84 -7.889 -13.294 -10.683 702 HE3 LYS 84 HE1 LYS 84 -7.454 -12.392 -12.133 703 HZ1 LYS 84 HZ1 LYS 84 -5.193 -12.221 -10.741 704 HZ2 LYS 84 HZ2 LYS 84 -5.510 -13.456 -11.851 705 HZ3 LYS 84 HZ3 LYS 84 -5.751 -13.724 -10.198 706 H TYR 85 HN TYR 85 -10.439 -10.086 -7.683 707 HA TYR 85 HA TYR 85 -13.166 -10.532 -7.133 708 HB2 TYR 85 HB2 TYR 85 -10.683 -10.217 -5.599 709 HB3 TYR 85 HB1 TYR 85 -12.118 -9.658 -4.746 710 HD1 TYR 85 HD1 TYR 85 -12.288 -12.411 -7.171 711 HD2 TYR 85 HD2 TYR 85 -11.961 -11.378 -3.057 712 HE1 TYR 85 HE1 TYR 85 -12.818 -14.731 -6.553 713 HE2 TYR 85 HE2 TYR 85 -12.490 -13.695 -2.428 714 HH TYR 85 HH TYR 85 -13.549 -15.653 -3.328 715 H GLY 86 HN GLY 86 -11.554 -7.712 -7.957 716 HA2 GLY 86 HA2 GLY 86 -12.558 -5.617 -8.262 717 HA3 GLY 86 HA1 GLY 86 -13.856 -6.107 -7.182 718 H ARG 87 HN ARG 87 -10.596 -6.652 -6.192 719 HA ARG 87 HA ARG 87 -10.831 -5.291 -3.783 720 HB2 ARG 87 HB2 ARG 87 -8.868 -6.818 -5.090 721 HB3 ARG 87 HB1 ARG 87 -8.087 -5.298 -4.679 722 HG2 ARG 87 HG2 ARG 87 -7.685 -6.674 -2.845 723 HG3 ARG 87 HG1 ARG 87 -9.030 -5.651 -2.333 724 HD2 ARG 87 HD2 ARG 87 -9.481 -7.918 -1.676 725 HD3 ARG 87 HD1 ARG 87 -10.592 -7.466 -2.969 726 HE ARG 87 HE ARG 87 -8.607 -8.648 -4.329 727 HH11 ARG 87 HH11 ARG 87 -10.394 -9.643 -1.500 728 HH12 ARG 87 HH12 ARG 87 -10.227 -11.333 -1.837 729 HH21 ARG 87 HH21 ARG 87 -8.389 -10.868 -4.774 730 HH22 ARG 87 HH22 ARG 87 -9.091 -12.029 -3.697 731 H GLY 88 HN GLY 88 -9.295 -3.465 -3.101 732 HA2 GLY 88 HA2 GLY 88 -9.825 -1.214 -4.883 733 HA3 GLY 88 HA1 GLY 88 -9.358 -1.112 -3.193 734 H LEU 89 HN LEU 89 -8.299 -1.057 -6.433 735 HA LEU 89 HA LEU 89 -5.515 -1.518 -5.862 736 HB2 LEU 89 HB2 LEU 89 -7.023 -0.608 -8.296 737 HB3 LEU 89 HB1 LEU 89 -5.271 -0.638 -8.254 738 HG LEU 89 HG LEU 89 -6.523 -2.643 -9.278 739 HD11 LEU 89 HD11 LEU 89 -4.124 -2.598 -8.855 740 HD12 LEU 89 HD12 LEU 89 -4.803 -4.186 -8.501 741 HD13 LEU 89 HD13 LEU 89 -4.404 -3.084 -7.183 742 HD21 LEU 89 HD21 LEU 89 -6.699 -3.478 -6.396 743 HD22 LEU 89 HD22 LEU 89 -7.304 -4.331 -7.816 744 HD23 LEU 89 HD23 LEU 89 -8.070 -2.828 -7.296 745 H ALA 90 HN ALA 90 -5.649 0.175 -4.096 746 HA ALA 90 HA ALA 90 -4.671 2.703 -5.194 747 HB1 ALA 90 HB1 ALA 90 -6.793 3.469 -4.758 748 HB2 ALA 90 HB2 ALA 90 -6.006 3.789 -3.215 749 HB3 ALA 90 HB3 ALA 90 -7.030 2.366 -3.404 750 H TYR 91 HN TYR 91 -3.743 4.089 -3.375 751 HA TYR 91 HA TYR 91 -2.148 2.341 -1.647 752 HB2 TYR 91 HB2 TYR 91 -1.618 5.273 -2.039 753 HB3 TYR 91 HB1 TYR 91 -0.490 3.998 -1.603 754 HD1 TYR 91 HD2 TYR 91 -2.608 5.193 -4.429 755 HD2 TYR 91 HD1 TYR 91 0.865 3.045 -3.237 756 HE1 TYR 91 HE2 TYR 91 -1.919 5.015 -6.781 757 HE2 TYR 91 HE1 TYR 91 1.567 2.867 -5.585 758 HH TYR 91 HH TYR 91 1.080 4.307 -7.768 759 H ILE 92 HN ILE 92 -2.235 2.474 0.546 760 HA ILE 92 HA ILE 92 -4.366 4.136 1.676 761 HB ILE 92 HB ILE 92 -2.726 2.000 3.046 762 HG12 ILE 92 HG12 ILE 92 -5.123 0.845 2.747 763 HG13 ILE 92 HG11 ILE 92 -5.144 1.867 1.312 764 HG21 ILE 92 HG21 ILE 92 -4.518 2.006 4.695 765 HG22 ILE 92 HG22 ILE 92 -5.349 3.280 3.801 766 HG23 ILE 92 HG23 ILE 92 -3.789 3.606 4.554 767 HD11 ILE 92 HD11 ILE 92 -4.053 0.229 0.296 768 HD12 ILE 92 HD12 ILE 92 -3.713 -0.590 1.820 769 HD13 ILE 92 HD13 ILE 92 -2.648 0.696 1.253 770 H TYR 93 HN TYR 93 -3.975 5.932 2.802 771 HA TYR 93 HA TYR 93 -1.190 6.545 3.503 772 HB2 TYR 93 HB2 TYR 93 -3.551 8.415 3.229 773 HB3 TYR 93 HB1 TYR 93 -1.905 8.897 3.598 774 HD1 TYR 93 HD2 TYR 93 -2.965 6.414 1.034 775 HD2 TYR 93 HD1 TYR 93 -1.419 10.299 1.796 776 HE1 TYR 93 HE2 TYR 93 -2.545 6.702 -1.363 777 HE2 TYR 93 HE1 TYR 93 -0.982 10.598 -0.605 778 HH TYR 93 HH TYR 93 -1.280 7.986 -2.871 779 H ALA 94 HN ALA 94 -0.772 7.682 5.502 780 HA ALA 94 HA ALA 94 -2.804 7.430 7.583 781 HB1 ALA 94 HB1 ALA 94 -1.889 5.536 8.344 782 HB2 ALA 94 HB2 ALA 94 -0.561 6.550 8.910 783 HB3 ALA 94 HB3 ALA 94 -0.445 5.735 7.352 784 H ASP 95 HN ASP 95 -2.931 9.394 8.444 785 HA ASP 95 HA ASP 95 -2.359 11.364 9.423 786 HB2 ASP 95 HB2 ASP 95 -0.059 9.651 9.924 787 HB3 ASP 95 HB1 ASP 95 0.393 11.349 9.813 788 H GLY 96 HN GLY 96 -1.727 10.596 6.415 789 HA2 GLY 96 HA2 GLY 96 -1.613 12.392 4.792 790 HA3 GLY 96 HA1 GLY 96 -0.462 13.196 5.843 791 H LYS 97 HN LYS 97 0.033 9.838 5.577 792 HA LYS 97 HA LYS 97 1.975 10.218 3.417 793 HB2 LYS 97 HB2 LYS 97 2.490 9.318 6.207 794 HB3 LYS 97 HB1 LYS 97 3.393 8.541 4.916 795 HG2 LYS 97 HG2 LYS 97 3.998 10.893 4.150 796 HG3 LYS 97 HG1 LYS 97 3.392 11.426 5.721 797 HD2 LYS 97 HD2 LYS 97 5.475 9.273 5.435 798 HD3 LYS 97 HD1 LYS 97 5.891 10.984 5.547 799 HE2 LYS 97 HE2 LYS 97 5.292 11.128 7.738 800 HE3 LYS 97 HE1 LYS 97 4.038 9.897 7.588 801 HZ1 LYS 97 HZ1 LYS 97 5.752 8.977 8.898 802 HZ2 LYS 97 HZ2 LYS 97 6.963 9.481 7.828 803 HZ3 LYS 97 HZ3 LYS 97 5.895 8.249 7.377 804 H MET 98 HN MET 98 2.087 8.562 1.987 805 HA MET 98 HA MET 98 0.084 6.548 2.084 806 HB2 MET 98 HB2 MET 98 2.328 6.093 0.225 807 HB3 MET 98 HB1 MET 98 0.594 6.105 -0.072 808 HG2 MET 98 HG2 MET 98 0.798 8.661 0.208 809 HG3 MET 98 HG1 MET 98 2.519 8.390 -0.049 810 HE1 MET 98 HE1 MET 98 2.289 6.454 -3.543 811 HE2 MET 98 HE2 MET 98 1.574 5.610 -2.169 812 HE3 MET 98 HE3 MET 98 3.104 6.466 -1.978 813 H VAL 99 HN VAL 99 0.136 4.890 3.396 814 HA VAL 99 HA VAL 99 2.335 3.895 4.774 815 HB VAL 99 HB VAL 99 -0.093 2.270 4.027 816 HG11 VAL 99 HG11 VAL 99 1.063 0.752 5.207 817 HG12 VAL 99 HG12 VAL 99 0.531 1.680 6.608 818 HG13 VAL 99 HG13 VAL 99 2.128 1.966 5.916 819 HG21 VAL 99 HG21 VAL 99 0.235 4.465 6.043 820 HG22 VAL 99 HG22 VAL 99 -0.955 3.184 6.269 821 HG23 VAL 99 HG23 VAL 99 -1.048 4.236 4.856 822 H ASN 100 HN ASN 100 1.075 3.055 1.614 823 HA ASN 100 HA ASN 100 2.365 0.617 1.190 824 HB2 ASN 100 HB2 ASN 100 2.020 2.687 -0.978 825 HB3 ASN 100 HB1 ASN 100 1.951 0.932 -1.120 826 HD21 ASN 100 HD21 ASN 100 0.003 0.071 -1.222 827 HD22 ASN 100 HD22 ASN 100 -1.464 0.799 -0.680 828 H GLU 101 HN GLU 101 3.474 3.890 0.310 829 HA GLU 101 HA GLU 101 5.972 3.185 -0.695 830 HB2 GLU 101 HB2 GLU 101 4.682 5.493 -0.564 831 HB3 GLU 101 HB1 GLU 101 5.680 5.715 0.866 832 HG2 GLU 101 HG2 GLU 101 7.371 4.794 -1.197 833 HG3 GLU 101 HG1 GLU 101 6.363 6.072 -1.872 834 H ALA 102 HN ALA 102 4.872 3.577 2.599 835 HA ALA 102 HA ALA 102 7.361 3.748 3.885 836 HB1 ALA 102 HB1 ALA 102 4.869 2.465 4.993 837 HB2 ALA 102 HB2 ALA 102 5.143 4.206 4.931 838 HB3 ALA 102 HB3 ALA 102 6.202 3.181 5.900 839 H LEU 103 HN LEU 103 5.256 0.882 3.528 840 HA LEU 103 HA LEU 103 7.080 -0.988 4.507 841 HB2 LEU 103 HB2 LEU 103 4.951 -1.420 2.409 842 HB3 LEU 103 HB1 LEU 103 5.724 -2.673 3.361 843 HG LEU 103 HG LEU 103 4.642 -0.807 5.194 844 HD11 LEU 103 HD11 LEU 103 2.650 -0.150 4.455 845 HD12 LEU 103 HD12 LEU 103 2.275 -1.744 3.801 846 HD13 LEU 103 HD13 LEU 103 3.210 -0.595 2.844 847 HD21 LEU 103 HD21 LEU 103 3.427 -3.459 4.491 848 HD22 LEU 103 HD22 LEU 103 3.550 -2.679 6.068 849 HD23 LEU 103 HD23 LEU 103 4.991 -3.344 5.299 850 H VAL 104 HN VAL 104 6.596 0.277 1.261 851 HA VAL 104 HA VAL 104 8.319 -1.485 -0.102 852 HB VAL 104 HB VAL 104 7.722 1.382 -0.844 853 HG11 VAL 104 HG11 VAL 104 8.976 -0.910 -2.219 854 HG12 VAL 104 HG12 VAL 104 9.250 0.821 -2.413 855 HG13 VAL 104 HG13 VAL 104 7.850 0.059 -3.169 856 HG21 VAL 104 HG21 VAL 104 5.827 -0.535 -0.397 857 HG22 VAL 104 HG22 VAL 104 6.143 -0.724 -2.122 858 HG23 VAL 104 HG23 VAL 104 5.643 0.843 -1.484 859 H ARG 105 HN ARG 105 8.862 1.697 1.362 860 HA ARG 105 HA ARG 105 11.639 1.751 0.636 861 HB2 ARG 105 HB2 ARG 105 10.503 3.849 0.788 862 HB3 ARG 105 HB1 ARG 105 9.951 3.502 2.422 863 HG2 ARG 105 HG2 ARG 105 12.805 3.368 2.342 864 HG3 ARG 105 HG1 ARG 105 12.265 4.886 1.621 865 HD2 ARG 105 HD2 ARG 105 12.286 5.557 3.782 866 HD3 ARG 105 HD1 ARG 105 10.675 4.847 3.767 867 HE ARG 105 HE ARG 105 11.689 2.831 4.739 868 HH11 ARG 105 HH11 ARG 105 13.453 5.844 5.002 869 HH12 ARG 105 HH12 ARG 105 14.357 5.329 6.383 870 HH21 ARG 105 HH21 ARG 105 12.888 2.167 6.550 871 HH22 ARG 105 HH22 ARG 105 14.040 3.248 7.260 872 H GLN 106 HN GLN 106 9.788 0.770 3.453 873 HA GLN 106 HA GLN 106 12.017 0.697 5.237 874 HB2 GLN 106 HB2 GLN 106 9.190 0.169 5.377 875 HB3 GLN 106 HB1 GLN 106 10.080 -1.126 6.162 876 HG2 GLN 106 HG2 GLN 106 10.069 0.187 7.954 877 HG3 GLN 106 HG1 GLN 106 11.331 1.099 7.129 878 HE21 GLN 106 HE21 GLN 106 9.808 2.300 5.143 879 HE22 GLN 106 HE22 GLN 106 8.738 3.440 5.877 880 H GLY 107 HN GLY 107 10.483 -1.666 3.120 881 HA2 GLY 107 HA2 GLY 107 12.078 -3.328 2.180 882 HA3 GLY 107 HA1 GLY 107 12.641 -3.566 3.831 883 H LEU 108 HN LEU 108 9.623 -3.218 4.549 884 HA LEU 108 HA LEU 108 9.040 -5.919 4.933 885 HB2 LEU 108 HB2 LEU 108 6.949 -3.769 4.672 886 HB3 LEU 108 HB1 LEU 108 6.874 -5.232 5.634 887 HG LEU 108 HG LEU 108 8.663 -2.860 6.174 888 HD11 LEU 108 HD11 LEU 108 6.348 -2.359 6.642 889 HD12 LEU 108 HD12 LEU 108 7.232 -2.567 8.155 890 HD13 LEU 108 HD13 LEU 108 6.181 -3.853 7.564 891 HD21 LEU 108 HD21 LEU 108 9.129 -4.036 8.303 892 HD22 LEU 108 HD22 LEU 108 9.746 -4.887 6.888 893 HD23 LEU 108 HD23 LEU 108 8.269 -5.443 7.677 894 H ALA 109 HN ALA 109 8.381 -3.784 2.252 895 HA ALA 109 HA ALA 109 7.425 -6.081 0.707 896 HB1 ALA 109 HB1 ALA 109 5.424 -4.906 1.462 897 HB2 ALA 109 HB2 ALA 109 5.624 -4.763 -0.285 898 HB3 ALA 109 HB3 ALA 109 6.034 -3.406 0.765 899 H LYS 110 HN LYS 110 7.193 -5.351 -1.694 900 HA LYS 110 HA LYS 110 9.106 -3.324 -2.491 901 HB2 LYS 110 HB2 LYS 110 10.279 -5.001 -4.000 902 HB3 LYS 110 HB1 LYS 110 10.649 -5.103 -2.284 903 HG2 LYS 110 HG2 LYS 110 9.415 -7.060 -2.010 904 HG3 LYS 110 HG1 LYS 110 8.524 -6.818 -3.514 905 HD2 LYS 110 HD2 LYS 110 11.035 -6.939 -4.475 906 HD3 LYS 110 HD1 LYS 110 11.203 -7.975 -3.055 907 HE2 LYS 110 HE2 LYS 110 9.471 -9.423 -3.811 908 HE3 LYS 110 HE1 LYS 110 9.012 -8.304 -5.095 909 HZ1 LYS 110 HZ1 LYS 110 10.378 -10.278 -5.785 910 HZ2 LYS 110 HZ2 LYS 110 11.684 -9.578 -4.968 911 HZ3 LYS 110 HZ3 LYS 110 10.976 -8.773 -6.277 912 H VAL 111 HN VAL 111 9.165 -3.122 -4.930 913 HA VAL 111 HA VAL 111 6.556 -2.863 -5.909 914 HB VAL 111 HB VAL 111 7.698 -2.596 -8.179 915 HG11 VAL 111 HG11 VAL 111 7.946 -0.918 -5.777 916 HG12 VAL 111 HG12 VAL 111 7.280 -0.542 -7.367 917 HG13 VAL 111 HG13 VAL 111 9.025 -0.500 -7.110 918 HG21 VAL 111 HG21 VAL 111 9.806 -3.251 -8.402 919 HG22 VAL 111 HG22 VAL 111 9.869 -3.696 -6.696 920 HG23 VAL 111 HG23 VAL 111 10.299 -2.061 -7.199 921 H ALA 112 HN ALA 112 5.195 -4.339 -6.691 922 HA ALA 112 HA ALA 112 6.273 -6.651 -8.130 923 HB1 ALA 112 HB1 ALA 112 5.767 -7.079 -5.608 924 HB2 ALA 112 HB2 ALA 112 5.275 -8.259 -6.823 925 HB3 ALA 112 HB3 ALA 112 4.091 -7.136 -6.155 926 H TYR 113 HN TYR 113 5.080 -7.315 -9.811 927 HA TYR 113 HA TYR 113 3.579 -7.184 -11.509 928 HB2 TYR 113 HB2 TYR 113 1.719 -7.089 -9.133 929 HB3 TYR 113 HB1 TYR 113 1.178 -7.320 -10.792 930 HD1 TYR 113 HD2 TYR 113 3.054 -8.834 -8.009 931 HD2 TYR 113 HD1 TYR 113 1.454 -9.425 -11.906 932 HE1 TYR 113 HE2 TYR 113 3.433 -11.254 -7.791 933 HE2 TYR 113 HE1 TYR 113 1.828 -11.846 -11.699 934 HH TYR 113 HH TYR 113 3.159 -13.405 -10.457 935 H VAL 114 HN VAL 114 4.743 -4.693 -10.930 936 HA VAL 114 HA VAL 114 2.686 -2.676 -10.877 937 HB VAL 114 HB VAL 114 4.895 -2.168 -9.953 938 HG11 VAL 114 HG11 VAL 114 6.841 -2.519 -11.005 939 HG12 VAL 114 HG12 VAL 114 6.244 -1.875 -12.534 940 HG13 VAL 114 HG13 VAL 114 5.898 -3.546 -12.085 941 HG21 VAL 114 HG21 VAL 114 4.046 -0.572 -12.360 942 HG22 VAL 114 HG22 VAL 114 5.336 -0.048 -11.277 943 HG23 VAL 114 HG23 VAL 114 3.698 -0.259 -10.659 944 H TYR 115 HN TYR 115 1.410 -2.325 -12.596 945 HA TYR 115 HA TYR 115 2.654 -2.446 -15.258 946 HB2 TYR 115 HB2 TYR 115 0.309 -3.889 -14.244 947 HB3 TYR 115 HB1 TYR 115 0.054 -3.086 -15.792 948 HD1 TYR 115 HD2 TYR 115 2.515 -3.350 -17.221 949 HD2 TYR 115 HD1 TYR 115 0.664 -6.139 -14.586 950 HE1 TYR 115 HE2 TYR 115 3.671 -5.197 -18.366 951 HE2 TYR 115 HE1 TYR 115 1.818 -7.989 -15.721 952 HH TYR 115 HH TYR 115 3.741 -8.390 -17.105 953 H LYS 116 HN LYS 116 1.401 -1.339 -16.935 954 HA LYS 116 HA LYS 116 0.442 1.243 -15.941 955 HB2 LYS 116 HB2 LYS 116 1.108 0.767 -18.809 956 HB3 LYS 116 HB1 LYS 116 1.324 2.218 -17.835 957 HG2 LYS 116 HG2 LYS 116 3.103 0.938 -16.575 958 HG3 LYS 116 HG1 LYS 116 3.004 -0.267 -17.860 959 HD2 LYS 116 HD2 LYS 116 4.562 0.964 -18.872 960 HD3 LYS 116 HD1 LYS 116 3.235 2.049 -19.283 961 HE2 LYS 116 HE2 LYS 116 3.922 2.850 -16.747 962 HE3 LYS 116 HE1 LYS 116 5.480 2.427 -17.454 963 HZ1 LYS 116 HZ1 LYS 116 5.231 4.002 -19.129 964 HZ2 LYS 116 HZ2 LYS 116 4.646 4.798 -17.755 965 HZ3 LYS 116 HZ3 LYS 116 3.563 4.159 -18.888 966 HA PRO 117 HA PRO 117 -0.377 3.062 -17.598 967 HB2 PRO 117 HB2 PRO 117 -3.020 4.095 -16.888 968 HB3 PRO 117 HB1 PRO 117 -2.003 4.481 -18.278 969 HG2 PRO 117 HG2 PRO 117 -4.290 3.073 -18.516 970 HG3 PRO 117 HG1 PRO 117 -2.887 2.790 -19.564 971 HD2 PRO 117 HD2 PRO 117 -3.802 1.241 -17.166 972 HD3 PRO 117 HD1 PRO 117 -3.201 0.645 -18.728 973 H ASN 118 HN ASN 118 -1.670 1.169 -15.192 974 HA ASN 118 HA ASN 118 -2.037 2.913 -13.049 975 HB2 ASN 118 HB2 ASN 118 -0.716 0.279 -12.549 976 HB3 ASN 118 HB1 ASN 118 -1.997 1.080 -11.652 977 HD21 ASN 118 HD21 ASN 118 -1.259 -0.689 -14.594 978 HD22 ASN 118 HD22 ASN 118 -2.860 -1.295 -14.851 979 H ASN 119 HN ASN 119 -0.645 4.461 -12.558 980 HA ASN 119 HA ASN 119 1.845 3.888 -11.383 981 HB2 ASN 119 HB2 ASN 119 3.192 5.226 -13.167 982 HB3 ASN 119 HB1 ASN 119 2.862 3.519 -13.444 983 HD21 ASN 119 HD21 ASN 119 2.470 3.191 -15.512 984 HD22 ASN 119 HD22 ASN 119 1.492 4.188 -16.529 985 H THR 120 HN THR 120 -0.536 5.435 -10.882 986 HA THR 120 HA THR 120 -0.236 8.177 -11.263 987 HB THR 120 HB THR 120 -1.346 7.453 -8.646 988 HG1 THR 120 HG1 THR 120 -2.163 5.644 -9.348 989 HG21 THR 120 HG21 THR 120 -3.192 8.726 -9.303 990 HG22 THR 120 HG22 THR 120 -2.813 8.550 -11.016 991 HG23 THR 120 HG23 THR 120 -1.795 9.557 -9.987 992 H HIS 121 HN HIS 121 0.966 6.102 -8.661 993 HA HIS 121 HA HIS 121 2.756 8.295 -7.843 994 HB2 HIS 121 HB2 HIS 121 1.398 6.205 -6.136 995 HB3 HIS 121 HB1 HIS 121 2.712 7.223 -5.557 996 HD1 HIS 121 HD1 HIS 121 1.720 9.890 -6.888 997 HD2 HIS 121 HD2 HIS 121 -0.620 7.304 -4.630 998 HE1 HIS 121 HE1 HIS 121 -0.177 11.290 -6.014 999 HE2 HIS 121 HE2 HIS 121 -1.624 9.686 -4.717 1000 H GLU 122 HN GLU 122 3.116 6.087 -9.803 1001 HA GLU 122 HA GLU 122 4.713 4.032 -8.810 1002 HB2 GLU 122 HB2 GLU 122 3.803 4.049 -11.086 1003 HB3 GLU 122 HB1 GLU 122 4.858 5.390 -11.507 1004 HG2 GLU 122 HG2 GLU 122 5.690 3.244 -12.340 1005 HG3 GLU 122 HG1 GLU 122 6.808 4.004 -11.208 1006 H GLN 123 HN GLN 123 5.658 7.231 -10.042 1007 HA GLN 123 HA GLN 123 8.408 6.966 -9.881 1008 HB2 GLN 123 HB2 GLN 123 6.706 9.410 -9.366 1009 HB3 GLN 123 HB1 GLN 123 8.448 9.445 -9.598 1010 HG2 GLN 123 HG2 GLN 123 6.382 8.573 -11.604 1011 HG3 GLN 123 HG1 GLN 123 7.339 10.053 -11.642 1012 HE21 GLN 123 HE21 GLN 123 9.827 9.296 -11.151 1013 HE22 GLN 123 HE22 GLN 123 10.393 8.168 -12.331 1014 H LEU 124 HN LEU 124 6.099 7.236 -7.322 1015 HA LEU 124 HA LEU 124 8.022 8.055 -5.336 1016 HB2 LEU 124 HB2 LEU 124 5.459 8.497 -5.410 1017 HB3 LEU 124 HB1 LEU 124 5.336 6.898 -4.700 1018 HG LEU 124 HG LEU 124 6.876 7.719 -2.864 1019 HD11 LEU 124 HD11 LEU 124 7.582 9.725 -4.313 1020 HD12 LEU 124 HD12 LEU 124 7.325 9.981 -2.588 1021 HD13 LEU 124 HD13 LEU 124 6.088 10.469 -3.746 1022 HD21 LEU 124 HD21 LEU 124 4.171 7.772 -3.091 1023 HD22 LEU 124 HD22 LEU 124 4.516 9.453 -2.684 1024 HD23 LEU 124 HD23 LEU 124 5.060 8.157 -1.618 1025 H LEU 125 HN LEU 125 6.164 5.081 -5.984 1026 HA LEU 125 HA LEU 125 7.590 3.605 -3.971 1027 HB2 LEU 125 HB2 LEU 125 5.624 2.770 -6.096 1028 HB3 LEU 125 HB1 LEU 125 6.333 1.652 -4.945 1029 HG LEU 125 HG LEU 125 5.356 3.489 -3.234 1030 HD11 LEU 125 HD11 LEU 125 4.172 4.976 -4.451 1031 HD12 LEU 125 HD12 LEU 125 2.925 3.735 -4.330 1032 HD13 LEU 125 HD13 LEU 125 3.917 3.849 -5.784 1033 HD21 LEU 125 HD21 LEU 125 3.316 1.592 -4.175 1034 HD22 LEU 125 HD22 LEU 125 4.014 1.809 -2.571 1035 HD23 LEU 125 HD23 LEU 125 4.887 0.885 -3.794 1036 H ARG 126 HN ARG 126 7.718 3.894 -7.471 1037 HA ARG 126 HA ARG 126 9.316 1.720 -8.102 1038 HB2 ARG 126 HB2 ARG 126 8.200 3.425 -9.658 1039 HB3 ARG 126 HB1 ARG 126 9.637 4.408 -9.418 1040 HG2 ARG 126 HG2 ARG 126 10.761 2.042 -10.083 1041 HG3 ARG 126 HG1 ARG 126 9.258 1.968 -11.005 1042 HD2 ARG 126 HD2 ARG 126 9.943 4.442 -11.635 1043 HD3 ARG 126 HD1 ARG 126 11.555 3.842 -11.251 1044 HE ARG 126 HE ARG 126 10.261 2.033 -12.979 1045 HH11 ARG 126 HH11 ARG 126 11.697 5.215 -12.980 1046 HH12 ARG 126 HH12 ARG 126 12.129 5.155 -14.656 1047 HH21 ARG 126 HH21 ARG 126 10.830 1.954 -15.184 1048 HH22 ARG 126 HH22 ARG 126 11.637 3.306 -15.906 1049 H LYS 127 HN LYS 127 10.327 4.992 -7.156 1050 HA LYS 127 HA LYS 127 13.119 4.272 -7.174 1051 HB2 LYS 127 HB2 LYS 127 12.033 6.743 -5.861 1052 HB3 LYS 127 HB1 LYS 127 13.574 6.512 -6.675 1053 HG2 LYS 127 HG2 LYS 127 10.932 6.479 -8.103 1054 HG3 LYS 127 HG1 LYS 127 11.908 7.934 -7.891 1055 HD2 LYS 127 HD2 LYS 127 13.809 6.575 -8.952 1056 HD3 LYS 127 HD1 LYS 127 12.545 5.454 -9.461 1057 HE2 LYS 127 HE2 LYS 127 12.692 6.844 -11.291 1058 HE3 LYS 127 HE1 LYS 127 11.392 7.604 -10.375 1059 HZ1 LYS 127 HZ1 LYS 127 14.081 8.521 -9.768 1060 HZ2 LYS 127 HZ2 LYS 127 12.645 9.401 -9.922 1061 HZ3 LYS 127 HZ3 LYS 127 13.497 8.927 -11.303 1062 H SER 128 HN SER 128 10.611 4.837 -4.764 1063 HA SER 128 HA SER 128 12.097 4.775 -2.439 1064 HB2 SER 128 HB2 SER 128 9.885 5.296 -2.071 1065 HB3 SER 128 HB1 SER 128 9.299 4.048 -3.166 1066 HG SER 128 HG SER 128 9.160 3.816 -0.693 1067 H GLU 129 HN GLU 129 10.944 2.084 -4.413 1068 HA GLU 129 HA GLU 129 11.689 0.037 -2.599 1069 HB2 GLU 129 HB2 GLU 129 10.075 -0.438 -4.340 1070 HB3 GLU 129 HB1 GLU 129 11.243 -0.020 -5.589 1071 HG2 GLU 129 HG2 GLU 129 10.933 -2.440 -5.350 1072 HG3 GLU 129 HG1 GLU 129 12.592 -1.935 -5.036 1073 H ALA 130 HN ALA 130 13.219 1.036 -5.666 1074 HA ALA 130 HA ALA 130 15.558 -0.478 -5.314 1075 HB1 ALA 130 HB1 ALA 130 14.501 0.981 -7.351 1076 HB2 ALA 130 HB2 ALA 130 16.127 0.300 -7.337 1077 HB3 ALA 130 HB3 ALA 130 15.873 1.982 -6.872 1078 H GLN 131 HN GLN 131 14.687 2.741 -4.249 1079 HA GLN 131 HA GLN 131 17.210 3.764 -3.665 1080 HB2 GLN 131 HB2 GLN 131 14.447 4.310 -2.758 1081 HB3 GLN 131 HB1 GLN 131 15.728 4.880 -1.701 1082 HG2 GLN 131 HG2 GLN 131 16.406 5.583 -4.353 1083 HG3 GLN 131 HG1 GLN 131 14.731 6.049 -4.078 1084 HE21 GLN 131 HE21 GLN 131 17.908 6.961 -3.736 1085 HE22 GLN 131 HE22 GLN 131 17.703 8.242 -2.594 1086 H ALA 132 HN ALA 132 14.987 1.956 -1.569 1087 HA ALA 132 HA ALA 132 16.914 1.799 0.562 1088 HB1 ALA 132 HB1 ALA 132 14.164 0.678 0.152 1089 HB2 ALA 132 HB2 ALA 132 14.705 1.893 1.309 1090 HB3 ALA 132 HB3 ALA 132 15.159 0.204 1.528 1091 H LYS 133 HN LYS 133 16.054 -0.107 -2.194 1092 HA LYS 133 HA LYS 133 16.898 -2.644 -1.357 1093 HB2 LYS 133 HB2 LYS 133 15.822 -1.590 -3.643 1094 HB3 LYS 133 HB1 LYS 133 17.457 -1.973 -4.164 1095 HG2 LYS 133 HG2 LYS 133 16.966 -4.124 -4.322 1096 HG3 LYS 133 HG1 LYS 133 16.377 -4.161 -2.659 1097 HD2 LYS 133 HD2 LYS 133 14.262 -3.033 -3.659 1098 HD3 LYS 133 HD1 LYS 133 14.868 -3.661 -5.193 1099 HE2 LYS 133 HE2 LYS 133 15.090 -5.889 -3.798 1100 HE3 LYS 133 HE1 LYS 133 13.847 -5.123 -2.808 1101 HZ1 LYS 133 HZ1 LYS 133 13.013 -6.581 -4.641 1102 HZ2 LYS 133 HZ2 LYS 133 13.604 -5.444 -5.745 1103 HZ3 LYS 133 HZ3 LYS 133 12.392 -5.007 -4.649 1104 H LYS 134 HN LYS 134 18.683 -0.161 -3.181 1105 HA LYS 134 HA LYS 134 21.107 -1.510 -3.367 1106 HB2 LYS 134 HB2 LYS 134 22.014 0.491 -4.138 1107 HB3 LYS 134 HB1 LYS 134 20.307 0.647 -4.506 1108 HG2 LYS 134 HG2 LYS 134 20.170 2.520 -3.350 1109 HG3 LYS 134 HG1 LYS 134 20.817 1.739 -1.911 1110 HD2 LYS 134 HD2 LYS 134 22.722 2.452 -4.072 1111 HD3 LYS 134 HD1 LYS 134 22.055 3.764 -3.100 1112 HE2 LYS 134 HE2 LYS 134 22.806 2.613 -1.062 1113 HE3 LYS 134 HE1 LYS 134 23.508 1.336 -2.056 1114 HZ1 LYS 134 HZ1 LYS 134 24.853 3.163 -3.128 1115 HZ2 LYS 134 HZ2 LYS 134 25.261 2.778 -1.533 1116 HZ3 LYS 134 HZ3 LYS 134 24.353 4.166 -1.860 1117 H GLU 135 HN GLU 135 19.784 0.386 -0.763 1118 HA GLU 135 HA GLU 135 22.277 0.132 0.758 1119 HB2 GLU 135 HB2 GLU 135 20.571 1.497 2.416 1120 HB3 GLU 135 HB1 GLU 135 21.725 2.237 1.312 1121 HG2 GLU 135 HG2 GLU 135 20.053 2.633 -0.313 1122 HG3 GLU 135 HG1 GLU 135 18.895 1.604 0.527 1123 H LYS 136 HN LYS 136 19.398 -1.547 0.383 1124 HA LYS 136 HA LYS 136 18.213 -3.020 1.683 1125 HB2 LYS 136 HB2 LYS 136 20.997 -3.605 2.709 1126 HB3 LYS 136 HB1 LYS 136 19.612 -4.687 2.800 1127 HG2 LYS 136 HG2 LYS 136 19.537 -4.600 0.280 1128 HG3 LYS 136 HG1 LYS 136 21.106 -3.797 0.352 1129 HD2 LYS 136 HD2 LYS 136 21.779 -5.978 0.137 1130 HD3 LYS 136 HD1 LYS 136 21.699 -5.854 1.896 1131 HE2 LYS 136 HE2 LYS 136 19.868 -7.188 2.045 1132 HE3 LYS 136 HE1 LYS 136 19.213 -6.645 0.500 1133 HZ1 LYS 136 HZ1 LYS 136 21.540 -8.469 0.786 1134 HZ2 LYS 136 HZ2 LYS 136 20.768 -8.034 -0.654 1135 HZ3 LYS 136 HZ3 LYS 136 19.956 -8.982 0.487 1136 H LEU 137 HN LEU 137 17.497 -0.915 2.762 1137 HA LEU 137 HA LEU 137 18.372 0.102 5.115 1138 HB2 LEU 137 HB2 LEU 137 15.699 -0.165 3.867 1139 HB3 LEU 137 HB1 LEU 137 15.721 0.254 5.571 1140 HG LEU 137 HG LEU 137 17.020 1.796 3.327 1141 HD11 LEU 137 HD11 LEU 137 15.340 3.491 4.617 1142 HD12 LEU 137 HD12 LEU 137 14.457 1.969 4.745 1143 HD13 LEU 137 HD13 LEU 137 14.927 2.586 3.160 1144 HD21 LEU 137 HD21 LEU 137 17.369 1.885 6.259 1145 HD22 LEU 137 HD22 LEU 137 17.178 3.436 5.440 1146 HD23 LEU 137 HD23 LEU 137 18.478 2.342 4.967 1147 H ASN 138 HN ASN 138 15.396 -1.681 5.652 1148 HA ASN 138 HA ASN 138 16.793 -3.229 7.730 1149 HB2 ASN 138 HB2 ASN 138 14.778 -3.118 9.091 1150 HB3 ASN 138 HB1 ASN 138 15.315 -1.495 8.674 1151 HD21 ASN 138 HD21 ASN 138 13.908 -0.157 7.768 1152 HD22 ASN 138 HD22 ASN 138 12.356 -0.601 7.151 1153 H ILE 139 HN ILE 139 16.431 -5.356 7.883 1154 HA ILE 139 HA ILE 139 16.000 -7.458 7.159 1155 HB ILE 139 HB ILE 139 13.680 -8.101 7.059 1156 HG12 ILE 139 HG12 ILE 139 12.859 -5.210 7.204 1157 HG13 ILE 139 HG11 ILE 139 13.049 -6.020 5.653 1158 HG21 ILE 139 HG21 ILE 139 12.891 -6.989 9.191 1159 HG22 ILE 139 HG22 ILE 139 14.359 -6.015 9.112 1160 HG23 ILE 139 HG23 ILE 139 14.470 -7.770 9.253 1161 HD11 ILE 139 HD11 ILE 139 11.009 -6.423 7.769 1162 HD12 ILE 139 HD12 ILE 139 11.465 -7.796 6.760 1163 HD13 ILE 139 HD13 ILE 139 10.825 -6.330 6.018 1164 H TRP 140 HN TRP 140 16.626 -5.442 4.965 1165 HA TRP 140 HA TRP 140 15.125 -6.358 2.693 1166 HB2 TRP 140 HB2 TRP 140 17.606 -4.661 2.969 1167 HB3 TRP 140 HB1 TRP 140 16.961 -5.138 1.399 1168 HD1 TRP 140 HD1 TRP 140 15.937 -3.165 4.526 1169 HE1 TRP 140 HE1 TRP 140 14.217 -1.381 3.837 1170 HE3 TRP 140 HE3 TRP 140 15.349 -4.480 -0.366 1171 HZ2 TRP 140 HZ2 TRP 140 12.804 -0.633 1.524 1172 HZ3 TRP 140 HZ3 TRP 140 13.783 -3.183 -1.756 1173 HH2 TRP 140 HH2 TRP 140 12.536 -1.298 -0.829 Start of MODEL 13 1 H1 ALA 1 HT1 ALA 1 -16.056 11.355 4.267 2 H2 ALA 1 HT2 ALA 1 -17.153 11.111 2.971 3 H3 ALA 1 HT3 ALA 1 -17.447 12.345 4.126 4 HA ALA 1 HA ALA 1 -15.234 13.270 3.412 5 HB1 ALA 1 HB1 ALA 1 -14.208 11.758 2.063 6 HB2 ALA 1 HB2 ALA 1 -15.078 12.669 0.828 7 HB3 ALA 1 HB3 ALA 1 -15.726 11.137 1.415 8 H THR 2 HN THR 2 -17.079 14.725 3.928 9 HA THR 2 HA THR 2 -18.487 15.592 1.490 10 HB THR 2 HB THR 2 -20.074 16.715 3.107 11 HG1 THR 2 HG1 THR 2 -18.519 16.523 4.895 12 HG21 THR 2 HG21 THR 2 -20.360 14.348 2.075 13 HG22 THR 2 HG22 THR 2 -21.420 14.880 3.381 14 HG23 THR 2 HG23 THR 2 -20.066 13.803 3.727 15 H SER 3 HN SER 3 -17.777 17.409 0.609 16 HA SER 3 HA SER 3 -16.812 19.562 2.341 17 HB2 SER 3 HB2 SER 3 -14.738 18.626 1.734 18 HB3 SER 3 HB1 SER 3 -15.274 18.280 0.091 19 HG SER 3 HG SER 3 -14.853 20.863 1.193 20 H THR 4 HN THR 4 -16.660 19.188 -1.181 21 HA THR 4 HA THR 4 -19.015 20.479 -1.875 22 HB THR 4 HB THR 4 -18.369 22.480 -0.821 23 HG1 THR 4 HG1 THR 4 -17.437 22.819 -3.472 24 HG21 THR 4 HG21 THR 4 -15.821 22.990 -2.118 25 HG22 THR 4 HG22 THR 4 -15.777 21.617 -1.014 26 HG23 THR 4 HG23 THR 4 -16.304 23.197 -0.435 27 H LYS 5 HN LYS 5 -15.559 20.673 -2.744 28 HA LYS 5 HA LYS 5 -16.257 19.597 -5.386 29 HB2 LYS 5 HB2 LYS 5 -14.344 21.124 -6.233 30 HB3 LYS 5 HB1 LYS 5 -15.930 21.829 -5.953 31 HG2 LYS 5 HG2 LYS 5 -15.209 23.105 -4.237 32 HG3 LYS 5 HG1 LYS 5 -14.060 21.891 -3.674 33 HD2 LYS 5 HD2 LYS 5 -12.466 22.507 -5.315 34 HD3 LYS 5 HD1 LYS 5 -13.647 23.474 -6.199 35 HE2 LYS 5 HE2 LYS 5 -13.706 24.628 -3.724 36 HE3 LYS 5 HE1 LYS 5 -12.012 24.159 -3.866 37 HZ1 LYS 5 HZ1 LYS 5 -13.506 26.170 -5.328 38 HZ2 LYS 5 HZ2 LYS 5 -12.432 25.251 -6.257 39 HZ3 LYS 5 HZ3 LYS 5 -11.864 26.121 -4.922 40 H LYS 6 HN LYS 6 -15.215 17.754 -5.698 41 HA LYS 6 HA LYS 6 -12.764 17.214 -4.201 42 HB2 LYS 6 HB2 LYS 6 -14.857 15.639 -4.433 43 HB3 LYS 6 HB1 LYS 6 -14.102 15.194 -5.957 44 HG2 LYS 6 HG2 LYS 6 -13.067 13.647 -4.716 45 HG3 LYS 6 HG1 LYS 6 -11.996 14.979 -4.274 46 HD2 LYS 6 HD2 LYS 6 -14.483 14.629 -2.691 47 HD3 LYS 6 HD1 LYS 6 -13.193 13.449 -2.454 48 HE2 LYS 6 HE2 LYS 6 -11.783 14.973 -1.520 49 HE3 LYS 6 HE1 LYS 6 -12.431 16.313 -2.464 50 HZ1 LYS 6 HZ1 LYS 6 -14.526 15.754 -0.943 51 HZ2 LYS 6 HZ2 LYS 6 -13.325 16.852 -0.483 52 HZ3 LYS 6 HZ3 LYS 6 -13.293 15.269 0.109 53 H LEU 7 HN LEU 7 -10.852 16.512 -5.189 54 HA LEU 7 HA LEU 7 -10.521 17.483 -7.924 55 HB2 LEU 7 HB2 LEU 7 -8.712 17.008 -5.613 56 HB3 LEU 7 HB1 LEU 7 -8.027 16.855 -7.220 57 HG LEU 7 HG LEU 7 -8.959 19.188 -7.676 58 HD11 LEU 7 HD11 LEU 7 -9.151 19.194 -4.668 59 HD12 LEU 7 HD12 LEU 7 -10.510 19.267 -5.789 60 HD13 LEU 7 HD13 LEU 7 -9.347 20.591 -5.726 61 HD21 LEU 7 HD21 LEU 7 -7.070 20.262 -6.390 62 HD22 LEU 7 HD22 LEU 7 -6.622 18.923 -7.446 63 HD23 LEU 7 HD23 LEU 7 -6.748 18.670 -5.705 64 H HIS 8 HN HIS 8 -9.347 14.684 -6.045 65 HA HIS 8 HA HIS 8 -10.189 12.818 -8.035 66 HB2 HIS 8 HB2 HIS 8 -7.846 11.999 -8.539 67 HB3 HIS 8 HB1 HIS 8 -8.291 13.533 -9.279 68 HD1 HIS 8 HD1 HIS 8 -7.057 15.643 -8.468 69 HD2 HIS 8 HD2 HIS 8 -5.842 12.147 -6.578 70 HE1 HIS 8 HE1 HIS 8 -4.941 16.239 -7.247 71 HE2 HIS 8 HE2 HIS 8 -4.180 14.089 -6.178 72 H LYS 9 HN LYS 9 -8.041 13.442 -5.290 73 HA LYS 9 HA LYS 9 -8.123 10.707 -4.408 74 HB2 LYS 9 HB2 LYS 9 -6.774 11.472 -2.539 75 HB3 LYS 9 HB1 LYS 9 -6.133 12.118 -4.042 76 HG2 LYS 9 HG2 LYS 9 -8.069 13.845 -2.659 77 HG3 LYS 9 HG1 LYS 9 -6.544 13.576 -1.812 78 HD2 LYS 9 HD2 LYS 9 -6.279 14.160 -4.679 79 HD3 LYS 9 HD1 LYS 9 -6.943 15.478 -3.713 80 HE2 LYS 9 HE2 LYS 9 -4.890 14.681 -2.140 81 HE3 LYS 9 HE1 LYS 9 -4.238 14.320 -3.738 82 HZ1 LYS 9 HZ1 LYS 9 -5.499 16.929 -3.315 83 HZ2 LYS 9 HZ2 LYS 9 -4.208 16.507 -4.324 84 HZ3 LYS 9 HZ3 LYS 9 -3.959 16.674 -2.659 85 H GLU 10 HN GLU 10 -8.836 10.150 -2.222 86 HA GLU 10 HA GLU 10 -10.852 11.820 -0.999 87 HB2 GLU 10 HB2 GLU 10 -11.686 10.052 -2.960 88 HB3 GLU 10 HB1 GLU 10 -11.975 9.167 -1.469 89 HG2 GLU 10 HG2 GLU 10 -12.969 11.645 -0.879 90 HG3 GLU 10 HG1 GLU 10 -13.364 11.471 -2.587 91 HA PRO 11 HA PRO 11 -9.096 9.605 2.446 92 HB2 PRO 11 HB2 PRO 11 -10.580 10.685 4.414 93 HB3 PRO 11 HB1 PRO 11 -9.325 11.605 3.577 94 HG2 PRO 11 HG2 PRO 11 -12.289 11.634 3.163 95 HG3 PRO 11 HG1 PRO 11 -11.153 12.996 3.217 96 HD2 PRO 11 HD2 PRO 11 -12.099 11.918 0.895 97 HD3 PRO 11 HD1 PRO 11 -10.518 12.712 1.031 98 H ALA 12 HN ALA 12 -9.811 8.176 4.223 99 HA ALA 12 HA ALA 12 -12.487 7.200 4.274 100 HB1 ALA 12 HB1 ALA 12 -11.903 6.083 2.255 101 HB2 ALA 12 HB2 ALA 12 -11.900 4.877 3.541 102 HB3 ALA 12 HB3 ALA 12 -10.375 5.525 2.938 103 H THR 13 HN THR 13 -12.707 5.305 5.755 104 HA THR 13 HA THR 13 -10.625 5.412 7.835 105 HB THR 13 HB THR 13 -13.478 4.589 8.319 106 HG1 THR 13 HG1 THR 13 -13.501 6.683 7.414 107 HG21 THR 13 HG21 THR 13 -12.396 6.075 10.443 108 HG22 THR 13 HG22 THR 13 -11.177 4.892 9.969 109 HG23 THR 13 HG23 THR 13 -12.801 4.360 10.405 110 H LEU 14 HN LEU 14 -10.071 3.484 8.927 111 HA LEU 14 HA LEU 14 -10.092 1.164 7.248 112 HB2 LEU 14 HB2 LEU 14 -8.528 2.116 9.375 113 HB3 LEU 14 HB1 LEU 14 -9.245 0.625 9.958 114 HG LEU 14 HG LEU 14 -6.977 0.402 8.888 115 HD11 LEU 14 HD11 LEU 14 -7.473 -1.727 8.424 116 HD12 LEU 14 HD12 LEU 14 -8.674 -1.285 7.210 117 HD13 LEU 14 HD13 LEU 14 -9.110 -1.295 8.918 118 HD21 LEU 14 HD21 LEU 14 -7.951 0.263 6.189 119 HD22 LEU 14 HD22 LEU 14 -6.579 1.159 6.839 120 HD23 LEU 14 HD23 LEU 14 -8.186 1.884 6.841 121 H ILE 15 HN ILE 15 -11.896 -0.008 7.053 122 HA ILE 15 HA ILE 15 -13.881 -0.190 9.090 123 HB ILE 15 HB ILE 15 -13.514 -1.956 6.662 124 HG12 ILE 15 HG12 ILE 15 -13.714 0.461 6.116 125 HG13 ILE 15 HG11 ILE 15 -15.078 -0.485 5.533 126 HG21 ILE 15 HG21 ILE 15 -14.978 -2.943 8.339 127 HG22 ILE 15 HG22 ILE 15 -15.902 -2.436 6.925 128 HG23 ILE 15 HG23 ILE 15 -15.934 -1.461 8.394 129 HD11 ILE 15 HD11 ILE 15 -16.180 1.292 6.413 130 HD12 ILE 15 HD12 ILE 15 -14.963 1.574 7.659 131 HD13 ILE 15 HD13 ILE 15 -16.121 0.256 7.839 132 H LYS 16 HN LYS 16 -11.380 -2.371 7.858 133 HA LYS 16 HA LYS 16 -10.945 -3.554 10.390 134 HB2 LYS 16 HB2 LYS 16 -12.936 -4.799 8.658 135 HB3 LYS 16 HB1 LYS 16 -11.630 -5.901 9.074 136 HG2 LYS 16 HG2 LYS 16 -12.876 -4.315 11.254 137 HG3 LYS 16 HG1 LYS 16 -13.780 -5.670 10.575 138 HD2 LYS 16 HD2 LYS 16 -12.639 -6.821 12.161 139 HD3 LYS 16 HD1 LYS 16 -11.403 -6.858 10.903 140 HE2 LYS 16 HE2 LYS 16 -10.033 -5.927 12.394 141 HE3 LYS 16 HE1 LYS 16 -10.967 -4.447 12.186 142 HZ1 LYS 16 HZ1 LYS 16 -10.941 -6.326 14.396 143 HZ2 LYS 16 HZ2 LYS 16 -12.467 -5.738 13.964 144 HZ3 LYS 16 HZ3 LYS 16 -11.238 -4.660 14.393 145 H ALA 17 HN ALA 17 -8.911 -4.276 10.436 146 HA ALA 17 HA ALA 17 -7.357 -4.244 8.034 147 HB1 ALA 17 HB1 ALA 17 -6.136 -5.279 10.507 148 HB2 ALA 17 HB2 ALA 17 -6.772 -3.636 10.582 149 HB3 ALA 17 HB3 ALA 17 -5.554 -4.057 9.377 150 H ILE 18 HN ILE 18 -6.806 -5.914 6.787 151 HA ILE 18 HA ILE 18 -7.654 -8.591 7.582 152 HB ILE 18 HB ILE 18 -6.363 -8.019 4.945 153 HG12 ILE 18 HG12 ILE 18 -8.388 -6.389 5.740 154 HG13 ILE 18 HG11 ILE 18 -8.084 -6.835 4.070 155 HG21 ILE 18 HG21 ILE 18 -8.394 -9.962 5.985 156 HG22 ILE 18 HG22 ILE 18 -6.816 -10.285 5.267 157 HG23 ILE 18 HG23 ILE 18 -8.143 -9.709 4.258 158 HD11 ILE 18 HD11 ILE 18 -9.864 -8.299 4.006 159 HD12 ILE 18 HD12 ILE 18 -10.474 -7.010 5.043 160 HD13 ILE 18 HD13 ILE 18 -9.887 -8.512 5.757 161 H ASP 19 HN ASP 19 -4.802 -7.399 5.804 162 HA ASP 19 HA ASP 19 -3.054 -8.743 7.708 163 HB2 ASP 19 HB2 ASP 19 -3.420 -9.625 4.867 164 HB3 ASP 19 HB1 ASP 19 -1.842 -9.789 5.631 165 H GLY 20 HN GLY 20 -1.878 -8.111 4.503 166 HA2 GLY 20 HA2 GLY 20 -0.686 -5.583 5.464 167 HA3 GLY 20 HA1 GLY 20 0.243 -6.774 4.561 168 H ASP 21 HN ASP 21 -0.478 -7.255 2.356 169 HA ASP 21 HA ASP 21 -0.951 -4.887 0.884 170 HB2 ASP 21 HB2 ASP 21 -0.978 -6.359 -1.083 171 HB3 ASP 21 HB1 ASP 21 0.377 -6.738 -0.024 172 H THR 22 HN THR 22 -3.062 -6.887 2.567 173 HA THR 22 HA THR 22 -5.332 -5.927 0.959 174 HB THR 22 HB THR 22 -5.684 -8.376 2.599 175 HG1 THR 22 HG1 THR 22 -4.173 -8.304 0.207 176 HG21 THR 22 HG21 THR 22 -7.529 -7.485 1.265 177 HG22 THR 22 HG22 THR 22 -7.049 -9.100 0.743 178 HG23 THR 22 HG23 THR 22 -6.560 -7.688 -0.195 179 H VAL 23 HN VAL 23 -6.732 -4.696 2.026 180 HA VAL 23 HA VAL 23 -7.234 -5.051 4.852 181 HB VAL 23 HB VAL 23 -6.815 -2.597 5.317 182 HG11 VAL 23 HG11 VAL 23 -4.480 -2.930 5.830 183 HG12 VAL 23 HG12 VAL 23 -4.382 -4.256 4.673 184 HG13 VAL 23 HG13 VAL 23 -5.365 -4.426 6.127 185 HG21 VAL 23 HG21 VAL 23 -4.989 -2.733 2.933 186 HG22 VAL 23 HG22 VAL 23 -5.419 -1.328 3.909 187 HG23 VAL 23 HG23 VAL 23 -6.617 -2.058 2.839 188 H LYS 24 HN LYS 24 -9.220 -4.220 5.486 189 HA LYS 24 HA LYS 24 -10.968 -3.420 3.308 190 HB2 LYS 24 HB2 LYS 24 -11.284 -4.767 5.830 191 HB3 LYS 24 HB1 LYS 24 -12.401 -3.412 5.740 192 HG2 LYS 24 HG2 LYS 24 -12.267 -5.080 3.327 193 HG3 LYS 24 HG1 LYS 24 -12.896 -5.883 4.766 194 HD2 LYS 24 HD2 LYS 24 -14.472 -3.963 5.050 195 HD3 LYS 24 HD1 LYS 24 -13.920 -3.351 3.490 196 HE2 LYS 24 HE2 LYS 24 -15.562 -4.583 2.607 197 HE3 LYS 24 HE1 LYS 24 -14.521 -5.969 2.932 198 HZ1 LYS 24 HZ1 LYS 24 -16.176 -5.071 5.145 199 HZ2 LYS 24 HZ2 LYS 24 -15.800 -6.641 4.641 200 HZ3 LYS 24 HZ3 LYS 24 -17.004 -5.762 3.841 201 H LEU 25 HN LEU 25 -11.788 -1.414 3.001 202 HA LEU 25 HA LEU 25 -11.325 0.598 5.090 203 HB2 LEU 25 HB2 LEU 25 -10.328 0.555 2.323 204 HB3 LEU 25 HB1 LEU 25 -11.020 2.080 2.841 205 HG LEU 25 HG LEU 25 -8.958 0.731 4.540 206 HD11 LEU 25 HD11 LEU 25 -7.442 2.463 3.176 207 HD12 LEU 25 HD12 LEU 25 -8.553 1.978 1.894 208 HD13 LEU 25 HD13 LEU 25 -7.595 0.762 2.737 209 HD21 LEU 25 HD21 LEU 25 -10.093 3.462 4.199 210 HD22 LEU 25 HD22 LEU 25 -8.441 3.289 4.790 211 HD23 LEU 25 HD23 LEU 25 -9.776 2.548 5.672 212 H MET 26 HN MET 26 -12.685 2.488 4.949 213 HA MET 26 HA MET 26 -15.363 1.793 4.105 214 HB2 MET 26 HB2 MET 26 -14.632 2.987 6.299 215 HB3 MET 26 HB1 MET 26 -14.598 4.435 5.303 216 HG2 MET 26 HG2 MET 26 -16.866 4.462 5.011 217 HG3 MET 26 HG1 MET 26 -17.028 2.723 5.250 218 HE1 MET 26 HE1 MET 26 -18.556 2.259 6.590 219 HE2 MET 26 HE2 MET 26 -19.353 3.597 7.418 220 HE3 MET 26 HE3 MET 26 -18.496 2.369 8.350 221 H TYR 27 HN TYR 27 -16.076 2.212 2.143 222 HA TYR 27 HA TYR 27 -15.280 4.719 0.831 223 HB2 TYR 27 HB2 TYR 27 -14.043 2.779 -0.143 224 HB3 TYR 27 HB1 TYR 27 -15.589 2.063 -0.577 225 HD1 TYR 27 HD1 TYR 27 -13.818 5.323 -0.980 226 HD2 TYR 27 HD2 TYR 27 -16.281 2.351 -2.756 227 HE1 TYR 27 HE1 TYR 27 -13.782 6.573 -3.099 228 HE2 TYR 27 HE2 TYR 27 -16.255 3.587 -4.881 229 HH TYR 27 HH TYR 27 -15.570 6.619 -5.237 230 H LYS 28 HN LYS 28 -16.987 5.929 0.369 231 HA LYS 28 HA LYS 28 -19.115 6.583 -0.087 232 HB2 LYS 28 HB2 LYS 28 -19.212 3.817 -1.289 233 HB3 LYS 28 HB1 LYS 28 -20.477 5.022 -1.485 234 HG2 LYS 28 HG2 LYS 28 -18.967 6.489 -2.656 235 HG3 LYS 28 HG1 LYS 28 -17.621 5.386 -2.360 236 HD2 LYS 28 HD2 LYS 28 -18.416 5.084 -4.618 237 HD3 LYS 28 HD1 LYS 28 -18.813 3.652 -3.668 238 HE2 LYS 28 HE2 LYS 28 -20.889 5.718 -3.659 239 HE3 LYS 28 HE1 LYS 28 -20.563 5.027 -5.248 240 HZ1 LYS 28 HZ1 LYS 28 -21.396 3.039 -4.651 241 HZ2 LYS 28 HZ2 LYS 28 -22.236 3.943 -3.494 242 HZ3 LYS 28 HZ3 LYS 28 -20.817 3.130 -3.063 243 H GLY 29 HN GLY 29 -18.699 5.734 2.498 244 HA2 GLY 29 HA2 GLY 29 -19.848 5.117 4.388 245 HA3 GLY 29 HA1 GLY 29 -21.308 5.268 3.420 246 H GLN 30 HN GLN 30 -18.943 3.075 2.260 247 HA GLN 30 HA GLN 30 -20.292 0.792 3.514 248 HB2 GLN 30 HB2 GLN 30 -20.904 -0.187 1.541 249 HB3 GLN 30 HB1 GLN 30 -20.993 1.492 1.032 250 HG2 GLN 30 HG2 GLN 30 -19.690 0.904 -0.658 251 HG3 GLN 30 HG1 GLN 30 -18.375 0.825 0.510 252 HE21 GLN 30 HE21 GLN 30 -17.329 -0.775 -0.683 253 HE22 GLN 30 HE22 GLN 30 -17.891 -2.408 -0.715 254 HA PRO 31 HA PRO 31 -16.168 -0.699 3.881 255 HB2 PRO 31 HB2 PRO 31 -16.570 -3.242 4.458 256 HB3 PRO 31 HB1 PRO 31 -17.233 -1.976 5.507 257 HG2 PRO 31 HG2 PRO 31 -18.627 -3.590 3.401 258 HG3 PRO 31 HG1 PRO 31 -19.170 -3.190 5.042 259 HD2 PRO 31 HD2 PRO 31 -19.923 -1.811 2.768 260 HD3 PRO 31 HD1 PRO 31 -19.941 -1.132 4.407 261 H MET 32 HN MET 32 -14.822 -0.805 2.224 262 HA MET 32 HA MET 32 -15.275 -2.843 0.147 263 HB2 MET 32 HB2 MET 32 -15.402 -0.334 -0.482 264 HB3 MET 32 HB1 MET 32 -13.654 -0.350 -0.291 265 HG2 MET 32 HG2 MET 32 -13.892 -0.723 -2.541 266 HG3 MET 32 HG1 MET 32 -13.747 -2.365 -1.915 267 HE1 MET 32 HE1 MET 32 -16.662 -1.304 -4.881 268 HE2 MET 32 HE2 MET 32 -14.969 -1.796 -4.856 269 HE3 MET 32 HE3 MET 32 -15.432 -0.200 -4.266 270 H THR 33 HN THR 33 -13.437 -3.952 -0.647 271 HA THR 33 HA THR 33 -11.345 -4.222 1.345 272 HB THR 33 HB THR 33 -11.623 -5.754 -1.242 273 HG1 THR 33 HG1 THR 33 -12.789 -7.272 0.014 274 HG21 THR 33 HG21 THR 33 -10.507 -7.543 -0.035 275 HG22 THR 33 HG22 THR 33 -10.370 -6.509 1.386 276 HG23 THR 33 HG23 THR 33 -9.508 -6.092 -0.095 277 H PHE 34 HN PHE 34 -9.666 -2.903 1.250 278 HA PHE 34 HA PHE 34 -8.722 -1.986 -1.372 279 HB2 PHE 34 HB2 PHE 34 -8.647 -0.819 1.373 280 HB3 PHE 34 HB1 PHE 34 -7.341 -0.413 0.263 281 HD1 PHE 34 HD1 PHE 34 -11.024 -0.356 0.664 282 HD2 PHE 34 HD2 PHE 34 -7.644 1.180 -1.421 283 HE1 PHE 34 HE1 PHE 34 -12.454 1.342 -0.403 284 HE2 PHE 34 HE2 PHE 34 -9.066 2.881 -2.486 285 HZ PHE 34 HZ PHE 34 -11.474 2.962 -1.979 286 H ARG 35 HN ARG 35 -6.651 -2.353 -2.050 287 HA ARG 35 HA ARG 35 -4.976 -3.992 -0.272 288 HB2 ARG 35 HB2 ARG 35 -4.579 -5.563 -1.923 289 HB3 ARG 35 HB1 ARG 35 -6.251 -5.133 -2.247 290 HG2 ARG 35 HG2 ARG 35 -5.539 -4.925 -4.356 291 HG3 ARG 35 HG1 ARG 35 -4.969 -3.344 -3.815 292 HD2 ARG 35 HD2 ARG 35 -2.808 -3.942 -3.956 293 HD3 ARG 35 HD1 ARG 35 -3.108 -5.545 -3.287 294 HE ARG 35 HE ARG 35 -2.926 -4.839 -6.051 295 HH11 ARG 35 HH11 ARG 35 -4.389 -7.072 -3.802 296 HH12 ARG 35 HH12 ARG 35 -4.584 -8.325 -4.981 297 HH21 ARG 35 HH21 ARG 35 -3.180 -6.486 -7.601 298 HH22 ARG 35 HH22 ARG 35 -3.897 -7.993 -7.138 299 H LEU 36 HN LEU 36 -2.733 -3.777 -0.455 300 HA LEU 36 HA LEU 36 -1.791 -1.203 -1.165 301 HB2 LEU 36 HB2 LEU 36 -0.269 -3.752 -0.561 302 HB3 LEU 36 HB1 LEU 36 0.468 -2.164 -0.722 303 HG LEU 36 HG LEU 36 -1.607 -2.847 1.359 304 HD11 LEU 36 HD11 LEU 36 0.762 -4.000 1.392 305 HD12 LEU 36 HD12 LEU 36 0.033 -3.363 2.866 306 HD13 LEU 36 HD13 LEU 36 1.263 -2.428 2.016 307 HD21 LEU 36 HD21 LEU 36 0.254 -0.494 1.046 308 HD22 LEU 36 HD22 LEU 36 -0.836 -0.772 2.405 309 HD23 LEU 36 HD23 LEU 36 -1.491 -0.482 0.793 310 H LEU 37 HN LEU 37 -2.533 -1.040 -3.318 311 HA LEU 37 HA LEU 37 -2.495 -2.259 -5.532 312 HB2 LEU 37 HB2 LEU 37 -2.650 0.193 -5.297 313 HB3 LEU 37 HB1 LEU 37 -0.900 0.285 -5.334 314 HG LEU 37 HG LEU 37 -0.903 -0.657 -7.592 315 HD11 LEU 37 HD11 LEU 37 -3.762 -0.992 -6.995 316 HD12 LEU 37 HD12 LEU 37 -2.692 -1.953 -8.016 317 HD13 LEU 37 HD13 LEU 37 -3.369 -0.442 -8.624 318 HD21 LEU 37 HD21 LEU 37 -1.433 1.892 -6.878 319 HD22 LEU 37 HD22 LEU 37 -2.827 1.543 -7.902 320 HD23 LEU 37 HD23 LEU 37 -1.193 1.364 -8.543 321 H LEU 38 HN LEU 38 0.661 -0.671 -5.437 322 HA LEU 38 HA LEU 38 1.786 -3.090 -6.581 323 HB2 LEU 38 HB2 LEU 38 3.702 -1.585 -7.209 324 HB3 LEU 38 HB1 LEU 38 2.168 -1.244 -7.987 325 HG LEU 38 HG LEU 38 2.848 0.268 -5.512 326 HD11 LEU 38 HD11 LEU 38 3.794 1.870 -7.547 327 HD12 LEU 38 HD12 LEU 38 4.452 0.282 -7.938 328 HD13 LEU 38 HD13 LEU 38 4.774 1.006 -6.363 329 HD21 LEU 38 HD21 LEU 38 1.827 1.989 -7.358 330 HD22 LEU 38 HD22 LEU 38 0.873 1.092 -6.178 331 HD23 LEU 38 HD23 LEU 38 1.053 0.472 -7.819 332 H VAL 39 HN VAL 39 1.808 -4.066 -4.427 333 HA VAL 39 HA VAL 39 4.341 -3.464 -3.093 334 HB VAL 39 HB VAL 39 1.694 -3.806 -1.676 335 HG11 VAL 39 HG11 VAL 39 2.817 -4.764 -0.009 336 HG12 VAL 39 HG12 VAL 39 3.649 -3.225 0.218 337 HG13 VAL 39 HG13 VAL 39 4.366 -4.475 -0.799 338 HG21 VAL 39 HG21 VAL 39 3.675 -1.548 -1.869 339 HG22 VAL 39 HG22 VAL 39 2.396 -1.608 -0.658 340 HG23 VAL 39 HG23 VAL 39 1.985 -1.557 -2.372 341 H ASP 40 HN ASP 40 5.441 -5.242 -2.362 342 HA ASP 40 HA ASP 40 4.258 -7.848 -3.041 343 HB2 ASP 40 HB2 ASP 40 6.680 -6.720 -3.793 344 HB3 ASP 40 HB1 ASP 40 7.129 -7.846 -2.514 345 H THR 41 HN THR 41 3.892 -9.323 -1.507 346 HA THR 41 HA THR 41 4.738 -8.695 1.230 347 HB THR 41 HB THR 41 3.036 -10.761 1.554 348 HG1 THR 41 HG1 THR 41 2.581 -11.004 -0.629 349 HG21 THR 41 HG21 THR 41 2.127 -9.111 2.721 350 HG22 THR 41 HG22 THR 41 1.241 -8.697 1.253 351 HG23 THR 41 HG23 THR 41 2.759 -7.881 1.627 352 HA PRO 42 HA PRO 42 7.653 -12.022 1.238 353 HB2 PRO 42 HB2 PRO 42 7.811 -12.527 3.889 354 HB3 PRO 42 HB1 PRO 42 8.490 -11.067 3.160 355 HG2 PRO 42 HG2 PRO 42 5.895 -11.428 4.608 356 HG3 PRO 42 HG1 PRO 42 7.080 -10.116 4.748 357 HD2 PRO 42 HD2 PRO 42 4.806 -9.894 3.282 358 HD3 PRO 42 HD1 PRO 42 6.309 -9.050 2.859 359 H GLU 43 HN GLU 43 6.583 -13.708 0.204 360 HA GLU 43 HA GLU 43 4.617 -15.290 1.607 361 HB2 GLU 43 HB2 GLU 43 5.891 -15.455 -1.112 362 HB3 GLU 43 HB1 GLU 43 4.887 -16.760 -0.498 363 HG2 GLU 43 HG2 GLU 43 3.670 -14.115 -0.262 364 HG3 GLU 43 HG1 GLU 43 3.999 -14.615 -1.921 365 H THR 44 HN THR 44 6.063 -15.819 3.412 366 HA THR 44 HA THR 44 8.353 -17.458 3.028 367 HB THR 44 HB THR 44 8.063 -16.130 5.054 368 HG1 THR 44 HG1 THR 44 9.345 -17.783 5.531 369 HG21 THR 44 HG21 THR 44 6.438 -16.431 6.659 370 HG22 THR 44 HG22 THR 44 5.992 -18.027 6.057 371 HG23 THR 44 HG23 THR 44 5.527 -16.584 5.157 372 H LYS 45 HN LYS 45 8.282 -19.631 4.490 373 HA LYS 45 HA LYS 45 6.245 -21.295 3.186 374 HB2 LYS 45 HB2 LYS 45 7.746 -23.171 3.558 375 HB3 LYS 45 HB1 LYS 45 8.595 -21.872 2.733 376 HG2 LYS 45 HG2 LYS 45 9.351 -21.190 5.117 377 HG3 LYS 45 HG1 LYS 45 8.895 -22.842 5.541 378 HD2 LYS 45 HD2 LYS 45 10.362 -23.199 3.251 379 HD3 LYS 45 HD1 LYS 45 11.195 -21.853 4.028 380 HE2 LYS 45 HE2 LYS 45 10.497 -24.434 5.419 381 HE3 LYS 45 HE1 LYS 45 12.053 -24.120 4.652 382 HZ1 LYS 45 HZ1 LYS 45 12.601 -23.378 6.680 383 HZ2 LYS 45 HZ2 LYS 45 10.997 -23.131 7.157 384 HZ3 LYS 45 HZ3 LYS 45 11.788 -21.967 6.217 385 H HIS 46 HN HIS 46 7.825 -20.778 6.324 386 HA HIS 46 HA HIS 46 5.487 -21.096 7.823 387 HB2 HIS 46 HB2 HIS 46 6.819 -23.585 7.098 388 HB3 HIS 46 HB1 HIS 46 6.682 -23.388 8.842 389 HD1 HIS 46 HD1 HIS 46 5.077 -25.471 7.034 390 HD2 HIS 46 HD2 HIS 46 3.626 -21.895 8.575 391 HE1 HIS 46 HE1 HIS 46 2.579 -25.744 7.128 392 HE2 HIS 46 HE2 HIS 46 1.731 -23.602 8.147 393 HA PRO 47 HA PRO 47 8.990 -19.153 10.061 394 HB2 PRO 47 HB2 PRO 47 6.829 -17.588 11.290 395 HB3 PRO 47 HB1 PRO 47 8.245 -17.032 10.396 396 HG2 PRO 47 HG2 PRO 47 5.761 -16.871 9.373 397 HG3 PRO 47 HG1 PRO 47 7.181 -17.178 8.356 398 HD2 PRO 47 HD2 PRO 47 5.134 -19.109 9.386 399 HD3 PRO 47 HD1 PRO 47 5.880 -19.012 7.777 400 H LYS 48 HN LYS 48 8.510 -21.560 10.950 401 HA LYS 48 HA LYS 48 8.244 -22.926 12.754 402 HB2 LYS 48 HB2 LYS 48 9.880 -20.879 13.463 403 HB3 LYS 48 HB1 LYS 48 8.635 -20.735 14.696 404 HG2 LYS 48 HG2 LYS 48 9.349 -22.544 15.785 405 HG3 LYS 48 HG1 LYS 48 9.528 -23.477 14.298 406 HD2 LYS 48 HD2 LYS 48 11.486 -21.391 15.255 407 HD3 LYS 48 HD1 LYS 48 11.663 -23.126 15.524 408 HE2 LYS 48 HE2 LYS 48 12.612 -23.340 13.529 409 HE3 LYS 48 HE1 LYS 48 11.148 -22.725 12.764 410 HZ1 LYS 48 HZ1 LYS 48 12.541 -21.121 12.072 411 HZ2 LYS 48 HZ2 LYS 48 13.654 -21.375 13.321 412 HZ3 LYS 48 HZ3 LYS 48 12.260 -20.459 13.605 413 H LYS 49 HN LYS 49 7.324 -22.410 15.370 414 HA LYS 49 HA LYS 49 4.470 -22.096 14.820 415 HB2 LYS 49 HB2 LYS 49 6.057 -23.716 16.622 416 HB3 LYS 49 HB1 LYS 49 4.805 -22.849 17.499 417 HG2 LYS 49 HG2 LYS 49 4.204 -24.432 15.023 418 HG3 LYS 49 HG1 LYS 49 4.232 -25.164 16.628 419 HD2 LYS 49 HD2 LYS 49 2.597 -23.341 17.317 420 HD3 LYS 49 HD1 LYS 49 2.415 -23.002 15.595 421 HE2 LYS 49 HE2 LYS 49 1.822 -25.594 17.012 422 HE3 LYS 49 HE1 LYS 49 0.654 -24.486 16.293 423 HZ1 LYS 49 HZ1 LYS 49 1.141 -26.440 14.898 424 HZ2 LYS 49 HZ2 LYS 49 2.749 -25.935 14.767 425 HZ3 LYS 49 HZ3 LYS 49 1.510 -24.980 14.125 426 H GLY 50 HN GLY 50 6.253 -19.780 14.982 427 HA2 GLY 50 HA2 GLY 50 5.520 -18.516 17.511 428 HA3 GLY 50 HA1 GLY 50 6.597 -17.853 16.290 429 H VAL 51 HN VAL 51 5.050 -17.954 14.031 430 HA VAL 51 HA VAL 51 2.715 -16.294 14.722 431 HB VAL 51 HB VAL 51 3.142 -14.977 12.665 432 HG11 VAL 51 HG11 VAL 51 4.625 -13.513 13.671 433 HG12 VAL 51 HG12 VAL 51 5.608 -14.811 14.349 434 HG13 VAL 51 HG13 VAL 51 4.029 -14.446 15.044 435 HG21 VAL 51 HG21 VAL 51 4.474 -16.683 11.484 436 HG22 VAL 51 HG22 VAL 51 5.794 -16.413 12.621 437 HG23 VAL 51 HG23 VAL 51 5.283 -15.116 11.541 438 H GLU 52 HN GLU 52 1.141 -16.115 12.877 439 HA GLU 52 HA GLU 52 0.901 -18.731 11.549 440 HB2 GLU 52 HB2 GLU 52 -1.298 -16.776 12.242 441 HB3 GLU 52 HB1 GLU 52 -1.510 -18.377 11.548 442 HG2 GLU 52 HG2 GLU 52 -0.590 -19.380 13.576 443 HG3 GLU 52 HG1 GLU 52 -0.382 -17.773 14.272 444 H LYS 53 HN LYS 53 0.795 -15.266 11.103 445 HA LYS 53 HA LYS 53 -0.083 -15.392 8.372 446 HB2 LYS 53 HB2 LYS 53 1.255 -13.079 9.778 447 HB3 LYS 53 HB1 LYS 53 0.264 -13.010 8.329 448 HG2 LYS 53 HG2 LYS 53 -1.395 -12.461 9.710 449 HG3 LYS 53 HG1 LYS 53 -1.432 -14.176 10.125 450 HD2 LYS 53 HD2 LYS 53 0.549 -13.274 11.754 451 HD3 LYS 53 HD1 LYS 53 -0.515 -11.868 11.695 452 HE2 LYS 53 HE2 LYS 53 -2.264 -12.980 12.693 453 HE3 LYS 53 HE1 LYS 53 -1.704 -14.563 12.152 454 HZ1 LYS 53 HZ1 LYS 53 -1.418 -14.256 14.541 455 HZ2 LYS 53 HZ2 LYS 53 -0.416 -12.923 14.268 456 HZ3 LYS 53 HZ3 LYS 53 0.073 -14.464 13.770 457 H TYR 54 HN TYR 54 1.427 -13.919 6.833 458 HA TYR 54 HA TYR 54 3.812 -15.519 6.474 459 HB2 TYR 54 HB2 TYR 54 2.964 -13.182 4.769 460 HB3 TYR 54 HB1 TYR 54 3.963 -14.558 4.312 461 HD1 TYR 54 HD2 TYR 54 0.541 -13.383 4.888 462 HD2 TYR 54 HD1 TYR 54 2.959 -16.693 3.746 463 HE1 TYR 54 HE2 TYR 54 -1.455 -14.539 4.035 464 HE2 TYR 54 HE1 TYR 54 0.969 -17.857 2.889 465 HH TYR 54 HH TYR 54 -1.978 -16.322 2.367 466 H GLY 55 HN GLY 55 3.269 -11.992 6.344 467 HA2 GLY 55 HA2 GLY 55 6.010 -11.616 7.326 468 HA3 GLY 55 HA1 GLY 55 5.038 -10.403 6.509 469 HA PRO 56 HA PRO 56 4.005 -10.718 11.296 470 HB2 PRO 56 HB2 PRO 56 6.345 -10.439 12.683 471 HB3 PRO 56 HB1 PRO 56 5.576 -11.997 12.360 472 HG2 PRO 56 HG2 PRO 56 7.849 -10.673 10.934 473 HG3 PRO 56 HG1 PRO 56 7.651 -12.375 11.391 474 HD2 PRO 56 HD2 PRO 56 7.212 -11.505 8.877 475 HD3 PRO 56 HD1 PRO 56 6.269 -12.827 9.595 476 H GLU 57 HN GLU 57 6.982 -8.998 10.325 477 HA GLU 57 HA GLU 57 6.147 -6.586 11.651 478 HB2 GLU 57 HB2 GLU 57 8.541 -7.508 10.168 479 HB3 GLU 57 HB1 GLU 57 8.230 -5.777 10.144 480 HG2 GLU 57 HG2 GLU 57 8.437 -7.441 12.642 481 HG3 GLU 57 HG1 GLU 57 9.754 -6.494 11.951 482 H ALA 58 HN ALA 58 5.947 -7.902 8.442 483 HA ALA 58 HA ALA 58 5.492 -5.452 7.069 484 HB1 ALA 58 HB1 ALA 58 5.370 -6.714 5.203 485 HB2 ALA 58 HB2 ALA 58 4.307 -7.908 5.951 486 HB3 ALA 58 HB3 ALA 58 6.044 -7.959 6.256 487 H SER 59 HN SER 59 3.330 -7.962 8.346 488 HA SER 59 HA SER 59 0.936 -6.673 7.520 489 HB2 SER 59 HB2 SER 59 1.645 -8.992 9.236 490 HB3 SER 59 HB1 SER 59 0.064 -8.259 9.507 491 HG SER 59 HG SER 59 0.238 -9.998 7.865 492 H ALA 60 HN ALA 60 2.733 -6.763 10.571 493 HA ALA 60 HA ALA 60 0.891 -5.305 12.112 494 HB1 ALA 60 HB1 ALA 60 3.766 -4.987 12.722 495 HB2 ALA 60 HB2 ALA 60 3.136 -6.634 12.697 496 HB3 ALA 60 HB3 ALA 60 2.423 -5.433 13.775 497 H PHE 61 HN PHE 61 3.837 -4.215 10.425 498 HA PHE 61 HA PHE 61 3.730 -1.531 11.057 499 HB2 PHE 61 HB2 PHE 61 5.605 -2.639 9.884 500 HB3 PHE 61 HB1 PHE 61 4.621 -2.722 8.426 501 HD1 PHE 61 HD1 PHE 61 6.375 -0.473 10.736 502 HD2 PHE 61 HD2 PHE 61 4.300 -0.821 7.041 503 HE1 PHE 61 HE1 PHE 61 7.161 1.772 10.086 504 HE2 PHE 61 HE2 PHE 61 5.074 1.417 6.383 505 HZ PHE 61 HZ PHE 61 6.509 2.718 7.908 506 H THR 62 HN THR 62 2.357 -3.090 8.152 507 HA THR 62 HA THR 62 1.226 -0.867 6.971 508 HB THR 62 HB THR 62 0.080 -3.667 7.049 509 HG1 THR 62 HG1 THR 62 1.901 -4.032 6.059 510 HG21 THR 62 HG21 THR 62 -0.475 -1.333 5.268 511 HG22 THR 62 HG22 THR 62 -1.610 -2.415 6.076 512 HG23 THR 62 HG23 THR 62 -0.670 -2.990 4.697 513 H LYS 63 HN LYS 63 -0.149 -2.968 9.466 514 HA LYS 63 HA LYS 63 -2.611 -1.518 9.640 515 HB2 LYS 63 HB2 LYS 63 -2.093 -3.979 10.309 516 HB3 LYS 63 HB1 LYS 63 -1.528 -3.279 11.820 517 HG2 LYS 63 HG2 LYS 63 -4.001 -2.101 11.420 518 HG3 LYS 63 HG1 LYS 63 -4.224 -3.771 10.896 519 HD2 LYS 63 HD2 LYS 63 -3.101 -2.885 13.554 520 HD3 LYS 63 HD1 LYS 63 -4.727 -3.513 13.275 521 HE2 LYS 63 HE2 LYS 63 -3.277 -5.496 12.189 522 HE3 LYS 63 HE1 LYS 63 -2.134 -4.926 13.405 523 HZ1 LYS 63 HZ1 LYS 63 -4.595 -5.078 14.660 524 HZ2 LYS 63 HZ2 LYS 63 -3.268 -6.101 14.883 525 HZ3 LYS 63 HZ3 LYS 63 -4.459 -6.500 13.751 526 H LYS 64 HN LYS 64 0.513 -1.364 11.157 527 HA LYS 64 HA LYS 64 -0.075 0.102 13.454 528 HB2 LYS 64 HB2 LYS 64 2.188 -0.911 12.307 529 HB3 LYS 64 HB1 LYS 64 2.436 0.816 12.090 530 HG2 LYS 64 HG2 LYS 64 1.842 -0.523 14.722 531 HG3 LYS 64 HG1 LYS 64 3.448 -0.061 14.153 532 HD2 LYS 64 HD2 LYS 64 1.682 2.181 13.925 533 HD3 LYS 64 HD1 LYS 64 1.574 1.518 15.557 534 HE2 LYS 64 HE2 LYS 64 4.211 1.480 15.318 535 HE3 LYS 64 HE1 LYS 64 3.880 2.761 14.152 536 HZ1 LYS 64 HZ1 LYS 64 2.452 3.725 16.055 537 HZ2 LYS 64 HZ2 LYS 64 4.133 3.912 16.115 538 HZ3 LYS 64 HZ3 LYS 64 3.382 2.723 17.053 539 H MET 65 HN MET 65 0.753 1.236 10.192 540 HA MET 65 HA MET 65 0.670 3.986 10.833 541 HB2 MET 65 HB2 MET 65 0.529 2.490 8.226 542 HB3 MET 65 HB1 MET 65 0.482 4.246 8.306 543 HG2 MET 65 HG2 MET 65 2.707 2.501 9.334 544 HG3 MET 65 HG1 MET 65 2.721 3.412 7.825 545 HE1 MET 65 HE1 MET 65 5.307 5.023 10.201 546 HE2 MET 65 HE2 MET 65 4.892 3.413 9.614 547 HE3 MET 65 HE3 MET 65 4.508 3.873 11.273 548 H VAL 66 HN VAL 66 -1.689 1.926 9.113 549 HA VAL 66 HA VAL 66 -3.618 3.940 8.776 550 HB VAL 66 HB VAL 66 -5.240 2.054 8.460 551 HG11 VAL 66 HG11 VAL 66 -2.642 2.173 6.964 552 HG12 VAL 66 HG12 VAL 66 -4.215 2.826 6.505 553 HG13 VAL 66 HG13 VAL 66 -3.939 1.085 6.474 554 HG21 VAL 66 HG21 VAL 66 -4.738 0.160 9.540 555 HG22 VAL 66 HG22 VAL 66 -3.034 0.586 9.684 556 HG23 VAL 66 HG23 VAL 66 -3.634 -0.156 8.202 557 H GLU 67 HN GLU 67 -3.126 1.615 11.391 558 HA GLU 67 HA GLU 67 -5.536 2.236 12.752 559 HB2 GLU 67 HB2 GLU 67 -2.991 0.926 13.710 560 HB3 GLU 67 HB1 GLU 67 -4.459 1.048 14.672 561 HG2 GLU 67 HG2 GLU 67 -4.435 -0.247 11.970 562 HG3 GLU 67 HG1 GLU 67 -4.034 -1.134 13.441 563 H ASN 68 HN ASN 68 -2.149 3.182 13.323 564 HA ASN 68 HA ASN 68 -2.746 4.899 15.498 565 HB2 ASN 68 HB2 ASN 68 -0.355 4.555 13.709 566 HB3 ASN 68 HB1 ASN 68 -0.415 5.860 14.889 567 HD21 ASN 68 HD21 ASN 68 -0.955 2.364 14.654 568 HD22 ASN 68 HD22 ASN 68 -0.252 1.980 16.184 569 H ALA 69 HN ALA 69 -2.537 5.369 12.030 570 HA ALA 69 HA ALA 69 -2.524 8.194 12.039 571 HB1 ALA 69 HB1 ALA 69 -3.406 7.893 9.668 572 HB2 ALA 69 HB2 ALA 69 -3.296 6.159 9.971 573 HB3 ALA 69 HB3 ALA 69 -1.846 7.162 10.045 574 H LYS 70 HN LYS 70 -4.072 9.547 12.630 575 HA LYS 70 HA LYS 70 -6.645 8.735 13.416 576 HB2 LYS 70 HB2 LYS 70 -5.750 11.523 12.669 577 HB3 LYS 70 HB1 LYS 70 -7.138 11.102 13.663 578 HG2 LYS 70 HG2 LYS 70 -5.887 10.745 15.500 579 HG3 LYS 70 HG1 LYS 70 -4.540 10.065 14.585 580 HD2 LYS 70 HD2 LYS 70 -3.927 12.332 13.843 581 HD3 LYS 70 HD1 LYS 70 -5.246 12.991 14.813 582 HE2 LYS 70 HE2 LYS 70 -3.957 11.497 16.664 583 HE3 LYS 70 HE1 LYS 70 -2.608 11.976 15.636 584 HZ1 LYS 70 HZ1 LYS 70 -4.512 14.043 16.451 585 HZ2 LYS 70 HZ2 LYS 70 -2.846 14.157 16.183 586 HZ3 LYS 70 HZ3 LYS 70 -3.427 13.472 17.615 587 H LYS 71 HN LYS 71 -5.362 9.595 10.331 588 HA LYS 71 HA LYS 71 -8.018 9.231 9.158 589 HB2 LYS 71 HB2 LYS 71 -7.197 11.730 9.428 590 HB3 LYS 71 HB1 LYS 71 -6.266 11.344 7.987 591 HG2 LYS 71 HG2 LYS 71 -8.546 10.491 7.071 592 HG3 LYS 71 HG1 LYS 71 -9.222 11.515 8.341 593 HD2 LYS 71 HD2 LYS 71 -7.152 12.905 6.886 594 HD3 LYS 71 HD1 LYS 71 -8.397 12.303 5.790 595 HE2 LYS 71 HE2 LYS 71 -10.052 13.308 7.508 596 HE3 LYS 71 HE1 LYS 71 -8.654 14.221 8.075 597 HZ1 LYS 71 HZ1 LYS 71 -8.637 15.501 6.242 598 HZ2 LYS 71 HZ2 LYS 71 -10.265 15.056 6.135 599 HZ3 LYS 71 HZ3 LYS 71 -9.106 14.247 5.207 600 H ILE 72 HN ILE 72 -8.039 8.180 7.224 601 HA ILE 72 HA ILE 72 -5.425 7.384 6.120 602 HB ILE 72 HB ILE 72 -7.904 5.722 5.825 603 HG12 ILE 72 HG12 ILE 72 -5.888 5.545 8.076 604 HG13 ILE 72 HG11 ILE 72 -7.569 6.042 8.239 605 HG21 ILE 72 HG21 ILE 72 -6.512 4.059 5.090 606 HG22 ILE 72 HG22 ILE 72 -5.124 4.671 5.988 607 HG23 ILE 72 HG23 ILE 72 -5.650 5.486 4.515 608 HD11 ILE 72 HD11 ILE 72 -6.819 3.349 7.161 609 HD12 ILE 72 HD12 ILE 72 -8.361 3.883 7.831 610 HD13 ILE 72 HD13 ILE 72 -6.969 3.659 8.890 611 H GLU 73 HN GLU 73 -5.190 7.367 3.895 612 HA GLU 73 HA GLU 73 -7.463 8.416 2.340 613 HB2 GLU 73 HB2 GLU 73 -4.624 9.178 1.717 614 HB3 GLU 73 HB1 GLU 73 -6.110 9.957 1.196 615 HG2 GLU 73 HG2 GLU 73 -6.453 10.469 3.699 616 HG3 GLU 73 HG1 GLU 73 -4.735 10.103 3.845 617 H VAL 74 HN VAL 74 -7.725 7.634 0.270 618 HA VAL 74 HA VAL 74 -5.858 5.517 -0.561 619 HB VAL 74 HB VAL 74 -7.920 4.468 -1.667 620 HG11 VAL 74 HG11 VAL 74 -8.577 3.709 0.888 621 HG12 VAL 74 HG12 VAL 74 -6.927 4.305 1.066 622 HG13 VAL 74 HG13 VAL 74 -7.281 3.022 -0.092 623 HG21 VAL 74 HG21 VAL 74 -9.598 5.489 0.506 624 HG22 VAL 74 HG22 VAL 74 -9.992 5.181 -1.185 625 HG23 VAL 74 HG23 VAL 74 -9.194 6.685 -0.726 626 H GLU 75 HN GLU 75 -5.216 5.516 -2.640 627 HA GLU 75 HA GLU 75 -6.532 7.399 -4.482 628 HB2 GLU 75 HB2 GLU 75 -4.323 8.229 -3.577 629 HB3 GLU 75 HB1 GLU 75 -3.559 6.878 -4.404 630 HG2 GLU 75 HG2 GLU 75 -5.194 8.166 -6.295 631 HG3 GLU 75 HG1 GLU 75 -4.317 9.428 -5.432 632 H PHE 76 HN PHE 76 -7.511 6.163 -5.962 633 HA PHE 76 HA PHE 76 -6.596 3.555 -6.661 634 HB2 PHE 76 HB2 PHE 76 -8.751 5.342 -7.791 635 HB3 PHE 76 HB1 PHE 76 -8.408 3.740 -8.432 636 HD1 PHE 76 HD2 PHE 76 -8.054 2.035 -6.194 637 HD2 PHE 76 HD1 PHE 76 -10.702 5.342 -6.606 638 HE1 PHE 76 HE2 PHE 76 -9.550 1.043 -4.511 639 HE2 PHE 76 HE1 PHE 76 -12.200 4.356 -4.924 640 HZ PHE 76 HZ PHE 76 -11.626 2.204 -3.875 641 H ASP 77 HN ASP 77 -5.678 2.858 -8.540 642 HA ASP 77 HA ASP 77 -3.754 4.480 -9.738 643 HB2 ASP 77 HB2 ASP 77 -3.367 2.648 -11.275 644 HB3 ASP 77 HB1 ASP 77 -3.683 1.995 -9.672 645 H LYS 78 HN LYS 78 -3.964 3.970 -12.489 646 HA LYS 78 HA LYS 78 -6.114 5.842 -13.208 647 HB2 LYS 78 HB2 LYS 78 -4.512 5.954 -15.363 648 HB3 LYS 78 HB1 LYS 78 -4.307 6.992 -13.961 649 HG2 LYS 78 HG2 LYS 78 -2.900 4.479 -13.656 650 HG3 LYS 78 HG1 LYS 78 -2.394 5.347 -15.094 651 HD2 LYS 78 HD2 LYS 78 -2.659 7.136 -12.855 652 HD3 LYS 78 HD1 LYS 78 -1.578 5.796 -12.477 653 HE2 LYS 78 HE2 LYS 78 -1.245 7.121 -15.109 654 HE3 LYS 78 HE1 LYS 78 -0.732 8.017 -13.681 655 HZ1 LYS 78 HZ1 LYS 78 0.544 5.842 -14.983 656 HZ2 LYS 78 HZ2 LYS 78 0.273 5.476 -13.354 657 HZ3 LYS 78 HZ3 LYS 78 1.142 6.864 -13.775 658 H GLY 79 HN GLY 79 -4.595 2.784 -14.022 659 HA2 GLY 79 HA2 GLY 79 -6.354 2.394 -16.308 660 HA3 GLY 79 HA1 GLY 79 -5.112 1.285 -15.748 661 H GLN 80 HN GLN 80 -5.685 -0.422 -14.532 662 HA GLN 80 HA GLN 80 -8.187 -1.456 -14.495 663 HB2 GLN 80 HB2 GLN 80 -5.743 -2.239 -13.545 664 HB3 GLN 80 HB1 GLN 80 -6.682 -2.124 -12.065 665 HG2 GLN 80 HG2 GLN 80 -8.246 -3.695 -12.806 666 HG3 GLN 80 HG1 GLN 80 -7.654 -3.615 -14.466 667 HE21 GLN 80 HE21 GLN 80 -7.128 -5.725 -14.728 668 HE22 GLN 80 HE22 GLN 80 -5.895 -6.533 -13.827 669 H ARG 81 HN ARG 81 -6.877 -0.508 -11.347 670 HA ARG 81 HA ARG 81 -7.728 0.819 -9.677 671 HB2 ARG 81 HB2 ARG 81 -10.233 1.123 -11.335 672 HB3 ARG 81 HB1 ARG 81 -9.804 2.038 -9.900 673 HG2 ARG 81 HG2 ARG 81 -7.670 2.586 -11.417 674 HG3 ARG 81 HG1 ARG 81 -8.872 2.328 -12.682 675 HD2 ARG 81 HD2 ARG 81 -9.993 3.927 -10.580 676 HD3 ARG 81 HD1 ARG 81 -8.470 4.632 -11.118 677 HE ARG 81 HE ARG 81 -10.189 3.892 -13.287 678 HH11 ARG 81 HH11 ARG 81 -9.483 6.382 -10.946 679 HH12 ARG 81 HH12 ARG 81 -10.170 7.651 -11.902 680 HH21 ARG 81 HH21 ARG 81 -11.094 5.561 -14.547 681 HH22 ARG 81 HH22 ARG 81 -11.086 7.185 -13.946 682 H THR 82 HN THR 82 -9.165 -1.950 -11.031 683 HA THR 82 HA THR 82 -9.881 -2.943 -8.452 684 HB THR 82 HB THR 82 -12.289 -3.480 -9.330 685 HG1 THR 82 HG1 THR 82 -12.422 -2.595 -11.271 686 HG21 THR 82 HG21 THR 82 -11.588 -1.936 -7.401 687 HG22 THR 82 HG22 THR 82 -13.196 -1.750 -8.101 688 HG23 THR 82 HG23 THR 82 -11.908 -0.627 -8.539 689 H ASP 83 HN ASP 83 -9.359 -5.016 -8.465 690 HA ASP 83 HA ASP 83 -8.844 -6.372 -10.954 691 HB2 ASP 83 HB2 ASP 83 -8.673 -7.422 -8.121 692 HB3 ASP 83 HB1 ASP 83 -8.000 -8.189 -9.557 693 H LYS 84 HN LYS 84 -9.485 -8.924 -10.637 694 HA LYS 84 HA LYS 84 -12.033 -9.243 -11.524 695 HB2 LYS 84 HB2 LYS 84 -11.738 -11.564 -10.099 696 HB3 LYS 84 HB1 LYS 84 -11.130 -11.288 -11.726 697 HG2 LYS 84 HG2 LYS 84 -9.398 -10.475 -9.460 698 HG3 LYS 84 HG1 LYS 84 -9.603 -12.201 -9.759 699 HD2 LYS 84 HD2 LYS 84 -8.660 -12.070 -11.886 700 HD3 LYS 84 HD1 LYS 84 -8.913 -10.327 -11.994 701 HE2 LYS 84 HE2 LYS 84 -7.289 -10.326 -9.908 702 HE3 LYS 84 HE1 LYS 84 -6.776 -11.863 -10.605 703 HZ1 LYS 84 HZ1 LYS 84 -5.413 -10.534 -11.775 704 HZ2 LYS 84 HZ2 LYS 84 -6.380 -9.161 -11.586 705 HZ3 LYS 84 HZ3 LYS 84 -6.768 -10.310 -12.764 706 H TYR 85 HN TYR 85 -11.089 -9.910 -8.151 707 HA TYR 85 HA TYR 85 -13.746 -10.183 -7.245 708 HB2 TYR 85 HB2 TYR 85 -11.059 -10.073 -6.017 709 HB3 TYR 85 HB1 TYR 85 -12.394 -9.615 -4.968 710 HD1 TYR 85 HD1 TYR 85 -11.598 -12.289 -7.448 711 HD2 TYR 85 HD2 TYR 85 -13.315 -11.292 -3.690 712 HE1 TYR 85 HE1 TYR 85 -12.081 -14.668 -7.048 713 HE2 TYR 85 HE2 TYR 85 -13.804 -13.666 -3.276 714 HH TYR 85 HH TYR 85 -12.945 -15.883 -4.028 715 H GLY 86 HN GLY 86 -12.082 -7.447 -8.185 716 HA2 GLY 86 HA2 GLY 86 -12.887 -5.261 -8.196 717 HA3 GLY 86 HA1 GLY 86 -14.106 -5.730 -7.018 718 H ARG 87 HN ARG 87 -10.823 -6.601 -6.414 719 HA ARG 87 HA ARG 87 -10.682 -5.435 -3.906 720 HB2 ARG 87 HB2 ARG 87 -9.096 -7.121 -5.223 721 HB3 ARG 87 HB1 ARG 87 -8.169 -5.653 -5.496 722 HG2 ARG 87 HG2 ARG 87 -7.342 -6.832 -3.554 723 HG3 ARG 87 HG1 ARG 87 -8.042 -5.284 -3.082 724 HD2 ARG 87 HD2 ARG 87 -8.647 -7.156 -1.574 725 HD3 ARG 87 HD1 ARG 87 -10.038 -6.356 -2.299 726 HE ARG 87 HE ARG 87 -9.967 -8.288 -3.947 727 HH11 ARG 87 HH11 ARG 87 -8.927 -8.593 -0.619 728 HH12 ARG 87 HH12 ARG 87 -9.271 -10.287 -0.545 729 HH21 ARG 87 HH21 ARG 87 -10.416 -10.510 -3.836 730 HH22 ARG 87 HH22 ARG 87 -10.115 -11.374 -2.365 731 H GLY 88 HN GLY 88 -9.192 -3.685 -3.178 732 HA2 GLY 88 HA2 GLY 88 -9.705 -1.313 -4.777 733 HA3 GLY 88 HA1 GLY 88 -9.122 -1.344 -3.123 734 H LEU 89 HN LEU 89 -8.295 -1.000 -6.393 735 HA LEU 89 HA LEU 89 -5.473 -1.540 -6.026 736 HB2 LEU 89 HB2 LEU 89 -7.092 -0.528 -8.351 737 HB3 LEU 89 HB1 LEU 89 -5.346 -0.668 -8.398 738 HG LEU 89 HG LEU 89 -6.747 -2.561 -9.409 739 HD11 LEU 89 HD11 LEU 89 -5.138 -4.271 -8.587 740 HD12 LEU 89 HD12 LEU 89 -4.557 -3.087 -7.417 741 HD13 LEU 89 HD13 LEU 89 -4.383 -2.778 -9.145 742 HD21 LEU 89 HD21 LEU 89 -6.909 -3.472 -6.553 743 HD22 LEU 89 HD22 LEU 89 -7.612 -4.229 -7.982 744 HD23 LEU 89 HD23 LEU 89 -8.253 -2.695 -7.390 745 H ALA 90 HN ALA 90 -5.455 0.099 -4.230 746 HA ALA 90 HA ALA 90 -4.548 2.648 -5.311 747 HB1 ALA 90 HB1 ALA 90 -6.819 3.187 -4.861 748 HB2 ALA 90 HB2 ALA 90 -5.859 3.879 -3.555 749 HB3 ALA 90 HB3 ALA 90 -6.763 2.389 -3.291 750 H TYR 91 HN TYR 91 -3.763 4.056 -3.368 751 HA TYR 91 HA TYR 91 -2.102 2.313 -1.691 752 HB2 TYR 91 HB2 TYR 91 -1.641 5.259 -2.090 753 HB3 TYR 91 HB1 TYR 91 -0.488 4.029 -1.596 754 HD1 TYR 91 HD2 TYR 91 -2.589 5.043 -4.508 755 HD2 TYR 91 HD1 TYR 91 0.968 3.136 -3.163 756 HE1 TYR 91 HE2 TYR 91 -1.828 4.833 -6.837 757 HE2 TYR 91 HE1 TYR 91 1.741 2.928 -5.486 758 HH TYR 91 HH TYR 91 -0.307 3.501 -8.165 759 H ILE 92 HN ILE 92 -2.246 2.387 0.497 760 HA ILE 92 HA ILE 92 -4.392 4.028 1.627 761 HB ILE 92 HB ILE 92 -2.778 1.828 2.929 762 HG12 ILE 92 HG12 ILE 92 -5.311 0.860 2.657 763 HG13 ILE 92 HG11 ILE 92 -5.164 1.823 1.190 764 HG21 ILE 92 HG21 ILE 92 -3.752 3.450 4.505 765 HG22 ILE 92 HG22 ILE 92 -4.483 1.851 4.651 766 HG23 ILE 92 HG23 ILE 92 -5.344 3.141 3.812 767 HD11 ILE 92 HD11 ILE 92 -3.200 -0.292 2.029 768 HD12 ILE 92 HD12 ILE 92 -3.251 0.572 0.492 769 HD13 ILE 92 HD13 ILE 92 -4.540 -0.555 0.913 770 H TYR 93 HN TYR 93 -3.959 5.888 2.592 771 HA TYR 93 HA TYR 93 -1.209 6.478 3.381 772 HB2 TYR 93 HB2 TYR 93 -3.584 8.334 3.155 773 HB3 TYR 93 HB1 TYR 93 -1.931 8.819 3.488 774 HD1 TYR 93 HD2 TYR 93 -2.975 6.317 0.941 775 HD2 TYR 93 HD1 TYR 93 -1.559 10.258 1.671 776 HE1 TYR 93 HE2 TYR 93 -2.615 6.621 -1.463 777 HE2 TYR 93 HE1 TYR 93 -1.182 10.571 -0.737 778 HH TYR 93 HH TYR 93 -2.114 9.580 -2.892 779 H ALA 94 HN ALA 94 -0.802 7.635 5.372 780 HA ALA 94 HA ALA 94 -2.799 7.331 7.477 781 HB1 ALA 94 HB1 ALA 94 -0.476 6.498 8.738 782 HB2 ALA 94 HB2 ALA 94 -0.452 5.650 7.193 783 HB3 ALA 94 HB3 ALA 94 -1.838 5.480 8.270 784 H ASP 95 HN ASP 95 -2.952 9.292 8.341 785 HA ASP 95 HA ASP 95 -2.401 11.260 9.336 786 HB2 ASP 95 HB2 ASP 95 -0.067 9.599 9.777 787 HB3 ASP 95 HB1 ASP 95 0.385 11.291 9.598 788 H GLY 96 HN GLY 96 -1.829 10.524 6.298 789 HA2 GLY 96 HA2 GLY 96 -1.843 12.355 4.699 790 HA3 GLY 96 HA1 GLY 96 -0.663 13.168 5.710 791 H LYS 97 HN LYS 97 -0.018 9.859 5.459 792 HA LYS 97 HA LYS 97 1.761 10.289 3.166 793 HB2 LYS 97 HB2 LYS 97 2.477 9.500 5.935 794 HB3 LYS 97 HB1 LYS 97 3.303 8.655 4.633 795 HG2 LYS 97 HG2 LYS 97 4.242 10.645 3.799 796 HG3 LYS 97 HG1 LYS 97 3.167 11.649 4.775 797 HD2 LYS 97 HD2 LYS 97 4.668 9.860 6.459 798 HD3 LYS 97 HD1 LYS 97 5.758 10.783 5.421 799 HE2 LYS 97 HE2 LYS 97 5.219 12.769 6.389 800 HE3 LYS 97 HE1 LYS 97 3.562 12.275 6.732 801 HZ1 LYS 97 HZ1 LYS 97 5.626 10.864 8.205 802 HZ2 LYS 97 HZ2 LYS 97 4.130 11.451 8.730 803 HZ3 LYS 97 HZ3 LYS 97 5.448 12.501 8.592 804 H MET 98 HN MET 98 1.903 8.612 1.760 805 HA MET 98 HA MET 98 -0.028 6.544 1.924 806 HB2 MET 98 HB2 MET 98 2.277 6.261 0.060 807 HB3 MET 98 HB1 MET 98 0.564 5.963 -0.212 808 HG2 MET 98 HG2 MET 98 0.573 7.865 -1.355 809 HG3 MET 98 HG1 MET 98 0.639 8.668 0.212 810 HE1 MET 98 HE1 MET 98 1.637 10.434 0.310 811 HE2 MET 98 HE2 MET 98 2.582 11.074 -1.034 812 HE3 MET 98 HE3 MET 98 3.390 10.568 0.450 813 H VAL 99 HN VAL 99 0.078 4.891 3.243 814 HA VAL 99 HA VAL 99 2.331 3.994 4.618 815 HB VAL 99 HB VAL 99 -0.015 2.220 3.968 816 HG11 VAL 99 HG11 VAL 99 0.449 1.170 6.039 817 HG12 VAL 99 HG12 VAL 99 1.567 2.447 6.517 818 HG13 VAL 99 HG13 VAL 99 1.996 1.343 5.211 819 HG21 VAL 99 HG21 VAL 99 -0.452 3.558 6.425 820 HG22 VAL 99 HG22 VAL 99 -1.421 3.631 4.953 821 HG23 VAL 99 HG23 VAL 99 -0.116 4.787 5.206 822 H ASN 100 HN ASN 100 0.969 2.962 1.544 823 HA ASN 100 HA ASN 100 2.270 0.574 1.101 824 HB2 ASN 100 HB2 ASN 100 1.972 2.678 -1.043 825 HB3 ASN 100 HB1 ASN 100 1.928 0.926 -1.226 826 HD21 ASN 100 HD21 ASN 100 -0.008 0.042 -1.371 827 HD22 ASN 100 HD22 ASN 100 -1.489 0.737 -0.829 828 H GLU 101 HN GLU 101 3.467 3.816 0.214 829 HA GLU 101 HA GLU 101 5.972 3.021 -0.724 830 HB2 GLU 101 HB2 GLU 101 4.686 5.369 -0.655 831 HB3 GLU 101 HB1 GLU 101 5.773 5.620 0.703 832 HG2 GLU 101 HG2 GLU 101 7.072 4.549 -1.686 833 HG3 GLU 101 HG1 GLU 101 6.356 6.145 -1.901 834 H ALA 102 HN ALA 102 4.860 3.756 2.539 835 HA ALA 102 HA ALA 102 7.313 3.885 3.850 836 HB1 ALA 102 HB1 ALA 102 5.144 4.465 4.873 837 HB2 ALA 102 HB2 ALA 102 6.102 3.380 5.880 838 HB3 ALA 102 HB3 ALA 102 4.744 2.749 4.948 839 H LEU 103 HN LEU 103 5.226 1.061 3.290 840 HA LEU 103 HA LEU 103 6.987 -0.812 4.483 841 HB2 LEU 103 HB2 LEU 103 4.615 -0.996 2.668 842 HB3 LEU 103 HB1 LEU 103 5.600 -2.420 2.941 843 HG LEU 103 HG LEU 103 5.159 -1.568 5.499 844 HD11 LEU 103 HD11 LEU 103 2.617 -1.069 3.958 845 HD12 LEU 103 HD12 LEU 103 3.617 0.173 4.710 846 HD13 LEU 103 HD13 LEU 103 2.807 -1.031 5.711 847 HD21 LEU 103 HD21 LEU 103 3.873 -3.497 5.735 848 HD22 LEU 103 HD22 LEU 103 4.900 -3.848 4.346 849 HD23 LEU 103 HD23 LEU 103 3.218 -3.375 4.102 850 H VAL 104 HN VAL 104 6.500 0.338 1.191 851 HA VAL 104 HA VAL 104 8.190 -1.466 -0.138 852 HB VAL 104 HB VAL 104 7.666 1.416 -0.887 853 HG11 VAL 104 HG11 VAL 104 7.929 -0.559 -3.011 854 HG12 VAL 104 HG12 VAL 104 9.392 -0.377 -2.043 855 HG13 VAL 104 HG13 VAL 104 8.680 1.028 -2.839 856 HG21 VAL 104 HG21 VAL 104 5.765 -0.546 -0.525 857 HG22 VAL 104 HG22 VAL 104 6.093 -0.613 -2.256 858 HG23 VAL 104 HG23 VAL 104 5.586 0.904 -1.513 859 H ARG 105 HN ARG 105 8.804 1.635 1.422 860 HA ARG 105 HA ARG 105 11.584 1.685 0.697 861 HB2 ARG 105 HB2 ARG 105 10.559 3.802 0.958 862 HB3 ARG 105 HB1 ARG 105 9.855 3.362 2.507 863 HG2 ARG 105 HG2 ARG 105 12.612 3.119 2.874 864 HG3 ARG 105 HG1 ARG 105 12.399 4.582 1.915 865 HD2 ARG 105 HD2 ARG 105 12.353 4.818 4.459 866 HD3 ARG 105 HD1 ARG 105 11.069 5.600 3.540 867 HE ARG 105 HE ARG 105 10.450 2.943 4.510 868 HH11 ARG 105 HH11 ARG 105 10.321 6.374 5.153 869 HH12 ARG 105 HH12 ARG 105 8.996 6.242 6.260 870 HH21 ARG 105 HH21 ARG 105 8.701 2.774 5.961 871 HH22 ARG 105 HH22 ARG 105 8.079 4.200 6.722 872 H GLN 106 HN GLN 106 9.749 1.067 3.685 873 HA GLN 106 HA GLN 106 11.841 0.711 5.450 874 HB2 GLN 106 HB2 GLN 106 9.044 -0.141 5.304 875 HB3 GLN 106 HB1 GLN 106 10.052 -1.214 6.259 876 HG2 GLN 106 HG2 GLN 106 10.157 1.729 6.716 877 HG3 GLN 106 HG1 GLN 106 8.847 0.768 7.399 878 HE21 GLN 106 HE21 GLN 106 9.777 -1.370 8.405 879 HE22 GLN 106 HE22 GLN 106 11.086 -1.122 9.503 880 H GLY 107 HN GLY 107 10.228 -1.874 3.591 881 HA2 GLY 107 HA2 GLY 107 12.002 -3.334 2.438 882 HA3 GLY 107 HA1 GLY 107 12.581 -3.578 4.079 883 H LEU 108 HN LEU 108 9.559 -3.395 4.811 884 HA LEU 108 HA LEU 108 9.140 -6.165 5.065 885 HB2 LEU 108 HB2 LEU 108 6.708 -4.512 5.078 886 HB3 LEU 108 HB1 LEU 108 7.313 -5.631 6.281 887 HG LEU 108 HG LEU 108 8.104 -2.742 5.920 888 HD11 LEU 108 HD11 LEU 108 5.935 -3.513 7.118 889 HD12 LEU 108 HD12 LEU 108 6.974 -2.311 7.882 890 HD13 LEU 108 HD13 LEU 108 7.035 -3.992 8.410 891 HD21 LEU 108 HD21 LEU 108 9.916 -2.999 7.220 892 HD22 LEU 108 HD22 LEU 108 9.842 -4.683 6.700 893 HD23 LEU 108 HD23 LEU 108 9.137 -4.206 8.243 894 H ALA 109 HN ALA 109 8.425 -3.923 2.537 895 HA ALA 109 HA ALA 109 7.371 -6.106 0.908 896 HB1 ALA 109 HB1 ALA 109 5.300 -5.311 0.747 897 HB2 ALA 109 HB2 ALA 109 5.891 -3.701 0.341 898 HB3 ALA 109 HB3 ALA 109 5.697 -4.171 2.030 899 H LYS 110 HN LYS 110 7.326 -5.530 -1.424 900 HA LYS 110 HA LYS 110 9.176 -3.358 -2.116 901 HB2 LYS 110 HB2 LYS 110 9.379 -6.021 -3.489 902 HB3 LYS 110 HB1 LYS 110 10.551 -4.711 -3.447 903 HG2 LYS 110 HG2 LYS 110 11.081 -5.190 -1.150 904 HG3 LYS 110 HG1 LYS 110 9.809 -6.411 -1.076 905 HD2 LYS 110 HD2 LYS 110 12.133 -6.552 -2.987 906 HD3 LYS 110 HD1 LYS 110 12.146 -7.298 -1.388 907 HE2 LYS 110 HE2 LYS 110 10.816 -8.986 -2.033 908 HE3 LYS 110 HE1 LYS 110 9.776 -7.930 -2.986 909 HZ1 LYS 110 HZ1 LYS 110 10.812 -9.374 -4.501 910 HZ2 LYS 110 HZ2 LYS 110 12.338 -9.173 -3.800 911 HZ3 LYS 110 HZ3 LYS 110 11.632 -7.903 -4.666 912 H VAL 111 HN VAL 111 9.150 -2.859 -4.474 913 HA VAL 111 HA VAL 111 6.492 -2.488 -5.358 914 HB VAL 111 HB VAL 111 9.168 -2.018 -6.647 915 HG11 VAL 111 HG11 VAL 111 7.948 -0.867 -8.490 916 HG12 VAL 111 HG12 VAL 111 6.460 -1.609 -7.902 917 HG13 VAL 111 HG13 VAL 111 7.775 -2.622 -8.497 918 HG21 VAL 111 HG21 VAL 111 8.523 0.320 -6.454 919 HG22 VAL 111 HG22 VAL 111 8.429 -0.485 -4.888 920 HG23 VAL 111 HG23 VAL 111 6.956 -0.153 -5.799 921 H ALA 112 HN ALA 112 5.226 -4.032 -6.119 922 HA ALA 112 HA ALA 112 6.239 -5.814 -8.198 923 HB1 ALA 112 HB1 ALA 112 4.592 -7.010 -6.006 924 HB2 ALA 112 HB2 ALA 112 6.342 -6.870 -5.834 925 HB3 ALA 112 HB3 ALA 112 5.660 -7.803 -7.165 926 H TYR 113 HN TYR 113 4.424 -7.031 -9.259 927 HA TYR 113 HA TYR 113 2.469 -7.008 -10.423 928 HB2 TYR 113 HB2 TYR 113 1.666 -6.094 -7.701 929 HB3 TYR 113 HB1 TYR 113 0.490 -5.940 -9.001 930 HD1 TYR 113 HD2 TYR 113 2.671 -8.393 -7.269 931 HD2 TYR 113 HD1 TYR 113 -0.769 -7.793 -9.694 932 HE1 TYR 113 HE2 TYR 113 2.072 -10.762 -6.991 933 HE2 TYR 113 HE1 TYR 113 -1.381 -10.159 -9.425 934 HH TYR 113 HH TYR 113 -0.918 -11.993 -7.677 935 H VAL 114 HN VAL 114 4.156 -5.025 -11.152 936 HA VAL 114 HA VAL 114 2.543 -2.581 -11.323 937 HB VAL 114 HB VAL 114 4.850 -2.295 -10.544 938 HG11 VAL 114 HG11 VAL 114 5.486 -4.226 -12.394 939 HG12 VAL 114 HG12 VAL 114 6.635 -3.235 -11.494 940 HG13 VAL 114 HG13 VAL 114 6.134 -2.753 -13.115 941 HG21 VAL 114 HG21 VAL 114 4.060 -1.103 -13.179 942 HG22 VAL 114 HG22 VAL 114 5.572 -0.651 -12.392 943 HG23 VAL 114 HG23 VAL 114 4.035 -0.372 -11.574 944 H TYR 115 HN TYR 115 1.255 -2.468 -13.030 945 HA TYR 115 HA TYR 115 2.306 -3.325 -15.642 946 HB2 TYR 115 HB2 TYR 115 -0.268 -3.755 -16.099 947 HB3 TYR 115 HB1 TYR 115 0.749 -4.993 -15.378 948 HD1 TYR 115 HD2 TYR 115 -1.132 -2.024 -14.113 949 HD2 TYR 115 HD1 TYR 115 -0.311 -6.175 -13.711 950 HE1 TYR 115 HE2 TYR 115 -2.656 -2.130 -12.184 951 HE2 TYR 115 HE1 TYR 115 -1.831 -6.297 -11.782 952 HH TYR 115 HH TYR 115 -4.045 -3.929 -11.034 953 H LYS 116 HN LYS 116 1.686 -2.078 -17.427 954 HA LYS 116 HA LYS 116 0.677 0.579 -16.708 955 HB2 LYS 116 HB2 LYS 116 2.050 -0.166 -19.282 956 HB3 LYS 116 HB1 LYS 116 1.827 1.439 -18.597 957 HG2 LYS 116 HG2 LYS 116 3.576 -0.738 -17.475 958 HG3 LYS 116 HG1 LYS 116 4.125 0.695 -18.348 959 HD2 LYS 116 HD2 LYS 116 2.422 1.029 -15.919 960 HD3 LYS 116 HD1 LYS 116 4.132 0.634 -15.724 961 HE2 LYS 116 HE2 LYS 116 4.062 2.974 -15.668 962 HE3 LYS 116 HE1 LYS 116 4.585 2.586 -17.306 963 HZ1 LYS 116 HZ1 LYS 116 1.722 2.958 -16.772 964 HZ2 LYS 116 HZ2 LYS 116 2.594 3.237 -18.194 965 HZ3 LYS 116 HZ3 LYS 116 2.713 4.322 -16.901 966 HA PRO 117 HA PRO 117 0.188 2.308 -17.858 967 HB2 PRO 117 HB2 PRO 117 -1.820 3.988 -18.333 968 HB3 PRO 117 HB1 PRO 117 -0.879 3.310 -19.667 969 HG2 PRO 117 HG2 PRO 117 -3.602 2.573 -18.702 970 HG3 PRO 117 HG1 PRO 117 -2.972 2.621 -20.356 971 HD2 PRO 117 HD2 PRO 117 -3.222 0.337 -18.737 972 HD3 PRO 117 HD1 PRO 117 -2.293 0.458 -20.243 973 H ASN 118 HN ASN 118 0.345 2.066 -15.655 974 HA ASN 118 HA ASN 118 -1.853 3.047 -14.061 975 HB2 ASN 118 HB2 ASN 118 -0.737 0.312 -13.430 976 HB3 ASN 118 HB1 ASN 118 -2.049 1.143 -12.606 977 HD21 ASN 118 HD21 ASN 118 -1.096 -0.296 -15.677 978 HD22 ASN 118 HD22 ASN 118 -2.697 -0.713 -16.178 979 H ASN 119 HN ASN 119 -1.021 2.450 -11.567 980 HA ASN 119 HA ASN 119 0.454 2.965 -9.926 981 HB2 ASN 119 HB2 ASN 119 2.595 2.771 -12.052 982 HB3 ASN 119 HB1 ASN 119 2.828 2.689 -10.309 983 HD21 ASN 119 HD21 ASN 119 1.957 0.988 -13.151 984 HD22 ASN 119 HD22 ASN 119 1.755 -0.568 -12.427 985 H THR 120 HN THR 120 -0.881 5.076 -10.766 986 HA THR 120 HA THR 120 0.263 7.253 -11.922 987 HB THR 120 HB THR 120 -1.122 7.780 -9.347 988 HG1 THR 120 HG1 THR 120 -2.354 6.088 -9.850 989 HG21 THR 120 HG21 THR 120 -1.712 8.703 -12.145 990 HG22 THR 120 HG22 THR 120 -0.740 9.580 -10.966 991 HG23 THR 120 HG23 THR 120 -2.453 9.293 -10.659 992 H HIS 121 HN HIS 121 1.044 5.921 -8.778 993 HA HIS 121 HA HIS 121 2.936 8.126 -8.312 994 HB2 HIS 121 HB2 HIS 121 1.472 6.261 -6.488 995 HB3 HIS 121 HB1 HIS 121 3.006 6.944 -5.961 996 HD1 HIS 121 HD1 HIS 121 -0.200 7.538 -5.156 997 HD2 HIS 121 HD2 HIS 121 2.622 10.018 -6.931 998 HE1 HIS 121 HE1 HIS 121 -0.981 9.882 -4.693 999 HE2 HIS 121 HE2 HIS 121 0.791 11.365 -5.699 1000 H GLU 122 HN GLU 122 3.398 5.866 -10.139 1001 HA GLU 122 HA GLU 122 5.091 3.936 -9.018 1002 HB2 GLU 122 HB2 GLU 122 4.064 3.989 -11.358 1003 HB3 GLU 122 HB1 GLU 122 5.398 5.041 -11.804 1004 HG2 GLU 122 HG2 GLU 122 6.948 3.233 -10.999 1005 HG3 GLU 122 HG1 GLU 122 5.533 2.190 -10.873 1006 H GLN 123 HN GLN 123 5.812 7.099 -10.443 1007 HA GLN 123 HA GLN 123 8.584 7.009 -10.350 1008 HB2 GLN 123 HB2 GLN 123 6.849 9.435 -9.854 1009 HB3 GLN 123 HB1 GLN 123 8.523 9.440 -10.392 1010 HG2 GLN 123 HG2 GLN 123 6.667 7.903 -12.072 1011 HG3 GLN 123 HG1 GLN 123 6.395 9.645 -12.031 1012 HE21 GLN 123 HE21 GLN 123 8.984 7.262 -12.431 1013 HE22 GLN 123 HE22 GLN 123 9.870 8.164 -13.608 1014 H LEU 124 HN LEU 124 6.308 7.315 -7.765 1015 HA LEU 124 HA LEU 124 8.209 8.391 -5.880 1016 HB2 LEU 124 HB2 LEU 124 5.832 8.927 -5.694 1017 HB3 LEU 124 HB1 LEU 124 5.454 7.229 -5.469 1018 HG LEU 124 HG LEU 124 7.047 7.426 -3.404 1019 HD11 LEU 124 HD11 LEU 124 7.598 9.839 -4.187 1020 HD12 LEU 124 HD12 LEU 124 7.366 9.513 -2.470 1021 HD13 LEU 124 HD13 LEU 124 6.069 10.249 -3.411 1022 HD21 LEU 124 HD21 LEU 124 5.109 8.142 -2.023 1023 HD22 LEU 124 HD22 LEU 124 4.718 6.890 -3.203 1024 HD23 LEU 124 HD23 LEU 124 4.259 8.565 -3.510 1025 H LEU 125 HN LEU 125 6.595 5.258 -6.376 1026 HA LEU 125 HA LEU 125 8.078 3.985 -4.275 1027 HB2 LEU 125 HB2 LEU 125 6.287 2.912 -6.448 1028 HB3 LEU 125 HB1 LEU 125 7.061 1.890 -5.253 1029 HG LEU 125 HG LEU 125 5.804 3.802 -3.705 1030 HD11 LEU 125 HD11 LEU 125 4.507 4.774 -5.387 1031 HD12 LEU 125 HD12 LEU 125 3.423 3.625 -4.605 1032 HD13 LEU 125 HD13 LEU 125 4.170 3.221 -6.150 1033 HD21 LEU 125 HD21 LEU 125 4.385 1.281 -4.433 1034 HD22 LEU 125 HD22 LEU 125 4.622 2.024 -2.851 1035 HD23 LEU 125 HD23 LEU 125 5.960 1.194 -3.646 1036 H ARG 126 HN ARG 126 8.498 4.460 -7.691 1037 HA ARG 126 HA ARG 126 10.237 2.373 -8.312 1038 HB2 ARG 126 HB2 ARG 126 9.198 4.116 -9.871 1039 HB3 ARG 126 HB1 ARG 126 10.528 5.167 -9.406 1040 HG2 ARG 126 HG2 ARG 126 12.132 3.600 -10.296 1041 HG3 ARG 126 HG1 ARG 126 10.845 2.449 -10.664 1042 HD2 ARG 126 HD2 ARG 126 9.857 4.079 -12.218 1043 HD3 ARG 126 HD1 ARG 126 11.176 5.196 -11.868 1044 HE ARG 126 HE ARG 126 12.472 4.028 -13.332 1045 HH11 ARG 126 HH11 ARG 126 9.845 1.966 -12.317 1046 HH12 ARG 126 HH12 ARG 126 10.266 0.685 -13.403 1047 HH21 ARG 126 HH21 ARG 126 13.025 2.345 -14.763 1048 HH22 ARG 126 HH22 ARG 126 12.072 0.898 -14.791 1049 H LYS 127 HN LYS 127 10.782 5.355 -6.586 1050 HA LYS 127 HA LYS 127 13.654 5.124 -6.622 1051 HB2 LYS 127 HB2 LYS 127 12.103 6.854 -4.715 1052 HB3 LYS 127 HB1 LYS 127 13.701 7.125 -5.391 1053 HG2 LYS 127 HG2 LYS 127 11.191 7.159 -7.040 1054 HG3 LYS 127 HG1 LYS 127 11.880 8.596 -6.283 1055 HD2 LYS 127 HD2 LYS 127 13.796 7.004 -7.830 1056 HD3 LYS 127 HD1 LYS 127 12.489 7.702 -8.788 1057 HE2 LYS 127 HE2 LYS 127 14.213 9.263 -6.870 1058 HE3 LYS 127 HE1 LYS 127 14.513 9.148 -8.603 1059 HZ1 LYS 127 HZ1 LYS 127 13.033 11.058 -7.450 1060 HZ2 LYS 127 HZ2 LYS 127 11.828 9.952 -7.880 1061 HZ3 LYS 127 HZ3 LYS 127 12.865 10.575 -9.062 1062 H SER 128 HN SER 128 11.181 4.946 -4.062 1063 HA SER 128 HA SER 128 12.797 4.130 -1.976 1064 HB2 SER 128 HB2 SER 128 10.649 4.694 -1.316 1065 HB3 SER 128 HB1 SER 128 9.896 3.774 -2.619 1066 HG SER 128 HG SER 128 9.560 2.576 -0.826 1067 H GLU 129 HN GLU 129 11.341 2.214 -4.541 1068 HA GLU 129 HA GLU 129 11.864 -0.333 -3.469 1069 HB2 GLU 129 HB2 GLU 129 10.330 -0.110 -5.301 1070 HB3 GLU 129 HB1 GLU 129 11.563 0.614 -6.320 1071 HG2 GLU 129 HG2 GLU 129 11.103 -1.700 -6.938 1072 HG3 GLU 129 HG1 GLU 129 12.769 -1.481 -6.405 1073 H ALA 130 HN ALA 130 13.692 1.510 -5.913 1074 HA ALA 130 HA ALA 130 15.867 -0.316 -5.937 1075 HB1 ALA 130 HB1 ALA 130 16.547 0.832 -7.728 1076 HB2 ALA 130 HB2 ALA 130 16.462 2.378 -6.882 1077 HB3 ALA 130 HB3 ALA 130 15.006 1.680 -7.592 1078 H GLN 131 HN GLN 131 15.193 2.640 -4.177 1079 HA GLN 131 HA GLN 131 17.842 3.114 -3.295 1080 HB2 GLN 131 HB2 GLN 131 15.159 4.161 -2.663 1081 HB3 GLN 131 HB1 GLN 131 16.325 4.269 -1.354 1082 HG2 GLN 131 HG2 GLN 131 17.066 6.134 -2.275 1083 HG3 GLN 131 HG1 GLN 131 17.705 5.156 -3.595 1084 HE21 GLN 131 HE21 GLN 131 16.658 5.128 -5.549 1085 HE22 GLN 131 HE22 GLN 131 15.372 6.211 -5.946 1086 H ALA 132 HN ALA 132 15.038 1.751 -1.558 1087 HA ALA 132 HA ALA 132 16.453 1.025 0.751 1088 HB1 ALA 132 HB1 ALA 132 14.011 1.193 0.663 1089 HB2 ALA 132 HB2 ALA 132 14.531 -0.372 1.288 1090 HB3 ALA 132 HB3 ALA 132 13.952 -0.232 -0.372 1091 H LYS 133 HN LYS 133 16.250 -0.456 -2.363 1092 HA LYS 133 HA LYS 133 16.998 -3.093 -1.584 1093 HB2 LYS 133 HB2 LYS 133 16.249 -1.761 -3.974 1094 HB3 LYS 133 HB1 LYS 133 17.814 -2.508 -4.269 1095 HG2 LYS 133 HG2 LYS 133 16.946 -4.555 -4.339 1096 HG3 LYS 133 HG1 LYS 133 15.972 -4.285 -2.892 1097 HD2 LYS 133 HD2 LYS 133 14.370 -2.992 -4.306 1098 HD3 LYS 133 HD1 LYS 133 15.301 -3.489 -5.722 1099 HE2 LYS 133 HE2 LYS 133 14.930 -5.881 -4.900 1100 HE3 LYS 133 HE1 LYS 133 13.707 -5.195 -3.830 1101 HZ1 LYS 133 HZ1 LYS 133 13.113 -4.132 -6.263 1102 HZ2 LYS 133 HZ2 LYS 133 12.328 -5.445 -5.541 1103 HZ3 LYS 133 HZ3 LYS 133 13.582 -5.712 -6.644 1104 H LYS 134 HN LYS 134 18.805 -0.429 -3.105 1105 HA LYS 134 HA LYS 134 21.300 -1.621 -3.217 1106 HB2 LYS 134 HB2 LYS 134 20.869 0.467 -4.335 1107 HB3 LYS 134 HB1 LYS 134 20.553 1.276 -2.807 1108 HG2 LYS 134 HG2 LYS 134 22.994 0.621 -2.238 1109 HG3 LYS 134 HG1 LYS 134 23.158 0.409 -3.982 1110 HD2 LYS 134 HD2 LYS 134 23.838 2.646 -3.365 1111 HD3 LYS 134 HD1 LYS 134 22.346 2.720 -4.304 1112 HE2 LYS 134 HE2 LYS 134 21.292 3.751 -2.641 1113 HE3 LYS 134 HE1 LYS 134 21.739 2.476 -1.509 1114 HZ1 LYS 134 HZ1 LYS 134 23.548 3.625 -0.782 1115 HZ2 LYS 134 HZ2 LYS 134 22.543 4.928 -1.172 1116 HZ3 LYS 134 HZ3 LYS 134 23.769 4.457 -2.239 1117 H GLU 135 HN GLU 135 19.746 0.029 -0.521 1118 HA GLU 135 HA GLU 135 22.119 -0.359 1.138 1119 HB2 GLU 135 HB2 GLU 135 20.029 0.726 2.707 1120 HB3 GLU 135 HB1 GLU 135 21.470 1.538 2.110 1121 HG2 GLU 135 HG2 GLU 135 20.203 2.026 0.001 1122 HG3 GLU 135 HG1 GLU 135 18.763 1.413 0.813 1123 H LYS 136 HN LYS 136 19.293 -2.035 0.388 1124 HA LYS 136 HA LYS 136 18.119 -3.715 1.398 1125 HB2 LYS 136 HB2 LYS 136 20.909 -4.244 2.435 1126 HB3 LYS 136 HB1 LYS 136 19.580 -5.389 2.562 1127 HG2 LYS 136 HG2 LYS 136 19.387 -5.299 0.066 1128 HG3 LYS 136 HG1 LYS 136 20.881 -4.361 0.056 1129 HD2 LYS 136 HD2 LYS 136 21.776 -6.440 -0.199 1130 HD3 LYS 136 HD1 LYS 136 21.694 -6.404 1.565 1131 HE2 LYS 136 HE2 LYS 136 19.909 -7.843 1.646 1132 HE3 LYS 136 HE1 LYS 136 19.329 -7.385 0.046 1133 HZ1 LYS 136 HZ1 LYS 136 20.583 -9.668 0.547 1134 HZ2 LYS 136 HZ2 LYS 136 21.915 -8.710 0.139 1135 HZ3 LYS 136 HZ3 LYS 136 20.642 -8.897 -0.958 1136 H LEU 137 HN LEU 137 17.194 -1.808 2.643 1137 HA LEU 137 HA LEU 137 17.866 -1.067 5.182 1138 HB2 LEU 137 HB2 LEU 137 15.322 -1.172 3.663 1139 HB3 LEU 137 HB1 LEU 137 15.192 -0.950 5.401 1140 HG LEU 137 HG LEU 137 16.680 0.830 3.471 1141 HD11 LEU 137 HD11 LEU 137 13.997 0.850 4.638 1142 HD12 LEU 137 HD12 LEU 137 14.627 1.683 3.217 1143 HD13 LEU 137 HD13 LEU 137 14.879 2.366 4.823 1144 HD21 LEU 137 HD21 LEU 137 16.671 2.228 5.741 1145 HD22 LEU 137 HD22 LEU 137 17.988 1.143 5.298 1146 HD23 LEU 137 HD23 LEU 137 16.742 0.603 6.423 1147 H ASN 138 HN ASN 138 14.872 -2.898 5.173 1148 HA ASN 138 HA ASN 138 16.075 -4.766 7.104 1149 HB2 ASN 138 HB2 ASN 138 13.889 -4.755 8.304 1150 HB3 ASN 138 HB1 ASN 138 14.717 -3.203 8.343 1151 HD21 ASN 138 HD21 ASN 138 13.440 -1.540 8.043 1152 HD22 ASN 138 HD22 ASN 138 12.000 -1.512 7.089 1153 H ILE 139 HN ILE 139 15.766 -6.857 6.729 1154 HA ILE 139 HA ILE 139 14.883 -8.815 5.964 1155 HB ILE 139 HB ILE 139 12.616 -7.254 4.739 1156 HG12 ILE 139 HG12 ILE 139 11.906 -8.533 7.206 1157 HG13 ILE 139 HG11 ILE 139 13.293 -7.484 7.488 1158 HG21 ILE 139 HG21 ILE 139 12.487 -9.392 3.883 1159 HG22 ILE 139 HG22 ILE 139 11.479 -9.517 5.325 1160 HG23 ILE 139 HG23 ILE 139 13.131 -10.131 5.350 1161 HD11 ILE 139 HD11 ILE 139 11.883 -5.792 7.633 1162 HD12 ILE 139 HD12 ILE 139 10.534 -6.805 7.112 1163 HD13 ILE 139 HD13 ILE 139 11.541 -5.991 5.914 1164 H TRP 140 HN TRP 140 16.101 -6.404 4.108 1165 HA TRP 140 HA TRP 140 15.536 -7.472 1.499 1166 HB2 TRP 140 HB2 TRP 140 17.690 -5.517 2.337 1167 HB3 TRP 140 HB1 TRP 140 17.179 -5.851 0.685 1168 HD1 TRP 140 HD1 TRP 140 15.858 -4.294 3.936 1169 HE1 TRP 140 HE1 TRP 140 14.050 -2.565 3.333 1170 HE3 TRP 140 HE3 TRP 140 15.588 -5.138 -1.091 1171 HZ2 TRP 140 HZ2 TRP 140 12.695 -1.679 1.036 1172 HZ3 TRP 140 HZ3 TRP 140 14.001 -3.807 -2.426 1173 HH2 TRP 140 HH2 TRP 140 12.583 -2.114 -1.382 Start of MODEL 14 1 H1 ALA 1 HT1 ALA 1 -20.093 27.102 1.261 2 H2 ALA 1 HT2 ALA 1 -20.802 26.438 2.676 3 H3 ALA 1 HT3 ALA 1 -21.013 28.101 2.307 4 HA ALA 1 HA ALA 1 -22.983 27.155 1.715 5 HB1 ALA 1 HB1 ALA 1 -21.795 26.882 -0.964 6 HB2 ALA 1 HB2 ALA 1 -21.458 28.398 -0.129 7 HB3 ALA 1 HB3 ALA 1 -23.126 27.896 -0.407 8 H THR 2 HN THR 2 -20.259 25.128 0.899 9 HA THR 2 HA THR 2 -20.053 22.908 0.448 10 HB THR 2 HB THR 2 -21.360 21.418 1.764 11 HG1 THR 2 HG1 THR 2 -23.427 22.030 1.251 12 HG21 THR 2 HG21 THR 2 -21.099 22.215 3.898 13 HG22 THR 2 HG22 THR 2 -21.591 23.852 3.464 14 HG23 THR 2 HG23 THR 2 -20.000 23.256 2.993 15 H SER 3 HN SER 3 -20.595 23.751 -1.814 16 HA SER 3 HA SER 3 -22.550 21.946 -2.953 17 HB2 SER 3 HB2 SER 3 -23.517 24.397 -2.363 18 HB3 SER 3 HB1 SER 3 -22.855 24.716 -3.967 19 HG SER 3 HG SER 3 -24.229 23.275 -4.838 20 H THR 4 HN THR 4 -19.656 22.295 -3.018 21 HA THR 4 HA THR 4 -19.228 21.893 -5.781 22 HB THR 4 HB THR 4 -19.458 24.312 -5.925 23 HG1 THR 4 HG1 THR 4 -17.743 23.155 -7.105 24 HG21 THR 4 HG21 THR 4 -18.068 25.862 -4.802 25 HG22 THR 4 HG22 THR 4 -17.105 24.573 -4.078 26 HG23 THR 4 HG23 THR 4 -18.777 24.814 -3.573 27 H LYS 5 HN LYS 5 -18.646 20.588 -3.316 28 HA LYS 5 HA LYS 5 -15.790 20.881 -2.890 29 HB2 LYS 5 HB2 LYS 5 -18.003 19.389 -1.565 30 HB3 LYS 5 HB1 LYS 5 -16.368 18.774 -1.374 31 HG2 LYS 5 HG2 LYS 5 -16.496 21.628 -0.919 32 HG3 LYS 5 HG1 LYS 5 -17.592 20.739 0.141 33 HD2 LYS 5 HD2 LYS 5 -14.957 19.503 -0.110 34 HD3 LYS 5 HD1 LYS 5 -14.905 21.130 0.572 35 HE2 LYS 5 HE2 LYS 5 -15.795 20.453 2.505 36 HE3 LYS 5 HE1 LYS 5 -17.050 19.520 1.693 37 HZ1 LYS 5 HZ1 LYS 5 -14.256 18.621 2.152 38 HZ2 LYS 5 HZ2 LYS 5 -15.465 17.725 1.380 39 HZ3 LYS 5 HZ3 LYS 5 -15.614 18.106 3.021 40 H LYS 6 HN LYS 6 -15.950 20.250 -5.424 41 HA LYS 6 HA LYS 6 -15.804 17.354 -5.744 42 HB2 LYS 6 HB2 LYS 6 -17.004 18.896 -7.382 43 HB3 LYS 6 HB1 LYS 6 -15.409 19.428 -7.896 44 HG2 LYS 6 HG2 LYS 6 -14.842 17.221 -8.631 45 HG3 LYS 6 HG1 LYS 6 -16.333 16.565 -7.956 46 HD2 LYS 6 HD2 LYS 6 -16.521 16.846 -10.371 47 HD3 LYS 6 HD1 LYS 6 -17.637 17.920 -9.525 48 HE2 LYS 6 HE2 LYS 6 -16.572 19.114 -11.337 49 HE3 LYS 6 HE1 LYS 6 -16.027 19.764 -9.792 50 HZ1 LYS 6 HZ1 LYS 6 -14.498 18.619 -11.885 51 HZ2 LYS 6 HZ2 LYS 6 -14.241 17.764 -10.449 52 HZ3 LYS 6 HZ3 LYS 6 -13.968 19.432 -10.498 53 H LEU 7 HN LEU 7 -13.893 16.879 -4.649 54 HA LEU 7 HA LEU 7 -11.423 18.179 -5.420 55 HB2 LEU 7 HB2 LEU 7 -11.955 15.856 -3.566 56 HB3 LEU 7 HB1 LEU 7 -10.395 16.623 -3.788 57 HG LEU 7 HG LEU 7 -11.305 17.474 -1.771 58 HD11 LEU 7 HD11 LEU 7 -12.065 19.767 -3.450 59 HD12 LEU 7 HD12 LEU 7 -10.469 19.082 -3.761 60 HD13 LEU 7 HD13 LEU 7 -10.885 19.653 -2.145 61 HD21 LEU 7 HD21 LEU 7 -13.764 18.431 -3.193 62 HD22 LEU 7 HD22 LEU 7 -13.477 18.270 -1.460 63 HD23 LEU 7 HD23 LEU 7 -13.687 16.830 -2.456 64 H HIS 8 HN HIS 8 -9.646 16.005 -5.317 65 HA HIS 8 HA HIS 8 -10.370 14.526 -7.755 66 HB2 HIS 8 HB2 HIS 8 -8.378 16.335 -7.625 67 HB3 HIS 8 HB1 HIS 8 -7.504 14.907 -7.079 68 HD1 HIS 8 HD1 HIS 8 -8.507 16.636 -10.079 69 HD2 HIS 8 HD2 HIS 8 -7.741 12.688 -9.036 70 HE1 HIS 8 HE1 HIS 8 -8.128 15.428 -12.253 71 HE2 HIS 8 HE2 HIS 8 -7.746 13.024 -11.600 72 H LYS 9 HN LYS 9 -8.991 14.452 -4.559 73 HA LYS 9 HA LYS 9 -8.632 11.556 -4.776 74 HB2 LYS 9 HB2 LYS 9 -7.238 11.756 -2.739 75 HB3 LYS 9 HB1 LYS 9 -6.610 12.693 -4.086 76 HG2 LYS 9 HG2 LYS 9 -8.421 14.156 -2.301 77 HG3 LYS 9 HG1 LYS 9 -6.906 13.628 -1.567 78 HD2 LYS 9 HD2 LYS 9 -7.125 15.187 -4.142 79 HD3 LYS 9 HD1 LYS 9 -6.769 15.891 -2.564 80 HE2 LYS 9 HE2 LYS 9 -4.621 15.325 -2.712 81 HE3 LYS 9 HE1 LYS 9 -5.025 13.659 -3.125 82 HZ1 LYS 9 HZ1 LYS 9 -3.959 14.323 -5.012 83 HZ2 LYS 9 HZ2 LYS 9 -4.469 15.931 -4.892 84 HZ3 LYS 9 HZ3 LYS 9 -5.543 14.742 -5.432 85 H GLU 10 HN GLU 10 -9.420 10.209 -3.075 86 HA GLU 10 HA GLU 10 -11.573 11.440 -1.485 87 HB2 GLU 10 HB2 GLU 10 -12.087 9.827 -3.545 88 HB3 GLU 10 HB1 GLU 10 -11.815 8.595 -2.320 89 HG2 GLU 10 HG2 GLU 10 -14.118 8.974 -2.303 90 HG3 GLU 10 HG1 GLU 10 -13.504 9.848 -0.901 91 HA PRO 11 HA PRO 11 -9.374 9.453 1.853 92 HB2 PRO 11 HB2 PRO 11 -10.893 10.304 3.881 93 HB3 PRO 11 HB1 PRO 11 -9.874 11.425 2.969 94 HG2 PRO 11 HG2 PRO 11 -12.818 10.947 2.767 95 HG3 PRO 11 HG1 PRO 11 -11.925 12.476 2.707 96 HD2 PRO 11 HD2 PRO 11 -12.845 11.103 0.492 97 HD3 PRO 11 HD1 PRO 11 -11.516 12.277 0.472 98 H ALA 12 HN ALA 12 -10.042 8.097 3.850 99 HA ALA 12 HA ALA 12 -12.501 6.665 3.707 100 HB1 ALA 12 HB1 ALA 12 -11.577 4.465 3.168 101 HB2 ALA 12 HB2 ALA 12 -10.000 5.199 2.883 102 HB3 ALA 12 HB3 ALA 12 -11.361 5.601 1.837 103 H THR 13 HN THR 13 -12.698 5.031 5.379 104 HA THR 13 HA THR 13 -10.756 5.412 7.563 105 HB THR 13 HB THR 13 -13.502 4.616 8.298 106 HG1 THR 13 HG1 THR 13 -14.295 6.123 7.031 107 HG21 THR 13 HG21 THR 13 -13.147 6.509 9.943 108 HG22 THR 13 HG22 THR 13 -11.490 6.573 9.344 109 HG23 THR 13 HG23 THR 13 -12.097 5.102 10.103 110 H LEU 14 HN LEU 14 -9.843 3.615 8.359 111 HA LEU 14 HA LEU 14 -10.112 1.134 7.132 112 HB2 LEU 14 HB2 LEU 14 -8.546 2.252 9.209 113 HB3 LEU 14 HB1 LEU 14 -9.248 0.774 9.844 114 HG LEU 14 HG LEU 14 -6.959 0.576 8.771 115 HD11 LEU 14 HD11 LEU 14 -8.663 -1.265 7.254 116 HD12 LEU 14 HD12 LEU 14 -9.007 -1.189 8.982 117 HD13 LEU 14 HD13 LEU 14 -7.385 -1.597 8.423 118 HD21 LEU 14 HD21 LEU 14 -8.432 0.574 6.165 119 HD22 LEU 14 HD22 LEU 14 -6.696 0.660 6.465 120 HD23 LEU 14 HD23 LEU 14 -7.720 2.056 6.801 121 H ILE 15 HN ILE 15 -11.936 -0.009 7.061 122 HA ILE 15 HA ILE 15 -13.858 0.012 9.194 123 HB ILE 15 HB ILE 15 -13.709 -1.838 6.808 124 HG12 ILE 15 HG12 ILE 15 -13.792 0.554 6.167 125 HG13 ILE 15 HG11 ILE 15 -15.255 -0.312 5.709 126 HG21 ILE 15 HG21 ILE 15 -16.324 -1.178 7.934 127 HG22 ILE 15 HG22 ILE 15 -15.278 -2.076 9.033 128 HG23 ILE 15 HG23 ILE 15 -15.658 -2.736 7.443 129 HD11 ILE 15 HD11 ILE 15 -16.139 0.581 7.998 130 HD12 ILE 15 HD12 ILE 15 -16.123 1.618 6.571 131 HD13 ILE 15 HD13 ILE 15 -14.858 1.773 7.790 132 H LYS 16 HN LYS 16 -11.410 -2.192 7.952 133 HA LYS 16 HA LYS 16 -10.977 -3.381 10.479 134 HB2 LYS 16 HB2 LYS 16 -12.963 -4.633 8.751 135 HB3 LYS 16 HB1 LYS 16 -11.644 -5.729 9.140 136 HG2 LYS 16 HG2 LYS 16 -12.915 -4.176 11.338 137 HG3 LYS 16 HG1 LYS 16 -13.765 -5.567 10.664 138 HD2 LYS 16 HD2 LYS 16 -12.086 -7.058 11.312 139 HD3 LYS 16 HD1 LYS 16 -10.898 -5.769 11.520 140 HE2 LYS 16 HE2 LYS 16 -12.448 -4.919 13.382 141 HE3 LYS 16 HE1 LYS 16 -13.199 -6.511 13.297 142 HZ1 LYS 16 HZ1 LYS 16 -11.453 -6.377 14.992 143 HZ2 LYS 16 HZ2 LYS 16 -10.312 -6.025 13.794 144 HZ3 LYS 16 HZ3 LYS 16 -11.090 -7.526 13.804 145 H ALA 17 HN ALA 17 -8.920 -4.018 10.520 146 HA ALA 17 HA ALA 17 -7.387 -4.018 8.104 147 HB1 ALA 17 HB1 ALA 17 -5.918 -3.246 9.588 148 HB2 ALA 17 HB2 ALA 17 -5.716 -4.916 10.119 149 HB3 ALA 17 HB3 ALA 17 -6.860 -3.860 10.947 150 H ILE 18 HN ILE 18 -6.868 -5.714 6.881 151 HA ILE 18 HA ILE 18 -7.646 -8.379 7.757 152 HB ILE 18 HB ILE 18 -6.353 -7.862 5.110 153 HG12 ILE 18 HG12 ILE 18 -8.404 -6.242 5.845 154 HG13 ILE 18 HG11 ILE 18 -8.091 -6.737 4.192 155 HG21 ILE 18 HG21 ILE 18 -7.821 -9.664 4.386 156 HG22 ILE 18 HG22 ILE 18 -8.547 -9.725 5.992 157 HG23 ILE 18 HG23 ILE 18 -6.849 -10.147 5.776 158 HD11 ILE 18 HD11 ILE 18 -10.472 -6.915 5.008 159 HD12 ILE 18 HD12 ILE 18 -9.929 -8.262 6.008 160 HD13 ILE 18 HD13 ILE 18 -9.795 -8.356 4.251 161 H ASP 19 HN ASP 19 -4.808 -7.236 5.928 162 HA ASP 19 HA ASP 19 -3.018 -8.387 7.900 163 HB2 ASP 19 HB2 ASP 19 -3.533 -9.659 5.252 164 HB3 ASP 19 HB1 ASP 19 -1.879 -9.649 5.854 165 H GLY 20 HN GLY 20 -2.012 -8.121 4.573 166 HA2 GLY 20 HA2 GLY 20 -0.718 -5.542 5.215 167 HA3 GLY 20 HA1 GLY 20 0.109 -6.822 4.337 168 H ASP 21 HN ASP 21 -0.663 -7.389 2.223 169 HA ASP 21 HA ASP 21 -1.248 -5.172 0.606 170 HB2 ASP 21 HB2 ASP 21 -1.646 -6.919 -1.179 171 HB3 ASP 21 HB1 ASP 21 -0.082 -7.006 -0.374 172 H THR 22 HN THR 22 -3.290 -7.089 2.538 173 HA THR 22 HA THR 22 -5.644 -6.137 1.047 174 HB THR 22 HB THR 22 -5.787 -8.465 2.926 175 HG1 THR 22 HG1 THR 22 -4.875 -9.779 1.553 176 HG21 THR 22 HG21 THR 22 -7.897 -7.790 2.117 177 HG22 THR 22 HG22 THR 22 -7.451 -9.236 1.213 178 HG23 THR 22 HG23 THR 22 -7.298 -7.647 0.465 179 H VAL 23 HN VAL 23 -6.992 -4.826 2.092 180 HA VAL 23 HA VAL 23 -7.247 -4.873 4.969 181 HB VAL 23 HB VAL 23 -6.794 -2.412 5.178 182 HG11 VAL 23 HG11 VAL 23 -4.391 -4.027 4.340 183 HG12 VAL 23 HG12 VAL 23 -5.204 -4.191 5.896 184 HG13 VAL 23 HG13 VAL 23 -4.429 -2.668 5.462 185 HG21 VAL 23 HG21 VAL 23 -5.062 -1.675 3.338 186 HG22 VAL 23 HG22 VAL 23 -6.795 -1.471 3.088 187 HG23 VAL 23 HG23 VAL 23 -5.952 -2.834 2.352 188 H LYS 24 HN LYS 24 -9.189 -4.029 5.666 189 HA LYS 24 HA LYS 24 -11.109 -3.418 3.571 190 HB2 LYS 24 HB2 LYS 24 -11.554 -4.994 5.534 191 HB3 LYS 24 HB1 LYS 24 -11.666 -3.552 6.531 192 HG2 LYS 24 HG2 LYS 24 -13.870 -4.264 5.889 193 HG3 LYS 24 HG1 LYS 24 -13.493 -2.731 5.103 194 HD2 LYS 24 HD2 LYS 24 -14.602 -4.300 3.575 195 HD3 LYS 24 HD1 LYS 24 -12.974 -3.891 3.032 196 HE2 LYS 24 HE2 LYS 24 -13.451 -6.286 2.792 197 HE3 LYS 24 HE1 LYS 24 -12.127 -5.987 3.915 198 HZ1 LYS 24 HZ1 LYS 24 -13.591 -6.352 5.755 199 HZ2 LYS 24 HZ2 LYS 24 -13.730 -7.668 4.702 200 HZ3 LYS 24 HZ3 LYS 24 -14.936 -6.484 4.737 201 H LEU 25 HN LEU 25 -11.847 -1.427 3.106 202 HA LEU 25 HA LEU 25 -11.334 0.727 5.033 203 HB2 LEU 25 HB2 LEU 25 -10.430 0.483 2.243 204 HB3 LEU 25 HB1 LEU 25 -11.076 2.049 2.691 205 HG LEU 25 HG LEU 25 -8.887 0.684 4.247 206 HD11 LEU 25 HD11 LEU 25 -8.386 2.882 2.286 207 HD12 LEU 25 HD12 LEU 25 -8.406 1.201 1.754 208 HD13 LEU 25 HD13 LEU 25 -7.256 1.724 2.984 209 HD21 LEU 25 HD21 LEU 25 -9.765 3.563 4.093 210 HD22 LEU 25 HD22 LEU 25 -8.476 2.913 5.107 211 HD23 LEU 25 HD23 LEU 25 -10.151 2.444 5.401 212 H MET 26 HN MET 26 -12.702 2.607 4.792 213 HA MET 26 HA MET 26 -15.394 1.846 4.041 214 HB2 MET 26 HB2 MET 26 -14.676 3.136 6.167 215 HB3 MET 26 HB1 MET 26 -14.598 4.539 5.110 216 HG2 MET 26 HG2 MET 26 -16.892 4.485 4.673 217 HG3 MET 26 HG1 MET 26 -17.056 2.835 5.273 218 HE1 MET 26 HE1 MET 26 -19.118 5.316 7.644 219 HE2 MET 26 HE2 MET 26 -19.188 4.424 6.124 220 HE3 MET 26 HE3 MET 26 -18.494 6.044 6.165 221 H TYR 27 HN TYR 27 -16.227 2.234 2.120 222 HA TYR 27 HA TYR 27 -15.420 4.650 0.664 223 HB2 TYR 27 HB2 TYR 27 -14.244 2.555 -0.186 224 HB3 TYR 27 HB1 TYR 27 -15.828 1.994 -0.709 225 HD1 TYR 27 HD1 TYR 27 -14.411 5.428 -0.856 226 HD2 TYR 27 HD2 TYR 27 -15.694 2.013 -3.040 227 HE1 TYR 27 HE1 TYR 27 -14.152 6.683 -2.955 228 HE2 TYR 27 HE2 TYR 27 -15.438 3.255 -5.146 229 HH TYR 27 HH TYR 27 -15.501 5.958 -5.708 230 H LYS 28 HN LYS 28 -17.143 5.834 0.179 231 HA LYS 28 HA LYS 28 -19.270 6.480 -0.253 232 HB2 LYS 28 HB2 LYS 28 -19.285 3.719 -1.457 233 HB3 LYS 28 HB1 LYS 28 -20.674 4.791 -1.542 234 HG2 LYS 28 HG2 LYS 28 -19.233 6.476 -2.665 235 HG3 LYS 28 HG1 LYS 28 -17.942 5.275 -2.697 236 HD2 LYS 28 HD2 LYS 28 -18.827 4.248 -4.470 237 HD3 LYS 28 HD1 LYS 28 -20.429 4.204 -3.731 238 HE2 LYS 28 HE2 LYS 28 -21.128 6.020 -4.851 239 HE3 LYS 28 HE1 LYS 28 -19.591 6.859 -4.647 240 HZ1 LYS 28 HZ1 LYS 28 -20.441 5.030 -6.778 241 HZ2 LYS 28 HZ2 LYS 28 -18.798 5.109 -6.385 242 HZ3 LYS 28 HZ3 LYS 28 -19.613 6.502 -6.891 243 H GLY 29 HN GLY 29 -18.844 5.718 2.342 244 HA2 GLY 29 HA2 GLY 29 -20.003 5.228 4.259 245 HA3 GLY 29 HA1 GLY 29 -21.459 5.269 3.279 246 H GLN 30 HN GLN 30 -19.119 3.037 2.205 247 HA GLN 30 HA GLN 30 -20.343 0.843 3.717 248 HB2 GLN 30 HB2 GLN 30 -21.419 0.063 1.920 249 HB3 GLN 30 HB1 GLN 30 -20.819 1.407 0.962 250 HG2 GLN 30 HG2 GLN 30 -18.891 0.150 0.296 251 HG3 GLN 30 HG1 GLN 30 -19.309 -1.159 1.400 252 HE21 GLN 30 HE21 GLN 30 -18.923 -1.129 -1.520 253 HE22 GLN 30 HE22 GLN 30 -20.378 -1.776 -2.187 254 HA PRO 31 HA PRO 31 -16.210 -0.605 3.990 255 HB2 PRO 31 HB2 PRO 31 -16.574 -3.155 4.627 256 HB3 PRO 31 HB1 PRO 31 -17.191 -1.868 5.677 257 HG2 PRO 31 HG2 PRO 31 -18.673 -3.495 3.639 258 HG3 PRO 31 HG1 PRO 31 -19.131 -3.122 5.313 259 HD2 PRO 31 HD2 PRO 31 -20.054 -1.726 3.148 260 HD3 PRO 31 HD1 PRO 31 -19.883 -1.023 4.769 261 H MET 32 HN MET 32 -14.872 -0.774 2.332 262 HA MET 32 HA MET 32 -15.386 -2.834 0.291 263 HB2 MET 32 HB2 MET 32 -15.546 -0.309 -0.347 264 HB3 MET 32 HB1 MET 32 -13.790 -0.359 -0.281 265 HG2 MET 32 HG2 MET 32 -13.977 -0.889 -2.446 266 HG3 MET 32 HG1 MET 32 -14.266 -2.512 -1.823 267 HE1 MET 32 HE1 MET 32 -17.247 -2.486 -0.704 268 HE2 MET 32 HE2 MET 32 -16.455 -3.695 -1.715 269 HE3 MET 32 HE3 MET 32 -18.026 -3.046 -2.185 270 H THR 33 HN THR 33 -13.606 -3.968 -0.511 271 HA THR 33 HA THR 33 -11.413 -4.177 1.366 272 HB THR 33 HB THR 33 -11.956 -5.773 -1.145 273 HG1 THR 33 HG1 THR 33 -13.575 -5.867 0.583 274 HG21 THR 33 HG21 THR 33 -10.614 -7.228 0.903 275 HG22 THR 33 HG22 THR 33 -9.701 -5.766 0.530 276 HG23 THR 33 HG23 THR 33 -10.104 -6.904 -0.754 277 H PHE 34 HN PHE 34 -9.726 -2.879 1.162 278 HA PHE 34 HA PHE 34 -8.935 -1.977 -1.514 279 HB2 PHE 34 HB2 PHE 34 -8.628 -0.851 1.236 280 HB3 PHE 34 HB1 PHE 34 -7.400 -0.459 0.035 281 HD1 PHE 34 HD1 PHE 34 -11.071 -0.395 0.618 282 HD2 PHE 34 HD2 PHE 34 -7.757 1.244 -1.497 283 HE1 PHE 34 HE1 PHE 34 -12.532 1.356 -0.310 284 HE2 PHE 34 HE2 PHE 34 -9.213 2.999 -2.424 285 HZ PHE 34 HZ PHE 34 -11.601 3.055 -1.831 286 H ARG 35 HN ARG 35 -6.718 -2.093 -2.167 287 HA ARG 35 HA ARG 35 -5.159 -4.072 -0.647 288 HB2 ARG 35 HB2 ARG 35 -6.010 -5.237 -2.536 289 HB3 ARG 35 HB1 ARG 35 -5.645 -3.900 -3.615 290 HG2 ARG 35 HG2 ARG 35 -3.314 -5.010 -2.231 291 HG3 ARG 35 HG1 ARG 35 -4.126 -6.129 -3.326 292 HD2 ARG 35 HD2 ARG 35 -4.072 -4.058 -4.949 293 HD3 ARG 35 HD1 ARG 35 -2.734 -3.560 -3.914 294 HE ARG 35 HE ARG 35 -2.181 -6.158 -4.563 295 HH11 ARG 35 HH11 ARG 35 -2.794 -3.238 -6.376 296 HH12 ARG 35 HH12 ARG 35 -1.791 -3.706 -7.707 297 HH21 ARG 35 HH21 ARG 35 -0.862 -6.773 -6.313 298 HH22 ARG 35 HH22 ARG 35 -0.693 -5.714 -7.672 299 H LEU 36 HN LEU 36 -2.948 -3.812 -0.565 300 HA LEU 36 HA LEU 36 -1.965 -1.174 -0.784 301 HB2 LEU 36 HB2 LEU 36 -0.443 -3.773 -0.533 302 HB3 LEU 36 HB1 LEU 36 0.244 -2.171 -0.302 303 HG LEU 36 HG LEU 36 -1.901 -3.431 1.410 304 HD11 LEU 36 HD11 LEU 36 -0.164 -3.481 3.131 305 HD12 LEU 36 HD12 LEU 36 1.008 -2.869 1.964 306 HD13 LEU 36 HD13 LEU 36 0.281 -4.458 1.731 307 HD21 LEU 36 HD21 LEU 36 -1.262 -0.711 1.004 308 HD22 LEU 36 HD22 LEU 36 -0.630 -1.164 2.586 309 HD23 LEU 36 HD23 LEU 36 -2.335 -1.411 2.215 310 H LEU 37 HN LEU 37 -2.472 -0.611 -2.950 311 HA LEU 37 HA LEU 37 -1.970 -1.776 -5.290 312 HB2 LEU 37 HB2 LEU 37 -2.619 0.708 -4.636 313 HB3 LEU 37 HB1 LEU 37 -0.950 0.998 -5.090 314 HG LEU 37 HG LEU 37 -1.392 -0.001 -7.301 315 HD11 LEU 37 HD11 LEU 37 -4.092 0.054 -7.630 316 HD12 LEU 37 HD12 LEU 37 -3.938 -0.637 -6.015 317 HD13 LEU 37 HD13 LEU 37 -3.131 -1.403 -7.383 318 HD21 LEU 37 HD21 LEU 37 -2.651 2.442 -6.268 319 HD22 LEU 37 HD22 LEU 37 -3.290 1.867 -7.808 320 HD23 LEU 37 HD23 LEU 37 -1.569 2.213 -7.642 321 H LEU 38 HN LEU 38 -0.400 -2.403 -6.545 322 HA LEU 38 HA LEU 38 1.651 -3.324 -6.978 323 HB2 LEU 38 HB2 LEU 38 3.195 -1.639 -7.787 324 HB3 LEU 38 HB1 LEU 38 1.549 -1.295 -8.280 325 HG LEU 38 HG LEU 38 2.327 0.038 -5.788 326 HD11 LEU 38 HD11 LEU 38 4.031 1.347 -6.484 327 HD12 LEU 38 HD12 LEU 38 3.511 1.321 -8.169 328 HD13 LEU 38 HD13 LEU 38 4.385 -0.054 -7.495 329 HD21 LEU 38 HD21 LEU 38 1.518 1.950 -7.520 330 HD22 LEU 38 HD22 LEU 38 0.424 0.973 -6.541 331 HD23 LEU 38 HD23 LEU 38 0.744 0.527 -8.216 332 H VAL 39 HN VAL 39 1.687 -4.097 -4.542 333 HA VAL 39 HA VAL 39 4.317 -3.262 -3.539 334 HB VAL 39 HB VAL 39 3.698 -3.242 -1.274 335 HG11 VAL 39 HG11 VAL 39 2.604 -1.451 -3.048 336 HG12 VAL 39 HG12 VAL 39 2.718 -1.246 -1.302 337 HG13 VAL 39 HG13 VAL 39 1.241 -1.884 -2.018 338 HG21 VAL 39 HG21 VAL 39 1.493 -3.850 -0.426 339 HG22 VAL 39 HG22 VAL 39 2.247 -5.203 -1.265 340 HG23 VAL 39 HG23 VAL 39 0.975 -4.276 -2.056 341 H ASP 40 HN ASP 40 5.494 -4.893 -2.434 342 HA ASP 40 HA ASP 40 4.610 -7.600 -3.156 343 HB2 ASP 40 HB2 ASP 40 6.896 -6.449 -3.883 344 HB3 ASP 40 HB1 ASP 40 7.413 -7.050 -2.309 345 H THR 41 HN THR 41 4.467 -9.207 -1.662 346 HA THR 41 HA THR 41 4.813 -8.401 1.148 347 HB THR 41 HB THR 41 3.261 -10.617 1.304 348 HG1 THR 41 HG1 THR 41 2.887 -10.976 -0.800 349 HG21 THR 41 HG21 THR 41 2.889 -8.068 1.972 350 HG22 THR 41 HG22 THR 41 1.596 -9.266 1.997 351 HG23 THR 41 HG23 THR 41 1.758 -8.173 0.624 352 HA PRO 42 HA PRO 42 8.040 -11.282 1.949 353 HB2 PRO 42 HB2 PRO 42 6.339 -12.276 4.190 354 HB3 PRO 42 HB1 PRO 42 8.024 -11.740 4.208 355 HG2 PRO 42 HG2 PRO 42 6.094 -10.174 5.158 356 HG3 PRO 42 HG1 PRO 42 7.446 -9.493 4.234 357 HD2 PRO 42 HD2 PRO 42 4.623 -9.970 3.395 358 HD3 PRO 42 HD1 PRO 42 5.733 -8.662 2.938 359 H GLU 43 HN GLU 43 8.563 -13.516 1.847 360 HA GLU 43 HA GLU 43 6.339 -15.296 1.110 361 HB2 GLU 43 HB2 GLU 43 7.472 -14.521 -0.933 362 HB3 GLU 43 HB1 GLU 43 9.005 -15.107 -0.303 363 HG2 GLU 43 HG2 GLU 43 6.925 -17.144 -0.338 364 HG3 GLU 43 HG1 GLU 43 7.296 -16.493 -1.933 365 H THR 44 HN THR 44 6.328 -17.163 2.174 366 HA THR 44 HA THR 44 8.847 -18.188 3.282 367 HB THR 44 HB THR 44 7.903 -17.200 5.192 368 HG1 THR 44 HG1 THR 44 6.849 -19.826 5.259 369 HG21 THR 44 HG21 THR 44 5.612 -16.885 4.077 370 HG22 THR 44 HG22 THR 44 5.682 -17.115 5.824 371 HG23 THR 44 HG23 THR 44 5.227 -18.458 4.775 372 H LYS 45 HN LYS 45 5.395 -18.965 2.837 373 HA LYS 45 HA LYS 45 4.333 -20.866 2.188 374 HB2 LYS 45 HB2 LYS 45 6.931 -21.441 0.753 375 HB3 LYS 45 HB1 LYS 45 5.367 -22.161 0.400 376 HG2 LYS 45 HG2 LYS 45 4.818 -19.494 0.204 377 HG3 LYS 45 HG1 LYS 45 6.473 -19.582 -0.404 378 HD2 LYS 45 HD2 LYS 45 5.533 -21.617 -1.766 379 HD3 LYS 45 HD1 LYS 45 3.982 -20.826 -1.478 380 HE2 LYS 45 HE2 LYS 45 6.391 -19.490 -2.705 381 HE3 LYS 45 HE1 LYS 45 5.052 -20.177 -3.623 382 HZ1 LYS 45 HZ1 LYS 45 4.941 -17.899 -1.725 383 HZ2 LYS 45 HZ2 LYS 45 3.569 -18.631 -2.389 384 HZ3 LYS 45 HZ3 LYS 45 4.682 -17.854 -3.397 385 H HIS 46 HN HIS 46 5.118 -21.135 4.694 386 HA HIS 46 HA HIS 46 6.750 -23.497 5.050 387 HB2 HIS 46 HB2 HIS 46 6.489 -21.395 6.626 388 HB3 HIS 46 HB1 HIS 46 5.134 -22.315 7.271 389 HD1 HIS 46 HD1 HIS 46 7.218 -24.936 6.470 390 HD2 HIS 46 HD2 HIS 46 7.484 -21.950 9.348 391 HE1 HIS 46 HE1 HIS 46 8.777 -25.832 8.227 392 HE2 HIS 46 HE2 HIS 46 8.846 -24.048 10.004 393 HA PRO 47 HA PRO 47 2.335 -25.096 6.542 394 HB2 PRO 47 HB2 PRO 47 0.678 -23.494 4.671 395 HB3 PRO 47 HB1 PRO 47 0.358 -23.954 6.346 396 HG2 PRO 47 HG2 PRO 47 1.045 -21.455 5.723 397 HG3 PRO 47 HG1 PRO 47 1.642 -22.227 7.205 398 HD2 PRO 47 HD2 PRO 47 3.055 -21.749 4.612 399 HD3 PRO 47 HD1 PRO 47 3.671 -21.623 6.273 400 H LYS 48 HN LYS 48 1.160 -26.761 5.491 401 HA LYS 48 HA LYS 48 1.589 -27.055 2.608 402 HB2 LYS 48 HB2 LYS 48 3.311 -28.293 4.176 403 HB3 LYS 48 HB1 LYS 48 1.997 -29.447 4.351 404 HG2 LYS 48 HG2 LYS 48 1.978 -29.322 1.724 405 HG3 LYS 48 HG1 LYS 48 3.643 -28.788 1.966 406 HD2 LYS 48 HD2 LYS 48 2.942 -31.111 3.584 407 HD3 LYS 48 HD1 LYS 48 2.780 -31.403 1.852 408 HE2 LYS 48 HE2 LYS 48 5.007 -31.993 2.525 409 HE3 LYS 48 HE1 LYS 48 5.083 -30.530 1.543 410 HZ1 LYS 48 HZ1 LYS 48 6.437 -29.979 3.285 411 HZ2 LYS 48 HZ2 LYS 48 5.546 -30.858 4.422 412 HZ3 LYS 48 HZ3 LYS 48 4.962 -29.376 3.857 413 H LYS 49 HN LYS 49 -0.596 -26.714 2.243 414 HA LYS 49 HA LYS 49 -2.791 -27.256 1.998 415 HB2 LYS 49 HB2 LYS 49 -1.641 -29.981 2.588 416 HB3 LYS 49 HB1 LYS 49 -3.336 -29.735 2.189 417 HG2 LYS 49 HG2 LYS 49 -2.241 -30.373 0.195 418 HG3 LYS 49 HG1 LYS 49 -2.576 -28.647 0.061 419 HD2 LYS 49 HD2 LYS 49 -0.389 -28.093 0.063 420 HD3 LYS 49 HD1 LYS 49 0.028 -29.332 1.249 421 HE2 LYS 49 HE2 LYS 49 -0.623 -30.852 -0.908 422 HE3 LYS 49 HE1 LYS 49 0.065 -29.428 -1.688 423 HZ1 LYS 49 HZ1 LYS 49 1.715 -31.170 -1.198 424 HZ2 LYS 49 HZ2 LYS 49 1.412 -30.980 0.455 425 HZ3 LYS 49 HZ3 LYS 49 2.073 -29.703 -0.435 426 H GLY 50 HN GLY 50 -1.820 -26.374 4.598 427 HA2 GLY 50 HA2 GLY 50 -3.859 -27.651 6.317 428 HA3 GLY 50 HA1 GLY 50 -2.329 -27.043 6.932 429 H VAL 51 HN VAL 51 -2.511 -25.192 7.986 430 HA VAL 51 HA VAL 51 -4.776 -23.435 7.396 431 HB VAL 51 HB VAL 51 -4.063 -22.267 9.520 432 HG11 VAL 51 HG11 VAL 51 -5.916 -23.850 9.465 433 HG12 VAL 51 HG12 VAL 51 -5.024 -23.979 10.981 434 HG13 VAL 51 HG13 VAL 51 -4.794 -25.187 9.717 435 HG21 VAL 51 HG21 VAL 51 -2.319 -22.960 10.774 436 HG22 VAL 51 HG22 VAL 51 -1.734 -23.597 9.237 437 HG23 VAL 51 HG23 VAL 51 -2.567 -24.659 10.372 438 H GLU 52 HN GLU 52 -4.555 -21.329 6.764 439 HA GLU 52 HA GLU 52 -2.264 -20.601 5.306 440 HB2 GLU 52 HB2 GLU 52 -4.763 -19.216 6.157 441 HB3 GLU 52 HB1 GLU 52 -3.435 -18.232 5.556 442 HG2 GLU 52 HG2 GLU 52 -3.618 -20.253 3.696 443 HG3 GLU 52 HG1 GLU 52 -5.298 -19.930 4.119 444 H LYS 53 HN LYS 53 -1.038 -18.533 5.668 445 HA LYS 53 HA LYS 53 -0.398 -18.201 8.527 446 HB2 LYS 53 HB2 LYS 53 1.275 -19.341 6.733 447 HB3 LYS 53 HB1 LYS 53 1.732 -17.652 6.546 448 HG2 LYS 53 HG2 LYS 53 2.785 -17.597 8.514 449 HG3 LYS 53 HG1 LYS 53 1.513 -18.508 9.330 450 HD2 LYS 53 HD2 LYS 53 2.592 -20.461 9.081 451 HD3 LYS 53 HD1 LYS 53 3.074 -20.090 7.425 452 HE2 LYS 53 HE2 LYS 53 4.390 -18.647 9.678 453 HE3 LYS 53 HE1 LYS 53 4.862 -20.311 9.338 454 HZ1 LYS 53 HZ1 LYS 53 5.567 -19.729 7.188 455 HZ2 LYS 53 HZ2 LYS 53 6.184 -18.519 8.195 456 HZ3 LYS 53 HZ3 LYS 53 4.816 -18.213 7.247 457 H TYR 54 HN TYR 54 0.983 -16.102 8.806 458 HA TYR 54 HA TYR 54 0.141 -13.951 7.037 459 HB2 TYR 54 HB2 TYR 54 -0.373 -13.565 9.965 460 HB3 TYR 54 HB1 TYR 54 -1.068 -12.710 8.593 461 HD1 TYR 54 HD2 TYR 54 -1.254 -15.733 10.663 462 HD2 TYR 54 HD1 TYR 54 -2.990 -13.598 7.418 463 HE1 TYR 54 HE2 TYR 54 -3.239 -17.178 10.783 464 HE2 TYR 54 HE1 TYR 54 -4.980 -15.037 7.530 465 HH TYR 54 HH TYR 54 -5.553 -17.186 10.146 466 H GLY 55 HN GLY 55 1.618 -12.344 6.911 467 HA2 GLY 55 HA2 GLY 55 4.196 -12.712 7.946 468 HA3 GLY 55 HA1 GLY 55 3.597 -11.224 7.231 469 HA PRO 56 HA PRO 56 3.778 -10.859 11.947 470 HB2 PRO 56 HB2 PRO 56 6.391 -10.789 12.641 471 HB3 PRO 56 HB1 PRO 56 5.457 -12.283 12.568 472 HG2 PRO 56 HG2 PRO 56 7.546 -11.287 10.749 473 HG3 PRO 56 HG1 PRO 56 6.999 -12.944 11.035 474 HD2 PRO 56 HD2 PRO 56 6.311 -11.224 8.862 475 HD3 PRO 56 HD1 PRO 56 5.702 -12.856 9.191 476 H GLU 57 HN GLU 57 6.743 -9.531 10.462 477 HA GLU 57 HA GLU 57 6.228 -6.941 11.592 478 HB2 GLU 57 HB2 GLU 57 8.509 -8.136 11.123 479 HB3 GLU 57 HB1 GLU 57 8.326 -7.442 9.517 480 HG2 GLU 57 HG2 GLU 57 9.276 -5.608 10.308 481 HG3 GLU 57 HG1 GLU 57 7.803 -5.332 11.235 482 H ALA 58 HN ALA 58 5.612 -8.500 8.566 483 HA ALA 58 HA ALA 58 5.409 -6.140 6.980 484 HB1 ALA 58 HB1 ALA 58 5.696 -7.896 5.583 485 HB2 ALA 58 HB2 ALA 58 3.932 -7.888 5.591 486 HB3 ALA 58 HB3 ALA 58 4.813 -9.012 6.626 487 H SER 59 HN SER 59 2.952 -8.309 8.376 488 HA SER 59 HA SER 59 0.769 -6.639 7.653 489 HB2 SER 59 HB2 SER 59 1.160 -9.200 8.923 490 HB3 SER 59 HB1 SER 59 -0.042 -8.258 9.805 491 HG SER 59 HG SER 59 -0.742 -9.606 7.918 492 H ALA 60 HN ALA 60 2.731 -6.983 10.555 493 HA ALA 60 HA ALA 60 1.143 -5.477 12.308 494 HB1 ALA 60 HB1 ALA 60 3.450 -5.046 13.428 495 HB2 ALA 60 HB2 ALA 60 4.040 -6.194 12.226 496 HB3 ALA 60 HB3 ALA 60 2.794 -6.683 13.375 497 H PHE 61 HN PHE 61 4.040 -4.443 10.495 498 HA PHE 61 HA PHE 61 3.964 -1.761 11.168 499 HB2 PHE 61 HB2 PHE 61 5.850 -2.865 10.021 500 HB3 PHE 61 HB1 PHE 61 4.889 -2.950 8.548 501 HD1 PHE 61 HD1 PHE 61 6.499 -0.649 10.929 502 HD2 PHE 61 HD2 PHE 61 4.694 -1.103 7.108 503 HE1 PHE 61 HE1 PHE 61 7.283 1.601 10.295 504 HE2 PHE 61 HE2 PHE 61 5.466 1.140 6.463 505 HZ PHE 61 HZ PHE 61 6.767 2.497 8.059 506 H THR 62 HN THR 62 2.621 -3.287 8.237 507 HA THR 62 HA THR 62 1.548 -1.048 7.039 508 HB THR 62 HB THR 62 0.125 -3.707 7.064 509 HG1 THR 62 HG1 THR 62 1.942 -4.506 6.401 510 HG21 THR 62 HG21 THR 62 -0.862 -3.102 5.156 511 HG22 THR 62 HG22 THR 62 0.578 -2.284 4.549 512 HG23 THR 62 HG23 THR 62 -0.490 -1.461 5.686 513 H LYS 63 HN LYS 63 -0.087 -3.229 9.336 514 HA LYS 63 HA LYS 63 -2.468 -1.703 9.482 515 HB2 LYS 63 HB2 LYS 63 -1.684 -4.175 10.371 516 HB3 LYS 63 HB1 LYS 63 -1.775 -3.266 11.873 517 HG2 LYS 63 HG2 LYS 63 -4.101 -2.525 10.825 518 HG3 LYS 63 HG1 LYS 63 -3.923 -4.079 10.010 519 HD2 LYS 63 HD2 LYS 63 -3.735 -3.661 12.993 520 HD3 LYS 63 HD1 LYS 63 -5.169 -4.239 12.144 521 HE2 LYS 63 HE2 LYS 63 -3.170 -5.901 11.224 522 HE3 LYS 63 HE1 LYS 63 -2.752 -5.665 12.920 523 HZ1 LYS 63 HZ1 LYS 63 -4.361 -7.555 12.250 524 HZ2 LYS 63 HZ2 LYS 63 -5.522 -6.327 12.181 525 HZ3 LYS 63 HZ3 LYS 63 -4.699 -6.631 13.627 526 H LYS 64 HN LYS 64 0.577 -1.603 11.180 527 HA LYS 64 HA LYS 64 -0.087 -0.109 13.421 528 HB2 LYS 64 HB2 LYS 64 2.140 -1.195 12.802 529 HB3 LYS 64 HB1 LYS 64 2.465 0.252 11.860 530 HG2 LYS 64 HG2 LYS 64 1.818 0.310 14.794 531 HG3 LYS 64 HG1 LYS 64 3.459 0.198 14.156 532 HD2 LYS 64 HD2 LYS 64 2.447 2.297 12.733 533 HD3 LYS 64 HD1 LYS 64 1.641 2.494 14.291 534 HE2 LYS 64 HE2 LYS 64 4.508 1.881 14.452 535 HE3 LYS 64 HE1 LYS 64 4.127 3.427 13.695 536 HZ1 LYS 64 HZ1 LYS 64 3.031 4.166 15.616 537 HZ2 LYS 64 HZ2 LYS 64 4.445 3.433 16.184 538 HZ3 LYS 64 HZ3 LYS 64 2.968 2.617 16.296 539 H MET 65 HN MET 65 0.704 0.989 10.148 540 HA MET 65 HA MET 65 0.645 3.751 10.787 541 HB2 MET 65 HB2 MET 65 0.830 2.125 8.317 542 HB3 MET 65 HB1 MET 65 0.246 3.774 8.133 543 HG2 MET 65 HG2 MET 65 2.439 4.085 9.750 544 HG3 MET 65 HG1 MET 65 2.928 2.782 8.669 545 HE1 MET 65 HE1 MET 65 3.375 6.993 8.108 546 HE2 MET 65 HE2 MET 65 4.681 5.807 8.109 547 HE3 MET 65 HE3 MET 65 3.524 5.845 9.438 548 H VAL 66 HN VAL 66 -1.678 1.663 9.059 549 HA VAL 66 HA VAL 66 -3.639 3.681 8.779 550 HB VAL 66 HB VAL 66 -5.207 1.804 8.280 551 HG11 VAL 66 HG11 VAL 66 -2.551 1.958 6.882 552 HG12 VAL 66 HG12 VAL 66 -4.072 2.729 6.434 553 HG13 VAL 66 HG13 VAL 66 -3.887 0.982 6.273 554 HG21 VAL 66 HG21 VAL 66 -3.011 0.272 9.467 555 HG22 VAL 66 HG22 VAL 66 -3.614 -0.389 7.947 556 HG23 VAL 66 HG23 VAL 66 -4.718 -0.133 9.299 557 H GLU 67 HN GLU 67 -3.129 1.179 11.225 558 HA GLU 67 HA GLU 67 -5.570 1.567 12.588 559 HB2 GLU 67 HB2 GLU 67 -2.926 0.444 13.516 560 HB3 GLU 67 HB1 GLU 67 -4.385 0.435 14.498 561 HG2 GLU 67 HG2 GLU 67 -4.303 -0.798 11.767 562 HG3 GLU 67 HG1 GLU 67 -3.815 -1.682 13.212 563 H ASN 68 HN ASN 68 -2.287 2.754 13.311 564 HA ASN 68 HA ASN 68 -3.099 4.353 15.505 565 HB2 ASN 68 HB2 ASN 68 -0.619 4.285 13.798 566 HB3 ASN 68 HB1 ASN 68 -0.826 5.486 15.068 567 HD21 ASN 68 HD21 ASN 68 -0.833 2.011 14.457 568 HD22 ASN 68 HD22 ASN 68 -0.255 1.555 16.019 569 H ALA 69 HN ALA 69 -2.785 4.952 12.062 570 HA ALA 69 HA ALA 69 -3.021 7.779 12.202 571 HB1 ALA 69 HB1 ALA 69 -3.422 5.809 9.967 572 HB2 ALA 69 HB2 ALA 69 -2.061 6.895 10.241 573 HB3 ALA 69 HB3 ALA 69 -3.624 7.548 9.754 574 H LYS 70 HN LYS 70 -4.739 8.824 12.923 575 HA LYS 70 HA LYS 70 -7.288 7.717 13.279 576 HB2 LYS 70 HB2 LYS 70 -7.998 10.160 13.497 577 HB3 LYS 70 HB1 LYS 70 -6.759 9.590 14.608 578 HG2 LYS 70 HG2 LYS 70 -5.445 11.245 13.961 579 HG3 LYS 70 HG1 LYS 70 -5.425 10.577 12.328 580 HD2 LYS 70 HD2 LYS 70 -7.457 11.836 11.791 581 HD3 LYS 70 HD1 LYS 70 -7.473 12.504 13.425 582 HE2 LYS 70 HE2 LYS 70 -6.397 14.208 12.382 583 HE3 LYS 70 HE1 LYS 70 -4.997 13.195 12.728 584 HZ1 LYS 70 HZ1 LYS 70 -5.490 12.189 10.434 585 HZ2 LYS 70 HZ2 LYS 70 -4.751 13.708 10.502 586 HZ3 LYS 70 HZ3 LYS 70 -6.404 13.588 10.168 587 H LYS 71 HN LYS 71 -5.838 9.389 10.580 588 HA LYS 71 HA LYS 71 -8.352 9.051 9.080 589 HB2 LYS 71 HB2 LYS 71 -7.322 11.452 9.629 590 HB3 LYS 71 HB1 LYS 71 -6.376 11.086 8.194 591 HG2 LYS 71 HG2 LYS 71 -8.484 10.678 6.962 592 HG3 LYS 71 HG1 LYS 71 -9.376 11.199 8.393 593 HD2 LYS 71 HD2 LYS 71 -9.202 13.051 6.863 594 HD3 LYS 71 HD1 LYS 71 -8.194 13.379 8.274 595 HE2 LYS 71 HE2 LYS 71 -6.827 11.988 6.080 596 HE3 LYS 71 HE1 LYS 71 -7.380 13.616 5.688 597 HZ1 LYS 71 HZ1 LYS 71 -6.084 14.537 7.379 598 HZ2 LYS 71 HZ2 LYS 71 -5.072 13.380 6.674 599 HZ3 LYS 71 HZ3 LYS 71 -5.837 13.049 8.145 600 H ILE 72 HN ILE 72 -8.258 8.099 7.109 601 HA ILE 72 HA ILE 72 -5.601 7.308 6.119 602 HB ILE 72 HB ILE 72 -8.059 5.643 5.692 603 HG12 ILE 72 HG12 ILE 72 -7.743 5.881 8.128 604 HG13 ILE 72 HG11 ILE 72 -7.408 4.240 7.585 605 HG21 ILE 72 HG21 ILE 72 -5.273 4.605 5.858 606 HG22 ILE 72 HG22 ILE 72 -5.783 5.476 4.411 607 HG23 ILE 72 HG23 ILE 72 -6.641 4.020 4.912 608 HD11 ILE 72 HD11 ILE 72 -4.945 5.432 7.455 609 HD12 ILE 72 HD12 ILE 72 -5.537 4.418 8.771 610 HD13 ILE 72 HD13 ILE 72 -5.670 6.174 8.880 611 H GLU 73 HN GLU 73 -5.284 7.364 3.908 612 HA GLU 73 HA GLU 73 -7.500 8.473 2.307 613 HB2 GLU 73 HB2 GLU 73 -4.642 9.224 1.779 614 HB3 GLU 73 HB1 GLU 73 -6.110 10.046 1.272 615 HG2 GLU 73 HG2 GLU 73 -6.512 10.833 3.498 616 HG3 GLU 73 HG1 GLU 73 -5.169 9.876 4.124 617 H VAL 74 HN VAL 74 -7.690 7.762 0.199 618 HA VAL 74 HA VAL 74 -5.809 5.659 -0.628 619 HB VAL 74 HB VAL 74 -7.863 4.649 -1.817 620 HG11 VAL 74 HG11 VAL 74 -8.503 3.472 0.383 621 HG12 VAL 74 HG12 VAL 74 -7.232 4.459 1.102 622 HG13 VAL 74 HG13 VAL 74 -6.844 3.333 -0.199 623 HG21 VAL 74 HG21 VAL 74 -9.997 5.055 -0.900 624 HG22 VAL 74 HG22 VAL 74 -9.297 6.648 -1.193 625 HG23 VAL 74 HG23 VAL 74 -9.329 5.986 0.441 626 H GLU 75 HN GLU 75 -5.171 5.639 -2.716 627 HA GLU 75 HA GLU 75 -6.391 7.610 -4.531 628 HB2 GLU 75 HB2 GLU 75 -4.063 8.173 -3.539 629 HB3 GLU 75 HB1 GLU 75 -3.466 6.929 -4.629 630 HG2 GLU 75 HG2 GLU 75 -5.219 8.776 -5.984 631 HG3 GLU 75 HG1 GLU 75 -3.870 9.606 -5.211 632 H PHE 76 HN PHE 76 -7.456 6.426 -5.995 633 HA PHE 76 HA PHE 76 -6.665 3.794 -6.748 634 HB2 PHE 76 HB2 PHE 76 -8.765 5.674 -7.830 635 HB3 PHE 76 HB1 PHE 76 -8.515 4.046 -8.451 636 HD1 PHE 76 HD2 PHE 76 -8.291 2.276 -6.341 637 HD2 PHE 76 HD1 PHE 76 -10.569 5.872 -6.448 638 HE1 PHE 76 HE2 PHE 76 -9.777 1.382 -4.597 639 HE2 PHE 76 HE1 PHE 76 -12.058 4.983 -4.702 640 HZ PHE 76 HZ PHE 76 -11.664 2.736 -3.777 641 H ASP 77 HN ASP 77 -5.704 3.081 -8.557 642 HA ASP 77 HA ASP 77 -3.799 4.647 -9.844 643 HB2 ASP 77 HB2 ASP 77 -3.498 2.769 -11.362 644 HB3 ASP 77 HB1 ASP 77 -3.738 2.177 -9.723 645 H LYS 78 HN LYS 78 -3.948 4.218 -12.529 646 HA LYS 78 HA LYS 78 -6.177 5.969 -13.305 647 HB2 LYS 78 HB2 LYS 78 -4.510 6.166 -15.413 648 HB3 LYS 78 HB1 LYS 78 -4.429 7.224 -14.013 649 HG2 LYS 78 HG2 LYS 78 -2.867 4.752 -13.767 650 HG3 LYS 78 HG1 LYS 78 -2.332 5.849 -15.037 651 HD2 LYS 78 HD2 LYS 78 -2.917 7.360 -12.684 652 HD3 LYS 78 HD1 LYS 78 -1.854 6.020 -12.259 653 HE2 LYS 78 HE2 LYS 78 -0.130 7.148 -13.086 654 HE3 LYS 78 HE1 LYS 78 -0.885 7.112 -14.678 655 HZ1 LYS 78 HZ1 LYS 78 -0.835 9.329 -14.443 656 HZ2 LYS 78 HZ2 LYS 78 -0.725 9.274 -12.756 657 HZ3 LYS 78 HZ3 LYS 78 -2.229 9.103 -13.511 658 H GLY 79 HN GLY 79 -4.686 2.898 -13.857 659 HA2 GLY 79 HA2 GLY 79 -6.213 2.441 -16.304 660 HA3 GLY 79 HA1 GLY 79 -5.025 1.354 -15.602 661 H GLN 80 HN GLN 80 -5.677 -0.244 -14.244 662 HA GLN 80 HA GLN 80 -8.212 -1.262 -14.377 663 HB2 GLN 80 HB2 GLN 80 -5.834 -2.036 -13.242 664 HB3 GLN 80 HB1 GLN 80 -6.878 -1.873 -11.840 665 HG2 GLN 80 HG2 GLN 80 -8.395 -3.451 -12.646 666 HG3 GLN 80 HG1 GLN 80 -7.689 -3.418 -14.263 667 HE21 GLN 80 HE21 GLN 80 -7.459 -5.687 -14.176 668 HE22 GLN 80 HE22 GLN 80 -6.183 -6.423 -13.273 669 H ARG 81 HN ARG 81 -7.071 -0.239 -11.188 670 HA ARG 81 HA ARG 81 -7.971 1.171 -9.622 671 HB2 ARG 81 HB2 ARG 81 -10.369 1.530 -11.410 672 HB3 ARG 81 HB1 ARG 81 -9.903 2.523 -10.039 673 HG2 ARG 81 HG2 ARG 81 -7.763 2.995 -11.394 674 HG3 ARG 81 HG1 ARG 81 -8.689 2.388 -12.768 675 HD2 ARG 81 HD2 ARG 81 -9.804 4.508 -10.967 676 HD3 ARG 81 HD1 ARG 81 -8.700 4.924 -12.277 677 HE ARG 81 HE ARG 81 -10.570 3.422 -13.516 678 HH11 ARG 81 HH11 ARG 81 -10.771 6.196 -11.408 679 HH12 ARG 81 HH12 ARG 81 -12.231 6.792 -12.124 680 HH21 ARG 81 HH21 ARG 81 -12.490 4.205 -14.460 681 HH22 ARG 81 HH22 ARG 81 -13.208 5.661 -13.855 682 H THR 82 HN THR 82 -9.572 -1.506 -11.051 683 HA THR 82 HA THR 82 -10.419 -2.469 -8.504 684 HB THR 82 HB THR 82 -12.866 -2.738 -9.505 685 HG1 THR 82 HG1 THR 82 -12.005 -0.264 -10.588 686 HG21 THR 82 HG21 THR 82 -11.847 -1.268 -7.478 687 HG22 THR 82 HG22 THR 82 -13.555 -1.329 -7.916 688 HG23 THR 82 HG23 THR 82 -12.541 -0.008 -8.500 689 H ASP 83 HN ASP 83 -9.975 -4.558 -8.598 690 HA ASP 83 HA ASP 83 -9.653 -5.902 -11.114 691 HB2 ASP 83 HB2 ASP 83 -8.623 -6.228 -8.546 692 HB3 ASP 83 HB1 ASP 83 -9.636 -7.647 -8.787 693 H LYS 84 HN LYS 84 -10.486 -8.443 -10.690 694 HA LYS 84 HA LYS 84 -13.043 -8.566 -11.615 695 HB2 LYS 84 HB2 LYS 84 -12.974 -10.855 -10.117 696 HB3 LYS 84 HB1 LYS 84 -12.311 -10.685 -11.738 697 HG2 LYS 84 HG2 LYS 84 -10.561 -9.955 -9.457 698 HG3 LYS 84 HG1 LYS 84 -10.912 -11.666 -9.708 699 HD2 LYS 84 HD2 LYS 84 -10.333 -10.764 -12.247 700 HD3 LYS 84 HD1 LYS 84 -9.204 -9.863 -11.234 701 HE2 LYS 84 HE2 LYS 84 -8.279 -12.009 -12.035 702 HE3 LYS 84 HE1 LYS 84 -8.358 -11.905 -10.277 703 HZ1 LYS 84 HZ1 LYS 84 -9.789 -13.597 -10.172 704 HZ2 LYS 84 HZ2 LYS 84 -9.302 -13.956 -11.751 705 HZ3 LYS 84 HZ3 LYS 84 -10.707 -13.053 -11.484 706 H TYR 85 HN TYR 85 -12.202 -9.217 -8.213 707 HA TYR 85 HA TYR 85 -14.890 -9.197 -7.345 708 HB2 TYR 85 HB2 TYR 85 -12.235 -9.444 -6.119 709 HB3 TYR 85 HB1 TYR 85 -13.429 -8.683 -5.077 710 HD1 TYR 85 HD1 TYR 85 -13.145 -11.624 -7.352 711 HD2 TYR 85 HD2 TYR 85 -14.679 -10.058 -3.712 712 HE1 TYR 85 HE1 TYR 85 -14.044 -13.844 -6.787 713 HE2 TYR 85 HE2 TYR 85 -15.584 -12.271 -3.132 714 HH TYR 85 HH TYR 85 -15.041 -14.700 -3.745 715 H GLY 86 HN GLY 86 -12.934 -6.677 -8.317 716 HA2 GLY 86 HA2 GLY 86 -13.479 -4.415 -8.376 717 HA3 GLY 86 HA1 GLY 86 -14.776 -4.724 -7.228 718 H ARG 87 HN ARG 87 -11.593 -5.909 -6.562 719 HA ARG 87 HA ARG 87 -11.388 -4.802 -4.043 720 HB2 ARG 87 HB2 ARG 87 -9.877 -6.517 -5.491 721 HB3 ARG 87 HB1 ARG 87 -8.834 -5.102 -5.503 722 HG2 ARG 87 HG2 ARG 87 -8.283 -5.340 -3.351 723 HG3 ARG 87 HG1 ARG 87 -9.934 -5.737 -2.871 724 HD2 ARG 87 HD2 ARG 87 -8.048 -7.643 -4.248 725 HD3 ARG 87 HD1 ARG 87 -8.308 -7.582 -2.506 726 HE ARG 87 HE ARG 87 -10.726 -7.920 -4.019 727 HH11 ARG 87 HH11 ARG 87 -8.026 -9.563 -2.541 728 HH12 ARG 87 HH12 ARG 87 -8.866 -11.069 -2.385 729 HH21 ARG 87 HH21 ARG 87 -11.835 -9.900 -3.813 730 HH22 ARG 87 HH22 ARG 87 -11.031 -11.260 -3.104 731 H GLY 88 HN GLY 88 -9.855 -3.169 -3.230 732 HA2 GLY 88 HA2 GLY 88 -10.155 -0.719 -4.756 733 HA3 GLY 88 HA1 GLY 88 -9.590 -0.854 -3.099 734 H LEU 89 HN LEU 89 -8.697 -0.804 -6.448 735 HA LEU 89 HA LEU 89 -5.925 -1.415 -5.995 736 HB2 LEU 89 HB2 LEU 89 -7.471 -0.381 -8.354 737 HB3 LEU 89 HB1 LEU 89 -5.729 -0.550 -8.388 738 HG LEU 89 HG LEU 89 -7.075 -2.437 -9.400 739 HD11 LEU 89 HD11 LEU 89 -5.394 -3.567 -7.237 740 HD12 LEU 89 HD12 LEU 89 -4.645 -2.430 -8.360 741 HD13 LEU 89 HD13 LEU 89 -5.393 -3.907 -8.967 742 HD21 LEU 89 HD21 LEU 89 -8.149 -4.011 -8.030 743 HD22 LEU 89 HD22 LEU 89 -8.727 -2.441 -7.471 744 HD23 LEU 89 HD23 LEU 89 -7.487 -3.301 -6.558 745 H ALA 90 HN ALA 90 -5.841 0.262 -4.224 746 HA ALA 90 HA ALA 90 -4.728 2.715 -5.342 747 HB1 ALA 90 HB1 ALA 90 -5.970 4.073 -3.627 748 HB2 ALA 90 HB2 ALA 90 -6.988 2.660 -3.355 749 HB3 ALA 90 HB3 ALA 90 -6.957 3.431 -4.938 750 H TYR 91 HN TYR 91 -3.757 4.069 -3.500 751 HA TYR 91 HA TYR 91 -2.259 2.238 -1.784 752 HB2 TYR 91 HB2 TYR 91 -1.656 5.165 -2.089 753 HB3 TYR 91 HB1 TYR 91 -0.564 3.860 -1.656 754 HD1 TYR 91 HD2 TYR 91 -2.572 5.197 -4.492 755 HD2 TYR 91 HD1 TYR 91 0.774 2.862 -3.289 756 HE1 TYR 91 HE2 TYR 91 -1.844 5.048 -6.834 757 HE2 TYR 91 HE1 TYR 91 1.516 2.712 -5.628 758 HH TYR 91 HH TYR 91 1.164 4.179 -7.770 759 H ILE 92 HN ILE 92 -2.329 2.327 0.416 760 HA ILE 92 HA ILE 92 -4.463 3.960 1.573 761 HB ILE 92 HB ILE 92 -2.840 1.762 2.862 762 HG12 ILE 92 HG12 ILE 92 -5.075 0.509 2.574 763 HG13 ILE 92 HG11 ILE 92 -5.466 1.744 1.382 764 HG21 ILE 92 HG21 ILE 92 -5.423 3.052 3.729 765 HG22 ILE 92 HG22 ILE 92 -3.840 3.354 4.444 766 HG23 ILE 92 HG23 ILE 92 -4.572 1.753 4.564 767 HD11 ILE 92 HD11 ILE 92 -4.130 0.838 -0.158 768 HD12 ILE 92 HD12 ILE 92 -4.209 -0.602 0.855 769 HD13 ILE 92 HD13 ILE 92 -2.847 0.508 1.004 770 H TYR 93 HN TYR 93 -4.050 5.786 2.614 771 HA TYR 93 HA TYR 93 -1.289 6.388 3.386 772 HB2 TYR 93 HB2 TYR 93 -3.683 8.224 3.191 773 HB3 TYR 93 HB1 TYR 93 -2.042 8.721 3.561 774 HD1 TYR 93 HD2 TYR 93 -2.874 6.243 0.928 775 HD2 TYR 93 HD1 TYR 93 -1.815 10.269 1.792 776 HE1 TYR 93 HE2 TYR 93 -2.503 6.647 -1.458 777 HE2 TYR 93 HE1 TYR 93 -1.421 10.680 -0.597 778 HH TYR 93 HH TYR 93 -0.793 8.774 -2.714 779 H ALA 94 HN ALA 94 -0.835 7.391 5.412 780 HA ALA 94 HA ALA 94 -2.850 7.016 7.511 781 HB1 ALA 94 HB1 ALA 94 -1.654 5.073 7.893 782 HB2 ALA 94 HB2 ALA 94 -0.824 6.217 8.949 783 HB3 ALA 94 HB3 ALA 94 -0.126 5.792 7.388 784 H ASP 95 HN ASP 95 -3.135 8.962 8.391 785 HA ASP 95 HA ASP 95 -2.716 10.975 9.357 786 HB2 ASP 95 HB2 ASP 95 -0.497 9.376 10.061 787 HB3 ASP 95 HB1 ASP 95 0.150 10.945 9.593 788 H GLY 96 HN GLY 96 -2.012 10.251 6.346 789 HA2 GLY 96 HA2 GLY 96 -2.057 12.097 4.752 790 HA3 GLY 96 HA1 GLY 96 -0.906 12.927 5.782 791 H LYS 97 HN LYS 97 -0.147 9.650 5.566 792 HA LYS 97 HA LYS 97 1.631 10.121 3.277 793 HB2 LYS 97 HB2 LYS 97 2.339 9.366 6.057 794 HB3 LYS 97 HB1 LYS 97 3.204 8.537 4.770 795 HG2 LYS 97 HG2 LYS 97 3.926 10.672 3.856 796 HG3 LYS 97 HG1 LYS 97 3.025 11.522 5.113 797 HD2 LYS 97 HD2 LYS 97 5.006 9.477 5.965 798 HD3 LYS 97 HD1 LYS 97 5.621 11.009 5.341 799 HE2 LYS 97 HE2 LYS 97 5.290 11.883 7.357 800 HE3 LYS 97 HE1 LYS 97 3.557 11.694 7.099 801 HZ1 LYS 97 HZ1 LYS 97 3.462 9.914 8.449 802 HZ2 LYS 97 HZ2 LYS 97 4.868 10.573 9.116 803 HZ3 LYS 97 HZ3 LYS 97 4.977 9.320 7.986 804 H MET 98 HN MET 98 1.712 8.498 1.826 805 HA MET 98 HA MET 98 -0.108 6.364 1.961 806 HB2 MET 98 HB2 MET 98 2.323 6.255 0.207 807 HB3 MET 98 HB1 MET 98 0.700 5.657 -0.109 808 HG2 MET 98 HG2 MET 98 0.125 7.533 -1.099 809 HG3 MET 98 HG1 MET 98 0.641 8.499 0.278 810 HE1 MET 98 HE1 MET 98 1.195 6.924 -2.915 811 HE2 MET 98 HE2 MET 98 2.912 6.536 -2.812 812 HE3 MET 98 HE3 MET 98 2.378 7.941 -3.736 813 H VAL 99 HN VAL 99 -0.005 4.779 3.391 814 HA VAL 99 HA VAL 99 2.221 3.913 4.805 815 HB VAL 99 HB VAL 99 -0.122 2.150 4.095 816 HG11 VAL 99 HG11 VAL 99 0.309 1.160 6.293 817 HG12 VAL 99 HG12 VAL 99 1.681 2.246 6.511 818 HG13 VAL 99 HG13 VAL 99 1.715 1.029 5.236 819 HG21 VAL 99 HG21 VAL 99 -1.039 3.094 6.306 820 HG22 VAL 99 HG22 VAL 99 -1.183 4.086 4.855 821 HG23 VAL 99 HG23 VAL 99 0.082 4.427 6.033 822 H ASN 100 HN ASN 100 0.888 2.736 1.752 823 HA ASN 100 HA ASN 100 2.354 0.427 1.381 824 HB2 ASN 100 HB2 ASN 100 1.713 2.450 -0.774 825 HB3 ASN 100 HB1 ASN 100 2.004 0.727 -0.996 826 HD21 ASN 100 HD21 ASN 100 -0.061 0.716 -2.053 827 HD22 ASN 100 HD22 ASN 100 -1.506 0.625 -1.115 828 H GLU 101 HN GLU 101 3.272 3.758 0.555 829 HA GLU 101 HA GLU 101 5.745 3.238 -0.607 830 HB2 GLU 101 HB2 GLU 101 4.456 5.451 -0.451 831 HB3 GLU 101 HB1 GLU 101 5.212 5.644 1.124 832 HG2 GLU 101 HG2 GLU 101 7.068 4.994 -1.046 833 HG3 GLU 101 HG1 GLU 101 6.241 6.542 -1.217 834 H ALA 102 HN ALA 102 4.875 3.694 2.788 835 HA ALA 102 HA ALA 102 7.409 3.787 3.918 836 HB1 ALA 102 HB1 ALA 102 6.358 2.991 5.979 837 HB2 ALA 102 HB2 ALA 102 4.925 2.520 5.065 838 HB3 ALA 102 HB3 ALA 102 5.375 4.221 5.184 839 H LEU 103 HN LEU 103 5.360 0.898 3.510 840 HA LEU 103 HA LEU 103 7.222 -0.983 4.385 841 HB2 LEU 103 HB2 LEU 103 4.997 -1.276 2.365 842 HB3 LEU 103 HB1 LEU 103 5.881 -2.619 3.063 843 HG LEU 103 HG LEU 103 4.960 -1.149 5.256 844 HD11 LEU 103 HD11 LEU 103 2.400 -1.499 4.475 845 HD12 LEU 103 HD12 LEU 103 3.128 -0.944 2.967 846 HD13 LEU 103 HD13 LEU 103 3.250 0.046 4.421 847 HD21 LEU 103 HD21 LEU 103 5.090 -3.729 4.519 848 HD22 LEU 103 HD22 LEU 103 3.357 -3.454 4.349 849 HD23 LEU 103 HD23 LEU 103 4.150 -3.158 5.897 850 H VAL 104 HN VAL 104 6.660 0.404 1.200 851 HA VAL 104 HA VAL 104 8.395 -1.282 -0.247 852 HB VAL 104 HB VAL 104 7.708 1.580 -0.915 853 HG11 VAL 104 HG11 VAL 104 9.477 -0.057 -2.156 854 HG12 VAL 104 HG12 VAL 104 8.572 1.227 -2.959 855 HG13 VAL 104 HG13 VAL 104 7.993 -0.438 -3.030 856 HG21 VAL 104 HG21 VAL 104 5.623 1.000 -1.478 857 HG22 VAL 104 HG22 VAL 104 5.885 -0.436 -0.490 858 HG23 VAL 104 HG23 VAL 104 6.151 -0.504 -2.231 859 H ARG 105 HN ARG 105 8.896 1.871 1.303 860 HA ARG 105 HA ARG 105 11.642 2.001 0.482 861 HB2 ARG 105 HB2 ARG 105 11.747 4.080 1.618 862 HB3 ARG 105 HB1 ARG 105 10.160 4.000 0.869 863 HG2 ARG 105 HG2 ARG 105 9.179 4.334 2.819 864 HG3 ARG 105 HG1 ARG 105 9.992 2.930 3.507 865 HD2 ARG 105 HD2 ARG 105 11.607 5.386 3.196 866 HD3 ARG 105 HD1 ARG 105 10.343 5.418 4.425 867 HE ARG 105 HE ARG 105 11.651 3.083 4.897 868 HH11 ARG 105 HH11 ARG 105 12.660 6.412 4.609 869 HH12 ARG 105 HH12 ARG 105 13.993 6.233 5.697 870 HH21 ARG 105 HH21 ARG 105 13.406 2.847 6.330 871 HH22 ARG 105 HH22 ARG 105 14.418 4.209 6.676 872 H GLN 106 HN GLN 106 9.923 0.858 3.318 873 HA GLN 106 HA GLN 106 12.240 0.782 5.003 874 HB2 GLN 106 HB2 GLN 106 9.445 0.307 5.302 875 HB3 GLN 106 HB1 GLN 106 10.303 -1.106 5.893 876 HG2 GLN 106 HG2 GLN 106 10.649 -0.035 7.791 877 HG3 GLN 106 HG1 GLN 106 11.688 1.091 6.916 878 HE21 GLN 106 HE21 GLN 106 9.836 2.413 5.377 879 HE22 GLN 106 HE22 GLN 106 8.785 3.326 6.398 880 H GLY 107 HN GLY 107 10.457 -1.663 3.148 881 HA2 GLY 107 HA2 GLY 107 12.112 -3.234 1.994 882 HA3 GLY 107 HA1 GLY 107 12.667 -3.563 3.630 883 H LEU 108 HN LEU 108 9.820 -3.297 4.593 884 HA LEU 108 HA LEU 108 9.128 -5.966 4.724 885 HB2 LEU 108 HB2 LEU 108 7.057 -3.789 4.699 886 HB3 LEU 108 HB1 LEU 108 7.046 -5.289 5.605 887 HG LEU 108 HG LEU 108 8.700 -2.830 6.143 888 HD11 LEU 108 HD11 LEU 108 7.574 -2.945 8.327 889 HD12 LEU 108 HD12 LEU 108 6.634 -4.322 7.751 890 HD13 LEU 108 HD13 LEU 108 6.440 -2.742 6.992 891 HD21 LEU 108 HD21 LEU 108 10.030 -4.939 6.395 892 HD22 LEU 108 HD22 LEU 108 8.869 -5.449 7.621 893 HD23 LEU 108 HD23 LEU 108 9.842 -3.999 7.875 894 H ALA 109 HN ALA 109 8.583 -3.671 2.191 895 HA ALA 109 HA ALA 109 7.497 -5.784 0.503 896 HB1 ALA 109 HB1 ALA 109 5.543 -4.607 1.465 897 HB2 ALA 109 HB2 ALA 109 5.650 -4.442 -0.287 898 HB3 ALA 109 HB3 ALA 109 6.134 -3.104 0.757 899 H LYS 110 HN LYS 110 7.347 -4.985 -1.821 900 HA LYS 110 HA LYS 110 9.126 -2.794 -2.485 901 HB2 LYS 110 HB2 LYS 110 10.543 -4.210 -3.952 902 HB3 LYS 110 HB1 LYS 110 10.731 -4.583 -2.245 903 HG2 LYS 110 HG2 LYS 110 9.614 -6.609 -2.434 904 HG3 LYS 110 HG1 LYS 110 8.833 -6.147 -3.947 905 HD2 LYS 110 HD2 LYS 110 11.740 -6.119 -4.122 906 HD3 LYS 110 HD1 LYS 110 11.096 -7.706 -3.693 907 HE2 LYS 110 HE2 LYS 110 11.099 -7.769 -6.009 908 HE3 LYS 110 HE1 LYS 110 9.442 -7.294 -5.639 909 HZ1 LYS 110 HZ1 LYS 110 9.870 -5.678 -7.115 910 HZ2 LYS 110 HZ2 LYS 110 11.549 -5.795 -6.943 911 HZ3 LYS 110 HZ3 LYS 110 10.643 -4.915 -5.818 912 H VAL 111 HN VAL 111 9.225 -2.479 -4.901 913 HA VAL 111 HA VAL 111 6.613 -2.405 -5.931 914 HB VAL 111 HB VAL 111 7.870 -1.949 -8.174 915 HG11 VAL 111 HG11 VAL 111 7.524 -0.289 -5.767 916 HG12 VAL 111 HG12 VAL 111 6.924 -0.056 -7.410 917 HG13 VAL 111 HG13 VAL 111 8.591 0.362 -7.012 918 HG21 VAL 111 HG21 VAL 111 10.033 -2.775 -6.693 919 HG22 VAL 111 HG22 VAL 111 10.165 -1.016 -6.638 920 HG23 VAL 111 HG23 VAL 111 10.102 -1.848 -8.192 921 H ALA 112 HN ALA 112 5.451 -4.055 -6.640 922 HA ALA 112 HA ALA 112 6.686 -5.998 -8.437 923 HB1 ALA 112 HB1 ALA 112 5.433 -7.834 -7.171 924 HB2 ALA 112 HB2 ALA 112 5.350 -6.680 -5.839 925 HB3 ALA 112 HB3 ALA 112 6.917 -7.210 -6.451 926 H TYR 113 HN TYR 113 5.326 -6.806 -9.975 927 HA TYR 113 HA TYR 113 3.519 -6.946 -11.342 928 HB2 TYR 113 HB2 TYR 113 2.076 -6.618 -8.709 929 HB3 TYR 113 HB1 TYR 113 1.251 -6.943 -10.230 930 HD1 TYR 113 HD2 TYR 113 3.536 -8.321 -7.696 931 HD2 TYR 113 HD1 TYR 113 1.305 -9.127 -11.227 932 HE1 TYR 113 HE2 TYR 113 3.900 -10.732 -7.368 933 HE2 TYR 113 HE1 TYR 113 1.662 -11.540 -10.910 934 HH TYR 113 HH TYR 113 3.502 -12.983 -9.682 935 H VAL 114 HN VAL 114 4.782 -4.449 -11.183 936 HA VAL 114 HA VAL 114 2.665 -2.449 -11.110 937 HB VAL 114 HB VAL 114 4.869 -1.885 -10.149 938 HG11 VAL 114 HG11 VAL 114 5.975 -1.802 -12.938 939 HG12 VAL 114 HG12 VAL 114 6.119 -3.241 -11.929 940 HG13 VAL 114 HG13 VAL 114 6.837 -1.719 -11.401 941 HG21 VAL 114 HG21 VAL 114 5.204 0.225 -11.693 942 HG22 VAL 114 HG22 VAL 114 3.770 0.047 -10.683 943 HG23 VAL 114 HG23 VAL 114 3.691 -0.339 -12.402 944 H TYR 115 HN TYR 115 1.414 -2.254 -12.855 945 HA TYR 115 HA TYR 115 2.696 -2.406 -15.503 946 HB2 TYR 115 HB2 TYR 115 0.164 -3.659 -14.521 947 HB3 TYR 115 HB1 TYR 115 0.282 -3.175 -16.210 948 HD1 TYR 115 HD2 TYR 115 2.832 -3.879 -17.138 949 HD2 TYR 115 HD1 TYR 115 0.478 -5.921 -14.241 950 HE1 TYR 115 HE2 TYR 115 4.014 -5.970 -17.659 951 HE2 TYR 115 HE1 TYR 115 1.655 -8.018 -14.753 952 HH TYR 115 HH TYR 115 3.725 -8.347 -17.473 953 H LYS 116 HN LYS 116 1.580 -1.229 -17.202 954 HA LYS 116 HA LYS 116 0.554 1.320 -16.207 955 HB2 LYS 116 HB2 LYS 116 0.840 1.953 -18.686 956 HB3 LYS 116 HB1 LYS 116 2.294 1.673 -17.737 957 HG2 LYS 116 HG2 LYS 116 1.241 -0.708 -19.070 958 HG3 LYS 116 HG1 LYS 116 1.776 0.573 -20.164 959 HD2 LYS 116 HD2 LYS 116 3.938 0.642 -18.970 960 HD3 LYS 116 HD1 LYS 116 3.397 -0.698 -17.957 961 HE2 LYS 116 HE2 LYS 116 4.745 -1.637 -19.667 962 HE3 LYS 116 HE1 LYS 116 3.073 -2.023 -20.070 963 HZ1 LYS 116 HZ1 LYS 116 3.243 0.148 -21.455 964 HZ2 LYS 116 HZ2 LYS 116 3.886 -1.291 -22.070 965 HZ3 LYS 116 HZ3 LYS 116 4.910 -0.137 -21.377 966 HA PRO 117 HA PRO 117 -0.302 3.094 -17.676 967 HB2 PRO 117 HB2 PRO 117 -2.483 4.599 -17.216 968 HB3 PRO 117 HB1 PRO 117 -2.081 4.001 -18.830 969 HG2 PRO 117 HG2 PRO 117 -4.055 2.929 -16.852 970 HG3 PRO 117 HG1 PRO 117 -4.234 3.151 -18.601 971 HD2 PRO 117 HD2 PRO 117 -3.653 0.749 -17.448 972 HD3 PRO 117 HD1 PRO 117 -3.140 1.193 -19.087 973 H ASN 118 HN ASN 118 -1.648 1.146 -15.377 974 HA ASN 118 HA ASN 118 -2.086 2.824 -13.185 975 HB2 ASN 118 HB2 ASN 118 -0.885 0.087 -12.864 976 HB3 ASN 118 HB1 ASN 118 -2.057 0.910 -11.843 977 HD21 ASN 118 HD21 ASN 118 -1.589 -0.769 -14.888 978 HD22 ASN 118 HD22 ASN 118 -3.251 -1.184 -15.127 979 H ASN 119 HN ASN 119 -0.664 4.310 -12.563 980 HA ASN 119 HA ASN 119 1.722 3.635 -11.272 981 HB2 ASN 119 HB2 ASN 119 3.280 4.834 -12.955 982 HB3 ASN 119 HB1 ASN 119 2.819 3.168 -13.284 983 HD21 ASN 119 HD21 ASN 119 2.413 2.842 -15.341 984 HD22 ASN 119 HD22 ASN 119 1.650 3.956 -16.420 985 H THR 120 HN THR 120 -0.573 5.315 -10.907 986 HA THR 120 HA THR 120 -0.150 8.025 -11.321 987 HB THR 120 HB THR 120 -1.315 7.409 -8.701 988 HG1 THR 120 HG1 THR 120 -2.062 5.549 -9.462 989 HG21 THR 120 HG21 THR 120 -3.350 8.406 -9.984 990 HG22 THR 120 HG22 THR 120 -2.121 8.886 -11.155 991 HG23 THR 120 HG23 THR 120 -2.013 9.442 -9.485 992 H HIS 121 HN HIS 121 1.007 5.943 -8.713 993 HA HIS 121 HA HIS 121 2.834 8.107 -7.901 994 HB2 HIS 121 HB2 HIS 121 1.392 6.090 -6.179 995 HB3 HIS 121 HB1 HIS 121 2.758 7.039 -5.602 996 HD1 HIS 121 HD1 HIS 121 -0.638 7.061 -5.164 997 HD2 HIS 121 HD2 HIS 121 1.996 9.999 -6.468 998 HE1 HIS 121 HE1 HIS 121 -1.813 9.247 -4.756 999 HE2 HIS 121 HE2 HIS 121 -0.230 11.006 -5.618 1000 H GLU 122 HN GLU 122 3.129 5.823 -9.812 1001 HA GLU 122 HA GLU 122 4.751 3.816 -8.696 1002 HB2 GLU 122 HB2 GLU 122 3.670 3.687 -10.931 1003 HB3 GLU 122 HB1 GLU 122 4.815 4.882 -11.525 1004 HG2 GLU 122 HG2 GLU 122 6.586 3.164 -10.644 1005 HG3 GLU 122 HG1 GLU 122 5.248 2.028 -10.805 1006 H GLN 123 HN GLN 123 5.582 6.881 -10.283 1007 HA GLN 123 HA GLN 123 8.349 6.634 -10.253 1008 HB2 GLN 123 HB2 GLN 123 6.689 9.140 -9.926 1009 HB3 GLN 123 HB1 GLN 123 8.399 9.105 -10.333 1010 HG2 GLN 123 HG2 GLN 123 6.105 8.095 -11.992 1011 HG3 GLN 123 HG1 GLN 123 7.161 9.465 -12.334 1012 HE21 GLN 123 HE21 GLN 123 9.617 8.352 -11.736 1013 HE22 GLN 123 HE22 GLN 123 9.970 7.108 -12.882 1014 H LEU 124 HN LEU 124 6.155 7.214 -7.647 1015 HA LEU 124 HA LEU 124 8.155 8.272 -5.857 1016 HB2 LEU 124 HB2 LEU 124 5.775 8.912 -5.687 1017 HB3 LEU 124 HB1 LEU 124 5.371 7.255 -5.280 1018 HG LEU 124 HG LEU 124 7.162 7.721 -3.345 1019 HD11 LEU 124 HD11 LEU 124 6.398 10.119 -2.554 1020 HD12 LEU 124 HD12 LEU 124 6.244 10.384 -4.291 1021 HD13 LEU 124 HD13 LEU 124 7.795 9.897 -3.608 1022 HD21 LEU 124 HD21 LEU 124 4.845 6.947 -3.069 1023 HD22 LEU 124 HD22 LEU 124 4.282 8.609 -3.242 1024 HD23 LEU 124 HD23 LEU 124 5.289 8.158 -1.866 1025 H LEU 125 HN LEU 125 6.463 5.197 -6.315 1026 HA LEU 125 HA LEU 125 7.830 3.922 -4.131 1027 HB2 LEU 125 HB2 LEU 125 5.995 2.937 -6.300 1028 HB3 LEU 125 HB1 LEU 125 6.776 1.837 -5.179 1029 HG LEU 125 HG LEU 125 5.675 3.539 -3.413 1030 HD11 LEU 125 HD11 LEU 125 3.969 3.662 -5.883 1031 HD12 LEU 125 HD12 LEU 125 4.583 4.994 -4.905 1032 HD13 LEU 125 HD13 LEU 125 3.322 3.940 -4.267 1033 HD21 LEU 125 HD21 LEU 125 3.808 1.519 -4.506 1034 HD22 LEU 125 HD22 LEU 125 4.349 1.788 -2.849 1035 HD23 LEU 125 HD23 LEU 125 5.397 0.949 -3.994 1036 H ARG 126 HN ARG 126 8.299 4.244 -7.569 1037 HA ARG 126 HA ARG 126 9.997 2.091 -8.062 1038 HB2 ARG 126 HB2 ARG 126 8.981 4.009 -9.613 1039 HB3 ARG 126 HB1 ARG 126 10.587 4.688 -9.391 1040 HG2 ARG 126 HG2 ARG 126 11.595 2.675 -10.284 1041 HG3 ARG 126 HG1 ARG 126 10.005 1.926 -10.440 1042 HD2 ARG 126 HD2 ARG 126 9.339 3.569 -12.071 1043 HD3 ARG 126 HD1 ARG 126 10.841 4.463 -11.837 1044 HE ARG 126 HE ARG 126 10.450 2.200 -13.513 1045 HH11 ARG 126 HH11 ARG 126 12.800 3.757 -11.456 1046 HH12 ARG 126 HH12 ARG 126 14.160 3.088 -12.292 1047 HH21 ARG 126 HH21 ARG 126 12.239 1.321 -14.616 1048 HH22 ARG 126 HH22 ARG 126 13.843 1.706 -14.088 1049 H LYS 127 HN LYS 127 10.722 5.318 -6.813 1050 HA LYS 127 HA LYS 127 13.556 4.806 -6.681 1051 HB2 LYS 127 HB2 LYS 127 12.180 7.037 -5.219 1052 HB3 LYS 127 HB1 LYS 127 13.793 7.006 -5.915 1053 HG2 LYS 127 HG2 LYS 127 11.293 6.930 -7.575 1054 HG3 LYS 127 HG1 LYS 127 12.103 8.427 -7.111 1055 HD2 LYS 127 HD2 LYS 127 14.100 7.778 -8.270 1056 HD3 LYS 127 HD1 LYS 127 13.448 6.169 -8.588 1057 HE2 LYS 127 HE2 LYS 127 11.700 8.280 -9.550 1058 HE3 LYS 127 HE1 LYS 127 13.309 8.370 -10.264 1059 HZ1 LYS 127 HZ1 LYS 127 12.109 5.726 -10.160 1060 HZ2 LYS 127 HZ2 LYS 127 13.014 6.457 -11.387 1061 HZ3 LYS 127 HZ3 LYS 127 11.373 6.826 -11.214 1062 H SER 128 HN SER 128 10.856 4.992 -4.420 1063 HA SER 128 HA SER 128 12.176 4.756 -2.009 1064 HB2 SER 128 HB2 SER 128 9.918 5.142 -1.762 1065 HB3 SER 128 HB1 SER 128 9.474 3.977 -3.008 1066 HG SER 128 HG SER 128 9.389 2.458 -1.548 1067 H GLU 129 HN GLU 129 11.092 2.160 -4.180 1068 HA GLU 129 HA GLU 129 11.906 0.018 -2.547 1069 HB2 GLU 129 HB2 GLU 129 10.365 -0.393 -4.347 1070 HB3 GLU 129 HB1 GLU 129 11.513 0.214 -5.535 1071 HG2 GLU 129 HG2 GLU 129 12.694 -1.939 -4.062 1072 HG3 GLU 129 HG1 GLU 129 11.129 -2.434 -4.701 1073 H ALA 130 HN ALA 130 13.527 1.473 -5.370 1074 HA ALA 130 HA ALA 130 15.881 -0.060 -5.145 1075 HB1 ALA 130 HB1 ALA 130 14.849 1.607 -7.026 1076 HB2 ALA 130 HB2 ALA 130 16.490 0.961 -7.041 1077 HB3 ALA 130 HB3 ALA 130 16.183 2.571 -6.390 1078 H GLN 131 HN GLN 131 14.894 2.958 -3.677 1079 HA GLN 131 HA GLN 131 17.374 3.986 -2.948 1080 HB2 GLN 131 HB2 GLN 131 14.609 4.432 -2.224 1081 HB3 GLN 131 HB1 GLN 131 15.650 4.579 -0.817 1082 HG2 GLN 131 HG2 GLN 131 16.190 6.619 -1.453 1083 HG3 GLN 131 HG1 GLN 131 16.925 5.957 -2.913 1084 HE21 GLN 131 HE21 GLN 131 13.551 6.186 -1.854 1085 HE22 GLN 131 HE22 GLN 131 12.999 7.078 -3.228 1086 H ALA 132 HN ALA 132 15.267 1.755 -1.162 1087 HA ALA 132 HA ALA 132 17.264 1.411 0.909 1088 HB1 ALA 132 HB1 ALA 132 15.237 1.339 1.929 1089 HB2 ALA 132 HB2 ALA 132 15.431 -0.383 1.600 1090 HB3 ALA 132 HB3 ALA 132 14.435 0.612 0.537 1091 H LYS 133 HN LYS 133 16.268 -0.184 -1.994 1092 HA LYS 133 HA LYS 133 17.030 -2.811 -1.505 1093 HB2 LYS 133 HB2 LYS 133 16.132 -1.377 -3.683 1094 HB3 LYS 133 HB1 LYS 133 17.741 -1.877 -4.181 1095 HG2 LYS 133 HG2 LYS 133 17.119 -3.998 -4.458 1096 HG3 LYS 133 HG1 LYS 133 16.202 -4.023 -2.951 1097 HD2 LYS 133 HD2 LYS 133 14.562 -2.491 -4.357 1098 HD3 LYS 133 HD1 LYS 133 15.321 -3.339 -5.706 1099 HE2 LYS 133 HE2 LYS 133 14.784 -5.374 -3.949 1100 HE3 LYS 133 HE1 LYS 133 13.406 -4.299 -3.718 1101 HZ1 LYS 133 HZ1 LYS 133 14.259 -5.022 -6.441 1102 HZ2 LYS 133 HZ2 LYS 133 12.730 -4.556 -5.889 1103 HZ3 LYS 133 HZ3 LYS 133 13.317 -6.103 -5.541 1104 H LYS 134 HN LYS 134 19.005 -0.203 -2.916 1105 HA LYS 134 HA LYS 134 21.365 -1.622 -3.233 1106 HB2 LYS 134 HB2 LYS 134 21.080 0.560 -4.211 1107 HB3 LYS 134 HB1 LYS 134 20.933 1.303 -2.625 1108 HG2 LYS 134 HG2 LYS 134 23.300 0.475 -2.196 1109 HG3 LYS 134 HG1 LYS 134 23.380 0.163 -3.931 1110 HD2 LYS 134 HD2 LYS 134 24.313 2.350 -3.407 1111 HD3 LYS 134 HD1 LYS 134 22.843 2.517 -4.369 1112 HE2 LYS 134 HE2 LYS 134 21.889 3.748 -2.784 1113 HE3 LYS 134 HE1 LYS 134 22.182 2.494 -1.580 1114 HZ1 LYS 134 HZ1 LYS 134 24.309 4.372 -2.407 1115 HZ2 LYS 134 HZ2 LYS 134 24.231 3.419 -1.012 1116 HZ3 LYS 134 HZ3 LYS 134 23.214 4.761 -1.177 1117 H GLU 135 HN GLU 135 20.096 -0.033 -0.364 1118 HA GLU 135 HA GLU 135 22.505 -0.770 1.131 1119 HB2 GLU 135 HB2 GLU 135 20.871 0.523 2.934 1120 HB3 GLU 135 HB1 GLU 135 22.168 1.265 2.007 1121 HG2 GLU 135 HG2 GLU 135 20.641 2.066 0.367 1122 HG3 GLU 135 HG1 GLU 135 19.321 1.121 1.053 1123 H LYS 136 HN LYS 136 19.599 -2.184 0.414 1124 HA LYS 136 HA LYS 136 18.221 -3.693 1.455 1125 HB2 LYS 136 HB2 LYS 136 20.885 -4.589 2.571 1126 HB3 LYS 136 HB1 LYS 136 19.434 -5.577 2.445 1127 HG2 LYS 136 HG2 LYS 136 19.543 -5.132 -0.057 1128 HG3 LYS 136 HG1 LYS 136 21.175 -4.530 0.239 1129 HD2 LYS 136 HD2 LYS 136 21.732 -6.690 -0.140 1130 HD3 LYS 136 HD1 LYS 136 21.293 -6.874 1.560 1131 HE2 LYS 136 HE2 LYS 136 19.407 -8.023 1.086 1132 HE3 LYS 136 HE1 LYS 136 19.071 -7.078 -0.366 1133 HZ1 LYS 136 HZ1 LYS 136 21.338 -8.947 -0.374 1134 HZ2 LYS 136 HZ2 LYS 136 20.363 -8.436 -1.658 1135 HZ3 LYS 136 HZ3 LYS 136 19.770 -9.562 -0.544 1136 H LEU 137 HN LEU 137 17.531 -1.715 2.728 1137 HA LEU 137 HA LEU 137 18.270 -0.947 5.187 1138 HB2 LEU 137 HB2 LEU 137 15.679 -1.078 3.794 1139 HB3 LEU 137 HB1 LEU 137 15.582 -0.878 5.535 1140 HG LEU 137 HG LEU 137 16.994 0.933 3.581 1141 HD11 LEU 137 HD11 LEU 137 14.960 1.997 5.399 1142 HD12 LEU 137 HD12 LEU 137 14.348 0.841 4.216 1143 HD13 LEU 137 HD13 LEU 137 15.209 2.284 3.677 1144 HD21 LEU 137 HD21 LEU 137 17.072 0.773 6.561 1145 HD22 LEU 137 HD22 LEU 137 17.165 2.347 5.770 1146 HD23 LEU 137 HD23 LEU 137 18.372 1.111 5.419 1147 H ASN 138 HN ASN 138 15.328 -2.906 5.344 1148 HA ASN 138 HA ASN 138 16.517 -4.249 7.663 1149 HB2 ASN 138 HB2 ASN 138 13.956 -4.833 8.028 1150 HB3 ASN 138 HB1 ASN 138 14.640 -3.294 8.537 1151 HD21 ASN 138 HD21 ASN 138 13.461 -1.610 8.031 1152 HD22 ASN 138 HD22 ASN 138 12.400 -1.471 6.674 1153 H ILE 139 HN ILE 139 13.681 -5.439 5.925 1154 HA ILE 139 HA ILE 139 14.960 -8.041 5.783 1155 HB ILE 139 HB ILE 139 12.767 -8.920 5.220 1156 HG12 ILE 139 HG12 ILE 139 11.316 -6.404 5.658 1157 HG13 ILE 139 HG11 ILE 139 12.252 -6.433 4.167 1158 HG21 ILE 139 HG21 ILE 139 13.359 -8.576 7.569 1159 HG22 ILE 139 HG22 ILE 139 11.626 -8.386 7.302 1160 HG23 ILE 139 HG23 ILE 139 12.647 -6.964 7.511 1161 HD11 ILE 139 HD11 ILE 139 11.014 -8.865 4.117 1162 HD12 ILE 139 HD12 ILE 139 10.457 -7.412 3.288 1163 HD13 ILE 139 HD13 ILE 139 9.798 -7.832 4.869 1164 H TRP 140 HN TRP 140 16.199 -6.408 3.982 1165 HA TRP 140 HA TRP 140 15.016 -6.955 1.368 1166 HB2 TRP 140 HB2 TRP 140 17.491 -5.396 2.135 1167 HB3 TRP 140 HB1 TRP 140 16.885 -5.578 0.490 1168 HD1 TRP 140 HD1 TRP 140 15.800 -4.079 3.870 1169 HE1 TRP 140 HE1 TRP 140 14.215 -2.108 3.399 1170 HE3 TRP 140 HE3 TRP 140 15.444 -4.524 -1.203 1171 HZ2 TRP 140 HZ2 TRP 140 12.990 -0.899 1.181 1172 HZ3 TRP 140 HZ3 TRP 140 14.038 -2.919 -2.432 1173 HH2 TRP 140 HH2 TRP 140 12.835 -1.144 -1.262 Start of MODEL 15 1 H1 ALA 1 HT1 ALA 1 -12.476 24.978 6.766 2 H2 ALA 1 HT2 ALA 1 -12.520 23.411 6.067 3 H3 ALA 1 HT3 ALA 1 -11.896 24.736 5.172 4 HA ALA 1 HA ALA 1 -10.259 24.952 7.076 5 HB1 ALA 1 HB1 ALA 1 -9.822 22.405 7.759 6 HB2 ALA 1 HB2 ALA 1 -11.578 22.359 7.599 7 HB3 ALA 1 HB3 ALA 1 -10.823 23.497 8.715 8 H THR 2 HN THR 2 -8.439 25.054 5.950 9 HA THR 2 HA THR 2 -6.820 24.651 4.407 10 HB THR 2 HB THR 2 -7.609 21.818 4.023 11 HG1 THR 2 HG1 THR 2 -6.978 21.256 6.095 12 HG21 THR 2 HG21 THR 2 -5.505 22.129 3.206 13 HG22 THR 2 HG22 THR 2 -5.134 21.643 4.861 14 HG23 THR 2 HG23 THR 2 -5.096 23.348 4.412 15 H SER 3 HN SER 3 -9.481 25.448 3.542 16 HA SER 3 HA SER 3 -9.837 24.091 0.987 17 HB2 SER 3 HB2 SER 3 -11.874 25.385 0.772 18 HB3 SER 3 HB1 SER 3 -11.811 24.699 2.396 19 HG SER 3 HG SER 3 -12.398 26.983 2.242 20 H THR 4 HN THR 4 -8.434 24.694 -0.540 21 HA THR 4 HA THR 4 -8.353 27.487 -1.320 22 HB THR 4 HB THR 4 -5.719 27.082 -1.526 23 HG1 THR 4 HG1 THR 4 -4.945 25.903 0.167 24 HG21 THR 4 HG21 THR 4 -5.444 28.138 0.742 25 HG22 THR 4 HG22 THR 4 -7.198 28.047 0.898 26 HG23 THR 4 HG23 THR 4 -6.475 29.000 -0.398 27 H LYS 5 HN LYS 5 -7.075 24.228 -1.910 28 HA LYS 5 HA LYS 5 -7.220 24.777 -4.799 29 HB2 LYS 5 HB2 LYS 5 -5.698 22.712 -4.938 30 HB3 LYS 5 HB1 LYS 5 -4.994 24.210 -4.346 31 HG2 LYS 5 HG2 LYS 5 -4.230 22.380 -2.996 32 HG3 LYS 5 HG1 LYS 5 -5.298 23.402 -2.034 33 HD2 LYS 5 HD2 LYS 5 -6.886 21.797 -1.852 34 HD3 LYS 5 HD1 LYS 5 -6.585 21.168 -3.473 35 HE2 LYS 5 HE2 LYS 5 -4.915 19.766 -2.769 36 HE3 LYS 5 HE1 LYS 5 -4.496 20.782 -1.391 37 HZ1 LYS 5 HZ1 LYS 5 -5.540 18.776 -0.630 38 HZ2 LYS 5 HZ2 LYS 5 -6.881 19.030 -1.628 39 HZ3 LYS 5 HZ3 LYS 5 -6.582 20.075 -0.331 40 H LYS 6 HN LYS 6 -8.092 23.181 -6.185 41 HA LYS 6 HA LYS 6 -10.437 21.960 -5.271 42 HB2 LYS 6 HB2 LYS 6 -9.879 22.613 -7.648 43 HB3 LYS 6 HB1 LYS 6 -8.895 21.159 -7.739 44 HG2 LYS 6 HG2 LYS 6 -10.988 20.659 -8.727 45 HG3 LYS 6 HG1 LYS 6 -10.943 19.841 -7.165 46 HD2 LYS 6 HD2 LYS 6 -13.092 20.814 -7.334 47 HD3 LYS 6 HD1 LYS 6 -12.176 21.842 -6.229 48 HE2 LYS 6 HE2 LYS 6 -13.027 23.475 -7.550 49 HE3 LYS 6 HE1 LYS 6 -11.610 23.086 -8.521 50 HZ1 LYS 6 HZ1 LYS 6 -13.370 23.092 -10.023 51 HZ2 LYS 6 HZ2 LYS 6 -14.417 22.284 -8.970 52 HZ3 LYS 6 HZ3 LYS 6 -13.140 21.448 -9.696 53 H LEU 7 HN LEU 7 -10.990 19.698 -5.175 54 HA LEU 7 HA LEU 7 -9.084 18.184 -3.690 55 HB2 LEU 7 HB2 LEU 7 -11.676 17.174 -4.846 56 HB3 LEU 7 HB1 LEU 7 -10.799 16.536 -3.468 57 HG LEU 7 HG LEU 7 -11.338 19.195 -2.792 58 HD11 LEU 7 HD11 LEU 7 -13.795 19.311 -3.035 59 HD12 LEU 7 HD12 LEU 7 -13.730 17.899 -4.089 60 HD13 LEU 7 HD13 LEU 7 -12.941 19.399 -4.575 61 HD21 LEU 7 HD21 LEU 7 -13.200 17.852 -1.412 62 HD22 LEU 7 HD22 LEU 7 -11.481 17.797 -1.018 63 HD23 LEU 7 HD23 LEU 7 -12.213 16.498 -1.961 64 H HIS 8 HN HIS 8 -8.542 15.907 -4.221 65 HA HIS 8 HA HIS 8 -8.397 15.311 -7.075 66 HB2 HIS 8 HB2 HIS 8 -6.313 16.589 -6.331 67 HB3 HIS 8 HB1 HIS 8 -5.911 15.167 -5.374 68 HD1 HIS 8 HD1 HIS 8 -3.982 15.971 -7.544 69 HD2 HIS 8 HD2 HIS 8 -7.159 13.375 -8.199 70 HE1 HIS 8 HE1 HIS 8 -3.345 14.629 -9.572 71 HE2 HIS 8 HE2 HIS 8 -5.245 13.006 -9.898 72 H LYS 9 HN LYS 9 -7.548 14.246 -3.796 73 HA LYS 9 HA LYS 9 -8.143 11.480 -4.610 74 HB2 LYS 9 HB2 LYS 9 -6.844 10.857 -2.539 75 HB3 LYS 9 HB1 LYS 9 -5.900 11.607 -3.818 76 HG2 LYS 9 HG2 LYS 9 -7.023 13.329 -1.668 77 HG3 LYS 9 HG1 LYS 9 -5.609 12.332 -1.320 78 HD2 LYS 9 HD2 LYS 9 -5.549 13.899 -3.830 79 HD3 LYS 9 HD1 LYS 9 -5.444 14.812 -2.323 80 HE2 LYS 9 HE2 LYS 9 -3.738 12.428 -2.434 81 HE3 LYS 9 HE1 LYS 9 -3.330 13.678 -3.610 82 HZ1 LYS 9 HZ1 LYS 9 -3.626 15.162 -1.441 83 HZ2 LYS 9 HZ2 LYS 9 -2.149 14.463 -1.874 84 HZ3 LYS 9 HZ3 LYS 9 -3.125 13.721 -0.708 85 H GLU 10 HN GLU 10 -9.156 10.118 -2.927 86 HA GLU 10 HA GLU 10 -11.069 11.686 -1.327 87 HB2 GLU 10 HB2 GLU 10 -11.421 9.065 -2.776 88 HB3 GLU 10 HB1 GLU 10 -12.559 9.642 -1.568 89 HG2 GLU 10 HG2 GLU 10 -13.499 10.285 -3.592 90 HG3 GLU 10 HG1 GLU 10 -12.729 11.752 -2.992 91 HA PRO 11 HA PRO 11 -9.218 9.600 2.147 92 HB2 PRO 11 HB2 PRO 11 -10.939 10.414 4.059 93 HB3 PRO 11 HB1 PRO 11 -9.754 11.506 3.330 94 HG2 PRO 11 HG2 PRO 11 -12.670 11.200 2.724 95 HG3 PRO 11 HG1 PRO 11 -11.715 12.684 2.902 96 HD2 PRO 11 HD2 PRO 11 -12.374 11.621 0.485 97 HD3 PRO 11 HD1 PRO 11 -10.892 12.557 0.759 98 H ALA 12 HN ALA 12 -9.969 8.153 3.984 99 HA ALA 12 HA ALA 12 -12.449 6.779 3.713 100 HB1 ALA 12 HB1 ALA 12 -11.334 4.541 3.228 101 HB2 ALA 12 HB2 ALA 12 -9.949 5.482 2.676 102 HB3 ALA 12 HB3 ALA 12 -11.511 5.659 1.876 103 H THR 13 HN THR 13 -12.676 5.018 5.284 104 HA THR 13 HA THR 13 -10.786 5.296 7.530 105 HB THR 13 HB THR 13 -13.724 4.701 7.845 106 HG1 THR 13 HG1 THR 13 -13.615 6.725 6.915 107 HG21 THR 13 HG21 THR 13 -13.418 4.814 10.046 108 HG22 THR 13 HG22 THR 13 -12.319 6.188 9.921 109 HG23 THR 13 HG23 THR 13 -11.714 4.550 9.675 110 H LEU 14 HN LEU 14 -9.985 3.461 8.386 111 HA LEU 14 HA LEU 14 -10.234 1.023 7.023 112 HB2 LEU 14 HB2 LEU 14 -8.646 2.057 9.100 113 HB3 LEU 14 HB1 LEU 14 -9.414 0.624 9.759 114 HG LEU 14 HG LEU 14 -7.151 0.265 8.724 115 HD11 LEU 14 HD11 LEU 14 -7.729 -1.865 8.399 116 HD12 LEU 14 HD12 LEU 14 -8.851 -1.457 7.103 117 HD13 LEU 14 HD13 LEU 14 -9.370 -1.345 8.784 118 HD21 LEU 14 HD21 LEU 14 -8.332 1.653 6.573 119 HD22 LEU 14 HD22 LEU 14 -8.049 0.000 6.026 120 HD23 LEU 14 HD23 LEU 14 -6.714 0.959 6.665 121 H ILE 15 HN ILE 15 -12.083 -0.086 6.901 122 HA ILE 15 HA ILE 15 -14.055 -0.063 8.972 123 HB ILE 15 HB ILE 15 -13.827 -1.942 6.614 124 HG12 ILE 15 HG12 ILE 15 -13.886 0.451 5.959 125 HG13 ILE 15 HG11 ILE 15 -15.322 -0.425 5.442 126 HG21 ILE 15 HG21 ILE 15 -15.483 -2.135 8.793 127 HG22 ILE 15 HG22 ILE 15 -15.782 -2.846 7.208 128 HG23 ILE 15 HG23 ILE 15 -16.483 -1.281 7.619 129 HD11 ILE 15 HD11 ILE 15 -16.262 1.483 6.258 130 HD12 ILE 15 HD12 ILE 15 -15.025 1.696 7.498 131 HD13 ILE 15 HD13 ILE 15 -16.286 0.482 7.710 132 H LYS 16 HN LYS 16 -11.627 -2.351 7.823 133 HA LYS 16 HA LYS 16 -11.247 -3.480 10.385 134 HB2 LYS 16 HB2 LYS 16 -13.205 -4.766 8.616 135 HB3 LYS 16 HB1 LYS 16 -11.956 -5.856 9.198 136 HG2 LYS 16 HG2 LYS 16 -13.107 -4.143 11.271 137 HG3 LYS 16 HG1 LYS 16 -14.256 -5.252 10.519 138 HD2 LYS 16 HD2 LYS 16 -12.417 -7.034 10.902 139 HD3 LYS 16 HD1 LYS 16 -11.757 -5.870 12.052 140 HE2 LYS 16 HE2 LYS 16 -14.649 -6.403 12.270 141 HE3 LYS 16 HE1 LYS 16 -13.586 -7.747 12.689 142 HZ1 LYS 16 HZ1 LYS 16 -12.645 -6.571 14.423 143 HZ2 LYS 16 HZ2 LYS 16 -14.262 -6.084 14.507 144 HZ3 LYS 16 HZ3 LYS 16 -13.108 -5.062 13.811 145 H ALA 17 HN ALA 17 -9.302 -4.498 10.489 146 HA ALA 17 HA ALA 17 -7.642 -4.390 8.159 147 HB1 ALA 17 HB1 ALA 17 -6.734 -3.748 10.311 148 HB2 ALA 17 HB2 ALA 17 -5.852 -5.136 9.673 149 HB3 ALA 17 HB3 ALA 17 -7.047 -5.362 10.949 150 H ILE 18 HN ILE 18 -7.092 -6.008 6.824 151 HA ILE 18 HA ILE 18 -8.263 -8.635 7.292 152 HB ILE 18 HB ILE 18 -6.641 -7.992 4.861 153 HG12 ILE 18 HG12 ILE 18 -8.559 -6.228 5.572 154 HG13 ILE 18 HG11 ILE 18 -8.164 -6.612 3.907 155 HG21 ILE 18 HG21 ILE 18 -8.864 -9.851 5.576 156 HG22 ILE 18 HG22 ILE 18 -7.302 -10.200 4.836 157 HG23 ILE 18 HG23 ILE 18 -8.571 -9.421 3.891 158 HD11 ILE 18 HD11 ILE 18 -10.048 -7.977 3.663 159 HD12 ILE 18 HD12 ILE 18 -10.617 -6.570 4.564 160 HD13 ILE 18 HD13 ILE 18 -10.298 -8.087 5.406 161 H ASP 19 HN ASP 19 -5.145 -7.709 5.842 162 HA ASP 19 HA ASP 19 -3.768 -9.386 7.806 163 HB2 ASP 19 HB2 ASP 19 -3.913 -9.923 4.869 164 HB3 ASP 19 HB1 ASP 19 -2.415 -10.285 5.719 165 H GLY 20 HN GLY 20 -2.166 -8.521 4.847 166 HA2 GLY 20 HA2 GLY 20 -0.755 -6.377 6.310 167 HA3 GLY 20 HA1 GLY 20 0.011 -7.423 5.120 168 H ASP 21 HN ASP 21 -0.689 -7.235 2.888 169 HA ASP 21 HA ASP 21 -0.934 -4.527 2.087 170 HB2 ASP 21 HB2 ASP 21 -1.034 -7.132 0.567 171 HB3 ASP 21 HB1 ASP 21 -1.179 -5.563 -0.222 172 H THR 22 HN THR 22 -3.180 -7.072 2.746 173 HA THR 22 HA THR 22 -5.348 -5.686 1.366 174 HB THR 22 HB THR 22 -5.647 -8.212 2.969 175 HG1 THR 22 HG1 THR 22 -5.044 -9.371 1.155 176 HG21 THR 22 HG21 THR 22 -6.992 -7.372 0.418 177 HG22 THR 22 HG22 THR 22 -7.661 -7.097 2.027 178 HG23 THR 22 HG23 THR 22 -7.396 -8.743 1.452 179 H VAL 23 HN VAL 23 -6.791 -4.467 2.356 180 HA VAL 23 HA VAL 23 -7.413 -4.762 5.161 181 HB VAL 23 HB VAL 23 -7.001 -2.299 5.593 182 HG11 VAL 23 HG11 VAL 23 -5.477 -4.425 6.123 183 HG12 VAL 23 HG12 VAL 23 -5.017 -2.785 6.579 184 HG13 VAL 23 HG13 VAL 23 -4.346 -3.516 5.121 185 HG21 VAL 23 HG21 VAL 23 -6.515 -2.126 2.946 186 HG22 VAL 23 HG22 VAL 23 -4.869 -2.277 3.561 187 HG23 VAL 23 HG23 VAL 23 -5.908 -0.971 4.133 188 H LYS 24 HN LYS 24 -9.448 -3.982 5.646 189 HA LYS 24 HA LYS 24 -11.053 -3.187 3.361 190 HB2 LYS 24 HB2 LYS 24 -11.520 -4.548 5.852 191 HB3 LYS 24 HB1 LYS 24 -12.638 -3.200 5.699 192 HG2 LYS 24 HG2 LYS 24 -12.450 -4.669 3.226 193 HG3 LYS 24 HG1 LYS 24 -12.878 -5.730 4.569 194 HD2 LYS 24 HD2 LYS 24 -14.643 -4.027 5.184 195 HD3 LYS 24 HD1 LYS 24 -14.310 -3.251 3.634 196 HE2 LYS 24 HE2 LYS 24 -15.808 -4.639 2.745 197 HE3 LYS 24 HE1 LYS 24 -14.633 -5.929 2.995 198 HZ1 LYS 24 HZ1 LYS 24 -16.673 -5.109 4.990 199 HZ2 LYS 24 HZ2 LYS 24 -15.621 -6.427 5.106 200 HZ3 LYS 24 HZ3 LYS 24 -16.841 -6.419 3.934 201 H LEU 25 HN LEU 25 -11.786 -1.186 2.961 202 HA LEU 25 HA LEU 25 -11.517 0.832 5.077 203 HB2 LEU 25 HB2 LEU 25 -10.500 0.882 2.288 204 HB3 LEU 25 HB1 LEU 25 -11.066 2.384 2.983 205 HG LEU 25 HG LEU 25 -9.330 1.147 4.871 206 HD11 LEU 25 HD11 LEU 25 -8.470 0.918 2.049 207 HD12 LEU 25 HD12 LEU 25 -8.056 -0.073 3.448 208 HD13 LEU 25 HD13 LEU 25 -7.277 1.492 3.214 209 HD21 LEU 25 HD21 LEU 25 -9.465 3.438 4.990 210 HD22 LEU 25 HD22 LEU 25 -9.396 3.641 3.239 211 HD23 LEU 25 HD23 LEU 25 -7.934 3.235 4.138 212 H MET 26 HN MET 26 -12.901 2.698 4.855 213 HA MET 26 HA MET 26 -15.524 1.951 3.923 214 HB2 MET 26 HB2 MET 26 -15.011 3.204 6.079 215 HB3 MET 26 HB1 MET 26 -14.712 4.616 5.075 216 HG2 MET 26 HG2 MET 26 -16.885 5.008 4.775 217 HG3 MET 26 HG1 MET 26 -17.250 3.307 4.497 218 HE1 MET 26 HE1 MET 26 -19.376 2.964 5.701 219 HE2 MET 26 HE2 MET 26 -19.535 4.707 5.916 220 HE3 MET 26 HE3 MET 26 -19.790 3.623 7.284 221 H TYR 27 HN TYR 27 -16.178 2.259 1.919 222 HA TYR 27 HA TYR 27 -15.334 4.690 0.496 223 HB2 TYR 27 HB2 TYR 27 -14.071 2.671 -0.300 224 HB3 TYR 27 HB1 TYR 27 -15.607 1.971 -0.794 225 HD1 TYR 27 HD1 TYR 27 -14.458 5.491 -1.125 226 HD2 TYR 27 HD2 TYR 27 -15.441 1.867 -3.124 227 HE1 TYR 27 HE1 TYR 27 -14.276 6.644 -3.290 228 HE2 TYR 27 HE2 TYR 27 -15.260 3.009 -5.295 229 HH TYR 27 HH TYR 27 -13.926 6.160 -5.611 230 H LYS 28 HN LYS 28 -17.055 5.874 0.014 231 HA LYS 28 HA LYS 28 -19.172 6.497 -0.522 232 HB2 LYS 28 HB2 LYS 28 -19.144 3.758 -1.789 233 HB3 LYS 28 HB1 LYS 28 -20.432 4.932 -2.016 234 HG2 LYS 28 HG2 LYS 28 -18.655 6.514 -2.881 235 HG3 LYS 28 HG1 LYS 28 -17.575 5.119 -2.914 236 HD2 LYS 28 HD2 LYS 28 -18.365 4.744 -4.971 237 HD3 LYS 28 HD1 LYS 28 -19.839 4.185 -4.177 238 HE2 LYS 28 HE2 LYS 28 -20.881 5.770 -5.357 239 HE3 LYS 28 HE1 LYS 28 -20.168 6.910 -4.217 240 HZ1 LYS 28 HZ1 LYS 28 -18.523 6.110 -6.487 241 HZ2 LYS 28 HZ2 LYS 28 -18.658 7.615 -5.726 242 HZ3 LYS 28 HZ3 LYS 28 -19.843 7.114 -6.823 243 H GLY 29 HN GLY 29 -18.889 5.643 2.060 244 HA2 GLY 29 HA2 GLY 29 -20.126 4.993 3.879 245 HA3 GLY 29 HA1 GLY 29 -21.530 5.082 2.827 246 H GLN 30 HN GLN 30 -19.011 2.969 1.839 247 HA GLN 30 HA GLN 30 -20.365 0.657 3.033 248 HB2 GLN 30 HB2 GLN 30 -20.902 -0.316 1.059 249 HB3 GLN 30 HB1 GLN 30 -20.850 1.334 0.455 250 HG2 GLN 30 HG2 GLN 30 -18.313 0.736 0.048 251 HG3 GLN 30 HG1 GLN 30 -18.949 -0.908 0.033 252 HE21 GLN 30 HE21 GLN 30 -17.758 0.507 -2.150 253 HE22 GLN 30 HE22 GLN 30 -18.953 0.630 -3.390 254 HA PRO 31 HA PRO 31 -16.218 -0.679 3.699 255 HB2 PRO 31 HB2 PRO 31 -16.643 -3.158 4.524 256 HB3 PRO 31 HB1 PRO 31 -17.335 -1.792 5.415 257 HG2 PRO 31 HG2 PRO 31 -18.662 -3.626 3.453 258 HG3 PRO 31 HG1 PRO 31 -19.260 -3.040 5.017 259 HD2 PRO 31 HD2 PRO 31 -19.913 -1.938 2.561 260 HD3 PRO 31 HD1 PRO 31 -20.026 -1.088 4.116 261 H MET 32 HN MET 32 -14.759 -1.020 2.156 262 HA MET 32 HA MET 32 -15.173 -3.267 0.298 263 HB2 MET 32 HB2 MET 32 -15.312 -0.784 -0.571 264 HB3 MET 32 HB1 MET 32 -13.557 -0.885 -0.509 265 HG2 MET 32 HG2 MET 32 -14.355 -1.408 -2.725 266 HG3 MET 32 HG1 MET 32 -13.620 -2.830 -1.989 267 HE1 MET 32 HE1 MET 32 -14.215 -4.649 -2.655 268 HE2 MET 32 HE2 MET 32 -15.598 -4.940 -3.710 269 HE3 MET 32 HE3 MET 32 -15.658 -5.438 -2.019 270 H THR 33 HN THR 33 -13.324 -4.407 -0.359 271 HA THR 33 HA THR 33 -11.211 -4.425 1.623 272 HB THR 33 HB THR 33 -11.498 -6.214 -0.793 273 HG1 THR 33 HG1 THR 33 -12.521 -6.631 1.817 274 HG21 THR 33 HG21 THR 33 -10.515 -7.581 1.460 275 HG22 THR 33 HG22 THR 33 -9.577 -6.096 1.300 276 HG23 THR 33 HG23 THR 33 -9.683 -7.222 -0.052 277 H PHE 34 HN PHE 34 -9.479 -3.198 1.390 278 HA PHE 34 HA PHE 34 -8.656 -2.377 -1.300 279 HB2 PHE 34 HB2 PHE 34 -8.315 -1.197 1.429 280 HB3 PHE 34 HB1 PHE 34 -7.157 -0.788 0.166 281 HD1 PHE 34 HD1 PHE 34 -10.812 -0.850 0.886 282 HD2 PHE 34 HD2 PHE 34 -7.629 0.902 -1.337 283 HE1 PHE 34 HE1 PHE 34 -12.365 0.836 -0.011 284 HE2 PHE 34 HE2 PHE 34 -9.175 2.591 -2.229 285 HZ PHE 34 HZ PHE 34 -11.545 2.558 -1.569 286 H ARG 35 HN ARG 35 -6.410 -2.417 -1.893 287 HA ARG 35 HA ARG 35 -4.781 -4.281 -0.320 288 HB2 ARG 35 HB2 ARG 35 -4.297 -5.646 -2.138 289 HB3 ARG 35 HB1 ARG 35 -5.998 -5.274 -2.382 290 HG2 ARG 35 HG2 ARG 35 -5.178 -4.965 -4.491 291 HG3 ARG 35 HG1 ARG 35 -5.062 -3.327 -3.844 292 HD2 ARG 35 HD2 ARG 35 -2.796 -3.369 -3.771 293 HD3 ARG 35 HD1 ARG 35 -2.728 -5.093 -3.426 294 HE ARG 35 HE ARG 35 -2.896 -3.835 -6.055 295 HH11 ARG 35 HH11 ARG 35 -2.810 -6.776 -4.168 296 HH12 ARG 35 HH12 ARG 35 -2.386 -7.772 -5.517 297 HH21 ARG 35 HH21 ARG 35 -2.343 -5.150 -7.825 298 HH22 ARG 35 HH22 ARG 35 -2.122 -6.851 -7.592 299 H LEU 36 HN LEU 36 -2.594 -3.865 -0.264 300 HA LEU 36 HA LEU 36 -1.736 -1.236 -0.797 301 HB2 LEU 36 HB2 LEU 36 -0.294 -3.776 -0.076 302 HB3 LEU 36 HB1 LEU 36 0.599 -2.311 -0.448 303 HG LEU 36 HG LEU 36 -1.401 -2.645 1.788 304 HD11 LEU 36 HD11 LEU 36 1.303 -3.359 1.633 305 HD12 LEU 36 HD12 LEU 36 0.299 -3.252 3.078 306 HD13 LEU 36 HD13 LEU 36 1.252 -1.861 2.563 307 HD21 LEU 36 HD21 LEU 36 -1.500 -0.390 0.930 308 HD22 LEU 36 HD22 LEU 36 0.258 -0.265 0.969 309 HD23 LEU 36 HD23 LEU 36 -0.650 -0.396 2.474 310 H LEU 37 HN LEU 37 -2.272 -0.884 -2.987 311 HA LEU 37 HA LEU 37 -1.746 -2.230 -5.233 312 HB2 LEU 37 HB2 LEU 37 -2.606 0.199 -4.829 313 HB3 LEU 37 HB1 LEU 37 -0.945 0.642 -5.174 314 HG LEU 37 HG LEU 37 -1.097 -0.425 -7.363 315 HD11 LEU 37 HD11 LEU 37 -3.479 -1.011 -8.120 316 HD12 LEU 37 HD12 LEU 37 -3.827 -1.160 -6.398 317 HD13 LEU 37 HD13 LEU 37 -2.596 -2.180 -7.139 318 HD21 LEU 37 HD21 LEU 37 -2.005 1.400 -8.315 319 HD22 LEU 37 HD22 LEU 37 -2.112 1.978 -6.653 320 HD23 LEU 37 HD23 LEU 37 -3.517 1.240 -7.422 321 H LEU 38 HN LEU 38 -0.135 -2.701 -6.599 322 HA LEU 38 HA LEU 38 1.967 -3.457 -7.092 323 HB2 LEU 38 HB2 LEU 38 3.437 -1.708 -7.756 324 HB3 LEU 38 HB1 LEU 38 1.794 -1.201 -8.094 325 HG LEU 38 HG LEU 38 3.026 -0.346 -5.519 326 HD11 LEU 38 HD11 LEU 38 4.245 1.414 -6.458 327 HD12 LEU 38 HD12 LEU 38 3.518 1.190 -8.049 328 HD13 LEU 38 HD13 LEU 38 4.678 0.011 -7.436 329 HD21 LEU 38 HD21 LEU 38 1.643 1.681 -6.959 330 HD22 LEU 38 HD22 LEU 38 1.179 0.882 -5.457 331 HD23 LEU 38 HD23 LEU 38 0.679 0.206 -7.007 332 H VAL 39 HN VAL 39 1.438 -3.730 -4.262 333 HA VAL 39 HA VAL 39 4.163 -3.331 -3.210 334 HB VAL 39 HB VAL 39 1.607 -3.622 -1.621 335 HG11 VAL 39 HG11 VAL 39 4.412 -3.013 -0.699 336 HG12 VAL 39 HG12 VAL 39 3.570 -4.547 -0.482 337 HG13 VAL 39 HG13 VAL 39 2.974 -3.094 0.318 338 HG21 VAL 39 HG21 VAL 39 2.730 -1.165 -1.048 339 HG22 VAL 39 HG22 VAL 39 1.333 -1.453 -2.083 340 HG23 VAL 39 HG23 VAL 39 2.942 -1.319 -2.792 341 H ASP 40 HN ASP 40 5.247 -5.052 -2.354 342 HA ASP 40 HA ASP 40 4.072 -7.681 -2.887 343 HB2 ASP 40 HB2 ASP 40 6.484 -6.683 -3.622 344 HB3 ASP 40 HB1 ASP 40 6.921 -7.490 -2.118 345 H THR 41 HN THR 41 4.182 -9.374 -1.375 346 HA THR 41 HA THR 41 4.354 -8.453 1.411 347 HB THR 41 HB THR 41 3.103 -10.818 1.646 348 HG1 THR 41 HG1 THR 41 2.294 -9.851 -0.892 349 HG21 THR 41 HG21 THR 41 1.792 -8.229 0.862 350 HG22 THR 41 HG22 THR 41 2.123 -8.811 2.494 351 HG23 THR 41 HG23 THR 41 0.934 -9.637 1.486 352 HA PRO 42 HA PRO 42 7.908 -11.082 1.859 353 HB2 PRO 42 HB2 PRO 42 8.176 -10.994 4.531 354 HB3 PRO 42 HB1 PRO 42 8.510 -9.586 3.515 355 HG2 PRO 42 HG2 PRO 42 6.074 -10.218 5.136 356 HG3 PRO 42 HG1 PRO 42 6.929 -8.676 4.956 357 HD2 PRO 42 HD2 PRO 42 4.646 -9.316 3.588 358 HD3 PRO 42 HD1 PRO 42 5.868 -8.178 2.987 359 H GLU 43 HN GLU 43 8.546 -13.132 2.729 360 HA GLU 43 HA GLU 43 6.277 -14.912 3.148 361 HB2 GLU 43 HB2 GLU 43 8.532 -15.183 1.647 362 HB3 GLU 43 HB1 GLU 43 8.998 -16.051 3.103 363 HG2 GLU 43 HG2 GLU 43 8.076 -17.747 1.903 364 HG3 GLU 43 HG1 GLU 43 6.656 -17.191 2.787 365 H THR 44 HN THR 44 6.659 -16.764 4.733 366 HA THR 44 HA THR 44 7.994 -15.791 7.167 367 HB THR 44 HB THR 44 5.323 -17.202 7.135 368 HG1 THR 44 HG1 THR 44 5.904 -14.448 7.477 369 HG21 THR 44 HG21 THR 44 6.511 -15.620 9.383 370 HG22 THR 44 HG22 THR 44 6.779 -17.354 9.206 371 HG23 THR 44 HG23 THR 44 5.143 -16.731 9.416 372 H LYS 45 HN LYS 45 9.729 -17.200 6.571 373 HA LYS 45 HA LYS 45 10.932 -19.127 6.681 374 HB2 LYS 45 HB2 LYS 45 8.767 -19.497 8.670 375 HB3 LYS 45 HB1 LYS 45 9.636 -20.947 8.188 376 HG2 LYS 45 HG2 LYS 45 10.594 -19.929 10.189 377 HG3 LYS 45 HG1 LYS 45 11.740 -19.939 8.847 378 HD2 LYS 45 HD2 LYS 45 10.815 -17.553 8.385 379 HD3 LYS 45 HD1 LYS 45 10.254 -17.639 10.056 380 HE2 LYS 45 HE2 LYS 45 12.300 -16.780 10.480 381 HE3 LYS 45 HE1 LYS 45 12.780 -18.473 10.389 382 HZ1 LYS 45 HZ1 LYS 45 13.604 -18.197 8.239 383 HZ2 LYS 45 HZ2 LYS 45 14.123 -16.807 9.052 384 HZ3 LYS 45 HZ3 LYS 45 12.798 -16.728 8.003 385 H HIS 46 HN HIS 46 8.892 -18.777 4.576 386 HA HIS 46 HA HIS 46 7.974 -19.930 2.845 387 HB2 HIS 46 HB2 HIS 46 10.333 -21.421 3.671 388 HB3 HIS 46 HB1 HIS 46 9.132 -22.462 2.915 389 HD1 HIS 46 HD1 HIS 46 12.017 -21.215 1.834 390 HD2 HIS 46 HD2 HIS 46 8.149 -20.423 0.540 391 HE1 HIS 46 HE1 HIS 46 12.256 -20.366 -0.521 392 HE2 HIS 46 HE2 HIS 46 9.910 -19.812 -1.252 393 HA PRO 47 HA PRO 47 5.029 -21.991 5.856 394 HB2 PRO 47 HB2 PRO 47 3.185 -20.691 3.916 395 HB3 PRO 47 HB1 PRO 47 3.101 -20.754 5.680 396 HG2 PRO 47 HG2 PRO 47 3.845 -18.521 4.433 397 HG3 PRO 47 HG1 PRO 47 4.621 -19.022 5.947 398 HD2 PRO 47 HD2 PRO 47 5.634 -19.209 3.142 399 HD3 PRO 47 HD1 PRO 47 6.516 -18.846 4.640 400 H LYS 48 HN LYS 48 3.468 -23.663 5.410 401 HA LYS 48 HA LYS 48 4.243 -25.359 3.269 402 HB2 LYS 48 HB2 LYS 48 3.067 -25.794 5.657 403 HB3 LYS 48 HB1 LYS 48 1.652 -25.862 4.615 404 HG2 LYS 48 HG2 LYS 48 2.290 -27.797 3.635 405 HG3 LYS 48 HG1 LYS 48 4.010 -27.420 3.753 406 HD2 LYS 48 HD2 LYS 48 3.845 -29.109 5.298 407 HD3 LYS 48 HD1 LYS 48 3.565 -27.705 6.329 408 HE2 LYS 48 HE2 LYS 48 1.049 -28.352 5.350 409 HE3 LYS 48 HE1 LYS 48 1.803 -29.913 5.677 410 HZ1 LYS 48 HZ1 LYS 48 1.995 -27.803 7.706 411 HZ2 LYS 48 HZ2 LYS 48 1.945 -29.483 7.902 412 HZ3 LYS 48 HZ3 LYS 48 0.529 -28.632 7.538 413 H LYS 49 HN LYS 49 2.119 -26.480 2.142 414 HA LYS 49 HA LYS 49 1.022 -24.311 0.510 415 HB2 LYS 49 HB2 LYS 49 1.648 -27.175 0.049 416 HB3 LYS 49 HB1 LYS 49 0.268 -26.520 -0.820 417 HG2 LYS 49 HG2 LYS 49 2.820 -24.999 -0.877 418 HG3 LYS 49 HG1 LYS 49 2.688 -26.471 -1.842 419 HD2 LYS 49 HD2 LYS 49 0.654 -25.568 -2.899 420 HD3 LYS 49 HD1 LYS 49 0.849 -24.082 -1.967 421 HE2 LYS 49 HE2 LYS 49 2.525 -23.326 -3.275 422 HE3 LYS 49 HE1 LYS 49 3.214 -24.934 -3.497 423 HZ1 LYS 49 HZ1 LYS 49 2.014 -25.289 -5.352 424 HZ2 LYS 49 HZ2 LYS 49 1.970 -23.599 -5.422 425 HZ3 LYS 49 HZ3 LYS 49 0.655 -24.454 -4.788 426 H GLY 50 HN GLY 50 -0.020 -24.950 3.172 427 HA2 GLY 50 HA2 GLY 50 -2.806 -24.994 2.487 428 HA3 GLY 50 HA1 GLY 50 -2.291 -26.471 3.288 429 H VAL 51 HN VAL 51 -0.904 -23.333 3.986 430 HA VAL 51 HA VAL 51 -2.429 -23.199 6.491 431 HB VAL 51 HB VAL 51 0.554 -22.758 6.394 432 HG11 VAL 51 HG11 VAL 51 -0.131 -21.602 8.239 433 HG12 VAL 51 HG12 VAL 51 0.052 -23.205 8.951 434 HG13 VAL 51 HG13 VAL 51 -1.547 -22.621 8.491 435 HG21 VAL 51 HG21 VAL 51 -0.120 -25.136 5.932 436 HG22 VAL 51 HG22 VAL 51 -0.852 -25.164 7.536 437 HG23 VAL 51 HG23 VAL 51 0.885 -24.903 7.363 438 H GLU 52 HN GLU 52 -2.376 -21.088 7.515 439 HA GLU 52 HA GLU 52 -2.680 -18.982 5.633 440 HB2 GLU 52 HB2 GLU 52 -2.905 -19.271 8.583 441 HB3 GLU 52 HB1 GLU 52 -2.668 -17.646 7.954 442 HG2 GLU 52 HG2 GLU 52 -4.645 -18.674 6.336 443 HG3 GLU 52 HG1 GLU 52 -5.027 -19.334 7.925 444 H LYS 53 HN LYS 53 -1.127 -17.820 4.732 445 HA LYS 53 HA LYS 53 1.579 -17.958 5.425 446 HB2 LYS 53 HB2 LYS 53 0.114 -15.826 3.860 447 HB3 LYS 53 HB1 LYS 53 1.862 -16.009 3.915 448 HG2 LYS 53 HG2 LYS 53 1.860 -17.742 2.482 449 HG3 LYS 53 HG1 LYS 53 0.365 -18.416 3.133 450 HD2 LYS 53 HD2 LYS 53 -0.940 -16.761 1.934 451 HD3 LYS 53 HD1 LYS 53 0.536 -15.991 1.345 452 HE2 LYS 53 HE2 LYS 53 0.996 -17.697 -0.132 453 HE3 LYS 53 HE1 LYS 53 0.083 -18.886 0.794 454 HZ1 LYS 53 HZ1 LYS 53 -1.019 -18.269 -1.286 455 HZ2 LYS 53 HZ2 LYS 53 -1.117 -16.662 -0.766 456 HZ3 LYS 53 HZ3 LYS 53 -1.962 -17.872 0.062 457 H TYR 54 HN TYR 54 -0.366 -14.980 5.603 458 HA TYR 54 HA TYR 54 -0.353 -13.236 7.060 459 HB2 TYR 54 HB2 TYR 54 -0.568 -15.471 8.614 460 HB3 TYR 54 HB1 TYR 54 0.862 -14.710 9.302 461 HD1 TYR 54 HD2 TYR 54 0.652 -12.224 9.968 462 HD2 TYR 54 HD1 TYR 54 -2.693 -14.751 9.241 463 HE1 TYR 54 HE2 TYR 54 -0.779 -10.688 11.249 464 HE2 TYR 54 HE1 TYR 54 -4.134 -13.221 10.519 465 HH TYR 54 HH TYR 54 -4.141 -10.812 11.172 466 H GLY 55 HN GLY 55 1.025 -11.683 8.082 467 HA2 GLY 55 HA2 GLY 55 3.900 -12.179 7.597 468 HA3 GLY 55 HA1 GLY 55 3.125 -10.652 7.210 469 HA PRO 56 HA PRO 56 4.405 -10.747 11.752 470 HB2 PRO 56 HB2 PRO 56 7.113 -10.501 11.766 471 HB3 PRO 56 HB1 PRO 56 6.279 -12.054 11.810 472 HG2 PRO 56 HG2 PRO 56 7.801 -10.818 9.632 473 HG3 PRO 56 HG1 PRO 56 7.345 -12.511 9.863 474 HD2 PRO 56 HD2 PRO 56 6.121 -10.553 8.153 475 HD3 PRO 56 HD1 PRO 56 5.684 -12.258 8.359 476 H GLU 57 HN GLU 57 6.988 -9.067 9.987 477 HA GLU 57 HA GLU 57 6.380 -6.603 11.337 478 HB2 GLU 57 HB2 GLU 57 8.451 -7.414 9.310 479 HB3 GLU 57 HB1 GLU 57 8.270 -5.746 9.832 480 HG2 GLU 57 HG2 GLU 57 8.513 -7.784 11.955 481 HG3 GLU 57 HG1 GLU 57 9.949 -7.466 10.984 482 H ALA 58 HN ALA 58 5.607 -8.043 8.285 483 HA ALA 58 HA ALA 58 5.063 -5.624 6.878 484 HB1 ALA 58 HB1 ALA 58 3.619 -8.025 6.010 485 HB2 ALA 58 HB2 ALA 58 5.368 -8.216 6.136 486 HB3 ALA 58 HB3 ALA 58 4.690 -6.953 5.109 487 H SER 59 HN SER 59 2.889 -8.107 8.230 488 HA SER 59 HA SER 59 0.521 -6.650 7.813 489 HB2 SER 59 HB2 SER 59 1.290 -9.149 9.017 490 HB3 SER 59 HB1 SER 59 0.117 -8.329 10.047 491 HG SER 59 HG SER 59 -1.328 -8.959 8.675 492 H ALA 60 HN ALA 60 2.679 -6.887 10.603 493 HA ALA 60 HA ALA 60 1.107 -5.412 12.404 494 HB1 ALA 60 HB1 ALA 60 3.191 -6.858 12.843 495 HB2 ALA 60 HB2 ALA 60 2.952 -5.409 13.821 496 HB3 ALA 60 HB3 ALA 60 4.101 -5.390 12.482 497 H PHE 61 HN PHE 61 3.803 -4.376 10.312 498 HA PHE 61 HA PHE 61 3.837 -1.700 11.050 499 HB2 PHE 61 HB2 PHE 61 5.582 -2.799 9.689 500 HB3 PHE 61 HB1 PHE 61 4.467 -2.846 8.327 501 HD1 PHE 61 HD1 PHE 61 6.331 -0.606 10.576 502 HD2 PHE 61 HD2 PHE 61 4.133 -0.965 6.956 503 HE1 PHE 61 HE1 PHE 61 7.049 1.660 9.919 504 HE2 PHE 61 HE2 PHE 61 4.835 1.292 6.292 505 HZ PHE 61 HZ PHE 61 6.300 2.611 7.774 506 H THR 62 HN THR 62 2.161 -3.201 8.286 507 HA THR 62 HA THR 62 0.993 -0.947 7.210 508 HB THR 62 HB THR 62 -0.479 -3.571 7.408 509 HG1 THR 62 HG1 THR 62 1.848 -2.940 5.961 510 HG21 THR 62 HG21 THR 62 -0.690 -1.215 5.734 511 HG22 THR 62 HG22 THR 62 -1.826 -2.542 5.980 512 HG23 THR 62 HG23 THR 62 -0.522 -2.703 4.804 513 H LYS 63 HN LYS 63 -0.469 -3.132 9.623 514 HA LYS 63 HA LYS 63 -2.742 -1.498 10.076 515 HB2 LYS 63 HB2 LYS 63 -2.274 -4.021 10.653 516 HB3 LYS 63 HB1 LYS 63 -1.682 -3.357 12.170 517 HG2 LYS 63 HG2 LYS 63 -4.159 -2.126 11.673 518 HG3 LYS 63 HG1 LYS 63 -4.371 -3.840 11.328 519 HD2 LYS 63 HD2 LYS 63 -4.853 -3.193 13.691 520 HD3 LYS 63 HD1 LYS 63 -3.624 -4.446 13.519 521 HE2 LYS 63 HE2 LYS 63 -2.613 -1.682 13.571 522 HE3 LYS 63 HE1 LYS 63 -3.364 -2.236 15.067 523 HZ1 LYS 63 HZ1 LYS 63 -1.418 -3.181 15.512 524 HZ2 LYS 63 HZ2 LYS 63 -0.835 -2.936 13.944 525 HZ3 LYS 63 HZ3 LYS 63 -1.756 -4.310 14.298 526 H LYS 64 HN LYS 64 0.462 -1.650 11.444 527 HA LYS 64 HA LYS 64 0.027 -0.109 13.755 528 HB2 LYS 64 HB2 LYS 64 1.998 -1.389 13.678 529 HB3 LYS 64 HB1 LYS 64 2.436 -0.780 12.091 530 HG2 LYS 64 HG2 LYS 64 3.857 0.068 13.917 531 HG3 LYS 64 HG1 LYS 64 3.052 1.343 13.004 532 HD2 LYS 64 HD2 LYS 64 1.251 1.237 14.834 533 HD3 LYS 64 HD1 LYS 64 2.444 0.330 15.766 534 HE2 LYS 64 HE2 LYS 64 3.282 2.896 14.518 535 HE3 LYS 64 HE1 LYS 64 2.244 2.963 15.942 536 HZ1 LYS 64 HZ1 LYS 64 4.886 1.620 15.751 537 HZ2 LYS 64 HZ2 LYS 64 3.877 1.569 17.106 538 HZ3 LYS 64 HZ3 LYS 64 4.539 3.041 16.601 539 H MET 65 HN MET 65 0.777 0.763 10.427 540 HA MET 65 HA MET 65 1.207 3.526 11.051 541 HB2 MET 65 HB2 MET 65 1.172 1.893 8.554 542 HB3 MET 65 HB1 MET 65 1.042 3.641 8.429 543 HG2 MET 65 HG2 MET 65 3.211 2.562 10.128 544 HG3 MET 65 HG1 MET 65 3.368 2.365 8.383 545 HE1 MET 65 HE1 MET 65 5.416 3.431 9.684 546 HE2 MET 65 HE2 MET 65 5.459 5.091 10.279 547 HE3 MET 65 HE3 MET 65 5.819 4.752 8.586 548 H VAL 66 HN VAL 66 -1.304 1.759 9.231 549 HA VAL 66 HA VAL 66 -2.929 3.998 8.747 550 HB VAL 66 HB VAL 66 -4.773 2.326 8.384 551 HG11 VAL 66 HG11 VAL 66 -2.132 2.223 6.995 552 HG12 VAL 66 HG12 VAL 66 -3.669 2.888 6.439 553 HG13 VAL 66 HG13 VAL 66 -3.430 1.141 6.491 554 HG21 VAL 66 HG21 VAL 66 -3.542 -0.076 8.192 555 HG22 VAL 66 HG22 VAL 66 -4.514 0.431 9.573 556 HG23 VAL 66 HG23 VAL 66 -2.759 0.580 9.629 557 H GLU 67 HN GLU 67 -3.184 1.514 11.296 558 HA GLU 67 HA GLU 67 -5.484 2.545 12.514 559 HB2 GLU 67 HB2 GLU 67 -3.215 0.969 13.737 560 HB3 GLU 67 HB1 GLU 67 -4.769 1.250 14.507 561 HG2 GLU 67 HG2 GLU 67 -4.360 -0.198 11.905 562 HG3 GLU 67 HG1 GLU 67 -4.621 -0.962 13.472 563 H ASN 68 HN ASN 68 -2.054 3.164 13.218 564 HA ASN 68 HA ASN 68 -2.525 4.893 15.403 565 HB2 ASN 68 HB2 ASN 68 -0.186 4.413 13.586 566 HB3 ASN 68 HB1 ASN 68 -0.150 5.746 14.735 567 HD21 ASN 68 HD21 ASN 68 -1.086 2.323 14.693 568 HD22 ASN 68 HD22 ASN 68 -0.305 1.916 16.180 569 H ALA 69 HN ALA 69 -2.518 5.361 11.958 570 HA ALA 69 HA ALA 69 -2.333 8.212 12.026 571 HB1 ALA 69 HB1 ALA 69 -3.433 7.721 9.618 572 HB2 ALA 69 HB2 ALA 69 -2.749 6.136 9.978 573 HB3 ALA 69 HB3 ALA 69 -1.710 7.561 9.960 574 H LYS 70 HN LYS 70 -3.864 9.517 12.755 575 HA LYS 70 HA LYS 70 -6.462 8.748 13.424 576 HB2 LYS 70 HB2 LYS 70 -5.268 11.468 12.905 577 HB3 LYS 70 HB1 LYS 70 -6.910 11.243 13.491 578 HG2 LYS 70 HG2 LYS 70 -5.790 9.852 15.365 579 HG3 LYS 70 HG1 LYS 70 -4.319 10.694 14.872 580 HD2 LYS 70 HD2 LYS 70 -6.655 12.433 15.216 581 HD3 LYS 70 HD1 LYS 70 -6.123 11.628 16.693 582 HE2 LYS 70 HE2 LYS 70 -4.756 13.428 16.816 583 HE3 LYS 70 HE1 LYS 70 -3.748 12.433 15.766 584 HZ1 LYS 70 HZ1 LYS 70 -5.695 14.438 14.767 585 HZ2 LYS 70 HZ2 LYS 70 -4.540 13.599 13.863 586 HZ3 LYS 70 HZ3 LYS 70 -4.049 14.756 14.994 587 H LYS 71 HN LYS 71 -5.128 9.708 10.386 588 HA LYS 71 HA LYS 71 -7.795 9.478 9.185 589 HB2 LYS 71 HB2 LYS 71 -6.775 11.912 9.480 590 HB3 LYS 71 HB1 LYS 71 -5.903 11.463 8.022 591 HG2 LYS 71 HG2 LYS 71 -7.960 11.094 6.838 592 HG3 LYS 71 HG1 LYS 71 -8.897 11.369 8.308 593 HD2 LYS 71 HD2 LYS 71 -8.798 13.593 8.077 594 HD3 LYS 71 HD1 LYS 71 -7.075 13.561 7.696 595 HE2 LYS 71 HE2 LYS 71 -7.520 13.082 5.400 596 HE3 LYS 71 HE1 LYS 71 -9.232 12.821 5.728 597 HZ1 LYS 71 HZ1 LYS 71 -9.651 15.018 5.757 598 HZ2 LYS 71 HZ2 LYS 71 -8.250 15.111 4.815 599 HZ3 LYS 71 HZ3 LYS 71 -8.173 15.422 6.476 600 H ILE 72 HN ILE 72 -7.873 8.413 7.265 601 HA ILE 72 HA ILE 72 -5.309 7.520 6.123 602 HB ILE 72 HB ILE 72 -7.823 5.888 5.973 603 HG12 ILE 72 HG12 ILE 72 -7.353 6.221 8.355 604 HG13 ILE 72 HG11 ILE 72 -7.000 4.561 7.881 605 HG21 ILE 72 HG21 ILE 72 -6.502 4.198 5.172 606 HG22 ILE 72 HG22 ILE 72 -5.056 4.792 5.988 607 HG23 ILE 72 HG23 ILE 72 -5.647 5.605 4.538 608 HD11 ILE 72 HD11 ILE 72 -4.817 6.590 7.896 609 HD12 ILE 72 HD12 ILE 72 -4.731 4.842 8.109 610 HD13 ILE 72 HD13 ILE 72 -5.356 5.858 9.407 611 H GLU 73 HN GLU 73 -5.148 7.434 3.896 612 HA GLU 73 HA GLU 73 -7.458 8.452 2.375 613 HB2 GLU 73 HB2 GLU 73 -4.619 9.248 1.759 614 HB3 GLU 73 HB1 GLU 73 -6.104 9.954 1.137 615 HG2 GLU 73 HG2 GLU 73 -6.609 10.711 3.471 616 HG3 GLU 73 HG1 GLU 73 -4.987 10.186 3.918 617 H VAL 74 HN VAL 74 -7.746 7.630 0.318 618 HA VAL 74 HA VAL 74 -5.853 5.538 -0.514 619 HB VAL 74 HB VAL 74 -7.911 4.430 -1.570 620 HG11 VAL 74 HG11 VAL 74 -8.304 3.988 1.258 621 HG12 VAL 74 HG12 VAL 74 -6.592 4.074 0.843 622 HG13 VAL 74 HG13 VAL 74 -7.639 2.913 0.028 623 HG21 VAL 74 HG21 VAL 74 -10.008 5.014 -0.958 624 HG22 VAL 74 HG22 VAL 74 -9.250 6.588 -0.721 625 HG23 VAL 74 HG23 VAL 74 -9.513 5.520 0.657 626 H GLU 75 HN GLU 75 -5.320 5.435 -2.628 627 HA GLU 75 HA GLU 75 -6.664 7.310 -4.461 628 HB2 GLU 75 HB2 GLU 75 -4.472 8.205 -3.760 629 HB3 GLU 75 HB1 GLU 75 -3.696 6.737 -4.337 630 HG2 GLU 75 HG2 GLU 75 -4.280 7.235 -6.598 631 HG3 GLU 75 HG1 GLU 75 -5.280 8.596 -6.091 632 H PHE 76 HN PHE 76 -7.770 6.020 -5.812 633 HA PHE 76 HA PHE 76 -6.911 3.390 -6.507 634 HB2 PHE 76 HB2 PHE 76 -9.142 5.160 -7.496 635 HB3 PHE 76 HB1 PHE 76 -8.831 3.573 -8.186 636 HD1 PHE 76 HD2 PHE 76 -8.347 1.803 -6.044 637 HD2 PHE 76 HD1 PHE 76 -10.978 5.149 -6.150 638 HE1 PHE 76 HE2 PHE 76 -9.725 0.772 -4.285 639 HE2 PHE 76 HE1 PHE 76 -12.359 4.124 -4.391 640 HZ PHE 76 HZ PHE 76 -11.734 1.932 -3.460 641 H ASP 77 HN ASP 77 -5.899 2.674 -8.275 642 HA ASP 77 HA ASP 77 -4.201 4.336 -9.721 643 HB2 ASP 77 HB2 ASP 77 -3.707 2.409 -11.093 644 HB3 ASP 77 HB1 ASP 77 -3.918 1.876 -9.430 645 H LYS 78 HN LYS 78 -4.391 3.706 -12.380 646 HA LYS 78 HA LYS 78 -6.923 4.977 -13.189 647 HB2 LYS 78 HB2 LYS 78 -5.179 5.621 -15.207 648 HB3 LYS 78 HB1 LYS 78 -5.637 6.681 -13.884 649 HG2 LYS 78 HG2 LYS 78 -3.359 4.823 -13.461 650 HG3 LYS 78 HG1 LYS 78 -3.112 6.227 -14.495 651 HD2 LYS 78 HD2 LYS 78 -4.478 7.192 -12.257 652 HD3 LYS 78 HD1 LYS 78 -3.277 6.067 -11.620 653 HE2 LYS 78 HE2 LYS 78 -2.363 8.318 -11.752 654 HE3 LYS 78 HE1 LYS 78 -1.524 7.238 -12.866 655 HZ1 LYS 78 HZ1 LYS 78 -3.404 8.189 -14.467 656 HZ2 LYS 78 HZ2 LYS 78 -1.901 8.941 -14.275 657 HZ3 LYS 78 HZ3 LYS 78 -3.248 9.515 -13.428 658 H GLY 79 HN GLY 79 -4.833 2.310 -13.583 659 HA2 GLY 79 HA2 GLY 79 -5.646 1.645 -16.264 660 HA3 GLY 79 HA1 GLY 79 -4.702 0.639 -15.179 661 H GLN 80 HN GLN 80 -5.935 -0.416 -13.386 662 HA GLN 80 HA GLN 80 -8.516 -1.345 -14.430 663 HB2 GLN 80 HB2 GLN 80 -8.175 -3.347 -13.097 664 HB3 GLN 80 HB1 GLN 80 -6.782 -3.051 -14.124 665 HG2 GLN 80 HG2 GLN 80 -5.731 -1.929 -12.096 666 HG3 GLN 80 HG1 GLN 80 -7.026 -2.680 -11.165 667 HE21 GLN 80 HE21 GLN 80 -4.384 -3.242 -10.665 668 HE22 GLN 80 HE22 GLN 80 -4.048 -4.876 -11.113 669 H ARG 81 HN ARG 81 -6.969 -0.569 -11.327 670 HA ARG 81 HA ARG 81 -7.788 0.460 -9.463 671 HB2 ARG 81 HB2 ARG 81 -10.417 0.768 -10.910 672 HB3 ARG 81 HB1 ARG 81 -9.864 1.661 -9.502 673 HG2 ARG 81 HG2 ARG 81 -8.116 2.708 -10.839 674 HG3 ARG 81 HG1 ARG 81 -8.653 1.802 -12.255 675 HD2 ARG 81 HD2 ARG 81 -9.530 4.075 -12.291 676 HD3 ARG 81 HD1 ARG 81 -10.833 2.898 -12.136 677 HE ARG 81 HE ARG 81 -10.272 3.588 -9.570 678 HH11 ARG 81 HH11 ARG 81 -11.066 5.401 -12.443 679 HH12 ARG 81 HH12 ARG 81 -11.845 6.678 -11.573 680 HH21 ARG 81 HH21 ARG 81 -11.296 5.267 -8.423 681 HH22 ARG 81 HH22 ARG 81 -11.977 6.603 -9.290 682 H THR 82 HN THR 82 -8.948 -2.354 -10.831 683 HA THR 82 HA THR 82 -9.794 -3.341 -8.254 684 HB THR 82 HB THR 82 -11.902 -4.349 -9.405 685 HG1 THR 82 HG1 THR 82 -12.516 -3.461 -11.210 686 HG21 THR 82 HG21 THR 82 -13.295 -2.525 -8.722 687 HG22 THR 82 HG22 THR 82 -11.925 -1.414 -8.751 688 HG23 THR 82 HG23 THR 82 -11.982 -2.713 -7.559 689 H ASP 83 HN ASP 83 -9.204 -5.410 -8.008 690 HA ASP 83 HA ASP 83 -7.965 -6.746 -10.269 691 HB2 ASP 83 HB2 ASP 83 -7.529 -6.692 -7.459 692 HB3 ASP 83 HB1 ASP 83 -7.903 -8.354 -7.905 693 H LYS 84 HN LYS 84 -8.263 -9.386 -9.654 694 HA LYS 84 HA LYS 84 -10.482 -10.214 -10.995 695 HB2 LYS 84 HB2 LYS 84 -10.243 -12.283 -9.249 696 HB3 LYS 84 HB1 LYS 84 -9.244 -12.071 -10.682 697 HG2 LYS 84 HG2 LYS 84 -8.297 -10.723 -8.233 698 HG3 LYS 84 HG1 LYS 84 -8.273 -12.487 -8.212 699 HD2 LYS 84 HD2 LYS 84 -6.966 -12.505 -10.272 700 HD3 LYS 84 HD1 LYS 84 -7.009 -10.741 -10.326 701 HE2 LYS 84 HE2 LYS 84 -5.972 -10.930 -7.938 702 HE3 LYS 84 HE1 LYS 84 -5.523 -12.551 -8.469 703 HZ1 LYS 84 HZ1 LYS 84 -3.734 -11.062 -8.936 704 HZ2 LYS 84 HZ2 LYS 84 -4.754 -9.985 -9.747 705 HZ3 LYS 84 HZ3 LYS 84 -4.434 -11.507 -10.411 706 H TYR 85 HN TYR 85 -10.264 -10.477 -7.450 707 HA TYR 85 HA TYR 85 -13.035 -10.915 -7.135 708 HB2 TYR 85 HB2 TYR 85 -10.690 -10.650 -5.405 709 HB3 TYR 85 HB1 TYR 85 -12.160 -10.018 -4.673 710 HD1 TYR 85 HD1 TYR 85 -11.892 -12.885 -7.013 711 HD2 TYR 85 HD2 TYR 85 -12.575 -11.626 -3.007 712 HE1 TYR 85 HE1 TYR 85 -12.567 -15.172 -6.417 713 HE2 TYR 85 HE2 TYR 85 -13.252 -13.911 -2.399 714 HH TYR 85 HH TYR 85 -13.943 -16.296 -4.691 715 H GLY 86 HN GLY 86 -11.326 -8.109 -7.823 716 HA2 GLY 86 HA2 GLY 86 -12.289 -6.008 -8.223 717 HA3 GLY 86 HA1 GLY 86 -13.675 -6.483 -7.250 718 H ARG 87 HN ARG 87 -10.477 -7.013 -6.044 719 HA ARG 87 HA ARG 87 -10.877 -5.710 -3.633 720 HB2 ARG 87 HB2 ARG 87 -8.866 -7.225 -4.739 721 HB3 ARG 87 HB1 ARG 87 -8.089 -5.661 -4.535 722 HG2 ARG 87 HG2 ARG 87 -8.270 -5.716 -2.242 723 HG3 ARG 87 HG1 ARG 87 -9.631 -6.839 -2.271 724 HD2 ARG 87 HD2 ARG 87 -6.737 -7.451 -2.839 725 HD3 ARG 87 HD1 ARG 87 -7.700 -8.013 -1.474 726 HE ARG 87 HE ARG 87 -9.027 -8.937 -3.674 727 HH11 ARG 87 HH11 ARG 87 -5.769 -9.243 -2.460 728 HH12 ARG 87 HH12 ARG 87 -5.523 -10.807 -3.158 729 HH21 ARG 87 HH21 ARG 87 -8.705 -10.996 -4.592 730 HH22 ARG 87 HH22 ARG 87 -7.189 -11.803 -4.369 731 H GLY 88 HN GLY 88 -9.130 -3.918 -2.935 732 HA2 GLY 88 HA2 GLY 88 -9.820 -1.598 -4.582 733 HA3 GLY 88 HA1 GLY 88 -9.277 -1.550 -2.914 734 H LEU 89 HN LEU 89 -8.392 -1.235 -6.156 735 HA LEU 89 HA LEU 89 -5.564 -1.680 -5.723 736 HB2 LEU 89 HB2 LEU 89 -7.178 -0.803 -8.101 737 HB3 LEU 89 HB1 LEU 89 -5.428 -0.869 -8.122 738 HG LEU 89 HG LEU 89 -6.743 -2.854 -9.083 739 HD11 LEU 89 HD11 LEU 89 -4.642 -3.442 -7.012 740 HD12 LEU 89 HD12 LEU 89 -4.305 -2.795 -8.618 741 HD13 LEU 89 HD13 LEU 89 -5.025 -4.395 -8.445 742 HD21 LEU 89 HD21 LEU 89 -6.882 -3.654 -6.191 743 HD22 LEU 89 HD22 LEU 89 -7.526 -4.513 -7.590 744 HD23 LEU 89 HD23 LEU 89 -8.254 -2.989 -7.077 745 H ALA 90 HN ALA 90 -5.615 0.018 -3.980 746 HA ALA 90 HA ALA 90 -4.786 2.558 -5.153 747 HB1 ALA 90 HB1 ALA 90 -6.099 3.819 -3.451 748 HB2 ALA 90 HB2 ALA 90 -6.912 2.311 -3.033 749 HB3 ALA 90 HB3 ALA 90 -7.088 2.989 -4.650 750 H TYR 91 HN TYR 91 -3.937 4.034 -3.319 751 HA TYR 91 HA TYR 91 -2.195 2.382 -1.634 752 HB2 TYR 91 HB2 TYR 91 -1.846 5.324 -2.170 753 HB3 TYR 91 HB1 TYR 91 -0.644 4.174 -1.607 754 HD1 TYR 91 HD2 TYR 91 -2.800 4.911 -4.567 755 HD2 TYR 91 HD1 TYR 91 0.844 3.256 -3.124 756 HE1 TYR 91 HE2 TYR 91 -2.037 4.589 -6.880 757 HE2 TYR 91 HE1 TYR 91 1.618 2.936 -5.434 758 HH TYR 91 HH TYR 91 1.199 3.789 -7.653 759 H ILE 92 HN ILE 92 -2.340 2.450 0.544 760 HA ILE 92 HA ILE 92 -4.433 4.138 1.704 761 HB ILE 92 HB ILE 92 -2.829 1.952 3.036 762 HG12 ILE 92 HG12 ILE 92 -5.411 1.022 2.704 763 HG13 ILE 92 HG11 ILE 92 -5.098 1.858 1.186 764 HG21 ILE 92 HG21 ILE 92 -5.482 3.100 3.868 765 HG22 ILE 92 HG22 ILE 92 -3.939 3.702 4.475 766 HG23 ILE 92 HG23 ILE 92 -4.419 2.034 4.788 767 HD11 ILE 92 HD11 ILE 92 -3.105 -0.082 2.266 768 HD12 ILE 92 HD12 ILE 92 -3.392 0.423 0.601 769 HD13 ILE 92 HD13 ILE 92 -4.535 -0.652 1.405 770 H TYR 93 HN TYR 93 -3.944 6.000 2.639 771 HA TYR 93 HA TYR 93 -1.172 6.544 3.377 772 HB2 TYR 93 HB2 TYR 93 -3.531 8.430 3.229 773 HB3 TYR 93 HB1 TYR 93 -1.865 8.892 3.525 774 HD1 TYR 93 HD2 TYR 93 -2.956 6.411 0.983 775 HD2 TYR 93 HD1 TYR 93 -1.566 10.363 1.711 776 HE1 TYR 93 HE2 TYR 93 -2.656 6.736 -1.424 777 HE2 TYR 93 HE1 TYR 93 -1.244 10.695 -0.704 778 HH TYR 93 HH TYR 93 -2.549 9.291 -2.944 779 H ALA 94 HN ALA 94 -0.641 7.529 5.392 780 HA ALA 94 HA ALA 94 -2.617 7.275 7.533 781 HB1 ALA 94 HB1 ALA 94 -1.632 5.211 7.856 782 HB2 ALA 94 HB2 ALA 94 -0.669 6.238 8.918 783 HB3 ALA 94 HB3 ALA 94 -0.043 5.770 7.338 784 H ASP 95 HN ASP 95 -2.684 9.208 8.461 785 HA ASP 95 HA ASP 95 -2.036 11.114 9.524 786 HB2 ASP 95 HB2 ASP 95 -0.097 9.376 10.248 787 HB3 ASP 95 HB1 ASP 95 0.870 10.565 9.383 788 H GLY 96 HN GLY 96 -1.579 10.462 6.438 789 HA2 GLY 96 HA2 GLY 96 -1.612 12.337 4.893 790 HA3 GLY 96 HA1 GLY 96 -0.393 13.105 5.894 791 H LYS 97 HN LYS 97 0.137 9.778 5.484 792 HA LYS 97 HA LYS 97 1.874 10.244 3.173 793 HB2 LYS 97 HB2 LYS 97 2.666 9.340 5.897 794 HB3 LYS 97 HB1 LYS 97 3.472 8.597 4.522 795 HG2 LYS 97 HG2 LYS 97 4.006 10.918 3.718 796 HG3 LYS 97 HG1 LYS 97 3.421 11.503 5.278 797 HD2 LYS 97 HD2 LYS 97 5.493 9.347 5.166 798 HD3 LYS 97 HD1 LYS 97 5.961 11.034 4.944 799 HE2 LYS 97 HE2 LYS 97 5.454 11.602 7.101 800 HE3 LYS 97 HE1 LYS 97 4.216 10.354 7.253 801 HZ1 LYS 97 HZ1 LYS 97 7.092 10.183 7.700 802 HZ2 LYS 97 HZ2 LYS 97 6.350 8.827 7.014 803 HZ3 LYS 97 HZ3 LYS 97 5.822 9.412 8.510 804 H MET 98 HN MET 98 1.916 8.599 1.722 805 HA MET 98 HA MET 98 -0.027 6.562 1.900 806 HB2 MET 98 HB2 MET 98 2.271 6.253 0.025 807 HB3 MET 98 HB1 MET 98 0.557 5.950 -0.234 808 HG2 MET 98 HG2 MET 98 0.586 7.841 -1.402 809 HG3 MET 98 HG1 MET 98 0.590 8.644 0.168 810 HE1 MET 98 HE1 MET 98 1.398 10.641 -0.402 811 HE2 MET 98 HE2 MET 98 3.005 11.087 -0.973 812 HE3 MET 98 HE3 MET 98 2.784 10.526 0.684 813 H VAL 99 HN VAL 99 0.064 4.972 3.303 814 HA VAL 99 HA VAL 99 2.293 3.998 4.634 815 HB VAL 99 HB VAL 99 -0.102 2.283 4.004 816 HG11 VAL 99 HG11 VAL 99 0.429 1.761 6.540 817 HG12 VAL 99 HG12 VAL 99 2.034 2.320 6.069 818 HG13 VAL 99 HG13 VAL 99 1.293 0.958 5.229 819 HG21 VAL 99 HG21 VAL 99 -0.122 4.851 5.246 820 HG22 VAL 99 HG22 VAL 99 -0.481 3.630 6.468 821 HG23 VAL 99 HG23 VAL 99 -1.462 3.729 5.004 822 H ASN 100 HN ASN 100 1.002 3.134 1.508 823 HA ASN 100 HA ASN 100 2.233 0.667 1.097 824 HB2 ASN 100 HB2 ASN 100 1.915 2.752 -1.063 825 HB3 ASN 100 HB1 ASN 100 1.853 0.999 -1.227 826 HD21 ASN 100 HD21 ASN 100 -0.091 0.130 -1.337 827 HD22 ASN 100 HD22 ASN 100 -1.561 0.843 -0.783 828 H GLU 101 HN GLU 101 3.436 3.923 0.286 829 HA GLU 101 HA GLU 101 5.910 3.153 -0.748 830 HB2 GLU 101 HB2 GLU 101 4.692 5.496 -0.599 831 HB3 GLU 101 HB1 GLU 101 5.689 5.675 0.838 832 HG2 GLU 101 HG2 GLU 101 7.299 4.714 -1.317 833 HG3 GLU 101 HG1 GLU 101 6.400 6.137 -1.841 834 H ALA 102 HN ALA 102 4.866 3.699 2.568 835 HA ALA 102 HA ALA 102 7.357 3.715 3.833 836 HB1 ALA 102 HB1 ALA 102 4.716 2.684 4.862 837 HB2 ALA 102 HB2 ALA 102 5.330 4.332 5.003 838 HB3 ALA 102 HB3 ALA 102 6.136 3.015 5.855 839 H LEU 103 HN LEU 103 5.143 0.952 3.397 840 HA LEU 103 HA LEU 103 6.854 -1.015 4.404 841 HB2 LEU 103 HB2 LEU 103 4.566 -1.093 2.456 842 HB3 LEU 103 HB1 LEU 103 5.457 -2.546 2.866 843 HG LEU 103 HG LEU 103 4.835 -1.503 5.337 844 HD11 LEU 103 HD11 LEU 103 2.860 -0.594 3.362 845 HD12 LEU 103 HD12 LEU 103 3.228 0.024 4.972 846 HD13 LEU 103 HD13 LEU 103 2.190 -1.391 4.785 847 HD21 LEU 103 HD21 LEU 103 2.856 -3.355 4.196 848 HD22 LEU 103 HD22 LEU 103 3.866 -3.513 5.634 849 HD23 LEU 103 HD23 LEU 103 4.541 -3.853 4.039 850 H VAL 104 HN VAL 104 6.392 0.230 1.138 851 HA VAL 104 HA VAL 104 8.092 -1.545 -0.220 852 HB VAL 104 HB VAL 104 7.532 1.338 -0.929 853 HG11 VAL 104 HG11 VAL 104 9.321 -0.300 -2.107 854 HG12 VAL 104 HG12 VAL 104 8.432 0.962 -2.962 855 HG13 VAL 104 HG13 VAL 104 7.867 -0.709 -3.018 856 HG21 VAL 104 HG21 VAL 104 5.458 0.805 -1.572 857 HG22 VAL 104 HG22 VAL 104 5.651 -0.635 -0.572 858 HG23 VAL 104 HG23 VAL 104 5.980 -0.712 -2.303 859 H ARG 105 HN ARG 105 8.690 1.536 1.384 860 HA ARG 105 HA ARG 105 11.444 1.664 0.602 861 HB2 ARG 105 HB2 ARG 105 10.385 3.744 0.992 862 HB3 ARG 105 HB1 ARG 105 9.736 3.217 2.536 863 HG2 ARG 105 HG2 ARG 105 12.582 3.061 2.642 864 HG3 ARG 105 HG1 ARG 105 12.116 4.646 2.023 865 HD2 ARG 105 HD2 ARG 105 11.968 5.131 4.227 866 HD3 ARG 105 HD1 ARG 105 10.364 4.433 4.034 867 HE ARG 105 HE ARG 105 11.158 2.424 5.039 868 HH11 ARG 105 HH11 ARG 105 13.464 5.055 5.146 869 HH12 ARG 105 HH12 ARG 105 14.367 4.365 6.451 870 HH21 ARG 105 HH21 ARG 105 12.356 1.528 6.751 871 HH22 ARG 105 HH22 ARG 105 13.742 2.369 7.360 872 H GLN 106 HN GLN 106 9.668 0.672 3.496 873 HA GLN 106 HA GLN 106 11.817 0.339 5.238 874 HB2 GLN 106 HB2 GLN 106 9.048 -0.625 5.067 875 HB3 GLN 106 HB1 GLN 106 10.121 -1.684 5.972 876 HG2 GLN 106 HG2 GLN 106 9.983 1.257 6.526 877 HG3 GLN 106 HG1 GLN 106 8.850 0.119 7.252 878 HE21 GLN 106 HE21 GLN 106 10.219 -1.968 7.992 879 HE22 GLN 106 HE22 GLN 106 11.510 -1.570 9.069 880 H GLY 107 HN GLY 107 10.321 -2.079 3.091 881 HA2 GLY 107 HA2 GLY 107 12.111 -3.411 1.867 882 HA3 GLY 107 HA1 GLY 107 12.702 -3.785 3.476 883 H LEU 108 HN LEU 108 10.102 -4.073 4.679 884 HA LEU 108 HA LEU 108 9.637 -6.768 4.390 885 HB2 LEU 108 HB2 LEU 108 7.151 -5.972 5.065 886 HB3 LEU 108 HB1 LEU 108 8.475 -6.109 6.201 887 HG LEU 108 HG LEU 108 8.256 -3.487 4.872 888 HD11 LEU 108 HD11 LEU 108 6.324 -3.904 7.076 889 HD12 LEU 108 HD12 LEU 108 5.863 -4.477 5.473 890 HD13 LEU 108 HD13 LEU 108 6.276 -2.780 5.718 891 HD21 LEU 108 HD21 LEU 108 8.836 -4.575 7.598 892 HD22 LEU 108 HD22 LEU 108 8.451 -2.868 7.381 893 HD23 LEU 108 HD23 LEU 108 9.843 -3.569 6.557 894 H ALA 109 HN ALA 109 8.574 -4.162 2.371 895 HA ALA 109 HA ALA 109 7.307 -6.111 0.576 896 HB1 ALA 109 HB1 ALA 109 5.562 -4.844 1.784 897 HB2 ALA 109 HB2 ALA 109 5.541 -4.552 0.046 898 HB3 ALA 109 HB3 ALA 109 6.231 -3.348 1.132 899 H LYS 110 HN LYS 110 7.435 -5.587 -1.658 900 HA LYS 110 HA LYS 110 9.250 -3.375 -2.333 901 HB2 LYS 110 HB2 LYS 110 9.438 -6.010 -3.764 902 HB3 LYS 110 HB1 LYS 110 10.611 -4.700 -3.705 903 HG2 LYS 110 HG2 LYS 110 11.683 -5.872 -2.162 904 HG3 LYS 110 HG1 LYS 110 10.357 -5.491 -1.064 905 HD2 LYS 110 HD2 LYS 110 9.523 -7.582 -1.149 906 HD3 LYS 110 HD1 LYS 110 9.842 -7.742 -2.878 907 HE2 LYS 110 HE2 LYS 110 11.422 -9.196 -2.218 908 HE3 LYS 110 HE1 LYS 110 12.364 -7.744 -1.886 909 HZ1 LYS 110 HZ1 LYS 110 10.583 -8.824 0.191 910 HZ2 LYS 110 HZ2 LYS 110 11.999 -7.913 0.362 911 HZ3 LYS 110 HZ3 LYS 110 12.092 -9.546 -0.068 912 H VAL 111 HN VAL 111 9.211 -2.881 -4.712 913 HA VAL 111 HA VAL 111 6.492 -2.585 -5.537 914 HB VAL 111 HB VAL 111 9.115 -1.807 -6.796 915 HG11 VAL 111 HG11 VAL 111 6.347 -1.435 -7.929 916 HG12 VAL 111 HG12 VAL 111 7.690 -2.317 -8.655 917 HG13 VAL 111 HG13 VAL 111 7.777 -0.565 -8.485 918 HG21 VAL 111 HG21 VAL 111 8.357 -0.502 -4.878 919 HG22 VAL 111 HG22 VAL 111 6.822 -0.192 -5.688 920 HG23 VAL 111 HG23 VAL 111 8.320 0.457 -6.357 921 H ALA 112 HN ALA 112 5.389 -4.224 -6.375 922 HA ALA 112 HA ALA 112 6.540 -5.692 -8.623 923 HB1 ALA 112 HB1 ALA 112 5.100 -7.255 -6.517 924 HB2 ALA 112 HB2 ALA 112 6.827 -6.934 -6.366 925 HB3 ALA 112 HB3 ALA 112 6.213 -7.818 -7.763 926 H TYR 113 HN TYR 113 5.029 -6.442 -10.105 927 HA TYR 113 HA TYR 113 3.080 -6.467 -11.275 928 HB2 TYR 113 HB2 TYR 113 1.630 -6.315 -8.636 929 HB3 TYR 113 HB1 TYR 113 1.079 -7.052 -10.137 930 HD1 TYR 113 HD1 TYR 113 2.013 -9.218 -10.868 931 HD2 TYR 113 HD2 TYR 113 3.052 -7.500 -7.117 932 HE1 TYR 113 HE1 TYR 113 2.881 -11.393 -10.119 933 HE2 TYR 113 HE2 TYR 113 3.923 -9.670 -6.357 934 HH TYR 113 HH TYR 113 4.802 -11.756 -7.365 935 H VAL 114 HN VAL 114 3.514 -4.380 -12.121 936 HA VAL 114 HA VAL 114 1.431 -2.496 -11.640 937 HB VAL 114 HB VAL 114 2.892 -1.912 -9.746 938 HG11 VAL 114 HG11 VAL 114 5.111 -1.561 -9.886 939 HG12 VAL 114 HG12 VAL 114 4.994 -0.766 -11.456 940 HG13 VAL 114 HG13 VAL 114 4.973 -2.527 -11.355 941 HG21 VAL 114 HG21 VAL 114 2.235 -0.069 -11.943 942 HG22 VAL 114 HG22 VAL 114 3.410 0.537 -10.777 943 HG23 VAL 114 HG23 VAL 114 1.820 0.008 -10.231 944 H TYR 115 HN TYR 115 1.103 -1.242 -13.407 945 HA TYR 115 HA TYR 115 3.078 -0.357 -15.189 946 HB2 TYR 115 HB2 TYR 115 2.705 -1.803 -17.111 947 HB3 TYR 115 HB1 TYR 115 3.255 -2.761 -15.741 948 HD1 TYR 115 HD1 TYR 115 1.569 -4.112 -14.449 949 HD2 TYR 115 HD2 TYR 115 0.634 -2.245 -18.155 950 HE1 TYR 115 HE1 TYR 115 -0.383 -5.588 -14.691 951 HE2 TYR 115 HE2 TYR 115 -1.322 -3.714 -18.408 952 HH TYR 115 HH TYR 115 -2.792 -5.221 -16.179 953 H LYS 116 HN LYS 116 2.115 0.498 -17.247 954 HA LYS 116 HA LYS 116 -0.086 2.130 -16.702 955 HB2 LYS 116 HB2 LYS 116 -0.083 2.475 -19.236 956 HB3 LYS 116 HB1 LYS 116 1.397 2.872 -18.371 957 HG2 LYS 116 HG2 LYS 116 1.268 0.109 -19.303 958 HG3 LYS 116 HG1 LYS 116 1.245 1.313 -20.598 959 HD2 LYS 116 HD2 LYS 116 3.205 2.022 -18.613 960 HD3 LYS 116 HD1 LYS 116 3.473 0.369 -19.165 961 HE2 LYS 116 HE2 LYS 116 4.500 1.225 -20.945 962 HE3 LYS 116 HE1 LYS 116 2.930 1.818 -21.482 963 HZ1 LYS 116 HZ1 LYS 116 5.176 3.274 -20.462 964 HZ2 LYS 116 HZ2 LYS 116 3.742 3.672 -19.661 965 HZ3 LYS 116 HZ3 LYS 116 3.841 3.828 -21.342 966 HA PRO 117 HA PRO 117 -1.719 3.202 -17.851 967 HB2 PRO 117 HB2 PRO 117 -4.478 3.092 -16.972 968 HB3 PRO 117 HB1 PRO 117 -3.823 3.747 -18.473 969 HG2 PRO 117 HG2 PRO 117 -5.376 1.506 -18.359 970 HG3 PRO 117 HG1 PRO 117 -4.171 1.802 -19.624 971 HD2 PRO 117 HD2 PRO 117 -3.966 0.090 -17.174 972 HD3 PRO 117 HD1 PRO 117 -3.392 -0.230 -18.826 973 H ASN 118 HN ASN 118 -1.438 0.987 -15.614 974 HA ASN 118 HA ASN 118 -2.300 2.561 -13.315 975 HB2 ASN 118 HB2 ASN 118 -0.900 -0.073 -13.059 976 HB3 ASN 118 HB1 ASN 118 -2.147 0.633 -12.038 977 HD21 ASN 118 HD21 ASN 118 -1.571 -0.815 -15.215 978 HD22 ASN 118 HD22 ASN 118 -3.166 -1.458 -15.399 979 H ASN 119 HN ASN 119 -0.909 4.080 -12.692 980 HA ASN 119 HA ASN 119 1.670 3.457 -11.759 981 HB2 ASN 119 HB2 ASN 119 2.845 5.043 -13.478 982 HB3 ASN 119 HB1 ASN 119 2.578 3.351 -13.889 983 HD21 ASN 119 HD21 ASN 119 2.011 3.145 -15.922 984 HD22 ASN 119 HD22 ASN 119 0.949 4.188 -16.797 985 H THR 120 HN THR 120 -0.692 4.865 -10.920 986 HA THR 120 HA THR 120 -0.606 7.613 -11.011 987 HB THR 120 HB THR 120 -1.182 6.516 -8.336 988 HG1 THR 120 HG1 THR 120 -1.896 4.732 -9.320 989 HG21 THR 120 HG21 THR 120 -3.352 7.625 -9.952 990 HG22 THR 120 HG22 THR 120 -1.991 8.717 -9.694 991 HG23 THR 120 HG23 THR 120 -2.834 8.016 -8.313 992 H HIS 121 HN HIS 121 1.087 5.491 -8.713 993 HA HIS 121 HA HIS 121 2.898 7.739 -8.120 994 HB2 HIS 121 HB2 HIS 121 1.490 5.859 -6.307 995 HB3 HIS 121 HB1 HIS 121 3.159 6.246 -5.896 996 HD1 HIS 121 HD1 HIS 121 -0.147 7.370 -5.259 997 HD2 HIS 121 HD2 HIS 121 3.496 9.263 -5.904 998 HE1 HIS 121 HE1 HIS 121 -0.420 9.690 -4.324 999 HE2 HIS 121 HE2 HIS 121 1.821 10.792 -4.662 1000 H GLU 122 HN GLU 122 3.101 5.576 -10.128 1001 HA GLU 122 HA GLU 122 4.883 3.572 -9.333 1002 HB2 GLU 122 HB2 GLU 122 3.642 3.619 -11.491 1003 HB3 GLU 122 HB1 GLU 122 4.721 4.892 -12.048 1004 HG2 GLU 122 HG2 GLU 122 6.555 3.093 -11.384 1005 HG3 GLU 122 HG1 GLU 122 5.214 1.994 -11.703 1006 H GLN 123 HN GLN 123 5.459 6.861 -10.479 1007 HA GLN 123 HA GLN 123 8.289 6.628 -10.611 1008 HB2 GLN 123 HB2 GLN 123 6.642 9.137 -10.266 1009 HB3 GLN 123 HB1 GLN 123 8.298 9.042 -10.849 1010 HG2 GLN 123 HG2 GLN 123 6.040 7.675 -12.269 1011 HG3 GLN 123 HG1 GLN 123 6.450 9.363 -12.568 1012 HE21 GLN 123 HE21 GLN 123 7.611 6.065 -12.743 1013 HE22 GLN 123 HE22 GLN 123 8.843 6.357 -13.920 1014 H LEU 124 HN LEU 124 6.043 7.280 -8.049 1015 HA LEU 124 HA LEU 124 7.984 8.421 -6.263 1016 HB2 LEU 124 HB2 LEU 124 5.636 9.017 -6.061 1017 HB3 LEU 124 HB1 LEU 124 5.210 7.340 -5.773 1018 HG LEU 124 HG LEU 124 6.997 7.763 -3.766 1019 HD11 LEU 124 HD11 LEU 124 7.114 10.174 -4.455 1020 HD12 LEU 124 HD12 LEU 124 6.657 9.892 -2.775 1021 HD13 LEU 124 HD13 LEU 124 5.426 10.321 -3.963 1022 HD21 LEU 124 HD21 LEU 124 4.932 8.140 -2.346 1023 HD22 LEU 124 HD22 LEU 124 4.932 6.699 -3.363 1024 HD23 LEU 124 HD23 LEU 124 4.014 8.124 -3.852 1025 H LEU 125 HN LEU 125 6.499 5.253 -6.736 1026 HA LEU 125 HA LEU 125 7.847 4.086 -4.477 1027 HB2 LEU 125 HB2 LEU 125 5.993 3.143 -6.595 1028 HB3 LEU 125 HB1 LEU 125 7.014 1.941 -5.831 1029 HG LEU 125 HG LEU 125 5.938 3.408 -3.709 1030 HD11 LEU 125 HD11 LEU 125 3.864 4.056 -4.174 1031 HD12 LEU 125 HD12 LEU 125 3.496 2.543 -5.001 1032 HD13 LEU 125 HD13 LEU 125 4.277 3.860 -5.877 1033 HD21 LEU 125 HD21 LEU 125 4.651 1.299 -3.322 1034 HD22 LEU 125 HD22 LEU 125 6.380 1.070 -3.587 1035 HD23 LEU 125 HD23 LEU 125 5.235 0.726 -4.884 1036 H ARG 126 HN ARG 126 8.465 4.472 -7.876 1037 HA ARG 126 HA ARG 126 10.326 2.438 -8.301 1038 HB2 ARG 126 HB2 ARG 126 9.326 4.013 -10.020 1039 HB3 ARG 126 HB1 ARG 126 10.508 5.203 -9.493 1040 HG2 ARG 126 HG2 ARG 126 12.158 3.160 -9.966 1041 HG3 ARG 126 HG1 ARG 126 10.868 2.752 -11.099 1042 HD2 ARG 126 HD2 ARG 126 11.079 5.320 -11.692 1043 HD3 ARG 126 HD1 ARG 126 12.710 5.085 -11.066 1044 HE ARG 126 HE ARG 126 12.397 3.033 -12.813 1045 HH11 ARG 126 HH11 ARG 126 11.999 6.491 -13.063 1046 HH12 ARG 126 HH12 ARG 126 12.423 6.543 -14.743 1047 HH21 ARG 126 HH21 ARG 126 12.954 3.101 -15.021 1048 HH22 ARG 126 HH22 ARG 126 12.963 4.619 -15.853 1049 H LYS 127 HN LYS 127 10.604 5.467 -6.615 1050 HA LYS 127 HA LYS 127 13.482 5.427 -6.499 1051 HB2 LYS 127 HB2 LYS 127 11.724 7.055 -4.686 1052 HB3 LYS 127 HB1 LYS 127 13.332 7.431 -5.287 1053 HG2 LYS 127 HG2 LYS 127 10.834 7.361 -6.965 1054 HG3 LYS 127 HG1 LYS 127 11.585 8.817 -6.310 1055 HD2 LYS 127 HD2 LYS 127 13.689 7.609 -7.569 1056 HD3 LYS 127 HD1 LYS 127 12.337 7.184 -8.623 1057 HE2 LYS 127 HE2 LYS 127 13.505 9.318 -9.218 1058 HE3 LYS 127 HE1 LYS 127 11.770 9.474 -8.947 1059 HZ1 LYS 127 HZ1 LYS 127 13.466 9.903 -6.627 1060 HZ2 LYS 127 HZ2 LYS 127 12.078 10.731 -7.121 1061 HZ3 LYS 127 HZ3 LYS 127 13.570 11.077 -7.841 1062 H SER 128 HN SER 128 10.855 4.975 -4.137 1063 HA SER 128 HA SER 128 12.454 4.302 -1.952 1064 HB2 SER 128 HB2 SER 128 10.249 4.789 -1.398 1065 HB3 SER 128 HB1 SER 128 9.595 3.783 -2.690 1066 HG SER 128 HG SER 128 9.915 2.003 -1.489 1067 H GLU 129 HN GLU 129 11.104 2.287 -4.519 1068 HA GLU 129 HA GLU 129 11.749 -0.211 -3.406 1069 HB2 GLU 129 HB2 GLU 129 10.208 -0.015 -5.276 1070 HB3 GLU 129 HB1 GLU 129 11.489 0.618 -6.302 1071 HG2 GLU 129 HG2 GLU 129 12.479 -1.804 -5.385 1072 HG3 GLU 129 HG1 GLU 129 10.772 -2.116 -5.699 1073 H ALA 130 HN ALA 130 13.499 1.675 -5.873 1074 HA ALA 130 HA ALA 130 15.762 -0.046 -5.839 1075 HB1 ALA 130 HB1 ALA 130 14.816 1.818 -7.577 1076 HB2 ALA 130 HB2 ALA 130 16.420 1.091 -7.649 1077 HB3 ALA 130 HB3 ALA 130 16.196 2.656 -6.867 1078 H GLN 131 HN GLN 131 14.921 2.919 -4.172 1079 HA GLN 131 HA GLN 131 17.476 3.686 -3.326 1080 HB2 GLN 131 HB2 GLN 131 14.709 4.177 -2.302 1081 HB3 GLN 131 HB1 GLN 131 16.083 4.669 -1.327 1082 HG2 GLN 131 HG2 GLN 131 16.509 5.547 -3.987 1083 HG3 GLN 131 HG1 GLN 131 14.888 6.026 -3.491 1084 HE21 GLN 131 HE21 GLN 131 14.990 6.739 -1.007 1085 HE22 GLN 131 HE22 GLN 131 16.158 7.976 -0.706 1086 H ALA 132 HN ALA 132 15.020 1.776 -1.597 1087 HA ALA 132 HA ALA 132 16.775 1.169 0.572 1088 HB1 ALA 132 HB1 ALA 132 14.069 0.146 -0.233 1089 HB2 ALA 132 HB2 ALA 132 14.489 1.219 1.101 1090 HB3 ALA 132 HB3 ALA 132 14.939 -0.485 1.166 1091 H LYS 133 HN LYS 133 16.152 -0.275 -2.513 1092 HA LYS 133 HA LYS 133 16.923 -2.925 -1.969 1093 HB2 LYS 133 HB2 LYS 133 16.171 -1.412 -4.234 1094 HB3 LYS 133 HB1 LYS 133 17.724 -2.139 -4.618 1095 HG2 LYS 133 HG2 LYS 133 16.844 -4.174 -4.828 1096 HG3 LYS 133 HG1 LYS 133 15.871 -4.003 -3.366 1097 HD2 LYS 133 HD2 LYS 133 14.242 -2.661 -4.624 1098 HD3 LYS 133 HD1 LYS 133 15.210 -2.872 -6.083 1099 HE2 LYS 133 HE2 LYS 133 14.204 -4.803 -6.494 1100 HE3 LYS 133 HE1 LYS 133 14.738 -5.434 -4.938 1101 HZ1 LYS 133 HZ1 LYS 133 12.154 -4.947 -5.694 1102 HZ2 LYS 133 HZ2 LYS 133 12.521 -3.657 -4.663 1103 HZ3 LYS 133 HZ3 LYS 133 12.695 -5.249 -4.120 1104 H LYS 134 HN LYS 134 18.822 -0.235 -3.321 1105 HA LYS 134 HA LYS 134 21.251 -1.574 -3.526 1106 HB2 LYS 134 HB2 LYS 134 22.203 0.494 -3.989 1107 HB3 LYS 134 HB1 LYS 134 20.518 0.728 -4.418 1108 HG2 LYS 134 HG2 LYS 134 20.454 2.504 -3.117 1109 HG3 LYS 134 HG1 LYS 134 20.750 1.476 -1.718 1110 HD2 LYS 134 HD2 LYS 134 23.057 2.307 -3.411 1111 HD3 LYS 134 HD1 LYS 134 22.354 3.479 -2.295 1112 HE2 LYS 134 HE2 LYS 134 22.723 1.968 -0.435 1113 HE3 LYS 134 HE1 LYS 134 23.338 0.732 -1.532 1114 HZ1 LYS 134 HZ1 LYS 134 25.284 1.645 -0.851 1115 HZ2 LYS 134 HZ2 LYS 134 24.621 3.178 -0.579 1116 HZ3 LYS 134 HZ3 LYS 134 24.975 2.679 -2.156 1117 H GLU 135 HN GLU 135 19.767 -0.010 -0.787 1118 HA GLU 135 HA GLU 135 22.163 -0.440 0.837 1119 HB2 GLU 135 HB2 GLU 135 20.315 0.632 2.559 1120 HB3 GLU 135 HB1 GLU 135 21.511 1.546 1.650 1121 HG2 GLU 135 HG2 GLU 135 19.931 2.120 -0.021 1122 HG3 GLU 135 HG1 GLU 135 18.751 0.973 0.612 1123 H LYS 136 HN LYS 136 19.315 -2.082 0.085 1124 HA LYS 136 HA LYS 136 18.127 -3.759 1.090 1125 HB2 LYS 136 HB2 LYS 136 20.908 -4.404 2.091 1126 HB3 LYS 136 HB1 LYS 136 19.551 -5.525 2.086 1127 HG2 LYS 136 HG2 LYS 136 19.439 -5.192 -0.409 1128 HG3 LYS 136 HG1 LYS 136 20.981 -4.343 -0.276 1129 HD2 LYS 136 HD2 LYS 136 21.835 -6.405 -0.630 1130 HD3 LYS 136 HD1 LYS 136 21.549 -6.593 1.102 1131 HE2 LYS 136 HE2 LYS 136 19.742 -7.953 0.796 1132 HE3 LYS 136 HE1 LYS 136 19.308 -7.212 -0.744 1133 HZ1 LYS 136 HZ1 LYS 136 21.823 -8.667 -0.694 1134 HZ2 LYS 136 HZ2 LYS 136 20.627 -8.612 -1.889 1135 HZ3 LYS 136 HZ3 LYS 136 20.427 -9.610 -0.538 1136 H LEU 137 HN LEU 137 17.250 -1.910 2.421 1137 HA LEU 137 HA LEU 137 17.983 -1.136 4.888 1138 HB2 LEU 137 HB2 LEU 137 15.383 -1.426 3.531 1139 HB3 LEU 137 HB1 LEU 137 15.306 -1.273 5.279 1140 HG LEU 137 HG LEU 137 16.516 0.678 3.327 1141 HD11 LEU 137 HD11 LEU 137 13.918 0.382 4.431 1142 HD12 LEU 137 HD12 LEU 137 14.528 1.654 3.375 1143 HD13 LEU 137 HD13 LEU 137 14.648 1.829 5.125 1144 HD21 LEU 137 HD21 LEU 137 16.904 0.349 6.237 1145 HD22 LEU 137 HD22 LEU 137 16.597 1.988 5.665 1146 HD23 LEU 137 HD23 LEU 137 17.959 1.071 5.022 1147 H ASN 138 HN ASN 138 15.205 -3.340 5.044 1148 HA ASN 138 HA ASN 138 16.566 -4.623 7.302 1149 HB2 ASN 138 HB2 ASN 138 14.107 -5.422 7.773 1150 HB3 ASN 138 HB1 ASN 138 14.637 -3.807 8.222 1151 HD21 ASN 138 HD21 ASN 138 13.043 -2.439 7.905 1152 HD22 ASN 138 HD22 ASN 138 11.996 -2.388 6.530 1153 H ILE 139 HN ILE 139 13.815 -5.974 5.518 1154 HA ILE 139 HA ILE 139 15.227 -8.502 5.409 1155 HB ILE 139 HB ILE 139 13.108 -9.479 4.736 1156 HG12 ILE 139 HG12 ILE 139 11.407 -7.173 5.113 1157 HG13 ILE 139 HG11 ILE 139 12.540 -6.888 3.795 1158 HG21 ILE 139 HG21 ILE 139 11.758 -8.327 6.773 1159 HG22 ILE 139 HG22 ILE 139 13.403 -7.807 7.136 1160 HG23 ILE 139 HG23 ILE 139 13.035 -9.525 6.984 1161 HD11 ILE 139 HD11 ILE 139 11.808 -9.019 2.772 1162 HD12 ILE 139 HD12 ILE 139 10.522 -7.819 2.911 1163 HD13 ILE 139 HD13 ILE 139 10.595 -9.167 4.045 1164 H TRP 140 HN TRP 140 16.296 -6.570 3.602 1165 HA TRP 140 HA TRP 140 15.311 -7.308 0.970 1166 HB2 TRP 140 HB2 TRP 140 17.638 -5.560 1.788 1167 HB3 TRP 140 HB1 TRP 140 17.080 -5.793 0.133 1168 HD1 TRP 140 HD1 TRP 140 15.870 -4.323 3.477 1169 HE1 TRP 140 HE1 TRP 140 14.135 -2.495 2.969 1170 HE3 TRP 140 HE3 TRP 140 15.528 -4.905 -1.588 1171 HZ2 TRP 140 HZ2 TRP 140 12.822 -1.430 0.743 1172 HZ3 TRP 140 HZ3 TRP 140 13.995 -3.437 -2.838 1173 HH2 TRP 140 HH2 TRP 140 12.666 -1.734 -1.696 Start of MODEL 16 1 H1 ALA 1 HT1 ALA 1 -3.330 28.456 -3.904 2 H2 ALA 1 HT2 ALA 1 -1.745 28.907 -4.383 3 H3 ALA 1 HT3 ALA 1 -2.711 27.931 -5.412 4 HA ALA 1 HA ALA 1 -4.334 29.860 -5.327 5 HB1 ALA 1 HB1 ALA 1 -3.026 32.033 -5.178 6 HB2 ALA 1 HB2 ALA 1 -1.768 31.097 -4.373 7 HB3 ALA 1 HB3 ALA 1 -3.376 31.211 -3.657 8 H THR 2 HN THR 2 -4.321 28.846 -7.387 9 HA THR 2 HA THR 2 -3.874 28.653 -9.610 10 HB THR 2 HB THR 2 -3.412 30.683 -10.789 11 HG1 THR 2 HG1 THR 2 -2.634 32.524 -9.660 12 HG21 THR 2 HG21 THR 2 -4.701 31.966 -8.476 13 HG22 THR 2 HG22 THR 2 -5.496 30.530 -9.119 14 HG23 THR 2 HG23 THR 2 -5.187 31.911 -10.170 15 H SER 3 HN SER 3 -2.265 27.012 -9.099 16 HA SER 3 HA SER 3 0.350 27.779 -10.136 17 HB2 SER 3 HB2 SER 3 -0.042 26.370 -7.487 18 HB3 SER 3 HB1 SER 3 1.504 26.486 -8.329 19 HG SER 3 HG SER 3 -0.074 28.675 -7.441 20 H THR 4 HN THR 4 -1.636 25.102 -8.896 21 HA THR 4 HA THR 4 -1.112 23.590 -11.311 22 HB THR 4 HB THR 4 -0.536 22.207 -8.708 23 HG1 THR 4 HG1 THR 4 1.484 22.885 -8.713 24 HG21 THR 4 HG21 THR 4 -0.761 21.215 -11.215 25 HG22 THR 4 HG22 THR 4 0.205 20.491 -9.929 26 HG23 THR 4 HG23 THR 4 0.970 21.539 -11.125 27 H LYS 5 HN LYS 5 -3.347 23.826 -11.631 28 HA LYS 5 HA LYS 5 -5.339 23.186 -9.774 29 HB2 LYS 5 HB2 LYS 5 -6.767 22.818 -11.857 30 HB3 LYS 5 HB1 LYS 5 -6.017 24.397 -11.678 31 HG2 LYS 5 HG2 LYS 5 -4.391 23.922 -13.317 32 HG3 LYS 5 HG1 LYS 5 -4.790 22.203 -13.319 33 HD2 LYS 5 HD2 LYS 5 -7.096 23.866 -13.914 34 HD3 LYS 5 HD1 LYS 5 -5.774 24.130 -15.052 35 HE2 LYS 5 HE2 LYS 5 -7.175 22.381 -15.907 36 HE3 LYS 5 HE1 LYS 5 -5.648 21.671 -15.387 37 HZ1 LYS 5 HZ1 LYS 5 -8.321 21.386 -14.229 38 HZ2 LYS 5 HZ2 LYS 5 -6.997 21.337 -13.178 39 HZ3 LYS 5 HZ3 LYS 5 -7.109 20.225 -14.447 40 H LYS 6 HN LYS 6 -4.926 21.280 -8.692 41 HA LYS 6 HA LYS 6 -4.525 18.822 -10.169 42 HB2 LYS 6 HB2 LYS 6 -3.539 19.549 -7.836 43 HB3 LYS 6 HB1 LYS 6 -5.049 18.888 -7.226 44 HG2 LYS 6 HG2 LYS 6 -3.424 17.171 -7.094 45 HG3 LYS 6 HG1 LYS 6 -4.502 16.762 -8.431 46 HD2 LYS 6 HD2 LYS 6 -2.303 16.347 -9.204 47 HD3 LYS 6 HD1 LYS 6 -2.812 17.857 -9.961 48 HE2 LYS 6 HE2 LYS 6 -0.594 18.199 -9.215 49 HE3 LYS 6 HE1 LYS 6 -1.637 19.058 -8.083 50 HZ1 LYS 6 HZ1 LYS 6 -0.057 16.623 -7.672 51 HZ2 LYS 6 HZ2 LYS 6 -1.486 16.812 -6.790 52 HZ3 LYS 6 HZ3 LYS 6 -0.254 17.962 -6.657 53 H LEU 7 HN LEU 7 -5.896 16.936 -9.851 54 HA LEU 7 HA LEU 7 -8.600 17.481 -10.356 55 HB2 LEU 7 HB2 LEU 7 -7.158 14.947 -9.609 56 HB3 LEU 7 HB1 LEU 7 -8.879 14.980 -9.945 57 HG LEU 7 HG LEU 7 -6.958 16.068 -11.965 58 HD11 LEU 7 HD11 LEU 7 -7.212 13.658 -12.954 59 HD12 LEU 7 HD12 LEU 7 -7.411 13.209 -11.260 60 HD13 LEU 7 HD13 LEU 7 -5.938 14.022 -11.790 61 HD21 LEU 7 HD21 LEU 7 -8.741 15.196 -13.490 62 HD22 LEU 7 HD22 LEU 7 -9.263 16.485 -12.405 63 HD23 LEU 7 HD23 LEU 7 -9.693 14.810 -12.056 64 H HIS 8 HN HIS 8 -7.901 15.187 -7.773 65 HA HIS 8 HA HIS 8 -8.549 16.644 -5.531 66 HB2 HIS 8 HB2 HIS 8 -10.970 15.927 -5.219 67 HB3 HIS 8 HB1 HIS 8 -10.688 17.214 -6.385 68 HD1 HIS 8 HD1 HIS 8 -11.567 16.851 -8.696 69 HD2 HIS 8 HD2 HIS 8 -11.450 13.339 -6.477 70 HE1 HIS 8 HE1 HIS 8 -12.723 15.124 -10.111 71 HE2 HIS 8 HE2 HIS 8 -12.709 13.027 -8.714 72 H LYS 9 HN LYS 9 -8.586 15.373 -3.685 73 HA LYS 9 HA LYS 9 -8.225 12.492 -4.163 74 HB2 LYS 9 HB2 LYS 9 -7.083 14.294 -2.030 75 HB3 LYS 9 HB1 LYS 9 -6.984 12.541 -1.959 76 HG2 LYS 9 HG2 LYS 9 -4.939 13.177 -2.848 77 HG3 LYS 9 HG1 LYS 9 -5.879 12.701 -4.263 78 HD2 LYS 9 HD2 LYS 9 -5.531 14.707 -5.156 79 HD3 LYS 9 HD1 LYS 9 -6.379 15.450 -3.799 80 HE2 LYS 9 HE2 LYS 9 -4.214 16.445 -3.941 81 HE3 LYS 9 HE1 LYS 9 -4.233 15.394 -2.526 82 HZ1 LYS 9 HZ1 LYS 9 -3.325 14.175 -5.002 83 HZ2 LYS 9 HZ2 LYS 9 -2.727 14.007 -3.429 84 HZ3 LYS 9 HZ3 LYS 9 -2.306 15.360 -4.352 85 H GLU 10 HN GLU 10 -8.894 11.069 -2.365 86 HA GLU 10 HA GLU 10 -11.110 12.154 -0.779 87 HB2 GLU 10 HB2 GLU 10 -11.629 10.770 -3.039 88 HB3 GLU 10 HB1 GLU 10 -11.516 9.441 -1.892 89 HG2 GLU 10 HG2 GLU 10 -13.540 9.864 -1.113 90 HG3 GLU 10 HG1 GLU 10 -13.114 11.543 -0.783 91 HA PRO 11 HA PRO 11 -8.999 9.724 2.305 92 HB2 PRO 11 HB2 PRO 11 -10.587 10.270 4.395 93 HB3 PRO 11 HB1 PRO 11 -9.531 11.501 3.692 94 HG2 PRO 11 HG2 PRO 11 -12.467 11.080 3.309 95 HG3 PRO 11 HG1 PRO 11 -11.573 12.594 3.529 96 HD2 PRO 11 HD2 PRO 11 -12.403 11.632 1.092 97 HD3 PRO 11 HD1 PRO 11 -11.029 12.731 1.312 98 H ALA 12 HN ALA 12 -9.864 8.217 4.213 99 HA ALA 12 HA ALA 12 -12.232 6.735 3.659 100 HB1 ALA 12 HB1 ALA 12 -9.576 5.507 2.951 101 HB2 ALA 12 HB2 ALA 12 -10.957 5.774 1.887 102 HB3 ALA 12 HB3 ALA 12 -11.058 4.579 3.179 103 H THR 13 HN THR 13 -12.667 5.107 5.235 104 HA THR 13 HA THR 13 -10.974 5.333 7.638 105 HB THR 13 HB THR 13 -13.901 4.638 7.696 106 HG1 THR 13 HG1 THR 13 -13.823 6.632 6.705 107 HG21 THR 13 HG21 THR 13 -13.788 4.843 9.910 108 HG22 THR 13 HG22 THR 13 -12.749 6.265 9.823 109 HG23 THR 13 HG23 THR 13 -12.049 4.652 9.689 110 H LEU 14 HN LEU 14 -10.122 3.505 8.426 111 HA LEU 14 HA LEU 14 -10.361 1.064 7.034 112 HB2 LEU 14 HB2 LEU 14 -8.692 2.120 9.024 113 HB3 LEU 14 HB1 LEU 14 -9.428 0.699 9.747 114 HG LEU 14 HG LEU 14 -7.224 0.294 8.628 115 HD11 LEU 14 HD11 LEU 14 -8.269 -1.651 7.170 116 HD12 LEU 14 HD12 LEU 14 -9.734 -1.169 8.027 117 HD13 LEU 14 HD13 LEU 14 -8.311 -1.681 8.934 118 HD21 LEU 14 HD21 LEU 14 -8.109 1.848 6.637 119 HD22 LEU 14 HD22 LEU 14 -8.544 0.268 5.986 120 HD23 LEU 14 HD23 LEU 14 -6.870 0.613 6.417 121 H ILE 15 HN ILE 15 -12.190 -0.076 6.984 122 HA ILE 15 HA ILE 15 -14.097 -0.080 9.109 123 HB ILE 15 HB ILE 15 -13.885 -2.000 6.783 124 HG12 ILE 15 HG12 ILE 15 -14.005 0.379 6.077 125 HG13 ILE 15 HG11 ILE 15 -15.431 -0.542 5.608 126 HG21 ILE 15 HG21 ILE 15 -16.199 -1.298 8.583 127 HG22 ILE 15 HG22 ILE 15 -15.325 -2.829 8.544 128 HG23 ILE 15 HG23 ILE 15 -16.294 -2.332 7.158 129 HD11 ILE 15 HD11 ILE 15 -16.378 0.394 7.868 130 HD12 ILE 15 HD12 ILE 15 -16.394 1.367 6.397 131 HD13 ILE 15 HD13 ILE 15 -15.145 1.628 7.614 132 H LYS 16 HN LYS 16 -11.632 -2.315 7.939 133 HA LYS 16 HA LYS 16 -11.181 -3.415 10.504 134 HB2 LYS 16 HB2 LYS 16 -13.248 -4.658 8.937 135 HB3 LYS 16 HB1 LYS 16 -11.904 -5.776 9.122 136 HG2 LYS 16 HG2 LYS 16 -13.315 -4.368 11.380 137 HG3 LYS 16 HG1 LYS 16 -13.595 -6.036 10.877 138 HD2 LYS 16 HD2 LYS 16 -12.024 -6.575 12.379 139 HD3 LYS 16 HD1 LYS 16 -10.868 -5.954 11.199 140 HE2 LYS 16 HE2 LYS 16 -10.217 -4.572 12.835 141 HE3 LYS 16 HE1 LYS 16 -11.688 -3.672 12.466 142 HZ1 LYS 16 HZ1 LYS 16 -12.828 -5.078 14.152 143 HZ2 LYS 16 HZ2 LYS 16 -11.632 -4.068 14.793 144 HZ3 LYS 16 HZ3 LYS 16 -11.321 -5.716 14.583 145 H ALA 17 HN ALA 17 -9.207 -4.384 10.582 146 HA ALA 17 HA ALA 17 -7.584 -4.243 8.228 147 HB1 ALA 17 HB1 ALA 17 -5.740 -4.809 9.672 148 HB2 ALA 17 HB2 ALA 17 -6.849 -5.296 10.953 149 HB3 ALA 17 HB3 ALA 17 -6.751 -3.603 10.469 150 H ILE 18 HN ILE 18 -7.006 -5.855 6.892 151 HA ILE 18 HA ILE 18 -8.139 -8.495 7.354 152 HB ILE 18 HB ILE 18 -6.460 -7.839 4.964 153 HG12 ILE 18 HG12 ILE 18 -8.423 -6.109 5.609 154 HG13 ILE 18 HG11 ILE 18 -7.988 -6.506 3.956 155 HG21 ILE 18 HG21 ILE 18 -8.328 -9.313 3.947 156 HG22 ILE 18 HG22 ILE 18 -8.664 -9.740 5.625 157 HG23 ILE 18 HG23 ILE 18 -7.072 -10.061 4.935 158 HD11 ILE 18 HD11 ILE 18 -10.475 -6.518 4.693 159 HD12 ILE 18 HD12 ILE 18 -10.080 -8.102 5.359 160 HD13 ILE 18 HD13 ILE 18 -9.870 -7.793 3.637 161 H ASP 19 HN ASP 19 -5.000 -7.558 5.972 162 HA ASP 19 HA ASP 19 -3.626 -9.155 7.990 163 HB2 ASP 19 HB2 ASP 19 -4.100 -10.815 6.293 164 HB3 ASP 19 HB1 ASP 19 -3.469 -9.764 5.030 165 H GLY 20 HN GLY 20 -2.010 -8.511 4.987 166 HA2 GLY 20 HA2 GLY 20 -0.530 -6.343 6.329 167 HA3 GLY 20 HA1 GLY 20 0.139 -7.401 5.094 168 H ASP 21 HN ASP 21 -0.506 -7.113 2.909 169 HA ASP 21 HA ASP 21 -0.814 -4.408 2.158 170 HB2 ASP 21 HB2 ASP 21 -0.942 -6.986 0.594 171 HB3 ASP 21 HB1 ASP 21 -1.092 -5.403 -0.162 172 H THR 22 HN THR 22 -3.056 -6.929 2.868 173 HA THR 22 HA THR 22 -5.237 -5.564 1.490 174 HB THR 22 HB THR 22 -5.600 -8.022 3.164 175 HG1 THR 22 HG1 THR 22 -4.562 -7.989 0.526 176 HG21 THR 22 HG21 THR 22 -7.244 -8.620 1.534 177 HG22 THR 22 HG22 THR 22 -6.787 -7.258 0.511 178 HG23 THR 22 HG23 THR 22 -7.551 -6.969 2.073 179 H VAL 23 HN VAL 23 -6.736 -4.385 2.464 180 HA VAL 23 HA VAL 23 -7.273 -4.581 5.296 181 HB VAL 23 HB VAL 23 -6.920 -2.116 5.652 182 HG11 VAL 23 HG11 VAL 23 -5.305 -4.084 6.236 183 HG12 VAL 23 HG12 VAL 23 -4.769 -2.413 6.416 184 HG13 VAL 23 HG13 VAL 23 -4.281 -3.348 5.003 185 HG21 VAL 23 HG21 VAL 23 -6.708 -1.056 3.644 186 HG22 VAL 23 HG22 VAL 23 -5.819 -2.390 2.907 187 HG23 VAL 23 HG23 VAL 23 -5.001 -1.293 4.021 188 H LYS 24 HN LYS 24 -9.315 -3.825 5.811 189 HA LYS 24 HA LYS 24 -11.015 -3.194 3.541 190 HB2 LYS 24 HB2 LYS 24 -11.666 -4.874 5.285 191 HB3 LYS 24 HB1 LYS 24 -11.802 -3.553 6.435 192 HG2 LYS 24 HG2 LYS 24 -13.983 -3.883 5.746 193 HG3 LYS 24 HG1 LYS 24 -13.449 -2.530 4.746 194 HD2 LYS 24 HD2 LYS 24 -14.568 -3.988 3.275 195 HD3 LYS 24 HD1 LYS 24 -12.850 -4.269 2.989 196 HE2 LYS 24 HE2 LYS 24 -13.853 -6.405 3.085 197 HE3 LYS 24 HE1 LYS 24 -13.025 -6.186 4.626 198 HZ1 LYS 24 HZ1 LYS 24 -15.175 -7.099 5.035 199 HZ2 LYS 24 HZ2 LYS 24 -15.933 -5.902 4.111 200 HZ3 LYS 24 HZ3 LYS 24 -15.188 -5.494 5.573 201 H LEU 25 HN LEU 25 -11.707 -1.220 3.025 202 HA LEU 25 HA LEU 25 -11.456 0.909 5.038 203 HB2 LEU 25 HB2 LEU 25 -10.757 0.929 2.130 204 HB3 LEU 25 HB1 LEU 25 -11.127 2.416 2.969 205 HG LEU 25 HG LEU 25 -9.042 0.603 4.099 206 HD11 LEU 25 HD11 LEU 25 -7.597 2.379 2.601 207 HD12 LEU 25 HD12 LEU 25 -8.907 1.936 1.506 208 HD13 LEU 25 HD13 LEU 25 -7.874 0.685 2.197 209 HD21 LEU 25 HD21 LEU 25 -9.667 2.484 5.434 210 HD22 LEU 25 HD22 LEU 25 -9.513 3.578 4.059 211 HD23 LEU 25 HD23 LEU 25 -8.078 2.814 4.742 212 H MET 26 HN MET 26 -12.937 2.706 4.808 213 HA MET 26 HA MET 26 -15.567 1.791 4.005 214 HB2 MET 26 HB2 MET 26 -15.017 3.053 6.167 215 HB3 MET 26 HB1 MET 26 -14.902 4.491 5.163 216 HG2 MET 26 HG2 MET 26 -17.128 4.633 4.867 217 HG3 MET 26 HG1 MET 26 -17.345 2.884 4.827 218 HE1 MET 26 HE1 MET 26 -19.649 3.071 7.704 219 HE2 MET 26 HE2 MET 26 -18.777 1.757 6.914 220 HE3 MET 26 HE3 MET 26 -19.463 3.064 5.950 221 H TYR 27 HN TYR 27 -16.111 1.989 1.942 222 HA TYR 27 HA TYR 27 -15.468 4.509 0.555 223 HB2 TYR 27 HB2 TYR 27 -14.257 2.396 -0.249 224 HB3 TYR 27 HB1 TYR 27 -15.827 1.863 -0.838 225 HD1 TYR 27 HD1 TYR 27 -14.324 5.266 -0.891 226 HD2 TYR 27 HD2 TYR 27 -15.644 1.920 -3.158 227 HE1 TYR 27 HE1 TYR 27 -13.971 6.542 -2.964 228 HE2 TYR 27 HE2 TYR 27 -15.294 3.183 -5.239 229 HH TYR 27 HH TYR 27 -15.140 5.476 -5.997 230 H LYS 28 HN LYS 28 -17.224 5.671 0.155 231 HA LYS 28 HA LYS 28 -19.371 6.268 -0.285 232 HB2 LYS 28 HB2 LYS 28 -19.320 3.569 -1.631 233 HB3 LYS 28 HB1 LYS 28 -20.656 4.703 -1.768 234 HG2 LYS 28 HG2 LYS 28 -19.150 6.351 -2.773 235 HG3 LYS 28 HG1 LYS 28 -17.822 5.195 -2.654 236 HD2 LYS 28 HD2 LYS 28 -18.420 4.620 -4.741 237 HD3 LYS 28 HD1 LYS 28 -19.713 3.721 -3.945 238 HE2 LYS 28 HE2 LYS 28 -19.880 6.515 -5.067 239 HE3 LYS 28 HE1 LYS 28 -20.632 5.066 -5.733 240 HZ1 LYS 28 HZ1 LYS 28 -22.342 6.064 -4.572 241 HZ2 LYS 28 HZ2 LYS 28 -21.347 6.568 -3.300 242 HZ3 LYS 28 HZ3 LYS 28 -21.770 4.937 -3.447 243 H GLY 29 HN GLY 29 -19.032 5.417 2.263 244 HA2 GLY 29 HA2 GLY 29 -20.202 4.703 4.104 245 HA3 GLY 29 HA1 GLY 29 -21.631 4.761 3.084 246 H GLN 30 HN GLN 30 -19.074 2.728 2.022 247 HA GLN 30 HA GLN 30 -20.338 0.371 3.224 248 HB2 GLN 30 HB2 GLN 30 -20.925 -0.576 1.259 249 HB3 GLN 30 HB1 GLN 30 -20.866 1.069 0.645 250 HG2 GLN 30 HG2 GLN 30 -18.360 0.488 0.179 251 HG3 GLN 30 HG1 GLN 30 -18.945 -1.173 0.255 252 HE21 GLN 30 HE21 GLN 30 -20.218 1.865 -1.072 253 HE22 GLN 30 HE22 GLN 30 -20.531 1.242 -2.653 254 HA PRO 31 HA PRO 31 -16.152 -0.908 3.760 255 HB2 PRO 31 HB2 PRO 31 -16.495 -3.442 4.444 256 HB3 PRO 31 HB1 PRO 31 -17.232 -2.154 5.409 257 HG2 PRO 31 HG2 PRO 31 -18.493 -3.920 3.345 258 HG3 PRO 31 HG1 PRO 31 -19.114 -3.441 4.936 259 HD2 PRO 31 HD2 PRO 31 -19.794 -2.228 2.538 260 HD3 PRO 31 HD1 PRO 31 -19.953 -1.476 4.137 261 H MET 32 HN MET 32 -14.667 -1.133 2.213 262 HA MET 32 HA MET 32 -15.026 -3.275 0.223 263 HB2 MET 32 HB2 MET 32 -15.129 -0.654 -0.410 264 HB3 MET 32 HB1 MET 32 -13.397 -0.924 -0.545 265 HG2 MET 32 HG2 MET 32 -14.201 -1.297 -2.690 266 HG3 MET 32 HG1 MET 32 -14.003 -2.916 -2.021 267 HE1 MET 32 HE1 MET 32 -17.098 -0.119 -2.157 268 HE2 MET 32 HE2 MET 32 -17.708 -0.934 -3.597 269 HE3 MET 32 HE3 MET 32 -16.047 -0.343 -3.555 270 H THR 33 HN THR 33 -13.248 -4.489 -0.299 271 HA THR 33 HA THR 33 -11.104 -4.483 1.623 272 HB THR 33 HB THR 33 -10.349 -6.377 -0.136 273 HG1 THR 33 HG1 THR 33 -12.177 -7.300 -1.055 274 HG21 THR 33 HG21 THR 33 -11.621 -6.384 2.333 275 HG22 THR 33 HG22 THR 33 -10.870 -7.753 1.512 276 HG23 THR 33 HG23 THR 33 -12.594 -7.441 1.311 277 H PHE 34 HN PHE 34 -9.405 -3.192 1.420 278 HA PHE 34 HA PHE 34 -8.561 -2.366 -1.262 279 HB2 PHE 34 HB2 PHE 34 -8.277 -1.157 1.461 280 HB3 PHE 34 HB1 PHE 34 -7.121 -0.729 0.202 281 HD1 PHE 34 HD1 PHE 34 -10.775 -0.895 0.888 282 HD2 PHE 34 HD2 PHE 34 -7.628 0.945 -1.312 283 HE1 PHE 34 HE1 PHE 34 -12.373 0.731 -0.041 284 HE2 PHE 34 HE2 PHE 34 -9.219 2.578 -2.234 285 HZ PHE 34 HZ PHE 34 -11.594 2.472 -1.599 286 H ARG 35 HN ARG 35 -6.327 -2.383 -1.841 287 HA ARG 35 HA ARG 35 -4.670 -4.199 -0.237 288 HB2 ARG 35 HB2 ARG 35 -4.187 -5.590 -2.023 289 HB3 ARG 35 HB1 ARG 35 -5.880 -5.207 -2.310 290 HG2 ARG 35 HG2 ARG 35 -5.086 -4.863 -4.400 291 HG3 ARG 35 HG1 ARG 35 -4.808 -3.252 -3.736 292 HD2 ARG 35 HD2 ARG 35 -2.573 -3.470 -3.817 293 HD3 ARG 35 HD1 ARG 35 -2.621 -5.146 -3.274 294 HE ARG 35 HE ARG 35 -2.556 -4.197 -5.992 295 HH11 ARG 35 HH11 ARG 35 -3.385 -6.864 -3.899 296 HH12 ARG 35 HH12 ARG 35 -3.251 -8.052 -5.151 297 HH21 ARG 35 HH21 ARG 35 -2.379 -5.759 -7.641 298 HH22 ARG 35 HH22 ARG 35 -2.678 -7.425 -7.275 299 H LEU 36 HN LEU 36 -2.466 -3.790 -0.234 300 HA LEU 36 HA LEU 36 -1.642 -1.144 -0.797 301 HB2 LEU 36 HB2 LEU 36 -0.166 -3.658 -0.048 302 HB3 LEU 36 HB1 LEU 36 0.703 -2.186 -0.439 303 HG LEU 36 HG LEU 36 -1.289 -2.505 1.807 304 HD11 LEU 36 HD11 LEU 36 0.420 -2.910 3.203 305 HD12 LEU 36 HD12 LEU 36 1.497 -1.785 2.377 306 HD13 LEU 36 HD13 LEU 36 1.271 -3.416 1.744 307 HD21 LEU 36 HD21 LEU 36 -1.329 -0.250 0.886 308 HD22 LEU 36 HD22 LEU 36 0.425 -0.150 1.025 309 HD23 LEU 36 HD23 LEU 36 -0.569 -0.264 2.477 310 H LEU 37 HN LEU 37 -2.213 -0.866 -3.003 311 HA LEU 37 HA LEU 37 -1.657 -2.268 -5.212 312 HB2 LEU 37 HB2 LEU 37 -2.609 0.122 -4.917 313 HB3 LEU 37 HB1 LEU 37 -0.956 0.638 -5.196 314 HG LEU 37 HG LEU 37 -0.985 -0.545 -7.368 315 HD11 LEU 37 HD11 LEU 37 -3.726 -1.234 -6.449 316 HD12 LEU 37 HD12 LEU 37 -2.537 -2.224 -7.294 317 HD13 LEU 37 HD13 LEU 37 -3.436 -0.985 -8.170 318 HD21 LEU 37 HD21 LEU 37 -1.768 1.913 -6.876 319 HD22 LEU 37 HD22 LEU 37 -3.332 1.284 -7.398 320 HD23 LEU 37 HD23 LEU 37 -1.944 1.210 -8.485 321 H LEU 38 HN LEU 38 -0.028 -2.696 -6.589 322 HA LEU 38 HA LEU 38 2.089 -3.395 -7.079 323 HB2 LEU 38 HB2 LEU 38 3.574 -1.594 -7.645 324 HB3 LEU 38 HB1 LEU 38 1.933 -1.167 -8.086 325 HG LEU 38 HG LEU 38 2.882 -0.241 -5.434 326 HD11 LEU 38 HD11 LEU 38 4.047 0.634 -8.035 327 HD12 LEU 38 HD12 LEU 38 4.825 0.423 -6.466 328 HD13 LEU 38 HD13 LEU 38 3.788 1.820 -6.756 329 HD21 LEU 38 HD21 LEU 38 0.786 0.319 -7.305 330 HD22 LEU 38 HD22 LEU 38 1.703 1.788 -6.980 331 HD23 LEU 38 HD23 LEU 38 0.982 0.886 -5.647 332 H VAL 39 HN VAL 39 1.512 -3.695 -4.249 333 HA VAL 39 HA VAL 39 4.243 -3.361 -3.186 334 HB VAL 39 HB VAL 39 1.704 -3.524 -1.554 335 HG11 VAL 39 HG11 VAL 39 4.570 -3.000 -0.777 336 HG12 VAL 39 HG12 VAL 39 3.604 -4.417 -0.367 337 HG13 VAL 39 HG13 VAL 39 3.186 -2.840 0.304 338 HG21 VAL 39 HG21 VAL 39 1.435 -1.371 -2.092 339 HG22 VAL 39 HG22 VAL 39 3.024 -1.281 -2.852 340 HG23 VAL 39 HG23 VAL 39 2.865 -1.055 -1.109 341 H ASP 40 HN ASP 40 5.228 -5.109 -2.254 342 HA ASP 40 HA ASP 40 3.990 -7.691 -2.816 343 HB2 ASP 40 HB2 ASP 40 6.537 -6.754 -3.214 344 HB3 ASP 40 HB1 ASP 40 6.719 -7.686 -1.730 345 H THR 41 HN THR 41 3.724 -9.313 -1.295 346 HA THR 41 HA THR 41 3.797 -8.406 1.505 347 HB THR 41 HB THR 41 2.159 -10.584 1.542 348 HG1 THR 41 HG1 THR 41 2.303 -10.633 -0.801 349 HG21 THR 41 HG21 THR 41 0.588 -8.312 0.763 350 HG22 THR 41 HG22 THR 41 1.851 -7.842 1.901 351 HG23 THR 41 HG23 THR 41 0.709 -9.116 2.327 352 HA PRO 42 HA PRO 42 6.927 -11.595 1.911 353 HB2 PRO 42 HB2 PRO 42 7.522 -11.168 4.503 354 HB3 PRO 42 HB1 PRO 42 8.051 -10.067 3.225 355 HG2 PRO 42 HG2 PRO 42 5.738 -9.812 5.107 356 HG3 PRO 42 HG1 PRO 42 6.907 -8.580 4.598 357 HD2 PRO 42 HD2 PRO 42 4.407 -8.802 3.533 358 HD3 PRO 42 HD1 PRO 42 5.795 -8.163 2.631 359 H GLU 43 HN GLU 43 5.982 -13.570 1.811 360 HA GLU 43 HA GLU 43 5.035 -15.521 2.492 361 HB2 GLU 43 HB2 GLU 43 6.700 -15.184 4.357 362 HB3 GLU 43 HB1 GLU 43 5.395 -14.484 5.305 363 HG2 GLU 43 HG2 GLU 43 4.365 -16.486 5.631 364 HG3 GLU 43 HG1 GLU 43 4.963 -17.167 4.118 365 H THR 44 HN THR 44 3.077 -14.481 1.531 366 HA THR 44 HA THR 44 0.866 -14.789 3.331 367 HB THR 44 HB THR 44 0.778 -12.153 1.966 368 HG1 THR 44 HG1 THR 44 2.033 -11.161 3.455 369 HG21 THR 44 HG21 THR 44 -0.797 -11.650 3.462 370 HG22 THR 44 HG22 THR 44 0.103 -12.362 4.801 371 HG23 THR 44 HG23 THR 44 -0.860 -13.390 3.739 372 H LYS 45 HN LYS 45 1.834 -13.463 0.176 373 HA LYS 45 HA LYS 45 -0.514 -14.764 -1.024 374 HB2 LYS 45 HB2 LYS 45 1.170 -12.420 -1.878 375 HB3 LYS 45 HB1 LYS 45 0.127 -13.260 -3.017 376 HG2 LYS 45 HG2 LYS 45 -1.564 -12.797 -0.918 377 HG3 LYS 45 HG1 LYS 45 -0.542 -11.359 -0.910 378 HD2 LYS 45 HD2 LYS 45 -1.275 -10.659 -2.961 379 HD3 LYS 45 HD1 LYS 45 -1.610 -12.298 -3.520 380 HE2 LYS 45 HE2 LYS 45 -3.695 -11.145 -3.233 381 HE3 LYS 45 HE1 LYS 45 -3.551 -12.371 -1.973 382 HZ1 LYS 45 HZ1 LYS 45 -3.085 -9.455 -1.673 383 HZ2 LYS 45 HZ2 LYS 45 -2.780 -10.597 -0.463 384 HZ3 LYS 45 HZ3 LYS 45 -4.360 -10.351 -1.015 385 H HIS 46 HN HIS 46 0.631 -16.814 -0.887 386 HA HIS 46 HA HIS 46 2.052 -17.360 -3.331 387 HB2 HIS 46 HB2 HIS 46 3.490 -17.035 -0.822 388 HB3 HIS 46 HB1 HIS 46 3.739 -18.632 -1.518 389 HD1 HIS 46 HD1 HIS 46 5.771 -16.080 -1.337 390 HD2 HIS 46 HD2 HIS 46 3.852 -17.606 -4.693 391 HE1 HIS 46 HE1 HIS 46 7.162 -15.347 -3.299 392 HE2 HIS 46 HE2 HIS 46 6.031 -16.358 -5.311 393 HA PRO 47 HA PRO 47 1.308 -21.594 -0.985 394 HB2 PRO 47 HB2 PRO 47 -0.247 -21.238 1.300 395 HB3 PRO 47 HB1 PRO 47 1.488 -21.558 1.277 396 HG2 PRO 47 HG2 PRO 47 0.042 -18.962 1.560 397 HG3 PRO 47 HG1 PRO 47 1.521 -19.518 2.365 398 HD2 PRO 47 HD2 PRO 47 1.627 -17.775 0.346 399 HD3 PRO 47 HD1 PRO 47 2.851 -19.050 0.516 400 H LYS 48 HN LYS 48 -0.984 -22.617 -0.114 401 HA LYS 48 HA LYS 48 -2.764 -22.313 -2.233 402 HB2 LYS 48 HB2 LYS 48 -2.612 -23.851 0.196 403 HB3 LYS 48 HB1 LYS 48 -4.257 -23.278 -0.043 404 HG2 LYS 48 HG2 LYS 48 -3.739 -24.159 -2.517 405 HG3 LYS 48 HG1 LYS 48 -2.681 -25.229 -1.594 406 HD2 LYS 48 HD2 LYS 48 -5.326 -24.946 -0.405 407 HD3 LYS 48 HD1 LYS 48 -5.377 -25.602 -2.043 408 HE2 LYS 48 HE2 LYS 48 -4.259 -27.505 -1.464 409 HE3 LYS 48 HE1 LYS 48 -3.361 -26.714 -0.169 410 HZ1 LYS 48 HZ1 LYS 48 -4.961 -28.266 0.726 411 HZ2 LYS 48 HZ2 LYS 48 -6.227 -27.488 -0.081 412 HZ3 LYS 48 HZ3 LYS 48 -5.395 -26.688 1.155 413 H LYS 49 HN LYS 49 -5.311 -22.101 -1.212 414 HA LYS 49 HA LYS 49 -5.910 -19.441 -1.384 415 HB2 LYS 49 HB2 LYS 49 -7.306 -21.831 -0.393 416 HB3 LYS 49 HB1 LYS 49 -7.918 -20.315 0.255 417 HG2 LYS 49 HG2 LYS 49 -8.675 -19.590 -1.773 418 HG3 LYS 49 HG1 LYS 49 -7.475 -20.517 -2.676 419 HD2 LYS 49 HD2 LYS 49 -9.222 -21.868 -3.124 420 HD3 LYS 49 HD1 LYS 49 -8.888 -22.515 -1.517 421 HE2 LYS 49 HE2 LYS 49 -10.617 -20.131 -1.599 422 HE3 LYS 49 HE1 LYS 49 -11.301 -21.591 -2.314 423 HZ1 LYS 49 HZ1 LYS 49 -10.122 -21.493 0.407 424 HZ2 LYS 49 HZ2 LYS 49 -11.007 -22.760 -0.281 425 HZ3 LYS 49 HZ3 LYS 49 -11.774 -21.299 0.093 426 H GLY 50 HN GLY 50 -4.803 -21.184 1.428 427 HA2 GLY 50 HA2 GLY 50 -3.678 -19.288 2.881 428 HA3 GLY 50 HA1 GLY 50 -5.368 -18.910 3.177 429 H VAL 51 HN VAL 51 -2.845 -20.268 4.587 430 HA VAL 51 HA VAL 51 -4.484 -22.266 6.005 431 HB VAL 51 HB VAL 51 -1.500 -22.460 5.587 432 HG11 VAL 51 HG11 VAL 51 -2.973 -23.587 7.545 433 HG12 VAL 51 HG12 VAL 51 -1.524 -24.321 6.860 434 HG13 VAL 51 HG13 VAL 51 -3.118 -24.819 6.291 435 HG21 VAL 51 HG21 VAL 51 -2.127 -22.968 3.470 436 HG22 VAL 51 HG22 VAL 51 -3.771 -23.402 3.943 437 HG23 VAL 51 HG23 VAL 51 -2.449 -24.541 4.200 438 H GLU 52 HN GLU 52 -1.322 -20.673 6.438 439 HA GLU 52 HA GLU 52 -2.241 -19.335 8.825 440 HB2 GLU 52 HB2 GLU 52 -0.615 -21.794 8.931 441 HB3 GLU 52 HB1 GLU 52 -0.013 -20.463 9.910 442 HG2 GLU 52 HG2 GLU 52 -2.894 -21.170 10.095 443 HG3 GLU 52 HG1 GLU 52 -1.709 -22.220 10.872 444 H LYS 53 HN LYS 53 1.104 -20.267 8.277 445 HA LYS 53 HA LYS 53 2.968 -18.969 8.042 446 HB2 LYS 53 HB2 LYS 53 1.195 -18.408 5.721 447 HB3 LYS 53 HB1 LYS 53 2.628 -17.408 5.907 448 HG2 LYS 53 HG2 LYS 53 2.961 -19.367 4.433 449 HG3 LYS 53 HG1 LYS 53 4.059 -19.327 5.814 450 HD2 LYS 53 HD2 LYS 53 3.111 -21.152 6.793 451 HD3 LYS 53 HD1 LYS 53 1.505 -20.795 6.155 452 HE2 LYS 53 HE2 LYS 53 3.824 -21.875 4.556 453 HE3 LYS 53 HE1 LYS 53 2.477 -22.831 5.171 454 HZ1 LYS 53 HZ1 LYS 53 2.604 -21.106 2.869 455 HZ2 LYS 53 HZ2 LYS 53 1.231 -20.852 3.824 456 HZ3 LYS 53 HZ3 LYS 53 1.555 -22.391 3.202 457 H TYR 54 HN TYR 54 0.922 -16.403 6.757 458 HA TYR 54 HA TYR 54 0.544 -14.266 7.420 459 HB2 TYR 54 HB2 TYR 54 0.731 -15.698 10.039 460 HB3 TYR 54 HB1 TYR 54 0.678 -13.938 10.032 461 HD1 TYR 54 HD1 TYR 54 -1.292 -12.800 8.912 462 HD2 TYR 54 HD2 TYR 54 -1.231 -16.966 9.773 463 HE1 TYR 54 HE1 TYR 54 -3.742 -12.871 8.708 464 HE2 TYR 54 HE2 TYR 54 -3.681 -17.050 9.571 465 HH TYR 54 HH TYR 54 -5.496 -14.591 8.190 466 H GLY 55 HN GLY 55 1.698 -12.391 7.632 467 HA2 GLY 55 HA2 GLY 55 4.557 -12.724 8.297 468 HA3 GLY 55 HA1 GLY 55 3.954 -11.603 7.085 469 HA PRO 56 HA PRO 56 2.832 -10.019 11.670 470 HB2 PRO 56 HB2 PRO 56 5.443 -10.930 12.778 471 HB3 PRO 56 HB1 PRO 56 3.866 -10.812 13.565 472 HG2 PRO 56 HG2 PRO 56 4.838 -13.177 12.829 473 HG3 PRO 56 HG1 PRO 56 3.112 -12.808 12.652 474 HD2 PRO 56 HD2 PRO 56 5.253 -12.918 10.575 475 HD3 PRO 56 HD1 PRO 56 3.543 -13.384 10.463 476 H GLU 57 HN GLU 57 5.852 -10.119 9.923 477 HA GLU 57 HA GLU 57 6.957 -7.720 10.954 478 HB2 GLU 57 HB2 GLU 57 7.788 -9.735 9.220 479 HB3 GLU 57 HB1 GLU 57 7.737 -8.295 8.213 480 HG2 GLU 57 HG2 GLU 57 9.242 -8.591 10.802 481 HG3 GLU 57 HG1 GLU 57 9.938 -8.621 9.184 482 H ALA 58 HN ALA 58 5.290 -8.398 7.872 483 HA ALA 58 HA ALA 58 5.103 -5.594 7.240 484 HB1 ALA 58 HB1 ALA 58 3.602 -7.766 5.821 485 HB2 ALA 58 HB2 ALA 58 5.336 -7.548 5.593 486 HB3 ALA 58 HB3 ALA 58 4.223 -6.245 5.182 487 H SER 59 HN SER 59 2.799 -8.155 8.124 488 HA SER 59 HA SER 59 0.451 -6.691 8.005 489 HB2 SER 59 HB2 SER 59 1.344 -9.137 9.402 490 HB3 SER 59 HB1 SER 59 -0.067 -8.341 10.100 491 HG SER 59 HG SER 59 -1.027 -9.485 8.590 492 H ALA 60 HN ALA 60 2.951 -6.673 10.438 493 HA ALA 60 HA ALA 60 1.434 -5.361 12.452 494 HB1 ALA 60 HB1 ALA 60 4.369 -5.820 12.047 495 HB2 ALA 60 HB2 ALA 60 3.288 -6.553 13.233 496 HB3 ALA 60 HB3 ALA 60 3.756 -4.859 13.391 497 H PHE 61 HN PHE 61 4.057 -4.179 10.332 498 HA PHE 61 HA PHE 61 3.888 -1.507 11.056 499 HB2 PHE 61 HB2 PHE 61 5.739 -2.513 9.753 500 HB3 PHE 61 HB1 PHE 61 4.676 -2.594 8.352 501 HD1 PHE 61 HD1 PHE 61 6.461 -0.345 10.634 502 HD2 PHE 61 HD2 PHE 61 4.173 -0.665 7.069 503 HE1 PHE 61 HE1 PHE 61 7.082 1.963 10.033 504 HE2 PHE 61 HE2 PHE 61 4.784 1.632 6.454 505 HZ PHE 61 HZ PHE 61 6.244 2.954 7.939 506 H THR 62 HN THR 62 2.393 -3.114 8.243 507 HA THR 62 HA THR 62 1.126 -0.934 7.125 508 HB THR 62 HB THR 62 0.073 -3.767 7.301 509 HG1 THR 62 HG1 THR 62 1.469 -4.218 5.809 510 HG21 THR 62 HG21 THR 62 -0.946 -1.412 5.924 511 HG22 THR 62 HG22 THR 62 -1.722 -2.958 6.266 512 HG23 THR 62 HG23 THR 62 -0.667 -2.793 4.863 513 H LYS 63 HN LYS 63 -0.057 -3.059 9.703 514 HA LYS 63 HA LYS 63 -2.525 -1.653 10.036 515 HB2 LYS 63 HB2 LYS 63 -2.518 -3.926 10.710 516 HB3 LYS 63 HB1 LYS 63 -1.053 -3.724 11.658 517 HG2 LYS 63 HG2 LYS 63 -2.280 -3.395 13.466 518 HG3 LYS 63 HG1 LYS 63 -2.993 -1.966 12.724 519 HD2 LYS 63 HD2 LYS 63 -4.879 -3.202 13.125 520 HD3 LYS 63 HD1 LYS 63 -4.483 -3.754 11.495 521 HE2 LYS 63 HE2 LYS 63 -3.048 -5.522 12.863 522 HE3 LYS 63 HE1 LYS 63 -4.261 -5.171 14.095 523 HZ1 LYS 63 HZ1 LYS 63 -4.795 -7.064 12.576 524 HZ2 LYS 63 HZ2 LYS 63 -4.951 -5.944 11.318 525 HZ3 LYS 63 HZ3 LYS 63 -5.985 -5.863 12.653 526 H LYS 64 HN LYS 64 0.683 -1.459 11.378 527 HA LYS 64 HA LYS 64 0.208 0.065 13.662 528 HB2 LYS 64 HB2 LYS 64 2.442 -0.865 12.210 529 HB3 LYS 64 HB1 LYS 64 2.665 0.868 12.397 530 HG2 LYS 64 HG2 LYS 64 2.012 -0.937 14.707 531 HG3 LYS 64 HG1 LYS 64 3.666 -0.606 14.181 532 HD2 LYS 64 HD2 LYS 64 1.717 1.588 14.839 533 HD3 LYS 64 HD1 LYS 64 2.740 0.839 16.066 534 HE2 LYS 64 HE2 LYS 64 4.232 2.413 15.501 535 HE3 LYS 64 HE1 LYS 64 4.544 1.395 14.096 536 HZ1 LYS 64 HZ1 LYS 64 2.453 2.823 13.250 537 HZ2 LYS 64 HZ2 LYS 64 4.063 3.269 12.985 538 HZ3 LYS 64 HZ3 LYS 64 3.196 3.955 14.264 539 H MET 65 HN MET 65 0.903 1.134 10.343 540 HA MET 65 HA MET 65 0.807 3.897 10.995 541 HB2 MET 65 HB2 MET 65 0.735 2.450 8.354 542 HB3 MET 65 HB1 MET 65 0.792 4.201 8.502 543 HG2 MET 65 HG2 MET 65 2.853 2.544 9.875 544 HG3 MET 65 HG1 MET 65 2.974 2.829 8.140 545 HE1 MET 65 HE1 MET 65 4.972 4.485 7.711 546 HE2 MET 65 HE2 MET 65 4.460 6.171 7.790 547 HE3 MET 65 HE3 MET 65 3.426 4.971 7.015 548 H VAL 66 HN VAL 66 -1.454 1.805 9.184 549 HA VAL 66 HA VAL 66 -3.380 3.780 8.719 550 HB VAL 66 HB VAL 66 -4.982 1.839 8.456 551 HG11 VAL 66 HG11 VAL 66 -3.780 0.963 6.440 552 HG12 VAL 66 HG12 VAL 66 -2.371 1.892 6.953 553 HG13 VAL 66 HG13 VAL 66 -3.871 2.722 6.537 554 HG21 VAL 66 HG21 VAL 66 -2.808 0.490 9.790 555 HG22 VAL 66 HG22 VAL 66 -3.168 -0.270 8.240 556 HG23 VAL 66 HG23 VAL 66 -4.440 -0.079 9.445 557 H GLU 67 HN GLU 67 -2.989 1.579 11.456 558 HA GLU 67 HA GLU 67 -5.471 2.317 12.652 559 HB2 GLU 67 HB2 GLU 67 -3.089 0.834 13.758 560 HB3 GLU 67 HB1 GLU 67 -4.607 1.048 14.618 561 HG2 GLU 67 HG2 GLU 67 -4.217 -0.405 12.014 562 HG3 GLU 67 HG1 GLU 67 -4.525 -1.132 13.591 563 H ASN 68 HN ASN 68 -2.077 3.183 13.234 564 HA ASN 68 HA ASN 68 -2.607 4.825 15.486 565 HB2 ASN 68 HB2 ASN 68 -0.279 4.548 13.609 566 HB3 ASN 68 HB1 ASN 68 -0.311 5.844 14.799 567 HD21 ASN 68 HD21 ASN 68 -1.118 2.384 14.743 568 HD22 ASN 68 HD22 ASN 68 -0.234 1.985 16.173 569 H ALA 69 HN ALA 69 -2.641 5.365 12.043 570 HA ALA 69 HA ALA 69 -2.678 8.218 12.177 571 HB1 ALA 69 HB1 ALA 69 -1.980 7.591 10.109 572 HB2 ALA 69 HB2 ALA 69 -3.699 7.771 9.761 573 HB3 ALA 69 HB3 ALA 69 -3.023 6.170 10.064 574 H LYS 70 HN LYS 70 -4.314 9.475 12.750 575 HA LYS 70 HA LYS 70 -6.851 8.474 13.456 576 HB2 LYS 70 HB2 LYS 70 -5.566 11.130 13.296 577 HB3 LYS 70 HB1 LYS 70 -7.320 11.128 13.192 578 HG2 LYS 70 HG2 LYS 70 -7.444 10.954 15.391 579 HG3 LYS 70 HG1 LYS 70 -6.605 9.404 15.313 580 HD2 LYS 70 HD2 LYS 70 -5.166 10.549 16.669 581 HD3 LYS 70 HD1 LYS 70 -4.484 10.971 15.096 582 HE2 LYS 70 HE2 LYS 70 -5.082 13.132 15.279 583 HE3 LYS 70 HE1 LYS 70 -6.633 12.744 16.022 584 HZ1 LYS 70 HZ1 LYS 70 -5.585 12.484 18.128 585 HZ2 LYS 70 HZ2 LYS 70 -5.068 13.962 17.489 586 HZ3 LYS 70 HZ3 LYS 70 -4.038 12.622 17.457 587 H LYS 71 HN LYS 71 -5.553 9.504 10.439 588 HA LYS 71 HA LYS 71 -8.182 9.113 9.209 589 HB2 LYS 71 HB2 LYS 71 -7.363 11.617 9.541 590 HB3 LYS 71 HB1 LYS 71 -6.443 11.257 8.087 591 HG2 LYS 71 HG2 LYS 71 -8.601 10.525 7.028 592 HG3 LYS 71 HG1 LYS 71 -9.427 11.192 8.438 593 HD2 LYS 71 HD2 LYS 71 -9.380 13.200 7.484 594 HD3 LYS 71 HD1 LYS 71 -7.617 13.165 7.540 595 HE2 LYS 71 HE2 LYS 71 -8.121 11.592 5.378 596 HE3 LYS 71 HE1 LYS 71 -9.450 12.746 5.283 597 HZ1 LYS 71 HZ1 LYS 71 -7.126 13.240 4.199 598 HZ2 LYS 71 HZ2 LYS 71 -6.756 13.789 5.755 599 HZ3 LYS 71 HZ3 LYS 71 -8.045 14.476 4.902 600 H ILE 72 HN ILE 72 -8.156 8.081 7.267 601 HA ILE 72 HA ILE 72 -5.513 7.347 6.192 602 HB ILE 72 HB ILE 72 -7.960 5.645 5.847 603 HG12 ILE 72 HG12 ILE 72 -5.946 5.476 8.101 604 HG13 ILE 72 HG11 ILE 72 -7.642 5.918 8.264 605 HG21 ILE 72 HG21 ILE 72 -6.548 4.039 5.053 606 HG22 ILE 72 HG22 ILE 72 -5.178 4.614 6.004 607 HG23 ILE 72 HG23 ILE 72 -5.674 5.488 4.555 608 HD11 ILE 72 HD11 ILE 72 -6.641 3.252 7.298 609 HD12 ILE 72 HD12 ILE 72 -8.320 3.704 7.595 610 HD13 ILE 72 HD13 ILE 72 -7.183 3.604 8.939 611 H GLU 73 HN GLU 73 -5.240 7.353 3.972 612 HA GLU 73 HA GLU 73 -7.495 8.409 2.393 613 HB2 GLU 73 HB2 GLU 73 -4.638 9.153 1.824 614 HB3 GLU 73 HB1 GLU 73 -6.107 9.934 1.258 615 HG2 GLU 73 HG2 GLU 73 -6.545 10.544 3.676 616 HG3 GLU 73 HG1 GLU 73 -4.887 10.036 3.997 617 H VAL 74 HN VAL 74 -7.719 7.658 0.293 618 HA VAL 74 HA VAL 74 -5.874 5.505 -0.497 619 HB VAL 74 HB VAL 74 -7.923 4.498 -1.660 620 HG11 VAL 74 HG11 VAL 74 -8.643 3.831 0.944 621 HG12 VAL 74 HG12 VAL 74 -6.937 4.267 1.040 622 HG13 VAL 74 HG13 VAL 74 -7.464 3.009 -0.078 623 HG21 VAL 74 HG21 VAL 74 -10.046 5.103 -1.046 624 HG22 VAL 74 HG22 VAL 74 -9.240 6.671 -0.991 625 HG23 VAL 74 HG23 VAL 74 -9.526 5.774 0.501 626 H GLU 75 HN GLU 75 -5.285 5.374 -2.606 627 HA GLU 75 HA GLU 75 -6.430 7.350 -4.464 628 HB2 GLU 75 HB2 GLU 75 -4.244 8.145 -3.672 629 HB3 GLU 75 HB1 GLU 75 -3.505 6.631 -4.177 630 HG2 GLU 75 HG2 GLU 75 -3.686 7.139 -6.425 631 HG3 GLU 75 HG1 GLU 75 -4.962 8.327 -6.157 632 H PHE 76 HN PHE 76 -7.563 6.094 -5.833 633 HA PHE 76 HA PHE 76 -6.769 3.448 -6.543 634 HB2 PHE 76 HB2 PHE 76 -8.931 5.292 -7.548 635 HB3 PHE 76 HB1 PHE 76 -8.662 3.697 -8.241 636 HD1 PHE 76 HD2 PHE 76 -8.281 1.889 -6.133 637 HD2 PHE 76 HD1 PHE 76 -10.755 5.355 -6.183 638 HE1 PHE 76 HE2 PHE 76 -9.700 0.897 -4.386 639 HE2 PHE 76 HE1 PHE 76 -12.178 4.367 -4.437 640 HZ PHE 76 HZ PHE 76 -11.653 2.136 -3.538 641 H ASP 77 HN ASP 77 -5.752 2.714 -8.294 642 HA ASP 77 HA ASP 77 -3.974 4.318 -9.711 643 HB2 ASP 77 HB2 ASP 77 -3.548 2.374 -11.095 644 HB3 ASP 77 HB1 ASP 77 -3.768 1.857 -9.428 645 H LYS 78 HN LYS 78 -4.150 3.687 -12.369 646 HA LYS 78 HA LYS 78 -6.536 5.196 -13.204 647 HB2 LYS 78 HB2 LYS 78 -4.782 5.392 -15.315 648 HB3 LYS 78 HB1 LYS 78 -5.029 6.612 -14.076 649 HG2 LYS 78 HG2 LYS 78 -3.033 4.442 -13.620 650 HG3 LYS 78 HG1 LYS 78 -2.627 5.803 -14.666 651 HD2 LYS 78 HD2 LYS 78 -3.867 6.691 -12.208 652 HD3 LYS 78 HD1 LYS 78 -2.437 5.706 -11.891 653 HE2 LYS 78 HE2 LYS 78 -2.537 8.093 -13.733 654 HE3 LYS 78 HE1 LYS 78 -1.912 8.107 -12.085 655 HZ1 LYS 78 HZ1 LYS 78 -0.507 6.106 -13.135 656 HZ2 LYS 78 HZ2 LYS 78 0.021 7.714 -13.133 657 HZ3 LYS 78 HZ3 LYS 78 -0.712 7.067 -14.514 658 H GLY 79 HN GLY 79 -4.796 2.251 -13.557 659 HA2 GLY 79 HA2 GLY 79 -5.808 1.501 -16.116 660 HA3 GLY 79 HA1 GLY 79 -5.071 0.428 -14.935 661 H GLN 80 HN GLN 80 -6.339 -0.850 -13.689 662 HA GLN 80 HA GLN 80 -9.142 -0.999 -14.415 663 HB2 GLN 80 HB2 GLN 80 -9.150 -3.121 -13.267 664 HB3 GLN 80 HB1 GLN 80 -7.738 -3.029 -14.307 665 HG2 GLN 80 HG2 GLN 80 -6.468 -2.282 -12.227 666 HG3 GLN 80 HG1 GLN 80 -7.871 -2.850 -11.323 667 HE21 GLN 80 HE21 GLN 80 -6.775 -4.498 -10.310 668 HE22 GLN 80 HE22 GLN 80 -6.217 -5.907 -11.139 669 H ARG 81 HN ARG 81 -7.247 -0.659 -11.444 670 HA ARG 81 HA ARG 81 -7.706 0.462 -9.507 671 HB2 ARG 81 HB2 ARG 81 -10.430 1.117 -10.614 672 HB3 ARG 81 HB1 ARG 81 -9.586 1.923 -9.300 673 HG2 ARG 81 HG2 ARG 81 -7.855 2.629 -10.960 674 HG3 ARG 81 HG1 ARG 81 -8.901 1.986 -12.228 675 HD2 ARG 81 HD2 ARG 81 -9.800 4.050 -10.229 676 HD3 ARG 81 HD1 ARG 81 -9.094 4.463 -11.791 677 HE ARG 81 HE ARG 81 -11.274 2.657 -12.075 678 HH11 ARG 81 HH11 ARG 81 -10.499 6.014 -11.522 679 HH12 ARG 81 HH12 ARG 81 -11.982 6.597 -12.198 680 HH21 ARG 81 HH21 ARG 81 -13.224 3.422 -12.965 681 HH22 ARG 81 HH22 ARG 81 -13.531 5.126 -13.016 682 H THR 82 HN THR 82 -9.613 -2.032 -10.826 683 HA THR 82 HA THR 82 -10.084 -3.116 -8.199 684 HB THR 82 HB THR 82 -12.582 -3.521 -8.947 685 HG1 THR 82 HG1 THR 82 -12.023 -1.017 -10.151 686 HG21 THR 82 HG21 THR 82 -13.314 -1.847 -7.534 687 HG22 THR 82 HG22 THR 82 -11.996 -0.759 -7.974 688 HG23 THR 82 HG23 THR 82 -11.677 -2.168 -6.961 689 H ASP 83 HN ASP 83 -9.518 -5.164 -8.356 690 HA ASP 83 HA ASP 83 -9.332 -6.481 -10.898 691 HB2 ASP 83 HB2 ASP 83 -8.201 -6.815 -8.314 692 HB3 ASP 83 HB1 ASP 83 -9.014 -8.322 -8.727 693 H LYS 84 HN LYS 84 -10.014 -9.034 -10.543 694 HA LYS 84 HA LYS 84 -12.645 -9.254 -11.205 695 HB2 LYS 84 HB2 LYS 84 -12.303 -11.611 -9.856 696 HB3 LYS 84 HB1 LYS 84 -11.827 -11.320 -11.525 697 HG2 LYS 84 HG2 LYS 84 -9.883 -10.613 -9.399 698 HG3 LYS 84 HG1 LYS 84 -10.169 -12.324 -9.716 699 HD2 LYS 84 HD2 LYS 84 -9.886 -10.953 -12.207 700 HD3 LYS 84 HD1 LYS 84 -8.532 -10.524 -11.161 701 HE2 LYS 84 HE2 LYS 84 -7.990 -12.847 -10.829 702 HE3 LYS 84 HE1 LYS 84 -9.427 -13.348 -11.718 703 HZ1 LYS 84 HZ1 LYS 84 -6.963 -13.054 -12.781 704 HZ2 LYS 84 HZ2 LYS 84 -7.699 -11.591 -13.206 705 HZ3 LYS 84 HZ3 LYS 84 -8.406 -13.057 -13.666 706 H TYR 85 HN TYR 85 -11.411 -9.992 -7.942 707 HA TYR 85 HA TYR 85 -13.986 -10.210 -6.805 708 HB2 TYR 85 HB2 TYR 85 -11.215 -10.341 -5.884 709 HB3 TYR 85 HB1 TYR 85 -12.302 -9.645 -4.687 710 HD1 TYR 85 HD1 TYR 85 -13.128 -12.274 -7.169 711 HD2 TYR 85 HD2 TYR 85 -12.374 -11.365 -3.084 712 HE1 TYR 85 HE1 TYR 85 -13.868 -14.533 -6.537 713 HE2 TYR 85 HE2 TYR 85 -13.110 -13.621 -2.439 714 HH TYR 85 HH TYR 85 -14.446 -15.432 -3.273 715 H GLY 86 HN GLY 86 -12.378 -7.509 -7.882 716 HA2 GLY 86 HA2 GLY 86 -13.089 -5.298 -7.769 717 HA3 GLY 86 HA1 GLY 86 -14.224 -5.757 -6.507 718 H ARG 87 HN ARG 87 -10.912 -6.703 -6.215 719 HA ARG 87 HA ARG 87 -10.528 -5.651 -3.692 720 HB2 ARG 87 HB2 ARG 87 -9.043 -7.185 -5.388 721 HB3 ARG 87 HB1 ARG 87 -8.106 -5.697 -5.368 722 HG2 ARG 87 HG2 ARG 87 -7.549 -5.911 -3.163 723 HG3 ARG 87 HG1 ARG 87 -8.998 -6.841 -2.773 724 HD2 ARG 87 HD2 ARG 87 -6.657 -7.853 -4.385 725 HD3 ARG 87 HD1 ARG 87 -6.944 -8.200 -2.681 726 HE ARG 87 HE ARG 87 -9.145 -8.915 -4.381 727 HH11 ARG 87 HH11 ARG 87 -6.089 -9.978 -3.071 728 HH12 ARG 87 HH12 ARG 87 -6.458 -11.660 -3.245 729 HH21 ARG 87 HH21 ARG 87 -9.632 -11.128 -4.610 730 HH22 ARG 87 HH22 ARG 87 -8.469 -12.314 -4.118 731 H GLY 88 HN GLY 88 -9.123 -3.897 -2.957 732 HA2 GLY 88 HA2 GLY 88 -9.683 -1.477 -4.466 733 HA3 GLY 88 HA1 GLY 88 -9.072 -1.555 -2.825 734 H LEU 89 HN LEU 89 -8.296 -1.300 -6.150 735 HA LEU 89 HA LEU 89 -5.467 -1.747 -5.800 736 HB2 LEU 89 HB2 LEU 89 -7.135 -0.813 -8.121 737 HB3 LEU 89 HB1 LEU 89 -5.391 -0.958 -8.196 738 HG LEU 89 HG LEU 89 -6.706 -2.879 -9.154 739 HD11 LEU 89 HD11 LEU 89 -5.215 -4.582 -8.224 740 HD12 LEU 89 HD12 LEU 89 -4.771 -3.473 -6.926 741 HD13 LEU 89 HD13 LEU 89 -4.353 -3.090 -8.597 742 HD21 LEU 89 HD21 LEU 89 -8.381 -2.861 -7.264 743 HD22 LEU 89 HD22 LEU 89 -7.146 -3.662 -6.292 744 HD23 LEU 89 HD23 LEU 89 -7.765 -4.443 -7.748 745 H ALA 90 HN ALA 90 -5.578 -0.015 -4.023 746 HA ALA 90 HA ALA 90 -4.683 2.502 -5.211 747 HB1 ALA 90 HB1 ALA 90 -5.986 3.779 -3.503 748 HB2 ALA 90 HB2 ALA 90 -6.829 2.282 -3.107 749 HB3 ALA 90 HB3 ALA 90 -6.974 2.975 -4.720 750 H TYR 91 HN TYR 91 -3.887 3.986 -3.325 751 HA TYR 91 HA TYR 91 -2.122 2.331 -1.666 752 HB2 TYR 91 HB2 TYR 91 -1.826 5.284 -2.194 753 HB3 TYR 91 HB1 TYR 91 -0.607 4.169 -1.595 754 HD1 TYR 91 HD2 TYR 91 -2.728 4.824 -4.594 755 HD2 TYR 91 HD1 TYR 91 0.928 3.263 -3.079 756 HE1 TYR 91 HE2 TYR 91 -1.927 4.488 -6.893 757 HE2 TYR 91 HE1 TYR 91 1.742 2.928 -5.373 758 HH TYR 91 HH TYR 91 -0.021 4.122 -8.148 759 H ILE 92 HN ILE 92 -2.223 2.397 0.516 760 HA ILE 92 HA ILE 92 -4.373 3.992 1.705 761 HB ILE 92 HB ILE 92 -2.685 1.825 2.965 762 HG12 ILE 92 HG12 ILE 92 -5.174 0.773 2.745 763 HG13 ILE 92 HG11 ILE 92 -5.130 1.773 1.296 764 HG21 ILE 92 HG21 ILE 92 -4.398 1.797 4.701 765 HG22 ILE 92 HG22 ILE 92 -5.246 3.116 3.895 766 HG23 ILE 92 HG23 ILE 92 -3.646 3.387 4.584 767 HD11 ILE 92 HD11 ILE 92 -3.095 -0.322 2.013 768 HD12 ILE 92 HD12 ILE 92 -3.152 0.627 0.528 769 HD13 ILE 92 HD13 ILE 92 -4.429 -0.537 0.881 770 H TYR 93 HN TYR 93 -4.001 5.803 2.791 771 HA TYR 93 HA TYR 93 -1.236 6.457 3.532 772 HB2 TYR 93 HB2 TYR 93 -3.629 8.291 3.288 773 HB3 TYR 93 HB1 TYR 93 -1.985 8.790 3.639 774 HD1 TYR 93 HD2 TYR 93 -2.993 6.305 1.061 775 HD2 TYR 93 HD1 TYR 93 -1.602 10.244 1.843 776 HE1 TYR 93 HE2 TYR 93 -2.617 6.636 -1.336 777 HE2 TYR 93 HE1 TYR 93 -1.209 10.585 -0.559 778 HH TYR 93 HH TYR 93 -1.305 8.016 -2.821 779 H ALA 94 HN ALA 94 -0.848 7.564 5.552 780 HA ALA 94 HA ALA 94 -2.897 7.235 7.611 781 HB1 ALA 94 HB1 ALA 94 -1.884 5.289 8.183 782 HB2 ALA 94 HB2 ALA 94 -0.805 6.386 9.046 783 HB3 ALA 94 HB3 ALA 94 -0.340 5.753 7.467 784 H ASP 95 HN ASP 95 -3.105 9.182 8.492 785 HA ASP 95 HA ASP 95 -2.609 11.152 9.517 786 HB2 ASP 95 HB2 ASP 95 -0.747 9.555 10.523 787 HB3 ASP 95 HB1 ASP 95 0.319 10.586 9.573 788 H GLY 96 HN GLY 96 -1.991 10.477 6.496 789 HA2 GLY 96 HA2 GLY 96 -1.954 12.302 4.905 790 HA3 GLY 96 HA1 GLY 96 -0.826 13.132 5.964 791 H LYS 97 HN LYS 97 -0.138 9.828 5.698 792 HA LYS 97 HA LYS 97 1.752 10.315 3.507 793 HB2 LYS 97 HB2 LYS 97 2.314 9.448 6.287 794 HB3 LYS 97 HB1 LYS 97 3.203 8.626 5.011 795 HG2 LYS 97 HG2 LYS 97 4.133 10.680 4.234 796 HG3 LYS 97 HG1 LYS 97 3.095 11.615 5.313 797 HD2 LYS 97 HD2 LYS 97 4.658 9.629 6.745 798 HD3 LYS 97 HD1 LYS 97 5.677 10.751 5.843 799 HE2 LYS 97 HE2 LYS 97 4.921 12.593 7.023 800 HE3 LYS 97 HE1 LYS 97 3.427 11.793 7.511 801 HZ1 LYS 97 HZ1 LYS 97 4.779 11.900 9.415 802 HZ2 LYS 97 HZ2 LYS 97 6.151 11.359 8.588 803 HZ3 LYS 97 HZ3 LYS 97 4.874 10.294 8.892 804 H MET 98 HN MET 98 1.886 8.712 2.029 805 HA MET 98 HA MET 98 -0.024 6.614 2.100 806 HB2 MET 98 HB2 MET 98 2.285 6.440 0.229 807 HB3 MET 98 HB1 MET 98 0.577 6.128 -0.056 808 HG2 MET 98 HG2 MET 98 0.538 8.075 -1.110 809 HG3 MET 98 HG1 MET 98 0.634 8.823 0.483 810 HE1 MET 98 HE1 MET 98 3.021 11.052 -1.649 811 HE2 MET 98 HE2 MET 98 1.913 11.114 -0.278 812 HE3 MET 98 HE3 MET 98 1.363 10.475 -1.828 813 H VAL 99 HN VAL 99 0.123 4.967 3.433 814 HA VAL 99 HA VAL 99 2.388 4.035 4.735 815 HB VAL 99 HB VAL 99 0.011 2.316 4.034 816 HG11 VAL 99 HG11 VAL 99 0.644 1.640 6.533 817 HG12 VAL 99 HG12 VAL 99 2.234 2.166 5.983 818 HG13 VAL 99 HG13 VAL 99 1.386 0.879 5.127 819 HG21 VAL 99 HG21 VAL 99 0.292 4.506 6.065 820 HG22 VAL 99 HG22 VAL 99 -0.844 3.177 6.295 821 HG23 VAL 99 HG23 VAL 99 -1.002 4.241 4.898 822 H ASN 100 HN ASN 100 1.073 3.148 1.605 823 HA ASN 100 HA ASN 100 2.382 0.769 1.097 824 HB2 ASN 100 HB2 ASN 100 2.044 2.949 -0.965 825 HB3 ASN 100 HB1 ASN 100 2.062 1.206 -1.228 826 HD21 ASN 100 HD21 ASN 100 0.167 0.226 -1.363 827 HD22 ASN 100 HD22 ASN 100 -1.343 0.858 -0.822 828 H GLU 101 HN GLU 101 3.551 4.033 0.250 829 HA GLU 101 HA GLU 101 6.061 3.283 -0.690 830 HB2 GLU 101 HB2 GLU 101 4.754 5.626 -0.524 831 HB3 GLU 101 HB1 GLU 101 5.879 5.837 0.811 832 HG2 GLU 101 HG2 GLU 101 7.335 4.829 -1.401 833 HG3 GLU 101 HG1 GLU 101 6.333 6.165 -1.968 834 H ALA 102 HN ALA 102 4.957 3.921 2.594 835 HA ALA 102 HA ALA 102 7.439 3.992 3.878 836 HB1 ALA 102 HB1 ALA 102 5.346 4.657 4.959 837 HB2 ALA 102 HB2 ALA 102 6.221 3.466 5.921 838 HB3 ALA 102 HB3 ALA 102 4.819 2.974 4.970 839 H LEU 103 HN LEU 103 5.237 1.239 3.411 840 HA LEU 103 HA LEU 103 6.906 -0.702 4.567 841 HB2 LEU 103 HB2 LEU 103 4.578 -0.767 2.696 842 HB3 LEU 103 HB1 LEU 103 5.514 -2.231 2.928 843 HG LEU 103 HG LEU 103 4.981 -1.269 5.509 844 HD11 LEU 103 HD11 LEU 103 3.179 0.025 4.054 845 HD12 LEU 103 HD12 LEU 103 2.803 -0.630 5.648 846 HD13 LEU 103 HD13 LEU 103 2.335 -1.517 4.197 847 HD21 LEU 103 HD21 LEU 103 3.306 -3.396 4.273 848 HD22 LEU 103 HD22 LEU 103 4.116 -3.362 5.839 849 HD23 LEU 103 HD23 LEU 103 5.051 -3.636 4.370 850 H VAL 104 HN VAL 104 6.518 0.435 1.252 851 HA VAL 104 HA VAL 104 8.207 -1.392 -0.030 852 HB VAL 104 HB VAL 104 7.803 1.510 -0.774 853 HG11 VAL 104 HG11 VAL 104 9.595 0.489 -2.018 854 HG12 VAL 104 HG12 VAL 104 8.194 0.687 -3.071 855 HG13 VAL 104 HG13 VAL 104 8.581 -0.900 -2.407 856 HG21 VAL 104 HG21 VAL 104 5.833 -0.429 -0.494 857 HG22 VAL 104 HG22 VAL 104 6.179 -0.398 -2.223 858 HG23 VAL 104 HG23 VAL 104 5.706 1.084 -1.392 859 H ARG 105 HN ARG 105 8.843 1.654 1.604 860 HA ARG 105 HA ARG 105 11.641 1.666 0.960 861 HB2 ARG 105 HB2 ARG 105 10.607 3.786 1.226 862 HB3 ARG 105 HB1 ARG 105 9.909 3.335 2.772 863 HG2 ARG 105 HG2 ARG 105 12.868 3.331 2.526 864 HG3 ARG 105 HG1 ARG 105 12.038 4.887 2.588 865 HD2 ARG 105 HD2 ARG 105 12.171 2.725 4.651 866 HD3 ARG 105 HD1 ARG 105 12.500 4.448 4.820 867 HE ARG 105 HE ARG 105 9.951 3.132 5.040 868 HH11 ARG 105 HH11 ARG 105 11.563 6.155 4.364 869 HH12 ARG 105 HH12 ARG 105 10.205 7.127 4.824 870 HH21 ARG 105 HH21 ARG 105 8.165 4.412 5.649 871 HH22 ARG 105 HH22 ARG 105 8.275 6.137 5.551 872 H GLN 106 HN GLN 106 9.777 1.178 3.996 873 HA GLN 106 HA GLN 106 11.801 0.667 5.740 874 HB2 GLN 106 HB2 GLN 106 8.981 0.120 5.566 875 HB3 GLN 106 HB1 GLN 106 9.806 -1.235 6.312 876 HG2 GLN 106 HG2 GLN 106 9.015 0.388 7.955 877 HG3 GLN 106 HG1 GLN 106 10.753 0.208 7.962 878 HE21 GLN 106 HE21 GLN 106 8.408 2.378 8.213 879 HE22 GLN 106 HE22 GLN 106 9.261 3.773 7.683 880 H GLY 107 HN GLY 107 10.213 -1.747 3.646 881 HA2 GLY 107 HA2 GLY 107 11.898 -3.266 2.537 882 HA3 GLY 107 HA1 GLY 107 12.504 -3.544 4.162 883 H LEU 108 HN LEU 108 9.527 -3.385 5.017 884 HA LEU 108 HA LEU 108 9.088 -6.141 5.216 885 HB2 LEU 108 HB2 LEU 108 6.726 -4.332 5.214 886 HB3 LEU 108 HB1 LEU 108 7.128 -5.645 6.301 887 HG LEU 108 HG LEU 108 9.085 -3.790 6.866 888 HD11 LEU 108 HD11 LEU 108 7.854 -2.163 5.437 889 HD12 LEU 108 HD12 LEU 108 8.038 -1.658 7.116 890 HD13 LEU 108 HD13 LEU 108 6.493 -2.292 6.551 891 HD21 LEU 108 HD21 LEU 108 6.411 -4.269 8.165 892 HD22 LEU 108 HD22 LEU 108 7.722 -3.348 8.903 893 HD23 LEU 108 HD23 LEU 108 7.943 -5.060 8.538 894 H ALA 109 HN ALA 109 8.431 -3.921 2.663 895 HA ALA 109 HA ALA 109 7.394 -6.100 1.029 896 HB1 ALA 109 HB1 ALA 109 5.563 -4.668 0.158 897 HB2 ALA 109 HB2 ALA 109 5.935 -3.490 1.416 898 HB3 ALA 109 HB3 ALA 109 5.368 -5.101 1.857 899 H LYS 110 HN LYS 110 7.415 -5.572 -1.286 900 HA LYS 110 HA LYS 110 9.200 -3.343 -1.971 901 HB2 LYS 110 HB2 LYS 110 10.262 -4.930 -3.669 902 HB3 LYS 110 HB1 LYS 110 10.708 -5.148 -1.983 903 HG2 LYS 110 HG2 LYS 110 9.417 -7.087 -1.772 904 HG3 LYS 110 HG1 LYS 110 8.511 -6.747 -3.247 905 HD2 LYS 110 HD2 LYS 110 9.998 -8.432 -3.881 906 HD3 LYS 110 HD1 LYS 110 10.775 -6.951 -4.444 907 HE2 LYS 110 HE2 LYS 110 12.538 -8.012 -3.419 908 HE3 LYS 110 HE1 LYS 110 11.928 -7.014 -2.100 909 HZ1 LYS 110 HZ1 LYS 110 11.007 -9.797 -2.470 910 HZ2 LYS 110 HZ2 LYS 110 10.941 -8.840 -1.078 911 HZ3 LYS 110 HZ3 LYS 110 12.425 -9.448 -1.614 912 H VAL 111 HN VAL 111 9.210 -2.911 -4.363 913 HA VAL 111 HA VAL 111 6.503 -2.741 -5.277 914 HB VAL 111 HB VAL 111 9.118 -1.887 -6.514 915 HG11 VAL 111 HG11 VAL 111 7.631 -2.413 -8.333 916 HG12 VAL 111 HG12 VAL 111 7.759 -0.662 -8.174 917 HG13 VAL 111 HG13 VAL 111 6.326 -1.499 -7.577 918 HG21 VAL 111 HG21 VAL 111 6.830 -0.290 -5.371 919 HG22 VAL 111 HG22 VAL 111 8.343 0.354 -6.008 920 HG23 VAL 111 HG23 VAL 111 8.350 -0.632 -4.546 921 H ALA 112 HN ALA 112 5.558 -4.532 -6.034 922 HA ALA 112 HA ALA 112 6.812 -5.906 -8.284 923 HB1 ALA 112 HB1 ALA 112 5.813 -8.071 -7.064 924 HB2 ALA 112 HB2 ALA 112 6.252 -7.117 -5.647 925 HB3 ALA 112 HB3 ALA 112 7.476 -7.525 -6.850 926 H TYR 113 HN TYR 113 5.227 -7.464 -9.319 927 HA TYR 113 HA TYR 113 3.262 -7.781 -10.417 928 HB2 TYR 113 HB2 TYR 113 2.054 -6.869 -7.798 929 HB3 TYR 113 HB1 TYR 113 1.211 -7.742 -9.074 930 HD1 TYR 113 HD1 TYR 113 1.653 -10.113 -9.460 931 HD2 TYR 113 HD2 TYR 113 3.593 -8.003 -6.316 932 HE1 TYR 113 HE1 TYR 113 2.317 -12.251 -8.443 933 HE2 TYR 113 HE2 TYR 113 4.263 -10.135 -5.291 934 HH TYR 113 HH TYR 113 4.621 -12.701 -6.446 935 H VAL 114 HN VAL 114 4.459 -5.398 -11.022 936 HA VAL 114 HA VAL 114 2.353 -3.368 -10.977 937 HB VAL 114 HB VAL 114 4.599 -2.627 -10.351 938 HG11 VAL 114 HG11 VAL 114 6.457 -3.185 -11.442 939 HG12 VAL 114 HG12 VAL 114 5.782 -2.702 -12.998 940 HG13 VAL 114 HG13 VAL 114 5.464 -4.315 -12.362 941 HG21 VAL 114 HG21 VAL 114 3.507 -1.534 -12.934 942 HG22 VAL 114 HG22 VAL 114 4.819 -0.765 -12.042 943 HG23 VAL 114 HG23 VAL 114 3.230 -0.941 -11.297 944 H TYR 115 HN TYR 115 0.893 -3.664 -12.547 945 HA TYR 115 HA TYR 115 1.855 -4.367 -15.237 946 HB2 TYR 115 HB2 TYR 115 -0.710 -4.817 -15.559 947 HB3 TYR 115 HB1 TYR 115 0.298 -6.001 -14.741 948 HD1 TYR 115 HD2 TYR 115 -1.465 -2.881 -13.699 949 HD2 TYR 115 HD1 TYR 115 -0.791 -7.014 -12.984 950 HE1 TYR 115 HE2 TYR 115 -2.954 -2.775 -11.743 951 HE2 TYR 115 HE1 TYR 115 -2.278 -6.926 -11.026 952 HH TYR 115 HH TYR 115 -3.039 -4.506 -9.402 953 H LYS 116 HN LYS 116 0.831 -3.335 -17.066 954 HA LYS 116 HA LYS 116 0.177 -0.533 -16.486 955 HB2 LYS 116 HB2 LYS 116 0.921 -1.718 -19.160 956 HB3 LYS 116 HB1 LYS 116 0.914 -0.020 -18.704 957 HG2 LYS 116 HG2 LYS 116 2.781 -2.138 -17.662 958 HG3 LYS 116 HG1 LYS 116 3.178 -0.858 -18.812 959 HD2 LYS 116 HD2 LYS 116 2.179 -0.346 -16.015 960 HD3 LYS 116 HD1 LYS 116 3.889 -0.420 -16.443 961 HE2 LYS 116 HE2 LYS 116 2.667 1.314 -18.296 962 HE3 LYS 116 HE1 LYS 116 2.048 1.759 -16.706 963 HZ1 LYS 116 HZ1 LYS 116 4.349 2.651 -17.694 964 HZ2 LYS 116 HZ2 LYS 116 4.909 1.288 -16.863 965 HZ3 LYS 116 HZ3 LYS 116 4.052 2.489 -16.036 966 HA PRO 117 HA PRO 117 -0.420 1.086 -17.877 967 HB2 PRO 117 HB2 PRO 117 -2.365 2.874 -18.179 968 HB3 PRO 117 HB1 PRO 117 -1.807 1.908 -19.551 969 HG2 PRO 117 HG2 PRO 117 -4.265 1.597 -17.888 970 HG3 PRO 117 HG1 PRO 117 -4.053 1.360 -19.630 971 HD2 PRO 117 HD2 PRO 117 -4.067 -0.657 -17.690 972 HD3 PRO 117 HD1 PRO 117 -3.468 -0.819 -19.351 973 H ASN 118 HN ASN 118 0.256 1.285 -15.797 974 HA ASN 118 HA ASN 118 -1.460 2.665 -13.932 975 HB2 ASN 118 HB2 ASN 118 -0.317 -0.018 -13.133 976 HB3 ASN 118 HB1 ASN 118 -1.310 1.044 -12.142 977 HD21 ASN 118 HD21 ASN 118 -1.287 -1.036 -14.961 978 HD22 ASN 118 HD22 ASN 118 -2.987 -1.337 -14.986 979 H ASN 119 HN ASN 119 -0.277 4.100 -12.838 980 HA ASN 119 HA ASN 119 2.247 3.596 -11.717 981 HB2 ASN 119 HB2 ASN 119 3.569 5.179 -13.204 982 HB3 ASN 119 HB1 ASN 119 3.197 3.601 -13.890 983 HD21 ASN 119 HD21 ASN 119 1.930 3.461 -15.672 984 HD22 ASN 119 HD22 ASN 119 1.327 4.831 -16.534 985 H THR 120 HN THR 120 -0.228 4.803 -10.976 986 HA THR 120 HA THR 120 -0.337 7.557 -10.982 987 HB THR 120 HB THR 120 -1.004 6.393 -8.372 988 HG1 THR 120 HG1 THR 120 -1.899 4.647 -9.058 989 HG21 THR 120 HG21 THR 120 -3.102 7.396 -8.692 990 HG22 THR 120 HG22 THR 120 -2.872 7.505 -10.437 991 HG23 THR 120 HG23 THR 120 -1.922 8.526 -9.356 992 H HIS 121 HN HIS 121 1.350 5.472 -8.647 993 HA HIS 121 HA HIS 121 2.983 7.802 -7.883 994 HB2 HIS 121 HB2 HIS 121 1.534 5.847 -6.214 995 HB3 HIS 121 HB1 HIS 121 3.182 6.195 -5.701 996 HD1 HIS 121 HD1 HIS 121 0.943 7.048 -3.871 997 HD2 HIS 121 HD2 HIS 121 2.454 9.488 -6.877 998 HE1 HIS 121 HE1 HIS 121 0.368 9.396 -3.182 999 HE2 HIS 121 HE2 HIS 121 1.365 10.861 -4.975 1000 H GLU 122 HN GLU 122 3.386 5.653 -9.914 1001 HA GLU 122 HA GLU 122 5.220 3.732 -9.098 1002 HB2 GLU 122 HB2 GLU 122 4.168 3.752 -11.316 1003 HB3 GLU 122 HB1 GLU 122 5.101 5.178 -11.751 1004 HG2 GLU 122 HG2 GLU 122 7.065 3.463 -10.990 1005 HG3 GLU 122 HG1 GLU 122 5.879 2.358 -11.684 1006 H GLN 123 HN GLN 123 5.924 6.916 -10.545 1007 HA GLN 123 HA GLN 123 8.679 6.850 -10.365 1008 HB2 GLN 123 HB2 GLN 123 6.807 9.204 -10.096 1009 HB3 GLN 123 HB1 GLN 123 8.547 9.352 -10.291 1010 HG2 GLN 123 HG2 GLN 123 6.692 8.028 -12.256 1011 HG3 GLN 123 HG1 GLN 123 7.315 9.672 -12.390 1012 HE21 GLN 123 HE21 GLN 123 9.860 9.600 -11.927 1013 HE22 GLN 123 HE22 GLN 123 10.703 8.496 -12.954 1014 H LEU 124 HN LEU 124 6.353 7.257 -7.833 1015 HA LEU 124 HA LEU 124 8.233 8.361 -5.943 1016 HB2 LEU 124 HB2 LEU 124 5.890 8.960 -5.779 1017 HB3 LEU 124 HB1 LEU 124 5.439 7.276 -5.600 1018 HG LEU 124 HG LEU 124 6.946 7.360 -3.474 1019 HD11 LEU 124 HD11 LEU 124 6.485 9.820 -2.544 1020 HD12 LEU 124 HD12 LEU 124 6.709 10.201 -4.252 1021 HD13 LEU 124 HD13 LEU 124 7.983 9.368 -3.360 1022 HD21 LEU 124 HD21 LEU 124 4.202 8.538 -3.778 1023 HD22 LEU 124 HD22 LEU 124 4.964 8.345 -2.199 1024 HD23 LEU 124 HD23 LEU 124 4.659 6.932 -3.210 1025 H LEU 125 HN LEU 125 6.658 5.226 -6.472 1026 HA LEU 125 HA LEU 125 8.035 3.986 -4.273 1027 HB2 LEU 125 HB2 LEU 125 6.282 2.934 -6.480 1028 HB3 LEU 125 HB1 LEU 125 7.064 1.873 -5.324 1029 HG LEU 125 HG LEU 125 5.855 3.589 -3.626 1030 HD11 LEU 125 HD11 LEU 125 4.638 4.952 -5.013 1031 HD12 LEU 125 HD12 LEU 125 3.460 3.684 -4.672 1032 HD13 LEU 125 HD13 LEU 125 4.349 3.676 -6.195 1033 HD21 LEU 125 HD21 LEU 125 4.726 1.757 -2.991 1034 HD22 LEU 125 HD22 LEU 125 5.672 0.945 -4.239 1035 HD23 LEU 125 HD23 LEU 125 4.037 1.502 -4.594 1036 H ARG 126 HN ARG 126 8.612 4.423 -7.667 1037 HA ARG 126 HA ARG 126 10.342 2.308 -8.200 1038 HB2 ARG 126 HB2 ARG 126 9.489 4.632 -9.525 1039 HB3 ARG 126 HB1 ARG 126 11.243 4.732 -9.492 1040 HG2 ARG 126 HG2 ARG 126 11.419 2.565 -10.554 1041 HG3 ARG 126 HG1 ARG 126 9.663 2.383 -10.518 1042 HD2 ARG 126 HD2 ARG 126 9.356 3.756 -12.280 1043 HD3 ARG 126 HD1 ARG 126 10.647 4.850 -11.783 1044 HE ARG 126 HE ARG 126 11.587 2.322 -12.780 1045 HH11 ARG 126 HH11 ARG 126 10.602 5.555 -13.650 1046 HH12 ARG 126 HH12 ARG 126 11.493 5.562 -15.134 1047 HH21 ARG 126 HH21 ARG 126 12.759 2.328 -14.732 1048 HH22 ARG 126 HH22 ARG 126 12.717 3.729 -15.750 1049 H LYS 127 HN LYS 127 10.904 5.359 -6.568 1050 HA LYS 127 HA LYS 127 13.761 5.016 -6.455 1051 HB2 LYS 127 HB2 LYS 127 12.216 6.906 -4.707 1052 HB3 LYS 127 HB1 LYS 127 13.837 7.085 -5.362 1053 HG2 LYS 127 HG2 LYS 127 11.251 7.271 -6.891 1054 HG3 LYS 127 HG1 LYS 127 12.331 8.601 -6.471 1055 HD2 LYS 127 HD2 LYS 127 13.672 6.434 -7.894 1056 HD3 LYS 127 HD1 LYS 127 12.368 7.174 -8.824 1057 HE2 LYS 127 HE2 LYS 127 13.593 9.372 -7.827 1058 HE3 LYS 127 HE1 LYS 127 14.966 8.277 -7.987 1059 HZ1 LYS 127 HZ1 LYS 127 14.491 7.990 -10.294 1060 HZ2 LYS 127 HZ2 LYS 127 14.537 9.652 -9.981 1061 HZ3 LYS 127 HZ3 LYS 127 13.051 8.871 -10.176 1062 H SER 128 HN SER 128 11.106 4.893 -4.089 1063 HA SER 128 HA SER 128 12.620 4.223 -1.850 1064 HB2 SER 128 HB2 SER 128 10.428 4.842 -1.370 1065 HB3 SER 128 HB1 SER 128 9.751 3.795 -2.619 1066 HG SER 128 HG SER 128 9.408 2.958 -0.518 1067 H GLU 129 HN GLU 129 11.252 2.152 -4.364 1068 HA GLU 129 HA GLU 129 11.755 -0.315 -3.104 1069 HB2 GLU 129 HB2 GLU 129 10.244 -0.194 -4.983 1070 HB3 GLU 129 HB1 GLU 129 11.528 0.396 -6.031 1071 HG2 GLU 129 HG2 GLU 129 12.426 -2.045 -4.965 1072 HG3 GLU 129 HG1 GLU 129 10.750 -2.290 -5.450 1073 H ALA 130 HN ALA 130 13.629 1.361 -5.634 1074 HA ALA 130 HA ALA 130 15.810 -0.462 -5.464 1075 HB1 ALA 130 HB1 ALA 130 16.545 0.539 -7.326 1076 HB2 ALA 130 HB2 ALA 130 16.387 2.154 -6.635 1077 HB3 ALA 130 HB3 ALA 130 14.977 1.347 -7.321 1078 H GLN 131 HN GLN 131 15.060 2.613 -3.969 1079 HA GLN 131 HA GLN 131 17.637 3.316 -3.119 1080 HB2 GLN 131 HB2 GLN 131 14.876 3.992 -2.177 1081 HB3 GLN 131 HB1 GLN 131 16.264 4.502 -1.233 1082 HG2 GLN 131 HG2 GLN 131 16.729 5.159 -3.952 1083 HG3 GLN 131 HG1 GLN 131 15.130 5.737 -3.498 1084 HE21 GLN 131 HE21 GLN 131 14.937 7.287 -1.875 1085 HE22 GLN 131 HE22 GLN 131 16.280 8.241 -1.355 1086 H ALA 132 HN ALA 132 15.036 1.718 -1.291 1087 HA ALA 132 HA ALA 132 16.667 1.141 0.956 1088 HB1 ALA 132 HB1 ALA 132 14.765 -0.436 1.538 1089 HB2 ALA 132 HB2 ALA 132 13.991 0.121 0.055 1090 HB3 ALA 132 HB3 ALA 132 14.353 1.268 1.344 1091 H LYS 133 HN LYS 133 16.171 -0.456 -2.072 1092 HA LYS 133 HA LYS 133 16.866 -3.085 -1.338 1093 HB2 LYS 133 HB2 LYS 133 16.178 -1.735 -3.701 1094 HB3 LYS 133 HB1 LYS 133 17.766 -2.423 -4.004 1095 HG2 LYS 133 HG2 LYS 133 16.961 -4.493 -4.149 1096 HG3 LYS 133 HG1 LYS 133 15.956 -4.297 -2.713 1097 HD2 LYS 133 HD2 LYS 133 14.390 -2.933 -4.169 1098 HD3 LYS 133 HD1 LYS 133 15.319 -3.521 -5.550 1099 HE2 LYS 133 HE2 LYS 133 14.872 -5.863 -4.556 1100 HE3 LYS 133 HE1 LYS 133 13.604 -5.059 -3.633 1101 HZ1 LYS 133 HZ1 LYS 133 12.979 -6.090 -5.859 1102 HZ2 LYS 133 HZ2 LYS 133 13.776 -4.778 -6.569 1103 HZ3 LYS 133 HZ3 LYS 133 12.446 -4.512 -5.560 1104 H LYS 134 HN LYS 134 18.836 -0.430 -2.636 1105 HA LYS 134 HA LYS 134 21.274 -1.801 -2.716 1106 HB2 LYS 134 HB2 LYS 134 21.024 0.272 -3.893 1107 HB3 LYS 134 HB1 LYS 134 20.650 1.136 -2.410 1108 HG2 LYS 134 HG2 LYS 134 22.955 0.643 -1.616 1109 HG3 LYS 134 HG1 LYS 134 23.301 -0.048 -3.203 1110 HD2 LYS 134 HD2 LYS 134 22.328 2.772 -2.769 1111 HD3 LYS 134 HD1 LYS 134 24.029 2.331 -2.915 1112 HE2 LYS 134 HE2 LYS 134 23.884 1.975 -5.143 1113 HE3 LYS 134 HE1 LYS 134 22.248 1.328 -5.040 1114 HZ1 LYS 134 HZ1 LYS 134 22.450 3.501 -6.216 1115 HZ2 LYS 134 HZ2 LYS 134 22.881 4.209 -4.742 1116 HZ3 LYS 134 HZ3 LYS 134 21.355 3.505 -4.925 1117 H GLU 135 HN GLU 135 19.663 -0.124 -0.083 1118 HA GLU 135 HA GLU 135 21.979 -0.550 1.654 1119 HB2 GLU 135 HB2 GLU 135 19.737 0.638 3.024 1120 HB3 GLU 135 HB1 GLU 135 21.342 1.297 2.734 1121 HG2 GLU 135 HG2 GLU 135 20.586 2.042 0.498 1122 HG3 GLU 135 HG1 GLU 135 18.966 1.469 0.894 1123 H LYS 136 HN LYS 136 19.189 -2.193 0.800 1124 HA LYS 136 HA LYS 136 17.892 -3.792 1.798 1125 HB2 LYS 136 HB2 LYS 136 20.574 -4.443 3.034 1126 HB3 LYS 136 HB1 LYS 136 19.203 -5.543 2.933 1127 HG2 LYS 136 HG2 LYS 136 19.321 -5.211 0.418 1128 HG3 LYS 136 HG1 LYS 136 20.894 -4.463 0.703 1129 HD2 LYS 136 HD2 LYS 136 21.636 -6.584 0.438 1130 HD3 LYS 136 HD1 LYS 136 21.175 -6.730 2.137 1131 HE2 LYS 136 HE2 LYS 136 19.389 -8.038 1.679 1132 HE3 LYS 136 HE1 LYS 136 19.027 -7.199 0.171 1133 HZ1 LYS 136 HZ1 LYS 136 20.710 -8.416 -0.949 1134 HZ2 LYS 136 HZ2 LYS 136 19.791 -9.543 -0.085 1135 HZ3 LYS 136 HZ3 LYS 136 21.307 -9.070 0.493 1136 H LEU 137 HN LEU 137 16.953 -1.891 2.973 1137 HA LEU 137 HA LEU 137 17.572 -1.127 5.531 1138 HB2 LEU 137 HB2 LEU 137 15.116 -1.092 3.881 1139 HB3 LEU 137 HB1 LEU 137 14.909 -0.833 5.605 1140 HG LEU 137 HG LEU 137 16.654 0.800 3.764 1141 HD11 LEU 137 HD11 LEU 137 14.637 1.678 3.270 1142 HD12 LEU 137 HD12 LEU 137 14.867 2.519 4.803 1143 HD13 LEU 137 HD13 LEU 137 13.884 1.057 4.738 1144 HD21 LEU 137 HD21 LEU 137 16.163 2.024 6.294 1145 HD22 LEU 137 HD22 LEU 137 17.703 1.580 5.558 1146 HD23 LEU 137 HD23 LEU 137 16.836 0.415 6.559 1147 H ASN 138 HN ASN 138 14.512 -2.869 5.266 1148 HA ASN 138 HA ASN 138 15.058 -4.139 7.800 1149 HB2 ASN 138 HB2 ASN 138 12.608 -4.114 6.038 1150 HB3 ASN 138 HB1 ASN 138 12.693 -4.957 7.580 1151 HD21 ASN 138 HD21 ASN 138 10.859 -2.946 7.000 1152 HD22 ASN 138 HD22 ASN 138 11.188 -1.592 8.019 1153 H ILE 139 HN ILE 139 13.018 -6.046 5.835 1154 HA ILE 139 HA ILE 139 14.927 -8.231 5.971 1155 HB ILE 139 HB ILE 139 13.029 -9.654 5.296 1156 HG12 ILE 139 HG12 ILE 139 11.470 -7.058 5.346 1157 HG13 ILE 139 HG11 ILE 139 11.817 -8.026 3.916 1158 HG21 ILE 139 HG21 ILE 139 12.002 -9.648 7.380 1159 HG22 ILE 139 HG22 ILE 139 12.089 -7.893 7.527 1160 HG23 ILE 139 HG23 ILE 139 13.551 -8.866 7.694 1161 HD11 ILE 139 HD11 ILE 139 10.159 -9.465 4.343 1162 HD12 ILE 139 HD12 ILE 139 9.533 -8.158 5.350 1163 HD13 ILE 139 HD13 ILE 139 10.466 -9.467 6.080 1164 H TRP 140 HN TRP 140 15.905 -6.534 4.148 1165 HA TRP 140 HA TRP 140 14.981 -7.252 1.498 1166 HB2 TRP 140 HB2 TRP 140 17.324 -5.570 2.408 1167 HB3 TRP 140 HB1 TRP 140 16.841 -5.793 0.728 1168 HD1 TRP 140 HD1 TRP 140 15.600 -4.202 3.993 1169 HE1 TRP 140 HE1 TRP 140 13.902 -2.360 3.403 1170 HE3 TRP 140 HE3 TRP 140 15.279 -4.987 -1.038 1171 HZ2 TRP 140 HZ2 TRP 140 12.611 -1.365 1.112 1172 HZ3 TRP 140 HZ3 TRP 140 13.787 -3.545 -2.365 1173 HH2 TRP 140 HH2 TRP 140 12.478 -1.772 -1.310 Start of MODEL 17 1 H1 ALA 1 HT1 ALA 1 -15.966 29.624 9.985 2 H2 ALA 1 HT2 ALA 1 -17.677 29.493 10.037 3 H3 ALA 1 HT3 ALA 1 -16.895 29.986 8.591 4 HA ALA 1 HA ALA 1 -16.356 27.397 9.843 5 HB1 ALA 1 HB1 ALA 1 -18.865 28.045 9.131 6 HB2 ALA 1 HB2 ALA 1 -18.195 26.422 8.975 7 HB3 ALA 1 HB3 ALA 1 -18.239 27.498 7.576 8 H THR 2 HN THR 2 -16.362 25.939 7.561 9 HA THR 2 HA THR 2 -14.424 27.301 5.809 10 HB THR 2 HB THR 2 -13.138 25.822 7.174 11 HG1 THR 2 HG1 THR 2 -12.850 25.726 4.815 12 HG21 THR 2 HG21 THR 2 -14.984 23.573 6.417 13 HG22 THR 2 HG22 THR 2 -14.984 24.392 7.980 14 HG23 THR 2 HG23 THR 2 -13.563 23.485 7.459 15 H SER 3 HN SER 3 -14.783 27.134 3.680 16 HA SER 3 HA SER 3 -17.218 26.080 2.716 17 HB2 SER 3 HB2 SER 3 -14.746 26.922 1.183 18 HB3 SER 3 HB1 SER 3 -16.337 26.644 0.477 19 HG SER 3 HG SER 3 -17.097 28.433 1.438 20 H THR 4 HN THR 4 -16.889 24.727 0.468 21 HA THR 4 HA THR 4 -15.363 22.318 1.208 22 HB THR 4 HB THR 4 -17.369 21.311 -0.329 23 HG1 THR 4 HG1 THR 4 -18.572 23.310 1.277 24 HG21 THR 4 HG21 THR 4 -16.547 20.804 2.128 25 HG22 THR 4 HG22 THR 4 -18.090 20.212 1.513 26 HG23 THR 4 HG23 THR 4 -18.040 21.651 2.532 27 H LYS 5 HN LYS 5 -13.711 23.417 -0.138 28 HA LYS 5 HA LYS 5 -14.176 23.659 -2.961 29 HB2 LYS 5 HB2 LYS 5 -11.517 23.620 -1.530 30 HB3 LYS 5 HB1 LYS 5 -11.862 24.292 -3.118 31 HG2 LYS 5 HG2 LYS 5 -13.138 26.068 -2.174 32 HG3 LYS 5 HG1 LYS 5 -13.084 25.329 -0.572 33 HD2 LYS 5 HD2 LYS 5 -10.461 25.517 -1.027 34 HD3 LYS 5 HD1 LYS 5 -11.007 26.857 -2.038 35 HE2 LYS 5 HE2 LYS 5 -11.034 28.096 -0.187 36 HE3 LYS 5 HE1 LYS 5 -12.438 27.158 0.318 37 HZ1 LYS 5 HZ1 LYS 5 -10.239 27.347 1.769 38 HZ2 LYS 5 HZ2 LYS 5 -9.826 25.985 0.853 39 HZ3 LYS 5 HZ3 LYS 5 -11.231 25.976 1.795 40 H LYS 6 HN LYS 6 -12.706 22.526 -4.537 41 HA LYS 6 HA LYS 6 -12.961 19.689 -4.148 42 HB2 LYS 6 HB2 LYS 6 -13.246 21.131 -6.330 43 HB3 LYS 6 HB1 LYS 6 -11.511 20.887 -6.473 44 HG2 LYS 6 HG2 LYS 6 -12.188 19.083 -7.649 45 HG3 LYS 6 HG1 LYS 6 -12.247 18.360 -6.039 46 HD2 LYS 6 HD2 LYS 6 -14.681 19.788 -6.894 47 HD3 LYS 6 HD1 LYS 6 -14.304 18.313 -7.787 48 HE2 LYS 6 HE2 LYS 6 -14.543 16.970 -5.933 49 HE3 LYS 6 HE1 LYS 6 -14.183 18.279 -4.808 50 HZ1 LYS 6 HZ1 LYS 6 -16.316 19.015 -4.835 51 HZ2 LYS 6 HZ2 LYS 6 -16.616 17.381 -5.151 52 HZ3 LYS 6 HZ3 LYS 6 -16.613 18.499 -6.420 53 H LEU 7 HN LEU 7 -11.247 18.157 -4.326 54 HA LEU 7 HA LEU 7 -8.605 19.234 -3.585 55 HB2 LEU 7 HB2 LEU 7 -9.651 16.573 -2.653 56 HB3 LEU 7 HB1 LEU 7 -8.278 17.476 -2.040 57 HG LEU 7 HG LEU 7 -10.951 18.749 -1.797 58 HD11 LEU 7 HD11 LEU 7 -10.203 16.187 -0.537 59 HD12 LEU 7 HD12 LEU 7 -11.794 16.852 -0.906 60 HD13 LEU 7 HD13 LEU 7 -10.914 17.408 0.518 61 HD21 LEU 7 HD21 LEU 7 -8.316 18.794 -0.460 62 HD22 LEU 7 HD22 LEU 7 -9.730 19.058 0.561 63 HD23 LEU 7 HD23 LEU 7 -9.430 20.112 -0.820 64 H HIS 8 HN HIS 8 -7.301 16.702 -3.577 65 HA HIS 8 HA HIS 8 -7.470 15.952 -6.419 66 HB2 HIS 8 HB2 HIS 8 -5.393 17.322 -5.419 67 HB3 HIS 8 HB1 HIS 8 -4.867 15.693 -5.002 68 HD1 HIS 8 HD1 HIS 8 -4.284 18.019 -7.502 69 HD2 HIS 8 HD2 HIS 8 -5.340 14.001 -7.597 70 HE1 HIS 8 HE1 HIS 8 -3.602 17.199 -9.780 71 HE2 HIS 8 HE2 HIS 8 -4.182 14.746 -9.786 72 H LYS 9 HN LYS 9 -6.911 14.962 -3.111 73 HA LYS 9 HA LYS 9 -7.033 12.158 -3.968 74 HB2 LYS 9 HB2 LYS 9 -5.972 11.652 -1.747 75 HB3 LYS 9 HB1 LYS 9 -4.949 12.540 -2.867 76 HG2 LYS 9 HG2 LYS 9 -6.569 14.115 -0.949 77 HG3 LYS 9 HG1 LYS 9 -5.185 13.217 -0.320 78 HD2 LYS 9 HD2 LYS 9 -4.927 14.983 -2.731 79 HD3 LYS 9 HD1 LYS 9 -4.820 15.645 -1.099 80 HE2 LYS 9 HE2 LYS 9 -3.102 13.430 -2.210 81 HE3 LYS 9 HE1 LYS 9 -2.610 15.113 -2.032 82 HZ1 LYS 9 HZ1 LYS 9 -2.899 13.040 -0.012 83 HZ2 LYS 9 HZ2 LYS 9 -3.397 14.592 0.441 84 HZ3 LYS 9 HZ3 LYS 9 -1.812 14.335 -0.090 85 H GLU 10 HN GLU 10 -8.185 10.680 -2.522 86 HA GLU 10 HA GLU 10 -10.415 12.034 -1.157 87 HB2 GLU 10 HB2 GLU 10 -10.372 9.439 -2.699 88 HB3 GLU 10 HB1 GLU 10 -11.720 9.942 -1.689 89 HG2 GLU 10 HG2 GLU 10 -12.549 10.954 -3.472 90 HG3 GLU 10 HG1 GLU 10 -11.245 12.129 -3.317 91 HA PRO 11 HA PRO 11 -8.928 9.838 2.429 92 HB2 PRO 11 HB2 PRO 11 -10.776 10.655 4.187 93 HB3 PRO 11 HB1 PRO 11 -9.562 11.767 3.543 94 HG2 PRO 11 HG2 PRO 11 -12.427 11.426 2.750 95 HG3 PRO 11 HG1 PRO 11 -11.496 12.919 2.968 96 HD2 PRO 11 HD2 PRO 11 -11.998 11.754 0.529 97 HD3 PRO 11 HD1 PRO 11 -10.614 12.814 0.860 98 H ALA 12 HN ALA 12 -9.820 8.313 4.098 99 HA ALA 12 HA ALA 12 -12.314 7.029 3.611 100 HB1 ALA 12 HB1 ALA 12 -9.796 5.609 2.767 101 HB2 ALA 12 HB2 ALA 12 -11.170 6.046 1.751 102 HB3 ALA 12 HB3 ALA 12 -11.354 4.814 3.000 103 H THR 13 HN THR 13 -12.732 5.266 5.101 104 HA THR 13 HA THR 13 -10.978 5.366 7.469 105 HB THR 13 HB THR 13 -13.921 4.750 7.583 106 HG1 THR 13 HG1 THR 13 -13.870 6.771 6.694 107 HG21 THR 13 HG21 THR 13 -12.266 6.116 9.667 108 HG22 THR 13 HG22 THR 13 -12.343 4.359 9.551 109 HG23 THR 13 HG23 THR 13 -13.813 5.287 9.841 110 H LEU 14 HN LEU 14 -10.431 3.462 8.462 111 HA LEU 14 HA LEU 14 -10.665 1.081 6.888 112 HB2 LEU 14 HB2 LEU 14 -8.929 2.018 8.863 113 HB3 LEU 14 HB1 LEU 14 -9.725 0.634 9.593 114 HG LEU 14 HG LEU 14 -7.562 0.121 8.439 115 HD11 LEU 14 HD11 LEU 14 -8.848 -1.713 6.929 116 HD12 LEU 14 HD12 LEU 14 -10.146 -1.215 8.014 117 HD13 LEU 14 HD13 LEU 14 -8.634 -1.839 8.675 118 HD21 LEU 14 HD21 LEU 14 -8.365 1.733 6.475 119 HD22 LEU 14 HD22 LEU 14 -8.942 0.200 5.820 120 HD23 LEU 14 HD23 LEU 14 -7.235 0.405 6.211 121 H ILE 15 HN ILE 15 -12.531 0.006 6.822 122 HA ILE 15 HA ILE 15 -14.435 0.018 8.943 123 HB ILE 15 HB ILE 15 -14.249 -1.812 6.542 124 HG12 ILE 15 HG12 ILE 15 -14.455 0.608 6.002 125 HG13 ILE 15 HG11 ILE 15 -15.860 -0.328 5.497 126 HG21 ILE 15 HG21 ILE 15 -15.687 -2.946 7.941 127 HG22 ILE 15 HG22 ILE 15 -16.805 -1.919 7.044 128 HG23 ILE 15 HG23 ILE 15 -16.310 -1.468 8.675 129 HD11 ILE 15 HD11 ILE 15 -16.961 1.381 6.456 130 HD12 ILE 15 HD12 ILE 15 -15.620 1.793 7.523 131 HD13 ILE 15 HD13 ILE 15 -16.685 0.446 7.925 132 H LYS 16 HN LYS 16 -11.975 -2.238 7.809 133 HA LYS 16 HA LYS 16 -11.652 -3.394 10.373 134 HB2 LYS 16 HB2 LYS 16 -13.667 -4.569 8.713 135 HB3 LYS 16 HB1 LYS 16 -12.336 -5.708 8.871 136 HG2 LYS 16 HG2 LYS 16 -13.173 -4.428 11.377 137 HG3 LYS 16 HG1 LYS 16 -14.379 -5.475 10.627 138 HD2 LYS 16 HD2 LYS 16 -13.139 -7.358 10.945 139 HD3 LYS 16 HD1 LYS 16 -11.603 -6.503 10.789 140 HE2 LYS 16 HE2 LYS 16 -12.311 -5.407 13.047 141 HE3 LYS 16 HE1 LYS 16 -13.378 -6.805 13.175 142 HZ1 LYS 16 HZ1 LYS 16 -11.064 -6.977 14.191 143 HZ2 LYS 16 HZ2 LYS 16 -10.496 -7.121 12.604 144 HZ3 LYS 16 HZ3 LYS 16 -11.581 -8.263 13.219 145 H ALA 17 HN ALA 17 -9.696 -4.374 10.531 146 HA ALA 17 HA ALA 17 -7.951 -4.205 8.269 147 HB1 ALA 17 HB1 ALA 17 -7.544 -3.895 10.906 148 HB2 ALA 17 HB2 ALA 17 -6.258 -4.261 9.757 149 HB3 ALA 17 HB3 ALA 17 -6.991 -5.557 10.703 150 H ILE 18 HN ILE 18 -7.255 -5.798 6.966 151 HA ILE 18 HA ILE 18 -8.416 -8.450 7.323 152 HB ILE 18 HB ILE 18 -6.672 -7.727 4.999 153 HG12 ILE 18 HG12 ILE 18 -8.663 -6.024 5.629 154 HG13 ILE 18 HG11 ILE 18 -8.182 -6.378 3.980 155 HG21 ILE 18 HG21 ILE 18 -8.459 -9.194 3.878 156 HG22 ILE 18 HG22 ILE 18 -8.912 -9.637 5.524 157 HG23 ILE 18 HG23 ILE 18 -7.280 -9.962 4.940 158 HD11 ILE 18 HD11 ILE 18 -10.274 -8.069 5.241 159 HD12 ILE 18 HD12 ILE 18 -10.067 -7.597 3.555 160 HD13 ILE 18 HD13 ILE 18 -10.696 -6.437 4.726 161 H ASP 19 HN ASP 19 -5.243 -7.444 6.066 162 HA ASP 19 HA ASP 19 -3.925 -9.085 8.096 163 HB2 ASP 19 HB2 ASP 19 -4.147 -9.812 5.254 164 HB3 ASP 19 HB1 ASP 19 -2.503 -9.855 5.882 165 H GLY 20 HN GLY 20 -2.383 -8.125 5.101 166 HA2 GLY 20 HA2 GLY 20 -0.964 -6.006 6.589 167 HA3 GLY 20 HA1 GLY 20 -0.186 -7.035 5.391 168 H ASP 21 HN ASP 21 -0.646 -6.732 3.186 169 HA ASP 21 HA ASP 21 -1.071 -4.067 2.408 170 HB2 ASP 21 HB2 ASP 21 -1.234 -5.088 0.081 171 HB3 ASP 21 HB1 ASP 21 0.250 -5.417 0.969 172 H THR 22 HN THR 22 -3.217 -6.680 3.049 173 HA THR 22 HA THR 22 -5.418 -5.420 1.608 174 HB THR 22 HB THR 22 -6.559 -7.554 2.807 175 HG1 THR 22 HG1 THR 22 -3.901 -8.386 2.309 176 HG21 THR 22 HG21 THR 22 -6.762 -8.339 0.743 177 HG22 THR 22 HG22 THR 22 -5.016 -8.465 0.529 178 HG23 THR 22 HG23 THR 22 -5.831 -6.929 0.237 179 H VAL 23 HN VAL 23 -6.930 -4.247 2.539 180 HA VAL 23 HA VAL 23 -7.584 -4.490 5.341 181 HB VAL 23 HB VAL 23 -7.255 -2.056 5.783 182 HG11 VAL 23 HG11 VAL 23 -5.590 -3.999 6.298 183 HG12 VAL 23 HG12 VAL 23 -5.096 -2.323 6.539 184 HG13 VAL 23 HG13 VAL 23 -4.583 -3.194 5.094 185 HG21 VAL 23 HG21 VAL 23 -5.475 -2.060 3.359 186 HG22 VAL 23 HG22 VAL 23 -5.950 -0.690 4.363 187 HG23 VAL 23 HG23 VAL 23 -7.138 -1.474 3.322 188 H LYS 24 HN LYS 24 -9.645 -3.753 5.792 189 HA LYS 24 HA LYS 24 -11.268 -3.113 3.470 190 HB2 LYS 24 HB2 LYS 24 -12.001 -4.815 5.135 191 HB3 LYS 24 HB1 LYS 24 -12.127 -3.540 6.336 192 HG2 LYS 24 HG2 LYS 24 -14.302 -3.737 5.637 193 HG3 LYS 24 HG1 LYS 24 -13.717 -2.430 4.604 194 HD2 LYS 24 HD2 LYS 24 -14.923 -3.910 3.199 195 HD3 LYS 24 HD1 LYS 24 -13.214 -4.193 2.868 196 HE2 LYS 24 HE2 LYS 24 -14.539 -5.847 4.954 197 HE3 LYS 24 HE1 LYS 24 -14.909 -6.187 3.264 198 HZ1 LYS 24 HZ1 LYS 24 -13.026 -7.316 3.146 199 HZ2 LYS 24 HZ2 LYS 24 -12.627 -6.912 4.739 200 HZ3 LYS 24 HZ3 LYS 24 -12.148 -5.905 3.467 201 H LEU 25 HN LEU 25 -12.061 -1.151 2.988 202 HA LEU 25 HA LEU 25 -11.889 0.946 5.037 203 HB2 LEU 25 HB2 LEU 25 -10.858 0.927 2.263 204 HB3 LEU 25 HB1 LEU 25 -11.553 2.424 2.844 205 HG LEU 25 HG LEU 25 -9.882 1.802 4.899 206 HD11 LEU 25 HD11 LEU 25 -7.804 1.000 4.067 207 HD12 LEU 25 HD12 LEU 25 -8.398 1.003 2.407 208 HD13 LEU 25 HD13 LEU 25 -9.046 -0.150 3.573 209 HD21 LEU 25 HD21 LEU 25 -9.728 3.535 2.507 210 HD22 LEU 25 HD22 LEU 25 -8.242 3.316 3.431 211 HD23 LEU 25 HD23 LEU 25 -9.684 3.955 4.220 212 H MET 26 HN MET 26 -13.378 2.726 4.774 213 HA MET 26 HA MET 26 -15.948 1.803 3.799 214 HB2 MET 26 HB2 MET 26 -15.426 3.074 6.024 215 HB3 MET 26 HB1 MET 26 -15.486 4.507 5.008 216 HG2 MET 26 HG2 MET 26 -17.734 4.267 4.567 217 HG3 MET 26 HG1 MET 26 -17.728 2.542 4.928 218 HE1 MET 26 HE1 MET 26 -19.301 1.926 6.872 219 HE2 MET 26 HE2 MET 26 -20.068 3.298 6.071 220 HE3 MET 26 HE3 MET 26 -20.009 3.226 7.831 221 H TYR 27 HN TYR 27 -16.457 2.103 1.744 222 HA TYR 27 HA TYR 27 -15.761 4.670 0.478 223 HB2 TYR 27 HB2 TYR 27 -14.467 2.617 -0.350 224 HB3 TYR 27 HB1 TYR 27 -15.995 2.080 -1.039 225 HD1 TYR 27 HD1 TYR 27 -14.599 5.522 -0.868 226 HD2 TYR 27 HD2 TYR 27 -15.660 2.232 -3.346 227 HE1 TYR 27 HE1 TYR 27 -14.170 6.896 -2.863 228 HE2 TYR 27 HE2 TYR 27 -15.235 3.595 -5.348 229 HH TYR 27 HH TYR 27 -13.514 6.016 -5.596 230 H LYS 28 HN LYS 28 -17.511 5.817 0.013 231 HA LYS 28 HA LYS 28 -19.645 6.389 -0.523 232 HB2 LYS 28 HB2 LYS 28 -19.524 3.694 -1.878 233 HB3 LYS 28 HB1 LYS 28 -20.839 4.842 -2.083 234 HG2 LYS 28 HG2 LYS 28 -19.150 6.493 -2.917 235 HG3 LYS 28 HG1 LYS 28 -17.969 5.183 -2.903 236 HD2 LYS 28 HD2 LYS 28 -18.698 4.458 -4.875 237 HD3 LYS 28 HD1 LYS 28 -20.338 4.300 -4.243 238 HE2 LYS 28 HE2 LYS 28 -20.323 5.777 -6.164 239 HE3 LYS 28 HE1 LYS 28 -20.729 6.681 -4.706 240 HZ1 LYS 28 HZ1 LYS 28 -18.069 6.966 -4.791 241 HZ2 LYS 28 HZ2 LYS 28 -19.160 8.074 -5.453 242 HZ3 LYS 28 HZ3 LYS 28 -18.428 6.915 -6.444 243 H GLY 29 HN GLY 29 -19.339 5.437 2.029 244 HA2 GLY 29 HA2 GLY 29 -20.555 4.655 3.814 245 HA3 GLY 29 HA1 GLY 29 -21.962 4.762 2.766 246 H GLN 30 HN GLN 30 -19.362 2.785 1.696 247 HA GLN 30 HA GLN 30 -20.685 0.368 2.704 248 HB2 GLN 30 HB2 GLN 30 -20.956 -0.584 0.629 249 HB3 GLN 30 HB1 GLN 30 -21.203 1.107 0.220 250 HG2 GLN 30 HG2 GLN 30 -19.634 0.917 -1.318 251 HG3 GLN 30 HG1 GLN 30 -18.448 0.656 -0.043 252 HE21 GLN 30 HE21 GLN 30 -19.511 -0.542 -2.844 253 HE22 GLN 30 HE22 GLN 30 -19.143 -2.217 -2.635 254 HA PRO 31 HA PRO 31 -16.536 -0.894 3.480 255 HB2 PRO 31 HB2 PRO 31 -16.909 -3.441 4.094 256 HB3 PRO 31 HB1 PRO 31 -17.697 -2.169 5.043 257 HG2 PRO 31 HG2 PRO 31 -18.849 -3.896 2.884 258 HG3 PRO 31 HG1 PRO 31 -19.550 -3.448 4.451 259 HD2 PRO 31 HD2 PRO 31 -20.110 -2.189 2.045 260 HD3 PRO 31 HD1 PRO 31 -20.345 -1.464 3.648 261 H MET 32 HN MET 32 -14.993 -1.056 1.986 262 HA MET 32 HA MET 32 -15.245 -3.133 -0.084 263 HB2 MET 32 HB2 MET 32 -15.394 -0.653 -0.785 264 HB3 MET 32 HB1 MET 32 -13.670 -0.605 -0.465 265 HG2 MET 32 HG2 MET 32 -14.102 -2.873 -2.053 266 HG3 MET 32 HG1 MET 32 -15.056 -1.573 -2.758 267 HE1 MET 32 HE1 MET 32 -12.947 0.732 -4.360 268 HE2 MET 32 HE2 MET 32 -12.947 1.247 -2.674 269 HE3 MET 32 HE3 MET 32 -14.390 0.512 -3.371 270 H THR 33 HN THR 33 -13.354 -4.193 -0.738 271 HA THR 33 HA THR 33 -11.368 -4.425 1.363 272 HB THR 33 HB THR 33 -10.563 -6.150 -0.607 273 HG1 THR 33 HG1 THR 33 -12.175 -6.698 -1.833 274 HG21 THR 33 HG21 THR 33 -12.789 -6.974 1.202 275 HG22 THR 33 HG22 THR 33 -11.199 -6.570 1.853 276 HG23 THR 33 HG23 THR 33 -11.368 -7.881 0.686 277 H PHE 34 HN PHE 34 -9.687 -3.079 1.352 278 HA PHE 34 HA PHE 34 -8.674 -2.114 -1.221 279 HB2 PHE 34 HB2 PHE 34 -8.656 -1.012 1.552 280 HB3 PHE 34 HB1 PHE 34 -7.363 -0.540 0.450 281 HD1 PHE 34 HD1 PHE 34 -11.056 -0.622 0.828 282 HD2 PHE 34 HD2 PHE 34 -7.712 1.101 -1.170 283 HE1 PHE 34 HE1 PHE 34 -12.535 1.049 -0.208 284 HE2 PHE 34 HE2 PHE 34 -9.186 2.778 -2.201 285 HZ PHE 34 HZ PHE 34 -11.601 2.754 -1.721 286 H ARG 35 HN ARG 35 -6.477 -2.215 -1.756 287 HA ARG 35 HA ARG 35 -4.837 -3.941 -0.040 288 HB2 ARG 35 HB2 ARG 35 -4.299 -5.402 -1.749 289 HB3 ARG 35 HB1 ARG 35 -5.984 -5.045 -2.104 290 HG2 ARG 35 HG2 ARG 35 -5.082 -4.828 -4.180 291 HG3 ARG 35 HG1 ARG 35 -4.934 -3.166 -3.609 292 HD2 ARG 35 HD2 ARG 35 -2.704 -3.240 -3.671 293 HD3 ARG 35 HD1 ARG 35 -2.654 -4.807 -2.866 294 HE ARG 35 HE ARG 35 -2.518 -4.301 -5.694 295 HH11 ARG 35 HH11 ARG 35 -3.286 -6.656 -3.236 296 HH12 ARG 35 HH12 ARG 35 -3.023 -8.013 -4.278 297 HH21 ARG 35 HH21 ARG 35 -2.172 -6.085 -7.065 298 HH22 ARG 35 HH22 ARG 35 -2.389 -7.690 -6.452 299 H LEU 36 HN LEU 36 -2.627 -3.506 -0.013 300 HA LEU 36 HA LEU 36 -1.826 -0.874 -0.634 301 HB2 LEU 36 HB2 LEU 36 -0.277 -3.357 0.094 302 HB3 LEU 36 HB1 LEU 36 0.534 -1.847 -0.280 303 HG LEU 36 HG LEU 36 -1.435 -2.257 1.973 304 HD11 LEU 36 HD11 LEU 36 0.486 -2.045 3.429 305 HD12 LEU 36 HD12 LEU 36 1.551 -1.838 2.039 306 HD13 LEU 36 HD13 LEU 36 0.736 -3.380 2.303 307 HD21 LEU 36 HD21 LEU 36 -0.862 -0.025 2.667 308 HD22 LEU 36 HD22 LEU 36 -1.453 0.025 1.008 309 HD23 LEU 36 HD23 LEU 36 0.276 0.138 1.330 310 H LEU 37 HN LEU 37 -2.378 -0.594 -2.841 311 HA LEU 37 HA LEU 37 -1.865 -2.020 -5.031 312 HB2 LEU 37 HB2 LEU 37 -2.648 0.473 -4.683 313 HB3 LEU 37 HB1 LEU 37 -0.991 0.823 -5.139 314 HG LEU 37 HG LEU 37 -1.286 -0.272 -7.263 315 HD11 LEU 37 HD11 LEU 37 -3.545 -1.470 -5.950 316 HD12 LEU 37 HD12 LEU 37 -2.729 -1.942 -7.441 317 HD13 LEU 37 HD13 LEU 37 -4.019 -0.743 -7.485 318 HD21 LEU 37 HD21 LEU 37 -3.423 1.708 -6.536 319 HD22 LEU 37 HD22 LEU 37 -3.156 1.160 -8.191 320 HD23 LEU 37 HD23 LEU 37 -1.876 2.011 -7.324 321 H LEU 38 HN LEU 38 -0.246 -2.632 -6.317 322 HA LEU 38 HA LEU 38 1.836 -3.418 -6.776 323 HB2 LEU 38 HB2 LEU 38 3.435 -1.700 -7.351 324 HB3 LEU 38 HB1 LEU 38 1.826 -1.242 -7.874 325 HG LEU 38 HG LEU 38 2.801 -0.217 -5.249 326 HD11 LEU 38 HD11 LEU 38 4.679 0.134 -6.802 327 HD12 LEU 38 HD12 LEU 38 3.918 1.648 -6.310 328 HD13 LEU 38 HD13 LEU 38 3.588 0.973 -7.905 329 HD21 LEU 38 HD21 LEU 38 0.600 0.218 -6.991 330 HD22 LEU 38 HD22 LEU 38 1.537 1.709 -6.904 331 HD23 LEU 38 HD23 LEU 38 0.932 0.960 -5.428 332 H VAL 39 HN VAL 39 1.357 -4.019 -4.150 333 HA VAL 39 HA VAL 39 3.877 -3.335 -2.786 334 HB VAL 39 HB VAL 39 1.692 -2.842 -1.598 335 HG11 VAL 39 HG11 VAL 39 1.064 -5.435 -2.364 336 HG12 VAL 39 HG12 VAL 39 0.161 -4.432 -1.234 337 HG13 VAL 39 HG13 VAL 39 1.374 -5.559 -0.634 338 HG21 VAL 39 HG21 VAL 39 2.492 -3.891 0.566 339 HG22 VAL 39 HG22 VAL 39 3.657 -2.886 -0.294 340 HG23 VAL 39 HG23 VAL 39 3.771 -4.644 -0.387 341 H ASP 40 HN ASP 40 5.122 -5.001 -1.844 342 HA ASP 40 HA ASP 40 4.549 -7.682 -2.924 343 HB2 ASP 40 HB2 ASP 40 6.795 -6.148 -3.356 344 HB3 ASP 40 HB1 ASP 40 7.299 -7.200 -2.036 345 H THR 41 HN THR 41 4.260 -9.299 -1.536 346 HA THR 41 HA THR 41 4.652 -8.747 1.315 347 HB THR 41 HB THR 41 3.237 -10.924 1.490 348 HG1 THR 41 HG1 THR 41 3.485 -11.296 -0.843 349 HG21 THR 41 HG21 THR 41 2.176 -8.965 2.182 350 HG22 THR 41 HG22 THR 41 1.109 -9.645 0.953 351 HG23 THR 41 HG23 THR 41 2.166 -8.289 0.553 352 HA PRO 42 HA PRO 42 8.102 -11.418 1.869 353 HB2 PRO 42 HB2 PRO 42 6.576 -12.620 4.127 354 HB3 PRO 42 HB1 PRO 42 8.202 -11.927 4.110 355 HG2 PRO 42 HG2 PRO 42 6.166 -10.587 5.182 356 HG3 PRO 42 HG1 PRO 42 7.417 -9.748 4.245 357 HD2 PRO 42 HD2 PRO 42 4.630 -10.479 3.463 358 HD3 PRO 42 HD1 PRO 42 5.578 -9.036 3.050 359 H GLU 43 HN GLU 43 8.764 -13.452 1.299 360 HA GLU 43 HA GLU 43 6.921 -15.112 -0.078 361 HB2 GLU 43 HB2 GLU 43 9.776 -14.923 0.245 362 HB3 GLU 43 HB1 GLU 43 9.268 -16.597 0.415 363 HG2 GLU 43 HG2 GLU 43 7.859 -15.840 -1.774 364 HG3 GLU 43 HG1 GLU 43 9.319 -14.868 -1.946 365 H THR 44 HN THR 44 6.032 -17.066 0.458 366 HA THR 44 HA THR 44 6.563 -18.127 3.141 367 HB THR 44 HB THR 44 3.917 -18.602 2.987 368 HG1 THR 44 HG1 THR 44 2.862 -16.936 2.051 369 HG21 THR 44 HG21 THR 44 5.076 -17.502 4.864 370 HG22 THR 44 HG22 THR 44 3.519 -16.769 4.477 371 HG23 THR 44 HG23 THR 44 5.015 -15.983 3.972 372 H LYS 45 HN LYS 45 5.207 -20.295 3.347 373 HA LYS 45 HA LYS 45 5.067 -22.474 2.713 374 HB2 LYS 45 HB2 LYS 45 4.646 -21.414 -0.080 375 HB3 LYS 45 HB1 LYS 45 4.104 -22.954 0.571 376 HG2 LYS 45 HG2 LYS 45 2.967 -21.078 2.259 377 HG3 LYS 45 HG1 LYS 45 2.837 -20.355 0.654 378 HD2 LYS 45 HD2 LYS 45 2.142 -23.207 0.790 379 HD3 LYS 45 HD1 LYS 45 1.069 -22.137 1.693 380 HE2 LYS 45 HE2 LYS 45 1.763 -21.161 -0.977 381 HE3 LYS 45 HE1 LYS 45 0.880 -22.686 -0.980 382 HZ1 LYS 45 HZ1 LYS 45 -0.706 -20.951 -1.053 383 HZ2 LYS 45 HZ2 LYS 45 0.027 -20.113 0.220 384 HZ3 LYS 45 HZ3 LYS 45 -0.763 -21.579 0.518 385 H HIS 46 HN HIS 46 7.660 -20.936 2.446 386 HA HIS 46 HA HIS 46 9.299 -23.036 1.623 387 HB2 HIS 46 HB2 HIS 46 8.248 -22.006 -0.612 388 HB3 HIS 46 HB1 HIS 46 9.589 -20.883 -0.413 389 HD1 HIS 46 HD1 HIS 46 9.336 -24.674 -0.076 390 HD2 HIS 46 HD2 HIS 46 11.613 -21.754 -1.961 391 HE1 HIS 46 HE1 HIS 46 11.124 -25.921 -1.330 392 HE2 HIS 46 HE2 HIS 46 12.540 -24.130 -2.394 393 HA PRO 47 HA PRO 47 11.199 -19.519 4.011 394 HB2 PRO 47 HB2 PRO 47 12.094 -21.034 6.070 395 HB3 PRO 47 HB1 PRO 47 10.456 -20.372 6.012 396 HG2 PRO 47 HG2 PRO 47 11.409 -23.127 5.325 397 HG3 PRO 47 HG1 PRO 47 9.981 -22.638 6.257 398 HD2 PRO 47 HD2 PRO 47 9.838 -23.370 3.655 399 HD3 PRO 47 HD1 PRO 47 8.755 -22.155 4.364 400 H LYS 48 HN LYS 48 13.411 -19.081 4.364 401 HA LYS 48 HA LYS 48 15.252 -21.012 3.112 402 HB2 LYS 48 HB2 LYS 48 14.660 -18.569 2.107 403 HB3 LYS 48 HB1 LYS 48 16.020 -18.156 3.142 404 HG2 LYS 48 HG2 LYS 48 17.447 -19.695 1.987 405 HG3 LYS 48 HG1 LYS 48 16.088 -20.317 1.049 406 HD2 LYS 48 HD2 LYS 48 17.099 -18.851 -0.436 407 HD3 LYS 48 HD1 LYS 48 15.821 -17.859 0.270 408 HE2 LYS 48 HE2 LYS 48 17.422 -16.869 1.814 409 HE3 LYS 48 HE1 LYS 48 18.703 -17.889 1.159 410 HZ1 LYS 48 HZ1 LYS 48 18.545 -15.520 0.306 411 HZ2 LYS 48 HZ2 LYS 48 17.179 -16.024 -0.556 412 HZ3 LYS 48 HZ3 LYS 48 18.681 -16.743 -0.856 413 H LYS 49 HN LYS 49 16.486 -21.912 4.615 414 HA LYS 49 HA LYS 49 17.939 -22.169 6.344 415 HB2 LYS 49 HB2 LYS 49 18.544 -19.661 5.301 416 HB3 LYS 49 HB1 LYS 49 18.377 -19.375 7.027 417 HG2 LYS 49 HG2 LYS 49 20.101 -21.560 5.899 418 HG3 LYS 49 HG1 LYS 49 20.692 -19.927 6.210 419 HD2 LYS 49 HD2 LYS 49 21.183 -20.706 8.256 420 HD3 LYS 49 HD1 LYS 49 19.454 -20.538 8.566 421 HE2 LYS 49 HE2 LYS 49 19.204 -22.901 7.698 422 HE3 LYS 49 HE1 LYS 49 20.963 -23.014 7.757 423 HZ1 LYS 49 HZ1 LYS 49 19.057 -22.727 9.991 424 HZ2 LYS 49 HZ2 LYS 49 20.677 -22.277 10.177 425 HZ3 LYS 49 HZ3 LYS 49 20.283 -23.874 9.782 426 H GLY 50 HN GLY 50 14.977 -21.550 6.687 427 HA2 GLY 50 HA2 GLY 50 13.772 -21.952 8.689 428 HA3 GLY 50 HA1 GLY 50 15.117 -21.287 9.602 429 H VAL 51 HN VAL 51 12.018 -20.743 8.741 430 HA VAL 51 HA VAL 51 12.163 -17.962 9.519 431 HB VAL 51 HB VAL 51 10.877 -18.647 6.873 432 HG11 VAL 51 HG11 VAL 51 11.510 -15.879 7.757 433 HG12 VAL 51 HG12 VAL 51 10.110 -16.687 8.462 434 HG13 VAL 51 HG13 VAL 51 10.212 -16.465 6.716 435 HG21 VAL 51 HG21 VAL 51 13.507 -17.296 7.458 436 HG22 VAL 51 HG22 VAL 51 12.709 -17.278 5.885 437 HG23 VAL 51 HG23 VAL 51 13.252 -18.805 6.582 438 H GLU 52 HN GLU 52 9.776 -19.980 7.801 439 HA GLU 52 HA GLU 52 7.660 -20.617 8.321 440 HB2 GLU 52 HB2 GLU 52 8.650 -20.362 11.166 441 HB3 GLU 52 HB1 GLU 52 7.189 -21.202 10.661 442 HG2 GLU 52 HG2 GLU 52 8.389 -22.916 9.629 443 HG3 GLU 52 HG1 GLU 52 9.880 -21.974 9.597 444 H LYS 53 HN LYS 53 5.601 -19.863 9.063 445 HA LYS 53 HA LYS 53 4.023 -18.264 9.397 446 HB2 LYS 53 HB2 LYS 53 6.052 -16.800 11.076 447 HB3 LYS 53 HB1 LYS 53 4.300 -16.771 11.224 448 HG2 LYS 53 HG2 LYS 53 4.532 -18.294 12.819 449 HG3 LYS 53 HG1 LYS 53 4.931 -19.440 11.538 450 HD2 LYS 53 HD2 LYS 53 7.110 -19.494 12.098 451 HD3 LYS 53 HD1 LYS 53 7.173 -17.758 12.409 452 HE2 LYS 53 HE2 LYS 53 5.772 -18.368 14.520 453 HE3 LYS 53 HE1 LYS 53 6.405 -19.990 14.244 454 HZ1 LYS 53 HZ1 LYS 53 8.084 -17.558 14.537 455 HZ2 LYS 53 HZ2 LYS 53 8.632 -19.153 14.413 456 HZ3 LYS 53 HZ3 LYS 53 7.769 -18.660 15.782 457 H TYR 54 HN TYR 54 3.390 -16.083 8.856 458 HA TYR 54 HA TYR 54 4.607 -15.129 6.513 459 HB2 TYR 54 HB2 TYR 54 2.215 -14.687 7.857 460 HB3 TYR 54 HB1 TYR 54 3.014 -13.118 7.902 461 HD1 TYR 54 HD1 TYR 54 2.065 -15.845 5.545 462 HD2 TYR 54 HD2 TYR 54 2.881 -11.701 6.061 463 HE1 TYR 54 HE1 TYR 54 1.346 -15.421 3.232 464 HE2 TYR 54 HE2 TYR 54 2.163 -11.266 3.749 465 HH TYR 54 HH TYR 54 2.014 -13.321 1.452 466 H GLY 55 HN GLY 55 4.590 -12.300 6.893 467 HA2 GLY 55 HA2 GLY 55 7.073 -12.016 8.464 468 HA3 GLY 55 HA1 GLY 55 6.683 -11.066 7.039 469 HA PRO 56 HA PRO 56 4.008 -9.718 11.062 470 HB2 PRO 56 HB2 PRO 56 6.519 -9.700 12.679 471 HB3 PRO 56 HB1 PRO 56 4.853 -9.987 13.193 472 HG2 PRO 56 HG2 PRO 56 6.554 -12.015 12.917 473 HG3 PRO 56 HG1 PRO 56 4.856 -12.180 12.437 474 HD2 PRO 56 HD2 PRO 56 7.285 -11.870 10.742 475 HD3 PRO 56 HD1 PRO 56 5.782 -12.757 10.416 476 H GLU 57 HN GLU 57 7.383 -8.952 10.313 477 HA GLU 57 HA GLU 57 7.487 -6.302 11.075 478 HB2 GLU 57 HB2 GLU 57 8.945 -8.024 9.218 479 HB3 GLU 57 HB1 GLU 57 8.948 -6.337 8.728 480 HG2 GLU 57 HG2 GLU 57 10.619 -6.005 10.132 481 HG3 GLU 57 HG1 GLU 57 9.493 -6.293 11.458 482 H ALA 58 HN ALA 58 6.375 -7.628 7.970 483 HA ALA 58 HA ALA 58 5.649 -5.028 6.966 484 HB1 ALA 58 HB1 ALA 58 4.915 -7.715 5.822 485 HB2 ALA 58 HB2 ALA 58 6.450 -6.901 5.522 486 HB3 ALA 58 HB3 ALA 58 4.940 -6.162 4.988 487 H SER 59 HN SER 59 3.809 -7.960 7.833 488 HA SER 59 HA SER 59 1.255 -6.940 7.484 489 HB2 SER 59 HB2 SER 59 2.255 -9.339 8.272 490 HB3 SER 59 HB1 SER 59 1.585 -8.753 9.795 491 HG SER 59 HG SER 59 -0.210 -9.500 8.983 492 H ALA 60 HN ALA 60 3.242 -6.928 10.435 493 HA ALA 60 HA ALA 60 1.345 -5.645 12.071 494 HB1 ALA 60 HB1 ALA 60 3.021 -5.490 13.686 495 HB2 ALA 60 HB2 ALA 60 4.303 -5.388 12.479 496 HB3 ALA 60 HB3 ALA 60 3.466 -6.917 12.747 497 H PHE 61 HN PHE 61 4.218 -4.310 10.422 498 HA PHE 61 HA PHE 61 3.949 -1.672 11.159 499 HB2 PHE 61 HB2 PHE 61 5.875 -2.596 9.917 500 HB3 PHE 61 HB1 PHE 61 4.880 -2.684 8.468 501 HD1 PHE 61 HD1 PHE 61 6.445 -0.395 10.887 502 HD2 PHE 61 HD2 PHE 61 4.472 -0.776 7.139 503 HE1 PHE 61 HE1 PHE 61 7.060 1.926 10.332 504 HE2 PHE 61 HE2 PHE 61 5.078 1.539 6.573 505 HZ PHE 61 HZ PHE 61 6.377 2.894 8.171 506 H THR 62 HN THR 62 2.636 -3.172 8.199 507 HA THR 62 HA THR 62 1.362 -0.969 7.134 508 HB THR 62 HB THR 62 0.385 -3.833 7.096 509 HG1 THR 62 HG1 THR 62 2.387 -3.827 6.226 510 HG21 THR 62 HG21 THR 62 -0.335 -1.456 5.432 511 HG22 THR 62 HG22 THR 62 -1.391 -2.639 6.205 512 HG23 THR 62 HG23 THR 62 -0.443 -3.094 4.790 513 H LYS 63 HN LYS 63 0.134 -3.265 9.534 514 HA LYS 63 HA LYS 63 -2.401 -1.951 9.803 515 HB2 LYS 63 HB2 LYS 63 -1.723 -4.423 10.325 516 HB3 LYS 63 HB1 LYS 63 -1.252 -3.771 11.888 517 HG2 LYS 63 HG2 LYS 63 -3.810 -2.750 11.354 518 HG3 LYS 63 HG1 LYS 63 -3.855 -4.454 10.910 519 HD2 LYS 63 HD2 LYS 63 -4.475 -3.984 13.281 520 HD3 LYS 63 HD1 LYS 63 -3.137 -5.118 13.091 521 HE2 LYS 63 HE2 LYS 63 -1.582 -3.617 13.886 522 HE3 LYS 63 HE1 LYS 63 -2.544 -2.214 13.427 523 HZ1 LYS 63 HZ1 LYS 63 -4.027 -2.626 15.244 524 HZ2 LYS 63 HZ2 LYS 63 -2.446 -2.584 15.845 525 HZ3 LYS 63 HZ3 LYS 63 -3.232 -4.067 15.640 526 H LYS 64 HN LYS 64 0.734 -1.668 11.244 527 HA LYS 64 HA LYS 64 0.058 -0.383 13.647 528 HB2 LYS 64 HB2 LYS 64 2.350 -1.320 12.583 529 HB3 LYS 64 HB1 LYS 64 2.578 0.400 12.302 530 HG2 LYS 64 HG2 LYS 64 2.026 -0.890 14.966 531 HG3 LYS 64 HG1 LYS 64 3.593 -0.311 14.394 532 HD2 LYS 64 HD2 LYS 64 2.710 1.964 14.263 533 HD3 LYS 64 HD1 LYS 64 1.134 1.389 14.809 534 HE2 LYS 64 HE2 LYS 64 3.518 0.793 16.485 535 HE3 LYS 64 HE1 LYS 64 2.885 2.439 16.486 536 HZ1 LYS 64 HZ1 LYS 64 1.049 0.176 16.894 537 HZ2 LYS 64 HZ2 LYS 64 0.913 1.775 17.429 538 HZ3 LYS 64 HZ3 LYS 64 1.999 0.720 18.185 539 H MET 65 HN MET 65 0.854 0.933 10.446 540 HA MET 65 HA MET 65 0.626 3.641 11.308 541 HB2 MET 65 HB2 MET 65 1.229 2.231 8.792 542 HB3 MET 65 HB1 MET 65 0.492 3.817 8.610 543 HG2 MET 65 HG2 MET 65 2.761 3.585 10.495 544 HG3 MET 65 HG1 MET 65 3.116 3.459 8.773 545 HE1 MET 65 HE1 MET 65 2.780 5.210 7.057 546 HE2 MET 65 HE2 MET 65 4.246 5.675 7.918 547 HE3 MET 65 HE3 MET 65 3.061 6.901 7.471 548 H VAL 66 HN VAL 66 -1.388 1.609 9.169 549 HA VAL 66 HA VAL 66 -3.368 3.511 8.682 550 HB VAL 66 HB VAL 66 -4.867 1.532 8.215 551 HG11 VAL 66 HG11 VAL 66 -3.605 0.853 6.225 552 HG12 VAL 66 HG12 VAL 66 -2.155 1.597 6.896 553 HG13 VAL 66 HG13 VAL 66 -3.545 2.598 6.473 554 HG21 VAL 66 HG21 VAL 66 -3.061 -0.540 8.024 555 HG22 VAL 66 HG22 VAL 66 -4.318 -0.371 9.248 556 HG23 VAL 66 HG23 VAL 66 -2.680 0.185 9.584 557 H GLU 67 HN GLU 67 -3.143 1.109 11.283 558 HA GLU 67 HA GLU 67 -5.704 1.697 12.357 559 HB2 GLU 67 HB2 GLU 67 -3.319 0.328 13.601 560 HB3 GLU 67 HB1 GLU 67 -4.926 0.382 14.313 561 HG2 GLU 67 HG2 GLU 67 -4.269 -0.836 11.641 562 HG3 GLU 67 HG1 GLU 67 -4.446 -1.734 13.149 563 H ASN 68 HN ASN 68 -2.408 2.644 13.316 564 HA ASN 68 HA ASN 68 -3.208 4.186 15.545 565 HB2 ASN 68 HB2 ASN 68 -0.711 4.075 13.881 566 HB3 ASN 68 HB1 ASN 68 -0.902 5.315 15.115 567 HD21 ASN 68 HD21 ASN 68 -1.382 1.818 14.747 568 HD22 ASN 68 HD22 ASN 68 -0.691 1.392 16.271 569 H ALA 69 HN ALA 69 -2.945 4.885 12.137 570 HA ALA 69 HA ALA 69 -3.095 7.722 12.383 571 HB1 ALA 69 HB1 ALA 69 -2.210 7.181 10.357 572 HB2 ALA 69 HB2 ALA 69 -3.896 7.374 9.880 573 HB3 ALA 69 HB3 ALA 69 -3.238 5.762 10.161 574 H LYS 70 HN LYS 70 -4.810 8.732 13.191 575 HA LYS 70 HA LYS 70 -7.370 7.658 13.476 576 HB2 LYS 70 HB2 LYS 70 -6.069 10.203 13.947 577 HB3 LYS 70 HB1 LYS 70 -7.706 10.437 13.354 578 HG2 LYS 70 HG2 LYS 70 -7.669 8.390 15.366 579 HG3 LYS 70 HG1 LYS 70 -6.897 9.858 15.967 580 HD2 LYS 70 HD2 LYS 70 -9.457 10.150 14.490 581 HD3 LYS 70 HD1 LYS 70 -9.524 9.473 16.118 582 HE2 LYS 70 HE2 LYS 70 -9.057 11.444 17.082 583 HE3 LYS 70 HE1 LYS 70 -7.824 11.843 15.887 584 HZ1 LYS 70 HZ1 LYS 70 -10.705 12.403 15.842 585 HZ2 LYS 70 HZ2 LYS 70 -9.895 12.200 14.372 586 HZ3 LYS 70 HZ3 LYS 70 -9.407 13.413 15.443 587 H LYS 71 HN LYS 71 -5.860 9.229 10.781 588 HA LYS 71 HA LYS 71 -8.384 9.006 9.282 589 HB2 LYS 71 HB2 LYS 71 -7.383 11.392 9.886 590 HB3 LYS 71 HB1 LYS 71 -6.377 11.057 8.484 591 HG2 LYS 71 HG2 LYS 71 -8.590 10.538 7.283 592 HG3 LYS 71 HG1 LYS 71 -9.346 11.392 8.629 593 HD2 LYS 71 HD2 LYS 71 -7.120 12.565 6.975 594 HD3 LYS 71 HD1 LYS 71 -8.827 12.788 6.590 595 HE2 LYS 71 HE2 LYS 71 -7.579 13.520 9.234 596 HE3 LYS 71 HE1 LYS 71 -7.806 14.655 7.903 597 HZ1 LYS 71 HZ1 LYS 71 -9.888 13.266 9.486 598 HZ2 LYS 71 HZ2 LYS 71 -10.230 14.030 8.017 599 HZ3 LYS 71 HZ3 LYS 71 -9.640 14.932 9.320 600 H ILE 72 HN ILE 72 -8.270 8.101 7.283 601 HA ILE 72 HA ILE 72 -5.604 7.306 6.317 602 HB ILE 72 HB ILE 72 -8.062 5.656 5.843 603 HG12 ILE 72 HG12 ILE 72 -6.111 5.358 8.138 604 HG13 ILE 72 HG11 ILE 72 -7.793 5.857 8.280 605 HG21 ILE 72 HG21 ILE 72 -5.772 5.494 4.589 606 HG22 ILE 72 HG22 ILE 72 -6.642 4.035 5.066 607 HG23 ILE 72 HG23 ILE 72 -5.283 4.607 6.034 608 HD11 ILE 72 HD11 ILE 72 -8.584 3.726 7.728 609 HD12 ILE 72 HD12 ILE 72 -7.234 3.443 8.829 610 HD13 ILE 72 HD13 ILE 72 -7.020 3.217 7.093 611 H GLU 73 HN GLU 73 -5.257 7.381 4.116 612 HA GLU 73 HA GLU 73 -7.445 8.496 2.485 613 HB2 GLU 73 HB2 GLU 73 -4.581 9.263 2.015 614 HB3 GLU 73 HB1 GLU 73 -6.043 10.086 1.491 615 HG2 GLU 73 HG2 GLU 73 -6.444 10.441 4.029 616 HG3 GLU 73 HG1 GLU 73 -4.719 10.102 4.164 617 H VAL 74 HN VAL 74 -7.658 7.709 0.424 618 HA VAL 74 HA VAL 74 -5.689 5.699 -0.426 619 HB VAL 74 HB VAL 74 -7.703 4.554 -1.543 620 HG11 VAL 74 HG11 VAL 74 -8.257 3.672 0.988 621 HG12 VAL 74 HG12 VAL 74 -6.654 4.386 1.173 622 HG13 VAL 74 HG13 VAL 74 -6.922 3.118 -0.022 623 HG21 VAL 74 HG21 VAL 74 -9.820 5.054 -0.921 624 HG22 VAL 74 HG22 VAL 74 -9.114 6.640 -0.609 625 HG23 VAL 74 HG23 VAL 74 -9.347 5.503 0.718 626 H GLU 75 HN GLU 75 -5.135 5.648 -2.543 627 HA GLU 75 HA GLU 75 -6.495 7.542 -4.345 628 HB2 GLU 75 HB2 GLU 75 -4.370 8.512 -3.632 629 HB3 GLU 75 HB1 GLU 75 -3.520 7.052 -4.119 630 HG2 GLU 75 HG2 GLU 75 -3.609 7.564 -6.325 631 HG3 GLU 75 HG1 GLU 75 -5.139 8.425 -6.179 632 H PHE 76 HN PHE 76 -7.507 6.327 -5.819 633 HA PHE 76 HA PHE 76 -6.646 3.707 -6.533 634 HB2 PHE 76 HB2 PHE 76 -8.802 5.529 -7.595 635 HB3 PHE 76 HB1 PHE 76 -8.491 3.937 -8.276 636 HD1 PHE 76 HD2 PHE 76 -8.093 2.185 -6.084 637 HD2 PHE 76 HD1 PHE 76 -10.725 5.520 -6.361 638 HE1 PHE 76 HE2 PHE 76 -9.550 1.173 -4.379 639 HE2 PHE 76 HE1 PHE 76 -12.185 4.513 -4.656 640 HZ PHE 76 HZ PHE 76 -11.599 2.336 -3.664 641 H ASP 77 HN ASP 77 -6.100 2.999 -8.642 642 HA ASP 77 HA ASP 77 -4.050 4.530 -9.844 643 HB2 ASP 77 HB2 ASP 77 -3.902 2.710 -11.474 644 HB3 ASP 77 HB1 ASP 77 -4.047 2.069 -9.841 645 H LYS 78 HN LYS 78 -4.294 4.258 -12.549 646 HA LYS 78 HA LYS 78 -6.413 6.199 -13.133 647 HB2 LYS 78 HB2 LYS 78 -4.397 5.640 -15.212 648 HB3 LYS 78 HB1 LYS 78 -5.026 7.176 -14.636 649 HG2 LYS 78 HG2 LYS 78 -2.883 5.499 -13.351 650 HG3 LYS 78 HG1 LYS 78 -2.684 7.060 -14.148 651 HD2 LYS 78 HD2 LYS 78 -4.547 7.701 -12.310 652 HD3 LYS 78 HD1 LYS 78 -3.693 6.417 -11.451 653 HE2 LYS 78 HE2 LYS 78 -2.601 8.418 -10.852 654 HE3 LYS 78 HE1 LYS 78 -1.554 7.643 -12.041 655 HZ1 LYS 78 HZ1 LYS 78 -1.594 9.682 -12.955 656 HZ2 LYS 78 HZ2 LYS 78 -3.060 10.118 -12.231 657 HZ3 LYS 78 HZ3 LYS 78 -3.057 9.157 -13.624 658 H GLY 79 HN GLY 79 -5.411 2.963 -13.798 659 HA2 GLY 79 HA2 GLY 79 -7.250 2.777 -16.080 660 HA3 GLY 79 HA1 GLY 79 -6.040 1.584 -15.639 661 H GLN 80 HN GLN 80 -6.651 -0.139 -14.487 662 HA GLN 80 HA GLN 80 -9.199 -0.994 -14.241 663 HB2 GLN 80 HB2 GLN 80 -6.749 -1.988 -13.563 664 HB3 GLN 80 HB1 GLN 80 -7.520 -1.856 -11.990 665 HG2 GLN 80 HG2 GLN 80 -9.265 -3.281 -12.601 666 HG3 GLN 80 HG1 GLN 80 -8.849 -3.181 -14.313 667 HE21 GLN 80 HE21 GLN 80 -7.950 -4.953 -15.056 668 HE22 GLN 80 HE22 GLN 80 -6.916 -6.024 -14.180 669 H ARG 81 HN ARG 81 -7.527 -0.247 -11.214 670 HA ARG 81 HA ARG 81 -8.122 1.107 -9.448 671 HB2 ARG 81 HB2 ARG 81 -10.811 1.482 -10.765 672 HB3 ARG 81 HB1 ARG 81 -10.175 2.377 -9.395 673 HG2 ARG 81 HG2 ARG 81 -8.249 2.873 -11.202 674 HG3 ARG 81 HG1 ARG 81 -9.640 2.685 -12.272 675 HD2 ARG 81 HD2 ARG 81 -10.150 4.321 -9.895 676 HD3 ARG 81 HD1 ARG 81 -8.946 4.991 -10.994 677 HE ARG 81 HE ARG 81 -11.081 4.219 -12.565 678 HH11 ARG 81 HH11 ARG 81 -10.525 6.451 -9.941 679 HH12 ARG 81 HH12 ARG 81 -11.750 7.560 -10.457 680 HH21 ARG 81 HH21 ARG 81 -12.693 5.676 -13.247 681 HH22 ARG 81 HH22 ARG 81 -12.983 7.119 -12.335 682 H THR 82 HN THR 82 -9.815 -1.587 -10.667 683 HA THR 82 HA THR 82 -10.183 -2.657 -8.055 684 HB THR 82 HB THR 82 -12.745 -3.032 -8.627 685 HG1 THR 82 HG1 THR 82 -12.467 -1.746 -10.598 686 HG21 THR 82 HG21 THR 82 -13.326 -1.479 -7.049 687 HG22 THR 82 HG22 THR 82 -12.124 -0.310 -7.599 688 HG23 THR 82 HG23 THR 82 -11.619 -1.729 -6.681 689 H ASP 83 HN ASP 83 -9.586 -4.685 -8.323 690 HA ASP 83 HA ASP 83 -9.571 -5.965 -10.865 691 HB2 ASP 83 HB2 ASP 83 -8.178 -6.323 -8.555 692 HB3 ASP 83 HB1 ASP 83 -9.305 -7.675 -8.475 693 H LYS 84 HN LYS 84 -10.336 -8.485 -10.618 694 HA LYS 84 HA LYS 84 -12.998 -8.584 -11.195 695 HB2 LYS 84 HB2 LYS 84 -12.705 -11.026 -10.029 696 HB3 LYS 84 HB1 LYS 84 -12.220 -10.639 -11.674 697 HG2 LYS 84 HG2 LYS 84 -10.227 -10.105 -9.562 698 HG3 LYS 84 HG1 LYS 84 -10.610 -11.798 -9.872 699 HD2 LYS 84 HD2 LYS 84 -9.751 -9.793 -11.959 700 HD3 LYS 84 HD1 LYS 84 -8.709 -11.013 -11.224 701 HE2 LYS 84 HE2 LYS 84 -10.756 -12.558 -12.065 702 HE3 LYS 84 HE1 LYS 84 -10.798 -11.288 -13.286 703 HZ1 LYS 84 HZ1 LYS 84 -9.328 -12.784 -14.188 704 HZ2 LYS 84 HZ2 LYS 84 -8.664 -13.224 -12.696 705 HZ3 LYS 84 HZ3 LYS 84 -8.264 -11.735 -13.392 706 H TYR 85 HN TYR 85 -11.682 -9.607 -8.043 707 HA TYR 85 HA TYR 85 -14.196 -9.814 -6.804 708 HB2 TYR 85 HB2 TYR 85 -11.404 -10.071 -6.036 709 HB3 TYR 85 HB1 TYR 85 -12.360 -9.328 -4.761 710 HD1 TYR 85 HD1 TYR 85 -12.586 -12.193 -7.140 711 HD2 TYR 85 HD2 TYR 85 -13.341 -10.733 -3.221 712 HE1 TYR 85 HE1 TYR 85 -13.405 -14.417 -6.479 713 HE2 TYR 85 HE2 TYR 85 -14.162 -12.950 -2.544 714 HH TYR 85 HH TYR 85 -14.816 -15.436 -4.808 715 H GLY 86 HN GLY 86 -12.467 -7.094 -7.739 716 HA2 GLY 86 HA2 GLY 86 -13.246 -4.887 -7.548 717 HA3 GLY 86 HA1 GLY 86 -14.244 -5.380 -6.186 718 H ARG 87 HN ARG 87 -10.954 -6.403 -6.229 719 HA ARG 87 HA ARG 87 -10.268 -5.448 -3.753 720 HB2 ARG 87 HB2 ARG 87 -8.992 -6.969 -5.496 721 HB3 ARG 87 HB1 ARG 87 -8.163 -5.467 -5.869 722 HG2 ARG 87 HG2 ARG 87 -6.789 -5.889 -4.186 723 HG3 ARG 87 HG1 ARG 87 -8.145 -5.633 -3.086 724 HD2 ARG 87 HD2 ARG 87 -7.204 -8.231 -4.281 725 HD3 ARG 87 HD1 ARG 87 -7.196 -7.765 -2.583 726 HE ARG 87 HE ARG 87 -9.558 -8.478 -4.176 727 HH11 ARG 87 HH11 ARG 87 -8.118 -7.765 -1.067 728 HH12 ARG 87 HH12 ARG 87 -9.479 -8.344 -0.171 729 HH21 ARG 87 HH21 ARG 87 -11.344 -9.229 -2.989 730 HH22 ARG 87 HH22 ARG 87 -11.311 -9.170 -1.259 731 H GLY 88 HN GLY 88 -8.899 -3.693 -3.043 732 HA2 GLY 88 HA2 GLY 88 -9.598 -1.219 -4.392 733 HA3 GLY 88 HA1 GLY 88 -8.857 -1.363 -2.812 734 H LEU 89 HN LEU 89 -8.350 -0.923 -6.168 735 HA LEU 89 HA LEU 89 -5.506 -1.363 -6.082 736 HB2 LEU 89 HB2 LEU 89 -7.385 -0.296 -8.171 737 HB3 LEU 89 HB1 LEU 89 -5.649 -0.326 -8.408 738 HG LEU 89 HG LEU 89 -7.011 -2.242 -9.394 739 HD11 LEU 89 HD11 LEU 89 -5.242 -3.786 -9.093 740 HD12 LEU 89 HD12 LEU 89 -4.791 -3.067 -7.546 741 HD13 LEU 89 HD13 LEU 89 -4.524 -2.176 -9.045 742 HD21 LEU 89 HD21 LEU 89 -8.352 -2.545 -7.273 743 HD22 LEU 89 HD22 LEU 89 -6.918 -3.313 -6.590 744 HD23 LEU 89 HD23 LEU 89 -7.705 -4.015 -8.004 745 H ALA 90 HN ALA 90 -5.528 0.240 -4.148 746 HA ALA 90 HA ALA 90 -4.596 2.797 -5.193 747 HB1 ALA 90 HB1 ALA 90 -5.878 4.025 -3.425 748 HB2 ALA 90 HB2 ALA 90 -6.784 2.540 -3.141 749 HB3 ALA 90 HB3 ALA 90 -6.866 3.337 -4.711 750 H TYR 91 HN TYR 91 -3.782 4.169 -3.240 751 HA TYR 91 HA TYR 91 -2.112 2.395 -1.603 752 HB2 TYR 91 HB2 TYR 91 -1.659 5.346 -2.013 753 HB3 TYR 91 HB1 TYR 91 -0.505 4.134 -1.476 754 HD1 TYR 91 HD2 TYR 91 -2.578 5.066 -4.437 755 HD2 TYR 91 HD1 TYR 91 0.976 3.216 -3.008 756 HE1 TYR 91 HE2 TYR 91 -1.793 4.802 -6.751 757 HE2 TYR 91 HE1 TYR 91 1.774 2.950 -5.318 758 HH TYR 91 HH TYR 91 0.062 4.363 -8.033 759 H ILE 92 HN ILE 92 -2.249 2.433 0.588 760 HA ILE 92 HA ILE 92 -4.378 4.069 1.750 761 HB ILE 92 HB ILE 92 -2.792 1.823 3.001 762 HG12 ILE 92 HG12 ILE 92 -5.475 1.072 2.633 763 HG13 ILE 92 HG11 ILE 92 -4.991 1.827 1.119 764 HG21 ILE 92 HG21 ILE 92 -3.757 3.429 4.609 765 HG22 ILE 92 HG22 ILE 92 -4.481 1.824 4.728 766 HG23 ILE 92 HG23 ILE 92 -5.351 3.125 3.915 767 HD11 ILE 92 HD11 ILE 92 -4.651 -0.748 1.594 768 HD12 ILE 92 HD12 ILE 92 -3.146 -0.159 2.302 769 HD13 ILE 92 HD13 ILE 92 -3.519 0.183 0.612 770 H TYR 93 HN TYR 93 -3.987 5.855 2.850 771 HA TYR 93 HA TYR 93 -1.239 6.448 3.684 772 HB2 TYR 93 HB2 TYR 93 -3.632 8.288 3.466 773 HB3 TYR 93 HB1 TYR 93 -2.000 8.779 3.880 774 HD1 TYR 93 HD2 TYR 93 -2.871 6.370 1.189 775 HD2 TYR 93 HD1 TYR 93 -1.635 10.325 2.143 776 HE1 TYR 93 HE2 TYR 93 -2.432 6.792 -1.182 777 HE2 TYR 93 HE1 TYR 93 -1.182 10.757 -0.233 778 HH TYR 93 HH TYR 93 -0.609 9.303 -2.294 779 H ALA 94 HN ALA 94 -0.843 7.390 5.766 780 HA ALA 94 HA ALA 94 -2.932 6.960 7.776 781 HB1 ALA 94 HB1 ALA 94 -0.204 5.722 7.748 782 HB2 ALA 94 HB2 ALA 94 -1.767 4.965 8.056 783 HB3 ALA 94 HB3 ALA 94 -1.047 6.026 9.267 784 H ASP 95 HN ASP 95 -3.216 8.854 8.744 785 HA ASP 95 HA ASP 95 -2.804 10.801 9.845 786 HB2 ASP 95 HB2 ASP 95 -0.907 9.196 10.816 787 HB3 ASP 95 HB1 ASP 95 0.135 10.340 9.975 788 H GLY 96 HN GLY 96 -2.097 10.270 6.822 789 HA2 GLY 96 HA2 GLY 96 -2.053 12.151 5.304 790 HA3 GLY 96 HA1 GLY 96 -0.975 12.965 6.425 791 H LYS 97 HN LYS 97 -0.214 9.685 6.049 792 HA LYS 97 HA LYS 97 1.739 10.298 3.946 793 HB2 LYS 97 HB2 LYS 97 2.220 9.303 6.702 794 HB3 LYS 97 HB1 LYS 97 3.179 8.583 5.416 795 HG2 LYS 97 HG2 LYS 97 3.876 10.865 4.734 796 HG3 LYS 97 HG1 LYS 97 3.023 11.496 6.144 797 HD2 LYS 97 HD2 LYS 97 5.140 9.377 6.382 798 HD3 LYS 97 HD1 LYS 97 5.538 11.097 6.371 799 HE2 LYS 97 HE2 LYS 97 5.001 11.269 8.518 800 HE3 LYS 97 HE1 LYS 97 3.386 10.640 8.197 801 HZ1 LYS 97 HZ1 LYS 97 5.816 9.158 8.983 802 HZ2 LYS 97 HZ2 LYS 97 4.522 8.370 8.230 803 HZ3 LYS 97 HZ3 LYS 97 4.288 9.151 9.711 804 H MET 98 HN MET 98 1.903 8.784 2.389 805 HA MET 98 HA MET 98 0.051 6.661 2.277 806 HB2 MET 98 HB2 MET 98 2.436 6.372 0.563 807 HB3 MET 98 HB1 MET 98 0.728 6.328 0.148 808 HG2 MET 98 HG2 MET 98 0.675 8.798 0.308 809 HG3 MET 98 HG1 MET 98 2.413 8.782 0.592 810 HE1 MET 98 HE1 MET 98 -0.099 6.951 -1.543 811 HE2 MET 98 HE2 MET 98 1.259 6.018 -2.174 812 HE3 MET 98 HE3 MET 98 0.429 7.179 -3.210 813 H VAL 99 HN VAL 99 0.095 4.947 3.535 814 HA VAL 99 HA VAL 99 2.304 4.001 4.964 815 HB VAL 99 HB VAL 99 -0.095 2.358 4.151 816 HG11 VAL 99 HG11 VAL 99 0.550 0.827 5.661 817 HG12 VAL 99 HG12 VAL 99 1.092 2.046 6.814 818 HG13 VAL 99 HG13 VAL 99 2.141 1.565 5.480 819 HG21 VAL 99 HG21 VAL 99 -1.022 3.148 6.367 820 HG22 VAL 99 HG22 VAL 99 -0.988 4.349 5.076 821 HG23 VAL 99 HG23 VAL 99 0.233 4.387 6.350 822 H ASN 100 HN ASN 100 1.199 3.303 1.734 823 HA ASN 100 HA ASN 100 2.546 0.878 1.291 824 HB2 ASN 100 HB2 ASN 100 2.157 2.972 -0.841 825 HB3 ASN 100 HB1 ASN 100 2.141 1.221 -1.013 826 HD21 ASN 100 HD21 ASN 100 0.222 0.365 -1.270 827 HD22 ASN 100 HD22 ASN 100 -1.272 1.010 -0.696 828 H GLU 101 HN GLU 101 3.542 4.203 0.474 829 HA GLU 101 HA GLU 101 6.051 3.646 -0.547 830 HB2 GLU 101 HB2 GLU 101 4.760 5.885 -0.388 831 HB3 GLU 101 HB1 GLU 101 5.563 6.065 1.165 832 HG2 GLU 101 HG2 GLU 101 7.590 5.372 -0.608 833 HG3 GLU 101 HG1 GLU 101 6.577 6.508 -1.494 834 H ALA 102 HN ALA 102 5.052 4.029 2.811 835 HA ALA 102 HA ALA 102 7.581 4.102 4.003 836 HB1 ALA 102 HB1 ALA 102 6.460 3.446 6.055 837 HB2 ALA 102 HB2 ALA 102 5.043 2.935 5.139 838 HB3 ALA 102 HB3 ALA 102 5.497 4.639 5.183 839 H LEU 103 HN LEU 103 5.408 1.288 3.654 840 HA LEU 103 HA LEU 103 7.179 -0.635 4.606 841 HB2 LEU 103 HB2 LEU 103 4.800 -0.705 2.804 842 HB3 LEU 103 HB1 LEU 103 5.782 -2.150 2.963 843 HG LEU 103 HG LEU 103 5.363 -1.418 5.585 844 HD11 LEU 103 HD11 LEU 103 3.748 0.239 5.177 845 HD12 LEU 103 HD12 LEU 103 2.832 -1.196 5.639 846 HD13 LEU 103 HD13 LEU 103 2.945 -0.730 3.941 847 HD21 LEU 103 HD21 LEU 103 3.431 -3.236 4.228 848 HD22 LEU 103 HD22 LEU 103 4.289 -3.439 5.757 849 HD23 LEU 103 HD23 LEU 103 5.147 -3.646 4.230 850 H VAL 104 HN VAL 104 6.732 0.648 1.355 851 HA VAL 104 HA VAL 104 8.487 -1.153 0.054 852 HB VAL 104 HB VAL 104 7.786 1.647 -0.827 853 HG11 VAL 104 HG11 VAL 104 9.399 1.019 -2.313 854 HG12 VAL 104 HG12 VAL 104 7.990 0.301 -3.096 855 HG13 VAL 104 HG13 VAL 104 9.063 -0.703 -2.121 856 HG21 VAL 104 HG21 VAL 104 6.052 -0.550 -0.407 857 HG22 VAL 104 HG22 VAL 104 6.239 -0.351 -2.150 858 HG23 VAL 104 HG23 VAL 104 5.689 1.002 -1.162 859 H ARG 105 HN ARG 105 8.930 2.080 1.431 860 HA ARG 105 HA ARG 105 11.681 2.216 0.630 861 HB2 ARG 105 HB2 ARG 105 11.717 4.365 1.547 862 HB3 ARG 105 HB1 ARG 105 10.072 4.178 0.963 863 HG2 ARG 105 HG2 ARG 105 9.342 4.765 2.965 864 HG3 ARG 105 HG1 ARG 105 10.041 3.284 3.620 865 HD2 ARG 105 HD2 ARG 105 11.803 5.649 3.188 866 HD3 ARG 105 HD1 ARG 105 10.713 5.640 4.574 867 HE ARG 105 HE ARG 105 11.949 3.244 4.750 868 HH11 ARG 105 HH11 ARG 105 13.123 6.513 4.422 869 HH12 ARG 105 HH12 ARG 105 14.599 6.202 5.273 870 HH21 ARG 105 HH21 ARG 105 13.891 2.832 5.870 871 HH22 ARG 105 HH22 ARG 105 15.036 4.112 6.095 872 H GLN 106 HN GLN 106 9.956 1.132 3.468 873 HA GLN 106 HA GLN 106 12.247 1.180 5.196 874 HB2 GLN 106 HB2 GLN 106 9.453 0.597 5.453 875 HB3 GLN 106 HB1 GLN 106 10.375 -0.728 6.143 876 HG2 GLN 106 HG2 GLN 106 10.612 0.468 7.982 877 HG3 GLN 106 HG1 GLN 106 11.611 1.596 7.069 878 HE21 GLN 106 HE21 GLN 106 10.199 3.132 5.671 879 HE22 GLN 106 HE22 GLN 106 8.895 3.887 6.515 880 H GLY 107 HN GLY 107 10.568 -1.338 3.347 881 HA2 GLY 107 HA2 GLY 107 12.203 -2.902 2.232 882 HA3 GLY 107 HA1 GLY 107 12.871 -3.127 3.841 883 H LEU 108 HN LEU 108 9.672 -2.791 4.365 884 HA LEU 108 HA LEU 108 9.287 -5.561 4.879 885 HB2 LEU 108 HB2 LEU 108 7.079 -3.529 4.744 886 HB3 LEU 108 HB1 LEU 108 7.174 -4.969 5.739 887 HG LEU 108 HG LEU 108 8.955 -2.562 6.115 888 HD11 LEU 108 HD11 LEU 108 6.215 -3.129 7.041 889 HD12 LEU 108 HD12 LEU 108 7.043 -1.590 6.807 890 HD13 LEU 108 HD13 LEU 108 7.343 -2.541 8.261 891 HD21 LEU 108 HD21 LEU 108 8.385 -4.488 8.277 892 HD22 LEU 108 HD22 LEU 108 9.875 -3.632 7.879 893 HD23 LEU 108 HD23 LEU 108 9.408 -5.064 6.961 894 H ALA 109 HN ALA 109 8.578 -3.449 2.222 895 HA ALA 109 HA ALA 109 7.637 -5.729 0.668 896 HB1 ALA 109 HB1 ALA 109 5.513 -5.029 1.121 897 HB2 ALA 109 HB2 ALA 109 5.859 -4.011 -0.277 898 HB3 ALA 109 HB3 ALA 109 5.997 -3.349 1.352 899 H LYS 110 HN LYS 110 7.334 -5.018 -1.696 900 HA LYS 110 HA LYS 110 9.118 -2.839 -2.474 901 HB2 LYS 110 HB2 LYS 110 9.455 -5.672 -3.483 902 HB3 LYS 110 HB1 LYS 110 10.349 -4.268 -4.046 903 HG2 LYS 110 HG2 LYS 110 11.873 -4.610 -2.486 904 HG3 LYS 110 HG1 LYS 110 10.650 -4.392 -1.236 905 HD2 LYS 110 HD2 LYS 110 10.809 -6.545 -0.703 906 HD3 LYS 110 HD1 LYS 110 10.321 -6.991 -2.339 907 HE2 LYS 110 HE2 LYS 110 12.572 -7.044 -3.088 908 HE3 LYS 110 HE1 LYS 110 13.151 -6.268 -1.613 909 HZ1 LYS 110 HZ1 LYS 110 11.734 -8.803 -1.320 910 HZ2 LYS 110 HZ2 LYS 110 13.050 -8.193 -0.450 911 HZ3 LYS 110 HZ3 LYS 110 13.289 -8.865 -1.985 912 H VAL 111 HN VAL 111 9.016 -2.486 -4.901 913 HA VAL 111 HA VAL 111 6.313 -2.271 -5.678 914 HB VAL 111 HB VAL 111 7.381 -1.801 -8.016 915 HG11 VAL 111 HG11 VAL 111 7.216 -0.198 -5.573 916 HG12 VAL 111 HG12 VAL 111 6.613 0.133 -7.198 917 HG13 VAL 111 HG13 VAL 111 8.303 0.450 -6.801 918 HG21 VAL 111 HG21 VAL 111 9.607 -1.739 -8.230 919 HG22 VAL 111 HG22 VAL 111 9.637 -2.731 -6.772 920 HG23 VAL 111 HG23 VAL 111 9.831 -0.982 -6.653 921 H ALA 112 HN ALA 112 5.068 -3.937 -6.215 922 HA ALA 112 HA ALA 112 6.168 -5.950 -8.060 923 HB1 ALA 112 HB1 ALA 112 5.757 -6.575 -5.511 924 HB2 ALA 112 HB2 ALA 112 5.458 -7.719 -6.819 925 HB3 ALA 112 HB3 ALA 112 4.115 -6.824 -6.107 926 H TYR 113 HN TYR 113 5.005 -6.240 -9.841 927 HA TYR 113 HA TYR 113 3.344 -6.094 -11.382 928 HB2 TYR 113 HB2 TYR 113 1.547 -6.246 -8.954 929 HB3 TYR 113 HB1 TYR 113 1.046 -6.512 -10.621 930 HD1 TYR 113 HD1 TYR 113 2.283 -8.417 -11.896 931 HD2 TYR 113 HD2 TYR 113 2.214 -8.053 -7.658 932 HE1 TYR 113 HE1 TYR 113 2.840 -10.803 -11.688 933 HE2 TYR 113 HE2 TYR 113 2.771 -10.438 -7.438 934 HH TYR 113 HH TYR 113 4.038 -12.253 -9.766 935 H VAL 114 HN VAL 114 4.231 -3.843 -11.590 936 HA VAL 114 HA VAL 114 2.080 -1.895 -11.074 937 HB VAL 114 HB VAL 114 3.962 -1.376 -9.603 938 HG11 VAL 114 HG11 VAL 114 5.802 -0.624 -11.761 939 HG12 VAL 114 HG12 VAL 114 5.560 -2.360 -11.562 940 HG13 VAL 114 HG13 VAL 114 6.124 -1.387 -10.203 941 HG21 VAL 114 HG21 VAL 114 2.696 0.495 -10.432 942 HG22 VAL 114 HG22 VAL 114 3.648 0.533 -11.917 943 HG23 VAL 114 HG23 VAL 114 4.400 0.943 -10.375 944 H TYR 115 HN TYR 115 1.158 -1.913 -13.085 945 HA TYR 115 HA TYR 115 2.888 -1.049 -15.303 946 HB2 TYR 115 HB2 TYR 115 0.794 -3.205 -15.277 947 HB3 TYR 115 HB1 TYR 115 1.240 -2.388 -16.769 948 HD1 TYR 115 HD2 TYR 115 3.619 -2.531 -17.574 949 HD2 TYR 115 HD1 TYR 115 2.155 -4.903 -14.360 950 HE1 TYR 115 HE2 TYR 115 5.527 -4.060 -17.840 951 HE2 TYR 115 HE1 TYR 115 4.059 -6.438 -14.615 952 HH TYR 115 HH TYR 115 6.573 -6.095 -15.646 953 H LYS 116 HN LYS 116 1.872 0.173 -16.947 954 HA LYS 116 HA LYS 116 0.100 2.155 -16.016 955 HB2 LYS 116 HB2 LYS 116 0.053 2.850 -18.433 956 HB3 LYS 116 HB1 LYS 116 1.666 2.690 -17.747 957 HG2 LYS 116 HG2 LYS 116 0.746 0.211 -18.912 958 HG3 LYS 116 HG1 LYS 116 0.727 1.534 -20.083 959 HD2 LYS 116 HD2 LYS 116 3.063 2.030 -19.576 960 HD3 LYS 116 HD1 LYS 116 3.086 0.743 -18.370 961 HE2 LYS 116 HE2 LYS 116 2.538 -0.876 -20.175 962 HE3 LYS 116 HE1 LYS 116 2.690 0.437 -21.342 963 HZ1 LYS 116 HZ1 LYS 116 4.924 0.437 -21.185 964 HZ2 LYS 116 HZ2 LYS 116 4.697 -1.162 -20.685 965 HZ3 LYS 116 HZ3 LYS 116 4.937 0.055 -19.537 966 HA PRO 117 HA PRO 117 -1.364 3.656 -17.446 967 HB2 PRO 117 HB2 PRO 117 -4.037 4.003 -16.303 968 HB3 PRO 117 HB1 PRO 117 -3.379 4.633 -17.814 969 HG2 PRO 117 HG2 PRO 117 -5.263 2.703 -17.756 970 HG3 PRO 117 HG1 PRO 117 -4.023 2.784 -19.021 971 HD2 PRO 117 HD2 PRO 117 -4.140 1.036 -16.588 972 HD3 PRO 117 HD1 PRO 117 -3.658 0.624 -18.248 973 H ASN 118 HN ASN 118 -2.044 1.476 -14.976 974 HA ASN 118 HA ASN 118 -2.270 3.135 -12.726 975 HB2 ASN 118 HB2 ASN 118 -0.838 0.502 -12.586 976 HB3 ASN 118 HB1 ASN 118 -1.945 1.228 -11.427 977 HD21 ASN 118 HD21 ASN 118 -1.716 -0.402 -14.533 978 HD22 ASN 118 HD22 ASN 118 -3.349 -0.974 -14.556 979 H ASN 119 HN ASN 119 -0.860 4.692 -12.261 980 HA ASN 119 HA ASN 119 1.800 4.096 -11.520 981 HB2 ASN 119 HB2 ASN 119 2.874 5.622 -13.276 982 HB3 ASN 119 HB1 ASN 119 2.402 4.008 -13.798 983 HD21 ASN 119 HD21 ASN 119 1.731 4.124 -15.813 984 HD22 ASN 119 HD22 ASN 119 0.650 5.306 -16.458 985 H THR 120 HN THR 120 -0.540 5.459 -10.506 986 HA THR 120 HA THR 120 -0.387 8.232 -10.567 987 HB THR 120 HB THR 120 -1.093 6.688 -8.078 988 HG1 THR 120 HG1 THR 120 -2.274 5.618 -9.536 989 HG21 THR 120 HG21 THR 120 -1.477 9.394 -8.955 990 HG22 THR 120 HG22 THR 120 -1.807 8.659 -7.386 991 HG23 THR 120 HG23 THR 120 -3.026 8.603 -8.660 992 H HIS 121 HN HIS 121 1.218 5.954 -8.359 993 HA HIS 121 HA HIS 121 3.087 8.119 -7.649 994 HB2 HIS 121 HB2 HIS 121 1.639 6.180 -5.927 995 HB3 HIS 121 HB1 HIS 121 3.303 6.550 -5.490 996 HD1 HIS 121 HD1 HIS 121 -0.119 7.920 -5.412 997 HD2 HIS 121 HD2 HIS 121 3.753 9.301 -4.811 998 HE1 HIS 121 HE1 HIS 121 -0.369 10.135 -4.249 999 HE2 HIS 121 HE2 HIS 121 1.989 10.914 -3.823 1000 H GLU 122 HN GLU 122 3.053 5.716 -9.617 1001 HA GLU 122 HA GLU 122 4.859 3.768 -8.918 1002 HB2 GLU 122 HB2 GLU 122 3.665 3.741 -11.037 1003 HB3 GLU 122 HB1 GLU 122 4.554 5.154 -11.588 1004 HG2 GLU 122 HG2 GLU 122 6.646 3.672 -11.231 1005 HG3 GLU 122 HG1 GLU 122 5.494 2.338 -11.262 1006 H GLN 123 HN GLN 123 5.582 6.973 -10.274 1007 HA GLN 123 HA GLN 123 8.368 6.698 -10.369 1008 HB2 GLN 123 HB2 GLN 123 6.747 9.214 -9.936 1009 HB3 GLN 123 HB1 GLN 123 8.428 9.153 -10.447 1010 HG2 GLN 123 HG2 GLN 123 6.086 8.058 -11.988 1011 HG3 GLN 123 HG1 GLN 123 6.919 9.577 -12.316 1012 HE21 GLN 123 HE21 GLN 123 7.287 6.086 -12.229 1013 HE22 GLN 123 HE22 GLN 123 8.593 6.008 -13.358 1014 H LEU 124 HN LEU 124 6.216 7.292 -7.718 1015 HA LEU 124 HA LEU 124 8.272 8.271 -5.945 1016 HB2 LEU 124 HB2 LEU 124 6.004 9.059 -5.653 1017 HB3 LEU 124 HB1 LEU 124 5.418 7.419 -5.461 1018 HG LEU 124 HG LEU 124 7.014 7.349 -3.405 1019 HD11 LEU 124 HD11 LEU 124 8.245 9.286 -3.473 1020 HD12 LEU 124 HD12 LEU 124 6.938 9.754 -2.386 1021 HD13 LEU 124 HD13 LEU 124 6.898 10.250 -4.078 1022 HD21 LEU 124 HD21 LEU 124 5.211 7.796 -2.038 1023 HD22 LEU 124 HD22 LEU 124 4.418 7.482 -3.582 1024 HD23 LEU 124 HD23 LEU 124 4.654 9.141 -3.034 1025 H LEU 125 HN LEU 125 6.499 5.249 -6.445 1026 HA LEU 125 HA LEU 125 7.823 3.911 -4.271 1027 HB2 LEU 125 HB2 LEU 125 5.946 3.042 -6.444 1028 HB3 LEU 125 HB1 LEU 125 6.744 1.862 -5.422 1029 HG LEU 125 HG LEU 125 5.708 3.547 -3.550 1030 HD11 LEU 125 HD11 LEU 125 3.287 3.795 -4.326 1031 HD12 LEU 125 HD12 LEU 125 3.923 3.612 -5.960 1032 HD13 LEU 125 HD13 LEU 125 4.466 4.950 -4.947 1033 HD21 LEU 125 HD21 LEU 125 3.690 1.749 -3.837 1034 HD22 LEU 125 HD22 LEU 125 5.223 1.420 -3.030 1035 HD23 LEU 125 HD23 LEU 125 4.997 0.951 -4.713 1036 H ARG 126 HN ARG 126 8.302 4.257 -7.709 1037 HA ARG 126 HA ARG 126 9.975 2.088 -8.215 1038 HB2 ARG 126 HB2 ARG 126 9.353 4.639 -9.496 1039 HB3 ARG 126 HB1 ARG 126 11.001 4.108 -9.799 1040 HG2 ARG 126 HG2 ARG 126 9.668 1.813 -10.261 1041 HG3 ARG 126 HG1 ARG 126 8.451 2.996 -10.744 1042 HD2 ARG 126 HD2 ARG 126 10.009 4.027 -12.278 1043 HD3 ARG 126 HD1 ARG 126 11.298 2.952 -11.737 1044 HE ARG 126 HE ARG 126 9.038 1.521 -12.740 1045 HH11 ARG 126 HH11 ARG 126 11.922 3.246 -13.682 1046 HH12 ARG 126 HH12 ARG 126 12.089 2.399 -15.183 1047 HH21 ARG 126 HH21 ARG 126 9.255 0.406 -14.714 1048 HH22 ARG 126 HH22 ARG 126 10.575 0.787 -15.769 1049 H LYS 127 HN LYS 127 10.740 5.308 -6.966 1050 HA LYS 127 HA LYS 127 13.565 4.749 -6.804 1051 HB2 LYS 127 HB2 LYS 127 12.195 7.011 -5.377 1052 HB3 LYS 127 HB1 LYS 127 13.826 6.948 -6.026 1053 HG2 LYS 127 HG2 LYS 127 11.388 6.881 -7.775 1054 HG3 LYS 127 HG1 LYS 127 12.161 8.385 -7.269 1055 HD2 LYS 127 HD2 LYS 127 13.378 8.121 -9.143 1056 HD3 LYS 127 HD1 LYS 127 14.300 6.974 -8.169 1057 HE2 LYS 127 HE2 LYS 127 12.338 5.359 -9.022 1058 HE3 LYS 127 HE1 LYS 127 12.383 6.495 -10.369 1059 HZ1 LYS 127 HZ1 LYS 127 14.385 5.757 -11.036 1060 HZ2 LYS 127 HZ2 LYS 127 13.956 4.358 -10.188 1061 HZ3 LYS 127 HZ3 LYS 127 14.959 5.510 -9.464 1062 H SER 128 HN SER 128 10.861 5.052 -4.550 1063 HA SER 128 HA SER 128 12.173 4.764 -2.136 1064 HB2 SER 128 HB2 SER 128 9.940 5.265 -1.886 1065 HB3 SER 128 HB1 SER 128 9.435 4.134 -3.139 1066 HG SER 128 HG SER 128 10.538 3.210 -0.717 1067 H GLU 129 HN GLU 129 11.132 2.256 -4.410 1068 HA GLU 129 HA GLU 129 11.793 0.068 -2.721 1069 HB2 GLU 129 HB2 GLU 129 10.227 -0.275 -4.524 1070 HB3 GLU 129 HB1 GLU 129 11.415 0.247 -5.714 1071 HG2 GLU 129 HG2 GLU 129 12.552 -1.901 -4.270 1072 HG3 GLU 129 HG1 GLU 129 10.912 -2.367 -4.713 1073 H ALA 130 HN ALA 130 13.410 1.236 -5.683 1074 HA ALA 130 HA ALA 130 15.732 -0.302 -5.372 1075 HB1 ALA 130 HB1 ALA 130 14.747 1.335 -7.313 1076 HB2 ALA 130 HB2 ALA 130 16.362 0.626 -7.312 1077 HB3 ALA 130 HB3 ALA 130 16.119 2.269 -6.716 1078 H GLN 131 HN GLN 131 14.795 2.740 -3.973 1079 HA GLN 131 HA GLN 131 17.269 3.806 -3.302 1080 HB2 GLN 131 HB2 GLN 131 14.501 4.094 -2.310 1081 HB3 GLN 131 HB1 GLN 131 15.761 4.583 -1.190 1082 HG2 GLN 131 HG2 GLN 131 16.373 5.648 -3.741 1083 HG3 GLN 131 HG1 GLN 131 14.690 6.014 -3.374 1084 HE21 GLN 131 HE21 GLN 131 17.986 6.617 -2.595 1085 HE22 GLN 131 HE22 GLN 131 17.712 7.870 -1.439 1086 H ALA 132 HN ALA 132 15.244 1.530 -1.482 1087 HA ALA 132 HA ALA 132 17.314 1.242 0.544 1088 HB1 ALA 132 HB1 ALA 132 15.361 1.207 1.683 1089 HB2 ALA 132 HB2 ALA 132 15.459 -0.517 1.325 1090 HB3 ALA 132 HB3 ALA 132 14.455 0.535 0.328 1091 H LYS 133 HN LYS 133 16.138 -0.411 -2.262 1092 HA LYS 133 HA LYS 133 16.839 -3.039 -1.766 1093 HB2 LYS 133 HB2 LYS 133 15.934 -1.617 -3.933 1094 HB3 LYS 133 HB1 LYS 133 17.534 -2.119 -4.463 1095 HG2 LYS 133 HG2 LYS 133 16.897 -4.234 -4.745 1096 HG3 LYS 133 HG1 LYS 133 16.027 -4.270 -3.210 1097 HD2 LYS 133 HD2 LYS 133 14.323 -2.755 -4.517 1098 HD3 LYS 133 HD1 LYS 133 15.063 -3.514 -5.928 1099 HE2 LYS 133 HE2 LYS 133 14.627 -5.651 -4.266 1100 HE3 LYS 133 HE1 LYS 133 13.231 -4.626 -3.937 1101 HZ1 LYS 133 HZ1 LYS 133 12.678 -6.075 -5.717 1102 HZ2 LYS 133 HZ2 LYS 133 14.089 -5.692 -6.568 1103 HZ3 LYS 133 HZ3 LYS 133 12.874 -4.531 -6.381 1104 H LYS 134 HN LYS 134 18.882 -0.519 -3.237 1105 HA LYS 134 HA LYS 134 21.191 -2.013 -3.573 1106 HB2 LYS 134 HB2 LYS 134 20.980 0.162 -4.567 1107 HB3 LYS 134 HB1 LYS 134 20.840 0.927 -2.991 1108 HG2 LYS 134 HG2 LYS 134 23.186 0.057 -2.536 1109 HG3 LYS 134 HG1 LYS 134 23.270 -0.286 -4.265 1110 HD2 LYS 134 HD2 LYS 134 24.247 1.893 -3.745 1111 HD3 LYS 134 HD1 LYS 134 22.810 2.066 -4.755 1112 HE2 LYS 134 HE2 LYS 134 21.821 3.337 -3.224 1113 HE3 LYS 134 HE1 LYS 134 22.081 2.115 -1.978 1114 HZ1 LYS 134 HZ1 LYS 134 24.379 3.013 -1.759 1115 HZ2 LYS 134 HZ2 LYS 134 23.165 4.093 -1.291 1116 HZ3 LYS 134 HZ3 LYS 134 23.936 4.285 -2.783 1117 H GLU 135 HN GLU 135 19.982 -0.407 -0.694 1118 HA GLU 135 HA GLU 135 22.386 -1.201 0.784 1119 HB2 GLU 135 HB2 GLU 135 20.708 0.146 2.562 1120 HB3 GLU 135 HB1 GLU 135 22.127 0.796 1.749 1121 HG2 GLU 135 HG2 GLU 135 20.768 1.676 -0.028 1122 HG3 GLU 135 HG1 GLU 135 19.331 0.903 0.640 1123 H LYS 136 HN LYS 136 19.501 -2.584 0.050 1124 HA LYS 136 HA LYS 136 18.054 -4.023 1.101 1125 HB2 LYS 136 HB2 LYS 136 20.677 -5.023 2.222 1126 HB3 LYS 136 HB1 LYS 136 19.198 -5.959 2.043 1127 HG2 LYS 136 HG2 LYS 136 19.387 -5.394 -0.454 1128 HG3 LYS 136 HG1 LYS 136 21.054 -4.955 -0.077 1129 HD2 LYS 136 HD2 LYS 136 21.429 -7.140 -0.537 1130 HD3 LYS 136 HD1 LYS 136 20.917 -7.352 1.139 1131 HE2 LYS 136 HE2 LYS 136 19.018 -8.389 0.550 1132 HE3 LYS 136 HE1 LYS 136 18.703 -7.262 -0.770 1133 HZ1 LYS 136 HZ1 LYS 136 20.830 -9.280 -1.042 1134 HZ2 LYS 136 HZ2 LYS 136 19.921 -8.517 -2.246 1135 HZ3 LYS 136 HZ3 LYS 136 19.217 -9.724 -1.292 1136 H LEU 137 HN LEU 137 17.466 -2.010 2.388 1137 HA LEU 137 HA LEU 137 18.286 -1.458 4.936 1138 HB2 LEU 137 HB2 LEU 137 15.782 -1.033 3.417 1139 HB3 LEU 137 HB1 LEU 137 15.682 -0.834 5.158 1140 HG LEU 137 HG LEU 137 17.494 0.671 3.275 1141 HD11 LEU 137 HD11 LEU 137 15.604 2.058 5.055 1142 HD12 LEU 137 HD12 LEU 137 14.879 1.125 3.745 1143 HD13 LEU 137 HD13 LEU 137 16.049 2.394 3.383 1144 HD21 LEU 137 HD21 LEU 137 17.522 0.345 6.213 1145 HD22 LEU 137 HD22 LEU 137 17.737 1.982 5.594 1146 HD23 LEU 137 HD23 LEU 137 18.840 0.699 5.095 1147 H ASN 138 HN ASN 138 15.002 -2.725 4.838 1148 HA ASN 138 HA ASN 138 15.505 -4.170 7.271 1149 HB2 ASN 138 HB2 ASN 138 12.986 -3.861 5.633 1150 HB3 ASN 138 HB1 ASN 138 13.067 -4.648 7.206 1151 HD21 ASN 138 HD21 ASN 138 11.464 -2.417 6.583 1152 HD22 ASN 138 HD22 ASN 138 12.007 -1.086 7.541 1153 H ILE 139 HN ILE 139 13.159 -5.811 5.440 1154 HA ILE 139 HA ILE 139 14.852 -8.166 5.368 1155 HB ILE 139 HB ILE 139 12.756 -9.355 4.737 1156 HG12 ILE 139 HG12 ILE 139 11.416 -6.698 5.272 1157 HG13 ILE 139 HG11 ILE 139 11.699 -7.342 3.658 1158 HG21 ILE 139 HG21 ILE 139 13.207 -7.867 7.236 1159 HG22 ILE 139 HG22 ILE 139 12.979 -9.594 6.965 1160 HG23 ILE 139 HG23 ILE 139 11.583 -8.518 7.016 1161 HD11 ILE 139 HD11 ILE 139 10.123 -8.996 3.899 1162 HD12 ILE 139 HD12 ILE 139 9.400 -7.666 4.804 1163 HD13 ILE 139 HD13 ILE 139 10.215 -8.976 5.660 1164 H TRP 140 HN TRP 140 15.862 -6.517 3.516 1165 HA TRP 140 HA TRP 140 14.680 -7.033 0.927 1166 HB2 TRP 140 HB2 TRP 140 17.271 -5.685 1.706 1167 HB3 TRP 140 HB1 TRP 140 16.650 -5.784 0.060 1168 HD1 TRP 140 HD1 TRP 140 15.877 -4.157 3.445 1169 HE1 TRP 140 HE1 TRP 140 14.371 -2.111 3.040 1170 HE3 TRP 140 HE3 TRP 140 15.033 -4.752 -1.557 1171 HZ2 TRP 140 HZ2 TRP 140 13.019 -0.905 0.894 1172 HZ3 TRP 140 HZ3 TRP 140 13.613 -3.107 -2.715 1173 HH2 TRP 140 HH2 TRP 140 12.627 -1.223 -1.513 Start of MODEL 18 1 H1 ALA 1 HT1 ALA 1 -25.294 16.069 -5.177 2 H2 ALA 1 HT2 ALA 1 -25.420 14.864 -3.961 3 H3 ALA 1 HT3 ALA 1 -26.647 15.018 -5.152 4 HA ALA 1 HA ALA 1 -25.028 13.162 -5.414 5 HB1 ALA 1 HB1 ALA 1 -25.335 13.205 -7.689 6 HB2 ALA 1 HB2 ALA 1 -25.016 14.936 -7.810 7 HB3 ALA 1 HB3 ALA 1 -26.555 14.366 -7.166 8 H THR 2 HN THR 2 -23.804 16.239 -6.747 9 HA THR 2 HA THR 2 -21.076 15.280 -6.173 10 HB THR 2 HB THR 2 -21.423 17.460 -8.139 11 HG1 THR 2 HG1 THR 2 -23.146 16.106 -8.719 12 HG21 THR 2 HG21 THR 2 -19.253 16.727 -8.102 13 HG22 THR 2 HG22 THR 2 -19.919 15.779 -9.430 14 HG23 THR 2 HG23 THR 2 -19.710 15.045 -7.840 15 H SER 3 HN SER 3 -22.919 16.786 -4.411 16 HA SER 3 HA SER 3 -22.922 18.556 -2.989 17 HB2 SER 3 HB2 SER 3 -19.980 18.226 -3.556 18 HB3 SER 3 HB1 SER 3 -20.577 19.419 -2.403 19 HG SER 3 HG SER 3 -20.003 17.232 -1.590 20 H THR 4 HN THR 4 -20.149 20.070 -4.462 21 HA THR 4 HA THR 4 -21.581 21.694 -6.311 22 HB THR 4 HB THR 4 -20.592 23.189 -3.892 23 HG1 THR 4 HG1 THR 4 -22.509 23.016 -2.955 24 HG21 THR 4 HG21 THR 4 -21.758 23.941 -6.398 25 HG22 THR 4 HG22 THR 4 -21.087 24.953 -5.120 26 HG23 THR 4 HG23 THR 4 -22.780 24.461 -5.059 27 H LYS 5 HN LYS 5 -18.767 21.593 -4.145 28 HA LYS 5 HA LYS 5 -17.092 23.013 -5.990 29 HB2 LYS 5 HB2 LYS 5 -15.303 22.586 -4.399 30 HB3 LYS 5 HB1 LYS 5 -16.743 23.144 -3.558 31 HG2 LYS 5 HG2 LYS 5 -16.758 20.282 -3.715 32 HG3 LYS 5 HG1 LYS 5 -15.228 20.845 -3.039 33 HD2 LYS 5 HD2 LYS 5 -16.979 22.423 -1.706 34 HD3 LYS 5 HD1 LYS 5 -17.951 20.965 -1.926 35 HE2 LYS 5 HE2 LYS 5 -16.871 20.591 0.099 36 HE3 LYS 5 HE1 LYS 5 -15.877 19.711 -1.061 37 HZ1 LYS 5 HZ1 LYS 5 -14.723 21.206 0.644 38 HZ2 LYS 5 HZ2 LYS 5 -15.233 22.496 -0.324 39 HZ3 LYS 5 HZ3 LYS 5 -14.217 21.307 -0.968 40 H LYS 6 HN LYS 6 -14.936 22.039 -6.633 41 HA LYS 6 HA LYS 6 -15.413 19.785 -8.288 42 HB2 LYS 6 HB2 LYS 6 -13.773 21.710 -8.677 43 HB3 LYS 6 HB1 LYS 6 -12.696 20.872 -7.568 44 HG2 LYS 6 HG2 LYS 6 -11.911 19.845 -9.378 45 HG3 LYS 6 HG1 LYS 6 -13.391 18.886 -9.318 46 HD2 LYS 6 HD2 LYS 6 -13.149 19.732 -11.543 47 HD3 LYS 6 HD1 LYS 6 -14.473 20.607 -10.771 48 HE2 LYS 6 HE2 LYS 6 -12.955 22.071 -12.072 49 HE3 LYS 6 HE1 LYS 6 -13.054 22.504 -10.365 50 HZ1 LYS 6 HZ1 LYS 6 -10.935 20.653 -11.087 51 HZ2 LYS 6 HZ2 LYS 6 -10.911 21.960 -10.015 52 HZ3 LYS 6 HZ3 LYS 6 -10.763 22.228 -11.678 53 H LEU 7 HN LEU 7 -14.520 17.699 -8.191 54 HA LEU 7 HA LEU 7 -13.396 16.909 -5.591 55 HB2 LEU 7 HB2 LEU 7 -15.397 15.252 -7.116 56 HB3 LEU 7 HB1 LEU 7 -14.767 14.954 -5.507 57 HG LEU 7 HG LEU 7 -15.895 17.346 -5.071 58 HD11 LEU 7 HD11 LEU 7 -17.301 16.172 -7.437 59 HD12 LEU 7 HD12 LEU 7 -16.814 17.841 -7.143 60 HD13 LEU 7 HD13 LEU 7 -18.174 17.150 -6.259 61 HD21 LEU 7 HD21 LEU 7 -16.292 15.234 -3.851 62 HD22 LEU 7 HD22 LEU 7 -17.430 14.752 -5.110 63 HD23 LEU 7 HD23 LEU 7 -17.767 16.166 -4.111 64 H HIS 8 HN HIS 8 -11.973 15.161 -5.612 65 HA HIS 8 HA HIS 8 -11.365 13.748 -8.034 66 HB2 HIS 8 HB2 HIS 8 -8.913 14.547 -7.958 67 HB3 HIS 8 HB1 HIS 8 -10.106 15.607 -8.700 68 HD1 HIS 8 HD1 HIS 8 -11.069 17.507 -6.923 69 HD2 HIS 8 HD2 HIS 8 -7.366 15.797 -6.133 70 HE1 HIS 8 HE1 HIS 8 -9.924 19.088 -5.338 71 HE2 HIS 8 HE2 HIS 8 -7.648 18.080 -4.950 72 H LYS 9 HN LYS 9 -10.268 14.666 -4.792 73 HA LYS 9 HA LYS 9 -9.107 12.006 -4.434 74 HB2 LYS 9 HB2 LYS 9 -7.999 12.891 -2.492 75 HB3 LYS 9 HB1 LYS 9 -7.762 14.019 -3.820 76 HG2 LYS 9 HG2 LYS 9 -10.116 14.618 -2.206 77 HG3 LYS 9 HG1 LYS 9 -8.605 14.664 -1.297 78 HD2 LYS 9 HD2 LYS 9 -9.160 16.147 -3.866 79 HD3 LYS 9 HD1 LYS 9 -9.169 16.855 -2.249 80 HE2 LYS 9 HE2 LYS 9 -6.720 15.545 -2.434 81 HE3 LYS 9 HE1 LYS 9 -6.943 16.299 -4.012 82 HZ1 LYS 9 HZ1 LYS 9 -7.459 17.882 -1.594 83 HZ2 LYS 9 HZ2 LYS 9 -6.929 18.391 -3.117 84 HZ3 LYS 9 HZ3 LYS 9 -5.857 17.613 -2.067 85 H GLU 10 HN GLU 10 -9.533 10.903 -2.357 86 HA GLU 10 HA GLU 10 -11.975 11.599 -0.980 87 HB2 GLU 10 HB2 GLU 10 -12.503 10.225 -3.134 88 HB3 GLU 10 HB1 GLU 10 -11.911 8.861 -2.195 89 HG2 GLU 10 HG2 GLU 10 -13.747 8.779 -0.920 90 HG3 GLU 10 HG1 GLU 10 -13.869 10.534 -0.802 91 HA PRO 11 HA PRO 11 -9.562 9.475 2.114 92 HB2 PRO 11 HB2 PRO 11 -11.012 10.138 4.249 93 HB3 PRO 11 HB1 PRO 11 -10.103 11.365 3.357 94 HG2 PRO 11 HG2 PRO 11 -13.025 10.751 3.292 95 HG3 PRO 11 HG1 PRO 11 -12.208 12.322 3.238 96 HD2 PRO 11 HD2 PRO 11 -13.190 10.933 1.031 97 HD3 PRO 11 HD1 PRO 11 -11.995 12.243 0.975 98 H ALA 12 HN ALA 12 -10.199 8.031 4.119 99 HA ALA 12 HA ALA 12 -12.579 6.486 3.869 100 HB1 ALA 12 HB1 ALA 12 -11.533 4.353 3.285 101 HB2 ALA 12 HB2 ALA 12 -9.991 5.176 3.055 102 HB3 ALA 12 HB3 ALA 12 -11.352 5.541 1.994 103 H THR 13 HN THR 13 -12.622 4.656 5.420 104 HA THR 13 HA THR 13 -10.742 5.033 7.650 105 HB THR 13 HB THR 13 -13.729 4.635 7.923 106 HG1 THR 13 HG1 THR 13 -12.958 6.763 7.199 107 HG21 THR 13 HG21 THR 13 -12.842 3.742 9.868 108 HG22 THR 13 HG22 THR 13 -13.187 5.417 10.301 109 HG23 THR 13 HG23 THR 13 -11.534 4.924 9.931 110 H LEU 14 HN LEU 14 -9.864 3.190 8.371 111 HA LEU 14 HA LEU 14 -10.243 0.750 7.079 112 HB2 LEU 14 HB2 LEU 14 -8.549 1.767 9.082 113 HB3 LEU 14 HB1 LEU 14 -9.302 0.340 9.773 114 HG LEU 14 HG LEU 14 -7.093 -0.042 8.629 115 HD11 LEU 14 HD11 LEU 14 -9.607 -1.513 8.147 116 HD12 LEU 14 HD12 LEU 14 -8.108 -2.039 8.912 117 HD13 LEU 14 HD13 LEU 14 -8.222 -1.967 7.154 118 HD21 LEU 14 HD21 LEU 14 -8.201 1.453 6.599 119 HD22 LEU 14 HD22 LEU 14 -8.298 -0.197 5.985 120 HD23 LEU 14 HD23 LEU 14 -6.743 0.468 6.485 121 H ILE 15 HN ILE 15 -12.104 -0.335 7.043 122 HA ILE 15 HA ILE 15 -13.962 -0.306 9.226 123 HB ILE 15 HB ILE 15 -13.911 -2.127 6.813 124 HG12 ILE 15 HG12 ILE 15 -13.986 0.285 6.226 125 HG13 ILE 15 HG11 ILE 15 -15.461 -0.568 5.778 126 HG21 ILE 15 HG21 ILE 15 -15.763 -1.783 9.076 127 HG22 ILE 15 HG22 ILE 15 -15.471 -3.186 8.048 128 HG23 ILE 15 HG23 ILE 15 -16.512 -1.880 7.482 129 HD11 ILE 15 HD11 ILE 15 -15.018 1.513 7.841 130 HD12 ILE 15 HD12 ILE 15 -16.251 0.288 8.144 131 HD13 ILE 15 HD13 ILE 15 -16.350 1.304 6.705 132 H LYS 16 HN LYS 16 -11.506 -2.473 7.979 133 HA LYS 16 HA LYS 16 -11.150 -3.745 10.479 134 HB2 LYS 16 HB2 LYS 16 -13.080 -4.933 8.671 135 HB3 LYS 16 HB1 LYS 16 -11.748 -6.037 8.986 136 HG2 LYS 16 HG2 LYS 16 -12.419 -4.988 11.478 137 HG3 LYS 16 HG1 LYS 16 -13.959 -5.294 10.673 138 HD2 LYS 16 HD2 LYS 16 -12.845 -7.583 10.063 139 HD3 LYS 16 HD1 LYS 16 -11.796 -7.210 11.432 140 HE2 LYS 16 HE2 LYS 16 -13.446 -7.511 12.949 141 HE3 LYS 16 HE1 LYS 16 -14.687 -6.848 11.887 142 HZ1 LYS 16 HZ1 LYS 16 -14.818 -8.899 10.716 143 HZ2 LYS 16 HZ2 LYS 16 -14.922 -9.257 12.365 144 HZ3 LYS 16 HZ3 LYS 16 -13.477 -9.533 11.531 145 H ALA 17 HN ALA 17 -9.086 -4.344 10.577 146 HA ALA 17 HA ALA 17 -7.465 -4.254 8.221 147 HB1 ALA 17 HB1 ALA 17 -5.612 -4.312 9.645 148 HB2 ALA 17 HB2 ALA 17 -6.511 -5.123 10.926 149 HB3 ALA 17 HB3 ALA 17 -6.835 -3.429 10.558 150 H ILE 18 HN ILE 18 -6.980 -5.906 6.940 151 HA ILE 18 HA ILE 18 -7.710 -8.606 7.728 152 HB ILE 18 HB ILE 18 -6.360 -7.985 5.131 153 HG12 ILE 18 HG12 ILE 18 -8.457 -6.426 5.864 154 HG13 ILE 18 HG11 ILE 18 -8.099 -6.868 4.204 155 HG21 ILE 18 HG21 ILE 18 -6.730 -10.256 5.374 156 HG22 ILE 18 HG22 ILE 18 -8.110 -9.726 4.412 157 HG23 ILE 18 HG23 ILE 18 -8.300 -10.021 6.141 158 HD11 ILE 18 HD11 ILE 18 -10.501 -7.114 5.064 159 HD12 ILE 18 HD12 ILE 18 -9.906 -8.555 5.889 160 HD13 ILE 18 HD13 ILE 18 -9.806 -8.440 4.132 161 H ASP 19 HN ASP 19 -4.847 -7.358 6.015 162 HA ASP 19 HA ASP 19 -3.096 -8.579 7.986 163 HB2 ASP 19 HB2 ASP 19 -3.448 -9.656 5.218 164 HB3 ASP 19 HB1 ASP 19 -1.847 -9.702 5.950 165 H GLY 20 HN GLY 20 -1.963 -8.084 4.731 166 HA2 GLY 20 HA2 GLY 20 -0.808 -5.494 5.557 167 HA3 GLY 20 HA1 GLY 20 0.139 -6.709 4.706 168 H ASP 21 HN ASP 21 -0.531 -7.289 2.535 169 HA ASP 21 HA ASP 21 -1.037 -5.050 0.919 170 HB2 ASP 21 HB2 ASP 21 -1.464 -7.900 0.038 171 HB3 ASP 21 HB1 ASP 21 -0.934 -6.529 -0.929 172 H THR 22 HN THR 22 -3.172 -6.981 2.720 173 HA THR 22 HA THR 22 -5.446 -5.979 1.141 174 HB THR 22 HB THR 22 -6.240 -8.235 2.701 175 HG1 THR 22 HG1 THR 22 -3.981 -8.689 1.052 176 HG21 THR 22 HG21 THR 22 -7.517 -8.345 0.899 177 HG22 THR 22 HG22 THR 22 -6.139 -9.060 0.062 178 HG23 THR 22 HG23 THR 22 -6.420 -7.321 -0.025 179 H VAL 23 HN VAL 23 -6.876 -4.772 2.208 180 HA VAL 23 HA VAL 23 -7.281 -5.036 5.057 181 HB VAL 23 HB VAL 23 -6.883 -2.582 5.457 182 HG11 VAL 23 HG11 VAL 23 -4.681 -2.910 6.086 183 HG12 VAL 23 HG12 VAL 23 -4.309 -3.877 4.659 184 HG13 VAL 23 HG13 VAL 23 -5.284 -4.563 5.959 185 HG21 VAL 23 HG21 VAL 23 -5.533 -1.321 3.949 186 HG22 VAL 23 HG22 VAL 23 -6.873 -1.992 3.021 187 HG23 VAL 23 HG23 VAL 23 -5.273 -2.725 2.914 188 H LYS 24 HN LYS 24 -9.253 -4.182 5.737 189 HA LYS 24 HA LYS 24 -11.087 -3.518 3.585 190 HB2 LYS 24 HB2 LYS 24 -11.653 -5.158 5.421 191 HB3 LYS 24 HB1 LYS 24 -11.722 -3.792 6.522 192 HG2 LYS 24 HG2 LYS 24 -13.945 -4.310 5.847 193 HG3 LYS 24 HG1 LYS 24 -13.480 -2.792 5.078 194 HD2 LYS 24 HD2 LYS 24 -14.603 -4.101 3.440 195 HD3 LYS 24 HD1 LYS 24 -12.888 -4.113 3.032 196 HE2 LYS 24 HE2 LYS 24 -13.399 -6.337 2.791 197 HE3 LYS 24 HE1 LYS 24 -12.883 -6.304 4.476 198 HZ1 LYS 24 HZ1 LYS 24 -15.005 -6.578 5.230 199 HZ2 LYS 24 HZ2 LYS 24 -15.104 -7.451 3.785 200 HZ3 LYS 24 HZ3 LYS 24 -15.719 -5.878 3.865 201 H LEU 25 HN LEU 25 -11.862 -1.531 3.159 202 HA LEU 25 HA LEU 25 -11.391 0.590 5.137 203 HB2 LEU 25 HB2 LEU 25 -10.481 0.405 2.351 204 HB3 LEU 25 HB1 LEU 25 -11.176 1.948 2.802 205 HG LEU 25 HG LEU 25 -8.927 0.631 4.317 206 HD11 LEU 25 HD11 LEU 25 -8.319 2.994 2.702 207 HD12 LEU 25 HD12 LEU 25 -8.707 1.552 1.764 208 HD13 LEU 25 HD13 LEU 25 -7.396 1.511 2.943 209 HD21 LEU 25 HD21 LEU 25 -9.942 2.171 5.736 210 HD22 LEU 25 HD22 LEU 25 -10.277 3.303 4.426 211 HD23 LEU 25 HD23 LEU 25 -8.626 3.088 5.005 212 H MET 26 HN MET 26 -12.787 2.451 4.943 213 HA MET 26 HA MET 26 -15.470 1.670 4.159 214 HB2 MET 26 HB2 MET 26 -14.789 2.868 6.348 215 HB3 MET 26 HB1 MET 26 -14.716 4.321 5.361 216 HG2 MET 26 HG2 MET 26 -16.976 4.393 5.044 217 HG3 MET 26 HG1 MET 26 -17.170 2.652 5.238 218 HE1 MET 26 HE1 MET 26 -19.349 3.921 6.415 219 HE2 MET 26 HE2 MET 26 -19.388 3.706 8.165 220 HE3 MET 26 HE3 MET 26 -19.037 2.333 7.115 221 H TYR 27 HN TYR 27 -16.183 2.054 2.186 222 HA TYR 27 HA TYR 27 -15.425 4.568 0.860 223 HB2 TYR 27 HB2 TYR 27 -14.255 2.485 -0.057 224 HB3 TYR 27 HB1 TYR 27 -15.839 1.984 -0.634 225 HD1 TYR 27 HD1 TYR 27 -14.314 5.376 -0.582 226 HD2 TYR 27 HD2 TYR 27 -15.704 2.134 -2.957 227 HE1 TYR 27 HE1 TYR 27 -13.992 6.733 -2.609 228 HE2 TYR 27 HE2 TYR 27 -15.386 3.479 -4.991 229 HH TYR 27 HH TYR 27 -15.220 5.790 -5.664 230 H LYS 28 HN LYS 28 -17.143 5.773 0.422 231 HA LYS 28 HA LYS 28 -19.277 6.430 0.011 232 HB2 LYS 28 HB2 LYS 28 -19.332 3.699 -1.268 233 HB3 LYS 28 HB1 LYS 28 -20.656 4.848 -1.382 234 HG2 LYS 28 HG2 LYS 28 -19.261 6.422 -2.546 235 HG3 LYS 28 HG1 LYS 28 -17.851 5.386 -2.323 236 HD2 LYS 28 HD2 LYS 28 -18.612 3.809 -3.851 237 HD3 LYS 28 HD1 LYS 28 -20.287 4.351 -3.723 238 HE2 LYS 28 HE2 LYS 28 -18.311 6.309 -4.736 239 HE3 LYS 28 HE1 LYS 28 -18.715 4.960 -5.797 240 HZ1 LYS 28 HZ1 LYS 28 -20.375 6.328 -6.402 241 HZ2 LYS 28 HZ2 LYS 28 -20.344 7.211 -4.960 242 HZ3 LYS 28 HZ3 LYS 28 -21.140 5.719 -5.021 243 H GLY 29 HN GLY 29 -18.869 5.594 2.574 244 HA2 GLY 29 HA2 GLY 29 -20.001 4.953 4.466 245 HA3 GLY 29 HA1 GLY 29 -21.464 5.080 3.501 246 H GLN 30 HN GLN 30 -19.070 2.912 2.347 247 HA GLN 30 HA GLN 30 -20.390 0.623 3.621 248 HB2 GLN 30 HB2 GLN 30 -21.115 -0.299 1.690 249 HB3 GLN 30 HB1 GLN 30 -21.008 1.339 1.067 250 HG2 GLN 30 HG2 GLN 30 -18.560 0.646 0.480 251 HG3 GLN 30 HG1 GLN 30 -19.210 -0.989 0.599 252 HE21 GLN 30 HE21 GLN 30 -19.135 -1.538 -1.514 253 HE22 GLN 30 HE22 GLN 30 -20.048 -0.752 -2.753 254 HA PRO 31 HA PRO 31 -16.268 -0.869 3.994 255 HB2 PRO 31 HB2 PRO 31 -16.688 -3.427 4.540 256 HB3 PRO 31 HB1 PRO 31 -17.343 -2.168 5.599 257 HG2 PRO 31 HG2 PRO 31 -18.739 -3.739 3.463 258 HG3 PRO 31 HG1 PRO 31 -19.281 -3.374 5.112 259 HD2 PRO 31 HD2 PRO 31 -20.041 -1.948 2.882 260 HD3 PRO 31 HD1 PRO 31 -20.027 -1.291 4.530 261 H MET 32 HN MET 32 -14.857 -1.023 2.390 262 HA MET 32 HA MET 32 -15.315 -3.029 0.284 263 HB2 MET 32 HB2 MET 32 -15.368 -0.381 -0.188 264 HB3 MET 32 HB1 MET 32 -13.639 -0.660 -0.339 265 HG2 MET 32 HG2 MET 32 -14.284 -0.974 -2.495 266 HG3 MET 32 HG1 MET 32 -14.422 -2.626 -1.892 267 HE1 MET 32 HE1 MET 32 -15.908 -3.634 -3.449 268 HE2 MET 32 HE2 MET 32 -17.663 -3.474 -3.357 269 HE3 MET 32 HE3 MET 32 -16.750 -3.997 -1.941 270 H THR 33 HN THR 33 -13.523 -4.179 -0.439 271 HA THR 33 HA THR 33 -11.375 -4.366 1.484 272 HB THR 33 HB THR 33 -11.748 -5.934 -1.072 273 HG1 THR 33 HG1 THR 33 -12.810 -7.443 0.219 274 HG21 THR 33 HG21 THR 33 -9.518 -6.055 0.115 275 HG22 THR 33 HG22 THR 33 -10.357 -7.582 -0.160 276 HG23 THR 33 HG23 THR 33 -10.382 -6.836 1.439 277 H PHE 34 HN PHE 34 -9.708 -3.036 1.350 278 HA PHE 34 HA PHE 34 -8.818 -2.123 -1.293 279 HB2 PHE 34 HB2 PHE 34 -8.677 -0.965 1.456 280 HB3 PHE 34 HB1 PHE 34 -7.395 -0.557 0.317 281 HD1 PHE 34 HD1 PHE 34 -11.086 -0.555 0.731 282 HD2 PHE 34 HD2 PHE 34 -7.715 1.104 -1.278 283 HE1 PHE 34 HE1 PHE 34 -12.538 1.146 -0.300 284 HE2 PHE 34 HE2 PHE 34 -9.161 2.811 -2.303 285 HZ PHE 34 HZ PHE 34 -11.575 2.832 -1.815 286 H ARG 35 HN ARG 35 -6.561 -2.174 -1.821 287 HA ARG 35 HA ARG 35 -4.994 -4.028 -0.170 288 HB2 ARG 35 HB2 ARG 35 -4.590 -5.482 -1.880 289 HB3 ARG 35 HB1 ARG 35 -6.161 -4.893 -2.404 290 HG2 ARG 35 HG2 ARG 35 -5.015 -4.703 -4.354 291 HG3 ARG 35 HG1 ARG 35 -4.682 -3.111 -3.670 292 HD2 ARG 35 HD2 ARG 35 -2.517 -3.563 -3.907 293 HD3 ARG 35 HD1 ARG 35 -2.699 -4.755 -2.622 294 HE ARG 35 HE ARG 35 -2.554 -6.425 -4.186 295 HH11 ARG 35 HH11 ARG 35 -3.085 -3.383 -5.813 296 HH12 ARG 35 HH12 ARG 35 -2.803 -4.035 -7.392 297 HH21 ARG 35 HH21 ARG 35 -2.185 -7.284 -6.261 298 HH22 ARG 35 HH22 ARG 35 -2.295 -6.250 -7.647 299 H LEU 36 HN LEU 36 -2.755 -3.768 -0.191 300 HA LEU 36 HA LEU 36 -1.826 -1.126 -0.577 301 HB2 LEU 36 HB2 LEU 36 -0.232 -3.668 -0.217 302 HB3 LEU 36 HB1 LEU 36 0.400 -2.037 -0.054 303 HG LEU 36 HG LEU 36 -1.671 -3.324 1.727 304 HD11 LEU 36 HD11 LEU 36 -0.022 -3.586 3.324 305 HD12 LEU 36 HD12 LEU 36 1.038 -2.391 2.577 306 HD13 LEU 36 HD13 LEU 36 0.839 -3.980 1.837 307 HD21 LEU 36 HD21 LEU 36 -2.229 -1.296 2.427 308 HD22 LEU 36 HD22 LEU 36 -1.178 -0.587 1.202 309 HD23 LEU 36 HD23 LEU 36 -0.544 -0.944 2.808 310 H LEU 37 HN LEU 37 -2.386 -0.713 -2.777 311 HA LEU 37 HA LEU 37 -1.917 -1.937 -5.070 312 HB2 LEU 37 HB2 LEU 37 -2.507 0.567 -4.509 313 HB3 LEU 37 HB1 LEU 37 -0.822 0.823 -4.920 314 HG LEU 37 HG LEU 37 -1.226 -0.204 -7.130 315 HD11 LEU 37 HD11 LEU 37 -3.861 -0.690 -5.918 316 HD12 LEU 37 HD12 LEU 37 -2.991 -1.595 -7.158 317 HD13 LEU 37 HD13 LEU 37 -3.873 -0.131 -7.590 318 HD21 LEU 37 HD21 LEU 37 -3.118 1.714 -7.647 319 HD22 LEU 37 HD22 LEU 37 -1.375 1.979 -7.585 320 HD23 LEU 37 HD23 LEU 37 -2.366 2.299 -6.162 321 H LEU 38 HN LEU 38 -0.353 -2.590 -6.384 322 HA LEU 38 HA LEU 38 1.668 -3.600 -6.793 323 HB2 LEU 38 HB2 LEU 38 3.382 -1.919 -7.415 324 HB3 LEU 38 HB1 LEU 38 1.803 -1.634 -8.118 325 HG LEU 38 HG LEU 38 2.398 -0.206 -5.588 326 HD11 LEU 38 HD11 LEU 38 3.465 1.601 -7.144 327 HD12 LEU 38 HD12 LEU 38 3.895 0.208 -8.135 328 HD13 LEU 38 HD13 LEU 38 4.460 0.311 -6.469 329 HD21 LEU 38 HD21 LEU 38 0.722 0.074 -7.984 330 HD22 LEU 38 HD22 LEU 38 1.408 1.579 -7.373 331 HD23 LEU 38 HD23 LEU 38 0.421 0.570 -6.319 332 H VAL 39 HN VAL 39 1.497 -4.362 -4.361 333 HA VAL 39 HA VAL 39 3.986 -3.514 -3.025 334 HB VAL 39 HB VAL 39 1.817 -3.044 -1.785 335 HG11 VAL 39 HG11 VAL 39 0.505 -4.962 -2.200 336 HG12 VAL 39 HG12 VAL 39 0.954 -5.052 -0.498 337 HG13 VAL 39 HG13 VAL 39 1.790 -6.051 -1.682 338 HG21 VAL 39 HG21 VAL 39 4.273 -3.577 -0.877 339 HG22 VAL 39 HG22 VAL 39 3.386 -4.872 -0.073 340 HG23 VAL 39 HG23 VAL 39 2.919 -3.191 0.185 341 H ASP 40 HN ASP 40 5.014 -5.241 -1.693 342 HA ASP 40 HA ASP 40 4.618 -7.907 -2.884 343 HB2 ASP 40 HB2 ASP 40 6.766 -6.495 -3.499 344 HB3 ASP 40 HB1 ASP 40 7.323 -7.065 -1.930 345 H THR 41 HN THR 41 4.695 -9.648 -1.513 346 HA THR 41 HA THR 41 4.705 -8.993 1.344 347 HB THR 41 HB THR 41 3.834 -11.619 1.095 348 HG1 THR 41 HG1 THR 41 3.658 -11.354 -1.155 349 HG21 THR 41 HG21 THR 41 2.492 -9.009 1.502 350 HG22 THR 41 HG22 THR 41 2.579 -10.420 2.557 351 HG23 THR 41 HG23 THR 41 1.491 -10.422 1.168 352 HA PRO 42 HA PRO 42 8.608 -11.199 1.488 353 HB2 PRO 42 HB2 PRO 42 9.306 -10.529 3.976 354 HB3 PRO 42 HB1 PRO 42 9.300 -9.328 2.677 355 HG2 PRO 42 HG2 PRO 42 7.264 -9.814 4.818 356 HG3 PRO 42 HG1 PRO 42 7.897 -8.276 4.205 357 HD2 PRO 42 HD2 PRO 42 5.503 -9.394 3.426 358 HD3 PRO 42 HD1 PRO 42 6.435 -8.242 2.450 359 H GLU 43 HN GLU 43 7.073 -13.161 1.400 360 HA GLU 43 HA GLU 43 6.518 -15.228 2.171 361 HB2 GLU 43 HB2 GLU 43 8.880 -14.446 3.748 362 HB3 GLU 43 HB1 GLU 43 7.899 -15.710 4.478 363 HG2 GLU 43 HG2 GLU 43 8.094 -17.040 2.439 364 HG3 GLU 43 HG1 GLU 43 9.081 -15.773 1.710 365 H THR 44 HN THR 44 6.021 -16.367 4.531 366 HA THR 44 HA THR 44 4.430 -14.507 6.131 367 HB THR 44 HB THR 44 3.222 -17.100 5.199 368 HG1 THR 44 HG1 THR 44 3.138 -14.569 3.942 369 HG21 THR 44 HG21 THR 44 2.310 -15.698 7.166 370 HG22 THR 44 HG22 THR 44 1.195 -16.290 5.933 371 HG23 THR 44 HG23 THR 44 1.736 -14.611 5.902 372 H LYS 45 HN LYS 45 6.904 -15.973 6.594 373 HA LYS 45 HA LYS 45 7.922 -17.191 8.223 374 HB2 LYS 45 HB2 LYS 45 5.306 -16.814 9.692 375 HB3 LYS 45 HB1 LYS 45 6.842 -17.273 10.413 376 HG2 LYS 45 HG2 LYS 45 6.715 -14.737 8.872 377 HG3 LYS 45 HG1 LYS 45 5.974 -14.791 10.473 378 HD2 LYS 45 HD2 LYS 45 8.045 -14.258 11.181 379 HD3 LYS 45 HD1 LYS 45 8.354 -15.984 10.974 380 HE2 LYS 45 HE2 LYS 45 9.147 -15.527 8.678 381 HE3 LYS 45 HE1 LYS 45 8.916 -13.803 8.968 382 HZ1 LYS 45 HZ1 LYS 45 10.623 -15.406 10.760 383 HZ2 LYS 45 HZ2 LYS 45 10.653 -13.739 10.474 384 HZ3 LYS 45 HZ3 LYS 45 11.237 -14.808 9.300 385 H HIS 46 HN HIS 46 7.953 -19.065 6.889 386 HA HIS 46 HA HIS 46 5.863 -20.977 6.865 387 HB2 HIS 46 HB2 HIS 46 8.662 -20.843 5.918 388 HB3 HIS 46 HB1 HIS 46 8.036 -22.459 6.226 389 HD1 HIS 46 HD1 HIS 46 6.982 -19.353 4.292 390 HD2 HIS 46 HD2 HIS 46 6.698 -23.495 4.117 391 HE1 HIS 46 HE1 HIS 46 5.835 -19.857 2.111 392 HE2 HIS 46 HE2 HIS 46 5.595 -22.364 2.069 393 HA PRO 47 HA PRO 47 6.464 -23.149 10.651 394 HB2 PRO 47 HB2 PRO 47 5.852 -25.696 9.944 395 HB3 PRO 47 HB1 PRO 47 4.634 -24.425 10.097 396 HG2 PRO 47 HG2 PRO 47 5.962 -25.489 7.633 397 HG3 PRO 47 HG1 PRO 47 4.254 -25.091 7.901 398 HD2 PRO 47 HD2 PRO 47 5.949 -23.432 6.595 399 HD3 PRO 47 HD1 PRO 47 4.599 -22.835 7.581 400 H LYS 48 HN LYS 48 8.629 -23.059 11.147 401 HA LYS 48 HA LYS 48 10.171 -25.451 10.517 402 HB2 LYS 48 HB2 LYS 48 10.768 -23.738 8.805 403 HB3 LYS 48 HB1 LYS 48 11.304 -22.680 10.102 404 HG2 LYS 48 HG2 LYS 48 13.313 -23.592 9.926 405 HG3 LYS 48 HG1 LYS 48 12.627 -25.098 10.537 406 HD2 LYS 48 HD2 LYS 48 13.240 -26.003 8.587 407 HD3 LYS 48 HD1 LYS 48 11.902 -25.102 7.874 408 HE2 LYS 48 HE2 LYS 48 13.718 -23.171 7.832 409 HE3 LYS 48 HE1 LYS 48 14.821 -24.546 7.817 410 HZ1 LYS 48 HZ1 LYS 48 14.310 -23.878 5.578 411 HZ2 LYS 48 HZ2 LYS 48 12.648 -24.013 5.863 412 HZ3 LYS 48 HZ3 LYS 48 13.620 -25.397 5.869 413 H LYS 49 HN LYS 49 10.723 -22.260 12.019 414 HA LYS 49 HA LYS 49 11.621 -23.672 14.444 415 HB2 LYS 49 HB2 LYS 49 12.386 -20.894 13.530 416 HB3 LYS 49 HB1 LYS 49 13.022 -21.745 14.931 417 HG2 LYS 49 HG2 LYS 49 14.219 -23.263 13.605 418 HG3 LYS 49 HG1 LYS 49 13.320 -22.827 12.150 419 HD2 LYS 49 HD2 LYS 49 14.344 -20.436 12.718 420 HD3 LYS 49 HD1 LYS 49 15.578 -21.438 13.484 421 HE2 LYS 49 HE2 LYS 49 14.794 -22.344 10.815 422 HE3 LYS 49 HE1 LYS 49 15.517 -20.737 10.839 423 HZ1 LYS 49 HZ1 LYS 49 17.252 -21.952 12.359 424 HZ2 LYS 49 HZ2 LYS 49 17.372 -22.023 10.674 425 HZ3 LYS 49 HZ3 LYS 49 16.708 -23.322 11.529 426 H GLY 50 HN GLY 50 8.866 -22.976 13.776 427 HA2 GLY 50 HA2 GLY 50 7.236 -22.498 15.484 428 HA3 GLY 50 HA1 GLY 50 8.324 -21.271 16.118 429 H VAL 51 HN VAL 51 5.451 -21.334 15.030 430 HA VAL 51 HA VAL 51 5.766 -18.965 13.309 431 HB VAL 51 HB VAL 51 3.563 -21.003 12.994 432 HG11 VAL 51 HG11 VAL 51 2.643 -19.184 12.022 433 HG12 VAL 51 HG12 VAL 51 3.667 -19.662 10.669 434 HG13 VAL 51 HG13 VAL 51 4.200 -18.395 11.773 435 HG21 VAL 51 HG21 VAL 51 4.692 -21.807 11.024 436 HG22 VAL 51 HG22 VAL 51 5.782 -21.937 12.406 437 HG23 VAL 51 HG23 VAL 51 5.987 -20.628 11.242 438 H GLU 52 HN GLU 52 5.468 -17.633 15.140 439 HA GLU 52 HA GLU 52 3.061 -17.867 16.716 440 HB2 GLU 52 HB2 GLU 52 5.500 -16.883 17.287 441 HB3 GLU 52 HB1 GLU 52 4.687 -15.391 16.840 442 HG2 GLU 52 HG2 GLU 52 3.461 -15.351 18.708 443 HG3 GLU 52 HG1 GLU 52 3.157 -17.088 18.666 444 H LYS 53 HN LYS 53 4.350 -15.621 14.291 445 HA LYS 53 HA LYS 53 1.603 -14.660 13.854 446 HB2 LYS 53 HB2 LYS 53 4.041 -12.905 13.598 447 HB3 LYS 53 HB1 LYS 53 2.352 -12.416 13.575 448 HG2 LYS 53 HG2 LYS 53 3.018 -13.791 16.028 449 HG3 LYS 53 HG1 LYS 53 4.070 -12.401 15.753 450 HD2 LYS 53 HD2 LYS 53 1.663 -11.343 15.114 451 HD3 LYS 53 HD1 LYS 53 1.187 -12.510 16.348 452 HE2 LYS 53 HE2 LYS 53 3.030 -11.526 17.784 453 HE3 LYS 53 HE1 LYS 53 3.133 -10.228 16.596 454 HZ1 LYS 53 HZ1 LYS 53 0.716 -9.846 16.995 455 HZ2 LYS 53 HZ2 LYS 53 1.703 -9.511 18.327 456 HZ3 LYS 53 HZ3 LYS 53 0.800 -10.941 18.284 457 H TYR 54 HN TYR 54 1.909 -13.099 11.694 458 HA TYR 54 HA TYR 54 2.935 -14.970 9.667 459 HB2 TYR 54 HB2 TYR 54 0.969 -12.749 9.141 460 HB3 TYR 54 HB1 TYR 54 1.282 -14.185 8.173 461 HD1 TYR 54 HD2 TYR 54 -0.076 -13.106 11.468 462 HD2 TYR 54 HD1 TYR 54 -0.058 -16.081 8.426 463 HE1 TYR 54 HE2 TYR 54 -1.935 -14.259 12.591 464 HE2 TYR 54 HE1 TYR 54 -1.916 -17.241 9.541 465 HH TYR 54 HH TYR 54 -2.893 -17.408 11.801 466 H GLY 55 HN GLY 55 2.473 -11.464 10.154 467 HA2 GLY 55 HA2 GLY 55 5.159 -11.011 9.083 468 HA3 GLY 55 HA1 GLY 55 3.816 -10.247 8.247 469 HA PRO 56 HA PRO 56 3.935 -8.393 12.819 470 HB2 PRO 56 HB2 PRO 56 6.817 -8.947 13.318 471 HB3 PRO 56 HB1 PRO 56 5.458 -8.947 14.447 472 HG2 PRO 56 HG2 PRO 56 6.521 -11.238 13.609 473 HG3 PRO 56 HG1 PRO 56 4.768 -11.072 13.826 474 HD2 PRO 56 HD2 PRO 56 6.378 -11.078 11.308 475 HD3 PRO 56 HD1 PRO 56 4.769 -11.762 11.623 476 H GLU 57 HN GLU 57 6.628 -8.363 10.548 477 HA GLU 57 HA GLU 57 7.339 -5.638 11.127 478 HB2 GLU 57 HB2 GLU 57 8.288 -7.764 9.295 479 HB3 GLU 57 HB1 GLU 57 8.568 -6.106 8.778 480 HG2 GLU 57 HG2 GLU 57 9.288 -6.711 11.565 481 HG3 GLU 57 HG1 GLU 57 10.255 -7.512 10.328 482 H ALA 58 HN ALA 58 5.914 -7.262 8.284 483 HA ALA 58 HA ALA 58 5.228 -4.743 7.070 484 HB1 ALA 58 HB1 ALA 58 5.669 -7.300 6.128 485 HB2 ALA 58 HB2 ALA 58 5.077 -5.928 5.193 486 HB3 ALA 58 HB3 ALA 58 3.935 -7.065 5.908 487 H SER 59 HN SER 59 3.288 -7.526 8.175 488 HA SER 59 HA SER 59 0.781 -6.422 7.833 489 HB2 SER 59 HB2 SER 59 1.718 -8.802 8.763 490 HB3 SER 59 HB1 SER 59 1.058 -8.101 10.239 491 HG SER 59 HG SER 59 -0.241 -9.160 8.127 492 H ALA 60 HN ALA 60 2.763 -6.351 10.797 493 HA ALA 60 HA ALA 60 0.910 -4.869 12.315 494 HB1 ALA 60 HB1 ALA 60 3.084 -6.224 12.981 495 HB2 ALA 60 HB2 ALA 60 2.442 -4.930 13.994 496 HB3 ALA 60 HB3 ALA 60 3.802 -4.615 12.916 497 H PHE 61 HN PHE 61 3.895 -3.804 10.665 498 HA PHE 61 HA PHE 61 3.782 -1.123 11.282 499 HB2 PHE 61 HB2 PHE 61 5.670 -2.211 10.125 500 HB3 PHE 61 HB1 PHE 61 4.696 -2.319 8.661 501 HD1 PHE 61 HD1 PHE 61 6.286 0.028 11.018 502 HD2 PHE 61 HD2 PHE 61 4.483 -0.490 7.205 503 HE1 PHE 61 HE1 PHE 61 7.038 2.281 10.361 504 HE2 PHE 61 HE2 PHE 61 5.223 1.756 6.535 505 HZ PHE 61 HZ PHE 61 6.506 3.147 8.116 506 H THR 62 HN THR 62 2.456 -2.646 8.335 507 HA THR 62 HA THR 62 1.298 -0.386 7.224 508 HB THR 62 HB THR 62 0.278 -3.235 7.123 509 HG1 THR 62 HG1 THR 62 1.560 -3.429 5.340 510 HG21 THR 62 HG21 THR 62 -0.659 -2.601 4.934 511 HG22 THR 62 HG22 THR 62 -0.271 -0.917 5.287 512 HG23 THR 62 HG23 THR 62 -1.438 -1.783 6.288 513 H LYS 63 HN LYS 63 0.035 -2.595 9.660 514 HA LYS 63 HA LYS 63 -2.544 -1.375 9.816 515 HB2 LYS 63 HB2 LYS 63 -2.431 -3.635 10.497 516 HB3 LYS 63 HB1 LYS 63 -1.038 -3.344 11.526 517 HG2 LYS 63 HG2 LYS 63 -2.375 -3.093 13.268 518 HG3 LYS 63 HG1 LYS 63 -3.158 -1.725 12.479 519 HD2 LYS 63 HD2 LYS 63 -4.970 -3.081 12.754 520 HD3 LYS 63 HD1 LYS 63 -4.415 -3.662 11.181 521 HE2 LYS 63 HE2 LYS 63 -2.951 -5.164 12.977 522 HE3 LYS 63 HE1 LYS 63 -4.535 -5.036 13.744 523 HZ1 LYS 63 HZ1 LYS 63 -3.916 -6.865 11.909 524 HZ2 LYS 63 HZ2 LYS 63 -4.565 -5.663 10.913 525 HZ3 LYS 63 HZ3 LYS 63 -5.490 -6.304 12.175 526 H LYS 64 HN LYS 64 0.535 -0.927 11.396 527 HA LYS 64 HA LYS 64 -0.284 0.566 13.617 528 HB2 LYS 64 HB2 LYS 64 2.230 0.106 12.147 529 HB3 LYS 64 HB1 LYS 64 2.164 1.618 13.041 530 HG2 LYS 64 HG2 LYS 64 1.375 -0.911 14.404 531 HG3 LYS 64 HG1 LYS 64 3.086 -0.556 14.151 532 HD2 LYS 64 HD2 LYS 64 2.688 1.670 15.238 533 HD3 LYS 64 HD1 LYS 64 1.066 1.107 15.648 534 HE2 LYS 64 HE2 LYS 64 3.442 -0.541 16.397 535 HE3 LYS 64 HE1 LYS 64 3.016 0.868 17.368 536 HZ1 LYS 64 HZ1 LYS 64 2.021 -1.542 17.807 537 HZ2 LYS 64 HZ2 LYS 64 0.852 -0.969 16.728 538 HZ3 LYS 64 HZ3 LYS 64 1.167 -0.124 18.159 539 H MET 65 HN MET 65 0.971 1.702 10.494 540 HA MET 65 HA MET 65 0.594 4.434 10.967 541 HB2 MET 65 HB2 MET 65 0.599 2.990 8.314 542 HB3 MET 65 HB1 MET 65 0.857 4.713 8.552 543 HG2 MET 65 HG2 MET 65 2.630 2.731 9.906 544 HG3 MET 65 HG1 MET 65 2.882 3.141 8.211 545 HE1 MET 65 HE1 MET 65 5.411 4.600 10.836 546 HE2 MET 65 HE2 MET 65 4.286 3.256 11.026 547 HE3 MET 65 HE3 MET 65 4.033 4.751 11.926 548 H VAL 66 HN VAL 66 -1.511 2.153 9.201 549 HA VAL 66 HA VAL 66 -3.469 4.074 8.545 550 HB VAL 66 HB VAL 66 -4.963 2.128 8.120 551 HG11 VAL 66 HG11 VAL 66 -3.464 2.983 6.393 552 HG12 VAL 66 HG12 VAL 66 -3.653 1.235 6.264 553 HG13 VAL 66 HG13 VAL 66 -2.184 1.914 6.965 554 HG21 VAL 66 HG21 VAL 66 -2.794 0.743 9.576 555 HG22 VAL 66 HG22 VAL 66 -3.467 -0.091 8.176 556 HG23 VAL 66 HG23 VAL 66 -4.520 0.391 9.505 557 H GLU 67 HN GLU 67 -3.329 1.715 11.206 558 HA GLU 67 HA GLU 67 -5.850 2.423 12.273 559 HB2 GLU 67 HB2 GLU 67 -3.498 1.021 13.541 560 HB3 GLU 67 HB1 GLU 67 -5.087 1.163 14.283 561 HG2 GLU 67 HG2 GLU 67 -4.469 -0.217 11.681 562 HG3 GLU 67 HG1 GLU 67 -4.796 -1.002 13.228 563 H ASN 68 HN ASN 68 -2.536 3.298 13.273 564 HA ASN 68 HA ASN 68 -3.351 4.950 15.417 565 HB2 ASN 68 HB2 ASN 68 -0.801 4.777 13.822 566 HB3 ASN 68 HB1 ASN 68 -1.011 5.967 15.101 567 HD21 ASN 68 HD21 ASN 68 -1.156 2.503 14.435 568 HD22 ASN 68 HD22 ASN 68 -0.674 1.999 16.015 569 H ALA 69 HN ALA 69 -2.972 5.516 11.993 570 HA ALA 69 HA ALA 69 -2.961 8.347 12.080 571 HB1 ALA 69 HB1 ALA 69 -3.775 8.065 9.653 572 HB2 ALA 69 HB2 ALA 69 -3.547 6.339 9.935 573 HB3 ALA 69 HB3 ALA 69 -2.181 7.445 10.083 574 H LYS 70 HN LYS 70 -4.546 9.576 12.830 575 HA LYS 70 HA LYS 70 -7.146 8.743 13.381 576 HB2 LYS 70 HB2 LYS 70 -6.006 11.502 12.947 577 HB3 LYS 70 HB1 LYS 70 -7.657 11.221 13.482 578 HG2 LYS 70 HG2 LYS 70 -6.690 9.927 15.413 579 HG3 LYS 70 HG1 LYS 70 -5.110 10.541 14.922 580 HD2 LYS 70 HD2 LYS 70 -7.479 12.296 15.551 581 HD3 LYS 70 HD1 LYS 70 -6.230 11.870 16.722 582 HE2 LYS 70 HE2 LYS 70 -5.340 12.981 14.122 583 HE3 LYS 70 HE1 LYS 70 -6.126 14.089 15.246 584 HZ1 LYS 70 HZ1 LYS 70 -3.560 13.694 15.326 585 HZ2 LYS 70 HZ2 LYS 70 -3.993 12.348 16.255 586 HZ3 LYS 70 HZ3 LYS 70 -4.443 13.900 16.755 587 H LYS 71 HN LYS 71 -5.730 9.750 10.404 588 HA LYS 71 HA LYS 71 -8.338 9.471 9.101 589 HB2 LYS 71 HB2 LYS 71 -7.442 11.938 9.496 590 HB3 LYS 71 HB1 LYS 71 -6.491 11.568 8.065 591 HG2 LYS 71 HG2 LYS 71 -8.492 11.119 6.796 592 HG3 LYS 71 HG1 LYS 71 -9.489 11.352 8.233 593 HD2 LYS 71 HD2 LYS 71 -7.661 13.557 7.445 594 HD3 LYS 71 HD1 LYS 71 -9.096 13.288 6.454 595 HE2 LYS 71 HE2 LYS 71 -9.802 13.183 9.230 596 HE3 LYS 71 HE1 LYS 71 -8.912 14.668 8.901 597 HZ1 LYS 71 HZ1 LYS 71 -10.564 15.481 7.635 598 HZ2 LYS 71 HZ2 LYS 71 -11.528 14.403 8.512 599 HZ3 LYS 71 HZ3 LYS 71 -10.970 13.978 6.973 600 H ILE 72 HN ILE 72 -8.295 8.460 7.150 601 HA ILE 72 HA ILE 72 -5.650 7.681 6.112 602 HB ILE 72 HB ILE 72 -8.111 6.007 5.744 603 HG12 ILE 72 HG12 ILE 72 -6.100 5.720 7.986 604 HG13 ILE 72 HG11 ILE 72 -7.741 6.330 8.181 605 HG21 ILE 72 HG21 ILE 72 -5.841 5.813 4.454 606 HG22 ILE 72 HG22 ILE 72 -6.705 4.370 4.985 607 HG23 ILE 72 HG23 ILE 72 -5.329 4.967 5.914 608 HD11 ILE 72 HD11 ILE 72 -6.768 3.577 7.837 609 HD12 ILE 72 HD12 ILE 72 -8.259 3.984 6.987 610 HD13 ILE 72 HD13 ILE 72 -8.155 4.193 8.735 611 H GLU 73 HN GLU 73 -5.358 7.692 3.899 612 HA GLU 73 HA GLU 73 -7.593 8.735 2.286 613 HB2 GLU 73 HB2 GLU 73 -4.761 9.533 1.706 614 HB3 GLU 73 HB1 GLU 73 -6.254 10.331 1.235 615 HG2 GLU 73 HG2 GLU 73 -6.602 11.124 3.471 616 HG3 GLU 73 HG1 GLU 73 -5.225 10.193 4.059 617 H VAL 74 HN VAL 74 -7.855 7.854 0.277 618 HA VAL 74 HA VAL 74 -5.894 5.801 -0.507 619 HB VAL 74 HB VAL 74 -7.896 4.711 -1.682 620 HG11 VAL 74 HG11 VAL 74 -7.860 3.196 -0.040 621 HG12 VAL 74 HG12 VAL 74 -8.384 4.361 1.177 622 HG13 VAL 74 HG13 VAL 74 -6.683 4.268 0.720 623 HG21 VAL 74 HG21 VAL 74 -9.241 6.910 -0.819 624 HG22 VAL 74 HG22 VAL 74 -9.658 5.735 0.428 625 HG23 VAL 74 HG23 VAL 74 -10.000 5.382 -1.266 626 H GLU 75 HN GLU 75 -5.336 5.616 -2.635 627 HA GLU 75 HA GLU 75 -6.535 7.527 -4.519 628 HB2 GLU 75 HB2 GLU 75 -4.349 8.372 -3.595 629 HB3 GLU 75 HB1 GLU 75 -3.569 6.983 -4.338 630 HG2 GLU 75 HG2 GLU 75 -4.977 8.030 -6.426 631 HG3 GLU 75 HG1 GLU 75 -4.505 9.474 -5.532 632 H PHE 76 HN PHE 76 -7.509 6.245 -5.962 633 HA PHE 76 HA PHE 76 -6.588 3.621 -6.588 634 HB2 PHE 76 HB2 PHE 76 -8.743 5.371 -7.774 635 HB3 PHE 76 HB1 PHE 76 -8.397 3.750 -8.364 636 HD1 PHE 76 HD2 PHE 76 -8.089 2.067 -6.152 637 HD2 PHE 76 HD1 PHE 76 -10.644 5.454 -6.511 638 HE1 PHE 76 HE2 PHE 76 -9.574 1.126 -4.431 639 HE2 PHE 76 HE1 PHE 76 -12.132 4.518 -4.789 640 HZ PHE 76 HZ PHE 76 -11.598 2.351 -3.748 641 H ASP 77 HN ASP 77 -5.770 2.864 -8.514 642 HA ASP 77 HA ASP 77 -3.775 4.390 -9.724 643 HB2 ASP 77 HB2 ASP 77 -3.548 2.543 -11.311 644 HB3 ASP 77 HB1 ASP 77 -3.778 1.927 -9.681 645 H LYS 78 HN LYS 78 -4.048 3.883 -12.478 646 HA LYS 78 HA LYS 78 -6.123 5.846 -13.177 647 HB2 LYS 78 HB2 LYS 78 -4.508 5.902 -15.335 648 HB3 LYS 78 HB1 LYS 78 -4.295 6.949 -13.940 649 HG2 LYS 78 HG2 LYS 78 -2.945 4.388 -13.644 650 HG3 LYS 78 HG1 LYS 78 -2.387 5.302 -15.035 651 HD2 LYS 78 HD2 LYS 78 -2.704 6.975 -12.695 652 HD3 LYS 78 HD1 LYS 78 -1.591 5.637 -12.414 653 HE2 LYS 78 HE2 LYS 78 -0.669 7.862 -13.362 654 HE3 LYS 78 HE1 LYS 78 -0.121 6.340 -14.061 655 HZ1 LYS 78 HZ1 LYS 78 -1.248 6.711 -15.985 656 HZ2 LYS 78 HZ2 LYS 78 -0.943 8.318 -15.554 657 HZ3 LYS 78 HZ3 LYS 78 -2.460 7.636 -15.251 658 H GLY 79 HN GLY 79 -4.688 2.754 -14.032 659 HA2 GLY 79 HA2 GLY 79 -6.490 2.441 -16.299 660 HA3 GLY 79 HA1 GLY 79 -5.253 1.305 -15.791 661 H GLN 80 HN GLN 80 -5.792 -0.381 -14.501 662 HA GLN 80 HA GLN 80 -8.302 -1.417 -14.474 663 HB2 GLN 80 HB2 GLN 80 -5.851 -2.207 -13.544 664 HB3 GLN 80 HB1 GLN 80 -6.784 -2.108 -12.060 665 HG2 GLN 80 HG2 GLN 80 -8.356 -3.667 -12.818 666 HG3 GLN 80 HG1 GLN 80 -7.757 -3.577 -14.474 667 HE21 GLN 80 HE21 GLN 80 -5.642 -4.442 -14.910 668 HE22 GLN 80 HE22 GLN 80 -5.029 -5.740 -13.948 669 H ARG 81 HN ARG 81 -6.971 -0.502 -11.325 670 HA ARG 81 HA ARG 81 -7.807 0.814 -9.638 671 HB2 ARG 81 HB2 ARG 81 -10.318 1.153 -11.278 672 HB3 ARG 81 HB1 ARG 81 -9.864 2.060 -9.845 673 HG2 ARG 81 HG2 ARG 81 -7.926 2.967 -11.081 674 HG3 ARG 81 HG1 ARG 81 -8.497 2.130 -12.526 675 HD2 ARG 81 HD2 ARG 81 -9.155 4.524 -12.431 676 HD3 ARG 81 HD1 ARG 81 -10.522 3.417 -12.544 677 HE ARG 81 HE ARG 81 -9.853 4.139 -9.846 678 HH11 ARG 81 HH11 ARG 81 -11.643 5.082 -12.690 679 HH12 ARG 81 HH12 ARG 81 -12.783 6.040 -11.807 680 HH21 ARG 81 HH21 ARG 81 -11.352 5.400 -8.684 681 HH22 ARG 81 HH22 ARG 81 -12.618 6.222 -9.534 682 H THR 82 HN THR 82 -9.247 -1.941 -11.007 683 HA THR 82 HA THR 82 -10.037 -2.887 -8.415 684 HB THR 82 HB THR 82 -12.373 -3.523 -9.410 685 HG1 THR 82 HG1 THR 82 -11.833 -1.133 -10.833 686 HG21 THR 82 HG21 THR 82 -13.404 -1.728 -8.350 687 HG22 THR 82 HG22 THR 82 -12.064 -0.634 -8.694 688 HG23 THR 82 HG23 THR 82 -11.871 -1.915 -7.498 689 H ASP 83 HN ASP 83 -9.498 -4.958 -8.316 690 HA ASP 83 HA ASP 83 -8.769 -6.383 -10.712 691 HB2 ASP 83 HB2 ASP 83 -8.769 -7.256 -7.814 692 HB3 ASP 83 HB1 ASP 83 -8.073 -8.173 -9.148 693 H LYS 84 HN LYS 84 -9.397 -8.957 -10.285 694 HA LYS 84 HA LYS 84 -11.821 -9.394 -11.405 695 HB2 LYS 84 HB2 LYS 84 -11.722 -11.591 -9.833 696 HB3 LYS 84 HB1 LYS 84 -10.784 -11.398 -11.310 697 HG2 LYS 84 HG2 LYS 84 -9.528 -10.344 -8.865 698 HG3 LYS 84 HG1 LYS 84 -9.748 -12.094 -8.918 699 HD2 LYS 84 HD2 LYS 84 -8.739 -11.075 -11.433 700 HD3 LYS 84 HD1 LYS 84 -7.689 -10.628 -10.087 701 HE2 LYS 84 HE2 LYS 84 -8.568 -13.380 -9.893 702 HE3 LYS 84 HE1 LYS 84 -7.748 -13.066 -11.422 703 HZ1 LYS 84 HZ1 LYS 84 -6.463 -13.681 -9.192 704 HZ2 LYS 84 HZ2 LYS 84 -6.479 -11.998 -9.031 705 HZ3 LYS 84 HZ3 LYS 84 -5.786 -12.709 -10.400 706 H TYR 85 HN TYR 85 -11.320 -9.923 -7.919 707 HA TYR 85 HA TYR 85 -14.069 -10.047 -7.337 708 HB2 TYR 85 HB2 TYR 85 -11.548 -10.043 -5.819 709 HB3 TYR 85 HB1 TYR 85 -12.931 -9.405 -4.937 710 HD1 TYR 85 HD1 TYR 85 -12.901 -12.125 -7.466 711 HD2 TYR 85 HD2 TYR 85 -13.361 -11.093 -3.366 712 HE1 TYR 85 HE1 TYR 85 -13.633 -14.421 -6.978 713 HE2 TYR 85 HE2 TYR 85 -14.094 -13.385 -2.865 714 HH TYR 85 HH TYR 85 -13.553 -15.872 -4.419 715 H GLY 86 HN GLY 86 -12.134 -7.410 -8.090 716 HA2 GLY 86 HA2 GLY 86 -12.909 -5.204 -8.322 717 HA3 GLY 86 HA1 GLY 86 -14.222 -5.573 -7.212 718 H ARG 87 HN ARG 87 -11.037 -6.539 -6.332 719 HA ARG 87 HA ARG 87 -10.988 -5.341 -3.868 720 HB2 ARG 87 HB2 ARG 87 -9.234 -6.872 -5.370 721 HB3 ARG 87 HB1 ARG 87 -8.333 -5.396 -5.070 722 HG2 ARG 87 HG2 ARG 87 -7.758 -6.749 -3.282 723 HG3 ARG 87 HG1 ARG 87 -9.024 -5.714 -2.616 724 HD2 ARG 87 HD2 ARG 87 -9.212 -8.166 -2.062 725 HD3 ARG 87 HD1 ARG 87 -10.642 -7.430 -2.778 726 HE ARG 87 HE ARG 87 -10.224 -8.594 -4.775 727 HH11 ARG 87 HH11 ARG 87 -7.876 -9.361 -2.301 728 HH12 ARG 87 HH12 ARG 87 -7.344 -10.808 -3.086 729 HH21 ARG 87 HH21 ARG 87 -9.518 -10.496 -5.802 730 HH22 ARG 87 HH22 ARG 87 -8.272 -11.451 -5.070 731 H GLY 88 HN GLY 88 -9.395 -3.630 -3.108 732 HA2 GLY 88 HA2 GLY 88 -9.934 -1.213 -4.643 733 HA3 GLY 88 HA1 GLY 88 -9.357 -1.283 -2.987 734 H LEU 89 HN LEU 89 -8.509 -0.960 -6.276 735 HA LEU 89 HA LEU 89 -5.691 -1.477 -5.887 736 HB2 LEU 89 HB2 LEU 89 -7.318 -0.475 -8.206 737 HB3 LEU 89 HB1 LEU 89 -5.571 -0.564 -8.260 738 HG LEU 89 HG LEU 89 -6.912 -2.489 -9.284 739 HD11 LEU 89 HD11 LEU 89 -5.259 -4.162 -8.457 740 HD12 LEU 89 HD12 LEU 89 -4.705 -2.955 -7.296 741 HD13 LEU 89 HD13 LEU 89 -4.548 -2.651 -9.026 742 HD21 LEU 89 HD21 LEU 89 -8.415 -2.680 -7.265 743 HD22 LEU 89 HD22 LEU 89 -7.051 -3.429 -6.436 744 HD23 LEU 89 HD23 LEU 89 -7.735 -4.189 -7.872 745 H ALA 90 HN ALA 90 -5.752 0.183 -4.063 746 HA ALA 90 HA ALA 90 -4.775 2.714 -5.140 747 HB1 ALA 90 HB1 ALA 90 -6.132 3.854 -3.232 748 HB2 ALA 90 HB2 ALA 90 -7.161 2.428 -3.364 749 HB3 ALA 90 HB3 ALA 90 -6.922 3.476 -4.760 750 H TYR 91 HN TYR 91 -3.772 4.064 -3.396 751 HA TYR 91 HA TYR 91 -2.300 2.310 -1.580 752 HB2 TYR 91 HB2 TYR 91 -1.652 5.209 -1.999 753 HB3 TYR 91 HB1 TYR 91 -0.578 3.890 -1.554 754 HD1 TYR 91 HD2 TYR 91 -2.552 5.285 -4.371 755 HD2 TYR 91 HD1 TYR 91 0.645 2.735 -3.199 756 HE1 TYR 91 HE2 TYR 91 -1.879 5.059 -6.724 757 HE2 TYR 91 HE1 TYR 91 1.329 2.504 -5.550 758 HH TYR 91 HH TYR 91 1.088 3.807 -7.675 759 H ILE 92 HN ILE 92 -2.362 2.521 0.612 760 HA ILE 92 HA ILE 92 -4.504 4.201 1.679 761 HB ILE 92 HB ILE 92 -2.873 2.112 3.124 762 HG12 ILE 92 HG12 ILE 92 -5.098 0.802 2.827 763 HG13 ILE 92 HG11 ILE 92 -5.398 1.920 1.500 764 HG21 ILE 92 HG21 ILE 92 -5.537 3.345 3.806 765 HG22 ILE 92 HG22 ILE 92 -3.997 3.778 4.549 766 HG23 ILE 92 HG23 ILE 92 -4.653 2.155 4.762 767 HD11 ILE 92 HD11 ILE 92 -4.040 -0.460 1.348 768 HD12 ILE 92 HD12 ILE 92 -2.749 0.742 1.390 769 HD13 ILE 92 HD13 ILE 92 -4.003 0.838 0.154 770 H TYR 93 HN TYR 93 -4.113 6.069 2.652 771 HA TYR 93 HA TYR 93 -1.362 6.716 3.416 772 HB2 TYR 93 HB2 TYR 93 -3.760 8.528 3.078 773 HB3 TYR 93 HB1 TYR 93 -2.136 9.059 3.478 774 HD1 TYR 93 HD2 TYR 93 -3.010 6.486 0.938 775 HD2 TYR 93 HD1 TYR 93 -1.703 10.467 1.655 776 HE1 TYR 93 HE2 TYR 93 -2.538 6.748 -1.452 777 HE2 TYR 93 HE1 TYR 93 -1.213 10.739 -0.739 778 HH TYR 93 HH TYR 93 -2.324 9.314 -3.018 779 H ALA 94 HN ALA 94 -0.959 7.853 5.408 780 HA ALA 94 HA ALA 94 -3.004 7.592 7.481 781 HB1 ALA 94 HB1 ALA 94 -0.774 6.781 8.847 782 HB2 ALA 94 HB2 ALA 94 -0.573 5.977 7.291 783 HB3 ALA 94 HB3 ALA 94 -2.039 5.715 8.235 784 H ASP 95 HN ASP 95 -3.187 9.560 8.319 785 HA ASP 95 HA ASP 95 -2.660 11.541 9.310 786 HB2 ASP 95 HB2 ASP 95 -0.644 9.887 10.142 787 HB3 ASP 95 HB1 ASP 95 0.258 11.184 9.364 788 H GLY 96 HN GLY 96 -2.048 10.771 6.284 789 HA2 GLY 96 HA2 GLY 96 -2.070 12.575 4.658 790 HA3 GLY 96 HA1 GLY 96 -0.918 13.425 5.672 791 H LYS 97 HN LYS 97 -0.252 10.106 5.436 792 HA LYS 97 HA LYS 97 1.556 10.538 3.174 793 HB2 LYS 97 HB2 LYS 97 2.271 9.819 5.963 794 HB3 LYS 97 HB1 LYS 97 3.135 8.985 4.679 795 HG2 LYS 97 HG2 LYS 97 4.053 10.965 3.850 796 HG3 LYS 97 HG1 LYS 97 2.891 11.968 4.722 797 HD2 LYS 97 HD2 LYS 97 4.351 10.341 6.580 798 HD3 LYS 97 HD1 LYS 97 5.479 11.209 5.537 799 HE2 LYS 97 HE2 LYS 97 4.401 13.315 6.087 800 HE3 LYS 97 HE1 LYS 97 3.211 12.469 7.075 801 HZ1 LYS 97 HZ1 LYS 97 5.473 13.539 8.023 802 HZ2 LYS 97 HZ2 LYS 97 5.968 11.941 7.771 803 HZ3 LYS 97 HZ3 LYS 97 4.642 12.266 8.769 804 H MET 98 HN MET 98 1.805 8.814 1.827 805 HA MET 98 HA MET 98 -0.097 6.718 1.991 806 HB2 MET 98 HB2 MET 98 2.269 6.416 0.208 807 HB3 MET 98 HB1 MET 98 0.569 6.090 -0.108 808 HG2 MET 98 HG2 MET 98 0.594 7.956 -1.308 809 HG3 MET 98 HG1 MET 98 0.594 8.807 0.236 810 HE1 MET 98 HE1 MET 98 1.528 10.873 -1.034 811 HE2 MET 98 HE2 MET 98 1.771 10.067 -2.584 812 HE3 MET 98 HE3 MET 98 3.099 10.950 -1.832 813 H VAL 99 HN VAL 99 -0.006 5.113 3.369 814 HA VAL 99 HA VAL 99 2.217 4.303 4.839 815 HB VAL 99 HB VAL 99 -0.052 2.438 4.190 816 HG11 VAL 99 HG11 VAL 99 1.667 2.858 6.630 817 HG12 VAL 99 HG12 VAL 99 1.717 1.490 5.518 818 HG13 VAL 99 HG13 VAL 99 0.303 1.743 6.540 819 HG21 VAL 99 HG21 VAL 99 -1.537 3.886 4.992 820 HG22 VAL 99 HG22 VAL 99 -0.268 5.063 5.328 821 HG23 VAL 99 HG23 VAL 99 -0.688 3.851 6.538 822 H ASN 100 HN ASN 100 0.877 2.993 1.838 823 HA ASN 100 HA ASN 100 2.372 0.688 1.573 824 HB2 ASN 100 HB2 ASN 100 1.655 2.576 -0.677 825 HB3 ASN 100 HB1 ASN 100 1.977 0.849 -0.810 826 HD21 ASN 100 HD21 ASN 100 -0.133 0.812 -1.835 827 HD22 ASN 100 HD22 ASN 100 -1.546 0.717 -0.851 828 H GLU 101 HN GLU 101 3.235 3.963 0.468 829 HA GLU 101 HA GLU 101 5.688 3.398 -0.685 830 HB2 GLU 101 HB2 GLU 101 4.418 5.608 -0.652 831 HB3 GLU 101 HB1 GLU 101 5.146 5.890 0.922 832 HG2 GLU 101 HG2 GLU 101 7.150 5.131 -0.993 833 HG3 GLU 101 HG1 GLU 101 6.210 6.499 -1.585 834 H ALA 102 HN ALA 102 4.936 4.121 2.706 835 HA ALA 102 HA ALA 102 7.518 4.224 3.725 836 HB1 ALA 102 HB1 ALA 102 5.920 4.867 5.248 837 HB2 ALA 102 HB2 ALA 102 6.337 3.263 5.849 838 HB3 ALA 102 HB3 ALA 102 4.873 3.494 4.894 839 H LEU 103 HN LEU 103 5.365 1.380 3.658 840 HA LEU 103 HA LEU 103 7.168 -0.490 4.634 841 HB2 LEU 103 HB2 LEU 103 4.762 -0.657 2.868 842 HB3 LEU 103 HB1 LEU 103 5.750 -2.086 3.101 843 HG LEU 103 HG LEU 103 5.354 -1.216 5.680 844 HD11 LEU 103 HD11 LEU 103 2.772 -0.842 4.168 845 HD12 LEU 103 HD12 LEU 103 3.730 0.451 4.889 846 HD13 LEU 103 HD13 LEU 103 2.984 -0.772 5.917 847 HD21 LEU 103 HD21 LEU 103 4.269 -3.221 5.968 848 HD22 LEU 103 HD22 LEU 103 5.119 -3.513 4.449 849 HD23 LEU 103 HD23 LEU 103 3.405 -3.097 4.436 850 H VAL 104 HN VAL 104 6.677 0.704 1.366 851 HA VAL 104 HA VAL 104 8.341 -1.150 0.039 852 HB VAL 104 HB VAL 104 7.764 1.686 -0.821 853 HG11 VAL 104 HG11 VAL 104 9.151 1.096 -2.476 854 HG12 VAL 104 HG12 VAL 104 7.810 0.106 -3.054 855 HG13 VAL 104 HG13 VAL 104 9.073 -0.616 -2.057 856 HG21 VAL 104 HG21 VAL 104 6.089 -0.251 -2.095 857 HG22 VAL 104 HG22 VAL 104 5.631 1.158 -1.141 858 HG23 VAL 104 HG23 VAL 104 5.916 -0.389 -0.346 859 H ARG 105 HN ARG 105 8.960 2.105 1.325 860 HA ARG 105 HA ARG 105 11.720 2.041 0.536 861 HB2 ARG 105 HB2 ARG 105 11.904 4.209 1.474 862 HB3 ARG 105 HB1 ARG 105 10.321 4.129 0.715 863 HG2 ARG 105 HG2 ARG 105 9.367 4.731 2.613 864 HG3 ARG 105 HG1 ARG 105 10.034 3.309 3.413 865 HD2 ARG 105 HD2 ARG 105 11.793 5.672 2.979 866 HD3 ARG 105 HD1 ARG 105 10.590 5.734 4.266 867 HE ARG 105 HE ARG 105 11.838 3.371 4.694 868 HH11 ARG 105 HH11 ARG 105 12.983 6.642 4.281 869 HH12 ARG 105 HH12 ARG 105 14.377 6.414 5.284 870 HH21 ARG 105 HH21 ARG 105 13.669 3.070 6.016 871 HH22 ARG 105 HH22 ARG 105 14.766 4.386 6.269 872 H GLN 106 HN GLN 106 9.914 1.190 3.404 873 HA GLN 106 HA GLN 106 12.199 1.176 5.142 874 HB2 GLN 106 HB2 GLN 106 9.373 0.780 5.413 875 HB3 GLN 106 HB1 GLN 106 10.210 -0.562 6.170 876 HG2 GLN 106 HG2 GLN 106 10.498 0.708 7.952 877 HG3 GLN 106 HG1 GLN 106 11.588 1.714 6.999 878 HE21 GLN 106 HE21 GLN 106 10.002 3.043 5.332 879 HE22 GLN 106 HE22 GLN 106 8.864 4.020 6.187 880 H GLY 107 HN GLY 107 10.457 -1.252 3.259 881 HA2 GLY 107 HA2 GLY 107 11.973 -2.979 2.279 882 HA3 GLY 107 HA1 GLY 107 12.606 -3.183 3.906 883 H LEU 108 HN LEU 108 9.737 -2.795 4.898 884 HA LEU 108 HA LEU 108 9.080 -5.449 5.322 885 HB2 LEU 108 HB2 LEU 108 6.981 -3.310 5.130 886 HB3 LEU 108 HB1 LEU 108 7.019 -4.706 6.187 887 HG LEU 108 HG LEU 108 8.743 -2.238 6.413 888 HD11 LEU 108 HD11 LEU 108 6.917 -1.491 7.466 889 HD12 LEU 108 HD12 LEU 108 7.426 -2.561 8.772 890 HD13 LEU 108 HD13 LEU 108 6.217 -3.103 7.609 891 HD21 LEU 108 HD21 LEU 108 8.776 -4.127 8.630 892 HD22 LEU 108 HD22 LEU 108 10.108 -3.293 7.832 893 HD23 LEU 108 HD23 LEU 108 9.469 -4.788 7.149 894 H ALA 109 HN ALA 109 8.453 -3.425 2.582 895 HA ALA 109 HA ALA 109 7.291 -5.711 1.178 896 HB1 ALA 109 HB1 ALA 109 6.025 -3.129 0.535 897 HB2 ALA 109 HB2 ALA 109 5.619 -3.810 2.110 898 HB3 ALA 109 HB3 ALA 109 5.324 -4.744 0.644 899 H LYS 110 HN LYS 110 7.146 -5.203 -1.241 900 HA LYS 110 HA LYS 110 9.215 -3.318 -2.100 901 HB2 LYS 110 HB2 LYS 110 9.143 -6.158 -3.117 902 HB3 LYS 110 HB1 LYS 110 10.365 -4.932 -3.434 903 HG2 LYS 110 HG2 LYS 110 11.228 -5.079 -1.253 904 HG3 LYS 110 HG1 LYS 110 9.824 -5.978 -0.673 905 HD2 LYS 110 HD2 LYS 110 10.633 -7.945 -1.405 906 HD3 LYS 110 HD1 LYS 110 11.243 -7.246 -2.906 907 HE2 LYS 110 HE2 LYS 110 13.308 -7.085 -2.087 908 HE3 LYS 110 HE1 LYS 110 12.735 -6.307 -0.612 909 HZ1 LYS 110 HZ1 LYS 110 12.632 -8.271 0.496 910 HZ2 LYS 110 HZ2 LYS 110 13.884 -8.654 -0.574 911 HZ3 LYS 110 HZ3 LYS 110 12.311 -9.188 -0.890 912 H VAL 111 HN VAL 111 9.239 -3.082 -4.516 913 HA VAL 111 HA VAL 111 6.543 -2.686 -5.428 914 HB VAL 111 HB VAL 111 9.235 -2.106 -6.651 915 HG11 VAL 111 HG11 VAL 111 7.867 -0.817 -8.374 916 HG12 VAL 111 HG12 VAL 111 6.506 -1.820 -7.873 917 HG13 VAL 111 HG13 VAL 111 7.949 -2.568 -8.558 918 HG21 VAL 111 HG21 VAL 111 8.593 0.207 -6.326 919 HG22 VAL 111 HG22 VAL 111 8.461 -0.674 -4.804 920 HG23 VAL 111 HG23 VAL 111 7.010 -0.293 -5.730 921 H ALA 112 HN ALA 112 5.441 -4.420 -6.099 922 HA ALA 112 HA ALA 112 6.608 -6.055 -8.229 923 HB1 ALA 112 HB1 ALA 112 5.004 -7.559 -6.265 924 HB2 ALA 112 HB2 ALA 112 6.603 -7.044 -5.728 925 HB3 ALA 112 HB3 ALA 112 6.437 -8.042 -7.172 926 H TYR 113 HN TYR 113 4.960 -7.333 -9.395 927 HA TYR 113 HA TYR 113 3.038 -7.432 -10.608 928 HB2 TYR 113 HB2 TYR 113 1.935 -6.664 -7.906 929 HB3 TYR 113 HB1 TYR 113 0.899 -7.014 -9.286 930 HD1 TYR 113 HD2 TYR 113 3.281 -8.443 -6.877 931 HD2 TYR 113 HD1 TYR 113 0.591 -9.268 -10.069 932 HE1 TYR 113 HE2 TYR 113 3.396 -10.841 -6.346 933 HE2 TYR 113 HE1 TYR 113 0.698 -11.668 -9.545 934 HH TYR 113 HH TYR 113 3.014 -12.976 -7.377 935 H VAL 114 HN VAL 114 4.203 -5.428 -11.560 936 HA VAL 114 HA VAL 114 2.387 -3.113 -11.383 937 HB VAL 114 HB VAL 114 4.604 -2.526 -10.593 938 HG11 VAL 114 HG11 VAL 114 5.649 -3.346 -13.297 939 HG12 VAL 114 HG12 VAL 114 5.817 -4.304 -11.827 940 HG13 VAL 114 HG13 VAL 114 6.582 -2.720 -11.938 941 HG21 VAL 114 HG21 VAL 114 5.019 -1.072 -12.985 942 HG22 VAL 114 HG22 VAL 114 4.233 -0.535 -11.501 943 HG23 VAL 114 HG23 VAL 114 3.278 -1.276 -12.785 944 H TYR 115 HN TYR 115 1.171 -2.806 -13.106 945 HA TYR 115 HA TYR 115 2.218 -3.565 -15.750 946 HB2 TYR 115 HB2 TYR 115 -0.298 -4.011 -16.276 947 HB3 TYR 115 HB1 TYR 115 0.635 -5.240 -15.433 948 HD1 TYR 115 HD2 TYR 115 -1.510 -2.286 -14.676 949 HD2 TYR 115 HD1 TYR 115 -0.288 -6.196 -13.541 950 HE1 TYR 115 HE2 TYR 115 -3.158 -2.262 -12.848 951 HE2 TYR 115 HE1 TYR 115 -1.932 -6.187 -11.710 952 HH TYR 115 HH TYR 115 -3.161 -4.563 -10.348 953 H LYS 116 HN LYS 116 1.758 -2.179 -17.436 954 HA LYS 116 HA LYS 116 0.662 0.418 -16.633 955 HB2 LYS 116 HB2 LYS 116 2.343 -0.286 -19.041 956 HB3 LYS 116 HB1 LYS 116 1.863 1.334 -18.553 957 HG2 LYS 116 HG2 LYS 116 3.655 -0.533 -17.021 958 HG3 LYS 116 HG1 LYS 116 4.152 0.907 -17.913 959 HD2 LYS 116 HD2 LYS 116 2.240 0.923 -15.579 960 HD3 LYS 116 HD1 LYS 116 3.971 1.245 -15.449 961 HE2 LYS 116 HE2 LYS 116 2.114 2.805 -17.236 962 HE3 LYS 116 HE1 LYS 116 2.503 3.281 -15.584 963 HZ1 LYS 116 HZ1 LYS 116 4.536 2.868 -17.704 964 HZ2 LYS 116 HZ2 LYS 116 4.784 3.526 -16.166 965 HZ3 LYS 116 HZ3 LYS 116 3.877 4.376 -17.313 966 HA PRO 117 HA PRO 117 0.320 2.239 -17.856 967 HB2 PRO 117 HB2 PRO 117 -1.653 3.945 -18.379 968 HB3 PRO 117 HB1 PRO 117 -0.654 3.292 -19.685 969 HG2 PRO 117 HG2 PRO 117 -3.416 2.529 -18.845 970 HG3 PRO 117 HG1 PRO 117 -2.734 2.654 -20.475 971 HD2 PRO 117 HD2 PRO 117 -3.042 0.295 -19.012 972 HD3 PRO 117 HD1 PRO 117 -1.999 0.503 -20.432 973 H ASN 118 HN ASN 118 0.394 1.995 -15.663 974 HA ASN 118 HA ASN 118 -1.843 2.966 -14.130 975 HB2 ASN 118 HB2 ASN 118 -0.822 0.177 -13.565 976 HB3 ASN 118 HB1 ASN 118 -2.094 1.027 -12.699 977 HD21 ASN 118 HD21 ASN 118 -1.220 -0.362 -15.812 978 HD22 ASN 118 HD22 ASN 118 -2.841 -0.684 -16.322 979 H ASN 119 HN ASN 119 -1.104 2.274 -11.617 980 HA ASN 119 HA ASN 119 0.315 2.755 -9.917 981 HB2 ASN 119 HB2 ASN 119 2.481 2.403 -11.998 982 HB3 ASN 119 HB1 ASN 119 2.723 2.440 -10.254 983 HD21 ASN 119 HD21 ASN 119 1.451 0.623 -12.937 984 HD22 ASN 119 HD22 ASN 119 1.333 -0.891 -12.112 985 H THR 120 HN THR 120 -0.879 4.927 -10.714 986 HA THR 120 HA THR 120 0.385 7.046 -11.866 987 HB THR 120 HB THR 120 -0.977 7.689 -9.317 988 HG1 THR 120 HG1 THR 120 -2.353 6.116 -9.683 989 HG21 THR 120 HG21 THR 120 -2.278 8.602 -11.704 990 HG22 THR 120 HG22 THR 120 -0.555 8.980 -11.746 991 HG23 THR 120 HG23 THR 120 -1.545 9.528 -10.394 992 H HIS 121 HN HIS 121 0.938 5.788 -8.613 993 HA HIS 121 HA HIS 121 2.886 7.893 -8.067 994 HB2 HIS 121 HB2 HIS 121 1.559 5.780 -6.403 995 HB3 HIS 121 HB1 HIS 121 3.038 6.546 -5.834 996 HD1 HIS 121 HD1 HIS 121 2.639 9.435 -6.397 997 HD2 HIS 121 HD2 HIS 121 -0.468 6.997 -5.104 998 HE1 HIS 121 HE1 HIS 121 0.948 10.988 -5.372 999 HE2 HIS 121 HE2 HIS 121 -0.884 9.483 -4.521 1000 H GLU 122 HN GLU 122 3.241 5.557 -10.015 1001 HA GLU 122 HA GLU 122 5.085 3.713 -9.094 1002 HB2 GLU 122 HB2 GLU 122 4.046 3.607 -11.316 1003 HB3 GLU 122 HB1 GLU 122 4.974 5.011 -11.823 1004 HG2 GLU 122 HG2 GLU 122 6.441 3.543 -12.618 1005 HG3 GLU 122 HG1 GLU 122 6.926 3.313 -10.939 1006 H GLN 123 HN GLN 123 5.726 6.907 -10.539 1007 HA GLN 123 HA GLN 123 8.487 6.875 -10.486 1008 HB2 GLN 123 HB2 GLN 123 6.635 9.212 -9.982 1009 HB3 GLN 123 HB1 GLN 123 8.350 9.353 -10.343 1010 HG2 GLN 123 HG2 GLN 123 6.699 7.808 -12.248 1011 HG3 GLN 123 HG1 GLN 123 6.457 9.554 -12.198 1012 HE21 GLN 123 HE21 GLN 123 9.008 7.109 -12.415 1013 HE22 GLN 123 HE22 GLN 123 10.036 8.022 -13.461 1014 H LEU 124 HN LEU 124 6.266 7.176 -7.836 1015 HA LEU 124 HA LEU 124 8.235 8.187 -5.983 1016 HB2 LEU 124 HB2 LEU 124 5.911 8.804 -5.693 1017 HB3 LEU 124 HB1 LEU 124 5.443 7.118 -5.574 1018 HG LEU 124 HG LEU 124 6.842 6.973 -3.481 1019 HD11 LEU 124 HD11 LEU 124 7.290 9.788 -4.213 1020 HD12 LEU 124 HD12 LEU 124 8.297 8.678 -3.283 1021 HD13 LEU 124 HD13 LEU 124 6.932 9.487 -2.512 1022 HD21 LEU 124 HD21 LEU 124 4.324 8.472 -3.839 1023 HD22 LEU 124 HD22 LEU 124 5.116 8.641 -2.273 1024 HD23 LEU 124 HD23 LEU 124 4.669 7.042 -2.866 1025 H LEU 125 HN LEU 125 6.619 5.092 -6.596 1026 HA LEU 125 HA LEU 125 8.062 3.740 -4.507 1027 HB2 LEU 125 HB2 LEU 125 6.150 2.880 -6.649 1028 HB3 LEU 125 HB1 LEU 125 7.044 1.690 -5.725 1029 HG LEU 125 HG LEU 125 5.978 3.318 -3.763 1030 HD11 LEU 125 HD11 LEU 125 3.839 3.945 -4.251 1031 HD12 LEU 125 HD12 LEU 125 3.658 2.743 -5.529 1032 HD13 LEU 125 HD13 LEU 125 4.600 4.205 -5.821 1033 HD21 LEU 125 HD21 LEU 125 6.073 0.693 -4.285 1034 HD22 LEU 125 HD22 LEU 125 4.365 0.992 -4.612 1035 HD23 LEU 125 HD23 LEU 125 5.044 1.391 -3.034 1036 H ARG 126 HN ARG 126 8.550 4.368 -7.878 1037 HA ARG 126 HA ARG 126 10.221 2.265 -8.604 1038 HB2 ARG 126 HB2 ARG 126 9.304 4.487 -9.859 1039 HB3 ARG 126 HB1 ARG 126 10.985 4.937 -9.612 1040 HG2 ARG 126 HG2 ARG 126 11.775 3.206 -10.943 1041 HG3 ARG 126 HG1 ARG 126 10.270 2.292 -10.814 1042 HD2 ARG 126 HD2 ARG 126 9.149 3.715 -12.301 1043 HD3 ARG 126 HD1 ARG 126 10.368 4.979 -12.145 1044 HE ARG 126 HE ARG 126 10.441 2.706 -13.902 1045 HH11 ARG 126 HH11 ARG 126 12.360 5.093 -12.230 1046 HH12 ARG 126 HH12 ARG 126 13.691 4.978 -13.332 1047 HH21 ARG 126 HH21 ARG 126 12.191 2.552 -15.352 1048 HH22 ARG 126 HH22 ARG 126 13.595 3.534 -15.105 1049 H LYS 127 HN LYS 127 11.002 5.338 -7.030 1050 HA LYS 127 HA LYS 127 13.806 4.697 -6.828 1051 HB2 LYS 127 HB2 LYS 127 12.443 6.863 -5.253 1052 HB3 LYS 127 HB1 LYS 127 14.090 6.816 -5.867 1053 HG2 LYS 127 HG2 LYS 127 11.598 7.128 -7.530 1054 HG3 LYS 127 HG1 LYS 127 12.724 8.414 -7.092 1055 HD2 LYS 127 HD2 LYS 127 14.033 6.119 -8.327 1056 HD3 LYS 127 HD1 LYS 127 12.834 6.878 -9.375 1057 HE2 LYS 127 HE2 LYS 127 14.454 8.324 -9.904 1058 HE3 LYS 127 HE1 LYS 127 14.158 9.037 -8.320 1059 HZ1 LYS 127 HZ1 LYS 127 16.004 6.767 -8.505 1060 HZ2 LYS 127 HZ2 LYS 127 16.014 8.080 -7.438 1061 HZ3 LYS 127 HZ3 LYS 127 16.542 8.283 -9.031 1062 H SER 128 HN SER 128 11.057 4.931 -4.600 1063 HA SER 128 HA SER 128 12.322 4.372 -2.212 1064 HB2 SER 128 HB2 SER 128 10.107 4.967 -1.946 1065 HB3 SER 128 HB1 SER 128 9.560 3.933 -3.263 1066 HG SER 128 HG SER 128 10.636 2.784 -0.937 1067 H GLU 129 HN GLU 129 11.446 2.204 -4.807 1068 HA GLU 129 HA GLU 129 11.826 -0.204 -3.312 1069 HB2 GLU 129 HB2 GLU 129 10.382 -0.304 -5.210 1070 HB3 GLU 129 HB1 GLU 129 11.616 0.367 -6.266 1071 HG2 GLU 129 HG2 GLU 129 11.313 -2.017 -6.637 1072 HG3 GLU 129 HG1 GLU 129 12.936 -1.658 -6.049 1073 H ALA 130 HN ALA 130 13.706 1.132 -6.041 1074 HA ALA 130 HA ALA 130 15.919 -0.570 -5.598 1075 HB1 ALA 130 HB1 ALA 130 15.087 0.968 -7.665 1076 HB2 ALA 130 HB2 ALA 130 16.683 0.229 -7.545 1077 HB3 ALA 130 HB3 ALA 130 16.451 1.910 -7.064 1078 H GLN 131 HN GLN 131 15.160 2.661 -4.461 1079 HA GLN 131 HA GLN 131 17.721 3.488 -3.729 1080 HB2 GLN 131 HB2 GLN 131 16.695 5.136 -2.352 1081 HB3 GLN 131 HB1 GLN 131 15.660 4.918 -3.751 1082 HG2 GLN 131 HG2 GLN 131 14.123 5.002 -2.076 1083 HG3 GLN 131 HG1 GLN 131 14.378 3.265 -2.200 1084 HE21 GLN 131 HE21 GLN 131 13.311 4.015 0.059 1085 HE22 GLN 131 HE22 GLN 131 14.448 4.031 1.359 1086 H ALA 132 HN ALA 132 15.299 1.742 -1.822 1087 HA ALA 132 HA ALA 132 17.094 1.430 0.410 1088 HB1 ALA 132 HB1 ALA 132 14.297 0.573 -0.188 1089 HB2 ALA 132 HB2 ALA 132 14.912 1.553 1.142 1090 HB3 ALA 132 HB3 ALA 132 15.178 -0.189 1.136 1091 H LYS 133 HN LYS 133 16.303 -0.306 -2.460 1092 HA LYS 133 HA LYS 133 16.926 -2.927 -1.767 1093 HB2 LYS 133 HB2 LYS 133 16.073 -1.767 -4.014 1094 HB3 LYS 133 HB1 LYS 133 17.773 -1.913 -4.433 1095 HG2 LYS 133 HG2 LYS 133 17.110 -3.911 -5.223 1096 HG3 LYS 133 HG1 LYS 133 17.333 -4.400 -3.542 1097 HD2 LYS 133 HD2 LYS 133 14.836 -3.598 -3.329 1098 HD3 LYS 133 HD1 LYS 133 14.821 -3.907 -5.066 1099 HE2 LYS 133 HE2 LYS 133 16.085 -6.127 -3.968 1100 HE3 LYS 133 HE1 LYS 133 14.768 -5.772 -2.852 1101 HZ1 LYS 133 HZ1 LYS 133 13.218 -6.322 -4.366 1102 HZ2 LYS 133 HZ2 LYS 133 14.472 -7.227 -5.052 1103 HZ3 LYS 133 HZ3 LYS 133 14.092 -5.701 -5.675 1104 H LYS 134 HN LYS 134 19.075 -0.461 -3.184 1105 HA LYS 134 HA LYS 134 21.404 -1.966 -3.246 1106 HB2 LYS 134 HB2 LYS 134 21.250 0.151 -4.391 1107 HB3 LYS 134 HB1 LYS 134 21.036 1.008 -2.870 1108 HG2 LYS 134 HG2 LYS 134 23.286 0.534 -2.212 1109 HG3 LYS 134 HG1 LYS 134 23.518 -0.529 -3.602 1110 HD2 LYS 134 HD2 LYS 134 22.651 2.214 -4.234 1111 HD3 LYS 134 HD1 LYS 134 24.265 2.070 -3.537 1112 HE2 LYS 134 HE2 LYS 134 25.095 0.955 -5.338 1113 HE3 LYS 134 HE1 LYS 134 23.555 0.179 -5.703 1114 HZ1 LYS 134 HZ1 LYS 134 22.910 1.874 -7.013 1115 HZ2 LYS 134 HZ2 LYS 134 24.572 2.156 -7.149 1116 HZ3 LYS 134 HZ3 LYS 134 23.647 3.062 -6.059 1117 H GLU 135 HN GLU 135 20.009 -0.121 -0.590 1118 HA GLU 135 HA GLU 135 22.288 -0.807 1.112 1119 HB2 GLU 135 HB2 GLU 135 20.477 0.602 2.690 1120 HB3 GLU 135 HB1 GLU 135 21.923 1.244 1.921 1121 HG2 GLU 135 HG2 GLU 135 20.652 1.990 0.027 1122 HG3 GLU 135 HG1 GLU 135 19.200 1.199 0.640 1123 H LYS 136 HN LYS 136 19.409 -2.211 0.275 1124 HA LYS 136 HA LYS 136 17.906 -3.597 1.321 1125 HB2 LYS 136 HB2 LYS 136 20.478 -4.619 2.535 1126 HB3 LYS 136 HB1 LYS 136 18.992 -5.536 2.309 1127 HG2 LYS 136 HG2 LYS 136 19.291 -4.963 -0.188 1128 HG3 LYS 136 HG1 LYS 136 20.957 -4.597 0.263 1129 HD2 LYS 136 HD2 LYS 136 21.202 -6.806 -0.250 1130 HD3 LYS 136 HD1 LYS 136 20.740 -6.971 1.446 1131 HE2 LYS 136 HE2 LYS 136 18.822 -7.991 0.926 1132 HE3 LYS 136 HE1 LYS 136 18.439 -6.810 -0.327 1133 HZ1 LYS 136 HZ1 LYS 136 18.993 -9.348 -0.844 1134 HZ2 LYS 136 HZ2 LYS 136 20.555 -8.710 -0.946 1135 HZ3 LYS 136 HZ3 LYS 136 19.326 -8.096 -1.933 1136 H LEU 137 HN LEU 137 17.248 -1.609 2.547 1137 HA LEU 137 HA LEU 137 18.018 -0.929 5.071 1138 HB2 LEU 137 HB2 LEU 137 15.506 -0.677 3.531 1139 HB3 LEU 137 HB1 LEU 137 15.384 -0.422 5.263 1140 HG LEU 137 HG LEU 137 17.167 1.090 3.357 1141 HD11 LEU 137 HD11 LEU 137 14.482 1.538 4.457 1142 HD12 LEU 137 HD12 LEU 137 15.241 2.188 3.004 1143 HD13 LEU 137 HD13 LEU 137 15.579 2.914 4.575 1144 HD21 LEU 137 HD21 LEU 137 17.226 0.784 6.259 1145 HD22 LEU 137 HD22 LEU 137 17.136 2.463 5.729 1146 HD23 LEU 137 HD23 LEU 137 18.445 1.429 5.160 1147 H ASN 138 HN ASN 138 14.793 -2.344 5.035 1148 HA ASN 138 HA ASN 138 15.387 -3.689 7.513 1149 HB2 ASN 138 HB2 ASN 138 12.839 -3.467 5.906 1150 HB3 ASN 138 HB1 ASN 138 12.954 -4.286 7.460 1151 HD21 ASN 138 HD21 ASN 138 11.320 -2.047 6.788 1152 HD22 ASN 138 HD22 ASN 138 11.798 -0.735 7.805 1153 H ILE 139 HN ILE 139 13.116 -5.336 5.497 1154 HA ILE 139 HA ILE 139 14.883 -7.670 5.486 1155 HB ILE 139 HB ILE 139 12.704 -8.873 4.834 1156 HG12 ILE 139 HG12 ILE 139 11.221 -6.716 6.213 1157 HG13 ILE 139 HG11 ILE 139 11.710 -6.363 4.558 1158 HG21 ILE 139 HG21 ILE 139 13.832 -8.958 7.047 1159 HG22 ILE 139 HG22 ILE 139 12.079 -9.133 7.136 1160 HG23 ILE 139 HG23 ILE 139 12.835 -7.598 7.562 1161 HD11 ILE 139 HD11 ILE 139 9.561 -7.258 4.394 1162 HD12 ILE 139 HD12 ILE 139 9.913 -8.544 5.550 1163 HD13 ILE 139 HD13 ILE 139 10.638 -8.580 3.942 1164 H TRP 140 HN TRP 140 15.904 -6.275 3.637 1165 HA TRP 140 HA TRP 140 14.561 -6.701 1.083 1166 HB2 TRP 140 HB2 TRP 140 17.120 -5.258 1.789 1167 HB3 TRP 140 HB1 TRP 140 16.459 -5.370 0.162 1168 HD1 TRP 140 HD1 TRP 140 15.704 -3.798 3.584 1169 HE1 TRP 140 HE1 TRP 140 14.103 -1.816 3.229 1170 HE3 TRP 140 HE3 TRP 140 14.771 -4.392 -1.405 1171 HZ2 TRP 140 HZ2 TRP 140 12.651 -0.654 1.124 1172 HZ3 TRP 140 HZ3 TRP 140 13.255 -2.798 -2.516 1173 HH2 TRP 140 HH2 TRP 140 12.217 -0.968 -1.276 Start of MODEL 19 1 H1 ALA 1 HT1 ALA 1 11.214 27.842 -4.597 2 H2 ALA 1 HT2 ALA 1 11.407 28.947 -5.896 3 H3 ALA 1 HT3 ALA 1 12.749 28.034 -5.336 4 HA ALA 1 HA ALA 1 12.122 26.984 -7.243 5 HB1 ALA 1 HB1 ALA 1 12.453 25.196 -5.894 6 HB2 ALA 1 HB2 ALA 1 10.738 24.942 -6.215 7 HB3 ALA 1 HB3 ALA 1 11.249 25.720 -4.717 8 H THR 2 HN THR 2 9.375 28.063 -5.375 9 HA THR 2 HA THR 2 7.169 28.356 -5.874 10 HB THR 2 HB THR 2 6.746 29.302 -8.152 11 HG1 THR 2 HG1 THR 2 8.301 29.334 -9.628 12 HG21 THR 2 HG21 THR 2 7.586 30.719 -6.277 13 HG22 THR 2 HG22 THR 2 7.978 31.308 -7.892 14 HG23 THR 2 HG23 THR 2 9.211 30.499 -6.924 15 H SER 3 HN SER 3 6.274 26.344 -5.585 16 HA SER 3 HA SER 3 6.006 24.675 -7.999 17 HB2 SER 3 HB2 SER 3 5.879 22.737 -6.622 18 HB3 SER 3 HB1 SER 3 7.232 23.683 -6.001 19 HG SER 3 HG SER 3 5.903 22.971 -4.306 20 H THR 4 HN THR 4 4.017 24.221 -8.745 21 HA THR 4 HA THR 4 1.696 24.736 -7.036 22 HB THR 4 HB THR 4 0.576 26.052 -8.708 23 HG1 THR 4 HG1 THR 4 2.867 25.582 -10.309 24 HG21 THR 4 HG21 THR 4 3.388 27.040 -8.314 25 HG22 THR 4 HG22 THR 4 1.971 27.415 -7.332 26 HG23 THR 4 HG23 THR 4 2.074 28.002 -8.991 27 H LYS 5 HN LYS 5 1.804 22.359 -7.048 28 HA LYS 5 HA LYS 5 1.049 21.070 -9.548 29 HB2 LYS 5 HB2 LYS 5 1.844 20.063 -6.830 30 HB3 LYS 5 HB1 LYS 5 1.095 18.991 -8.005 31 HG2 LYS 5 HG2 LYS 5 3.340 20.548 -9.055 32 HG3 LYS 5 HG1 LYS 5 3.766 19.427 -7.761 33 HD2 LYS 5 HD2 LYS 5 2.491 17.662 -9.059 34 HD3 LYS 5 HD1 LYS 5 2.455 18.810 -10.400 35 HE2 LYS 5 HE2 LYS 5 4.953 18.929 -10.244 36 HE3 LYS 5 HE1 LYS 5 4.883 17.610 -9.078 37 HZ1 LYS 5 HZ1 LYS 5 3.480 17.172 -11.583 38 HZ2 LYS 5 HZ2 LYS 5 4.425 16.107 -10.671 39 HZ3 LYS 5 HZ3 LYS 5 5.166 17.237 -11.688 40 H LYS 6 HN LYS 6 -1.004 20.845 -10.105 41 HA LYS 6 HA LYS 6 -3.108 21.284 -8.165 42 HB2 LYS 6 HB2 LYS 6 -3.029 22.125 -10.615 43 HB3 LYS 6 HB1 LYS 6 -3.548 20.497 -11.032 44 HG2 LYS 6 HG2 LYS 6 -5.469 20.857 -9.412 45 HG3 LYS 6 HG1 LYS 6 -5.009 22.560 -9.417 46 HD2 LYS 6 HD2 LYS 6 -5.753 20.928 -11.844 47 HD3 LYS 6 HD1 LYS 6 -6.795 22.099 -11.032 48 HE2 LYS 6 HE2 LYS 6 -5.298 23.896 -11.591 49 HE3 LYS 6 HE1 LYS 6 -4.119 22.764 -12.251 50 HZ1 LYS 6 HZ1 LYS 6 -6.858 23.052 -13.346 51 HZ2 LYS 6 HZ2 LYS 6 -5.539 22.260 -14.048 52 HZ3 LYS 6 HZ3 LYS 6 -5.541 23.946 -13.919 53 H LEU 7 HN LEU 7 -2.987 19.473 -6.823 54 HA LEU 7 HA LEU 7 -3.898 16.965 -8.075 55 HB2 LEU 7 HB2 LEU 7 -1.768 17.458 -6.054 56 HB3 LEU 7 HB1 LEU 7 -2.719 15.993 -5.903 57 HG LEU 7 HG LEU 7 -2.083 15.714 -8.455 58 HD11 LEU 7 HD11 LEU 7 -0.795 18.036 -8.049 59 HD12 LEU 7 HD12 LEU 7 -0.279 16.827 -9.226 60 HD13 LEU 7 HD13 LEU 7 0.490 16.901 -7.640 61 HD21 LEU 7 HD21 LEU 7 -1.405 13.961 -7.180 62 HD22 LEU 7 HD22 LEU 7 -0.662 14.991 -5.957 63 HD23 LEU 7 HD23 LEU 7 0.171 14.691 -7.481 64 H HIS 8 HN HIS 8 -5.025 15.504 -6.503 65 HA HIS 8 HA HIS 8 -6.224 16.720 -4.185 66 HB2 HIS 8 HB2 HIS 8 -8.580 16.259 -5.119 67 HB3 HIS 8 HB1 HIS 8 -7.750 17.712 -5.666 68 HD1 HIS 8 HD1 HIS 8 -7.624 18.024 -8.124 69 HD2 HIS 8 HD2 HIS 8 -8.364 14.069 -7.092 70 HE1 HIS 8 HE1 HIS 8 -8.021 16.825 -10.299 71 HE2 HIS 8 HE2 HIS 8 -8.378 14.416 -9.655 72 H LYS 9 HN LYS 9 -6.289 15.153 -2.727 73 HA LYS 9 HA LYS 9 -6.538 12.377 -3.643 74 HB2 LYS 9 HB2 LYS 9 -5.440 13.536 -1.080 75 HB3 LYS 9 HB1 LYS 9 -5.641 11.814 -1.368 76 HG2 LYS 9 HG2 LYS 9 -3.422 12.147 -1.875 77 HG3 LYS 9 HG1 LYS 9 -4.184 12.242 -3.463 78 HD2 LYS 9 HD2 LYS 9 -3.150 14.206 -3.705 79 HD3 LYS 9 HD1 LYS 9 -4.294 14.843 -2.520 80 HE2 LYS 9 HE2 LYS 9 -1.697 13.536 -1.743 81 HE3 LYS 9 HE1 LYS 9 -1.836 15.264 -2.063 82 HZ1 LYS 9 HZ1 LYS 9 -2.154 14.223 0.340 83 HZ2 LYS 9 HZ2 LYS 9 -3.756 14.121 -0.194 84 HZ3 LYS 9 HZ3 LYS 9 -2.971 15.619 -0.159 85 H GLU 10 HN GLU 10 -7.740 10.895 -2.225 86 HA GLU 10 HA GLU 10 -10.085 12.225 -1.037 87 HB2 GLU 10 HB2 GLU 10 -10.161 10.635 -3.209 88 HB3 GLU 10 HB1 GLU 10 -10.324 9.416 -1.953 89 HG2 GLU 10 HG2 GLU 10 -12.411 10.041 -1.434 90 HG3 GLU 10 HG1 GLU 10 -12.056 11.759 -1.623 91 HA PRO 11 HA PRO 11 -8.787 10.056 2.636 92 HB2 PRO 11 HB2 PRO 11 -10.662 10.954 4.311 93 HB3 PRO 11 HB1 PRO 11 -9.415 12.032 3.670 94 HG2 PRO 11 HG2 PRO 11 -12.267 11.721 2.828 95 HG3 PRO 11 HG1 PRO 11 -11.305 13.199 3.002 96 HD2 PRO 11 HD2 PRO 11 -11.794 11.908 0.605 97 HD3 PRO 11 HD1 PRO 11 -10.437 13.012 0.901 98 H ALA 12 HN ALA 12 -9.631 8.489 4.184 99 HA ALA 12 HA ALA 12 -12.185 7.291 3.802 100 HB1 ALA 12 HB1 ALA 12 -11.108 6.364 1.840 101 HB2 ALA 12 HB2 ALA 12 -11.381 5.094 3.033 102 HB3 ALA 12 HB3 ALA 12 -9.769 5.777 2.826 103 H THR 13 HN THR 13 -12.432 5.307 5.178 104 HA THR 13 HA THR 13 -10.637 5.459 7.512 105 HB THR 13 HB THR 13 -13.403 4.441 7.864 106 HG1 THR 13 HG1 THR 13 -13.901 6.225 6.674 107 HG21 THR 13 HG21 THR 13 -12.988 4.834 9.996 108 HG22 THR 13 HG22 THR 13 -12.596 6.520 9.660 109 HG23 THR 13 HG23 THR 13 -11.342 5.284 9.548 110 H LEU 14 HN LEU 14 -10.429 3.468 8.767 111 HA LEU 14 HA LEU 14 -10.323 1.154 6.991 112 HB2 LEU 14 HB2 LEU 14 -8.616 2.148 8.965 113 HB3 LEU 14 HB1 LEU 14 -9.317 0.705 9.675 114 HG LEU 14 HG LEU 14 -7.139 0.359 8.478 115 HD11 LEU 14 HD11 LEU 14 -8.224 -1.575 7.019 116 HD12 LEU 14 HD12 LEU 14 -9.645 -1.138 7.969 117 HD13 LEU 14 HD13 LEU 14 -8.162 -1.643 8.781 118 HD21 LEU 14 HD21 LEU 14 -8.210 1.903 6.520 119 HD22 LEU 14 HD22 LEU 14 -8.482 0.287 5.869 120 HD23 LEU 14 HD23 LEU 14 -6.850 0.802 6.294 121 H ILE 15 HN ILE 15 -12.129 -0.030 6.929 122 HA ILE 15 HA ILE 15 -14.004 -0.158 9.068 123 HB ILE 15 HB ILE 15 -13.739 -1.995 6.684 124 HG12 ILE 15 HG12 ILE 15 -14.007 0.413 6.104 125 HG13 ILE 15 HG11 ILE 15 -15.366 -0.580 5.588 126 HG21 ILE 15 HG21 ILE 15 -15.098 -2.886 8.555 127 HG22 ILE 15 HG22 ILE 15 -16.029 -2.609 7.083 128 HG23 ILE 15 HG23 ILE 15 -16.140 -1.470 8.424 129 HD11 ILE 15 HD11 ILE 15 -16.400 0.167 7.861 130 HD12 ILE 15 HD12 ILE 15 -16.433 1.244 6.466 131 HD13 ILE 15 HD13 ILE 15 -15.227 1.477 7.732 132 H LYS 16 HN LYS 16 -11.474 -2.311 7.855 133 HA LYS 16 HA LYS 16 -11.011 -3.431 10.413 134 HB2 LYS 16 HB2 LYS 16 -13.073 -4.671 8.891 135 HB3 LYS 16 HB1 LYS 16 -11.697 -5.765 8.913 136 HG2 LYS 16 HG2 LYS 16 -13.097 -4.591 11.306 137 HG3 LYS 16 HG1 LYS 16 -13.169 -6.265 10.749 138 HD2 LYS 16 HD2 LYS 16 -10.518 -6.012 10.989 139 HD3 LYS 16 HD1 LYS 16 -11.020 -4.829 12.200 140 HE2 LYS 16 HE2 LYS 16 -11.403 -6.478 13.636 141 HE3 LYS 16 HE1 LYS 16 -12.625 -7.135 12.548 142 HZ1 LYS 16 HZ1 LYS 16 -11.204 -8.891 12.686 143 HZ2 LYS 16 HZ2 LYS 16 -9.829 -7.932 12.905 144 HZ3 LYS 16 HZ3 LYS 16 -10.508 -8.095 11.364 145 H ALA 17 HN ALA 17 -8.958 -4.100 10.484 146 HA ALA 17 HA ALA 17 -7.393 -4.065 8.089 147 HB1 ALA 17 HB1 ALA 17 -6.565 -3.130 10.212 148 HB2 ALA 17 HB2 ALA 17 -5.485 -4.354 9.543 149 HB3 ALA 17 HB3 ALA 17 -6.543 -4.756 10.895 150 H ILE 18 HN ILE 18 -6.840 -5.740 6.857 151 HA ILE 18 HA ILE 18 -7.629 -8.420 7.685 152 HB ILE 18 HB ILE 18 -6.298 -7.867 5.066 153 HG12 ILE 18 HG12 ILE 18 -8.366 -6.254 5.796 154 HG13 ILE 18 HG11 ILE 18 -8.011 -6.714 4.140 155 HG21 ILE 18 HG21 ILE 18 -6.732 -10.137 5.449 156 HG22 ILE 18 HG22 ILE 18 -8.007 -9.597 4.357 157 HG23 ILE 18 HG23 ILE 18 -8.349 -9.809 6.074 158 HD11 ILE 18 HD11 ILE 18 -10.412 -6.909 4.905 159 HD12 ILE 18 HD12 ILE 18 -9.887 -8.288 5.871 160 HD13 ILE 18 HD13 ILE 18 -9.718 -8.324 4.116 161 H ASP 19 HN ASP 19 -4.767 -7.180 5.964 162 HA ASP 19 HA ASP 19 -2.993 -8.364 7.914 163 HB2 ASP 19 HB2 ASP 19 -3.369 -9.561 5.186 164 HB3 ASP 19 HB1 ASP 19 -1.806 -9.664 5.992 165 H GLY 20 HN GLY 20 -1.822 -8.140 4.664 166 HA2 GLY 20 HA2 GLY 20 -0.622 -5.517 5.311 167 HA3 GLY 20 HA1 GLY 20 0.255 -6.792 4.476 168 H ASP 21 HN ASP 21 -0.530 -7.442 2.354 169 HA ASP 21 HA ASP 21 -1.033 -5.230 0.684 170 HB2 ASP 21 HB2 ASP 21 -1.341 -6.978 -1.098 171 HB3 ASP 21 HB1 ASP 21 0.172 -7.101 -0.204 172 H THR 22 HN THR 22 -3.146 -6.989 2.638 173 HA THR 22 HA THR 22 -5.446 -6.079 1.041 174 HB THR 22 HB THR 22 -5.753 -8.399 2.886 175 HG1 THR 22 HG1 THR 22 -3.913 -8.950 1.685 176 HG21 THR 22 HG21 THR 22 -7.109 -7.323 0.507 177 HG22 THR 22 HG22 THR 22 -7.767 -8.134 1.928 178 HG23 THR 22 HG23 THR 22 -7.029 -9.080 0.635 179 H VAL 23 HN VAL 23 -6.853 -4.792 2.066 180 HA VAL 23 HA VAL 23 -7.183 -4.881 4.936 181 HB VAL 23 HB VAL 23 -6.700 -2.482 5.276 182 HG11 VAL 23 HG11 VAL 23 -4.331 -4.001 4.192 183 HG12 VAL 23 HG12 VAL 23 -5.025 -4.219 5.799 184 HG13 VAL 23 HG13 VAL 23 -4.294 -2.676 5.357 185 HG21 VAL 23 HG21 VAL 23 -6.982 -1.920 2.817 186 HG22 VAL 23 HG22 VAL 23 -5.336 -2.518 2.596 187 HG23 VAL 23 HG23 VAL 23 -5.639 -1.139 3.653 188 H LYS 24 HN LYS 24 -9.144 -4.058 5.607 189 HA LYS 24 HA LYS 24 -11.023 -3.401 3.484 190 HB2 LYS 24 HB2 LYS 24 -11.519 -5.057 5.354 191 HB3 LYS 24 HB1 LYS 24 -11.637 -3.668 6.424 192 HG2 LYS 24 HG2 LYS 24 -13.838 -4.265 5.752 193 HG3 LYS 24 HG1 LYS 24 -13.416 -2.756 4.943 194 HD2 LYS 24 HD2 LYS 24 -14.563 -4.345 3.447 195 HD3 LYS 24 HD1 LYS 24 -12.937 -3.944 2.891 196 HE2 LYS 24 HE2 LYS 24 -12.187 -6.051 3.177 197 HE3 LYS 24 HE1 LYS 24 -13.108 -6.285 4.661 198 HZ1 LYS 24 HZ1 LYS 24 -14.525 -6.189 2.088 199 HZ2 LYS 24 HZ2 LYS 24 -14.948 -6.991 3.515 200 HZ3 LYS 24 HZ3 LYS 24 -13.718 -7.608 2.533 201 H LEU 25 HN LEU 25 -11.882 -1.424 3.131 202 HA LEU 25 HA LEU 25 -11.423 0.671 5.134 203 HB2 LEU 25 HB2 LEU 25 -10.237 0.479 2.519 204 HB3 LEU 25 HB1 LEU 25 -11.234 1.918 2.623 205 HG LEU 25 HG LEU 25 -9.708 1.845 4.995 206 HD11 LEU 25 HD11 LEU 25 -8.004 1.376 2.554 207 HD12 LEU 25 HD12 LEU 25 -8.225 0.242 3.886 208 HD13 LEU 25 HD13 LEU 25 -7.425 1.788 4.168 209 HD21 LEU 25 HD21 LEU 25 -9.818 3.513 2.525 210 HD22 LEU 25 HD22 LEU 25 -8.545 3.800 3.711 211 HD23 LEU 25 HD23 LEU 25 -10.238 3.931 4.186 212 H MET 26 HN MET 26 -12.835 2.522 4.934 213 HA MET 26 HA MET 26 -15.491 1.727 4.073 214 HB2 MET 26 HB2 MET 26 -14.878 2.870 6.308 215 HB3 MET 26 HB1 MET 26 -14.792 4.350 5.363 216 HG2 MET 26 HG2 MET 26 -17.059 4.334 4.889 217 HG3 MET 26 HG1 MET 26 -17.223 2.617 5.249 218 HE1 MET 26 HE1 MET 26 -19.351 4.931 7.789 219 HE2 MET 26 HE2 MET 26 -19.561 3.426 6.894 220 HE3 MET 26 HE3 MET 26 -19.093 4.898 6.045 221 H TYR 27 HN TYR 27 -16.159 2.151 2.089 222 HA TYR 27 HA TYR 27 -15.404 4.715 0.860 223 HB2 TYR 27 HB2 TYR 27 -14.205 2.638 -0.081 224 HB3 TYR 27 HB1 TYR 27 -15.771 2.204 -0.758 225 HD1 TYR 27 HD1 TYR 27 -14.166 5.547 -0.450 226 HD2 TYR 27 HD2 TYR 27 -15.538 2.483 -3.059 227 HE1 TYR 27 HE1 TYR 27 -13.724 7.005 -2.382 228 HE2 TYR 27 HE2 TYR 27 -15.100 3.929 -4.999 229 HH TYR 27 HH TYR 27 -13.281 6.153 -5.264 230 H LYS 28 HN LYS 28 -17.104 5.908 0.318 231 HA LYS 28 HA LYS 28 -19.224 6.559 -0.152 232 HB2 LYS 28 HB2 LYS 28 -19.204 3.827 -1.418 233 HB3 LYS 28 HB1 LYS 28 -20.583 4.909 -1.527 234 HG2 LYS 28 HG2 LYS 28 -19.215 6.577 -2.646 235 HG3 LYS 28 HG1 LYS 28 -17.804 5.527 -2.503 236 HD2 LYS 28 HD2 LYS 28 -18.570 4.055 -4.098 237 HD3 LYS 28 HD1 LYS 28 -20.262 4.481 -3.830 238 HE2 LYS 28 HE2 LYS 28 -20.194 6.215 -5.275 239 HE3 LYS 28 HE1 LYS 28 -18.543 6.651 -4.834 240 HZ1 LYS 28 HZ1 LYS 28 -19.417 4.523 -6.703 241 HZ2 LYS 28 HZ2 LYS 28 -17.833 4.635 -6.120 242 HZ3 LYS 28 HZ3 LYS 28 -18.481 5.890 -7.051 243 H GLY 29 HN GLY 29 -18.846 5.705 2.434 244 HA2 GLY 29 HA2 GLY 29 -20.046 5.148 4.308 245 HA3 GLY 29 HA1 GLY 29 -21.482 5.239 3.300 246 H GLN 30 HN GLN 30 -19.129 3.039 2.186 247 HA GLN 30 HA GLN 30 -20.399 0.791 3.576 248 HB2 GLN 30 HB2 GLN 30 -21.376 0.007 1.725 249 HB3 GLN 30 HB1 GLN 30 -20.898 1.474 0.888 250 HG2 GLN 30 HG2 GLN 30 -18.800 0.398 0.219 251 HG3 GLN 30 HG1 GLN 30 -19.307 -1.078 1.038 252 HE21 GLN 30 HE21 GLN 30 -21.889 -1.338 0.346 253 HE22 GLN 30 HE22 GLN 30 -22.050 -1.525 -1.364 254 HA PRO 31 HA PRO 31 -16.274 -0.680 3.866 255 HB2 PRO 31 HB2 PRO 31 -16.653 -3.243 4.433 256 HB3 PRO 31 HB1 PRO 31 -17.291 -1.983 5.503 257 HG2 PRO 31 HG2 PRO 31 -18.732 -3.558 3.396 258 HG3 PRO 31 HG1 PRO 31 -19.227 -3.220 5.068 259 HD2 PRO 31 HD2 PRO 31 -20.089 -1.775 2.901 260 HD3 PRO 31 HD1 PRO 31 -19.979 -1.117 4.546 261 H MET 32 HN MET 32 -14.886 -0.840 2.238 262 HA MET 32 HA MET 32 -15.390 -2.847 0.143 263 HB2 MET 32 HB2 MET 32 -15.531 -0.265 -0.400 264 HB3 MET 32 HB1 MET 32 -13.779 -0.400 -0.439 265 HG2 MET 32 HG2 MET 32 -14.243 -0.785 -2.626 266 HG3 MET 32 HG1 MET 32 -14.308 -2.437 -2.018 267 HE1 MET 32 HE1 MET 32 -16.324 -3.604 -3.882 268 HE2 MET 32 HE2 MET 32 -15.224 -2.355 -4.466 269 HE3 MET 32 HE3 MET 32 -16.948 -2.249 -4.824 270 H THR 33 HN THR 33 -13.589 -3.930 -0.692 271 HA THR 33 HA THR 33 -11.447 -4.263 1.198 272 HB THR 33 HB THR 33 -10.705 -5.816 -0.883 273 HG1 THR 33 HG1 THR 33 -12.531 -5.034 -2.105 274 HG21 THR 33 HG21 THR 33 -11.327 -6.529 1.450 275 HG22 THR 33 HG22 THR 33 -11.720 -7.661 0.158 276 HG23 THR 33 HG23 THR 33 -12.987 -6.661 0.870 277 H PHE 34 HN PHE 34 -9.424 -3.501 1.070 278 HA PHE 34 HA PHE 34 -8.616 -2.145 -1.411 279 HB2 PHE 34 HB2 PHE 34 -8.523 -1.173 1.410 280 HB3 PHE 34 HB1 PHE 34 -7.236 -0.685 0.311 281 HD1 PHE 34 HD1 PHE 34 -10.898 -0.627 0.830 282 HD2 PHE 34 HD2 PHE 34 -7.587 0.972 -1.319 283 HE1 PHE 34 HE1 PHE 34 -12.349 1.132 -0.094 284 HE2 PHE 34 HE2 PHE 34 -9.032 2.736 -2.241 285 HZ PHE 34 HZ PHE 34 -11.416 2.815 -1.633 286 H ARG 35 HN ARG 35 -6.438 -2.327 -2.006 287 HA ARG 35 HA ARG 35 -4.859 -4.181 -0.370 288 HB2 ARG 35 HB2 ARG 35 -4.409 -5.601 -2.155 289 HB3 ARG 35 HB1 ARG 35 -6.097 -5.182 -2.415 290 HG2 ARG 35 HG2 ARG 35 -5.424 -4.792 -4.512 291 HG3 ARG 35 HG1 ARG 35 -4.886 -3.246 -3.854 292 HD2 ARG 35 HD2 ARG 35 -2.705 -3.782 -4.035 293 HD3 ARG 35 HD1 ARG 35 -2.974 -5.458 -3.559 294 HE ARG 35 HE ARG 35 -4.035 -5.114 -6.115 295 HH11 ARG 35 HH11 ARG 35 -0.922 -5.049 -4.538 296 HH12 ARG 35 HH12 ARG 35 -0.057 -5.562 -5.948 297 HH21 ARG 35 HH21 ARG 35 -2.899 -5.789 -7.970 298 HH22 ARG 35 HH22 ARG 35 -1.179 -5.982 -7.896 299 H LEU 36 HN LEU 36 -2.614 -3.997 -0.486 300 HA LEU 36 HA LEU 36 -1.625 -1.384 -1.046 301 HB2 LEU 36 HB2 LEU 36 -0.057 -3.917 -0.498 302 HB3 LEU 36 HB1 LEU 36 0.557 -2.270 -0.397 303 HG LEU 36 HG LEU 36 -1.629 -3.374 1.370 304 HD11 LEU 36 HD11 LEU 36 0.465 -4.540 1.785 305 HD12 LEU 36 HD12 LEU 36 0.084 -3.449 3.117 306 HD13 LEU 36 HD13 LEU 36 1.310 -3.000 1.931 307 HD21 LEU 36 HD21 LEU 36 -1.328 -0.830 0.846 308 HD22 LEU 36 HD22 LEU 36 0.037 -0.969 1.954 309 HD23 LEU 36 HD23 LEU 36 -1.589 -1.373 2.503 310 H LEU 37 HN LEU 37 -2.237 -1.185 -3.258 311 HA LEU 37 HA LEU 37 -1.779 -2.676 -5.418 312 HB2 LEU 37 HB2 LEU 37 -2.549 -0.186 -5.126 313 HB3 LEU 37 HB1 LEU 37 -0.897 0.163 -5.600 314 HG LEU 37 HG LEU 37 -1.237 -1.111 -7.680 315 HD11 LEU 37 HD11 LEU 37 -3.879 -1.621 -6.425 316 HD12 LEU 37 HD12 LEU 37 -2.847 -2.695 -7.368 317 HD13 LEU 37 HD13 LEU 37 -3.795 -1.447 -8.178 318 HD21 LEU 37 HD21 LEU 37 -1.960 0.739 -8.700 319 HD22 LEU 37 HD22 LEU 37 -2.091 1.425 -7.082 320 HD23 LEU 37 HD23 LEU 37 -3.505 0.709 -7.853 321 H LEU 38 HN LEU 38 -0.218 -3.285 -6.781 322 HA LEU 38 HA LEU 38 1.855 -4.204 -7.166 323 HB2 LEU 38 HB2 LEU 38 3.419 -2.466 -8.001 324 HB3 LEU 38 HB1 LEU 38 1.802 -2.373 -8.670 325 HG LEU 38 HG LEU 38 2.299 -0.678 -6.304 326 HD11 LEU 38 HD11 LEU 38 3.245 0.602 -8.749 327 HD12 LEU 38 HD12 LEU 38 4.296 -0.697 -8.183 328 HD13 LEU 38 HD13 LEU 38 3.903 0.651 -7.114 329 HD21 LEU 38 HD21 LEU 38 0.605 -0.771 -8.675 330 HD22 LEU 38 HD22 LEU 38 1.244 0.837 -8.336 331 HD23 LEU 38 HD23 LEU 38 0.320 -0.022 -7.104 332 H VAL 39 HN VAL 39 1.727 -4.604 -4.594 333 HA VAL 39 HA VAL 39 4.316 -3.656 -3.553 334 HB VAL 39 HB VAL 39 1.791 -4.255 -1.999 335 HG11 VAL 39 HG11 VAL 39 3.784 -5.138 -0.840 336 HG12 VAL 39 HG12 VAL 39 3.045 -3.790 0.022 337 HG13 VAL 39 HG13 VAL 39 4.514 -3.534 -0.918 338 HG21 VAL 39 HG21 VAL 39 2.862 -1.875 -3.120 339 HG22 VAL 39 HG22 VAL 39 2.978 -1.753 -1.364 340 HG23 VAL 39 HG23 VAL 39 1.420 -2.068 -2.123 341 H ASP 40 HN ASP 40 5.694 -5.185 -2.719 342 HA ASP 40 HA ASP 40 4.889 -7.976 -3.162 343 HB2 ASP 40 HB2 ASP 40 7.093 -6.584 -4.082 344 HB3 ASP 40 HB1 ASP 40 7.740 -7.504 -2.727 345 H THR 41 HN THR 41 5.424 -9.595 -1.680 346 HA THR 41 HA THR 41 5.684 -8.634 1.079 347 HB THR 41 HB THR 41 5.072 -11.242 1.375 348 HG1 THR 41 HG1 THR 41 4.183 -12.071 -0.329 349 HG21 THR 41 HG21 THR 41 3.136 -9.013 0.818 350 HG22 THR 41 HG22 THR 41 3.726 -9.566 2.386 351 HG23 THR 41 HG23 THR 41 2.668 -10.601 1.426 352 HA PRO 42 HA PRO 42 9.779 -10.135 1.646 353 HB2 PRO 42 HB2 PRO 42 9.509 -11.413 4.093 354 HB3 PRO 42 HB1 PRO 42 9.778 -9.681 3.873 355 HG2 PRO 42 HG2 PRO 42 7.229 -11.158 4.372 356 HG3 PRO 42 HG1 PRO 42 7.768 -9.597 5.020 357 HD2 PRO 42 HD2 PRO 42 5.976 -9.735 3.035 358 HD3 PRO 42 HD1 PRO 42 7.209 -8.459 3.076 359 H GLU 43 HN GLU 43 10.904 -12.273 2.549 360 HA GLU 43 HA GLU 43 10.401 -14.295 0.707 361 HB2 GLU 43 HB2 GLU 43 11.965 -14.154 3.255 362 HB3 GLU 43 HB1 GLU 43 11.751 -15.709 2.462 363 HG2 GLU 43 HG2 GLU 43 12.798 -14.878 0.456 364 HG3 GLU 43 HG1 GLU 43 12.918 -13.263 1.154 365 H THR 44 HN THR 44 8.577 -15.423 0.557 366 HA THR 44 HA THR 44 7.773 -17.228 2.574 367 HB THR 44 HB THR 44 6.842 -15.328 3.706 368 HG1 THR 44 HG1 THR 44 4.740 -16.615 2.307 369 HG21 THR 44 HG21 THR 44 6.477 -14.213 1.198 370 HG22 THR 44 HG22 THR 44 5.974 -13.535 2.746 371 HG23 THR 44 HG23 THR 44 4.846 -14.506 1.799 372 H LYS 45 HN LYS 45 8.164 -18.361 0.509 373 HA LYS 45 HA LYS 45 5.739 -18.361 -1.165 374 HB2 LYS 45 HB2 LYS 45 8.620 -18.743 -1.965 375 HB3 LYS 45 HB1 LYS 45 7.282 -19.233 -2.995 376 HG2 LYS 45 HG2 LYS 45 6.882 -16.536 -2.122 377 HG3 LYS 45 HG1 LYS 45 8.495 -16.708 -2.816 378 HD2 LYS 45 HD2 LYS 45 7.698 -17.026 -4.897 379 HD3 LYS 45 HD1 LYS 45 6.365 -18.036 -4.335 380 HE2 LYS 45 HE2 LYS 45 5.488 -15.719 -3.401 381 HE3 LYS 45 HE1 LYS 45 6.501 -15.088 -4.699 382 HZ1 LYS 45 HZ1 LYS 45 4.071 -16.722 -4.864 383 HZ2 LYS 45 HZ2 LYS 45 5.236 -16.887 -6.079 384 HZ3 LYS 45 HZ3 LYS 45 4.531 -15.379 -5.785 385 H HIS 46 HN HIS 46 5.128 -19.917 0.617 386 HA HIS 46 HA HIS 46 5.181 -22.543 -0.362 387 HB2 HIS 46 HB2 HIS 46 7.434 -21.838 1.294 388 HB3 HIS 46 HB1 HIS 46 6.471 -23.082 2.084 389 HD1 HIS 46 HD1 HIS 46 9.381 -23.219 0.524 390 HD2 HIS 46 HD2 HIS 46 5.725 -24.831 -0.616 391 HE1 HIS 46 HE1 HIS 46 9.937 -25.109 -1.038 392 HE2 HIS 46 HE2 HIS 46 7.714 -26.124 -1.647 393 HA PRO 47 HA PRO 47 1.476 -21.985 2.156 394 HB2 PRO 47 HB2 PRO 47 1.273 -24.884 1.481 395 HB3 PRO 47 HB1 PRO 47 0.051 -23.612 1.363 396 HG2 PRO 47 HG2 PRO 47 1.275 -24.516 -0.819 397 HG3 PRO 47 HG1 PRO 47 0.908 -22.792 -0.632 398 HD2 PRO 47 HD2 PRO 47 3.515 -24.216 -0.362 399 HD3 PRO 47 HD1 PRO 47 3.174 -22.592 -0.992 400 H LYS 48 HN LYS 48 0.499 -23.234 4.014 401 HA LYS 48 HA LYS 48 2.381 -24.910 5.474 402 HB2 LYS 48 HB2 LYS 48 2.449 -22.251 5.981 403 HB3 LYS 48 HB1 LYS 48 1.196 -22.752 7.110 404 HG2 LYS 48 HG2 LYS 48 3.050 -22.969 8.421 405 HG3 LYS 48 HG1 LYS 48 2.950 -24.596 7.746 406 HD2 LYS 48 HD2 LYS 48 4.436 -23.252 5.868 407 HD3 LYS 48 HD1 LYS 48 4.986 -22.534 7.382 408 HE2 LYS 48 HE2 LYS 48 6.376 -24.300 7.441 409 HE3 LYS 48 HE1 LYS 48 4.960 -25.159 8.044 410 HZ1 LYS 48 HZ1 LYS 48 5.668 -24.995 5.169 411 HZ2 LYS 48 HZ2 LYS 48 4.502 -25.989 5.885 412 HZ3 LYS 48 HZ3 LYS 48 6.145 -26.271 6.175 413 H LYS 49 HN LYS 49 1.386 -25.811 7.477 414 HA LYS 49 HA LYS 49 -1.128 -26.938 6.905 415 HB2 LYS 49 HB2 LYS 49 0.412 -26.811 9.502 416 HB3 LYS 49 HB1 LYS 49 -1.018 -27.801 9.246 417 HG2 LYS 49 HG2 LYS 49 0.284 -28.841 7.301 418 HG3 LYS 49 HG1 LYS 49 1.704 -28.090 8.031 419 HD2 LYS 49 HD2 LYS 49 1.603 -30.298 8.885 420 HD3 LYS 49 HD1 LYS 49 1.053 -29.239 10.184 421 HE2 LYS 49 HE2 LYS 49 -1.133 -30.100 8.484 422 HE3 LYS 49 HE1 LYS 49 -0.266 -31.466 9.183 423 HZ1 LYS 49 HZ1 LYS 49 -0.759 -30.790 11.326 424 HZ2 LYS 49 HZ2 LYS 49 -2.190 -30.438 10.496 425 HZ3 LYS 49 HZ3 LYS 49 -1.105 -29.197 10.870 426 H GLY 50 HN GLY 50 -0.171 -24.127 8.751 427 HA2 GLY 50 HA2 GLY 50 -3.023 -23.476 9.093 428 HA3 GLY 50 HA1 GLY 50 -1.929 -23.347 10.461 429 H VAL 51 HN VAL 51 -3.052 -21.888 7.548 430 HA VAL 51 HA VAL 51 -1.050 -19.773 7.645 431 HB VAL 51 HB VAL 51 -3.406 -20.029 5.771 432 HG11 VAL 51 HG11 VAL 51 -2.353 -17.773 6.036 433 HG12 VAL 51 HG12 VAL 51 -2.284 -18.431 4.401 434 HG13 VAL 51 HG13 VAL 51 -0.851 -18.470 5.428 435 HG21 VAL 51 HG21 VAL 51 -1.354 -21.807 5.902 436 HG22 VAL 51 HG22 VAL 51 -0.716 -20.627 4.756 437 HG23 VAL 51 HG23 VAL 51 -2.256 -21.425 4.436 438 H GLU 52 HN GLU 52 -1.428 -17.701 8.277 439 HA GLU 52 HA GLU 52 -4.143 -16.884 8.965 440 HB2 GLU 52 HB2 GLU 52 -2.201 -17.696 10.907 441 HB3 GLU 52 HB1 GLU 52 -2.496 -15.972 11.090 442 HG2 GLU 52 HG2 GLU 52 -4.758 -17.923 10.903 443 HG3 GLU 52 HG1 GLU 52 -3.936 -17.606 12.430 444 H LYS 53 HN LYS 53 -0.716 -15.940 8.922 445 HA LYS 53 HA LYS 53 -1.536 -13.363 7.768 446 HB2 LYS 53 HB2 LYS 53 0.689 -13.673 9.786 447 HB3 LYS 53 HB1 LYS 53 0.081 -12.173 9.098 448 HG2 LYS 53 HG2 LYS 53 -2.083 -13.571 10.320 449 HG3 LYS 53 HG1 LYS 53 -0.740 -13.476 11.460 450 HD2 LYS 53 HD2 LYS 53 -0.690 -11.119 11.358 451 HD3 LYS 53 HD1 LYS 53 -1.715 -11.082 9.922 452 HE2 LYS 53 HE2 LYS 53 -3.636 -11.524 11.120 453 HE3 LYS 53 HE1 LYS 53 -2.760 -12.291 12.442 454 HZ1 LYS 53 HZ1 LYS 53 -1.809 -9.821 12.608 455 HZ2 LYS 53 HZ2 LYS 53 -3.189 -10.334 13.442 456 HZ3 LYS 53 HZ3 LYS 53 -3.347 -9.481 11.989 457 H TYR 54 HN TYR 54 -0.298 -12.617 6.112 458 HA TYR 54 HA TYR 54 1.548 -14.478 4.916 459 HB2 TYR 54 HB2 TYR 54 0.146 -12.008 4.093 460 HB3 TYR 54 HB1 TYR 54 1.713 -12.277 3.337 461 HD1 TYR 54 HD1 TYR 54 2.097 -14.418 2.066 462 HD2 TYR 54 HD2 TYR 54 -1.759 -13.228 3.414 463 HE1 TYR 54 HE1 TYR 54 1.064 -15.978 0.471 464 HE2 TYR 54 HE2 TYR 54 -2.802 -14.786 1.823 465 HH TYR 54 HH TYR 54 -1.970 -17.043 0.640 466 H GLY 55 HN GLY 55 1.728 -11.187 6.243 467 HA2 GLY 55 HA2 GLY 55 4.636 -11.584 6.547 468 HA3 GLY 55 HA1 GLY 55 3.988 -10.070 5.936 469 HA PRO 56 HA PRO 56 3.333 -10.640 10.776 470 HB2 PRO 56 HB2 PRO 56 5.832 -10.934 11.864 471 HB3 PRO 56 HB1 PRO 56 4.726 -12.276 11.556 472 HG2 PRO 56 HG2 PRO 56 7.035 -11.310 9.920 473 HG3 PRO 56 HG1 PRO 56 6.550 -12.973 10.300 474 HD2 PRO 56 HD2 PRO 56 6.004 -11.844 7.922 475 HD3 PRO 56 HD1 PRO 56 4.886 -12.988 8.691 476 H GLU 57 HN GLU 57 6.323 -9.357 9.333 477 HA GLU 57 HA GLU 57 6.311 -7.034 11.028 478 HB2 GLU 57 HB2 GLU 57 8.305 -8.294 9.806 479 HB3 GLU 57 HB1 GLU 57 7.939 -7.136 8.534 480 HG2 GLU 57 HG2 GLU 57 9.584 -6.073 9.758 481 HG3 GLU 57 HG1 GLU 57 8.099 -5.367 10.394 482 H ALA 58 HN ALA 58 5.091 -7.867 7.883 483 HA ALA 58 HA ALA 58 4.734 -5.143 7.019 484 HB1 ALA 58 HB1 ALA 58 4.931 -6.405 5.151 485 HB2 ALA 58 HB2 ALA 58 3.180 -6.514 5.324 486 HB3 ALA 58 HB3 ALA 58 4.207 -7.827 5.901 487 H SER 59 HN SER 59 2.600 -7.753 8.143 488 HA SER 59 HA SER 59 0.180 -6.375 7.948 489 HB2 SER 59 HB2 SER 59 0.745 -8.888 8.540 490 HB3 SER 59 HB1 SER 59 0.608 -8.299 10.196 491 HG SER 59 HG SER 59 -1.354 -9.080 8.803 492 H ALA 60 HN ALA 60 2.438 -6.630 10.677 493 HA ALA 60 HA ALA 60 0.920 -5.142 12.511 494 HB1 ALA 60 HB1 ALA 60 2.567 -6.226 13.623 495 HB2 ALA 60 HB2 ALA 60 3.401 -4.688 13.402 496 HB3 ALA 60 HB3 ALA 60 3.730 -6.035 12.311 497 H PHE 61 HN PHE 61 3.738 -4.096 10.580 498 HA PHE 61 HA PHE 61 3.621 -1.402 11.274 499 HB2 PHE 61 HB2 PHE 61 5.553 -2.468 10.169 500 HB3 PHE 61 HB1 PHE 61 4.614 -2.607 8.685 501 HD1 PHE 61 HD1 PHE 61 6.036 -0.193 11.077 502 HD2 PHE 61 HD2 PHE 61 4.474 -0.824 7.178 503 HE1 PHE 61 HE1 PHE 61 6.766 2.071 10.425 504 HE2 PHE 61 HE2 PHE 61 5.192 1.428 6.510 505 HZ PHE 61 HZ PHE 61 6.344 2.883 8.136 506 H THR 62 HN THR 62 2.402 -2.960 8.300 507 HA THR 62 HA THR 62 1.264 -0.746 7.111 508 HB THR 62 HB THR 62 0.198 -3.579 7.077 509 HG1 THR 62 HG1 THR 62 2.233 -3.685 6.322 510 HG21 THR 62 HG21 THR 62 -0.720 -3.060 4.906 511 HG22 THR 62 HG22 THR 62 -0.151 -1.396 5.037 512 HG23 THR 62 HG23 THR 62 -1.403 -1.989 6.129 513 H LYS 63 HN LYS 63 -0.164 -2.935 9.502 514 HA LYS 63 HA LYS 63 -2.683 -1.585 9.572 515 HB2 LYS 63 HB2 LYS 63 -2.212 -4.012 10.213 516 HB3 LYS 63 HB1 LYS 63 -1.565 -3.381 11.720 517 HG2 LYS 63 HG2 LYS 63 -4.128 -2.219 11.268 518 HG3 LYS 63 HG1 LYS 63 -4.246 -3.969 11.070 519 HD2 LYS 63 HD2 LYS 63 -2.902 -2.679 13.435 520 HD3 LYS 63 HD1 LYS 63 -4.620 -3.081 13.412 521 HE2 LYS 63 HE2 LYS 63 -2.463 -5.098 12.836 522 HE3 LYS 63 HE1 LYS 63 -3.071 -4.790 14.463 523 HZ1 LYS 63 HZ1 LYS 63 -4.108 -6.664 13.035 524 HZ2 LYS 63 HZ2 LYS 63 -4.966 -5.406 12.300 525 HZ3 LYS 63 HZ3 LYS 63 -5.116 -5.672 13.964 526 H LYS 64 HN LYS 64 0.351 -1.292 11.251 527 HA LYS 64 HA LYS 64 -0.496 0.162 13.498 528 HB2 LYS 64 HB2 LYS 64 2.059 -0.335 12.096 529 HB3 LYS 64 HB1 LYS 64 2.007 1.116 13.085 530 HG2 LYS 64 HG2 LYS 64 1.108 -1.502 14.209 531 HG3 LYS 64 HG1 LYS 64 2.827 -1.109 14.114 532 HD2 LYS 64 HD2 LYS 64 0.815 0.733 15.381 533 HD3 LYS 64 HD1 LYS 64 1.637 -0.537 16.288 534 HE2 LYS 64 HE2 LYS 64 3.284 1.326 14.656 535 HE3 LYS 64 HE1 LYS 64 2.591 1.927 16.161 536 HZ1 LYS 64 HZ1 LYS 64 4.672 1.089 16.747 537 HZ2 LYS 64 HZ2 LYS 64 4.507 -0.291 15.783 538 HZ3 LYS 64 HZ3 LYS 64 3.601 -0.140 17.204 539 H MET 65 HN MET 65 0.964 1.336 10.477 540 HA MET 65 HA MET 65 0.742 4.053 10.963 541 HB2 MET 65 HB2 MET 65 0.953 2.383 8.509 542 HB3 MET 65 HB1 MET 65 0.540 4.081 8.316 543 HG2 MET 65 HG2 MET 65 2.839 3.450 10.064 544 HG3 MET 65 HG1 MET 65 3.046 3.186 8.333 545 HE1 MET 65 HE1 MET 65 1.536 6.709 10.473 546 HE2 MET 65 HE2 MET 65 3.264 6.726 10.826 547 HE3 MET 65 HE3 MET 65 2.308 5.286 11.171 548 H VAL 66 HN VAL 66 -1.583 1.950 9.257 549 HA VAL 66 HA VAL 66 -3.429 4.015 8.708 550 HB VAL 66 HB VAL 66 -5.065 2.196 8.296 551 HG11 VAL 66 HG11 VAL 66 -2.322 1.897 7.086 552 HG12 VAL 66 HG12 VAL 66 -3.659 2.878 6.484 553 HG13 VAL 66 HG13 VAL 66 -3.772 1.118 6.453 554 HG21 VAL 66 HG21 VAL 66 -4.268 -0.142 8.424 555 HG22 VAL 66 HG22 VAL 66 -4.398 0.627 10.005 556 HG23 VAL 66 HG23 VAL 66 -2.817 0.425 9.251 557 H GLU 67 HN GLU 67 -3.242 1.663 11.358 558 HA GLU 67 HA GLU 67 -5.671 2.463 12.575 559 HB2 GLU 67 HB2 GLU 67 -3.288 0.991 13.699 560 HB3 GLU 67 HB1 GLU 67 -4.813 1.201 14.549 561 HG2 GLU 67 HG2 GLU 67 -4.697 -0.073 11.843 562 HG3 GLU 67 HG1 GLU 67 -4.406 -0.998 13.315 563 H ASN 68 HN ASN 68 -2.270 3.219 13.288 564 HA ASN 68 HA ASN 68 -2.838 4.931 15.473 565 HB2 ASN 68 HB2 ASN 68 -0.432 4.494 13.729 566 HB3 ASN 68 HB1 ASN 68 -0.454 5.801 14.910 567 HD21 ASN 68 HD21 ASN 68 -1.173 2.341 14.662 568 HD22 ASN 68 HD22 ASN 68 -0.515 1.918 16.203 569 H ALA 69 HN ALA 69 -2.638 5.421 12.023 570 HA ALA 69 HA ALA 69 -2.453 8.247 12.058 571 HB1 ALA 69 HB1 ALA 69 -1.837 7.286 10.039 572 HB2 ALA 69 HB2 ALA 69 -3.426 7.963 9.682 573 HB3 ALA 69 HB3 ALA 69 -3.252 6.235 9.992 574 H LYS 70 HN LYS 70 -3.927 9.678 12.648 575 HA LYS 70 HA LYS 70 -6.521 9.020 13.470 576 HB2 LYS 70 HB2 LYS 70 -4.983 11.505 13.042 577 HB3 LYS 70 HB1 LYS 70 -6.731 11.682 12.975 578 HG2 LYS 70 HG2 LYS 70 -6.687 10.349 15.204 579 HG3 LYS 70 HG1 LYS 70 -4.998 10.856 15.259 580 HD2 LYS 70 HD2 LYS 70 -7.032 12.931 14.658 581 HD3 LYS 70 HD1 LYS 70 -6.960 12.316 16.311 582 HE2 LYS 70 HE2 LYS 70 -4.970 13.293 16.726 583 HE3 LYS 70 HE1 LYS 70 -4.363 12.981 15.100 584 HZ1 LYS 70 HZ1 LYS 70 -5.009 15.400 15.984 585 HZ2 LYS 70 HZ2 LYS 70 -6.492 14.948 15.307 586 HZ3 LYS 70 HZ3 LYS 70 -5.095 14.959 14.352 587 H LYS 71 HN LYS 71 -5.252 9.671 10.335 588 HA LYS 71 HA LYS 71 -7.918 9.334 9.201 589 HB2 LYS 71 HB2 LYS 71 -7.097 11.843 9.425 590 HB3 LYS 71 HB1 LYS 71 -6.198 11.435 7.971 591 HG2 LYS 71 HG2 LYS 71 -8.438 10.609 7.045 592 HG3 LYS 71 HG1 LYS 71 -9.163 11.508 8.380 593 HD2 LYS 71 HD2 LYS 71 -9.090 12.859 6.345 594 HD3 LYS 71 HD1 LYS 71 -8.067 13.552 7.604 595 HE2 LYS 71 HE2 LYS 71 -6.194 13.261 6.404 596 HE3 LYS 71 HE1 LYS 71 -6.682 11.658 5.858 597 HZ1 LYS 71 HZ1 LYS 71 -6.555 13.842 4.294 598 HZ2 LYS 71 HZ2 LYS 71 -8.198 13.819 4.695 599 HZ3 LYS 71 HZ3 LYS 71 -7.490 12.473 3.956 600 H ILE 72 HN ILE 72 -7.953 8.236 7.300 601 HA ILE 72 HA ILE 72 -5.350 7.446 6.168 602 HB ILE 72 HB ILE 72 -7.825 5.776 5.894 603 HG12 ILE 72 HG12 ILE 72 -5.798 5.473 8.117 604 HG13 ILE 72 HG11 ILE 72 -7.381 6.213 8.332 605 HG21 ILE 72 HG21 ILE 72 -5.593 5.515 4.583 606 HG22 ILE 72 HG22 ILE 72 -6.418 4.091 5.216 607 HG23 ILE 72 HG23 ILE 72 -5.029 4.758 6.073 608 HD11 ILE 72 HD11 ILE 72 -6.635 3.428 8.276 609 HD12 ILE 72 HD12 ILE 72 -7.924 3.782 7.126 610 HD13 ILE 72 HD13 ILE 72 -8.127 4.189 8.830 611 H GLU 73 HN GLU 73 -5.145 7.416 3.930 612 HA GLU 73 HA GLU 73 -7.455 8.424 2.403 613 HB2 GLU 73 HB2 GLU 73 -4.662 9.280 1.719 614 HB3 GLU 73 HB1 GLU 73 -6.187 10.036 1.284 615 HG2 GLU 73 HG2 GLU 73 -6.497 10.736 3.609 616 HG3 GLU 73 HG1 GLU 73 -4.954 9.995 4.030 617 H VAL 74 HN VAL 74 -7.781 7.539 0.411 618 HA VAL 74 HA VAL 74 -5.808 5.547 -0.482 619 HB VAL 74 HB VAL 74 -7.859 4.408 -1.560 620 HG11 VAL 74 HG11 VAL 74 -7.315 2.879 -0.060 621 HG12 VAL 74 HG12 VAL 74 -8.269 3.726 1.159 622 HG13 VAL 74 HG13 VAL 74 -6.560 4.114 0.946 623 HG21 VAL 74 HG21 VAL 74 -9.946 4.962 -0.935 624 HG22 VAL 74 HG22 VAL 74 -9.216 6.517 -0.536 625 HG23 VAL 74 HG23 VAL 74 -9.468 5.311 0.726 626 H GLU 75 HN GLU 75 -5.344 5.420 -2.628 627 HA GLU 75 HA GLU 75 -6.720 7.316 -4.413 628 HB2 GLU 75 HB2 GLU 75 -4.550 8.259 -3.741 629 HB3 GLU 75 HB1 GLU 75 -3.741 6.804 -4.308 630 HG2 GLU 75 HG2 GLU 75 -4.165 7.296 -6.546 631 HG3 GLU 75 HG1 GLU 75 -5.425 8.462 -6.145 632 H PHE 76 HN PHE 76 -7.780 6.086 -5.830 633 HA PHE 76 HA PHE 76 -6.932 3.453 -6.537 634 HB2 PHE 76 HB2 PHE 76 -9.138 5.244 -7.541 635 HB3 PHE 76 HB1 PHE 76 -8.834 3.651 -8.221 636 HD1 PHE 76 HD2 PHE 76 -8.382 1.872 -6.100 637 HD2 PHE 76 HD1 PHE 76 -10.964 5.260 -6.173 638 HE1 PHE 76 HE2 PHE 76 -9.760 0.859 -4.329 639 HE2 PHE 76 HE1 PHE 76 -12.346 4.249 -4.407 640 HZ PHE 76 HZ PHE 76 -11.746 2.046 -3.486 641 H ASP 77 HN ASP 77 -5.733 2.794 -8.165 642 HA ASP 77 HA ASP 77 -4.043 4.451 -9.577 643 HB2 ASP 77 HB2 ASP 77 -3.558 2.497 -10.995 644 HB3 ASP 77 HB1 ASP 77 -3.618 2.083 -9.287 645 H LYS 78 HN LYS 78 -3.844 4.854 -11.833 646 HA LYS 78 HA LYS 78 -6.151 6.049 -12.949 647 HB2 LYS 78 HB2 LYS 78 -4.509 6.022 -15.065 648 HB3 LYS 78 HB1 LYS 78 -4.327 7.159 -13.738 649 HG2 LYS 78 HG2 LYS 78 -2.911 4.592 -13.429 650 HG3 LYS 78 HG1 LYS 78 -2.325 5.653 -14.708 651 HD2 LYS 78 HD2 LYS 78 -2.809 7.224 -12.380 652 HD3 LYS 78 HD1 LYS 78 -1.841 5.822 -11.922 653 HE2 LYS 78 HE2 LYS 78 -0.044 6.837 -12.741 654 HE3 LYS 78 HE1 LYS 78 -0.770 6.780 -14.344 655 HZ1 LYS 78 HZ1 LYS 78 -0.686 8.991 -14.239 656 HZ2 LYS 78 HZ2 LYS 78 -0.434 9.010 -12.567 657 HZ3 LYS 78 HZ3 LYS 78 -2.005 8.892 -13.184 658 H GLY 79 HN GLY 79 -4.684 2.909 -13.312 659 HA2 GLY 79 HA2 GLY 79 -6.319 2.274 -15.647 660 HA3 GLY 79 HA1 GLY 79 -5.103 1.237 -14.915 661 H GLN 80 HN GLN 80 -6.137 -0.604 -14.385 662 HA GLN 80 HA GLN 80 -8.857 -0.759 -13.665 663 HB2 GLN 80 HB2 GLN 80 -6.641 -2.589 -13.953 664 HB3 GLN 80 HB1 GLN 80 -7.567 -2.969 -12.507 665 HG2 GLN 80 HG2 GLN 80 -9.624 -2.832 -14.024 666 HG3 GLN 80 HG1 GLN 80 -8.476 -2.934 -15.357 667 HE21 GLN 80 HE21 GLN 80 -10.413 -4.844 -14.984 668 HE22 GLN 80 HE22 GLN 80 -9.673 -6.332 -14.513 669 H ARG 81 HN ARG 81 -9.754 0.008 -11.892 670 HA ARG 81 HA ARG 81 -8.132 0.278 -9.470 671 HB2 ARG 81 HB2 ARG 81 -10.764 1.546 -10.214 672 HB3 ARG 81 HB1 ARG 81 -9.886 1.840 -8.717 673 HG2 ARG 81 HG2 ARG 81 -8.065 2.848 -9.899 674 HG3 ARG 81 HG1 ARG 81 -8.763 2.388 -11.456 675 HD2 ARG 81 HD2 ARG 81 -10.506 3.983 -9.697 676 HD3 ARG 81 HD1 ARG 81 -9.081 4.816 -10.310 677 HE ARG 81 HE ARG 81 -9.877 4.161 -12.573 678 HH11 ARG 81 HH11 ARG 81 -12.162 4.369 -9.929 679 HH12 ARG 81 HH12 ARG 81 -13.515 4.660 -10.969 680 HH21 ARG 81 HH21 ARG 81 -11.659 4.545 -13.924 681 HH22 ARG 81 HH22 ARG 81 -13.232 4.759 -13.230 682 H THR 82 HN THR 82 -9.963 -2.053 -10.674 683 HA THR 82 HA THR 82 -10.535 -3.180 -8.122 684 HB THR 82 HB THR 82 -13.049 -3.518 -8.898 685 HG1 THR 82 HG1 THR 82 -13.804 -1.543 -9.805 686 HG21 THR 82 HG21 THR 82 -13.733 -2.016 -7.309 687 HG22 THR 82 HG22 THR 82 -12.473 -0.850 -7.712 688 HG23 THR 82 HG23 THR 82 -12.064 -2.317 -6.823 689 H ASP 83 HN ASP 83 -9.839 -5.161 -8.425 690 HA ASP 83 HA ASP 83 -9.796 -6.412 -10.997 691 HB2 ASP 83 HB2 ASP 83 -8.498 -6.781 -8.517 692 HB3 ASP 83 HB1 ASP 83 -9.347 -8.285 -8.856 693 H LYS 84 HN LYS 84 -10.396 -9.016 -10.594 694 HA LYS 84 HA LYS 84 -13.041 -9.286 -11.185 695 HB2 LYS 84 HB2 LYS 84 -12.641 -11.633 -9.868 696 HB3 LYS 84 HB1 LYS 84 -12.149 -11.323 -11.529 697 HG2 LYS 84 HG2 LYS 84 -10.233 -10.576 -9.401 698 HG3 LYS 84 HG1 LYS 84 -10.503 -12.298 -9.674 699 HD2 LYS 84 HD2 LYS 84 -10.232 -11.083 -12.213 700 HD3 LYS 84 HD1 LYS 84 -8.934 -10.456 -11.197 701 HE2 LYS 84 HE2 LYS 84 -7.858 -12.335 -11.789 702 HE3 LYS 84 HE1 LYS 84 -8.874 -13.098 -10.567 703 HZ1 LYS 84 HZ1 LYS 84 -9.014 -13.268 -13.468 704 HZ2 LYS 84 HZ2 LYS 84 -10.495 -13.212 -12.654 705 HZ3 LYS 84 HZ3 LYS 84 -9.380 -14.431 -12.296 706 H TYR 85 HN TYR 85 -11.707 -10.023 -7.962 707 HA TYR 85 HA TYR 85 -14.243 -10.271 -6.752 708 HB2 TYR 85 HB2 TYR 85 -11.431 -10.273 -5.868 709 HB3 TYR 85 HB1 TYR 85 -12.588 -9.748 -4.651 710 HD1 TYR 85 HD1 TYR 85 -13.066 -12.302 -7.305 711 HD2 TYR 85 HD2 TYR 85 -12.614 -11.541 -3.146 712 HE1 TYR 85 HE1 TYR 85 -13.612 -14.651 -6.823 713 HE2 TYR 85 HE2 TYR 85 -13.156 -13.887 -2.651 714 HH TYR 85 HH TYR 85 -14.420 -16.021 -5.019 715 H GLY 86 HN GLY 86 -12.739 -7.541 -7.883 716 HA2 GLY 86 HA2 GLY 86 -13.458 -5.340 -7.721 717 HA3 GLY 86 HA1 GLY 86 -14.553 -5.825 -6.432 718 H ARG 87 HN ARG 87 -11.215 -6.717 -6.272 719 HA ARG 87 HA ARG 87 -10.775 -5.682 -3.739 720 HB2 ARG 87 HB2 ARG 87 -9.364 -7.307 -5.285 721 HB3 ARG 87 HB1 ARG 87 -8.483 -5.829 -5.648 722 HG2 ARG 87 HG2 ARG 87 -7.352 -6.941 -3.878 723 HG3 ARG 87 HG1 ARG 87 -8.141 -5.516 -3.198 724 HD2 ARG 87 HD2 ARG 87 -8.449 -7.407 -1.722 725 HD3 ARG 87 HD1 ARG 87 -9.996 -6.941 -2.427 726 HE ARG 87 HE ARG 87 -9.111 -8.880 -4.095 727 HH11 ARG 87 HH11 ARG 87 -9.528 -8.708 -0.634 728 HH12 ARG 87 HH12 ARG 87 -9.856 -10.400 -0.465 729 HH21 ARG 87 HH21 ARG 87 -9.542 -11.105 -3.873 730 HH22 ARG 87 HH22 ARG 87 -9.863 -11.761 -2.303 731 H GLY 88 HN GLY 88 -9.390 -3.922 -3.031 732 HA2 GLY 88 HA2 GLY 88 -9.959 -1.514 -4.558 733 HA3 GLY 88 HA1 GLY 88 -9.346 -1.577 -2.918 734 H LEU 89 HN LEU 89 -8.581 -1.340 -6.238 735 HA LEU 89 HA LEU 89 -5.756 -1.804 -5.928 736 HB2 LEU 89 HB2 LEU 89 -7.435 -0.785 -8.203 737 HB3 LEU 89 HB1 LEU 89 -5.694 -0.956 -8.304 738 HG LEU 89 HG LEU 89 -7.072 -2.828 -9.296 739 HD11 LEU 89 HD11 LEU 89 -5.597 -4.597 -8.354 740 HD12 LEU 89 HD12 LEU 89 -5.023 -3.416 -7.178 741 HD13 LEU 89 HD13 LEU 89 -4.744 -3.153 -8.899 742 HD21 LEU 89 HD21 LEU 89 -7.463 -3.630 -6.427 743 HD22 LEU 89 HD22 LEU 89 -8.063 -4.451 -7.869 744 HD23 LEU 89 HD23 LEU 89 -8.715 -2.876 -7.412 745 H ALA 90 HN ALA 90 -5.627 -0.179 -4.148 746 HA ALA 90 HA ALA 90 -4.783 2.380 -5.248 747 HB1 ALA 90 HB1 ALA 90 -6.803 3.256 -4.719 748 HB2 ALA 90 HB2 ALA 90 -6.076 3.362 -3.118 749 HB3 ALA 90 HB3 ALA 90 -7.147 2.019 -3.513 750 H TYR 91 HN TYR 91 -3.949 3.791 -3.331 751 HA TYR 91 HA TYR 91 -2.266 2.053 -1.659 752 HB2 TYR 91 HB2 TYR 91 -1.588 4.927 -1.914 753 HB3 TYR 91 HB1 TYR 91 -0.534 3.522 -1.898 754 HD1 TYR 91 HD1 TYR 91 -0.564 2.046 -4.037 755 HD2 TYR 91 HD2 TYR 91 -1.964 6.060 -3.914 756 HE1 TYR 91 HE1 TYR 91 -0.281 2.216 -6.471 757 HE2 TYR 91 HE2 TYR 91 -1.690 6.236 -6.357 758 HH TYR 91 HH TYR 91 -0.045 3.820 -8.195 759 H ILE 92 HN ILE 92 -2.285 2.267 0.537 760 HA ILE 92 HA ILE 92 -4.393 3.963 1.665 761 HB ILE 92 HB ILE 92 -2.721 1.859 3.045 762 HG12 ILE 92 HG12 ILE 92 -5.145 0.734 2.881 763 HG13 ILE 92 HG11 ILE 92 -5.211 1.715 1.420 764 HG21 ILE 92 HG21 ILE 92 -3.688 3.509 4.560 765 HG22 ILE 92 HG22 ILE 92 -4.460 1.935 4.759 766 HG23 ILE 92 HG23 ILE 92 -5.284 3.215 3.868 767 HD11 ILE 92 HD11 ILE 92 -4.190 0.031 0.406 768 HD12 ILE 92 HD12 ILE 92 -3.799 -0.752 1.938 769 HD13 ILE 92 HD13 ILE 92 -2.738 0.499 1.290 770 H TYR 93 HN TYR 93 -3.973 5.821 2.658 771 HA TYR 93 HA TYR 93 -1.186 6.476 3.290 772 HB2 TYR 93 HB2 TYR 93 -3.597 8.284 3.041 773 HB3 TYR 93 HB1 TYR 93 -1.960 8.818 3.379 774 HD1 TYR 93 HD2 TYR 93 -2.907 6.235 0.877 775 HD2 TYR 93 HD1 TYR 93 -1.615 10.232 1.537 776 HE1 TYR 93 HE2 TYR 93 -2.525 6.497 -1.529 777 HE2 TYR 93 HE1 TYR 93 -1.217 10.503 -0.873 778 HH TYR 93 HH TYR 93 -2.444 8.509 -3.175 779 H ALA 94 HN ALA 94 -0.743 7.707 5.244 780 HA ALA 94 HA ALA 94 -2.675 7.390 7.414 781 HB1 ALA 94 HB1 ALA 94 -0.510 6.668 8.783 782 HB2 ALA 94 HB2 ALA 94 -0.051 6.024 7.209 783 HB3 ALA 94 HB3 ALA 94 -1.547 5.492 7.975 784 H ASP 95 HN ASP 95 -2.908 9.367 8.227 785 HA ASP 95 HA ASP 95 -2.444 11.418 9.090 786 HB2 ASP 95 HB2 ASP 95 -0.124 9.819 9.709 787 HB3 ASP 95 HB1 ASP 95 0.352 11.487 9.407 788 H GLY 96 HN GLY 96 -1.856 10.600 6.115 789 HA2 GLY 96 HA2 GLY 96 -1.823 12.333 4.429 790 HA3 GLY 96 HA1 GLY 96 -0.683 13.213 5.430 791 H LYS 97 HN LYS 97 -0.035 9.882 5.307 792 HA LYS 97 HA LYS 97 1.843 10.253 3.084 793 HB2 LYS 97 HB2 LYS 97 2.437 9.535 5.898 794 HB3 LYS 97 HB1 LYS 97 3.308 8.644 4.658 795 HG2 LYS 97 HG2 LYS 97 4.233 10.648 3.762 796 HG3 LYS 97 HG1 LYS 97 3.202 11.644 4.793 797 HD2 LYS 97 HD2 LYS 97 4.793 9.738 6.311 798 HD3 LYS 97 HD1 LYS 97 5.787 10.839 5.355 799 HE2 LYS 97 HE2 LYS 97 4.655 12.750 6.345 800 HE3 LYS 97 HE1 LYS 97 3.605 11.671 7.263 801 HZ1 LYS 97 HZ1 LYS 97 6.459 11.262 7.610 802 HZ2 LYS 97 HZ2 LYS 97 5.214 11.233 8.754 803 HZ3 LYS 97 HZ3 LYS 97 5.848 12.712 8.231 804 H MET 98 HN MET 98 1.948 8.582 1.690 805 HA MET 98 HA MET 98 0.034 6.510 1.848 806 HB2 MET 98 HB2 MET 98 2.363 6.100 0.061 807 HB3 MET 98 HB1 MET 98 0.643 5.936 -0.267 808 HG2 MET 98 HG2 MET 98 0.622 8.520 -0.090 809 HG3 MET 98 HG1 MET 98 2.359 8.376 -0.351 810 HE1 MET 98 HE1 MET 98 2.173 9.089 -3.951 811 HE2 MET 98 HE2 MET 98 2.946 9.277 -2.377 812 HE3 MET 98 HE3 MET 98 1.410 10.079 -2.705 813 H VAL 99 HN VAL 99 0.103 4.911 3.250 814 HA VAL 99 HA VAL 99 2.323 4.027 4.678 815 HB VAL 99 HB VAL 99 -0.097 2.350 4.010 816 HG11 VAL 99 HG11 VAL 99 1.760 2.316 6.386 817 HG12 VAL 99 HG12 VAL 99 1.742 1.139 5.072 818 HG13 VAL 99 HG13 VAL 99 0.354 1.276 6.152 819 HG21 VAL 99 HG21 VAL 99 -0.969 4.394 4.826 820 HG22 VAL 99 HG22 VAL 99 0.281 4.513 6.063 821 HG23 VAL 99 HG23 VAL 99 -0.973 3.282 6.195 822 H ASN 100 HN ASN 100 1.063 3.006 1.572 823 HA ASN 100 HA ASN 100 2.382 0.583 1.234 824 HB2 ASN 100 HB2 ASN 100 2.050 2.597 -0.990 825 HB3 ASN 100 HB1 ASN 100 2.014 0.839 -1.098 826 HD21 ASN 100 HD21 ASN 100 0.090 -0.113 -1.091 827 HD22 ASN 100 HD22 ASN 100 -1.400 0.625 -0.630 828 H GLU 101 HN GLU 101 3.498 3.841 0.314 829 HA GLU 101 HA GLU 101 6.024 3.095 -0.626 830 HB2 GLU 101 HB2 GLU 101 4.725 5.395 -0.667 831 HB3 GLU 101 HB1 GLU 101 5.659 5.703 0.792 832 HG2 GLU 101 HG2 GLU 101 7.418 4.681 -1.188 833 HG3 GLU 101 HG1 GLU 101 6.455 5.968 -1.911 834 H ALA 102 HN ALA 102 4.843 3.697 2.620 835 HA ALA 102 HA ALA 102 7.273 3.958 3.970 836 HB1 ALA 102 HB1 ALA 102 6.069 3.389 5.971 837 HB2 ALA 102 HB2 ALA 102 4.778 2.639 5.032 838 HB3 ALA 102 HB3 ALA 102 5.030 4.382 4.950 839 H LEU 103 HN LEU 103 5.297 1.012 3.536 840 HA LEU 103 HA LEU 103 7.189 -0.757 4.636 841 HB2 LEU 103 HB2 LEU 103 4.852 -1.101 2.785 842 HB3 LEU 103 HB1 LEU 103 5.901 -2.458 3.151 843 HG LEU 103 HG LEU 103 5.359 -1.589 5.654 844 HD11 LEU 103 HD11 LEU 103 2.884 -1.036 4.023 845 HD12 LEU 103 HD12 LEU 103 3.849 0.157 4.893 846 HD13 LEU 103 HD13 LEU 103 2.967 -1.082 5.784 847 HD21 LEU 103 HD21 LEU 103 3.359 -3.367 4.344 848 HD22 LEU 103 HD22 LEU 103 4.183 -3.544 5.894 849 HD23 LEU 103 HD23 LEU 103 5.050 -3.864 4.391 850 H VAL 104 HN VAL 104 6.679 0.499 1.414 851 HA VAL 104 HA VAL 104 8.431 -1.206 0.008 852 HB VAL 104 HB VAL 104 7.656 1.652 -0.614 853 HG11 VAL 104 HG11 VAL 104 9.183 -0.405 -2.104 854 HG12 VAL 104 HG12 VAL 104 9.340 1.353 -2.110 855 HG13 VAL 104 HG13 VAL 104 8.037 0.580 -3.013 856 HG21 VAL 104 HG21 VAL 104 5.957 -0.450 -0.381 857 HG22 VAL 104 HG22 VAL 104 6.395 -0.554 -2.086 858 HG23 VAL 104 HG23 VAL 104 5.697 0.933 -1.444 859 H ARG 105 HN ARG 105 8.883 1.939 1.566 860 HA ARG 105 HA ARG 105 11.659 2.106 0.852 861 HB2 ARG 105 HB2 ARG 105 10.444 4.157 1.077 862 HB3 ARG 105 HB1 ARG 105 9.909 3.731 2.696 863 HG2 ARG 105 HG2 ARG 105 12.735 3.683 2.712 864 HG3 ARG 105 HG1 ARG 105 12.236 5.161 1.889 865 HD2 ARG 105 HD2 ARG 105 12.110 5.968 3.988 866 HD3 ARG 105 HD1 ARG 105 10.533 5.188 3.971 867 HE ARG 105 HE ARG 105 11.579 3.293 5.112 868 HH11 ARG 105 HH11 ARG 105 13.287 6.350 5.174 869 HH12 ARG 105 HH12 ARG 105 14.167 5.961 6.611 870 HH21 ARG 105 HH21 ARG 105 12.746 2.798 6.999 871 HH22 ARG 105 HH22 ARG 105 13.863 3.953 7.645 872 H GLN 106 HN GLN 106 9.832 1.265 3.773 873 HA GLN 106 HA GLN 106 12.049 1.090 5.505 874 HB2 GLN 106 HB2 GLN 106 9.231 0.470 5.607 875 HB3 GLN 106 HB1 GLN 106 10.163 -0.785 6.402 876 HG2 GLN 106 HG2 GLN 106 10.121 0.519 8.195 877 HG3 GLN 106 HG1 GLN 106 11.299 1.526 7.357 878 HE21 GLN 106 HE21 GLN 106 9.717 2.661 5.413 879 HE22 GLN 106 HE22 GLN 106 8.550 3.696 6.156 880 H GLY 107 HN GLY 107 10.360 -1.430 3.649 881 HA2 GLY 107 HA2 GLY 107 12.030 -2.993 2.548 882 HA3 GLY 107 HA1 GLY 107 12.643 -3.228 4.177 883 H LEU 108 HN LEU 108 9.530 -2.902 4.800 884 HA LEU 108 HA LEU 108 9.068 -5.648 5.225 885 HB2 LEU 108 HB2 LEU 108 6.911 -3.559 5.055 886 HB3 LEU 108 HB1 LEU 108 6.921 -5.029 6.011 887 HG LEU 108 HG LEU 108 8.594 -2.564 6.495 888 HD11 LEU 108 HD11 LEU 108 7.285 -2.694 8.697 889 HD12 LEU 108 HD12 LEU 108 6.180 -3.750 7.816 890 HD13 LEU 108 HD13 LEU 108 6.448 -2.096 7.266 891 HD21 LEU 108 HD21 LEU 108 8.516 -5.167 8.015 892 HD22 LEU 108 HD22 LEU 108 9.398 -3.717 8.492 893 HD23 LEU 108 HD23 LEU 108 9.855 -4.584 7.027 894 H ALA 109 HN ALA 109 8.747 -3.721 2.434 895 HA ALA 109 HA ALA 109 7.695 -5.956 0.944 896 HB1 ALA 109 HB1 ALA 109 5.615 -4.989 1.656 897 HB2 ALA 109 HB2 ALA 109 5.845 -4.637 -0.056 898 HB3 ALA 109 HB3 ALA 109 6.139 -3.382 1.148 899 H LYS 110 HN LYS 110 7.746 -5.564 -1.398 900 HA LYS 110 HA LYS 110 9.634 -3.421 -2.124 901 HB2 LYS 110 HB2 LYS 110 9.524 -6.214 -3.276 902 HB3 LYS 110 HB1 LYS 110 10.625 -4.938 -3.777 903 HG2 LYS 110 HG2 LYS 110 12.077 -5.681 -2.284 904 HG3 LYS 110 HG1 LYS 110 10.964 -5.175 -1.011 905 HD2 LYS 110 HD2 LYS 110 10.260 -7.287 -0.604 906 HD3 LYS 110 HD1 LYS 110 10.359 -7.759 -2.302 907 HE2 LYS 110 HE2 LYS 110 12.899 -7.658 -1.982 908 HE3 LYS 110 HE1 LYS 110 12.550 -7.640 -0.253 909 HZ1 LYS 110 HZ1 LYS 110 12.932 -9.879 -0.929 910 HZ2 LYS 110 HZ2 LYS 110 11.818 -9.759 -2.197 911 HZ3 LYS 110 HZ3 LYS 110 11.281 -9.723 -0.594 912 H VAL 111 HN VAL 111 9.588 -2.896 -4.491 913 HA VAL 111 HA VAL 111 6.859 -2.461 -5.289 914 HB VAL 111 HB VAL 111 9.487 -1.649 -6.525 915 HG11 VAL 111 HG11 VAL 111 8.181 -1.718 -8.419 916 HG12 VAL 111 HG12 VAL 111 7.873 -0.078 -7.847 917 HG13 VAL 111 HG13 VAL 111 6.696 -1.355 -7.539 918 HG21 VAL 111 HG21 VAL 111 8.899 0.563 -5.774 919 HG22 VAL 111 HG22 VAL 111 8.810 -0.555 -4.412 920 HG23 VAL 111 HG23 VAL 111 7.330 -0.009 -5.203 921 H ALA 112 HN ALA 112 5.802 -4.133 -6.178 922 HA ALA 112 HA ALA 112 6.955 -5.377 -8.555 923 HB1 ALA 112 HB1 ALA 112 6.578 -7.607 -7.848 924 HB2 ALA 112 HB2 ALA 112 5.724 -7.076 -6.398 925 HB3 ALA 112 HB3 ALA 112 7.462 -6.811 -6.546 926 H TYR 113 HN TYR 113 5.307 -6.712 -9.730 927 HA TYR 113 HA TYR 113 3.331 -6.823 -10.846 928 HB2 TYR 113 HB2 TYR 113 2.386 -6.418 -8.017 929 HB3 TYR 113 HB1 TYR 113 1.250 -6.608 -9.349 930 HD1 TYR 113 HD2 TYR 113 3.990 -8.280 -7.504 931 HD2 TYR 113 HD1 TYR 113 0.772 -8.745 -10.249 932 HE1 TYR 113 HE2 TYR 113 4.193 -10.723 -7.320 933 HE2 TYR 113 HE1 TYR 113 0.967 -11.190 -10.071 934 HH TYR 113 HH TYR 113 2.588 -12.868 -9.451 935 H VAL 114 HN VAL 114 4.601 -4.414 -11.147 936 HA VAL 114 HA VAL 114 2.509 -2.373 -10.895 937 HB VAL 114 HB VAL 114 4.732 -1.747 -10.067 938 HG11 VAL 114 HG11 VAL 114 5.702 -3.157 -12.212 939 HG12 VAL 114 HG12 VAL 114 6.645 -2.095 -11.168 940 HG13 VAL 114 HG13 VAL 114 5.988 -1.482 -12.686 941 HG21 VAL 114 HG21 VAL 114 4.346 -0.140 -12.557 942 HG22 VAL 114 HG22 VAL 114 4.720 0.399 -10.920 943 HG23 VAL 114 HG23 VAL 114 3.093 -0.156 -11.315 944 H TYR 115 HN TYR 115 1.136 -2.412 -12.568 945 HA TYR 115 HA TYR 115 2.283 -2.590 -15.276 946 HB2 TYR 115 HB2 TYR 115 -0.175 -3.834 -14.110 947 HB3 TYR 115 HB1 TYR 115 -0.146 -3.424 -15.823 948 HD1 TYR 115 HD2 TYR 115 2.263 -4.162 -16.933 949 HD2 TYR 115 HD1 TYR 115 0.303 -6.032 -13.652 950 HE1 TYR 115 HE2 TYR 115 3.462 -6.256 -17.416 951 HE2 TYR 115 HE1 TYR 115 1.497 -8.128 -14.120 952 HH TYR 115 HH TYR 115 2.637 -9.237 -15.912 953 H LYS 116 HN LYS 116 1.407 -1.300 -16.882 954 HA LYS 116 HA LYS 116 0.286 1.196 -15.944 955 HB2 LYS 116 HB2 LYS 116 0.573 1.845 -18.375 956 HB3 LYS 116 HB1 LYS 116 2.048 1.399 -17.526 957 HG2 LYS 116 HG2 LYS 116 0.725 -0.845 -18.834 958 HG3 LYS 116 HG1 LYS 116 1.249 0.422 -19.948 959 HD2 LYS 116 HD2 LYS 116 3.503 0.321 -18.834 960 HD3 LYS 116 HD1 LYS 116 2.936 -1.108 -17.973 961 HE2 LYS 116 HE2 LYS 116 2.388 -2.071 -20.266 962 HE3 LYS 116 HE1 LYS 116 3.348 -0.748 -20.928 963 HZ1 LYS 116 HZ1 LYS 116 5.271 -1.540 -19.844 964 HZ2 LYS 116 HZ2 LYS 116 4.560 -2.893 -20.567 965 HZ3 LYS 116 HZ3 LYS 116 4.396 -2.641 -18.903 966 HA PRO 117 HA PRO 117 -0.624 2.963 -17.409 967 HB2 PRO 117 HB2 PRO 117 -3.218 4.028 -16.621 968 HB3 PRO 117 HB1 PRO 117 -2.271 4.371 -18.070 969 HG2 PRO 117 HG2 PRO 117 -4.606 2.990 -18.131 970 HG3 PRO 117 HG1 PRO 117 -3.291 2.718 -19.290 971 HD2 PRO 117 HD2 PRO 117 -4.030 1.136 -16.853 972 HD3 PRO 117 HD1 PRO 117 -3.534 0.563 -18.462 973 H ASN 118 HN ASN 118 -2.120 1.052 -15.084 974 HA ASN 118 HA ASN 118 -2.315 2.702 -12.853 975 HB2 ASN 118 HB2 ASN 118 -1.329 -0.116 -12.566 976 HB3 ASN 118 HB1 ASN 118 -2.458 0.777 -11.557 977 HD21 ASN 118 HD21 ASN 118 -2.064 -0.890 -14.625 978 HD22 ASN 118 HD22 ASN 118 -3.745 -1.212 -14.871 979 H ASN 119 HN ASN 119 -0.760 4.041 -12.211 980 HA ASN 119 HA ASN 119 1.580 3.146 -10.992 981 HB2 ASN 119 HB2 ASN 119 3.180 4.279 -12.735 982 HB3 ASN 119 HB1 ASN 119 2.665 2.612 -12.967 983 HD21 ASN 119 HD21 ASN 119 2.113 2.161 -14.966 984 HD22 ASN 119 HD22 ASN 119 1.395 3.251 -16.097 985 H THR 120 HN THR 120 -0.545 5.034 -10.572 986 HA THR 120 HA THR 120 0.172 7.694 -10.972 987 HB THR 120 HB THR 120 -1.091 7.558 -8.449 988 HG1 THR 120 HG1 THR 120 -1.784 5.553 -8.533 989 HG21 THR 120 HG21 THR 120 -3.067 7.713 -10.456 990 HG22 THR 120 HG22 THR 120 -1.643 8.575 -11.037 991 HG23 THR 120 HG23 THR 120 -2.370 9.017 -9.493 992 H HIS 121 HN HIS 121 1.069 5.470 -8.362 993 HA HIS 121 HA HIS 121 2.905 7.520 -7.336 994 HB2 HIS 121 HB2 HIS 121 2.737 6.572 -5.206 995 HB3 HIS 121 HB1 HIS 121 1.097 6.481 -5.829 996 HD1 HIS 121 HD1 HIS 121 2.281 3.818 -7.575 997 HD2 HIS 121 HD2 HIS 121 1.863 4.437 -3.488 998 HE1 HIS 121 HE1 HIS 121 2.230 1.529 -6.546 999 HE2 HIS 121 HE2 HIS 121 2.063 1.925 -4.069 1000 H GLU 122 HN GLU 122 3.235 5.484 -9.599 1001 HA GLU 122 HA GLU 122 5.127 3.557 -8.804 1002 HB2 GLU 122 HB2 GLU 122 3.918 3.417 -10.925 1003 HB3 GLU 122 HB1 GLU 122 4.726 4.868 -11.499 1004 HG2 GLU 122 HG2 GLU 122 6.869 3.375 -10.923 1005 HG3 GLU 122 HG1 GLU 122 5.714 2.098 -11.294 1006 H GLN 123 HN GLN 123 5.586 6.740 -10.344 1007 HA GLN 123 HA GLN 123 8.351 6.764 -10.446 1008 HB2 GLN 123 HB2 GLN 123 6.420 9.045 -10.007 1009 HB3 GLN 123 HB1 GLN 123 8.132 9.268 -10.341 1010 HG2 GLN 123 HG2 GLN 123 6.429 7.656 -12.191 1011 HG3 GLN 123 HG1 GLN 123 6.425 9.417 -12.272 1012 HE21 GLN 123 HE21 GLN 123 8.472 6.567 -12.458 1013 HE22 GLN 123 HE22 GLN 123 9.692 7.278 -13.453 1014 H LEU 124 HN LEU 124 6.249 7.185 -7.715 1015 HA LEU 124 HA LEU 124 8.306 8.270 -6.004 1016 HB2 LEU 124 HB2 LEU 124 6.006 8.930 -5.630 1017 HB3 LEU 124 HB1 LEU 124 5.523 7.257 -5.425 1018 HG LEU 124 HG LEU 124 7.249 7.317 -3.441 1019 HD11 LEU 124 HD11 LEU 124 7.643 9.844 -4.271 1020 HD12 LEU 124 HD12 LEU 124 7.867 9.315 -2.605 1021 HD13 LEU 124 HD13 LEU 124 6.365 10.104 -3.085 1022 HD21 LEU 124 HD21 LEU 124 5.397 8.083 -1.949 1023 HD22 LEU 124 HD22 LEU 124 4.934 6.835 -3.106 1024 HD23 LEU 124 HD23 LEU 124 4.486 8.516 -3.396 1025 H LEU 125 HN LEU 125 6.798 5.167 -6.632 1026 HA LEU 125 HA LEU 125 8.130 3.829 -4.462 1027 HB2 LEU 125 HB2 LEU 125 6.256 3.084 -6.630 1028 HB3 LEU 125 HB1 LEU 125 7.296 1.808 -6.032 1029 HG LEU 125 HG LEU 125 6.452 2.483 -3.692 1030 HD11 LEU 125 HD11 LEU 125 4.257 3.514 -3.643 1031 HD12 LEU 125 HD12 LEU 125 4.301 3.719 -5.394 1032 HD13 LEU 125 HD13 LEU 125 5.440 4.598 -4.376 1033 HD21 LEU 125 HD21 LEU 125 5.348 0.784 -5.744 1034 HD22 LEU 125 HD22 LEU 125 4.084 1.357 -4.655 1035 HD23 LEU 125 HD23 LEU 125 5.485 0.505 -4.008 1036 H ARG 126 HN ARG 126 8.739 4.423 -7.843 1037 HA ARG 126 HA ARG 126 10.593 2.422 -8.400 1038 HB2 ARG 126 HB2 ARG 126 9.556 4.452 -9.827 1039 HB3 ARG 126 HB1 ARG 126 11.148 5.123 -9.496 1040 HG2 ARG 126 HG2 ARG 126 12.169 3.726 -10.914 1041 HG3 ARG 126 HG1 ARG 126 11.184 2.347 -10.422 1042 HD2 ARG 126 HD2 ARG 126 9.780 4.446 -11.940 1043 HD3 ARG 126 HD1 ARG 126 11.010 3.553 -12.834 1044 HE ARG 126 HE ARG 126 8.475 2.559 -11.892 1045 HH11 ARG 126 HH11 ARG 126 11.695 1.702 -12.934 1046 HH12 ARG 126 HH12 ARG 126 11.254 0.090 -13.388 1047 HH21 ARG 126 HH21 ARG 126 7.894 0.439 -12.486 1048 HH22 ARG 126 HH22 ARG 126 9.097 -0.627 -13.132 1049 H LYS 127 HN LYS 127 11.034 5.559 -6.843 1050 HA LYS 127 HA LYS 127 13.884 5.220 -6.580 1051 HB2 LYS 127 HB2 LYS 127 12.280 7.221 -5.022 1052 HB3 LYS 127 HB1 LYS 127 13.926 7.352 -5.622 1053 HG2 LYS 127 HG2 LYS 127 11.444 7.382 -7.326 1054 HG3 LYS 127 HG1 LYS 127 12.373 8.799 -6.837 1055 HD2 LYS 127 HD2 LYS 127 14.097 6.819 -8.022 1056 HD3 LYS 127 HD1 LYS 127 12.762 7.208 -9.108 1057 HE2 LYS 127 HE2 LYS 127 14.393 9.337 -7.756 1058 HE3 LYS 127 HE1 LYS 127 14.880 8.622 -9.292 1059 HZ1 LYS 127 HZ1 LYS 127 12.134 9.552 -9.149 1060 HZ2 LYS 127 HZ2 LYS 127 13.259 9.689 -10.402 1061 HZ3 LYS 127 HZ3 LYS 127 13.316 10.762 -9.096 1062 H SER 128 HN SER 128 11.124 5.278 -4.334 1063 HA SER 128 HA SER 128 12.458 4.788 -1.970 1064 HB2 SER 128 HB2 SER 128 10.218 5.300 -1.680 1065 HB3 SER 128 HB1 SER 128 9.691 4.187 -2.941 1066 HG SER 128 HG SER 128 10.893 3.208 -0.591 1067 H GLU 129 HN GLU 129 11.605 2.535 -4.511 1068 HA GLU 129 HA GLU 129 12.097 0.174 -2.991 1069 HB2 GLU 129 HB2 GLU 129 10.675 -0.027 -4.887 1070 HB3 GLU 129 HB1 GLU 129 11.866 0.711 -5.949 1071 HG2 GLU 129 HG2 GLU 129 12.944 -1.645 -4.706 1072 HG3 GLU 129 HG1 GLU 129 11.417 -2.006 -5.509 1073 H ALA 130 HN ALA 130 13.939 1.552 -5.720 1074 HA ALA 130 HA ALA 130 16.201 -0.052 -5.399 1075 HB1 ALA 130 HB1 ALA 130 16.957 1.021 -7.205 1076 HB2 ALA 130 HB2 ALA 130 16.769 2.608 -6.456 1077 HB3 ALA 130 HB3 ALA 130 15.383 1.819 -7.213 1078 H GLN 131 HN GLN 131 15.261 2.836 -3.697 1079 HA GLN 131 HA GLN 131 17.803 3.650 -2.818 1080 HB2 GLN 131 HB2 GLN 131 15.107 4.434 -2.373 1081 HB3 GLN 131 HB1 GLN 131 15.869 4.246 -0.807 1082 HG2 GLN 131 HG2 GLN 131 17.182 6.020 -1.095 1083 HG3 GLN 131 HG1 GLN 131 17.443 5.703 -2.806 1084 HE21 GLN 131 HE21 GLN 131 15.961 6.503 -4.310 1085 HE22 GLN 131 HE22 GLN 131 14.846 7.761 -3.913 1086 H ALA 132 HN ALA 132 15.319 1.772 -1.087 1087 HA ALA 132 HA ALA 132 17.115 1.135 1.052 1088 HB1 ALA 132 HB1 ALA 132 14.301 0.392 0.379 1089 HB2 ALA 132 HB2 ALA 132 14.923 1.291 1.762 1090 HB3 ALA 132 HB3 ALA 132 15.164 -0.453 1.664 1091 H LYS 133 HN LYS 133 16.284 -0.350 -1.966 1092 HA LYS 133 HA LYS 133 16.881 -3.028 -1.377 1093 HB2 LYS 133 HB2 LYS 133 16.095 -1.595 -3.621 1094 HB3 LYS 133 HB1 LYS 133 17.672 -2.230 -4.064 1095 HG2 LYS 133 HG2 LYS 133 16.874 -4.286 -4.329 1096 HG3 LYS 133 HG1 LYS 133 16.020 -4.237 -2.785 1097 HD2 LYS 133 HD2 LYS 133 14.305 -2.774 -3.978 1098 HD3 LYS 133 HD1 LYS 133 15.079 -3.289 -5.477 1099 HE2 LYS 133 HE2 LYS 133 14.745 -5.682 -4.367 1100 HE3 LYS 133 HE1 LYS 133 13.428 -4.836 -3.553 1101 HZ1 LYS 133 HZ1 LYS 133 12.561 -5.788 -5.524 1102 HZ2 LYS 133 HZ2 LYS 133 13.818 -5.170 -6.473 1103 HZ3 LYS 133 HZ3 LYS 133 12.671 -4.123 -5.803 1104 H LYS 134 HN LYS 134 18.953 -0.520 -2.825 1105 HA LYS 134 HA LYS 134 21.274 -2.030 -3.053 1106 HB2 LYS 134 HB2 LYS 134 21.120 0.077 -4.165 1107 HB3 LYS 134 HB1 LYS 134 20.865 0.931 -2.650 1108 HG2 LYS 134 HG2 LYS 134 23.158 0.340 -1.966 1109 HG3 LYS 134 HG1 LYS 134 23.404 -0.422 -3.538 1110 HD2 LYS 134 HD2 LYS 134 22.718 2.482 -3.081 1111 HD3 LYS 134 HD1 LYS 134 24.322 1.856 -3.468 1112 HE2 LYS 134 HE2 LYS 134 23.482 1.008 -5.598 1113 HE3 LYS 134 HE1 LYS 134 21.870 1.607 -5.209 1114 HZ1 LYS 134 HZ1 LYS 134 22.715 3.851 -5.218 1115 HZ2 LYS 134 HZ2 LYS 134 23.094 3.103 -6.687 1116 HZ3 LYS 134 HZ3 LYS 134 24.290 3.304 -5.508 1117 H GLU 135 HN GLU 135 19.940 -0.391 -0.259 1118 HA GLU 135 HA GLU 135 22.338 -1.083 1.293 1119 HB2 GLU 135 HB2 GLU 135 20.486 0.386 2.882 1120 HB3 GLU 135 HB1 GLU 135 22.071 0.883 2.306 1121 HG2 GLU 135 HG2 GLU 135 21.069 1.733 0.252 1122 HG3 GLU 135 HG1 GLU 135 19.478 1.214 0.810 1123 H LYS 136 HN LYS 136 19.422 -2.452 0.586 1124 HA LYS 136 HA LYS 136 17.967 -3.852 1.673 1125 HB2 LYS 136 HB2 LYS 136 20.607 -4.749 2.843 1126 HB3 LYS 136 HB1 LYS 136 19.123 -5.694 2.857 1127 HG2 LYS 136 HG2 LYS 136 19.159 -5.473 0.319 1128 HG3 LYS 136 HG1 LYS 136 20.823 -4.919 0.513 1129 HD2 LYS 136 HD2 LYS 136 21.223 -7.148 0.263 1130 HD3 LYS 136 HD1 LYS 136 20.956 -7.121 2.007 1131 HE2 LYS 136 HE2 LYS 136 18.998 -8.232 1.856 1132 HE3 LYS 136 HE1 LYS 136 18.533 -7.420 0.361 1133 HZ1 LYS 136 HZ1 LYS 136 20.514 -8.913 -0.539 1134 HZ2 LYS 136 HZ2 LYS 136 18.920 -9.473 -0.464 1135 HZ3 LYS 136 HZ3 LYS 136 20.022 -9.897 0.747 1136 H LEU 137 HN LEU 137 17.282 -1.813 2.816 1137 HA LEU 137 HA LEU 137 18.046 -1.059 5.331 1138 HB2 LEU 137 HB2 LEU 137 15.545 -0.817 3.761 1139 HB3 LEU 137 HB1 LEU 137 15.432 -0.484 5.480 1140 HG LEU 137 HG LEU 137 17.179 0.927 3.468 1141 HD11 LEU 137 HD11 LEU 137 15.542 2.640 5.046 1142 HD12 LEU 137 HD12 LEU 137 14.531 1.361 4.374 1143 HD13 LEU 137 HD13 LEU 137 15.504 2.370 3.304 1144 HD21 LEU 137 HD21 LEU 137 17.166 1.004 6.464 1145 HD22 LEU 137 HD22 LEU 137 17.659 2.409 5.519 1146 HD23 LEU 137 HD23 LEU 137 18.536 0.886 5.359 1147 H ASN 138 HN ASN 138 14.788 -2.357 5.337 1148 HA ASN 138 HA ASN 138 15.296 -3.627 7.854 1149 HB2 ASN 138 HB2 ASN 138 12.811 -3.481 6.145 1150 HB3 ASN 138 HB1 ASN 138 12.867 -4.220 7.742 1151 HD21 ASN 138 HD21 ASN 138 11.124 -2.242 7.357 1152 HD22 ASN 138 HD22 ASN 138 11.636 -0.794 8.149 1153 H ILE 139 HN ILE 139 13.058 -5.434 6.002 1154 HA ILE 139 HA ILE 139 14.828 -7.742 6.152 1155 HB ILE 139 HB ILE 139 12.748 -9.032 5.569 1156 HG12 ILE 139 HG12 ILE 139 11.386 -6.376 6.066 1157 HG13 ILE 139 HG11 ILE 139 11.576 -7.112 4.479 1158 HG21 ILE 139 HG21 ILE 139 13.236 -7.472 8.020 1159 HG22 ILE 139 HG22 ILE 139 13.069 -9.213 7.794 1160 HG23 ILE 139 HG23 ILE 139 11.634 -8.192 7.870 1161 HD11 ILE 139 HD11 ILE 139 9.772 -7.838 6.708 1162 HD12 ILE 139 HD12 ILE 139 10.387 -9.139 5.689 1163 HD13 ILE 139 HD13 ILE 139 9.478 -7.809 4.970 1164 H TRP 140 HN TRP 140 15.903 -6.375 4.244 1165 HA TRP 140 HA TRP 140 14.713 -7.032 1.670 1166 HB2 TRP 140 HB2 TRP 140 17.237 -5.527 2.378 1167 HB3 TRP 140 HB1 TRP 140 16.637 -5.760 0.737 1168 HD1 TRP 140 HD1 TRP 140 15.723 -3.973 4.016 1169 HE1 TRP 140 HE1 TRP 140 14.151 -2.015 3.456 1170 HE3 TRP 140 HE3 TRP 140 15.052 -4.873 -0.967 1171 HZ2 TRP 140 HZ2 TRP 140 12.813 -0.987 1.209 1172 HZ3 TRP 140 HZ3 TRP 140 13.604 -3.353 -2.252 1173 HH2 TRP 140 HH2 TRP 140 12.506 -1.450 -1.188 Start of MODEL 20 1 H1 ALA 1 HT1 ALA 1 -6.936 11.691 -29.022 2 H2 ALA 1 HT2 ALA 1 -6.001 11.789 -27.587 3 H3 ALA 1 HT3 ALA 1 -7.586 12.445 -27.627 4 HA ALA 1 HA ALA 1 -8.585 10.424 -27.636 5 HB1 ALA 1 HB1 ALA 1 -7.768 8.540 -28.573 6 HB2 ALA 1 HB2 ALA 1 -6.147 8.792 -27.926 7 HB3 ALA 1 HB3 ALA 1 -6.668 9.671 -29.363 8 H THR 2 HN THR 2 -5.212 10.303 -26.471 9 HA THR 2 HA THR 2 -5.842 8.966 -24.064 10 HB THR 2 HB THR 2 -3.594 8.885 -24.932 11 HG1 THR 2 HG1 THR 2 -3.554 10.451 -22.572 12 HG21 THR 2 HG21 THR 2 -3.306 10.935 -26.066 13 HG22 THR 2 HG22 THR 2 -2.119 10.903 -24.762 14 HG23 THR 2 HG23 THR 2 -3.587 11.867 -24.596 15 H SER 3 HN SER 3 -6.016 9.732 -21.949 16 HA SER 3 HA SER 3 -7.151 12.389 -21.737 17 HB2 SER 3 HB2 SER 3 -7.383 11.575 -19.253 18 HB3 SER 3 HB1 SER 3 -8.418 10.882 -20.502 19 HG SER 3 HG SER 3 -6.079 9.763 -19.360 20 H THR 4 HN THR 4 -6.570 13.485 -19.481 21 HA THR 4 HA THR 4 -3.824 13.316 -18.695 22 HB THR 4 HB THR 4 -4.629 15.874 -20.075 23 HG1 THR 4 HG1 THR 4 -3.636 15.168 -21.879 24 HG21 THR 4 HG21 THR 4 -2.055 15.977 -20.267 25 HG22 THR 4 HG22 THR 4 -2.082 14.818 -18.939 26 HG23 THR 4 HG23 THR 4 -2.829 16.403 -18.741 27 H LYS 5 HN LYS 5 -6.729 15.344 -18.793 28 HA LYS 5 HA LYS 5 -6.242 16.853 -16.499 29 HB2 LYS 5 HB2 LYS 5 -8.887 15.934 -17.638 30 HB3 LYS 5 HB1 LYS 5 -8.694 17.201 -16.432 31 HG2 LYS 5 HG2 LYS 5 -7.020 18.056 -18.404 32 HG3 LYS 5 HG1 LYS 5 -8.307 17.281 -19.328 33 HD2 LYS 5 HD2 LYS 5 -9.603 18.765 -17.339 34 HD3 LYS 5 HD1 LYS 5 -8.310 19.807 -17.936 35 HE2 LYS 5 HE2 LYS 5 -9.262 18.873 -20.270 36 HE3 LYS 5 HE1 LYS 5 -10.733 18.805 -19.299 37 HZ1 LYS 5 HZ1 LYS 5 -9.136 21.255 -19.197 38 HZ2 LYS 5 HZ2 LYS 5 -10.813 21.054 -19.094 39 HZ3 LYS 5 HZ3 LYS 5 -10.042 20.965 -20.597 40 H LYS 6 HN LYS 6 -5.870 16.149 -14.511 41 HA LYS 6 HA LYS 6 -6.642 13.544 -13.624 42 HB2 LYS 6 HB2 LYS 6 -4.592 14.939 -12.911 43 HB3 LYS 6 HB1 LYS 6 -5.702 15.762 -11.823 44 HG2 LYS 6 HG2 LYS 6 -5.277 14.173 -10.338 45 HG3 LYS 6 HG1 LYS 6 -6.168 13.060 -11.377 46 HD2 LYS 6 HD2 LYS 6 -4.027 12.094 -10.909 47 HD3 LYS 6 HD1 LYS 6 -4.039 12.607 -12.597 48 HE2 LYS 6 HE2 LYS 6 -1.947 13.267 -11.694 49 HE3 LYS 6 HE1 LYS 6 -2.919 14.729 -11.851 50 HZ1 LYS 6 HZ1 LYS 6 -1.852 14.770 -9.743 51 HZ2 LYS 6 HZ2 LYS 6 -2.368 13.205 -9.366 52 HZ3 LYS 6 HZ3 LYS 6 -3.493 14.465 -9.463 53 H LEU 7 HN LEU 7 -8.093 13.009 -11.945 54 HA LEU 7 HA LEU 7 -10.389 14.789 -11.825 55 HB2 LEU 7 HB2 LEU 7 -9.913 11.911 -11.455 56 HB3 LEU 7 HB1 LEU 7 -11.098 12.598 -10.359 57 HG LEU 7 HG LEU 7 -11.418 13.291 -13.219 58 HD11 LEU 7 HD11 LEU 7 -11.880 10.516 -12.147 59 HD12 LEU 7 HD12 LEU 7 -10.852 10.989 -13.499 60 HD13 LEU 7 HD13 LEU 7 -12.605 11.137 -13.630 61 HD21 LEU 7 HD21 LEU 7 -13.573 13.608 -12.628 62 HD22 LEU 7 HD22 LEU 7 -12.889 13.704 -11.004 63 HD23 LEU 7 HD23 LEU 7 -13.604 12.195 -11.573 64 H HIS 8 HN HIS 8 -9.488 12.625 -9.192 65 HA HIS 8 HA HIS 8 -8.277 14.325 -7.418 66 HB2 HIS 8 HB2 HIS 8 -10.312 15.739 -7.663 67 HB3 HIS 8 HB1 HIS 8 -11.279 14.414 -7.035 68 HD1 HIS 8 HD1 HIS 8 -8.372 16.605 -5.936 69 HD2 HIS 8 HD2 HIS 8 -11.569 14.483 -4.340 70 HE1 HIS 8 HE1 HIS 8 -8.378 17.146 -3.480 71 HE2 HIS 8 HE2 HIS 8 -10.272 15.787 -2.521 72 H LYS 9 HN LYS 9 -8.492 13.574 -5.142 73 HA LYS 9 HA LYS 9 -9.203 10.717 -5.101 74 HB2 LYS 9 HB2 LYS 9 -6.979 12.190 -3.699 75 HB3 LYS 9 HB1 LYS 9 -7.455 10.553 -3.275 76 HG2 LYS 9 HG2 LYS 9 -5.644 10.279 -4.713 77 HG3 LYS 9 HG1 LYS 9 -7.056 9.981 -5.727 78 HD2 LYS 9 HD2 LYS 9 -6.918 12.371 -6.475 79 HD3 LYS 9 HD1 LYS 9 -5.390 12.493 -5.600 80 HE2 LYS 9 HE2 LYS 9 -5.218 10.183 -7.194 81 HE3 LYS 9 HE1 LYS 9 -5.923 11.441 -8.210 82 HZ1 LYS 9 HZ1 LYS 9 -3.511 11.963 -6.587 83 HZ2 LYS 9 HZ2 LYS 9 -4.069 12.794 -7.950 84 HZ3 LYS 9 HZ3 LYS 9 -3.396 11.252 -8.118 85 H GLU 10 HN GLU 10 -9.774 9.844 -2.959 86 HA GLU 10 HA GLU 10 -11.056 11.839 -1.219 87 HB2 GLU 10 HB2 GLU 10 -12.474 10.273 -2.956 88 HB3 GLU 10 HB1 GLU 10 -12.512 9.298 -1.494 89 HG2 GLU 10 HG2 GLU 10 -13.791 10.793 -0.358 90 HG3 GLU 10 HG1 GLU 10 -13.157 12.179 -1.243 91 HA PRO 11 HA PRO 11 -9.218 9.414 2.000 92 HB2 PRO 11 HB2 PRO 11 -10.467 10.436 4.134 93 HB3 PRO 11 HB1 PRO 11 -9.348 11.411 3.172 94 HG2 PRO 11 HG2 PRO 11 -12.338 11.380 3.148 95 HG3 PRO 11 HG1 PRO 11 -11.230 12.760 3.052 96 HD2 PRO 11 HD2 PRO 11 -12.475 11.595 0.882 97 HD3 PRO 11 HD1 PRO 11 -10.982 12.548 0.794 98 H ALA 12 HN ALA 12 -9.939 8.118 4.010 99 HA ALA 12 HA ALA 12 -12.584 7.063 4.030 100 HB1 ALA 12 HB1 ALA 12 -10.440 5.596 2.600 101 HB2 ALA 12 HB2 ALA 12 -12.171 5.671 2.275 102 HB3 ALA 12 HB3 ALA 12 -11.562 4.660 3.585 103 H THR 13 HN THR 13 -12.617 4.997 5.484 104 HA THR 13 HA THR 13 -10.634 5.311 7.637 105 HB THR 13 HB THR 13 -13.559 4.728 8.103 106 HG1 THR 13 HG1 THR 13 -13.811 6.877 8.582 107 HG21 THR 13 HG21 THR 13 -12.279 6.060 10.256 108 HG22 THR 13 HG22 THR 13 -11.310 4.657 9.805 109 HG23 THR 13 HG23 THR 13 -13.013 4.456 10.221 110 H LEU 14 HN LEU 14 -9.711 3.468 8.306 111 HA LEU 14 HA LEU 14 -10.054 1.061 6.942 112 HB2 LEU 14 HB2 LEU 14 -8.329 2.058 8.909 113 HB3 LEU 14 HB1 LEU 14 -9.058 0.632 9.625 114 HG LEU 14 HG LEU 14 -6.884 0.237 8.440 115 HD11 LEU 14 HD11 LEU 14 -7.975 -1.736 8.760 116 HD12 LEU 14 HD12 LEU 14 -7.969 -1.692 6.997 117 HD13 LEU 14 HD13 LEU 14 -9.416 -1.212 7.886 118 HD21 LEU 14 HD21 LEU 14 -8.206 1.652 6.370 119 HD22 LEU 14 HD22 LEU 14 -7.912 0.008 5.799 120 HD23 LEU 14 HD23 LEU 14 -6.569 0.993 6.380 121 H ILE 15 HN ILE 15 -11.891 -0.070 6.907 122 HA ILE 15 HA ILE 15 -13.744 -0.118 9.078 123 HB ILE 15 HB ILE 15 -13.613 -2.004 6.721 124 HG12 ILE 15 HG12 ILE 15 -13.686 0.368 6.017 125 HG13 ILE 15 HG11 ILE 15 -15.161 -0.496 5.599 126 HG21 ILE 15 HG21 ILE 15 -15.912 -1.236 8.514 127 HG22 ILE 15 HG22 ILE 15 -15.038 -2.768 8.556 128 HG23 ILE 15 HG23 ILE 15 -15.991 -2.334 7.136 129 HD11 ILE 15 HD11 ILE 15 -14.722 1.676 7.565 130 HD12 ILE 15 HD12 ILE 15 -15.963 0.473 7.916 131 HD13 ILE 15 HD13 ILE 15 -16.049 1.420 6.431 132 H LYS 16 HN LYS 16 -11.262 -2.290 7.843 133 HA LYS 16 HA LYS 16 -10.829 -3.469 10.377 134 HB2 LYS 16 HB2 LYS 16 -12.776 -4.750 8.628 135 HB3 LYS 16 HB1 LYS 16 -11.449 -5.827 9.042 136 HG2 LYS 16 HG2 LYS 16 -12.304 -4.467 11.399 137 HG3 LYS 16 HG1 LYS 16 -13.709 -5.160 10.586 138 HD2 LYS 16 HD2 LYS 16 -12.319 -7.306 10.418 139 HD3 LYS 16 HD1 LYS 16 -11.255 -6.557 11.610 140 HE2 LYS 16 HE2 LYS 16 -12.879 -7.995 12.703 141 HE3 LYS 16 HE1 LYS 16 -13.153 -6.309 13.139 142 HZ1 LYS 16 HZ1 LYS 16 -15.094 -7.916 12.360 143 HZ2 LYS 16 HZ2 LYS 16 -14.632 -7.325 10.844 144 HZ3 LYS 16 HZ3 LYS 16 -15.119 -6.251 12.056 145 H ALA 17 HN ALA 17 -8.768 -4.093 10.441 146 HA ALA 17 HA ALA 17 -7.208 -4.065 8.042 147 HB1 ALA 17 HB1 ALA 17 -6.187 -3.085 9.930 148 HB2 ALA 17 HB2 ALA 17 -5.319 -4.592 9.638 149 HB3 ALA 17 HB3 ALA 17 -6.513 -4.498 10.933 150 H ILE 18 HN ILE 18 -6.716 -5.747 6.800 151 HA ILE 18 HA ILE 18 -7.460 -8.425 7.659 152 HB ILE 18 HB ILE 18 -6.150 -7.874 5.026 153 HG12 ILE 18 HG12 ILE 18 -8.235 -6.292 5.765 154 HG13 ILE 18 HG11 ILE 18 -7.890 -6.755 4.108 155 HG21 ILE 18 HG21 ILE 18 -7.749 -9.653 4.309 156 HG22 ILE 18 HG22 ILE 18 -8.229 -9.816 5.998 157 HG23 ILE 18 HG23 ILE 18 -6.567 -10.160 5.516 158 HD11 ILE 18 HD11 ILE 18 -9.633 -8.248 4.027 159 HD12 ILE 18 HD12 ILE 18 -10.289 -6.994 5.079 160 HD13 ILE 18 HD13 ILE 18 -9.655 -8.485 5.774 161 H ASP 19 HN ASP 19 -4.621 -7.219 5.882 162 HA ASP 19 HA ASP 19 -2.850 -8.448 7.837 163 HB2 ASP 19 HB2 ASP 19 -3.221 -9.488 5.056 164 HB3 ASP 19 HB1 ASP 19 -1.619 -9.551 5.785 165 H GLY 20 HN GLY 20 -1.693 -7.939 4.602 166 HA2 GLY 20 HA2 GLY 20 -0.563 -5.341 5.439 167 HA3 GLY 20 HA1 GLY 20 0.399 -6.554 4.603 168 H ASP 21 HN ASP 21 -0.362 -7.197 2.429 169 HA ASP 21 HA ASP 21 -0.806 -4.926 0.812 170 HB2 ASP 21 HB2 ASP 21 -0.925 -6.542 -1.052 171 HB3 ASP 21 HB1 ASP 21 0.465 -6.835 -0.010 172 H THR 22 HN THR 22 -2.948 -6.833 2.593 173 HA THR 22 HA THR 22 -5.212 -5.849 0.990 174 HB THR 22 HB THR 22 -5.614 -8.268 2.659 175 HG1 THR 22 HG1 THR 22 -4.431 -9.560 1.481 176 HG21 THR 22 HG21 THR 22 -7.519 -8.001 1.506 177 HG22 THR 22 HG22 THR 22 -6.630 -8.856 0.245 178 HG23 THR 22 HG23 THR 22 -6.737 -7.096 0.210 179 H VAL 23 HN VAL 23 -6.655 -4.651 2.060 180 HA VAL 23 HA VAL 23 -7.064 -4.934 4.909 181 HB VAL 23 HB VAL 23 -6.653 -2.520 5.368 182 HG11 VAL 23 HG11 VAL 23 -4.220 -4.031 4.422 183 HG12 VAL 23 HG12 VAL 23 -5.023 -4.265 5.976 184 HG13 VAL 23 HG13 VAL 23 -4.251 -2.723 5.605 185 HG21 VAL 23 HG21 VAL 23 -5.547 -2.617 2.575 186 HG22 VAL 23 HG22 VAL 23 -5.043 -1.396 3.743 187 HG23 VAL 23 HG23 VAL 23 -6.734 -1.502 3.251 188 H LYS 24 HN LYS 24 -9.018 -4.049 5.610 189 HA LYS 24 HA LYS 24 -10.884 -3.418 3.475 190 HB2 LYS 24 HB2 LYS 24 -11.412 -5.033 5.350 191 HB3 LYS 24 HB1 LYS 24 -11.472 -3.647 6.428 192 HG2 LYS 24 HG2 LYS 24 -13.697 -4.097 5.849 193 HG3 LYS 24 HG1 LYS 24 -13.235 -2.692 4.889 194 HD2 LYS 24 HD2 LYS 24 -14.493 -4.304 3.553 195 HD3 LYS 24 HD1 LYS 24 -12.842 -4.133 2.957 196 HE2 LYS 24 HE2 LYS 24 -13.175 -6.233 4.969 197 HE3 LYS 24 HE1 LYS 24 -14.097 -6.504 3.491 198 HZ1 LYS 24 HZ1 LYS 24 -12.202 -6.629 2.225 199 HZ2 LYS 24 HZ2 LYS 24 -11.665 -7.334 3.666 200 HZ3 LYS 24 HZ3 LYS 24 -11.264 -5.730 3.311 201 H LEU 25 HN LEU 25 -11.682 -1.436 3.043 202 HA LEU 25 HA LEU 25 -11.204 0.706 4.997 203 HB2 LEU 25 HB2 LEU 25 -10.010 0.422 2.414 204 HB3 LEU 25 HB1 LEU 25 -11.051 1.832 2.405 205 HG LEU 25 HG LEU 25 -9.611 2.040 4.790 206 HD11 LEU 25 HD11 LEU 25 -7.698 1.392 2.563 207 HD12 LEU 25 HD12 LEU 25 -8.134 0.249 3.832 208 HD13 LEU 25 HD13 LEU 25 -7.321 1.759 4.246 209 HD21 LEU 25 HD21 LEU 25 -9.533 4.103 3.979 210 HD22 LEU 25 HD22 LEU 25 -10.075 3.517 2.407 211 HD23 LEU 25 HD23 LEU 25 -8.352 3.592 2.773 212 H MET 26 HN MET 26 -12.597 2.567 4.769 213 HA MET 26 HA MET 26 -15.277 1.780 3.998 214 HB2 MET 26 HB2 MET 26 -14.575 3.065 6.138 215 HB3 MET 26 HB1 MET 26 -14.525 4.475 5.090 216 HG2 MET 26 HG2 MET 26 -16.773 4.570 4.870 217 HG3 MET 26 HG1 MET 26 -16.969 2.822 4.972 218 HE1 MET 26 HE1 MET 26 -18.345 2.069 6.330 219 HE2 MET 26 HE2 MET 26 -19.288 3.329 7.126 220 HE3 MET 26 HE3 MET 26 -18.368 2.175 8.090 221 H TYR 27 HN TYR 27 -16.006 2.104 2.020 222 HA TYR 27 HA TYR 27 -15.204 4.546 0.587 223 HB2 TYR 27 HB2 TYR 27 -14.093 2.415 -0.264 224 HB3 TYR 27 HB1 TYR 27 -15.696 1.900 -0.774 225 HD1 TYR 27 HD1 TYR 27 -13.996 5.211 -0.957 226 HD2 TYR 27 HD2 TYR 27 -15.766 1.986 -3.087 227 HE1 TYR 27 HE1 TYR 27 -13.712 6.455 -3.061 228 HE2 TYR 27 HE2 TYR 27 -15.489 3.217 -5.197 229 HH TYR 27 HH TYR 27 -13.688 5.238 -5.927 230 H LYS 28 HN LYS 28 -16.914 5.787 0.220 231 HA LYS 28 HA LYS 28 -19.035 6.486 -0.184 232 HB2 LYS 28 HB2 LYS 28 -19.152 3.768 -1.484 233 HB3 LYS 28 HB1 LYS 28 -20.446 4.952 -1.591 234 HG2 LYS 28 HG2 LYS 28 -18.959 6.515 -2.704 235 HG3 LYS 28 HG1 LYS 28 -17.625 5.368 -2.555 236 HD2 LYS 28 HD2 LYS 28 -18.278 4.832 -4.663 237 HD3 LYS 28 HD1 LYS 28 -19.397 3.789 -3.782 238 HE2 LYS 28 HE2 LYS 28 -21.118 4.851 -4.696 239 HE3 LYS 28 HE1 LYS 28 -20.570 6.369 -3.986 240 HZ1 LYS 28 HZ1 LYS 28 -20.439 6.955 -6.144 241 HZ2 LYS 28 HZ2 LYS 28 -20.255 5.368 -6.698 242 HZ3 LYS 28 HZ3 LYS 28 -18.928 6.198 -6.057 243 H GLY 29 HN GLY 29 -18.666 5.666 2.371 244 HA2 GLY 29 HA2 GLY 29 -19.816 5.058 4.260 245 HA3 GLY 29 HA1 GLY 29 -21.270 5.169 3.280 246 H GLN 30 HN GLN 30 -18.882 2.976 2.170 247 HA GLN 30 HA GLN 30 -20.204 0.716 3.490 248 HB2 GLN 30 HB2 GLN 30 -20.998 -0.186 1.590 249 HB3 GLN 30 HB1 GLN 30 -20.765 1.405 0.885 250 HG2 GLN 30 HG2 GLN 30 -18.584 0.731 0.046 251 HG3 GLN 30 HG1 GLN 30 -18.779 -0.857 0.788 252 HE21 GLN 30 HE21 GLN 30 -18.840 0.621 -2.056 253 HE22 GLN 30 HE22 GLN 30 -20.011 -0.331 -2.897 254 HA PRO 31 HA PRO 31 -16.079 -0.770 3.870 255 HB2 PRO 31 HB2 PRO 31 -16.494 -3.310 4.495 256 HB3 PRO 31 HB1 PRO 31 -17.151 -2.021 5.518 257 HG2 PRO 31 HG2 PRO 31 -18.546 -3.659 3.430 258 HG3 PRO 31 HG1 PRO 31 -19.087 -3.245 5.069 259 HD2 PRO 31 HD2 PRO 31 -19.846 -1.888 2.791 260 HD3 PRO 31 HD1 PRO 31 -19.846 -1.186 4.421 261 H MET 32 HN MET 32 -14.671 -0.978 2.261 262 HA MET 32 HA MET 32 -15.156 -3.040 0.215 263 HB2 MET 32 HB2 MET 32 -15.120 -0.353 -0.270 264 HB3 MET 32 HB1 MET 32 -13.439 -0.777 -0.562 265 HG2 MET 32 HG2 MET 32 -14.724 -0.854 -2.612 266 HG3 MET 32 HG1 MET 32 -14.133 -2.458 -2.181 267 HE1 MET 32 HE1 MET 32 -17.661 -2.801 -4.006 268 HE2 MET 32 HE2 MET 32 -15.963 -2.424 -4.302 269 HE3 MET 32 HE3 MET 32 -17.108 -1.127 -3.961 270 H THR 33 HN THR 33 -13.330 -4.136 -0.589 271 HA THR 33 HA THR 33 -11.183 -4.346 1.346 272 HB THR 33 HB THR 33 -11.403 -5.941 -1.195 273 HG1 THR 33 HG1 THR 33 -12.769 -7.345 -0.123 274 HG21 THR 33 HG21 THR 33 -9.664 -6.044 1.002 275 HG22 THR 33 HG22 THR 33 -9.801 -7.187 -0.334 276 HG23 THR 33 HG23 THR 33 -10.737 -7.437 1.139 277 H PHE 34 HN PHE 34 -9.498 -3.038 1.181 278 HA PHE 34 HA PHE 34 -8.656 -2.123 -1.472 279 HB2 PHE 34 HB2 PHE 34 -8.399 -1.010 1.285 280 HB3 PHE 34 HB1 PHE 34 -7.170 -0.592 0.097 281 HD1 PHE 34 HD1 PHE 34 -10.840 -0.578 0.669 282 HD2 PHE 34 HD2 PHE 34 -7.550 1.105 -1.449 283 HE1 PHE 34 HE1 PHE 34 -12.323 1.155 -0.259 284 HE2 PHE 34 HE2 PHE 34 -9.026 2.841 -2.373 285 HZ PHE 34 HZ PHE 34 -11.416 2.866 -1.782 286 H ARG 35 HN ARG 35 -6.402 -2.150 -2.040 287 HA ARG 35 HA ARG 35 -4.814 -4.065 -0.487 288 HB2 ARG 35 HB2 ARG 35 -4.349 -5.408 -2.310 289 HB3 ARG 35 HB1 ARG 35 -6.019 -4.953 -2.627 290 HG2 ARG 35 HG2 ARG 35 -5.268 -4.449 -4.666 291 HG3 ARG 35 HG1 ARG 35 -4.685 -2.968 -3.907 292 HD2 ARG 35 HD2 ARG 35 -2.533 -3.577 -4.101 293 HD3 ARG 35 HD1 ARG 35 -2.866 -5.246 -3.641 294 HE ARG 35 HE ARG 35 -3.871 -5.087 -6.145 295 HH11 ARG 35 HH11 ARG 35 -0.771 -4.270 -4.765 296 HH12 ARG 35 HH12 ARG 35 0.103 -4.597 -6.224 297 HH21 ARG 35 HH21 ARG 35 -2.722 -5.518 -8.062 298 HH22 ARG 35 HH22 ARG 35 -1.003 -5.306 -8.095 299 H LEU 36 HN LEU 36 -2.564 -3.818 -0.575 300 HA LEU 36 HA LEU 36 -1.670 -1.147 -0.981 301 HB2 LEU 36 HB2 LEU 36 -0.112 -3.685 -0.449 302 HB3 LEU 36 HB1 LEU 36 0.585 -2.073 -0.455 303 HG LEU 36 HG LEU 36 -1.554 -3.025 1.451 304 HD11 LEU 36 HD11 LEU 36 0.701 -4.065 1.750 305 HD12 LEU 36 HD12 LEU 36 0.149 -3.102 3.120 306 HD13 LEU 36 HD13 LEU 36 1.349 -2.446 2.008 307 HD21 LEU 36 HD21 LEU 36 0.045 -0.467 1.412 308 HD22 LEU 36 HD22 LEU 36 -1.165 -0.931 2.608 309 HD23 LEU 36 HD23 LEU 36 -1.648 -0.618 0.942 310 H LEU 37 HN LEU 37 -2.225 -0.819 -3.195 311 HA LEU 37 HA LEU 37 -1.626 -2.185 -5.424 312 HB2 LEU 37 HB2 LEU 37 -2.583 0.209 -5.092 313 HB3 LEU 37 HB1 LEU 37 -0.925 0.717 -5.353 314 HG LEU 37 HG LEU 37 -0.961 -0.490 -7.535 315 HD11 LEU 37 HD11 LEU 37 -3.366 -0.839 -8.405 316 HD12 LEU 37 HD12 LEU 37 -3.794 -0.943 -6.697 317 HD13 LEU 37 HD13 LEU 37 -2.637 -2.081 -7.385 318 HD21 LEU 37 HD21 LEU 37 -1.792 1.331 -8.646 319 HD22 LEU 37 HD22 LEU 37 -1.608 2.009 -7.029 320 HD23 LEU 37 HD23 LEU 37 -3.194 1.475 -7.586 321 H LEU 38 HN LEU 38 0.044 -2.610 -6.752 322 HA LEU 38 HA LEU 38 2.186 -3.306 -7.165 323 HB2 LEU 38 HB2 LEU 38 3.647 -1.502 -7.751 324 HB3 LEU 38 HB1 LEU 38 2.008 -1.078 -8.204 325 HG LEU 38 HG LEU 38 2.892 -0.131 -5.546 326 HD11 LEU 38 HD11 LEU 38 4.498 1.313 -6.182 327 HD12 LEU 38 HD12 LEU 38 3.783 1.579 -7.772 328 HD13 LEU 38 HD13 LEU 38 4.755 0.138 -7.471 329 HD21 LEU 38 HD21 LEU 38 1.855 1.951 -7.031 330 HD22 LEU 38 HD22 LEU 38 0.963 0.928 -5.907 331 HD23 LEU 38 HD23 LEU 38 0.979 0.542 -7.628 332 H VAL 39 HN VAL 39 1.707 -3.950 -4.567 333 HA VAL 39 HA VAL 39 4.310 -3.375 -3.315 334 HB VAL 39 HB VAL 39 1.701 -3.662 -1.815 335 HG11 VAL 39 HG11 VAL 39 3.522 -2.604 -0.083 336 HG12 VAL 39 HG12 VAL 39 4.514 -3.725 -1.014 337 HG13 VAL 39 HG13 VAL 39 3.080 -4.309 -0.170 338 HG21 VAL 39 HG21 VAL 39 2.880 -1.390 -3.077 339 HG22 VAL 39 HG22 VAL 39 2.940 -1.168 -1.328 340 HG23 VAL 39 HG23 VAL 39 1.399 -1.482 -2.124 341 H ASP 40 HN ASP 40 5.350 -5.082 -2.388 342 HA ASP 40 HA ASP 40 4.083 -7.715 -2.742 343 HB2 ASP 40 HB2 ASP 40 6.605 -6.709 -3.590 344 HB3 ASP 40 HB1 ASP 40 6.912 -7.940 -2.370 345 H THR 41 HN THR 41 4.036 -9.160 -1.080 346 HA THR 41 HA THR 41 4.797 -8.109 1.548 347 HB THR 41 HB THR 41 3.366 -10.328 2.125 348 HG1 THR 41 HG1 THR 41 1.632 -10.387 0.620 349 HG21 THR 41 HG21 THR 41 1.553 -8.178 1.406 350 HG22 THR 41 HG22 THR 41 2.935 -7.635 2.357 351 HG23 THR 41 HG23 THR 41 1.886 -8.910 2.976 352 HA PRO 42 HA PRO 42 8.272 -10.948 1.439 353 HB2 PRO 42 HB2 PRO 42 9.004 -10.602 4.057 354 HB3 PRO 42 HB1 PRO 42 9.447 -9.491 2.757 355 HG2 PRO 42 HG2 PRO 42 7.234 -9.278 4.759 356 HG3 PRO 42 HG1 PRO 42 8.339 -8.020 4.173 357 HD2 PRO 42 HD2 PRO 42 5.817 -8.228 3.262 358 HD3 PRO 42 HD1 PRO 42 7.152 -7.716 2.210 359 H GLU 43 HN GLU 43 7.149 -12.890 1.208 360 HA GLU 43 HA GLU 43 6.411 -14.950 1.814 361 HB2 GLU 43 HB2 GLU 43 7.675 -14.144 4.435 362 HB3 GLU 43 HB1 GLU 43 7.009 -15.743 4.134 363 HG2 GLU 43 HG2 GLU 43 8.973 -16.346 3.327 364 HG3 GLU 43 HG1 GLU 43 8.718 -15.231 1.986 365 H THR 44 HN THR 44 5.916 -13.495 5.004 366 HA THR 44 HA THR 44 4.050 -13.079 6.228 367 HB THR 44 HB THR 44 2.520 -12.985 3.630 368 HG1 THR 44 HG1 THR 44 4.278 -11.633 3.386 369 HG21 THR 44 HG21 THR 44 0.881 -12.576 5.109 370 HG22 THR 44 HG22 THR 44 1.578 -10.956 5.097 371 HG23 THR 44 HG23 THR 44 2.000 -12.088 6.382 372 H LYS 45 HN LYS 45 2.628 -14.897 3.509 373 HA LYS 45 HA LYS 45 1.799 -16.950 5.453 374 HB2 LYS 45 HB2 LYS 45 0.369 -16.295 2.878 375 HB3 LYS 45 HB1 LYS 45 -0.202 -17.308 4.196 376 HG2 LYS 45 HG2 LYS 45 0.425 -14.505 4.875 377 HG3 LYS 45 HG1 LYS 45 -0.979 -14.776 3.840 378 HD2 LYS 45 HD2 LYS 45 -1.495 -16.633 5.660 379 HD3 LYS 45 HD1 LYS 45 -0.515 -15.566 6.668 380 HE2 LYS 45 HE2 LYS 45 -1.983 -13.699 6.157 381 HE3 LYS 45 HE1 LYS 45 -2.936 -14.720 5.080 382 HZ1 LYS 45 HZ1 LYS 45 -3.915 -14.407 7.320 383 HZ2 LYS 45 HZ2 LYS 45 -2.600 -15.240 7.983 384 HZ3 LYS 45 HZ3 LYS 45 -3.651 -16.030 6.919 385 H HIS 46 HN HIS 46 2.839 -16.338 2.128 386 HA HIS 46 HA HIS 46 3.888 -17.638 0.588 387 HB2 HIS 46 HB2 HIS 46 5.023 -18.295 3.115 388 HB3 HIS 46 HB1 HIS 46 4.890 -19.783 2.184 389 HD1 HIS 46 HD1 HIS 46 5.550 -16.535 0.452 390 HD2 HIS 46 HD2 HIS 46 7.648 -19.885 1.731 391 HE1 HIS 46 HE1 HIS 46 7.815 -16.360 -0.624 392 HE2 HIS 46 HE2 HIS 46 9.097 -18.351 0.236 393 HA PRO 47 HA PRO 47 0.459 -20.576 0.097 394 HB2 PRO 47 HB2 PRO 47 0.673 -20.745 -2.613 395 HB3 PRO 47 HB1 PRO 47 -0.182 -19.437 -1.788 396 HG2 PRO 47 HG2 PRO 47 2.589 -19.472 -2.919 397 HG3 PRO 47 HG1 PRO 47 1.354 -18.201 -3.018 398 HD2 PRO 47 HD2 PRO 47 3.408 -18.082 -1.270 399 HD3 PRO 47 HD1 PRO 47 1.804 -17.424 -0.891 400 H LYS 48 HN LYS 48 0.994 -22.572 0.743 401 HA LYS 48 HA LYS 48 2.504 -24.272 -1.038 402 HB2 LYS 48 HB2 LYS 48 4.237 -23.194 0.410 403 HB3 LYS 48 HB1 LYS 48 3.455 -23.917 1.809 404 HG2 LYS 48 HG2 LYS 48 4.907 -25.583 1.506 405 HG3 LYS 48 HG1 LYS 48 3.823 -26.086 0.205 406 HD2 LYS 48 HD2 LYS 48 5.688 -25.977 -1.056 407 HD3 LYS 48 HD1 LYS 48 5.339 -24.247 -1.082 408 HE2 LYS 48 HE2 LYS 48 6.752 -24.112 1.041 409 HE3 LYS 48 HE1 LYS 48 7.299 -25.738 0.640 410 HZ1 LYS 48 HZ1 LYS 48 7.935 -23.203 -0.624 411 HZ2 LYS 48 HZ2 LYS 48 7.685 -24.500 -1.681 412 HZ3 LYS 48 HZ3 LYS 48 8.869 -24.608 -0.478 413 H LYS 49 HN LYS 49 1.553 -24.303 2.401 414 HA LYS 49 HA LYS 49 -0.047 -26.712 1.830 415 HB2 LYS 49 HB2 LYS 49 1.733 -26.031 4.145 416 HB3 LYS 49 HB1 LYS 49 0.383 -27.135 4.371 417 HG2 LYS 49 HG2 LYS 49 2.584 -27.500 2.349 418 HG3 LYS 49 HG1 LYS 49 2.513 -28.285 3.927 419 HD2 LYS 49 HD2 LYS 49 0.320 -29.271 3.256 420 HD3 LYS 49 HD1 LYS 49 0.574 -28.608 1.640 421 HE2 LYS 49 HE2 LYS 49 2.747 -29.878 1.583 422 HE3 LYS 49 HE1 LYS 49 2.233 -30.676 3.068 423 HZ1 LYS 49 HZ1 LYS 49 1.684 -32.034 1.182 424 HZ2 LYS 49 HZ2 LYS 49 0.838 -30.767 0.449 425 HZ3 LYS 49 HZ3 LYS 49 0.251 -31.460 1.876 426 H GLY 50 HN GLY 50 -0.928 -23.946 1.709 427 HA2 GLY 50 HA2 GLY 50 -3.280 -23.474 2.255 428 HA3 GLY 50 HA1 GLY 50 -2.927 -24.023 3.886 429 H VAL 51 HN VAL 51 -4.112 -21.575 3.434 430 HA VAL 51 HA VAL 51 -1.938 -19.651 3.930 431 HB VAL 51 HB VAL 51 -4.776 -18.999 3.137 432 HG11 VAL 51 HG11 VAL 51 -2.965 -17.380 4.308 433 HG12 VAL 51 HG12 VAL 51 -4.193 -16.820 3.173 434 HG13 VAL 51 HG13 VAL 51 -2.552 -17.140 2.610 435 HG21 VAL 51 HG21 VAL 51 -2.378 -19.648 1.500 436 HG22 VAL 51 HG22 VAL 51 -3.459 -18.372 0.938 437 HG23 VAL 51 HG23 VAL 51 -4.081 -20.001 1.202 438 H GLU 52 HN GLU 52 -1.669 -19.886 6.122 439 HA GLU 52 HA GLU 52 -3.659 -18.630 7.781 440 HB2 GLU 52 HB2 GLU 52 -3.908 -20.482 9.355 441 HB3 GLU 52 HB1 GLU 52 -4.479 -20.942 7.757 442 HG2 GLU 52 HG2 GLU 52 -3.056 -22.634 7.650 443 HG3 GLU 52 HG1 GLU 52 -1.694 -21.598 8.074 444 H LYS 53 HN LYS 53 -1.538 -17.355 7.536 445 HA LYS 53 HA LYS 53 0.182 -18.043 9.822 446 HB2 LYS 53 HB2 LYS 53 1.015 -18.125 7.196 447 HB3 LYS 53 HB1 LYS 53 1.517 -16.518 7.706 448 HG2 LYS 53 HG2 LYS 53 2.948 -17.346 9.339 449 HG3 LYS 53 HG1 LYS 53 2.157 -18.924 9.367 450 HD2 LYS 53 HD2 LYS 53 3.235 -19.649 7.475 451 HD3 LYS 53 HD1 LYS 53 3.438 -18.017 6.836 452 HE2 LYS 53 HE2 LYS 53 4.934 -17.889 9.099 453 HE3 LYS 53 HE1 LYS 53 5.159 -19.577 8.639 454 HZ1 LYS 53 HZ1 LYS 53 5.537 -17.348 6.726 455 HZ2 LYS 53 HZ2 LYS 53 6.048 -18.953 6.573 456 HZ3 LYS 53 HZ3 LYS 53 6.795 -17.933 7.696 457 H TYR 54 HN TYR 54 1.790 -15.783 9.778 458 HA TYR 54 HA TYR 54 0.138 -13.422 9.679 459 HB2 TYR 54 HB2 TYR 54 -0.390 -14.581 11.888 460 HB3 TYR 54 HB1 TYR 54 1.263 -14.207 12.366 461 HD1 TYR 54 HD1 TYR 54 -1.272 -12.181 10.517 462 HD2 TYR 54 HD2 TYR 54 1.149 -12.564 13.995 463 HE1 TYR 54 HE1 TYR 54 -1.999 -9.953 11.261 464 HE2 TYR 54 HE2 TYR 54 0.429 -10.337 14.749 465 HH TYR 54 HH TYR 54 -1.481 -8.802 14.397 466 H GLY 55 HN GLY 55 1.324 -11.558 9.547 467 HA2 GLY 55 HA2 GLY 55 4.258 -11.891 9.700 468 HA3 GLY 55 HA1 GLY 55 3.454 -10.873 8.514 469 HA PRO 56 HA PRO 56 3.030 -8.853 13.046 470 HB2 PRO 56 HB2 PRO 56 5.723 -9.816 13.895 471 HB3 PRO 56 HB1 PRO 56 4.274 -9.523 14.864 472 HG2 PRO 56 HG2 PRO 56 5.006 -12.004 14.243 473 HG3 PRO 56 HG1 PRO 56 3.296 -11.536 14.251 474 HD2 PRO 56 HD2 PRO 56 5.128 -11.988 11.942 475 HD3 PRO 56 HD1 PRO 56 3.392 -12.327 12.092 476 H GLU 57 HN GLU 57 5.802 -9.249 10.958 477 HA GLU 57 HA GLU 57 6.973 -6.711 11.632 478 HB2 GLU 57 HB2 GLU 57 7.528 -8.497 9.258 479 HB3 GLU 57 HB1 GLU 57 8.538 -7.175 9.825 480 HG2 GLU 57 HG2 GLU 57 7.911 -9.647 11.421 481 HG3 GLU 57 HG1 GLU 57 9.369 -9.416 10.456 482 H ALA 58 HN ALA 58 5.356 -7.989 8.719 483 HA ALA 58 HA ALA 58 5.172 -5.366 7.546 484 HB1 ALA 58 HB1 ALA 58 4.657 -6.423 5.623 485 HB2 ALA 58 HB2 ALA 58 3.557 -7.554 6.411 486 HB3 ALA 58 HB3 ALA 58 5.298 -7.827 6.476 487 H SER 59 HN SER 59 2.738 -7.763 8.575 488 HA SER 59 HA SER 59 0.467 -6.260 8.183 489 HB2 SER 59 HB2 SER 59 1.117 -8.409 10.188 490 HB3 SER 59 HB1 SER 59 -0.479 -7.663 10.128 491 HG SER 59 HG SER 59 0.761 -8.780 7.845 492 H ALA 60 HN ALA 60 2.427 -6.416 11.157 493 HA ALA 60 HA ALA 60 0.886 -4.769 12.761 494 HB1 ALA 60 HB1 ALA 60 2.845 -4.417 14.103 495 HB2 ALA 60 HB2 ALA 60 3.894 -4.887 12.765 496 HB3 ALA 60 HB3 ALA 60 2.840 -6.082 13.520 497 H PHE 61 HN PHE 61 3.715 -3.760 10.827 498 HA PHE 61 HA PHE 61 3.530 -1.044 11.337 499 HB2 PHE 61 HB2 PHE 61 5.461 -2.144 10.246 500 HB3 PHE 61 HB1 PHE 61 4.499 -2.333 8.781 501 HD1 PHE 61 HD1 PHE 61 6.005 0.142 11.058 502 HD2 PHE 61 HD2 PHE 61 4.251 -0.568 7.253 503 HE1 PHE 61 HE1 PHE 61 6.702 2.390 10.321 504 HE2 PHE 61 HE2 PHE 61 4.931 1.672 6.505 505 HZ PHE 61 HZ PHE 61 6.164 3.156 8.042 506 H THR 62 HN THR 62 2.277 -2.777 8.473 507 HA THR 62 HA THR 62 1.085 -0.641 7.196 508 HB THR 62 HB THR 62 -0.131 -3.402 7.303 509 HG1 THR 62 HG1 THR 62 1.331 -3.906 5.625 510 HG21 THR 62 HG21 THR 62 -0.999 -1.259 5.914 511 HG22 THR 62 HG22 THR 62 -1.209 -2.934 5.402 512 HG23 THR 62 HG23 THR 62 0.125 -1.975 4.758 513 H LYS 63 HN LYS 63 -0.408 -2.840 9.562 514 HA LYS 63 HA LYS 63 -2.879 -1.430 9.657 515 HB2 LYS 63 HB2 LYS 63 -2.770 -3.782 10.247 516 HB3 LYS 63 HB1 LYS 63 -1.649 -3.436 11.555 517 HG2 LYS 63 HG2 LYS 63 -4.168 -1.961 11.728 518 HG3 LYS 63 HG1 LYS 63 -4.346 -3.714 11.817 519 HD2 LYS 63 HD2 LYS 63 -2.406 -2.138 13.504 520 HD3 LYS 63 HD1 LYS 63 -4.034 -2.570 14.027 521 HE2 LYS 63 HE2 LYS 63 -2.885 -4.324 14.912 522 HE3 LYS 63 HE1 LYS 63 -3.235 -4.987 13.317 523 HZ1 LYS 63 HZ1 LYS 63 -0.793 -4.876 14.407 524 HZ2 LYS 63 HZ2 LYS 63 -0.787 -3.456 13.490 525 HZ3 LYS 63 HZ3 LYS 63 -1.085 -4.944 12.742 526 H LYS 64 HN LYS 64 0.161 -1.111 11.295 527 HA LYS 64 HA LYS 64 -0.651 0.288 13.586 528 HB2 LYS 64 HB2 LYS 64 1.875 -0.075 12.081 529 HB3 LYS 64 HB1 LYS 64 1.797 1.334 13.127 530 HG2 LYS 64 HG2 LYS 64 1.098 -1.398 14.136 531 HG3 LYS 64 HG1 LYS 64 2.768 -0.829 14.073 532 HD2 LYS 64 HD2 LYS 64 1.880 1.233 15.342 533 HD3 LYS 64 HD1 LYS 64 0.473 0.227 15.693 534 HE2 LYS 64 HE2 LYS 64 2.986 -1.152 16.187 535 HE3 LYS 64 HE1 LYS 64 2.827 0.324 17.140 536 HZ1 LYS 64 HZ1 LYS 64 0.417 -0.736 17.484 537 HZ2 LYS 64 HZ2 LYS 64 1.722 -1.051 18.514 538 HZ3 LYS 64 HZ3 LYS 64 1.321 -2.154 17.296 539 H MET 65 HN MET 65 0.694 1.553 10.552 540 HA MET 65 HA MET 65 0.383 4.255 11.085 541 HB2 MET 65 HB2 MET 65 1.215 2.686 8.921 542 HB3 MET 65 HB1 MET 65 -0.074 3.699 8.286 543 HG2 MET 65 HG2 MET 65 1.693 5.070 7.926 544 HG3 MET 65 HG1 MET 65 1.259 5.586 9.554 545 HE1 MET 65 HE1 MET 65 2.841 3.301 11.625 546 HE2 MET 65 HE2 MET 65 2.198 4.941 11.563 547 HE3 MET 65 HE3 MET 65 3.926 4.679 11.803 548 H VAL 66 HN VAL 66 -1.860 2.148 9.270 549 HA VAL 66 HA VAL 66 -3.792 4.109 8.778 550 HB VAL 66 HB VAL 66 -5.375 2.231 8.430 551 HG11 VAL 66 HG11 VAL 66 -4.059 1.139 6.604 552 HG12 VAL 66 HG12 VAL 66 -2.638 2.003 7.191 553 HG13 VAL 66 HG13 VAL 66 -4.026 2.902 6.579 554 HG21 VAL 66 HG21 VAL 66 -4.155 -0.081 8.494 555 HG22 VAL 66 HG22 VAL 66 -4.892 0.576 9.955 556 HG23 VAL 66 HG23 VAL 66 -3.151 0.707 9.712 557 H GLU 67 HN GLU 67 -3.571 1.753 11.429 558 HA GLU 67 HA GLU 67 -5.978 2.580 12.672 559 HB2 GLU 67 HB2 GLU 67 -3.621 1.069 13.802 560 HB3 GLU 67 HB1 GLU 67 -5.180 1.243 14.596 561 HG2 GLU 67 HG2 GLU 67 -4.896 0.027 11.870 562 HG3 GLU 67 HG1 GLU 67 -4.753 -0.918 13.351 563 H ASN 68 HN ASN 68 -2.562 3.334 13.286 564 HA ASN 68 HA ASN 68 -3.023 4.953 15.556 565 HB2 ASN 68 HB2 ASN 68 -0.742 4.671 13.622 566 HB3 ASN 68 HB1 ASN 68 -0.723 5.949 14.834 567 HD21 ASN 68 HD21 ASN 68 -1.350 2.467 14.579 568 HD22 ASN 68 HD22 ASN 68 -0.538 2.042 16.043 569 H ALA 69 HN ALA 69 -3.215 5.548 12.140 570 HA ALA 69 HA ALA 69 -3.243 8.421 12.397 571 HB1 ALA 69 HB1 ALA 69 -4.076 8.128 9.922 572 HB2 ALA 69 HB2 ALA 69 -3.488 6.482 10.152 573 HB3 ALA 69 HB3 ALA 69 -2.389 7.848 10.350 574 H LYS 70 HN LYS 70 -4.958 9.644 12.822 575 HA LYS 70 HA LYS 70 -7.476 8.541 13.441 576 HB2 LYS 70 HB2 LYS 70 -6.207 11.125 13.549 577 HB3 LYS 70 HB1 LYS 70 -7.845 11.287 12.932 578 HG2 LYS 70 HG2 LYS 70 -8.167 9.587 15.062 579 HG3 LYS 70 HG1 LYS 70 -6.908 10.689 15.620 580 HD2 LYS 70 HD2 LYS 70 -8.460 12.553 14.743 581 HD3 LYS 70 HD1 LYS 70 -9.712 11.310 14.755 582 HE2 LYS 70 HE2 LYS 70 -8.520 11.030 17.222 583 HE3 LYS 70 HE1 LYS 70 -8.503 12.774 16.964 584 HZ1 LYS 70 HZ1 LYS 70 -10.838 10.959 17.031 585 HZ2 LYS 70 HZ2 LYS 70 -10.934 12.511 16.365 586 HZ3 LYS 70 HZ3 LYS 70 -10.535 12.315 17.997 587 H LYS 71 HN LYS 71 -6.102 9.579 10.460 588 HA LYS 71 HA LYS 71 -8.668 9.072 9.136 589 HB2 LYS 71 HB2 LYS 71 -7.959 11.602 9.440 590 HB3 LYS 71 HB1 LYS 71 -6.935 11.248 8.056 591 HG2 LYS 71 HG2 LYS 71 -8.803 10.704 6.699 592 HG3 LYS 71 HG1 LYS 71 -9.894 10.721 8.087 593 HD2 LYS 71 HD2 LYS 71 -8.359 13.197 7.532 594 HD3 LYS 71 HD1 LYS 71 -9.662 12.786 6.413 595 HE2 LYS 71 HE2 LYS 71 -11.202 12.601 8.337 596 HE3 LYS 71 HE1 LYS 71 -9.896 13.114 9.402 597 HZ1 LYS 71 HZ1 LYS 71 -10.971 15.081 9.001 598 HZ2 LYS 71 HZ2 LYS 71 -11.391 14.675 7.413 599 HZ3 LYS 71 HZ3 LYS 71 -9.801 15.122 7.780 600 H ILE 72 HN ILE 72 -8.537 8.121 7.130 601 HA ILE 72 HA ILE 72 -5.837 7.343 6.239 602 HB ILE 72 HB ILE 72 -8.287 5.695 5.704 603 HG12 ILE 72 HG12 ILE 72 -8.104 5.961 8.151 604 HG13 ILE 72 HG11 ILE 72 -7.754 4.310 7.648 605 HG21 ILE 72 HG21 ILE 72 -5.885 5.516 4.601 606 HG22 ILE 72 HG22 ILE 72 -6.864 4.093 4.956 607 HG23 ILE 72 HG23 ILE 72 -5.569 4.568 6.055 608 HD11 ILE 72 HD11 ILE 72 -5.755 4.389 8.586 609 HD12 ILE 72 HD12 ILE 72 -6.203 5.953 9.270 610 HD13 ILE 72 HD13 ILE 72 -5.346 5.875 7.730 611 H GLU 73 HN GLU 73 -5.414 7.372 4.038 612 HA GLU 73 HA GLU 73 -7.534 8.520 2.340 613 HB2 GLU 73 HB2 GLU 73 -4.631 9.133 1.891 614 HB3 GLU 73 HB1 GLU 73 -6.043 10.012 1.326 615 HG2 GLU 73 HG2 GLU 73 -6.343 10.242 4.004 616 HG3 GLU 73 HG1 GLU 73 -4.586 10.201 3.865 617 H VAL 74 HN VAL 74 -7.776 7.703 0.303 618 HA VAL 74 HA VAL 74 -5.946 5.525 -0.461 619 HB VAL 74 HB VAL 74 -7.976 4.578 -1.695 620 HG11 VAL 74 HG11 VAL 74 -7.491 3.128 -0.065 621 HG12 VAL 74 HG12 VAL 74 -8.871 3.839 0.771 622 HG13 VAL 74 HG13 VAL 74 -7.238 4.402 1.127 623 HG21 VAL 74 HG21 VAL 74 -9.501 6.396 -1.551 624 HG22 VAL 74 HG22 VAL 74 -9.342 6.474 0.204 625 HG23 VAL 74 HG23 VAL 74 -10.148 5.097 -0.549 626 H GLU 75 HN GLU 75 -5.214 5.473 -2.515 627 HA GLU 75 HA GLU 75 -6.284 7.471 -4.396 628 HB2 GLU 75 HB2 GLU 75 -4.142 8.258 -3.520 629 HB3 GLU 75 HB1 GLU 75 -3.382 6.737 -3.968 630 HG2 GLU 75 HG2 GLU 75 -3.837 7.218 -6.328 631 HG3 GLU 75 HG1 GLU 75 -4.561 8.757 -5.863 632 H PHE 76 HN PHE 76 -7.354 6.267 -5.847 633 HA PHE 76 HA PHE 76 -6.570 3.622 -6.566 634 HB2 PHE 76 HB2 PHE 76 -8.644 5.524 -7.650 635 HB3 PHE 76 HB1 PHE 76 -8.375 3.926 -8.340 636 HD1 PHE 76 HD2 PHE 76 -8.102 2.119 -6.207 637 HD2 PHE 76 HD1 PHE 76 -10.549 5.598 -6.392 638 HE1 PHE 76 HE2 PHE 76 -9.609 1.142 -4.527 639 HE2 PHE 76 HE1 PHE 76 -12.061 4.627 -4.712 640 HZ PHE 76 HZ PHE 76 -11.593 2.396 -3.778 641 H ASP 77 HN ASP 77 -5.604 2.890 -8.375 642 HA ASP 77 HA ASP 77 -3.648 4.440 -9.598 643 HB2 ASP 77 HB2 ASP 77 -3.280 2.566 -11.080 644 HB3 ASP 77 HB1 ASP 77 -3.641 1.956 -9.471 645 H LYS 78 HN LYS 78 -3.796 3.916 -12.320 646 HA LYS 78 HA LYS 78 -5.947 5.749 -13.139 647 HB2 LYS 78 HB2 LYS 78 -4.269 5.944 -15.206 648 HB3 LYS 78 HB1 LYS 78 -4.110 6.942 -13.769 649 HG2 LYS 78 HG2 LYS 78 -2.691 4.434 -13.489 650 HG3 LYS 78 HG1 LYS 78 -2.157 5.333 -14.897 651 HD2 LYS 78 HD2 LYS 78 -2.508 7.000 -12.537 652 HD3 LYS 78 HD1 LYS 78 -1.307 5.725 -12.328 653 HE2 LYS 78 HE2 LYS 78 -1.284 7.416 -14.793 654 HE3 LYS 78 HE1 LYS 78 -0.587 8.033 -13.296 655 HZ1 LYS 78 HZ1 LYS 78 1.189 7.027 -14.361 656 HZ2 LYS 78 HZ2 LYS 78 0.269 5.716 -14.909 657 HZ3 LYS 78 HZ3 LYS 78 0.687 5.830 -13.275 658 H GLY 79 HN GLY 79 -4.348 2.718 -13.805 659 HA2 GLY 79 HA2 GLY 79 -5.620 2.217 -16.303 660 HA3 GLY 79 HA1 GLY 79 -4.808 1.029 -15.300 661 H GLN 80 HN GLN 80 -5.993 -0.332 -14.046 662 HA GLN 80 HA GLN 80 -8.802 -0.500 -14.628 663 HB2 GLN 80 HB2 GLN 80 -8.746 -2.596 -13.432 664 HB3 GLN 80 HB1 GLN 80 -7.361 -2.493 -14.506 665 HG2 GLN 80 HG2 GLN 80 -6.046 -1.696 -12.485 666 HG3 GLN 80 HG1 GLN 80 -7.422 -2.236 -11.524 667 HE21 GLN 80 HE21 GLN 80 -5.637 -3.593 -10.623 668 HE22 GLN 80 HE22 GLN 80 -5.354 -5.125 -11.367 669 H ARG 81 HN ARG 81 -6.928 -0.140 -11.624 670 HA ARG 81 HA ARG 81 -7.434 0.899 -9.655 671 HB2 ARG 81 HB2 ARG 81 -9.890 1.849 -11.139 672 HB3 ARG 81 HB1 ARG 81 -9.474 2.333 -9.504 673 HG2 ARG 81 HG2 ARG 81 -7.275 3.158 -10.469 674 HG3 ARG 81 HG1 ARG 81 -8.025 2.958 -12.054 675 HD2 ARG 81 HD2 ARG 81 -9.885 4.337 -10.450 676 HD3 ARG 81 HD1 ARG 81 -8.318 5.094 -10.164 677 HE ARG 81 HE ARG 81 -8.530 4.815 -12.894 678 HH11 ARG 81 HH11 ARG 81 -10.330 6.425 -10.375 679 HH12 ARG 81 HH12 ARG 81 -10.886 7.695 -11.412 680 HH21 ARG 81 HH21 ARG 81 -9.259 6.485 -14.260 681 HH22 ARG 81 HH22 ARG 81 -10.279 7.731 -13.617 682 H THR 82 HN THR 82 -9.202 -1.564 -11.053 683 HA THR 82 HA THR 82 -9.990 -2.585 -8.503 684 HB THR 82 HB THR 82 -12.439 -2.884 -9.428 685 HG1 THR 82 HG1 THR 82 -11.681 -0.423 -10.610 686 HG21 THR 82 HG21 THR 82 -13.164 -1.317 -7.968 687 HG22 THR 82 HG22 THR 82 -11.990 -0.113 -8.497 688 HG23 THR 82 HG23 THR 82 -11.487 -1.430 -7.437 689 H ASP 83 HN ASP 83 -9.567 -4.675 -8.608 690 HA ASP 83 HA ASP 83 -9.145 -5.992 -11.110 691 HB2 ASP 83 HB2 ASP 83 -8.156 -6.363 -8.608 692 HB3 ASP 83 HB1 ASP 83 -9.355 -7.651 -8.675 693 H LYS 84 HN LYS 84 -10.060 -8.459 -10.991 694 HA LYS 84 HA LYS 84 -12.601 -8.439 -11.973 695 HB2 LYS 84 HB2 LYS 84 -12.578 -10.886 -10.725 696 HB3 LYS 84 HB1 LYS 84 -11.928 -10.547 -12.324 697 HG2 LYS 84 HG2 LYS 84 -10.145 -10.101 -9.997 698 HG3 LYS 84 HG1 LYS 84 -10.527 -11.767 -10.433 699 HD2 LYS 84 HD2 LYS 84 -9.488 -9.720 -12.388 700 HD3 LYS 84 HD1 LYS 84 -8.456 -10.845 -11.505 701 HE2 LYS 84 HE2 LYS 84 -9.945 -12.684 -12.474 702 HE3 LYS 84 HE1 LYS 84 -10.546 -11.446 -13.576 703 HZ1 LYS 84 HZ1 LYS 84 -7.665 -12.073 -13.282 704 HZ2 LYS 84 HZ2 LYS 84 -8.411 -11.165 -14.500 705 HZ3 LYS 84 HZ3 LYS 84 -8.657 -12.837 -14.420 706 H TYR 85 HN TYR 85 -11.832 -9.467 -8.648 707 HA TYR 85 HA TYR 85 -14.524 -9.540 -7.818 708 HB2 TYR 85 HB2 TYR 85 -11.878 -9.816 -6.559 709 HB3 TYR 85 HB1 TYR 85 -13.132 -9.208 -5.486 710 HD1 TYR 85 HD1 TYR 85 -13.579 -11.621 -8.266 711 HD2 TYR 85 HD2 TYR 85 -13.434 -11.050 -4.054 712 HE1 TYR 85 HE1 TYR 85 -14.399 -13.916 -7.934 713 HE2 TYR 85 HE2 TYR 85 -14.252 -13.344 -3.708 714 HH TYR 85 HH TYR 85 -15.555 -15.046 -4.978 715 H GLY 86 HN GLY 86 -12.515 -6.931 -8.469 716 HA2 GLY 86 HA2 GLY 86 -13.188 -4.683 -8.409 717 HA3 GLY 86 HA1 GLY 86 -14.416 -5.104 -7.222 718 H ARG 87 HN ARG 87 -11.216 -6.297 -6.743 719 HA ARG 87 HA ARG 87 -10.894 -5.338 -4.188 720 HB2 ARG 87 HB2 ARG 87 -9.435 -6.951 -5.736 721 HB3 ARG 87 HB1 ARG 87 -8.446 -5.504 -5.873 722 HG2 ARG 87 HG2 ARG 87 -7.451 -6.293 -4.032 723 HG3 ARG 87 HG1 ARG 87 -8.843 -5.600 -3.197 724 HD2 ARG 87 HD2 ARG 87 -8.472 -8.458 -4.078 725 HD3 ARG 87 HD1 ARG 87 -8.529 -7.848 -2.424 726 HE ARG 87 HE ARG 87 -10.903 -7.323 -3.979 727 HH11 ARG 87 HH11 ARG 87 -9.290 -9.563 -1.842 728 HH12 ARG 87 HH12 ARG 87 -10.759 -10.313 -1.317 729 HH21 ARG 87 HH21 ARG 87 -12.835 -8.310 -3.290 730 HH22 ARG 87 HH22 ARG 87 -12.772 -9.602 -2.139 731 H GLY 88 HN GLY 88 -9.422 -3.694 -3.322 732 HA2 GLY 88 HA2 GLY 88 -9.803 -1.189 -4.744 733 HA3 GLY 88 HA1 GLY 88 -9.268 -1.365 -3.085 734 H LEU 89 HN LEU 89 -8.340 -0.963 -6.351 735 HA LEU 89 HA LEU 89 -5.541 -1.538 -5.896 736 HB2 LEU 89 HB2 LEU 89 -7.075 -0.478 -8.255 737 HB3 LEU 89 HB1 LEU 89 -5.332 -0.646 -8.255 738 HG LEU 89 HG LEU 89 -6.691 -2.500 -9.338 739 HD11 LEU 89 HD11 LEU 89 -4.344 -2.759 -8.877 740 HD12 LEU 89 HD12 LEU 89 -5.186 -4.255 -8.473 741 HD13 LEU 89 HD13 LEU 89 -4.686 -3.151 -7.192 742 HD21 LEU 89 HD21 LEU 89 -8.331 -2.596 -7.415 743 HD22 LEU 89 HD22 LEU 89 -7.073 -3.443 -6.516 744 HD23 LEU 89 HD23 LEU 89 -7.719 -4.142 -8.000 745 H ALA 90 HN ALA 90 -5.481 0.082 -4.097 746 HA ALA 90 HA ALA 90 -4.534 2.624 -5.150 747 HB1 ALA 90 HB1 ALA 90 -6.648 3.428 -4.743 748 HB2 ALA 90 HB2 ALA 90 -5.878 3.726 -3.187 749 HB3 ALA 90 HB3 ALA 90 -6.927 2.324 -3.398 750 H TYR 91 HN TYR 91 -3.765 4.019 -3.193 751 HA TYR 91 HA TYR 91 -2.165 2.252 -1.478 752 HB2 TYR 91 HB2 TYR 91 -1.631 5.186 -1.876 753 HB3 TYR 91 HB1 TYR 91 -0.514 3.928 -1.370 754 HD1 TYR 91 HD2 TYR 91 -2.567 4.969 -4.309 755 HD2 TYR 91 HD1 TYR 91 0.956 3.034 -2.919 756 HE1 TYR 91 HE2 TYR 91 -1.783 4.749 -6.627 757 HE2 TYR 91 HE1 TYR 91 1.754 2.814 -5.233 758 HH TYR 91 HH TYR 91 -0.083 3.023 -7.840 759 H ILE 92 HN ILE 92 -2.351 2.348 0.707 760 HA ILE 92 HA ILE 92 -4.492 4.030 1.770 761 HB ILE 92 HB ILE 92 -2.955 1.812 3.132 762 HG12 ILE 92 HG12 ILE 92 -5.463 0.846 2.777 763 HG13 ILE 92 HG11 ILE 92 -5.302 1.833 1.329 764 HG21 ILE 92 HG21 ILE 92 -4.013 3.517 4.619 765 HG22 ILE 92 HG22 ILE 92 -4.640 1.881 4.827 766 HG23 ILE 92 HG23 ILE 92 -5.572 3.074 3.923 767 HD11 ILE 92 HD11 ILE 92 -4.660 -0.515 0.988 768 HD12 ILE 92 HD12 ILE 92 -3.365 -0.309 2.167 769 HD13 ILE 92 HD13 ILE 92 -3.344 0.611 0.662 770 H TYR 93 HN TYR 93 -4.103 5.842 2.844 771 HA TYR 93 HA TYR 93 -1.367 6.378 3.757 772 HB2 TYR 93 HB2 TYR 93 -3.628 8.353 3.397 773 HB3 TYR 93 HB1 TYR 93 -1.955 8.736 3.751 774 HD1 TYR 93 HD2 TYR 93 -3.031 6.254 1.203 775 HD2 TYR 93 HD1 TYR 93 -1.554 10.173 1.929 776 HE1 TYR 93 HE2 TYR 93 -2.618 6.530 -1.195 777 HE2 TYR 93 HE1 TYR 93 -1.126 10.458 -0.474 778 HH TYR 93 HH TYR 93 -2.359 9.106 -2.735 779 H ALA 94 HN ALA 94 -1.148 7.670 5.752 780 HA ALA 94 HA ALA 94 -3.310 7.361 7.685 781 HB1 ALA 94 HB1 ALA 94 -0.802 5.833 7.711 782 HB2 ALA 94 HB2 ALA 94 -2.350 5.489 8.482 783 HB3 ALA 94 HB3 ALA 94 -1.215 6.608 9.241 784 H ASP 95 HN ASP 95 -3.590 9.342 8.472 785 HA ASP 95 HA ASP 95 -3.170 11.335 9.486 786 HB2 ASP 95 HB2 ASP 95 -0.907 9.742 10.194 787 HB3 ASP 95 HB1 ASP 95 -0.343 11.370 9.832 788 H GLY 96 HN GLY 96 -2.346 10.550 6.502 789 HA2 GLY 96 HA2 GLY 96 -2.360 12.390 4.887 790 HA3 GLY 96 HA1 GLY 96 -1.232 13.227 5.940 791 H LYS 97 HN LYS 97 -0.312 10.054 5.956 792 HA LYS 97 HA LYS 97 1.494 10.450 3.664 793 HB2 LYS 97 HB2 LYS 97 2.049 9.690 6.471 794 HB3 LYS 97 HB1 LYS 97 2.936 8.803 5.239 795 HG2 LYS 97 HG2 LYS 97 4.148 10.613 4.606 796 HG3 LYS 97 HG1 LYS 97 2.857 11.750 4.995 797 HD2 LYS 97 HD2 LYS 97 4.859 11.900 6.489 798 HD3 LYS 97 HD1 LYS 97 3.335 11.613 7.330 799 HE2 LYS 97 HE2 LYS 97 5.084 10.207 8.253 800 HE3 LYS 97 HE1 LYS 97 3.866 9.218 7.447 801 HZ1 LYS 97 HZ1 LYS 97 5.318 8.547 5.886 802 HZ2 LYS 97 HZ2 LYS 97 6.481 8.952 7.045 803 HZ3 LYS 97 HZ3 LYS 97 6.113 10.039 5.803 804 H MET 98 HN MET 98 1.904 8.694 2.350 805 HA MET 98 HA MET 98 -0.077 6.627 2.393 806 HB2 MET 98 HB2 MET 98 2.291 6.397 0.604 807 HB3 MET 98 HB1 MET 98 0.591 6.083 0.273 808 HG2 MET 98 HG2 MET 98 0.586 8.000 -0.834 809 HG3 MET 98 HG1 MET 98 0.649 8.795 0.737 810 HE1 MET 98 HE1 MET 98 1.717 10.684 0.712 811 HE2 MET 98 HE2 MET 98 3.333 11.090 0.132 812 HE3 MET 98 HE3 MET 98 3.138 10.134 1.601 813 H VAL 99 HN VAL 99 0.003 4.789 3.440 814 HA VAL 99 HA VAL 99 2.273 3.979 4.939 815 HB VAL 99 HB VAL 99 -0.135 2.278 4.299 816 HG11 VAL 99 HG11 VAL 99 2.133 1.601 5.618 817 HG12 VAL 99 HG12 VAL 99 0.553 0.879 5.919 818 HG13 VAL 99 HG13 VAL 99 1.134 2.189 6.947 819 HG21 VAL 99 HG21 VAL 99 -1.119 3.203 6.378 820 HG22 VAL 99 HG22 VAL 99 -0.955 4.403 5.096 821 HG23 VAL 99 HG23 VAL 99 0.191 4.382 6.436 822 H ASN 100 HN ASN 100 1.038 3.144 1.787 823 HA ASN 100 HA ASN 100 2.313 0.686 1.390 824 HB2 ASN 100 HB2 ASN 100 1.921 2.750 -0.774 825 HB3 ASN 100 HB1 ASN 100 1.913 0.995 -0.931 826 HD21 ASN 100 HD21 ASN 100 -0.004 0.088 -1.068 827 HD22 ASN 100 HD22 ASN 100 -1.490 0.750 -0.494 828 H GLU 101 HN GLU 101 3.415 3.904 0.274 829 HA GLU 101 HA GLU 101 5.919 3.106 -0.626 830 HB2 GLU 101 HB2 GLU 101 6.603 5.482 -0.282 831 HB3 GLU 101 HB1 GLU 101 5.100 5.294 -1.175 832 HG2 GLU 101 HG2 GLU 101 4.596 7.005 0.267 833 HG3 GLU 101 HG1 GLU 101 3.981 5.600 1.134 834 H ALA 102 HN ALA 102 4.844 3.975 2.617 835 HA ALA 102 HA ALA 102 7.303 4.176 3.894 836 HB1 ALA 102 HB1 ALA 102 5.982 3.292 5.923 837 HB2 ALA 102 HB2 ALA 102 4.594 3.305 4.834 838 HB3 ALA 102 HB3 ALA 102 5.461 4.803 5.175 839 H LEU 103 HN LEU 103 5.230 1.292 3.633 840 HA LEU 103 HA LEU 103 7.022 -0.530 4.770 841 HB2 LEU 103 HB2 LEU 103 4.894 -1.009 2.680 842 HB3 LEU 103 HB1 LEU 103 5.682 -2.261 3.620 843 HG LEU 103 HG LEU 103 4.533 -0.274 5.369 844 HD11 LEU 103 HD11 LEU 103 3.055 -0.259 3.176 845 HD12 LEU 103 HD12 LEU 103 2.333 -0.202 4.784 846 HD13 LEU 103 HD13 LEU 103 2.401 -1.727 3.901 847 HD21 LEU 103 HD21 LEU 103 5.195 -2.603 5.932 848 HD22 LEU 103 HD22 LEU 103 3.838 -3.180 4.964 849 HD23 LEU 103 HD23 LEU 103 3.544 -2.202 6.402 850 H VAL 104 HN VAL 104 6.519 0.485 1.427 851 HA VAL 104 HA VAL 104 8.231 -1.317 0.159 852 HB VAL 104 HB VAL 104 7.797 1.540 -0.709 853 HG11 VAL 104 HG11 VAL 104 7.842 -0.575 -2.715 854 HG12 VAL 104 HG12 VAL 104 9.351 -0.435 -1.811 855 HG13 VAL 104 HG13 VAL 104 8.702 0.964 -2.668 856 HG21 VAL 104 HG21 VAL 104 5.815 -0.401 -0.236 857 HG22 VAL 104 HG22 VAL 104 6.022 -0.316 -1.984 858 HG23 VAL 104 HG23 VAL 104 5.640 1.143 -1.070 859 H ARG 105 HN ARG 105 8.889 1.880 1.544 860 HA ARG 105 HA ARG 105 11.671 1.793 0.833 861 HB2 ARG 105 HB2 ARG 105 10.801 3.959 0.902 862 HB3 ARG 105 HB1 ARG 105 9.949 3.676 2.411 863 HG2 ARG 105 HG2 ARG 105 12.648 3.352 3.043 864 HG3 ARG 105 HG1 ARG 105 12.593 4.732 1.949 865 HD2 ARG 105 HD2 ARG 105 12.339 5.181 4.457 866 HD3 ARG 105 HD1 ARG 105 11.194 5.950 3.360 867 HE ARG 105 HE ARG 105 10.331 3.420 4.473 868 HH11 ARG 105 HH11 ARG 105 10.348 6.896 4.824 869 HH12 ARG 105 HH12 ARG 105 8.921 6.928 5.803 870 HH21 ARG 105 HH21 ARG 105 8.449 3.467 5.758 871 HH22 ARG 105 HH22 ARG 105 7.845 4.984 6.335 872 H GLN 106 HN GLN 106 9.764 1.190 3.761 873 HA GLN 106 HA GLN 106 12.034 0.866 5.453 874 HB2 GLN 106 HB2 GLN 106 9.210 0.875 5.767 875 HB3 GLN 106 HB1 GLN 106 9.817 -0.609 6.466 876 HG2 GLN 106 HG2 GLN 106 10.281 0.551 8.288 877 HG3 GLN 106 HG1 GLN 106 11.568 1.327 7.366 878 HE21 GLN 106 HE21 GLN 106 11.504 3.435 7.171 879 HE22 GLN 106 HE22 GLN 106 10.138 4.442 7.480 880 H GLY 107 HN GLY 107 10.908 -1.043 2.950 881 HA2 GLY 107 HA2 GLY 107 11.903 -3.046 2.251 882 HA3 GLY 107 HA1 GLY 107 12.537 -3.273 3.873 883 H LEU 108 HN LEU 108 9.618 -2.619 4.760 884 HA LEU 108 HA LEU 108 8.817 -5.224 5.303 885 HB2 LEU 108 HB2 LEU 108 6.951 -2.875 5.020 886 HB3 LEU 108 HB1 LEU 108 6.718 -4.305 6.008 887 HG LEU 108 HG LEU 108 8.834 -2.205 6.474 888 HD11 LEU 108 HD11 LEU 108 6.190 -2.699 7.824 889 HD12 LEU 108 HD12 LEU 108 6.677 -1.266 6.919 890 HD13 LEU 108 HD13 LEU 108 7.452 -1.643 8.458 891 HD21 LEU 108 HD21 LEU 108 7.986 -4.284 8.443 892 HD22 LEU 108 HD22 LEU 108 9.493 -3.370 8.351 893 HD23 LEU 108 HD23 LEU 108 9.180 -4.673 7.204 894 H ALA 109 HN ALA 109 8.457 -3.335 2.443 895 HA ALA 109 HA ALA 109 7.186 -5.580 1.102 896 HB1 ALA 109 HB1 ALA 109 5.606 -3.500 1.981 897 HB2 ALA 109 HB2 ALA 109 5.199 -4.644 0.703 898 HB3 ALA 109 HB3 ALA 109 5.921 -3.087 0.296 899 H LYS 110 HN LYS 110 7.020 -5.069 -1.334 900 HA LYS 110 HA LYS 110 9.115 -3.232 -2.219 901 HB2 LYS 110 HB2 LYS 110 9.072 -5.981 -3.404 902 HB3 LYS 110 HB1 LYS 110 10.382 -4.808 -3.358 903 HG2 LYS 110 HG2 LYS 110 10.429 -5.209 -0.842 904 HG3 LYS 110 HG1 LYS 110 9.419 -6.619 -1.171 905 HD2 LYS 110 HD2 LYS 110 11.844 -6.316 -2.837 906 HD3 LYS 110 HD1 LYS 110 12.103 -6.701 -1.134 907 HE2 LYS 110 HE2 LYS 110 11.913 -8.814 -1.981 908 HE3 LYS 110 HE1 LYS 110 10.219 -8.486 -1.614 909 HZ1 LYS 110 HZ1 LYS 110 10.316 -7.553 -4.073 910 HZ2 LYS 110 HZ2 LYS 110 9.998 -9.181 -3.742 911 HZ3 LYS 110 HZ3 LYS 110 11.553 -8.701 -4.199 912 H VAL 111 HN VAL 111 9.133 -3.023 -4.638 913 HA VAL 111 HA VAL 111 6.408 -2.710 -5.552 914 HB VAL 111 HB VAL 111 9.048 -1.918 -6.784 915 HG11 VAL 111 HG11 VAL 111 7.731 -0.608 -8.381 916 HG12 VAL 111 HG12 VAL 111 6.254 -1.325 -7.740 917 HG13 VAL 111 HG13 VAL 111 7.447 -2.340 -8.551 918 HG21 VAL 111 HG21 VAL 111 6.874 -0.216 -5.576 919 HG22 VAL 111 HG22 VAL 111 8.449 0.323 -6.160 920 HG23 VAL 111 HG23 VAL 111 8.343 -0.708 -4.733 921 H ALA 112 HN ALA 112 5.396 -4.325 -6.530 922 HA ALA 112 HA ALA 112 6.778 -5.818 -8.625 923 HB1 ALA 112 HB1 ALA 112 7.117 -7.352 -6.903 924 HB2 ALA 112 HB2 ALA 112 5.654 -7.937 -7.697 925 HB3 ALA 112 HB3 ALA 112 5.536 -7.039 -6.184 926 H TYR 113 HN TYR 113 5.205 -7.167 -9.905 927 HA TYR 113 HA TYR 113 3.362 -7.281 -11.234 928 HB2 TYR 113 HB2 TYR 113 2.234 -6.661 -8.543 929 HB3 TYR 113 HB1 TYR 113 1.159 -6.563 -9.933 930 HD1 TYR 113 HD2 TYR 113 3.948 -8.948 -9.360 931 HD2 TYR 113 HD1 TYR 113 -0.260 -8.402 -9.637 932 HE1 TYR 113 HE2 TYR 113 3.634 -11.387 -9.281 933 HE2 TYR 113 HE1 TYR 113 -0.588 -10.838 -9.557 934 HH TYR 113 HH TYR 113 1.718 -13.025 -10.147 935 H VAL 114 HN VAL 114 4.903 -4.951 -11.445 936 HA VAL 114 HA VAL 114 3.107 -2.684 -11.568 937 HB VAL 114 HB VAL 114 5.359 -2.211 -10.904 938 HG11 VAL 114 HG11 VAL 114 6.022 -4.068 -13.025 939 HG12 VAL 114 HG12 VAL 114 6.974 -3.555 -11.631 940 HG13 VAL 114 HG13 VAL 114 6.989 -2.595 -13.111 941 HG21 VAL 114 HG21 VAL 114 6.030 -0.535 -12.573 942 HG22 VAL 114 HG22 VAL 114 4.297 -0.487 -12.247 943 HG23 VAL 114 HG23 VAL 114 4.896 -1.241 -13.724 944 H TYR 115 HN TYR 115 1.617 -2.816 -13.139 945 HA TYR 115 HA TYR 115 2.567 -3.320 -15.883 946 HB2 TYR 115 HB2 TYR 115 0.052 -4.000 -16.219 947 HB3 TYR 115 HB1 TYR 115 1.200 -5.156 -15.556 948 HD1 TYR 115 HD2 TYR 115 -0.984 -2.423 -14.249 949 HD2 TYR 115 HD1 TYR 115 0.409 -6.412 -13.798 950 HE1 TYR 115 HE2 TYR 115 -2.420 -2.691 -12.268 951 HE2 TYR 115 HE1 TYR 115 -1.020 -6.697 -11.816 952 HH TYR 115 HH TYR 115 -3.420 -4.371 -10.932 953 H LYS 116 HN LYS 116 1.645 -2.071 -17.545 954 HA LYS 116 HA LYS 116 0.501 0.456 -16.598 955 HB2 LYS 116 HB2 LYS 116 1.819 -0.187 -19.237 956 HB3 LYS 116 HB1 LYS 116 1.265 1.401 -18.725 957 HG2 LYS 116 HG2 LYS 116 3.455 -0.224 -17.452 958 HG3 LYS 116 HG1 LYS 116 3.660 1.214 -18.456 959 HD2 LYS 116 HD2 LYS 116 2.173 1.145 -15.830 960 HD3 LYS 116 HD1 LYS 116 3.849 1.665 -16.021 961 HE2 LYS 116 HE2 LYS 116 2.036 2.993 -17.873 962 HE3 LYS 116 HE1 LYS 116 1.613 3.274 -16.185 963 HZ1 LYS 116 HZ1 LYS 116 3.733 4.176 -15.753 964 HZ2 LYS 116 HZ2 LYS 116 3.215 4.895 -17.194 965 HZ3 LYS 116 HZ3 LYS 116 4.358 3.650 -17.235 966 HA PRO 117 HA PRO 117 -0.211 2.200 -17.697 967 HB2 PRO 117 HB2 PRO 117 -2.379 3.729 -17.899 968 HB3 PRO 117 HB1 PRO 117 -1.545 3.150 -19.347 969 HG2 PRO 117 HG2 PRO 117 -4.074 2.178 -18.097 970 HG3 PRO 117 HG1 PRO 117 -3.653 2.324 -19.811 971 HD2 PRO 117 HD2 PRO 117 -3.540 -0.020 -18.281 972 HD3 PRO 117 HD1 PRO 117 -2.774 0.229 -19.862 973 H ASN 118 HN ASN 118 0.216 1.950 -15.536 974 HA ASN 118 HA ASN 118 -1.828 2.758 -13.672 975 HB2 ASN 118 HB2 ASN 118 -0.524 0.063 -13.264 976 HB3 ASN 118 HB1 ASN 118 -1.753 0.813 -12.254 977 HD21 ASN 118 HD21 ASN 118 -1.131 -0.569 -15.426 978 HD22 ASN 118 HD22 ASN 118 -2.766 -1.029 -15.744 979 H ASN 119 HN ASN 119 -0.708 2.193 -11.310 980 HA ASN 119 HA ASN 119 0.943 2.694 -9.838 981 HB2 ASN 119 HB2 ASN 119 2.861 2.760 -12.167 982 HB3 ASN 119 HB1 ASN 119 3.242 2.497 -10.468 983 HD21 ASN 119 HD21 ASN 119 2.149 1.086 -13.402 984 HD22 ASN 119 HD22 ASN 119 2.074 -0.548 -12.844 985 H THR 120 HN THR 120 -0.617 4.776 -10.605 986 HA THR 120 HA THR 120 0.402 7.043 -11.712 987 HB THR 120 HB THR 120 -0.946 7.411 -9.088 988 HG1 THR 120 HG1 THR 120 -2.389 5.972 -9.512 989 HG21 THR 120 HG21 THR 120 -2.430 8.464 -11.233 990 HG22 THR 120 HG22 THR 120 -0.736 8.848 -11.529 991 HG23 THR 120 HG23 THR 120 -1.497 9.331 -10.015 992 H HIS 121 HN HIS 121 1.171 5.737 -8.530 993 HA HIS 121 HA HIS 121 3.018 7.960 -8.034 994 HB2 HIS 121 HB2 HIS 121 1.575 6.015 -6.316 995 HB3 HIS 121 HB1 HIS 121 3.168 6.524 -5.767 996 HD1 HIS 121 HD1 HIS 121 1.794 7.634 -3.756 997 HD2 HIS 121 HD2 HIS 121 1.234 9.340 -7.504 998 HE1 HIS 121 HE1 HIS 121 0.751 9.880 -3.322 999 HE2 HIS 121 HE2 HIS 121 0.475 10.919 -5.602 1000 H GLU 122 HN GLU 122 3.546 5.827 -9.984 1001 HA GLU 122 HA GLU 122 5.298 3.876 -9.070 1002 HB2 GLU 122 HB2 GLU 122 4.398 3.939 -11.354 1003 HB3 GLU 122 HB1 GLU 122 5.379 5.356 -11.705 1004 HG2 GLU 122 HG2 GLU 122 7.407 4.017 -11.314 1005 HG3 GLU 122 HG1 GLU 122 6.393 2.600 -11.044 1006 H GLN 123 HN GLN 123 6.068 7.138 -10.272 1007 HA GLN 123 HA GLN 123 8.814 7.064 -10.054 1008 HB2 GLN 123 HB2 GLN 123 6.988 9.404 -9.484 1009 HB3 GLN 123 HB1 GLN 123 8.714 9.518 -9.801 1010 HG2 GLN 123 HG2 GLN 123 7.027 8.143 -11.812 1011 HG3 GLN 123 HG1 GLN 123 6.903 9.897 -11.687 1012 HE21 GLN 123 HE21 GLN 123 9.218 7.261 -12.071 1013 HE22 GLN 123 HE22 GLN 123 10.355 8.156 -13.014 1014 H LEU 124 HN LEU 124 6.474 7.155 -7.503 1015 HA LEU 124 HA LEU 124 8.324 8.099 -5.503 1016 HB2 LEU 124 HB2 LEU 124 5.881 8.543 -5.415 1017 HB3 LEU 124 HB1 LEU 124 5.611 6.832 -5.145 1018 HG LEU 124 HG LEU 124 7.345 7.368 -3.133 1019 HD11 LEU 124 HD11 LEU 124 6.803 9.464 -2.108 1020 HD12 LEU 124 HD12 LEU 124 5.638 9.837 -3.379 1021 HD13 LEU 124 HD13 LEU 124 7.360 9.773 -3.753 1022 HD21 LEU 124 HD21 LEU 124 5.397 7.387 -1.671 1023 HD22 LEU 124 HD22 LEU 124 5.204 6.195 -2.957 1024 HD23 LEU 124 HD23 LEU 124 4.353 7.737 -3.049 1025 H LEU 125 HN LEU 125 6.657 4.995 -6.094 1026 HA LEU 125 HA LEU 125 8.246 3.646 -4.112 1027 HB2 LEU 125 HB2 LEU 125 6.353 2.534 -6.179 1028 HB3 LEU 125 HB1 LEU 125 7.048 1.632 -4.846 1029 HG LEU 125 HG LEU 125 5.886 3.631 -3.466 1030 HD11 LEU 125 HD11 LEU 125 4.834 4.835 -5.138 1031 HD12 LEU 125 HD12 LEU 125 3.550 3.769 -4.567 1032 HD13 LEU 125 HD13 LEU 125 4.413 3.389 -6.057 1033 HD21 LEU 125 HD21 LEU 125 4.023 1.484 -4.252 1034 HD22 LEU 125 HD22 LEU 125 4.552 2.003 -2.652 1035 HD23 LEU 125 HD23 LEU 125 5.590 0.966 -3.630 1036 H ARG 126 HN ARG 126 8.335 3.970 -7.606 1037 HA ARG 126 HA ARG 126 9.955 1.844 -8.291 1038 HB2 ARG 126 HB2 ARG 126 8.900 3.679 -9.781 1039 HB3 ARG 126 HB1 ARG 126 10.390 4.567 -9.491 1040 HG2 ARG 126 HG2 ARG 126 11.410 2.201 -10.244 1041 HG3 ARG 126 HG1 ARG 126 9.893 2.179 -11.142 1042 HD2 ARG 126 HD2 ARG 126 10.873 4.748 -11.514 1043 HD3 ARG 126 HD1 ARG 126 12.303 3.721 -11.605 1044 HE ARG 126 HE ARG 126 10.075 2.786 -13.172 1045 HH11 ARG 126 HH11 ARG 126 12.917 4.812 -13.134 1046 HH12 ARG 126 HH12 ARG 126 13.109 4.788 -14.854 1047 HH21 ARG 126 HH21 ARG 126 10.327 2.754 -15.433 1048 HH22 ARG 126 HH22 ARG 126 11.638 3.619 -16.160 1049 H LYS 127 HN LYS 127 10.823 4.904 -6.811 1050 HA LYS 127 HA LYS 127 13.658 4.396 -6.950 1051 HB2 LYS 127 HB2 LYS 127 12.361 6.438 -5.163 1052 HB3 LYS 127 HB1 LYS 127 13.952 6.485 -5.910 1053 HG2 LYS 127 HG2 LYS 127 11.375 6.634 -7.449 1054 HG3 LYS 127 HG1 LYS 127 12.282 8.045 -6.900 1055 HD2 LYS 127 HD2 LYS 127 14.225 6.597 -8.142 1056 HD3 LYS 127 HD1 LYS 127 12.814 6.202 -9.124 1057 HE2 LYS 127 HE2 LYS 127 13.580 9.023 -8.406 1058 HE3 LYS 127 HE1 LYS 127 14.161 8.213 -9.860 1059 HZ1 LYS 127 HZ1 LYS 127 11.776 7.842 -10.442 1060 HZ2 LYS 127 HZ2 LYS 127 12.258 9.463 -10.454 1061 HZ3 LYS 127 HZ3 LYS 127 11.354 8.861 -9.158 1062 H SER 128 HN SER 128 11.271 4.643 -4.318 1063 HA SER 128 HA SER 128 12.875 3.908 -2.196 1064 HB2 SER 128 HB2 SER 128 10.771 4.630 -1.556 1065 HB3 SER 128 HB1 SER 128 9.950 3.654 -2.772 1066 HG SER 128 HG SER 128 10.277 1.844 -1.521 1067 H GLU 129 HN GLU 129 11.518 1.927 -4.715 1068 HA GLU 129 HA GLU 129 11.906 -0.577 -3.393 1069 HB2 GLU 129 HB2 GLU 129 10.271 -0.418 -5.165 1070 HB3 GLU 129 HB1 GLU 129 11.497 0.116 -6.305 1071 HG2 GLU 129 HG2 GLU 129 12.253 -2.398 -5.150 1072 HG3 GLU 129 HG1 GLU 129 10.627 -2.497 -5.820 1073 H ALA 130 HN ALA 130 13.587 0.856 -6.200 1074 HA ALA 130 HA ALA 130 15.719 -1.010 -6.095 1075 HB1 ALA 130 HB1 ALA 130 16.411 -0.104 -8.049 1076 HB2 ALA 130 HB2 ALA 130 16.110 1.551 -7.518 1077 HB3 ALA 130 HB3 ALA 130 14.766 0.533 -8.037 1078 H GLN 131 HN GLN 131 15.508 2.425 -5.162 1079 HA GLN 131 HA GLN 131 18.165 2.845 -4.507 1080 HB2 GLN 131 HB2 GLN 131 15.716 4.224 -4.125 1081 HB3 GLN 131 HB1 GLN 131 16.545 4.205 -2.579 1082 HG2 GLN 131 HG2 GLN 131 18.463 4.836 -4.527 1083 HG3 GLN 131 HG1 GLN 131 17.037 5.803 -4.887 1084 HE21 GLN 131 HE21 GLN 131 16.014 6.396 -2.497 1085 HE22 GLN 131 HE22 GLN 131 17.132 7.307 -1.546 1086 H ALA 132 HN ALA 132 15.548 1.688 -2.420 1087 HA ALA 132 HA ALA 132 17.220 1.281 -0.151 1088 HB1 ALA 132 HB1 ALA 132 15.283 -0.047 0.709 1089 HB2 ALA 132 HB2 ALA 132 14.482 0.229 -0.837 1090 HB3 ALA 132 HB3 ALA 132 14.880 1.594 0.206 1091 H LYS 133 HN LYS 133 16.528 -0.532 -2.994 1092 HA LYS 133 HA LYS 133 17.094 -3.134 -2.083 1093 HB2 LYS 133 HB2 LYS 133 16.218 -2.020 -4.428 1094 HB3 LYS 133 HB1 LYS 133 17.847 -2.512 -4.859 1095 HG2 LYS 133 HG2 LYS 133 16.027 -4.178 -5.335 1096 HG3 LYS 133 HG1 LYS 133 17.401 -4.782 -4.415 1097 HD2 LYS 133 HD2 LYS 133 15.361 -3.740 -2.666 1098 HD3 LYS 133 HD1 LYS 133 14.691 -4.956 -3.754 1099 HE2 LYS 133 HE2 LYS 133 17.000 -6.159 -3.019 1100 HE3 LYS 133 HE1 LYS 133 16.635 -5.241 -1.560 1101 HZ1 LYS 133 HZ1 LYS 133 14.701 -7.051 -2.896 1102 HZ2 LYS 133 HZ2 LYS 133 14.528 -6.305 -1.388 1103 HZ3 LYS 133 HZ3 LYS 133 15.687 -7.517 -1.603 1104 H LYS 134 HN LYS 134 19.166 -0.805 -3.814 1105 HA LYS 134 HA LYS 134 21.485 -2.365 -3.809 1106 HB2 LYS 134 HB2 LYS 134 22.606 -0.479 -4.592 1107 HB3 LYS 134 HB1 LYS 134 20.948 -0.204 -5.100 1108 HG2 LYS 134 HG2 LYS 134 20.654 1.216 -3.055 1109 HG3 LYS 134 HG1 LYS 134 22.394 1.077 -2.801 1110 HD2 LYS 134 HD2 LYS 134 21.800 3.149 -3.979 1111 HD3 LYS 134 HD1 LYS 134 22.814 2.096 -4.969 1112 HE2 LYS 134 HE2 LYS 134 21.225 1.857 -6.525 1113 HE3 LYS 134 HE1 LYS 134 19.965 1.596 -5.321 1114 HZ1 LYS 134 HZ1 LYS 134 20.851 4.088 -6.576 1115 HZ2 LYS 134 HZ2 LYS 134 20.290 4.164 -4.983 1116 HZ3 LYS 134 HZ3 LYS 134 19.285 3.564 -6.204 1117 H GLU 135 HN GLU 135 20.265 -0.073 -1.429 1118 HA GLU 135 HA GLU 135 22.613 -0.508 0.254 1119 HB2 GLU 135 HB2 GLU 135 20.964 1.100 1.741 1120 HB3 GLU 135 HB1 GLU 135 22.230 1.667 0.658 1121 HG2 GLU 135 HG2 GLU 135 20.672 2.097 -1.076 1122 HG3 GLU 135 HG1 GLU 135 19.387 1.247 -0.219 1123 H LYS 136 HN LYS 136 19.605 -1.922 -0.186 1124 HA LYS 136 HA LYS 136 18.210 -3.181 1.123 1125 HB2 LYS 136 HB2 LYS 136 20.857 -4.056 2.288 1126 HB3 LYS 136 HB1 LYS 136 19.361 -4.982 2.272 1127 HG2 LYS 136 HG2 LYS 136 19.487 -4.784 -0.276 1128 HG3 LYS 136 HG1 LYS 136 21.162 -4.292 -0.018 1129 HD2 LYS 136 HD2 LYS 136 21.418 -6.562 -0.280 1130 HD3 LYS 136 HD1 LYS 136 21.224 -6.461 1.471 1131 HE2 LYS 136 HE2 LYS 136 19.266 -7.552 1.433 1132 HE3 LYS 136 HE1 LYS 136 18.699 -6.679 0.009 1133 HZ1 LYS 136 HZ1 LYS 136 20.478 -9.054 0.070 1134 HZ2 LYS 136 HZ2 LYS 136 20.184 -8.142 -1.325 1135 HZ3 LYS 136 HZ3 LYS 136 18.912 -8.958 -0.566 1136 H LEU 137 HN LEU 137 17.682 -1.000 2.118 1137 HA LEU 137 HA LEU 137 18.571 0.053 4.433 1138 HB2 LEU 137 HB2 LEU 137 15.813 -0.197 3.303 1139 HB3 LEU 137 HB1 LEU 137 16.026 0.518 4.891 1140 HG LEU 137 HG LEU 137 17.221 1.513 2.305 1141 HD11 LEU 137 HD11 LEU 137 15.090 2.307 2.212 1142 HD12 LEU 137 HD12 LEU 137 15.819 3.566 3.209 1143 HD13 LEU 137 HD13 LEU 137 14.881 2.276 3.963 1144 HD21 LEU 137 HD21 LEU 137 17.695 3.489 4.037 1145 HD22 LEU 137 HD22 LEU 137 18.856 2.202 3.713 1146 HD23 LEU 137 HD23 LEU 137 17.820 2.117 5.138 1147 H ASN 138 HN ASN 138 15.488 -1.501 5.015 1148 HA ASN 138 HA ASN 138 16.734 -3.210 7.053 1149 HB2 ASN 138 HB2 ASN 138 14.714 -2.660 8.512 1150 HB3 ASN 138 HB1 ASN 138 15.921 -1.389 8.334 1151 HD21 ASN 138 HD21 ASN 138 12.820 -1.695 8.687 1152 HD22 ASN 138 HD22 ASN 138 12.205 -0.475 7.628 1153 H ILE 139 HN ILE 139 16.181 -5.257 6.787 1154 HA ILE 139 HA ILE 139 14.887 -7.124 6.480 1155 HB ILE 139 HB ILE 139 12.570 -5.469 5.532 1156 HG12 ILE 139 HG12 ILE 139 12.371 -6.139 8.333 1157 HG13 ILE 139 HG11 ILE 139 13.798 -5.150 8.048 1158 HG21 ILE 139 HG21 ILE 139 11.342 -7.334 5.799 1159 HG22 ILE 139 HG22 ILE 139 12.207 -7.824 7.255 1160 HG23 ILE 139 HG23 ILE 139 12.904 -8.142 5.666 1161 HD11 ILE 139 HD11 ILE 139 12.591 -3.322 7.536 1162 HD12 ILE 139 HD12 ILE 139 11.369 -4.142 8.508 1163 HD13 ILE 139 HD13 ILE 139 11.315 -4.249 6.747 1164 H TRP 140 HN TRP 140 16.391 -5.554 4.365 1165 HA TRP 140 HA TRP 140 14.984 -6.485 1.971 1166 HB2 TRP 140 HB2 TRP 140 17.435 -4.724 2.209 1167 HB3 TRP 140 HB1 TRP 140 16.619 -5.145 0.706 1168 HD1 TRP 140 HD1 TRP 140 15.910 -3.259 3.994 1169 HE1 TRP 140 HE1 TRP 140 14.206 -1.394 3.502 1170 HE3 TRP 140 HE3 TRP 140 14.948 -4.327 -0.908 1171 HZ2 TRP 140 HZ2 TRP 140 12.661 -0.499 1.324 1172 HZ3 TRP 140 HZ3 TRP 140 13.334 -2.922 -2.125 1173 HH2 TRP 140 HH2 TRP 140 12.216 -1.046 -1.032
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