NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26165 | 2kfs | 16188 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H MET 1 8.251 20.716 30.619 2 HA MET 1 HA MET 1 7.402 22.397 32.869 3 HB2 MET 1 HB2 MET 1 5.983 23.571 31.256 4 HB3 MET 1 HB3 MET 1 7.656 23.670 30.727 5 HG2 MET 1 HG2 MET 1 7.276 21.961 29.062 6 HG3 MET 1 HG3 MET 1 5.638 21.714 29.648 7 HE1 MET 1 HE1 MET 1 3.888 25.061 28.580 8 HE2 MET 1 HE2 MET 1 4.657 24.762 30.135 9 HE3 MET 1 HE3 MET 1 3.685 23.499 29.373 10 HA PRO 2 HA PRO 2 4.284 19.195 33.056 11 HB2 PRO 2 HB2 PRO 2 2.369 21.044 34.239 12 HB3 PRO 2 HB3 PRO 2 3.224 19.712 35.018 13 HG2 PRO 2 HG2 PRO 2 3.713 22.336 35.586 14 HG3 PRO 2 HG3 PRO 2 4.932 21.061 35.738 15 HD2 PRO 2 HD2 PRO 2 4.542 23.064 33.545 16 HD3 PRO 2 HD3 PRO 2 6.047 22.477 34.290 17 H GLY 3 H GLY 3 3.675 18.876 30.955 18 HA2 GLY 3 HA2 GLY 3 1.333 20.344 30.064 19 HA3 GLY 3 HA3 GLY 3 2.768 20.455 29.065 20 H ARG 4 H ARG 4 0.153 18.481 30.044 21 HA ARG 4 HA ARG 4 1.159 16.122 28.774 22 HB2 ARG 4 HB2 ARG 4 -1.552 16.789 29.898 23 HB3 ARG 4 HB3 ARG 4 -1.290 15.322 28.970 24 HG2 ARG 4 HG2 ARG 4 -1.172 14.745 31.270 25 HG3 ARG 4 HG3 ARG 4 0.462 14.678 30.631 26 HD2 ARG 4 HD2 ARG 4 0.481 15.716 32.806 27 HD3 ARG 4 HD3 ARG 4 0.897 16.913 31.576 28 HE ARG 4 HE ARG 4 -1.861 16.964 32.046 29 HH11 ARG 4 HH11 ARG 4 1.145 17.859 33.653 30 HH12 ARG 4 HH12 ARG 4 0.450 19.065 34.632 31 HH21 ARG 4 HH21 ARG 4 -2.840 18.619 33.385 32 HH22 ARG 4 HH22 ARG 4 -1.869 19.545 34.425 33 H ALA 5 H ALA 5 0.550 15.244 26.849 34 HA ALA 5 HA ALA 5 -0.400 17.186 24.911 35 HB1 ALA 5 HB1 ALA 5 0.891 14.480 24.505 36 HB2 ALA 5 HB2 ALA 5 1.711 16.039 24.416 37 HB3 ALA 5 HB3 ALA 5 0.475 15.624 23.229 38 HA PRO 6 HA PRO 6 -4.367 15.053 25.070 39 HB2 PRO 6 HB2 PRO 6 -5.668 16.664 23.348 40 HB3 PRO 6 HB3 PRO 6 -5.223 17.212 24.966 41 HG2 PRO 6 HG2 PRO 6 -3.842 17.722 22.358 42 HG3 PRO 6 HG3 PRO 6 -4.219 18.865 23.662 43 HD2 PRO 6 HD2 PRO 6 -1.779 17.726 23.327 44 HD3 PRO 6 HD3 PRO 6 -2.409 18.208 24.918 45 H GLY 7 H GLY 7 -2.356 13.894 23.477 46 HA2 GLY 7 HA2 GLY 7 -3.829 13.142 21.035 47 HA3 GLY 7 HA3 GLY 7 -2.068 13.211 21.118 48 H SER 8 H SER 8 -4.784 11.739 22.870 49 HA SER 8 HA SER 8 -3.127 9.581 23.747 50 HB2 SER 8 HB2 SER 8 -5.397 8.896 24.768 51 HB3 SER 8 HB3 SER 8 -4.618 10.361 25.373 52 HG SER 8 HG SER 8 -6.735 10.818 24.961 53 H THR 9 H THR 9 -5.624 10.180 21.441 54 HA THR 9 HA THR 9 -5.262 7.447 20.495 55 HB THR 9 HB THR 9 -7.759 9.136 20.182 56 HG1 THR 9 HG1 THR 9 -8.479 7.231 21.571 57 HG21 THR 9 HG21 THR 9 -7.302 7.492 18.352 58 HG22 THR 9 HG22 THR 9 -8.745 7.067 19.291 59 HG23 THR 9 HG23 THR 9 -7.217 6.222 19.557 60 H LEU 10 H LEU 10 -4.245 7.340 18.670 61 HA LEU 10 HA LEU 10 -3.861 9.640 17.004 62 HB2 LEU 10 HB2 LEU 10 -3.136 6.775 16.770 63 HB3 LEU 10 HB3 LEU 10 -2.661 7.969 15.568 64 HG LEU 10 HG LEU 10 -1.775 7.873 18.461 65 HD11 LEU 10 HD11 LEU 10 -0.724 6.196 17.097 66 HD12 LEU 10 HD12 LEU 10 0.440 7.489 17.441 67 HD13 LEU 10 HD13 LEU 10 -0.360 7.403 15.869 68 HD21 LEU 10 HD21 LEU 10 -1.988 10.192 17.744 69 HD22 LEU 10 HD22 LEU 10 -1.081 9.838 16.269 70 HD23 LEU 10 HD23 LEU 10 -0.288 9.741 17.837 71 H ALA 11 H ALA 11 -4.548 9.836 14.910 72 HA ALA 11 HA ALA 11 -7.082 8.536 14.391 73 HB1 ALA 11 HB1 ALA 11 -5.711 10.799 12.943 74 HB2 ALA 11 HB2 ALA 11 -6.985 10.965 14.156 75 HB3 ALA 11 HB3 ALA 11 -7.335 10.202 12.604 76 H ARG 12 H ARG 12 -6.567 6.552 13.780 77 HA ARG 12 HA ARG 12 -4.767 6.203 11.499 78 HB2 ARG 12 HB2 ARG 12 -4.817 3.762 12.190 79 HB3 ARG 12 HB3 ARG 12 -3.981 4.848 13.285 80 HG2 ARG 12 HG2 ARG 12 -5.573 4.637 14.926 81 HG3 ARG 12 HG3 ARG 12 -6.849 4.272 13.763 82 HD2 ARG 12 HD2 ARG 12 -4.582 2.407 14.387 83 HD3 ARG 12 HD3 ARG 12 -6.165 2.338 15.171 84 HE ARG 12 HE ARG 12 -6.263 2.389 12.314 85 HH11 ARG 12 HH11 ARG 12 -6.029 0.227 15.112 86 HH12 ARG 12 HH12 ARG 12 -6.767 -1.088 14.316 87 HH21 ARG 12 HH21 ARG 12 -7.293 0.643 11.282 88 HH22 ARG 12 HH22 ARG 12 -7.454 -0.861 12.075 89 H VAL 13 H VAL 13 -7.598 6.927 11.703 90 HA VAL 13 HA VAL 13 -8.545 5.087 9.693 91 HB VAL 13 HB VAL 13 -10.859 5.133 10.587 92 HG11 VAL 13 HG11 VAL 13 -10.565 3.595 12.470 93 HG12 VAL 13 HG12 VAL 13 -8.868 4.059 12.572 94 HG13 VAL 13 HG13 VAL 13 -9.468 3.223 11.138 95 HG21 VAL 13 HG21 VAL 13 -11.295 5.860 12.910 96 HG22 VAL 13 HG22 VAL 13 -10.800 7.199 11.872 97 HG23 VAL 13 HG23 VAL 13 -9.650 6.493 12.999 98 H GLY 14 H GLY 14 -9.554 6.059 8.077 99 HA2 GLY 14 HA2 GLY 14 -10.774 8.520 8.112 100 HA3 GLY 14 HA3 GLY 14 -9.085 8.735 7.638 101 H SER 15 H SER 15 -10.023 9.345 5.620 102 HA SER 15 HA SER 15 -11.000 7.090 4.060 103 HB2 SER 15 HB2 SER 15 -10.796 10.015 3.316 104 HB3 SER 15 HB3 SER 15 -11.590 8.753 2.370 105 HG SER 15 HG SER 15 -12.423 8.812 4.947 106 H ILE 16 H ILE 16 -9.334 5.880 3.474 107 HA ILE 16 HA ILE 16 -6.850 7.077 2.653 108 HB ILE 16 HB ILE 16 -7.722 4.151 2.786 109 HG12 ILE 16 HG12 ILE 16 -5.827 3.985 4.480 110 HG13 ILE 16 HG13 ILE 16 -5.726 5.733 4.436 111 HG21 ILE 16 HG21 ILE 16 -6.224 4.363 0.904 112 HG22 ILE 16 HG22 ILE 16 -5.432 3.492 2.218 113 HG23 ILE 16 HG23 ILE 16 -5.032 5.183 1.912 114 HD11 ILE 16 HD11 ILE 16 -8.092 4.107 5.350 115 HD12 ILE 16 HD12 ILE 16 -8.015 5.868 5.298 116 HD13 ILE 16 HD13 ILE 16 -6.950 4.968 6.379 117 HA PRO 17 HA PRO 17 -8.452 7.358 -1.491 118 HB2 PRO 17 HB2 PRO 17 -6.297 8.492 -2.627 119 HB3 PRO 17 HB3 PRO 17 -7.365 9.381 -1.537 120 HG2 PRO 17 HG2 PRO 17 -4.721 8.114 -0.971 121 HG3 PRO 17 HG3 PRO 17 -5.331 9.696 -0.454 122 HD2 PRO 17 HD2 PRO 17 -5.325 7.483 1.139 123 HD3 PRO 17 HD3 PRO 17 -6.505 8.797 1.300 124 H ALA 18 H ALA 18 -7.917 6.585 -3.611 125 HA ALA 18 HA ALA 18 -5.704 4.678 -3.788 126 HB1 ALA 18 HB1 ALA 18 -7.786 3.368 -3.615 127 HB2 ALA 18 HB2 ALA 18 -7.078 3.245 -5.224 128 HB3 ALA 18 HB3 ALA 18 -8.478 4.288 -4.961 129 H GLY 19 H GLY 19 -4.369 5.358 -5.376 130 HA2 GLY 19 HA2 GLY 19 -5.620 6.743 -7.623 131 HA3 GLY 19 HA3 GLY 19 -4.291 7.487 -6.762 132 H ASP 20 H ASP 20 -2.234 6.978 -7.316 133 HA ASP 20 HA ASP 20 -2.148 5.632 -9.880 134 HB2 ASP 20 HB2 ASP 20 -1.259 7.885 -9.797 135 HB3 ASP 20 HB3 ASP 20 -0.135 7.421 -8.533 136 H ASP 21 H ASP 21 -1.476 3.750 -10.146 137 HA ASP 21 HA ASP 21 -0.483 2.047 -8.187 138 HB2 ASP 21 HB2 ASP 21 -0.003 0.503 -10.136 139 HB3 ASP 21 HB3 ASP 21 -1.652 1.105 -10.054 140 H VAL 22 H VAL 22 1.422 1.944 -7.326 141 HA VAL 22 HA VAL 22 3.692 3.238 -8.589 142 HB VAL 22 HB VAL 22 3.497 1.958 -5.844 143 HG11 VAL 22 HG11 VAL 22 5.671 3.720 -6.988 144 HG12 VAL 22 HG12 VAL 22 5.805 1.988 -6.681 145 HG13 VAL 22 HG13 VAL 22 5.590 3.106 -5.334 146 HG21 VAL 22 HG21 VAL 22 3.442 4.287 -5.033 147 HG22 VAL 22 HG22 VAL 22 2.060 3.900 -6.058 148 HG23 VAL 22 HG23 VAL 22 3.400 4.847 -6.700 149 H LEU 23 H LEU 23 2.761 -0.020 -7.606 150 HA LEU 23 HA LEU 23 5.240 -1.060 -8.536 151 HB2 LEU 23 HB2 LEU 23 4.080 -3.331 -8.363 152 HB3 LEU 23 HB3 LEU 23 4.351 -2.445 -6.892 153 HG LEU 23 HG LEU 23 1.974 -1.891 -6.738 154 HD11 LEU 23 HD11 LEU 23 1.405 -1.775 -9.141 155 HD12 LEU 23 HD12 LEU 23 0.325 -2.865 -8.270 156 HD13 LEU 23 HD13 LEU 23 1.624 -3.520 -9.271 157 HD21 LEU 23 HD21 LEU 23 2.765 -3.941 -5.756 158 HD22 LEU 23 HD22 LEU 23 2.485 -4.803 -7.268 159 HD23 LEU 23 HD23 LEU 23 1.122 -4.142 -6.365 160 H ASP 24 H ASP 24 5.475 -2.555 -10.280 161 HA ASP 24 HA ASP 24 4.276 -1.506 -12.661 162 HB2 ASP 24 HB2 ASP 24 6.621 -2.230 -12.633 163 HB3 ASP 24 HB3 ASP 24 6.135 -3.859 -12.204 164 HA PRO 25 HA PRO 25 0.630 -4.093 -12.801 165 HB2 PRO 25 HB2 PRO 25 1.302 -4.401 -15.685 166 HB3 PRO 25 HB3 PRO 25 -0.232 -3.954 -14.926 167 HG2 PRO 25 HG2 PRO 25 1.248 -2.085 -16.050 168 HG3 PRO 25 HG3 PRO 25 0.471 -1.775 -14.487 169 HD2 PRO 25 HD2 PRO 25 3.329 -2.414 -15.083 170 HD3 PRO 25 HD3 PRO 25 2.646 -1.276 -13.900 171 H ASP 26 H ASP 26 3.674 -5.354 -14.050 172 HA ASP 26 HA ASP 26 2.619 -8.033 -14.344 173 HB2 ASP 26 HB2 ASP 26 4.485 -7.270 -15.785 174 HB3 ASP 26 HB3 ASP 26 5.510 -7.108 -14.368 175 H GLU 27 H GLU 27 3.632 -6.165 -11.738 176 HA GLU 27 HA GLU 27 4.734 -8.272 -10.151 177 HB2 GLU 27 HB2 GLU 27 3.613 -5.602 -9.253 178 HB3 GLU 27 HB3 GLU 27 4.614 -6.677 -8.293 179 HG2 GLU 27 HG2 GLU 27 5.443 -5.204 -10.778 180 HG3 GLU 27 HG3 GLU 27 5.901 -4.807 -9.123 181 HA PRO 28 HA PRO 28 1.013 -10.386 -8.994 182 HB2 PRO 28 HB2 PRO 28 2.360 -10.506 -6.329 183 HB3 PRO 28 HB3 PRO 28 1.624 -11.809 -7.270 184 HG2 PRO 28 HG2 PRO 28 4.242 -11.556 -7.197 185 HG3 PRO 28 HG3 PRO 28 3.428 -11.943 -8.724 186 HD2 PRO 28 HD2 PRO 28 4.590 -9.360 -7.799 187 HD3 PRO 28 HD3 PRO 28 4.576 -10.094 -9.419 188 H THR 29 H THR 29 -0.939 -9.753 -8.304 189 HA THR 29 HA THR 29 -1.177 -7.761 -6.204 190 HB THR 29 HB THR 29 -2.973 -6.681 -7.715 191 HG1 THR 29 HG1 THR 29 -1.340 -7.943 -9.683 192 HG21 THR 29 HG21 THR 29 -1.313 -5.175 -8.753 193 HG22 THR 29 HG22 THR 29 -0.038 -6.334 -8.378 194 HG23 THR 29 HG23 THR 29 -0.904 -5.520 -7.073 195 H TYR 30 H TYR 30 -3.312 -7.588 -5.369 196 HA TYR 30 HA TYR 30 -5.064 -9.924 -5.626 197 HB2 TYR 30 HB2 TYR 30 -4.296 -8.152 -3.344 198 HB3 TYR 30 HB3 TYR 30 -5.949 -8.743 -3.423 199 HD1 TYR 30 HD1 TYR 30 -5.907 -11.398 -4.157 200 HD2 TYR 30 HD2 TYR 30 -2.995 -9.329 -1.870 201 HE1 TYR 30 HE1 TYR 30 -5.268 -13.513 -3.110 202 HE2 TYR 30 HE2 TYR 30 -2.319 -11.445 -0.808 203 HH TYR 30 HH TYR 30 -3.213 -13.636 -0.367 204 H ASP 31 H ASP 31 -7.281 -9.355 -5.382 205 HA ASP 31 HA ASP 31 -7.994 -6.693 -6.376 206 HB2 ASP 31 HB2 ASP 31 -8.917 -9.377 -7.472 207 HB3 ASP 31 HB3 ASP 31 -9.626 -7.833 -7.909 208 H LEU 32 H LEU 32 -10.402 -6.423 -6.021 209 HA LEU 32 HA LEU 32 -10.942 -6.853 -3.344 210 HB2 LEU 32 HB2 LEU 32 -12.933 -6.234 -5.530 211 HB3 LEU 32 HB3 LEU 32 -13.277 -6.141 -3.818 212 HG LEU 32 HG LEU 32 -11.263 -4.434 -5.291 213 HD11 LEU 32 HD11 LEU 32 -12.836 -2.609 -4.878 214 HD12 LEU 32 HD12 LEU 32 -13.980 -3.754 -4.177 215 HD13 LEU 32 HD13 LEU 32 -13.551 -3.868 -5.883 216 HD21 LEU 32 HD21 LEU 32 -10.581 -4.803 -2.975 217 HD22 LEU 32 HD22 LEU 32 -12.192 -4.348 -2.414 218 HD23 LEU 32 HD23 LEU 32 -11.159 -3.153 -3.189 219 HA PRO 33 HA PRO 33 -13.955 -10.576 -4.397 220 HB2 PRO 33 HB2 PRO 33 -13.108 -11.964 -6.651 221 HB3 PRO 33 HB3 PRO 33 -14.515 -10.902 -6.592 222 HG2 PRO 33 HG2 PRO 33 -11.750 -10.339 -7.575 223 HG3 PRO 33 HG3 PRO 33 -13.308 -9.820 -8.247 224 HD2 PRO 33 HD2 PRO 33 -11.789 -8.140 -6.838 225 HD3 PRO 33 HD3 PRO 33 -13.559 -8.126 -6.677 226 H ARG 34 H ARG 34 -10.568 -10.564 -5.412 227 HA ARG 34 HA ARG 34 -10.065 -13.242 -4.577 228 HB2 ARG 34 HB2 ARG 34 -8.315 -11.020 -5.556 229 HB3 ARG 34 HB3 ARG 34 -7.586 -12.394 -4.750 230 HG2 ARG 34 HG2 ARG 34 -7.570 -12.565 -7.223 231 HG3 ARG 34 HG3 ARG 34 -8.373 -13.901 -6.419 232 HD2 ARG 34 HD2 ARG 34 -10.546 -13.002 -6.974 233 HD3 ARG 34 HD3 ARG 34 -9.815 -11.535 -7.612 234 HE ARG 34 HE ARG 34 -8.846 -12.894 -9.362 235 HH11 ARG 34 HH11 ARG 34 -11.433 -14.539 -7.561 236 HH12 ARG 34 HH12 ARG 34 -12.100 -15.303 -8.916 237 HH21 ARG 34 HH21 ARG 34 -9.733 -14.027 -11.261 238 HH22 ARG 34 HH22 ARG 34 -11.084 -15.033 -11.067 239 H VAL 35 H VAL 35 -9.589 -10.094 -3.066 240 HA VAL 35 HA VAL 35 -8.322 -11.281 -0.821 241 HB VAL 35 HB VAL 35 -9.722 -8.572 -0.899 242 HG11 VAL 35 HG11 VAL 35 -8.347 -7.995 1.055 243 HG12 VAL 35 HG12 VAL 35 -7.702 -9.638 1.076 244 HG13 VAL 35 HG13 VAL 35 -9.414 -9.361 1.385 245 HG21 VAL 35 HG21 VAL 35 -6.820 -9.261 -1.314 246 HG22 VAL 35 HG22 VAL 35 -7.469 -7.626 -1.178 247 HG23 VAL 35 HG23 VAL 35 -7.947 -8.656 -2.529 248 H ALA 36 H ALA 36 -11.609 -10.485 -1.606 249 HA ALA 36 HA ALA 36 -12.828 -11.166 0.805 250 HB1 ALA 36 HB1 ALA 36 -14.829 -11.611 -0.543 251 HB2 ALA 36 HB2 ALA 36 -13.847 -11.645 -2.009 252 HB3 ALA 36 HB3 ALA 36 -14.023 -10.143 -1.100 253 H GLU 37 H GLU 37 -11.830 -13.098 -1.925 254 HA GLU 37 HA GLU 37 -12.542 -15.660 -1.053 255 HB2 GLU 37 HB2 GLU 37 -10.524 -14.502 -2.860 256 HB3 GLU 37 HB3 GLU 37 -10.474 -16.213 -2.610 257 HG2 GLU 37 HG2 GLU 37 -12.906 -16.237 -3.385 258 HG3 GLU 37 HG3 GLU 37 -12.730 -14.518 -3.709 259 H LEU 38 H LEU 38 -9.550 -13.842 -0.680 260 HA LEU 38 HA LEU 38 -7.977 -15.793 0.518 261 HB2 LEU 38 HB2 LEU 38 -7.095 -13.763 -0.478 262 HB3 LEU 38 HB3 LEU 38 -7.870 -12.799 0.760 263 HG LEU 38 HG LEU 38 -6.413 -13.875 2.450 264 HD11 LEU 38 HD11 LEU 38 -5.038 -15.042 0.042 265 HD12 LEU 38 HD12 LEU 38 -5.897 -15.943 1.294 266 HD13 LEU 38 HD13 LEU 38 -4.411 -15.079 1.689 267 HD21 LEU 38 HD21 LEU 38 -5.040 -12.436 0.181 268 HD22 LEU 38 HD22 LEU 38 -4.372 -12.638 1.803 269 HD23 LEU 38 HD23 LEU 38 -5.848 -11.701 1.561 270 H LEU 39 H LEU 39 -9.868 -13.204 2.045 271 HA LEU 39 HA LEU 39 -9.175 -14.274 4.656 272 HB2 LEU 39 HB2 LEU 39 -10.809 -11.867 3.903 273 HB3 LEU 39 HB3 LEU 39 -10.373 -12.304 5.543 274 HG LEU 39 HG LEU 39 -8.470 -11.485 3.343 275 HD11 LEU 39 HD11 LEU 39 -9.807 -9.636 4.169 276 HD12 LEU 39 HD12 LEU 39 -8.133 -9.478 4.696 277 HD13 LEU 39 HD13 LEU 39 -9.366 -10.040 5.828 278 HD21 LEU 39 HD21 LEU 39 -6.760 -11.466 5.115 279 HD22 LEU 39 HD22 LEU 39 -7.417 -13.082 4.856 280 HD23 LEU 39 HD23 LEU 39 -7.937 -12.132 6.248 281 H GLY 40 H GLY 40 -11.637 -14.730 2.435 282 HA2 GLY 40 HA2 GLY 40 -13.511 -16.067 2.565 283 HA3 GLY 40 HA3 GLY 40 -13.109 -16.394 4.247 284 H VAL 41 H VAL 41 -13.416 -13.219 2.995 285 HA VAL 41 HA VAL 41 -15.835 -12.808 4.634 286 HB VAL 41 HB VAL 41 -15.052 -10.537 5.135 287 HG11 VAL 41 HG11 VAL 41 -13.155 -11.045 6.593 288 HG12 VAL 41 HG12 VAL 41 -12.968 -12.603 5.787 289 HG13 VAL 41 HG13 VAL 41 -14.431 -12.256 6.703 290 HG21 VAL 41 HG21 VAL 41 -12.623 -11.277 3.506 291 HG22 VAL 41 HG22 VAL 41 -12.727 -9.841 4.537 292 HG23 VAL 41 HG23 VAL 41 -13.803 -10.024 3.152 293 HA PRO 42 HA PRO 42 -17.643 -10.958 0.974 294 HB2 PRO 42 HB2 PRO 42 -19.011 -8.850 2.055 295 HB3 PRO 42 HB3 PRO 42 -19.587 -10.517 2.147 296 HG2 PRO 42 HG2 PRO 42 -18.086 -8.916 4.182 297 HG3 PRO 42 HG3 PRO 42 -19.501 -9.961 4.409 298 HD2 PRO 42 HD2 PRO 42 -17.046 -10.832 5.017 299 HD3 PRO 42 HD3 PRO 42 -18.244 -11.902 4.266 300 H VAL 43 H VAL 43 -17.540 -9.070 -0.342 301 HA VAL 43 HA VAL 43 -15.071 -7.736 -0.432 302 HB VAL 43 HB VAL 43 -17.668 -6.857 -1.739 303 HG11 VAL 43 HG11 VAL 43 -14.809 -6.262 -2.481 304 HG12 VAL 43 HG12 VAL 43 -15.987 -5.117 -1.848 305 HG13 VAL 43 HG13 VAL 43 -16.219 -5.826 -3.447 306 HG21 VAL 43 HG21 VAL 43 -16.930 -8.152 -3.683 307 HG22 VAL 43 HG22 VAL 43 -17.174 -9.165 -2.259 308 HG23 VAL 43 HG23 VAL 43 -15.538 -8.727 -2.764 309 H SER 44 H SER 44 -18.123 -6.819 0.916 310 HA SER 44 HA SER 44 -17.632 -4.130 1.431 311 HB2 SER 44 HB2 SER 44 -19.399 -6.123 2.824 312 HB3 SER 44 HB3 SER 44 -19.514 -4.370 3.052 313 HG SER 44 HG SER 44 -19.543 -4.581 0.545 314 H LYS 45 H LYS 45 -16.844 -7.013 3.390 315 HA LYS 45 HA LYS 45 -15.845 -5.456 5.544 316 HB2 LYS 45 HB2 LYS 45 -15.626 -8.375 4.886 317 HB3 LYS 45 HB3 LYS 45 -14.644 -7.681 6.172 318 HG2 LYS 45 HG2 LYS 45 -16.684 -6.917 7.309 319 HG3 LYS 45 HG3 LYS 45 -17.659 -7.619 6.025 320 HD2 LYS 45 HD2 LYS 45 -17.576 -9.053 8.024 321 HD3 LYS 45 HD3 LYS 45 -16.888 -9.851 6.621 322 HE2 LYS 45 HE2 LYS 45 -15.530 -10.304 8.560 323 HE3 LYS 45 HE3 LYS 45 -14.625 -9.293 7.447 324 HZ1 LYS 45 HZ1 LYS 45 -14.368 -8.585 9.721 325 HZ2 LYS 45 HZ2 LYS 45 -16.025 -8.324 9.893 326 HZ3 LYS 45 HZ3 LYS 45 -15.121 -7.382 8.830 327 H VAL 46 H VAL 46 -14.441 -6.771 2.657 328 HA VAL 46 HA VAL 46 -11.729 -6.243 3.225 329 HB VAL 46 HB VAL 46 -13.144 -6.058 0.539 330 HG11 VAL 46 HG11 VAL 46 -10.936 -6.450 -0.456 331 HG12 VAL 46 HG12 VAL 46 -10.215 -6.409 1.158 332 HG13 VAL 46 HG13 VAL 46 -10.982 -4.966 0.501 333 HG21 VAL 46 HG21 VAL 46 -12.346 -8.360 0.174 334 HG22 VAL 46 HG22 VAL 46 -13.457 -8.249 1.540 335 HG23 VAL 46 HG23 VAL 46 -11.724 -8.391 1.822 336 H ALA 47 H ALA 47 -14.268 -4.285 1.779 337 HA ALA 47 HA ALA 47 -12.778 -1.942 1.412 338 HB1 ALA 47 HB1 ALA 47 -15.738 -2.262 1.876 339 HB2 ALA 47 HB2 ALA 47 -14.921 -2.251 0.310 340 HB3 ALA 47 HB3 ALA 47 -14.956 -0.791 1.307 341 H GLN 48 H GLN 48 -14.534 -3.191 4.193 342 HA GLN 48 HA GLN 48 -14.364 -0.872 5.796 343 HB2 GLN 48 HB2 GLN 48 -14.598 -3.771 6.582 344 HB3 GLN 48 HB3 GLN 48 -14.505 -2.481 7.768 345 HG2 GLN 48 HG2 GLN 48 -16.632 -2.804 5.667 346 HG3 GLN 48 HG3 GLN 48 -16.783 -3.181 7.381 347 HE21 GLN 48 HE21 GLN 48 -16.905 -1.483 8.868 348 HE22 GLN 48 HE22 GLN 48 -17.259 0.136 8.377 349 H GLN 49 H GLN 49 -12.157 -3.575 5.384 350 HA GLN 49 HA GLN 49 -10.254 -2.884 7.327 351 HB2 GLN 49 HB2 GLN 49 -9.767 -4.122 4.611 352 HB3 GLN 49 HB3 GLN 49 -8.631 -4.130 5.950 353 HG2 GLN 49 HG2 GLN 49 -11.346 -5.427 5.979 354 HG3 GLN 49 HG3 GLN 49 -9.832 -6.244 5.619 355 HE21 GLN 49 HE21 GLN 49 -10.155 -7.642 7.370 356 HE22 GLN 49 HE22 GLN 49 -9.894 -7.161 8.998 357 H LEU 50 H LEU 50 -10.569 -1.970 3.999 358 HA LEU 50 HA LEU 50 -8.338 -0.270 3.769 359 HB2 LEU 50 HB2 LEU 50 -9.556 -1.154 1.845 360 HB3 LEU 50 HB3 LEU 50 -10.983 -0.262 2.307 361 HG LEU 50 HG LEU 50 -9.810 1.852 1.793 362 HD11 LEU 50 HD11 LEU 50 -7.518 1.148 2.202 363 HD12 LEU 50 HD12 LEU 50 -7.696 1.793 0.568 364 HD13 LEU 50 HD13 LEU 50 -7.596 0.052 0.823 365 HD21 LEU 50 HD21 LEU 50 -9.802 1.567 -0.644 366 HD22 LEU 50 HD22 LEU 50 -11.197 0.788 0.107 367 HD23 LEU 50 HD23 LEU 50 -9.825 -0.181 -0.431 368 H ARG 51 H ARG 51 -11.667 0.345 4.784 369 HA ARG 51 HA ARG 51 -11.388 3.171 5.113 370 HB2 ARG 51 HB2 ARG 51 -13.393 1.303 6.382 371 HB3 ARG 51 HB3 ARG 51 -13.508 3.056 6.380 372 HG2 ARG 51 HG2 ARG 51 -13.724 1.184 4.033 373 HG3 ARG 51 HG3 ARG 51 -15.011 2.134 4.762 374 HD2 ARG 51 HD2 ARG 51 -12.612 3.206 3.278 375 HD3 ARG 51 HD3 ARG 51 -14.261 3.100 2.677 376 HE ARG 51 HE ARG 51 -14.119 4.635 5.068 377 HH11 ARG 51 HH11 ARG 51 -13.497 4.837 1.588 378 HH12 ARG 51 HH12 ARG 51 -13.782 6.512 1.479 379 HH21 ARG 51 HH21 ARG 51 -14.496 6.934 4.936 380 HH22 ARG 51 HH22 ARG 51 -14.319 7.743 3.441 381 H GLU 52 H GLU 52 -10.595 0.447 7.123 382 HA GLU 52 HA GLU 52 -10.466 2.047 9.550 383 HB2 GLU 52 HB2 GLU 52 -9.829 -0.860 9.034 384 HB3 GLU 52 HB3 GLU 52 -9.719 -0.086 10.601 385 HG2 GLU 52 HG2 GLU 52 -12.235 -0.388 8.981 386 HG3 GLU 52 HG3 GLU 52 -11.757 -1.423 10.318 387 H GLY 53 H GLY 53 -8.518 1.629 6.963 388 HA2 GLY 53 HA2 GLY 53 -6.318 2.222 6.608 389 HA3 GLY 53 HA3 GLY 53 -6.219 2.654 8.309 390 H HIS 54 H HIS 54 -7.161 -0.496 7.105 391 HA HIS 54 HA HIS 54 -4.797 -1.635 8.415 392 HB2 HIS 54 HB2 HIS 54 -7.372 -2.915 7.496 393 HB3 HIS 54 HB3 HIS 54 -5.982 -3.857 7.992 394 HD1 HIS 54 HD1 HIS 54 -9.020 -3.270 9.342 395 HD2 HIS 54 HD2 HIS 54 -5.200 -2.438 10.723 396 HE1 HIS 54 HE1 HIS 54 -9.214 -3.084 11.840 397 H LEU 55 H LEU 55 -5.951 -0.858 5.331 398 HA LEU 55 HA LEU 55 -3.899 -2.426 4.064 399 HB2 LEU 55 HB2 LEU 55 -5.936 -3.882 4.397 400 HB3 LEU 55 HB3 LEU 55 -6.813 -2.781 3.368 401 HG LEU 55 HG LEU 55 -5.367 -3.392 1.480 402 HD11 LEU 55 HD11 LEU 55 -4.120 -5.316 3.457 403 HD12 LEU 55 HD12 LEU 55 -3.321 -3.930 2.710 404 HD13 LEU 55 HD13 LEU 55 -3.825 -5.295 1.721 405 HD21 LEU 55 HD21 LEU 55 -7.431 -4.602 1.839 406 HD22 LEU 55 HD22 LEU 55 -6.626 -5.691 2.969 407 HD23 LEU 55 HD23 LEU 55 -6.184 -5.717 1.271 408 H VAL 56 H VAL 56 -3.786 -1.765 1.712 409 HA VAL 56 HA VAL 56 -5.053 0.831 1.165 410 HB VAL 56 HB VAL 56 -2.138 0.170 0.571 411 HG11 VAL 56 HG11 VAL 56 -3.636 2.769 0.296 412 HG12 VAL 56 HG12 VAL 56 -3.127 1.720 -1.025 413 HG13 VAL 56 HG13 VAL 56 -1.918 2.526 -0.024 414 HG21 VAL 56 HG21 VAL 56 -1.545 1.828 2.261 415 HG22 VAL 56 HG22 VAL 56 -2.421 0.468 2.960 416 HG23 VAL 56 HG23 VAL 56 -3.248 2.001 2.685 417 H ALA 57 H ALA 57 -5.424 1.194 -1.077 418 HA ALA 57 HA ALA 57 -4.892 -1.047 -2.868 419 HB1 ALA 57 HB1 ALA 57 -7.169 -0.844 -3.754 420 HB2 ALA 57 HB2 ALA 57 -7.532 0.390 -2.551 421 HB3 ALA 57 HB3 ALA 57 -7.202 -1.263 -2.040 422 H VAL 58 H VAL 58 -4.749 -0.395 -5.048 423 HA VAL 58 HA VAL 58 -4.792 2.480 -5.573 424 HB VAL 58 HB VAL 58 -2.812 2.203 -7.130 425 HG11 VAL 58 HG11 VAL 58 -2.306 1.765 -4.199 426 HG12 VAL 58 HG12 VAL 58 -2.623 3.307 -4.986 427 HG13 VAL 58 HG13 VAL 58 -1.141 2.415 -5.362 428 HG21 VAL 58 HG21 VAL 58 -2.810 -0.235 -7.319 429 HG22 VAL 58 HG22 VAL 58 -2.449 -0.380 -5.598 430 HG23 VAL 58 HG23 VAL 58 -1.263 0.332 -6.690 431 H ARG 59 H ARG 59 -4.704 2.891 -8.015 432 HA ARG 59 HA ARG 59 -6.604 0.977 -9.201 433 HB2 ARG 59 HB2 ARG 59 -7.438 3.249 -8.430 434 HB3 ARG 59 HB3 ARG 59 -6.422 3.940 -9.681 435 HG2 ARG 59 HG2 ARG 59 -7.677 2.747 -11.380 436 HG3 ARG 59 HG3 ARG 59 -8.673 2.000 -10.130 437 HD2 ARG 59 HD2 ARG 59 -9.366 4.255 -9.394 438 HD3 ARG 59 HD3 ARG 59 -8.459 4.939 -10.743 439 HE ARG 59 HE ARG 59 -10.594 2.998 -11.210 440 HH11 ARG 59 HH11 ARG 59 -9.396 6.339 -11.552 441 HH12 ARG 59 HH12 ARG 59 -10.499 6.741 -12.781 442 HH21 ARG 59 HH21 ARG 59 -12.165 3.615 -12.883 443 HH22 ARG 59 HH22 ARG 59 -12.070 5.190 -13.538 444 H ARG 60 H ARG 60 -5.934 0.033 -10.917 445 HA ARG 60 HA ARG 60 -3.783 1.225 -12.542 446 HB2 ARG 60 HB2 ARG 60 -3.153 -1.130 -13.172 447 HB3 ARG 60 HB3 ARG 60 -2.947 -0.801 -11.458 448 HG2 ARG 60 HG2 ARG 60 -5.011 -1.980 -10.952 449 HG3 ARG 60 HG3 ARG 60 -5.304 -2.240 -12.665 450 HD2 ARG 60 HD2 ARG 60 -2.907 -3.318 -11.177 451 HD3 ARG 60 HD3 ARG 60 -4.393 -4.223 -11.452 452 HE ARG 60 HE ARG 60 -3.003 -3.156 -13.768 453 HH11 ARG 60 HH11 ARG 60 -3.832 -6.044 -11.809 454 HH12 ARG 60 HH12 ARG 60 -3.359 -7.135 -12.999 455 HH21 ARG 60 HH21 ARG 60 -2.322 -4.662 -15.346 456 HH22 ARG 60 HH22 ARG 60 -2.411 -6.336 -15.082 457 H ALA 61 H ALA 61 -4.581 1.957 -14.379 458 HA ALA 61 HA ALA 61 -5.677 2.225 -16.318 459 HB1 ALA 61 HB1 ALA 61 -6.414 -0.701 -16.136 460 HB2 ALA 61 HB2 ALA 61 -4.905 -0.078 -16.801 461 HB3 ALA 61 HB3 ALA 61 -6.438 0.299 -17.588 462 H GLY 62 H GLY 62 -7.335 1.216 -13.636 463 HA2 GLY 62 HA2 GLY 62 -9.465 2.742 -13.530 464 HA3 GLY 62 HA3 GLY 62 -9.990 1.581 -14.749 465 H GLY 63 H GLY 63 -8.173 -0.435 -13.230 466 HA2 GLY 63 HA2 GLY 63 -10.341 -1.422 -11.531 467 HA3 GLY 63 HA3 GLY 63 -8.950 -2.325 -12.110 468 H VAL 64 H VAL 64 -10.121 -2.000 -9.449 469 HA VAL 64 HA VAL 64 -8.023 -0.553 -8.021 470 HB VAL 64 HB VAL 64 -10.608 -1.770 -6.982 471 HG11 VAL 64 HG11 VAL 64 -8.641 0.062 -5.614 472 HG12 VAL 64 HG12 VAL 64 -8.899 -1.641 -5.250 473 HG13 VAL 64 HG13 VAL 64 -10.183 -0.469 -4.945 474 HG21 VAL 64 HG21 VAL 64 -11.049 0.097 -8.479 475 HG22 VAL 64 HG22 VAL 64 -9.936 1.118 -7.572 476 HG23 VAL 64 HG23 VAL 64 -11.421 0.543 -6.815 477 H VAL 65 H VAL 65 -6.405 -1.645 -7.203 478 HA VAL 65 HA VAL 65 -6.700 -4.493 -6.582 479 HB VAL 65 HB VAL 65 -4.311 -4.775 -7.429 480 HG11 VAL 65 HG11 VAL 65 -5.029 -5.155 -9.723 481 HG12 VAL 65 HG12 VAL 65 -6.469 -4.173 -9.447 482 HG13 VAL 65 HG13 VAL 65 -6.256 -5.701 -8.582 483 HG21 VAL 65 HG21 VAL 65 -3.609 -3.215 -9.189 484 HG22 VAL 65 HG22 VAL 65 -3.775 -2.399 -7.625 485 HG23 VAL 65 HG23 VAL 65 -5.037 -2.234 -8.851 486 H ILE 66 H ILE 66 -5.151 -5.298 -5.219 487 HA ILE 66 HA ILE 66 -3.890 -3.348 -3.409 488 HB ILE 66 HB ILE 66 -5.323 -5.941 -2.721 489 HG12 ILE 66 HG12 ILE 66 -6.065 -3.104 -1.987 490 HG13 ILE 66 HG13 ILE 66 -6.792 -3.996 -3.314 491 HG21 ILE 66 HG21 ILE 66 -3.973 -3.942 -0.903 492 HG22 ILE 66 HG22 ILE 66 -3.394 -5.566 -1.266 493 HG23 ILE 66 HG23 ILE 66 -4.901 -5.345 -0.373 494 HD11 ILE 66 HD11 ILE 66 -7.683 -5.614 -1.724 495 HD12 ILE 66 HD12 ILE 66 -8.216 -3.976 -1.350 496 HD13 ILE 66 HD13 ILE 66 -6.930 -4.720 -0.401 497 HA PRO 67 HA PRO 67 -0.381 -5.888 -4.842 498 HB2 PRO 67 HB2 PRO 67 0.899 -4.772 -2.419 499 HB3 PRO 67 HB3 PRO 67 1.461 -4.747 -4.093 500 HG2 PRO 67 HG2 PRO 67 0.517 -2.536 -2.952 501 HG3 PRO 67 HG3 PRO 67 0.146 -2.913 -4.642 502 HD2 PRO 67 HD2 PRO 67 -1.579 -3.192 -2.219 503 HD3 PRO 67 HD3 PRO 67 -2.005 -2.666 -3.861 504 H GLN 68 H GLN 68 -0.000 -7.975 -4.483 505 HA GLN 68 HA GLN 68 -0.969 -9.638 -2.524 506 HB2 GLN 68 HB2 GLN 68 1.549 -9.762 -4.131 507 HB3 GLN 68 HB3 GLN 68 1.063 -11.086 -3.084 508 HG2 GLN 68 HG2 GLN 68 -0.615 -10.021 -5.337 509 HG3 GLN 68 HG3 GLN 68 0.557 -11.314 -5.528 510 HE21 GLN 68 HE21 GLN 68 -2.242 -11.371 -5.969 511 HE22 GLN 68 HE22 GLN 68 -2.898 -12.583 -4.940 512 H VAL 69 H VAL 69 1.969 -7.821 -2.548 513 HA VAL 69 HA VAL 69 3.311 -9.071 -0.436 514 HB VAL 69 HB VAL 69 4.840 -7.151 -0.523 515 HG11 VAL 69 HG11 VAL 69 4.047 -8.324 -3.197 516 HG12 VAL 69 HG12 VAL 69 5.140 -9.057 -2.025 517 HG13 VAL 69 HG13 VAL 69 5.595 -7.559 -2.841 518 HG21 VAL 69 HG21 VAL 69 2.891 -6.110 -2.582 519 HG22 VAL 69 HG22 VAL 69 4.485 -5.420 -2.261 520 HG23 VAL 69 HG23 VAL 69 3.238 -5.388 -1.013 521 H PHE 70 H PHE 70 0.692 -6.896 -0.225 522 HA PHE 70 HA PHE 70 1.467 -5.767 2.304 523 HB2 PHE 70 HB2 PHE 70 -0.988 -5.620 0.599 524 HB3 PHE 70 HB3 PHE 70 -1.155 -5.240 2.310 525 HD1 PHE 70 HD1 PHE 70 1.250 -4.405 -0.449 526 HD2 PHE 70 HD2 PHE 70 -1.077 -3.002 2.825 527 HE1 PHE 70 HE1 PHE 70 2.057 -2.116 -0.845 528 HE2 PHE 70 HE2 PHE 70 -0.269 -0.730 2.449 529 HZ PHE 70 HZ PHE 70 1.286 -0.261 0.622 530 H PHE 71 H PHE 71 0.331 -8.700 1.273 531 HA PHE 71 HA PHE 71 -0.587 -9.415 3.958 532 HB2 PHE 71 HB2 PHE 71 -1.109 -10.747 1.290 533 HB3 PHE 71 HB3 PHE 71 -1.559 -11.441 2.840 534 HD1 PHE 71 HD1 PHE 71 -3.359 -10.471 4.153 535 HD2 PHE 71 HD2 PHE 71 -2.339 -8.934 0.322 536 HE1 PHE 71 HE1 PHE 71 -5.509 -9.286 4.062 537 HE2 PHE 71 HE2 PHE 71 -4.489 -7.745 0.222 538 HZ PHE 71 HZ PHE 71 -6.079 -7.925 2.095 539 H THR 72 H THR 72 0.382 -11.175 4.914 540 HA THR 72 HA THR 72 3.106 -11.624 4.222 541 HB THR 72 HB THR 72 2.980 -13.182 6.201 542 HG1 THR 72 HG1 THR 72 1.075 -13.688 6.987 543 HG21 THR 72 HG21 THR 72 1.841 -10.401 6.633 544 HG22 THR 72 HG22 THR 72 3.554 -10.792 6.503 545 HG23 THR 72 HG23 THR 72 2.613 -11.388 7.867 546 H ASN 73 H ASN 73 3.873 -14.031 4.339 547 HA ASN 73 HA ASN 73 2.881 -15.481 2.126 548 HB2 ASN 73 HB2 ASN 73 5.214 -15.552 3.040 549 HB3 ASN 73 HB3 ASN 73 4.611 -16.474 4.404 550 HD21 ASN 73 HD21 ASN 73 5.936 -18.205 3.929 551 HD22 ASN 73 HD22 ASN 73 5.651 -19.256 2.595 552 H SER 74 H SER 74 1.916 -15.331 5.392 553 HA SER 74 HA SER 74 0.510 -17.833 5.377 554 HB2 SER 74 HB2 SER 74 -0.165 -16.911 7.683 555 HB3 SER 74 HB3 SER 74 1.528 -17.347 7.422 556 HG SER 74 HG SER 74 1.302 -15.333 8.417 557 H GLY 75 H GLY 75 -0.088 -14.864 3.996 558 HA2 GLY 75 HA2 GLY 75 -1.978 -14.069 3.016 559 HA3 GLY 75 HA3 GLY 75 -2.849 -15.450 3.658 560 H GLN 76 H GLN 76 -1.052 -13.358 5.752 561 HA GLN 76 HA GLN 76 -3.595 -12.345 6.856 562 HB2 GLN 76 HB2 GLN 76 -2.214 -13.900 8.305 563 HB3 GLN 76 HB3 GLN 76 -0.930 -12.705 8.261 564 HG2 GLN 76 HG2 GLN 76 -2.516 -11.085 9.311 565 HG3 GLN 76 HG3 GLN 76 -3.657 -12.414 9.502 566 HE21 GLN 76 HE21 GLN 76 -3.639 -12.345 11.715 567 HE22 GLN 76 HE22 GLN 76 -2.273 -12.803 12.661 568 H VAL 77 H VAL 77 -3.465 -10.094 7.625 569 HA VAL 77 HA VAL 77 -1.813 -8.427 5.985 570 HB VAL 77 HB VAL 77 -3.513 -7.676 8.409 571 HG11 VAL 77 HG11 VAL 77 -2.390 -5.909 6.230 572 HG12 VAL 77 HG12 VAL 77 -1.840 -5.960 7.903 573 HG13 VAL 77 HG13 VAL 77 -3.468 -5.390 7.525 574 HG21 VAL 77 HG21 VAL 77 -4.852 -8.683 6.618 575 HG22 VAL 77 HG22 VAL 77 -4.189 -7.520 5.473 576 HG23 VAL 77 HG23 VAL 77 -5.214 -6.965 6.798 577 H VAL 78 H VAL 78 0.037 -7.356 6.579 578 HA VAL 78 HA VAL 78 1.665 -8.422 8.636 579 HB VAL 78 HB VAL 78 1.927 -5.751 7.275 580 HG11 VAL 78 HG11 VAL 78 3.400 -5.930 9.184 581 HG12 VAL 78 HG12 VAL 78 4.352 -5.986 7.701 582 HG13 VAL 78 HG13 VAL 78 4.024 -7.471 8.598 583 HG21 VAL 78 HG21 VAL 78 3.035 -8.399 6.362 584 HG22 VAL 78 HG22 VAL 78 3.389 -6.821 5.654 585 HG23 VAL 78 HG23 VAL 78 1.745 -7.461 5.592 586 H LYS 79 H LYS 79 1.823 -7.853 10.731 587 HA LYS 79 HA LYS 79 -0.290 -6.528 11.996 588 HB2 LYS 79 HB2 LYS 79 1.003 -8.253 13.099 589 HB3 LYS 79 HB3 LYS 79 2.427 -7.233 13.080 590 HG2 LYS 79 HG2 LYS 79 1.275 -5.640 14.576 591 HG3 LYS 79 HG3 LYS 79 -0.104 -6.740 14.643 592 HD2 LYS 79 HD2 LYS 79 1.284 -7.055 16.600 593 HD3 LYS 79 HD3 LYS 79 1.380 -8.487 15.578 594 HE2 LYS 79 HE2 LYS 79 3.528 -7.676 14.673 595 HE3 LYS 79 HE3 LYS 79 3.424 -6.259 15.721 596 HZ1 LYS 79 HZ1 LYS 79 3.651 -9.090 16.581 597 HZ2 LYS 79 HZ2 LYS 79 3.485 -7.777 17.632 598 HZ3 LYS 79 HZ3 LYS 79 4.849 -7.915 16.668 599 H SER 80 H SER 80 2.970 -5.321 11.370 600 HA SER 80 HA SER 80 2.280 -2.818 12.652 601 HB2 SER 80 HB2 SER 80 4.512 -3.840 13.051 602 HB3 SER 80 HB3 SER 80 4.907 -3.611 11.350 603 HG SER 80 HG SER 80 4.464 -1.322 11.761 604 H LEU 81 H LEU 81 1.603 -3.997 9.704 605 HA LEU 81 HA LEU 81 2.423 -1.872 8.079 606 HB2 LEU 81 HB2 LEU 81 2.043 -3.942 7.116 607 HB3 LEU 81 HB3 LEU 81 0.356 -4.040 7.609 608 HG LEU 81 HG LEU 81 1.451 -2.077 5.566 609 HD11 LEU 81 HD11 LEU 81 0.695 -3.683 3.887 610 HD12 LEU 81 HD12 LEU 81 0.254 -4.816 5.163 611 HD13 LEU 81 HD13 LEU 81 1.946 -4.387 4.910 612 HD21 LEU 81 HD21 LEU 81 -0.867 -1.990 4.798 613 HD22 LEU 81 HD22 LEU 81 -0.785 -1.559 6.504 614 HD23 LEU 81 HD23 LEU 81 -1.341 -3.164 6.027 615 HA PRO 82 HA PRO 82 -2.069 0.005 8.886 616 HB2 PRO 82 HB2 PRO 82 -2.441 -1.125 11.624 617 HB3 PRO 82 HB3 PRO 82 -3.652 -0.779 10.384 618 HG2 PRO 82 HG2 PRO 82 -2.930 -3.289 10.890 619 HG3 PRO 82 HG3 PRO 82 -3.219 -2.750 9.227 620 HD2 PRO 82 HD2 PRO 82 -0.635 -3.220 10.645 621 HD3 PRO 82 HD3 PRO 82 -1.094 -3.580 8.968 622 H GLY 83 H GLY 83 0.400 -0.794 11.158 623 HA2 GLY 83 HA2 GLY 83 0.329 1.528 12.797 624 HA3 GLY 83 HA3 GLY 83 1.697 0.433 12.619 625 H LEU 84 H LEU 84 2.205 0.678 9.879 626 HA LEU 84 HA LEU 84 3.603 3.141 9.828 627 HB2 LEU 84 HB2 LEU 84 4.480 2.523 7.699 628 HB3 LEU 84 HB3 LEU 84 4.313 1.022 8.566 629 HG LEU 84 HG LEU 84 2.025 0.929 7.242 630 HD11 LEU 84 HD11 LEU 84 2.203 3.090 6.176 631 HD12 LEU 84 HD12 LEU 84 2.219 1.825 4.960 632 HD13 LEU 84 HD13 LEU 84 3.720 2.630 5.410 633 HD21 LEU 84 HD21 LEU 84 4.678 0.274 5.940 634 HD22 LEU 84 HD22 LEU 84 3.118 -0.424 5.519 635 HD23 LEU 84 HD23 LEU 84 3.831 -0.744 7.102 636 H LEU 85 H LEU 85 0.634 1.986 8.435 637 HA LEU 85 HA LEU 85 0.020 4.238 6.909 638 HB2 LEU 85 HB2 LEU 85 -1.862 2.326 8.280 639 HB3 LEU 85 HB3 LEU 85 -2.320 3.467 7.032 640 HG LEU 85 HG LEU 85 -0.457 1.118 6.682 641 HD11 LEU 85 HD11 LEU 85 -2.232 0.200 5.304 642 HD12 LEU 85 HD12 LEU 85 -3.246 1.599 5.674 643 HD13 LEU 85 HD13 LEU 85 -2.780 0.485 6.958 644 HD21 LEU 85 HD21 LEU 85 -0.522 1.679 4.300 645 HD22 LEU 85 HD22 LEU 85 0.178 2.991 5.241 646 HD23 LEU 85 HD23 LEU 85 -1.482 3.114 4.658 647 H THR 86 H THR 86 -0.442 3.537 10.260 648 HA THR 86 HA THR 86 -2.151 5.663 10.964 649 HB THR 86 HB THR 86 0.042 4.414 12.653 650 HG1 THR 86 HG1 THR 86 -1.796 3.089 11.723 651 HG21 THR 86 HG21 THR 86 -2.387 6.029 13.478 652 HG22 THR 86 HG22 THR 86 -0.703 6.512 13.640 653 HG23 THR 86 HG23 THR 86 -1.330 5.161 14.590 654 H ILE 87 H ILE 87 1.412 5.556 11.020 655 HA ILE 87 HA ILE 87 1.611 8.256 11.807 656 HB ILE 87 HB ILE 87 3.331 6.759 12.516 657 HG12 ILE 87 HG12 ILE 87 4.094 9.135 11.923 658 HG13 ILE 87 HG13 ILE 87 5.348 7.929 12.153 659 HG21 ILE 87 HG21 ILE 87 3.965 6.120 9.677 660 HG22 ILE 87 HG22 ILE 87 3.258 5.074 10.899 661 HG23 ILE 87 HG23 ILE 87 4.930 5.617 11.066 662 HD11 ILE 87 HD11 ILE 87 4.324 8.953 9.513 663 HD12 ILE 87 HD12 ILE 87 5.591 7.744 9.723 664 HD13 ILE 87 HD13 ILE 87 5.855 9.389 10.294 665 H LEU 88 H LEU 88 1.904 6.691 8.658 666 HA LEU 88 HA LEU 88 2.502 9.088 7.278 667 HB2 LEU 88 HB2 LEU 88 1.485 6.431 6.362 668 HB3 LEU 88 HB3 LEU 88 1.496 7.784 5.261 669 HG LEU 88 HG LEU 88 3.414 6.389 4.868 670 HD11 LEU 88 HD11 LEU 88 5.229 7.967 5.069 671 HD12 LEU 88 HD12 LEU 88 4.282 8.934 6.193 672 HD13 LEU 88 HD13 LEU 88 3.746 8.744 4.520 673 HD21 LEU 88 HD21 LEU 88 4.213 6.904 7.712 674 HD22 LEU 88 HD22 LEU 88 5.162 6.067 6.487 675 HD23 LEU 88 HD23 LEU 88 3.641 5.364 7.053 676 H HIS 89 H HIS 89 -0.544 7.614 8.167 677 HA HIS 89 HA HIS 89 -2.232 9.270 6.627 678 HB2 HIS 89 HB2 HIS 89 -2.995 7.176 7.760 679 HB3 HIS 89 HB3 HIS 89 -2.807 7.975 9.313 680 HD1 HIS 89 HD1 HIS 89 -4.894 9.124 10.194 681 HD2 HIS 89 HD2 HIS 89 -5.042 8.397 6.103 682 HE1 HIS 89 HE1 HIS 89 -7.168 9.829 9.442 683 H ASP 90 H ASP 90 -0.871 9.576 9.849 684 HA ASP 90 HA ASP 90 -2.146 12.038 10.443 685 HB2 ASP 90 HB2 ASP 90 -1.252 10.598 12.223 686 HB3 ASP 90 HB3 ASP 90 0.379 10.845 11.617 687 H GLY 91 H GLY 91 0.770 11.160 8.815 688 HA2 GLY 91 HA2 GLY 91 1.767 13.855 8.577 689 HA3 GLY 91 HA3 GLY 91 2.397 12.431 7.761 690 H GLY 92 H GLY 92 -0.719 12.195 7.070 691 HA2 GLY 92 HA2 GLY 92 -2.172 12.918 5.448 692 HA3 GLY 92 HA3 GLY 92 -1.149 14.319 5.205 693 H TYR 93 H TYR 93 0.040 11.036 4.917 694 HA TYR 93 HA TYR 93 0.637 11.647 2.153 695 HB2 TYR 93 HB2 TYR 93 1.663 9.510 3.988 696 HB3 TYR 93 HB3 TYR 93 2.008 9.503 2.260 697 HD1 TYR 93 HD1 TYR 93 3.415 11.210 1.268 698 HD2 TYR 93 HD2 TYR 93 2.679 11.173 5.453 699 HE1 TYR 93 HE1 TYR 93 5.276 12.758 1.600 700 HE2 TYR 93 HE2 TYR 93 4.540 12.735 5.796 701 HH TYR 93 HH TYR 93 6.617 13.394 4.631 702 H ARG 94 H ARG 94 -0.251 10.825 0.490 703 HA ARG 94 HA ARG 94 -2.628 9.242 0.744 704 HB2 ARG 94 HB2 ARG 94 -2.928 9.629 -1.620 705 HB3 ARG 94 HB3 ARG 94 -2.423 11.133 -0.864 706 HG2 ARG 94 HG2 ARG 94 -0.123 10.682 -1.617 707 HG3 ARG 94 HG3 ARG 94 -0.711 9.258 -2.479 708 HD2 ARG 94 HD2 ARG 94 -0.543 11.012 -4.061 709 HD3 ARG 94 HD3 ARG 94 -2.259 10.812 -3.715 710 HE ARG 94 HE ARG 94 -1.606 12.736 -2.007 711 HH11 ARG 94 HH11 ARG 94 -1.009 12.370 -5.491 712 HH12 ARG 94 HH12 ARG 94 -0.794 14.034 -5.754 713 HH21 ARG 94 HH21 ARG 94 -1.269 15.057 -2.397 714 HH22 ARG 94 HH22 ARG 94 -0.938 15.559 -3.988 715 H ASP 95 H ASP 95 -2.946 7.455 -1.007 716 HA ASP 95 HA ASP 95 -1.615 5.150 -0.251 717 HB2 ASP 95 HB2 ASP 95 -2.743 4.155 -2.221 718 HB3 ASP 95 HB3 ASP 95 -3.827 5.176 -1.282 719 H THR 96 H THR 96 -1.207 7.110 -3.121 720 HA THR 96 HA THR 96 0.658 5.568 -4.438 721 HB THR 96 HB THR 96 0.257 8.582 -4.613 722 HG1 THR 96 HG1 THR 96 -1.418 6.517 -5.191 723 HG21 THR 96 HG21 THR 96 2.269 7.655 -5.768 724 HG22 THR 96 HG22 THR 96 1.069 8.311 -6.890 725 HG23 THR 96 HG23 THR 96 1.209 6.564 -6.653 726 H GLU 97 H GLU 97 1.029 8.131 -2.066 727 HA GLU 97 HA GLU 97 3.844 8.351 -2.211 728 HB2 GLU 97 HB2 GLU 97 1.896 9.073 -0.031 729 HB3 GLU 97 HB3 GLU 97 3.609 9.461 0.015 730 HG2 GLU 97 HG2 GLU 97 1.781 10.353 -2.184 731 HG3 GLU 97 HG3 GLU 97 2.082 11.307 -0.727 732 H ILE 98 H ILE 98 1.630 6.380 -0.284 733 HA ILE 98 HA ILE 98 3.473 5.413 1.636 734 HB ILE 98 HB ILE 98 1.147 3.849 0.482 735 HG12 ILE 98 HG12 ILE 98 0.191 5.932 1.237 736 HG13 ILE 98 HG13 ILE 98 -0.147 4.679 2.434 737 HG21 ILE 98 HG21 ILE 98 1.091 2.714 2.646 738 HG22 ILE 98 HG22 ILE 98 2.509 3.630 3.150 739 HG23 ILE 98 HG23 ILE 98 2.631 2.489 1.809 740 HD11 ILE 98 HD11 ILE 98 0.429 6.790 3.460 741 HD12 ILE 98 HD12 ILE 98 1.998 6.759 2.658 742 HD13 ILE 98 HD13 ILE 98 1.594 5.526 3.857 743 H MET 99 H MET 99 2.383 4.089 -1.439 744 HA MET 99 HA MET 99 4.162 1.874 -1.286 745 HB2 MET 99 HB2 MET 99 2.573 2.892 -3.628 746 HB3 MET 99 HB3 MET 99 3.411 1.349 -3.563 747 HG2 MET 99 HG2 MET 99 1.995 0.720 -1.644 748 HG3 MET 99 HG3 MET 99 1.110 2.228 -1.853 749 HE1 MET 99 HE1 MET 99 -1.523 -0.263 -3.076 750 HE2 MET 99 HE2 MET 99 -1.136 1.124 -2.051 751 HE3 MET 99 HE3 MET 99 -0.396 -0.443 -1.724 752 H ARG 100 H ARG 100 4.485 5.104 -2.365 753 HA ARG 100 HA ARG 100 6.322 4.919 -4.426 754 HB2 ARG 100 HB2 ARG 100 5.167 6.949 -3.758 755 HB3 ARG 100 HB3 ARG 100 6.048 6.977 -2.248 756 HG2 ARG 100 HG2 ARG 100 8.133 7.340 -3.505 757 HG3 ARG 100 HG3 ARG 100 7.189 7.376 -5.002 758 HD2 ARG 100 HD2 ARG 100 5.857 9.222 -4.118 759 HD3 ARG 100 HD3 ARG 100 6.807 9.188 -2.638 760 HE ARG 100 HE ARG 100 8.614 9.508 -4.661 761 HH11 ARG 100 HH11 ARG 100 5.742 11.290 -3.541 762 HH12 ARG 100 HH12 ARG 100 6.345 12.805 -4.005 763 HH21 ARG 100 HH21 ARG 100 9.445 11.623 -5.288 764 HH22 ARG 100 HH22 ARG 100 8.506 13.003 -4.994 765 H TRP 101 H TRP 101 7.120 5.642 -1.032 766 HA TRP 101 HA TRP 101 9.870 5.067 -1.449 767 HB2 TRP 101 HB2 TRP 101 10.013 5.196 1.102 768 HB3 TRP 101 HB3 TRP 101 9.473 6.640 0.261 769 HD1 TRP 101 HD1 TRP 101 7.069 7.498 0.746 770 HE1 TRP 101 HE1 TRP 101 5.290 6.925 2.479 771 HE3 TRP 101 HE3 TRP 101 9.009 3.079 2.478 772 HZ2 TRP 101 HZ2 TRP 101 4.775 4.871 4.378 773 HZ3 TRP 101 HZ3 TRP 101 7.824 1.907 4.241 774 HH2 TRP 101 HH2 TRP 101 5.757 2.765 5.176 775 H LEU 102 H LEU 102 7.201 3.198 -0.414 776 HA LEU 102 HA LEU 102 8.584 1.151 0.901 777 HB2 LEU 102 HB2 LEU 102 6.176 1.767 1.106 778 HB3 LEU 102 HB3 LEU 102 5.930 1.062 -0.462 779 HG LEU 102 HG LEU 102 6.345 -1.136 0.332 780 HD11 LEU 102 HD11 LEU 102 6.945 -1.554 2.687 781 HD12 LEU 102 HD12 LEU 102 7.100 0.184 2.952 782 HD13 LEU 102 HD13 LEU 102 8.197 -0.650 1.845 783 HD21 LEU 102 HD21 LEU 102 4.734 0.405 2.316 784 HD22 LEU 102 HD22 LEU 102 4.605 -1.333 2.031 785 HD23 LEU 102 HD23 LEU 102 4.139 -0.192 0.758 786 H PHE 103 H PHE 103 7.588 1.532 -2.467 787 HA PHE 103 HA PHE 103 8.645 -1.105 -3.054 788 HB2 PHE 103 HB2 PHE 103 7.042 0.842 -4.675 789 HB3 PHE 103 HB3 PHE 103 7.822 -0.550 -5.418 790 HD1 PHE 103 HD1 PHE 103 5.409 0.380 -2.722 791 HD2 PHE 103 HD2 PHE 103 6.773 -2.601 -5.432 792 HE1 PHE 103 HE1 PHE 103 3.471 -1.016 -2.160 793 HE2 PHE 103 HE2 PHE 103 4.839 -4.003 -4.869 794 HZ PHE 103 HZ PHE 103 3.178 -3.210 -3.243 795 H THR 104 H THR 104 10.003 1.833 -2.765 796 HA THR 104 HA THR 104 11.736 1.608 -5.076 797 HB THR 104 HB THR 104 11.815 3.566 -2.754 798 HG1 THR 104 HG1 THR 104 9.985 3.925 -4.013 799 HG21 THR 104 HG21 THR 104 14.010 3.313 -3.832 800 HG22 THR 104 HG22 THR 104 13.314 4.892 -4.195 801 HG23 THR 104 HG23 THR 104 13.276 3.612 -5.406 802 HA PRO 105 HA PRO 105 14.479 -1.060 -2.624 803 HB2 PRO 105 HB2 PRO 105 16.254 -0.681 -4.965 804 HB3 PRO 105 HB3 PRO 105 15.667 -2.185 -4.246 805 HG2 PRO 105 HG2 PRO 105 14.744 -1.322 -6.604 806 HG3 PRO 105 HG3 PRO 105 13.677 -2.126 -5.436 807 HD2 PRO 105 HD2 PRO 105 13.948 0.791 -6.060 808 HD3 PRO 105 HD3 PRO 105 12.493 -0.181 -5.733 809 H ASP 106 H ASP 106 15.884 -0.308 -1.177 810 HA ASP 106 HA ASP 106 16.934 2.360 -1.691 811 HB2 ASP 106 HB2 ASP 106 15.541 2.127 0.306 812 HB3 ASP 106 HB3 ASP 106 16.657 0.919 0.939 813 HA PRO 107 HA PRO 107 20.936 0.599 -2.307 814 HB2 PRO 107 HB2 PRO 107 22.353 2.923 -1.952 815 HB3 PRO 107 HB3 PRO 107 21.575 2.449 -3.462 816 HG2 PRO 107 HG2 PRO 107 20.612 4.330 -1.349 817 HG3 PRO 107 HG3 PRO 107 20.493 4.459 -3.113 818 HD2 PRO 107 HD2 PRO 107 18.416 3.721 -1.605 819 HD3 PRO 107 HD3 PRO 107 18.683 3.035 -3.225 820 H SER 108 H SER 108 20.177 2.548 0.537 821 HA SER 108 HA SER 108 22.532 1.479 1.832 822 HB2 SER 108 HB2 SER 108 21.794 3.008 3.743 823 HB3 SER 108 HB3 SER 108 22.311 3.790 2.252 824 HG SER 108 HG SER 108 19.593 3.249 2.332 825 H LEU 109 H LEU 109 19.663 0.259 1.218 826 HA LEU 109 HA LEU 109 19.338 -0.958 3.836 827 HB2 LEU 109 HB2 LEU 109 17.351 -0.015 2.767 828 HB3 LEU 109 HB3 LEU 109 17.598 -1.057 1.377 829 HG LEU 109 HG LEU 109 17.270 -3.019 2.880 830 HD11 LEU 109 HD11 LEU 109 17.837 -1.991 4.989 831 HD12 LEU 109 HD12 LEU 109 16.196 -2.633 5.043 832 HD13 LEU 109 HD13 LEU 109 16.463 -0.899 4.849 833 HD21 LEU 109 HD21 LEU 109 14.855 -2.765 3.033 834 HD22 LEU 109 HD22 LEU 109 15.486 -2.194 1.485 835 HD23 LEU 109 HD23 LEU 109 15.022 -1.031 2.741 836 H THR 110 H THR 110 20.077 -2.896 4.140 837 HA THR 110 HA THR 110 20.396 -4.702 1.888 838 HB THR 110 HB THR 110 22.441 -4.397 4.116 839 HG1 THR 110 HG1 THR 110 22.090 -2.895 2.081 840 HG21 THR 110 HG21 THR 110 23.795 -5.938 2.732 841 HG22 THR 110 HG22 THR 110 22.466 -6.071 1.584 842 HG23 THR 110 HG23 THR 110 22.278 -6.695 3.223 843 H ILE 111 H ILE 111 19.092 -6.263 2.261 844 HA ILE 111 HA ILE 111 18.618 -7.206 4.987 845 HB ILE 111 HB ILE 111 16.208 -7.496 4.350 846 HG12 ILE 111 HG12 ILE 111 16.924 -5.501 2.183 847 HG13 ILE 111 HG13 ILE 111 16.461 -7.173 1.925 848 HG21 ILE 111 HG21 ILE 111 17.243 -4.702 4.714 849 HG22 ILE 111 HG22 ILE 111 16.843 -5.888 5.964 850 HG23 ILE 111 HG23 ILE 111 15.566 -5.211 4.954 851 HD11 ILE 111 HD11 ILE 111 14.625 -5.690 1.426 852 HD12 ILE 111 HD12 ILE 111 14.736 -4.986 3.037 853 HD13 ILE 111 HD13 ILE 111 14.240 -6.669 2.846 854 H THR 112 H THR 112 17.560 -9.285 4.964 855 HA THR 112 HA THR 112 18.481 -10.858 2.739 856 HB THR 112 HB THR 112 18.857 -11.768 4.971 857 HG1 THR 112 HG1 THR 112 18.377 -13.222 3.274 858 HG21 THR 112 HG21 THR 112 16.979 -10.706 6.159 859 HG22 THR 112 HG22 THR 112 16.990 -12.450 6.448 860 HG23 THR 112 HG23 THR 112 15.847 -11.740 5.303 861 H ARG 113 H ARG 113 17.194 -11.913 1.409 862 HA ARG 113 HA ARG 113 14.734 -10.563 0.767 863 HB2 ARG 113 HB2 ARG 113 16.432 -11.590 -0.891 864 HB3 ARG 113 HB3 ARG 113 15.712 -13.137 -0.487 865 HG2 ARG 113 HG2 ARG 113 14.584 -12.511 -2.418 866 HG3 ARG 113 HG3 ARG 113 13.479 -12.030 -1.130 867 HD2 ARG 113 HD2 ARG 113 14.685 -9.741 -1.271 868 HD3 ARG 113 HD3 ARG 113 15.243 -10.311 -2.842 869 HE ARG 113 HE ARG 113 12.444 -10.104 -2.038 870 HH11 ARG 113 HH11 ARG 113 14.888 -9.777 -4.625 871 HH12 ARG 113 HH12 ARG 113 13.794 -9.104 -5.737 872 HH21 ARG 113 HH21 ARG 113 11.016 -9.147 -3.585 873 HH22 ARG 113 HH22 ARG 113 11.579 -8.743 -5.158 874 H ASP 114 H ASP 114 12.642 -11.302 1.171 875 HA ASP 114 HA ASP 114 12.325 -13.220 3.208 876 HB2 ASP 114 HB2 ASP 114 10.629 -11.524 3.050 877 HB3 ASP 114 HB3 ASP 114 10.299 -11.947 1.377 878 H GLY 115 H GLY 115 12.124 -15.301 3.183 879 HA2 GLY 115 HA2 GLY 115 11.359 -17.349 2.310 880 HA3 GLY 115 HA3 GLY 115 11.399 -16.649 0.693 881 H SER 116 H SER 116 14.105 -15.450 1.619 882 HA SER 116 HA SER 116 15.615 -17.829 0.898 883 HB2 SER 116 HB2 SER 116 15.525 -15.996 -0.816 884 HB3 SER 116 HB3 SER 116 16.272 -14.926 0.367 885 HG SER 116 HG SER 116 17.404 -16.807 -1.235 886 H ARG 117 H ARG 117 17.969 -17.160 1.435 887 HA ARG 117 HA ARG 117 18.157 -16.606 4.352 888 HB2 ARG 117 HB2 ARG 117 20.124 -18.083 4.317 889 HB3 ARG 117 HB3 ARG 117 18.707 -18.933 3.703 890 HG2 ARG 117 HG2 ARG 117 19.442 -18.532 1.416 891 HG3 ARG 117 HG3 ARG 117 20.830 -17.642 2.009 892 HD2 ARG 117 HD2 ARG 117 21.626 -19.703 3.094 893 HD3 ARG 117 HD3 ARG 117 20.260 -20.570 2.375 894 HE ARG 117 HE ARG 117 21.790 -19.063 0.501 895 HH11 ARG 117 HH11 ARG 117 21.495 -22.226 2.072 896 HH12 ARG 117 HH12 ARG 117 22.397 -23.069 0.909 897 HH21 ARG 117 HH21 ARG 117 23.075 -20.211 -1.091 898 HH22 ARG 117 HH22 ARG 117 23.329 -21.887 -0.934 899 H ASP 118 H ASP 118 19.133 -15.812 1.157 900 HA ASP 118 HA ASP 118 21.679 -14.717 1.840 901 HB2 ASP 118 HB2 ASP 118 20.170 -14.858 -0.767 902 HB3 ASP 118 HB3 ASP 118 21.749 -14.098 -0.604 903 H ALA 119 H ALA 119 22.328 -12.600 1.296 904 HA ALA 119 HA ALA 119 20.329 -10.653 2.136 905 HB1 ALA 119 HB1 ALA 119 22.347 -10.858 3.495 906 HB2 ALA 119 HB2 ALA 119 22.228 -9.264 2.744 907 HB3 ALA 119 HB3 ALA 119 23.334 -10.473 2.087 908 H VAL 120 H VAL 120 19.879 -8.903 0.966 909 HA VAL 120 HA VAL 120 21.177 -8.598 -1.642 910 HB VAL 120 HB VAL 120 18.243 -8.132 -1.000 911 HG11 VAL 120 HG11 VAL 120 19.713 -7.923 -3.627 912 HG12 VAL 120 HG12 VAL 120 19.065 -6.581 -2.688 913 HG13 VAL 120 HG13 VAL 120 17.971 -7.757 -3.413 914 HG21 VAL 120 HG21 VAL 120 17.776 -10.023 -2.502 915 HG22 VAL 120 HG22 VAL 120 18.728 -10.521 -1.104 916 HG23 VAL 120 HG23 VAL 120 19.508 -10.310 -2.671 917 H SER 121 H SER 121 22.224 -6.709 -1.676 918 HA SER 121 HA SER 121 21.381 -4.530 0.029 919 HB2 SER 121 HB2 SER 121 23.826 -4.999 -0.308 920 HB3 SER 121 HB3 SER 121 23.620 -4.704 -2.032 921 HG SER 121 HG SER 121 23.911 -2.967 0.032 922 H ASN 122 H ASN 122 20.396 -2.743 -0.710 923 HA ASN 122 HA ASN 122 19.058 -1.475 -1.933 924 HB2 ASN 122 HB2 ASN 122 20.996 -1.201 -3.499 925 HB3 ASN 122 HB3 ASN 122 20.460 -2.623 -4.378 926 HD21 ASN 122 HD21 ASN 122 18.759 -2.428 -5.825 927 HD22 ASN 122 HD22 ASN 122 18.078 -0.898 -6.258 928 H ALA 123 H ALA 123 17.624 -2.976 -0.971 929 HA ALA 123 HA ALA 123 16.108 -4.463 -2.996 930 HB1 ALA 123 HB1 ALA 123 15.437 -6.030 -1.236 931 HB2 ALA 123 HB2 ALA 123 16.433 -5.152 -0.075 932 HB3 ALA 123 HB3 ALA 123 17.190 -6.000 -1.424 933 H ARG 124 H ARG 124 13.820 -4.652 -2.460 934 HA ARG 124 HA ARG 124 12.802 -2.088 -1.751 935 HB2 ARG 124 HB2 ARG 124 10.590 -2.996 -2.312 936 HB3 ARG 124 HB3 ARG 124 11.755 -3.377 -3.569 937 HG2 ARG 124 HG2 ARG 124 11.940 -5.671 -2.646 938 HG3 ARG 124 HG3 ARG 124 10.720 -5.261 -1.449 939 HD2 ARG 124 HD2 ARG 124 9.132 -4.774 -3.296 940 HD3 ARG 124 HD3 ARG 124 10.356 -5.303 -4.450 941 HE ARG 124 HE ARG 124 9.840 -7.237 -2.420 942 HH11 ARG 124 HH11 ARG 124 8.707 -6.117 -5.631 943 HH12 ARG 124 HH12 ARG 124 7.896 -7.572 -5.970 944 HH21 ARG 124 HH21 ARG 124 8.676 -9.184 -2.915 945 HH22 ARG 124 HH22 ARG 124 7.878 -9.372 -4.394 946 HA PRO 125 HA PRO 125 12.385 -2.702 2.664 947 HB2 PRO 125 HB2 PRO 125 10.114 -0.808 2.318 948 HB3 PRO 125 HB3 PRO 125 11.485 -0.730 3.429 949 HG2 PRO 125 HG2 PRO 125 11.399 0.826 1.274 950 HG3 PRO 125 HG3 PRO 125 12.918 0.097 1.815 951 HD2 PRO 125 HD2 PRO 125 11.163 -0.665 -0.474 952 HD3 PRO 125 HD3 PRO 125 12.934 -0.691 -0.334 953 H VAL 126 H VAL 126 9.873 -3.214 0.403 954 HA VAL 126 HA VAL 126 7.771 -4.160 1.998 955 HB VAL 126 HB VAL 126 8.613 -5.169 -0.736 956 HG11 VAL 126 HG11 VAL 126 5.956 -5.316 0.669 957 HG12 VAL 126 HG12 VAL 126 7.061 -6.662 0.385 958 HG13 VAL 126 HG13 VAL 126 6.302 -5.835 -0.982 959 HG21 VAL 126 HG21 VAL 126 8.225 -2.736 -0.680 960 HG22 VAL 126 HG22 VAL 126 6.624 -3.040 -0.010 961 HG23 VAL 126 HG23 VAL 126 7.012 -3.585 -1.643 962 H ASP 127 H ASP 127 10.604 -5.826 0.655 963 HA ASP 127 HA ASP 127 9.877 -8.377 1.646 964 HB2 ASP 127 HB2 ASP 127 12.365 -7.271 0.435 965 HB3 ASP 127 HB3 ASP 127 12.457 -8.803 1.302 966 H ALA 128 H ALA 128 11.565 -5.712 2.955 967 HA ALA 128 HA ALA 128 12.720 -7.043 5.148 968 HB1 ALA 128 HB1 ALA 128 12.845 -4.824 6.208 969 HB2 ALA 128 HB2 ALA 128 11.770 -4.180 4.969 970 HB3 ALA 128 HB3 ALA 128 13.372 -4.755 4.530 971 H LEU 129 H LEU 129 9.630 -5.291 4.819 972 HA LEU 129 HA LEU 129 8.814 -5.912 7.486 973 HB2 LEU 129 HB2 LEU 129 6.666 -4.977 6.906 974 HB3 LEU 129 HB3 LEU 129 7.950 -3.933 6.352 975 HG LEU 129 HG LEU 129 7.547 -5.288 4.118 976 HD11 LEU 129 HD11 LEU 129 4.843 -5.322 5.413 977 HD12 LEU 129 HD12 LEU 129 5.865 -6.711 5.058 978 HD13 LEU 129 HD13 LEU 129 5.191 -5.751 3.725 979 HD21 LEU 129 HD21 LEU 129 5.856 -2.978 5.058 980 HD22 LEU 129 HD22 LEU 129 6.069 -3.463 3.373 981 HD23 LEU 129 HD23 LEU 129 7.450 -2.883 4.309 982 H HIS 130 H HIS 130 8.354 -7.491 4.428 983 HA HIS 130 HA HIS 130 6.290 -9.249 5.243 984 HB2 HIS 130 HB2 HIS 130 7.101 -8.568 2.866 985 HB3 HIS 130 HB3 HIS 130 8.319 -9.813 3.081 986 HD1 HIS 130 HD1 HIS 130 4.958 -9.318 1.843 987 HD2 HIS 130 HD2 HIS 130 7.077 -12.452 3.545 988 HE1 HIS 130 HE1 HIS 130 3.742 -11.416 1.193 989 H ALA 131 H ALA 131 9.669 -9.155 5.594 990 HA ALA 131 HA ALA 131 9.795 -11.911 6.649 991 HB1 ALA 131 HB1 ALA 131 11.447 -11.398 4.931 992 HB2 ALA 131 HB2 ALA 131 12.249 -11.684 6.480 993 HB3 ALA 131 HB3 ALA 131 12.014 -10.036 5.887 994 H HIS 132 H HIS 132 8.853 -9.282 7.897 995 HA HIS 132 HA HIS 132 8.665 -8.381 9.927 996 HB2 HIS 132 HB2 HIS 132 9.956 -10.960 10.841 997 HB3 HIS 132 HB3 HIS 132 9.253 -9.775 11.938 998 HD1 HIS 132 HD1 HIS 132 8.327 -12.879 10.559 999 HD2 HIS 132 HD2 HIS 132 6.411 -9.198 10.864 1000 HE1 HIS 132 HE1 HIS 132 5.881 -13.341 10.266 1001 H GLN 133 H GLN 133 10.991 -7.803 8.377 1002 HA GLN 133 HA GLN 133 12.915 -6.833 10.384 1003 HB2 GLN 133 HB2 GLN 133 12.976 -6.608 7.344 1004 HB3 GLN 133 HB3 GLN 133 14.314 -6.264 8.430 1005 HG2 GLN 133 HG2 GLN 133 14.471 -8.628 8.994 1006 HG3 GLN 133 HG3 GLN 133 13.088 -8.982 7.964 1007 HE21 GLN 133 HE21 GLN 133 13.361 -8.863 5.693 1008 HE22 GLN 133 HE22 GLN 133 14.906 -8.948 4.961 1009 H ALA 134 H ALA 134 10.168 -6.099 9.984 1010 HA ALA 134 HA ALA 134 9.506 -3.902 8.483 1011 HB1 ALA 134 HB1 ALA 134 7.541 -3.705 9.856 1012 HB2 ALA 134 HB2 ALA 134 8.293 -4.681 11.117 1013 HB3 ALA 134 HB3 ALA 134 7.905 -5.405 9.560 1014 H ARG 135 H ARG 135 11.209 -3.885 11.507 1015 HA ARG 135 HA ARG 135 10.487 -1.370 12.485 1016 HB2 ARG 135 HB2 ARG 135 13.179 -2.698 12.761 1017 HB3 ARG 135 HB3 ARG 135 12.534 -1.416 13.772 1018 HG2 ARG 135 HG2 ARG 135 10.773 -2.886 14.566 1019 HG3 ARG 135 HG3 ARG 135 11.374 -4.181 13.527 1020 HD2 ARG 135 HD2 ARG 135 13.527 -4.094 14.740 1021 HD3 ARG 135 HD3 ARG 135 12.847 -2.877 15.815 1022 HE ARG 135 HE ARG 135 11.461 -5.407 15.562 1023 HH11 ARG 135 HH11 ARG 135 13.548 -3.319 17.514 1024 HH12 ARG 135 HH12 ARG 135 13.323 -4.175 18.962 1025 HH21 ARG 135 HH21 ARG 135 11.181 -6.632 17.532 1026 HH22 ARG 135 HH22 ARG 135 11.965 -6.142 18.963 1027 H GLU 136 H GLU 136 12.973 -2.195 10.048 1028 HA GLU 136 HA GLU 136 14.119 0.361 9.844 1029 HB2 GLU 136 HB2 GLU 136 15.151 -1.693 9.077 1030 HB3 GLU 136 HB3 GLU 136 13.863 -1.932 7.905 1031 HG2 GLU 136 HG2 GLU 136 15.840 -1.182 6.871 1032 HG3 GLU 136 HG3 GLU 136 14.597 0.063 6.721 1033 H VAL 137 H VAL 137 11.326 -1.187 8.475 1034 HA VAL 137 HA VAL 137 10.796 0.753 6.444 1035 HB VAL 137 HB VAL 137 8.872 -1.229 7.705 1036 HG11 VAL 137 HG11 VAL 137 7.758 0.525 6.419 1037 HG12 VAL 137 HG12 VAL 137 7.607 -1.039 5.628 1038 HG13 VAL 137 HG13 VAL 137 8.771 0.146 5.024 1039 HG21 VAL 137 HG21 VAL 137 10.796 -2.417 6.859 1040 HG22 VAL 137 HG22 VAL 137 10.687 -1.554 5.325 1041 HG23 VAL 137 HG23 VAL 137 9.426 -2.690 5.781 1042 H VAL 138 H VAL 138 9.673 0.126 9.717 1043 HA VAL 138 HA VAL 138 7.818 2.230 9.923 1044 HB VAL 138 HB VAL 138 9.530 1.024 12.133 1045 HG11 VAL 138 HG11 VAL 138 7.798 1.840 13.676 1046 HG12 VAL 138 HG12 VAL 138 6.972 2.618 12.324 1047 HG13 VAL 138 HG13 VAL 138 8.579 3.164 12.805 1048 HG21 VAL 138 HG21 VAL 138 6.733 0.318 11.234 1049 HG22 VAL 138 HG22 VAL 138 7.573 -0.372 12.624 1050 HG23 VAL 138 HG23 VAL 138 8.184 -0.659 10.995 1051 H ARG 139 H ARG 139 11.264 2.051 10.663 1052 HA ARG 139 HA ARG 139 11.755 4.660 11.498 1053 HB2 ARG 139 HB2 ARG 139 13.475 2.997 11.670 1054 HB3 ARG 139 HB3 ARG 139 13.461 2.719 9.934 1055 HG2 ARG 139 HG2 ARG 139 14.230 5.100 9.659 1056 HG3 ARG 139 HG3 ARG 139 14.474 5.138 11.403 1057 HD2 ARG 139 HD2 ARG 139 16.092 3.364 11.262 1058 HD3 ARG 139 HD3 ARG 139 15.756 3.145 9.543 1059 HE ARG 139 HE ARG 139 16.717 5.720 10.506 1060 HH11 ARG 139 HH11 ARG 139 17.279 2.813 8.534 1061 HH12 ARG 139 HH12 ARG 139 18.687 3.449 7.800 1062 HH21 ARG 139 HH21 ARG 139 18.608 6.565 9.420 1063 HH22 ARG 139 HH22 ARG 139 19.433 5.595 8.288 1064 H ARG 140 H ARG 140 11.784 3.277 8.244 1065 HA ARG 140 HA ARG 140 12.595 5.609 6.879 1066 HB2 ARG 140 HB2 ARG 140 12.554 3.111 6.132 1067 HB3 ARG 140 HB3 ARG 140 10.907 3.455 5.643 1068 HG2 ARG 140 HG2 ARG 140 12.389 3.630 3.753 1069 HG3 ARG 140 HG3 ARG 140 11.735 5.221 4.146 1070 HD2 ARG 140 HD2 ARG 140 14.191 5.217 3.629 1071 HD3 ARG 140 HD3 ARG 140 13.788 5.888 5.202 1072 HE ARG 140 HE ARG 140 14.440 3.684 6.146 1073 HH11 ARG 140 HH11 ARG 140 15.826 4.648 3.036 1074 HH12 ARG 140 HH12 ARG 140 17.204 3.670 3.183 1075 HH21 ARG 140 HH21 ARG 140 16.364 2.421 6.407 1076 HH22 ARG 140 HH22 ARG 140 17.554 2.441 5.181 1077 H ALA 141 H ALA 141 9.481 4.300 7.780 1078 HA ALA 141 HA ALA 141 7.813 6.064 6.367 1079 HB1 ALA 141 HB1 ALA 141 6.990 3.982 7.285 1080 HB2 ALA 141 HB2 ALA 141 6.112 5.319 8.056 1081 HB3 ALA 141 HB3 ALA 141 7.412 4.500 8.911 1082 H GLN 142 H GLN 142 9.092 6.052 9.659 1083 HA GLN 142 HA GLN 142 7.967 8.442 10.558 1084 HB2 GLN 142 HB2 GLN 142 10.520 7.055 11.362 1085 HB3 GLN 142 HB3 GLN 142 9.869 8.446 12.214 1086 HG2 GLN 142 HG2 GLN 142 7.878 7.208 12.792 1087 HG3 GLN 142 HG3 GLN 142 8.423 5.839 11.829 1088 HE21 GLN 142 HE21 GLN 142 7.779 6.087 14.660 1089 HE22 GLN 142 HE22 GLN 142 9.160 5.509 15.522 1090 H ALA 143 H ALA 143 11.115 7.829 9.066 1091 HA ALA 143 HA ALA 143 12.022 10.487 9.092 1092 HB1 ALA 143 HB1 ALA 143 13.499 8.559 8.725 1093 HB2 ALA 143 HB2 ALA 143 13.672 9.768 7.452 1094 HB3 ALA 143 HB3 ALA 143 12.751 8.295 7.151 1095 H MET 144 H MET 144 9.920 8.802 6.909 1096 HA MET 144 HA MET 144 10.030 10.653 4.758 1097 HB2 MET 144 HB2 MET 144 9.274 8.333 4.482 1098 HB3 MET 144 HB3 MET 144 7.892 8.654 5.512 1099 HG2 MET 144 HG2 MET 144 7.190 8.638 3.216 1100 HG3 MET 144 HG3 MET 144 7.066 10.278 3.846 1101 HE1 MET 144 HE1 MET 144 7.990 10.745 0.042 1102 HE2 MET 144 HE2 MET 144 6.840 11.155 1.314 1103 HE3 MET 144 HE3 MET 144 6.966 9.497 0.751 1104 H ALA 145 H ALA 145 8.104 10.438 7.681 1105 HA ALA 145 HA ALA 145 6.567 12.752 6.734 1106 HB1 ALA 145 HB1 ALA 145 5.777 10.859 8.922 1107 HB2 ALA 145 HB2 ALA 145 5.237 10.757 7.246 1108 HB3 ALA 145 HB3 ALA 145 4.794 12.150 8.235 1109 H TYR 146 H TYR 146 7.932 11.572 9.857 1110 HA TYR 146 HA TYR 146 8.152 14.392 10.628 1111 HB2 TYR 146 HB2 TYR 146 7.236 12.092 12.367 1112 HB3 TYR 146 HB3 TYR 146 7.646 13.693 12.959 1113 HD1 TYR 146 HD1 TYR 146 6.169 15.581 12.538 1114 HD2 TYR 146 HD2 TYR 146 5.179 11.681 11.177 1115 HE1 TYR 146 HE1 TYR 146 3.857 16.300 12.183 1116 HE2 TYR 146 HE2 TYR 146 2.868 12.390 10.811 1117 HH TYR 146 HH TYR 146 1.375 14.108 11.711 Start of MODEL 2 1 H MET 1 H MET 1 -36.980 11.626 30.486 2 HA MET 1 HA MET 1 -35.839 9.859 31.487 3 HB2 MET 1 HB2 MET 1 -34.617 9.461 28.744 4 HB3 MET 1 HB3 MET 1 -33.936 8.763 30.194 5 HG2 MET 1 HG2 MET 1 -35.237 7.128 28.996 6 HG3 MET 1 HG3 MET 1 -35.992 7.474 30.545 7 HE1 MET 1 HE1 MET 1 -38.216 6.269 29.743 8 HE2 MET 1 HE2 MET 1 -37.449 5.908 28.198 9 HE3 MET 1 HE3 MET 1 -39.047 6.652 28.236 10 HA PRO 2 HA PRO 2 -33.121 13.463 31.762 11 HB2 PRO 2 HB2 PRO 2 -33.456 13.958 34.369 12 HB3 PRO 2 HB3 PRO 2 -34.695 14.400 33.187 13 HG2 PRO 2 HG2 PRO 2 -34.636 12.113 35.100 14 HG3 PRO 2 HG3 PRO 2 -36.011 13.086 34.553 15 HD2 PRO 2 HD2 PRO 2 -35.288 10.559 33.590 16 HD3 PRO 2 HD3 PRO 2 -36.403 11.689 32.801 17 H GLY 3 H GLY 3 -33.037 10.357 33.112 18 HA2 GLY 3 HA2 GLY 3 -30.386 10.818 34.281 19 HA3 GLY 3 HA3 GLY 3 -31.469 9.501 34.712 20 H ARG 4 H ARG 4 -31.031 7.645 33.892 21 HA ARG 4 HA ARG 4 -29.009 7.279 31.957 22 HB2 ARG 4 HB2 ARG 4 -29.596 4.888 32.072 23 HB3 ARG 4 HB3 ARG 4 -29.387 5.598 33.664 24 HG2 ARG 4 HG2 ARG 4 -31.842 5.762 33.874 25 HG3 ARG 4 HG3 ARG 4 -31.996 5.014 32.293 26 HD2 ARG 4 HD2 ARG 4 -30.917 3.004 33.099 27 HD3 ARG 4 HD3 ARG 4 -30.662 3.750 34.678 28 HE ARG 4 HE ARG 4 -33.379 3.718 33.814 29 HH11 ARG 4 HH11 ARG 4 -30.889 1.875 35.547 30 HH12 ARG 4 HH12 ARG 4 -32.006 0.932 36.424 31 HH21 ARG 4 HH21 ARG 4 -34.898 2.431 35.058 32 HH22 ARG 4 HH22 ARG 4 -34.335 1.272 36.159 33 H ALA 5 H ALA 5 -29.093 6.658 29.850 34 HA ALA 5 HA ALA 5 -31.531 6.204 28.456 35 HB1 ALA 5 HB1 ALA 5 -31.616 8.650 28.614 36 HB2 ALA 5 HB2 ALA 5 -31.308 8.154 26.951 37 HB3 ALA 5 HB3 ALA 5 -29.986 8.759 27.946 38 HA PRO 6 HA PRO 6 -28.390 4.190 25.965 39 HB2 PRO 6 HB2 PRO 6 -30.147 4.302 23.627 40 HB3 PRO 6 HB3 PRO 6 -29.652 2.894 24.566 41 HG2 PRO 6 HG2 PRO 6 -32.186 3.828 24.598 42 HG3 PRO 6 HG3 PRO 6 -31.436 3.052 26.002 43 HD2 PRO 6 HD2 PRO 6 -31.835 5.966 25.439 44 HD3 PRO 6 HD3 PRO 6 -32.068 5.059 26.954 45 H GLY 7 H GLY 7 -27.656 4.436 23.410 46 HA2 GLY 7 HA2 GLY 7 -27.760 7.142 22.493 47 HA3 GLY 7 HA3 GLY 7 -26.216 6.709 23.210 48 H SER 8 H SER 8 -27.583 7.100 20.374 49 HA SER 8 HA SER 8 -26.663 4.799 18.983 50 HB2 SER 8 HB2 SER 8 -27.201 7.605 17.952 51 HB3 SER 8 HB3 SER 8 -27.208 6.108 17.011 52 HG SER 8 HG SER 8 -29.294 7.070 17.819 53 H THR 9 H THR 9 -24.526 4.395 18.585 54 HA THR 9 HA THR 9 -22.613 6.332 19.482 55 HB THR 9 HB THR 9 -22.553 3.775 19.933 56 HG1 THR 9 HG1 THR 9 -20.880 5.106 20.490 57 HG21 THR 9 HG21 THR 9 -21.236 3.854 17.220 58 HG22 THR 9 HG22 THR 9 -22.789 3.079 17.550 59 HG23 THR 9 HG23 THR 9 -21.313 2.441 18.282 60 H LEU 10 H LEU 10 -20.492 6.331 18.088 61 HA LEU 10 HA LEU 10 -21.233 7.625 15.593 62 HB2 LEU 10 HB2 LEU 10 -18.654 7.334 17.030 63 HB3 LEU 10 HB3 LEU 10 -18.860 8.342 15.601 64 HG LEU 10 HG LEU 10 -20.020 8.782 18.362 65 HD11 LEU 10 HD11 LEU 10 -18.067 10.367 16.721 66 HD12 LEU 10 HD12 LEU 10 -17.683 9.378 18.130 67 HD13 LEU 10 HD13 LEU 10 -18.686 10.825 18.308 68 HD21 LEU 10 HD21 LEU 10 -20.989 10.847 17.470 69 HD22 LEU 10 HD22 LEU 10 -21.672 9.432 16.672 70 HD23 LEU 10 HD23 LEU 10 -20.448 10.405 15.854 71 H ALA 11 H ALA 11 -20.157 7.146 13.627 72 HA ALA 11 HA ALA 11 -19.107 4.409 13.449 73 HB1 ALA 11 HB1 ALA 11 -20.751 5.892 11.398 74 HB2 ALA 11 HB2 ALA 11 -21.342 4.607 12.446 75 HB3 ALA 11 HB3 ALA 11 -20.115 4.258 11.227 76 H ARG 12 H ARG 12 -16.993 4.665 13.269 77 HA ARG 12 HA ARG 12 -15.911 6.848 11.721 78 HB2 ARG 12 HB2 ARG 12 -13.657 5.874 12.474 79 HB3 ARG 12 HB3 ARG 12 -14.689 6.582 13.706 80 HG2 ARG 12 HG2 ARG 12 -15.372 4.396 14.459 81 HG3 ARG 12 HG3 ARG 12 -14.545 3.641 13.107 82 HD2 ARG 12 HD2 ARG 12 -13.101 5.273 15.186 83 HD3 ARG 12 HD3 ARG 12 -13.363 3.541 15.353 84 HE ARG 12 HE ARG 12 -11.480 4.876 13.637 85 HH11 ARG 12 HH11 ARG 12 -13.337 1.882 14.113 86 HH12 ARG 12 HH12 ARG 12 -12.269 0.911 13.208 87 HH21 ARG 12 HH21 ARG 12 -9.946 3.478 12.464 88 HH22 ARG 12 HH22 ARG 12 -10.296 1.820 12.302 89 H VAL 13 H VAL 13 -16.309 6.449 9.641 90 HA VAL 13 HA VAL 13 -14.939 4.116 8.573 91 HB VAL 13 HB VAL 13 -16.369 4.366 6.471 92 HG11 VAL 13 HG11 VAL 13 -16.858 2.635 8.105 93 HG12 VAL 13 HG12 VAL 13 -18.361 3.298 7.462 94 HG13 VAL 13 HG13 VAL 13 -17.799 3.779 9.063 95 HG21 VAL 13 HG21 VAL 13 -18.497 5.585 6.678 96 HG22 VAL 13 HG22 VAL 13 -17.113 6.674 6.824 97 HG23 VAL 13 HG23 VAL 13 -17.988 6.162 8.267 98 H GLY 14 H GLY 14 -12.990 4.993 8.547 99 HA2 GLY 14 HA2 GLY 14 -12.577 7.490 7.078 100 HA3 GLY 14 HA3 GLY 14 -11.431 6.728 8.176 101 H SER 15 H SER 15 -13.204 5.912 5.221 102 HA SER 15 HA SER 15 -11.188 4.140 4.359 103 HB2 SER 15 HB2 SER 15 -12.660 4.355 2.220 104 HB3 SER 15 HB3 SER 15 -13.265 3.500 3.635 105 HG SER 15 HG SER 15 -14.718 5.002 2.708 106 H ILE 16 H ILE 16 -9.448 4.589 3.316 107 HA ILE 16 HA ILE 16 -9.068 7.242 2.220 108 HB ILE 16 HB ILE 16 -7.138 4.899 2.393 109 HG12 ILE 16 HG12 ILE 16 -7.729 5.643 4.640 110 HG13 ILE 16 HG13 ILE 16 -6.081 6.140 4.270 111 HG21 ILE 16 HG21 ILE 16 -6.519 6.439 0.616 112 HG22 ILE 16 HG22 ILE 16 -5.368 6.545 1.947 113 HG23 ILE 16 HG23 ILE 16 -6.594 7.797 1.741 114 HD11 ILE 16 HD11 ILE 16 -8.536 7.894 4.241 115 HD12 ILE 16 HD12 ILE 16 -6.905 8.422 3.815 116 HD13 ILE 16 HD13 ILE 16 -7.263 7.888 5.456 117 HA PRO 17 HA PRO 17 -10.440 5.634 -1.768 118 HB2 PRO 17 HB2 PRO 17 -9.102 8.105 -2.730 119 HB3 PRO 17 HB3 PRO 17 -10.753 7.551 -3.005 120 HG2 PRO 17 HG2 PRO 17 -10.244 9.571 -1.343 121 HG3 PRO 17 HG3 PRO 17 -11.512 8.380 -0.992 122 HD2 PRO 17 HD2 PRO 17 -8.773 8.620 0.182 123 HD3 PRO 17 HD3 PRO 17 -10.314 8.178 0.953 124 H ALA 18 H ALA 18 -9.406 4.739 -3.548 125 HA ALA 18 HA ALA 18 -6.616 4.152 -3.109 126 HB1 ALA 18 HB1 ALA 18 -8.174 2.361 -3.728 127 HB2 ALA 18 HB2 ALA 18 -6.879 2.542 -4.904 128 HB3 ALA 18 HB3 ALA 18 -8.492 3.168 -5.268 129 H GLY 19 H GLY 19 -4.952 4.972 -4.237 130 HA2 GLY 19 HA2 GLY 19 -5.613 7.029 -6.165 131 HA3 GLY 19 HA3 GLY 19 -4.119 6.867 -5.255 132 H ASP 20 H ASP 20 -2.459 6.231 -6.401 133 HA ASP 20 HA ASP 20 -3.051 4.771 -8.877 134 HB2 ASP 20 HB2 ASP 20 -0.902 6.873 -8.499 135 HB3 ASP 20 HB3 ASP 20 -1.286 6.026 -9.989 136 H ASP 21 H ASP 21 -1.713 3.141 -9.432 137 HA ASP 21 HA ASP 21 -0.211 1.910 -7.374 138 HB2 ASP 21 HB2 ASP 21 0.357 0.169 -9.031 139 HB3 ASP 21 HB3 ASP 21 -1.360 0.533 -9.046 140 H VAL 22 H VAL 22 1.958 1.840 -6.982 141 HA VAL 22 HA VAL 22 3.671 3.305 -8.848 142 HB VAL 22 HB VAL 22 4.199 2.955 -5.870 143 HG11 VAL 22 HG11 VAL 22 5.514 4.551 -8.030 144 HG12 VAL 22 HG12 VAL 22 6.249 3.310 -7.002 145 HG13 VAL 22 HG13 VAL 22 5.782 4.882 -6.334 146 HG21 VAL 22 HG21 VAL 22 3.581 5.314 -5.639 147 HG22 VAL 22 HG22 VAL 22 2.224 4.348 -6.218 148 HG23 VAL 22 HG23 VAL 22 3.129 5.362 -7.341 149 H LEU 23 H LEU 23 3.001 0.311 -7.499 150 HA LEU 23 HA LEU 23 5.597 -0.837 -7.971 151 HB2 LEU 23 HB2 LEU 23 4.294 -3.053 -7.773 152 HB3 LEU 23 HB3 LEU 23 4.439 -2.074 -6.339 153 HG LEU 23 HG LEU 23 2.094 -1.414 -6.486 154 HD11 LEU 23 HD11 LEU 23 1.907 -3.151 -8.962 155 HD12 LEU 23 HD12 LEU 23 1.833 -1.395 -8.955 156 HD13 LEU 23 HD13 LEU 23 0.565 -2.332 -8.159 157 HD21 LEU 23 HD21 LEU 23 2.622 -3.458 -5.341 158 HD22 LEU 23 HD22 LEU 23 2.463 -4.372 -6.839 159 HD23 LEU 23 HD23 LEU 23 1.050 -3.585 -6.136 160 H ASP 24 H ASP 24 5.496 -2.856 -9.622 161 HA ASP 24 HA ASP 24 4.470 -1.601 -12.033 162 HB2 ASP 24 HB2 ASP 24 6.714 -2.829 -12.033 163 HB3 ASP 24 HB3 ASP 24 5.794 -4.325 -11.864 164 HA PRO 25 HA PRO 25 0.503 -3.540 -11.581 165 HB2 PRO 25 HB2 PRO 25 0.670 -3.582 -14.559 166 HB3 PRO 25 HB3 PRO 25 -0.652 -3.044 -13.517 167 HG2 PRO 25 HG2 PRO 25 0.930 -1.261 -14.687 168 HG3 PRO 25 HG3 PRO 25 0.390 -1.024 -13.015 169 HD2 PRO 25 HD2 PRO 25 3.059 -1.865 -14.047 170 HD3 PRO 25 HD3 PRO 25 2.636 -0.884 -12.628 171 H ASP 26 H ASP 26 3.109 -4.963 -13.416 172 HA ASP 26 HA ASP 26 1.790 -7.489 -13.814 173 HB2 ASP 26 HB2 ASP 26 3.423 -6.779 -15.449 174 HB3 ASP 26 HB3 ASP 26 4.651 -6.617 -14.204 175 H GLU 27 H GLU 27 3.569 -6.053 -11.213 176 HA GLU 27 HA GLU 27 4.660 -8.429 -10.119 177 HB2 GLU 27 HB2 GLU 27 4.037 -5.769 -8.815 178 HB3 GLU 27 HB3 GLU 27 4.845 -7.084 -7.977 179 HG2 GLU 27 HG2 GLU 27 6.596 -6.988 -9.792 180 HG3 GLU 27 HG3 GLU 27 5.823 -5.499 -10.322 181 HA PRO 28 HA PRO 28 1.366 -10.617 -8.236 182 HB2 PRO 28 HB2 PRO 28 2.840 -10.433 -5.650 183 HB3 PRO 28 HB3 PRO 28 2.184 -11.852 -6.470 184 HG2 PRO 28 HG2 PRO 28 4.784 -11.374 -6.538 185 HG3 PRO 28 HG3 PRO 28 3.942 -11.951 -7.990 186 HD2 PRO 28 HD2 PRO 28 4.909 -9.207 -7.327 187 HD3 PRO 28 HD3 PRO 28 4.908 -10.069 -8.877 188 H THR 29 H THR 29 -0.492 -9.571 -7.981 189 HA THR 29 HA THR 29 -0.790 -7.786 -5.699 190 HB THR 29 HB THR 29 -2.569 -6.683 -7.168 191 HG1 THR 29 HG1 THR 29 -2.758 -8.101 -8.830 192 HG21 THR 29 HG21 THR 29 0.331 -6.423 -8.008 193 HG22 THR 29 HG22 THR 29 -0.436 -5.570 -6.668 194 HG23 THR 29 HG23 THR 29 -0.934 -5.237 -8.325 195 H TYR 30 H TYR 30 -3.246 -7.503 -5.361 196 HA TYR 30 HA TYR 30 -4.759 -9.873 -5.956 197 HB2 TYR 30 HB2 TYR 30 -4.617 -8.364 -3.337 198 HB3 TYR 30 HB3 TYR 30 -5.978 -9.388 -3.769 199 HD1 TYR 30 HD1 TYR 30 -5.097 -11.784 -4.734 200 HD2 TYR 30 HD2 TYR 30 -3.138 -9.328 -1.891 201 HE1 TYR 30 HE1 TYR 30 -3.950 -13.745 -3.871 202 HE2 TYR 30 HE2 TYR 30 -1.963 -11.285 -1.000 203 HH TYR 30 HH TYR 30 -1.922 -14.301 -2.603 204 H ASP 31 H ASP 31 -7.096 -9.257 -5.847 205 HA ASP 31 HA ASP 31 -7.566 -6.505 -6.803 206 HB2 ASP 31 HB2 ASP 31 -8.727 -9.057 -8.000 207 HB3 ASP 31 HB3 ASP 31 -8.979 -7.424 -8.578 208 H LEU 32 H LEU 32 -9.990 -6.164 -6.631 209 HA LEU 32 HA LEU 32 -10.821 -6.579 -4.081 210 HB2 LEU 32 HB2 LEU 32 -12.612 -6.163 -6.465 211 HB3 LEU 32 HB3 LEU 32 -13.146 -6.025 -4.804 212 HG LEU 32 HG LEU 32 -11.059 -4.285 -6.122 213 HD11 LEU 32 HD11 LEU 32 -13.289 -3.831 -6.956 214 HD12 LEU 32 HD12 LEU 32 -12.739 -2.517 -5.917 215 HD13 LEU 32 HD13 LEU 32 -13.898 -3.692 -5.307 216 HD21 LEU 32 HD21 LEU 32 -10.586 -4.542 -3.753 217 HD22 LEU 32 HD22 LEU 32 -12.268 -4.174 -3.357 218 HD23 LEU 32 HD23 LEU 32 -11.235 -2.935 -4.068 219 HA PRO 33 HA PRO 33 -13.531 -10.497 -4.983 220 HB2 PRO 33 HB2 PRO 33 -12.750 -11.990 -7.163 221 HB3 PRO 33 HB3 PRO 33 -14.101 -10.858 -7.185 222 HG2 PRO 33 HG2 PRO 33 -11.290 -10.461 -8.126 223 HG3 PRO 33 HG3 PRO 33 -12.808 -9.969 -8.900 224 HD2 PRO 33 HD2 PRO 33 -11.302 -8.210 -7.556 225 HD3 PRO 33 HD3 PRO 33 -13.077 -8.147 -7.490 226 H ARG 34 H ARG 34 -10.180 -10.440 -6.065 227 HA ARG 34 HA ARG 34 -9.510 -13.042 -5.140 228 HB2 ARG 34 HB2 ARG 34 -8.322 -11.386 -6.876 229 HB3 ARG 34 HB3 ARG 34 -7.403 -10.983 -5.427 230 HG2 ARG 34 HG2 ARG 34 -6.204 -12.660 -6.595 231 HG3 ARG 34 HG3 ARG 34 -6.910 -13.408 -5.157 232 HD2 ARG 34 HD2 ARG 34 -8.789 -14.221 -6.540 233 HD3 ARG 34 HD3 ARG 34 -8.002 -13.530 -7.959 234 HE ARG 34 HE ARG 34 -6.781 -15.595 -6.286 235 HH11 ARG 34 HH11 ARG 34 -7.741 -14.460 -9.513 236 HH12 ARG 34 HH12 ARG 34 -7.011 -15.750 -10.341 237 HH21 ARG 34 HH21 ARG 34 -5.843 -17.380 -7.400 238 HH22 ARG 34 HH22 ARG 34 -5.938 -17.483 -9.106 239 H VAL 35 H VAL 35 -9.320 -9.817 -3.730 240 HA VAL 35 HA VAL 35 -7.819 -10.626 -1.459 241 HB VAL 35 HB VAL 35 -9.720 -8.253 -1.674 242 HG11 VAL 35 HG11 VAL 35 -7.503 -8.751 0.310 243 HG12 VAL 35 HG12 VAL 35 -9.229 -8.811 0.648 244 HG13 VAL 35 HG13 VAL 35 -8.474 -7.281 0.197 245 HG21 VAL 35 HG21 VAL 35 -7.779 -6.891 -2.144 246 HG22 VAL 35 HG22 VAL 35 -7.921 -8.173 -3.337 247 HG23 VAL 35 HG23 VAL 35 -6.728 -8.303 -2.038 248 H ALA 36 H ALA 36 -11.207 -10.269 -2.167 249 HA ALA 36 HA ALA 36 -12.282 -10.951 0.303 250 HB1 ALA 36 HB1 ALA 36 -13.576 -10.010 -1.562 251 HB2 ALA 36 HB2 ALA 36 -14.301 -11.501 -0.974 252 HB3 ALA 36 HB3 ALA 36 -13.362 -11.505 -2.470 253 H GLU 37 H GLU 37 -11.188 -12.890 -2.405 254 HA GLU 37 HA GLU 37 -11.893 -15.476 -1.579 255 HB2 GLU 37 HB2 GLU 37 -10.968 -14.629 -3.815 256 HB3 GLU 37 HB3 GLU 37 -9.434 -14.634 -3.035 257 HG2 GLU 37 HG2 GLU 37 -9.558 -17.019 -2.559 258 HG3 GLU 37 HG3 GLU 37 -11.098 -17.103 -3.411 259 H LEU 38 H LEU 38 -8.940 -13.578 -1.141 260 HA LEU 38 HA LEU 38 -7.379 -15.556 0.093 261 HB2 LEU 38 HB2 LEU 38 -6.483 -13.549 -1.008 262 HB3 LEU 38 HB3 LEU 38 -7.138 -12.562 0.283 263 HG LEU 38 HG LEU 38 -5.688 -13.912 1.858 264 HD11 LEU 38 HD11 LEU 38 -4.359 -14.715 -0.715 265 HD12 LEU 38 HD12 LEU 38 -5.211 -15.785 0.398 266 HD13 LEU 38 HD13 LEU 38 -3.722 -14.990 0.905 267 HD21 LEU 38 HD21 LEU 38 -3.702 -12.579 1.375 268 HD22 LEU 38 HD22 LEU 38 -5.176 -11.620 1.236 269 HD23 LEU 38 HD23 LEU 38 -4.349 -12.196 -0.217 270 H LEU 39 H LEU 39 -9.239 -12.863 1.428 271 HA LEU 39 HA LEU 39 -8.561 -13.634 4.121 272 HB2 LEU 39 HB2 LEU 39 -10.401 -11.510 3.069 273 HB3 LEU 39 HB3 LEU 39 -10.061 -11.752 4.774 274 HG LEU 39 HG LEU 39 -8.067 -10.937 2.655 275 HD11 LEU 39 HD11 LEU 39 -8.041 -8.794 3.829 276 HD12 LEU 39 HD12 LEU 39 -9.313 -9.371 4.906 277 HD13 LEU 39 HD13 LEU 39 -9.639 -9.162 3.185 278 HD21 LEU 39 HD21 LEU 39 -6.540 -10.573 4.556 279 HD22 LEU 39 HD22 LEU 39 -6.991 -12.270 4.395 280 HD23 LEU 39 HD23 LEU 39 -7.743 -11.274 5.637 281 H GLY 40 H GLY 40 -10.977 -14.463 1.907 282 HA2 GLY 40 HA2 GLY 40 -12.653 -16.026 2.117 283 HA3 GLY 40 HA3 GLY 40 -12.192 -16.235 3.803 284 H VAL 41 H VAL 41 -12.908 -13.193 2.397 285 HA VAL 41 HA VAL 41 -15.357 -12.996 4.045 286 HB VAL 41 HB VAL 41 -14.830 -10.643 4.461 287 HG11 VAL 41 HG11 VAL 41 -12.519 -12.427 5.173 288 HG12 VAL 41 HG12 VAL 41 -14.012 -12.216 6.092 289 HG13 VAL 41 HG13 VAL 41 -12.878 -10.877 5.931 290 HG21 VAL 41 HG21 VAL 41 -12.320 -11.149 2.866 291 HG22 VAL 41 HG22 VAL 41 -12.608 -9.700 3.841 292 HG23 VAL 41 HG23 VAL 41 -13.640 -10.059 2.458 293 HA PRO 42 HA PRO 42 -17.137 -11.330 0.251 294 HB2 PRO 42 HB2 PRO 42 -18.987 -9.587 1.184 295 HB3 PRO 42 HB3 PRO 42 -19.207 -11.335 1.327 296 HG2 PRO 42 HG2 PRO 42 -18.251 -9.376 3.378 297 HG3 PRO 42 HG3 PRO 42 -19.402 -10.713 3.559 298 HD2 PRO 42 HD2 PRO 42 -16.815 -10.889 4.321 299 HD3 PRO 42 HD3 PRO 42 -17.736 -12.289 3.742 300 H VAL 43 H VAL 43 -17.381 -9.285 -0.940 301 HA VAL 43 HA VAL 43 -15.137 -7.628 -0.792 302 HB VAL 43 HB VAL 43 -17.762 -7.032 -2.222 303 HG11 VAL 43 HG11 VAL 43 -15.004 -5.906 -2.717 304 HG12 VAL 43 HG12 VAL 43 -16.367 -5.030 -2.019 305 HG13 VAL 43 HG13 VAL 43 -16.439 -5.587 -3.691 306 HG21 VAL 43 HG21 VAL 43 -15.257 -8.364 -3.245 307 HG22 VAL 43 HG22 VAL 43 -16.689 -7.989 -4.204 308 HG23 VAL 43 HG23 VAL 43 -16.780 -9.179 -2.901 309 H SER 44 H SER 44 -18.309 -7.283 0.585 310 HA SER 44 HA SER 44 -18.279 -4.626 1.364 311 HB2 SER 44 HB2 SER 44 -20.245 -6.112 1.543 312 HB3 SER 44 HB3 SER 44 -19.464 -6.983 2.864 313 HG SER 44 HG SER 44 -20.328 -5.540 4.107 314 H LYS 45 H LYS 45 -16.861 -7.462 3.077 315 HA LYS 45 HA LYS 45 -15.997 -5.837 5.251 316 HB2 LYS 45 HB2 LYS 45 -15.182 -8.627 4.479 317 HB3 LYS 45 HB3 LYS 45 -14.490 -7.786 5.859 318 HG2 LYS 45 HG2 LYS 45 -16.765 -7.547 6.813 319 HG3 LYS 45 HG3 LYS 45 -17.401 -8.473 5.456 320 HD2 LYS 45 HD2 LYS 45 -17.155 -9.896 7.413 321 HD3 LYS 45 HD3 LYS 45 -16.028 -10.406 6.161 322 HE2 LYS 45 HE2 LYS 45 -14.951 -10.462 8.312 323 HE3 LYS 45 HE3 LYS 45 -14.230 -9.191 7.340 324 HZ1 LYS 45 HZ1 LYS 45 -14.601 -8.504 9.602 325 HZ2 LYS 45 HZ2 LYS 45 -16.254 -8.796 9.486 326 HZ3 LYS 45 HZ3 LYS 45 -15.533 -7.563 8.568 327 H VAL 46 H VAL 46 -14.599 -6.789 2.242 328 HA VAL 46 HA VAL 46 -11.944 -5.813 2.704 329 HB VAL 46 HB VAL 46 -13.506 -5.813 0.092 330 HG11 VAL 46 HG11 VAL 46 -10.527 -5.725 0.574 331 HG12 VAL 46 HG12 VAL 46 -11.536 -4.385 0.031 332 HG13 VAL 46 HG13 VAL 46 -11.319 -5.800 -1.006 333 HG21 VAL 46 HG21 VAL 46 -13.415 -8.053 1.041 334 HG22 VAL 46 HG22 VAL 46 -11.667 -7.921 1.227 335 HG23 VAL 46 HG23 VAL 46 -12.382 -7.952 -0.385 336 H ALA 47 H ALA 47 -14.857 -4.232 1.570 337 HA ALA 47 HA ALA 47 -13.755 -1.671 1.253 338 HB1 ALA 47 HB1 ALA 47 -15.961 -2.303 0.373 339 HB2 ALA 47 HB2 ALA 47 -16.074 -0.863 1.388 340 HB3 ALA 47 HB3 ALA 47 -16.580 -2.430 2.017 341 H GLN 48 H GLN 48 -15.054 -3.361 4.028 342 HA GLN 48 HA GLN 48 -15.000 -1.179 5.835 343 HB2 GLN 48 HB2 GLN 48 -14.869 -4.128 6.407 344 HB3 GLN 48 HB3 GLN 48 -15.053 -2.893 7.636 345 HG2 GLN 48 HG2 GLN 48 -17.164 -2.196 6.528 346 HG3 GLN 48 HG3 GLN 48 -16.979 -3.575 5.443 347 HE21 GLN 48 HE21 GLN 48 -17.556 -2.568 8.674 348 HE22 GLN 48 HE22 GLN 48 -18.170 -4.062 9.280 349 H GLN 49 H GLN 49 -12.609 -3.576 4.950 350 HA GLN 49 HA GLN 49 -10.661 -3.082 6.923 351 HB2 GLN 49 HB2 GLN 49 -10.067 -3.648 3.997 352 HB3 GLN 49 HB3 GLN 49 -9.019 -3.994 5.363 353 HG2 GLN 49 HG2 GLN 49 -11.667 -5.323 4.804 354 HG3 GLN 49 HG3 GLN 49 -10.082 -6.006 4.458 355 HE21 GLN 49 HE21 GLN 49 -8.920 -6.866 6.099 356 HE22 GLN 49 HE22 GLN 49 -9.543 -7.106 7.689 357 H LEU 50 H LEU 50 -11.208 -1.639 3.791 358 HA LEU 50 HA LEU 50 -9.232 0.343 3.838 359 HB2 LEU 50 HB2 LEU 50 -11.678 -0.242 2.319 360 HB3 LEU 50 HB3 LEU 50 -11.121 1.426 2.214 361 HG LEU 50 HG LEU 50 -10.383 0.123 0.305 362 HD11 LEU 50 HD11 LEU 50 -8.901 1.858 1.067 363 HD12 LEU 50 HD12 LEU 50 -7.982 0.506 0.408 364 HD13 LEU 50 HD13 LEU 50 -8.097 0.725 2.152 365 HD21 LEU 50 HD21 LEU 50 -10.394 -2.117 1.295 366 HD22 LEU 50 HD22 LEU 50 -9.000 -1.691 2.286 367 HD23 LEU 50 HD23 LEU 50 -8.842 -1.779 0.531 368 H ARG 51 H ARG 51 -12.552 0.315 4.982 369 HA ARG 51 HA ARG 51 -12.649 3.081 5.668 370 HB2 ARG 51 HB2 ARG 51 -14.449 0.803 6.521 371 HB3 ARG 51 HB3 ARG 51 -14.761 2.502 6.865 372 HG2 ARG 51 HG2 ARG 51 -14.915 3.019 4.554 373 HG3 ARG 51 HG3 ARG 51 -14.402 1.390 4.108 374 HD2 ARG 51 HD2 ARG 51 -16.518 0.583 5.218 375 HD3 ARG 51 HD3 ARG 51 -16.999 2.283 5.338 376 HE ARG 51 HE ARG 51 -16.162 1.838 2.749 377 HH11 ARG 51 HH11 ARG 51 -19.007 1.075 4.752 378 HH12 ARG 51 HH12 ARG 51 -19.940 0.586 3.418 379 HH21 ARG 51 HH21 ARG 51 -17.477 1.178 0.962 380 HH22 ARG 51 HH22 ARG 51 -19.068 0.663 1.213 381 H GLU 52 H GLU 52 -11.387 0.325 7.294 382 HA GLU 52 HA GLU 52 -11.397 1.642 9.876 383 HB2 GLU 52 HB2 GLU 52 -10.102 -0.886 8.856 384 HB3 GLU 52 HB3 GLU 52 -9.902 -0.299 10.495 385 HG2 GLU 52 HG2 GLU 52 -12.539 -1.030 9.244 386 HG3 GLU 52 HG3 GLU 52 -11.581 -2.095 10.271 387 H GLY 53 H GLY 53 -9.592 1.794 7.035 388 HA2 GLY 53 HA2 GLY 53 -7.581 2.774 6.491 389 HA3 GLY 53 HA3 GLY 53 -7.559 3.459 8.116 390 H HIS 54 H HIS 54 -7.876 0.083 7.560 391 HA HIS 54 HA HIS 54 -5.436 -0.368 9.127 392 HB2 HIS 54 HB2 HIS 54 -7.783 -1.280 9.728 393 HB3 HIS 54 HB3 HIS 54 -7.547 -2.401 8.401 394 HD1 HIS 54 HD1 HIS 54 -5.274 -3.980 8.746 395 HD2 HIS 54 HD2 HIS 54 -6.861 -2.108 12.090 396 HE1 HIS 54 HE1 HIS 54 -4.401 -5.249 10.731 397 H LEU 55 H LEU 55 -6.516 -0.363 5.974 398 HA LEU 55 HA LEU 55 -4.199 -1.678 4.959 399 HB2 LEU 55 HB2 LEU 55 -5.825 -3.549 5.367 400 HB3 LEU 55 HB3 LEU 55 -6.988 -2.716 4.363 401 HG LEU 55 HG LEU 55 -5.506 -3.035 2.410 402 HD11 LEU 55 HD11 LEU 55 -3.830 -4.660 4.322 403 HD12 LEU 55 HD12 LEU 55 -3.368 -3.123 3.591 404 HD13 LEU 55 HD13 LEU 55 -3.598 -4.547 2.578 405 HD21 LEU 55 HD21 LEU 55 -6.193 -5.543 3.937 406 HD22 LEU 55 HD22 LEU 55 -5.864 -5.449 2.208 407 HD23 LEU 55 HD23 LEU 55 -7.274 -4.633 2.882 408 H VAL 56 H VAL 56 -3.995 -1.019 2.638 409 HA VAL 56 HA VAL 56 -6.037 0.882 1.853 410 HB VAL 56 HB VAL 56 -4.071 2.017 2.934 411 HG11 VAL 56 HG11 VAL 56 -2.013 2.340 1.636 412 HG12 VAL 56 HG12 VAL 56 -2.573 1.117 0.496 413 HG13 VAL 56 HG13 VAL 56 -2.257 0.680 2.175 414 HG21 VAL 56 HG21 VAL 56 -4.642 2.775 0.077 415 HG22 VAL 56 HG22 VAL 56 -3.913 3.827 1.289 416 HG23 VAL 56 HG23 VAL 56 -5.569 3.256 1.499 417 H ALA 57 H ALA 57 -5.912 1.376 -0.487 418 HA ALA 57 HA ALA 57 -4.866 -0.881 -2.021 419 HB1 ALA 57 HB1 ALA 57 -7.634 0.303 -2.243 420 HB2 ALA 57 HB2 ALA 57 -7.244 -1.270 -1.547 421 HB3 ALA 57 HB3 ALA 57 -6.966 -0.971 -3.264 422 H VAL 58 H VAL 58 -4.813 -0.399 -4.323 423 HA VAL 58 HA VAL 58 -4.673 2.428 -5.017 424 HB VAL 58 HB VAL 58 -2.648 1.941 -6.441 425 HG11 VAL 58 HG11 VAL 58 -1.058 2.171 -4.633 426 HG12 VAL 58 HG12 VAL 58 -2.297 1.646 -3.478 427 HG13 VAL 58 HG13 VAL 58 -2.498 3.157 -4.361 428 HG21 VAL 58 HG21 VAL 58 -2.491 -0.556 -4.741 429 HG22 VAL 58 HG22 VAL 58 -1.224 0.025 -5.822 430 HG23 VAL 58 HG23 VAL 58 -2.773 -0.497 -6.483 431 H ARG 59 H ARG 59 -4.524 2.625 -7.478 432 HA ARG 59 HA ARG 59 -6.349 0.601 -8.558 433 HB2 ARG 59 HB2 ARG 59 -5.881 3.431 -9.461 434 HB3 ARG 59 HB3 ARG 59 -7.051 2.307 -10.129 435 HG2 ARG 59 HG2 ARG 59 -8.318 2.346 -8.086 436 HG3 ARG 59 HG3 ARG 59 -7.082 3.343 -7.308 437 HD2 ARG 59 HD2 ARG 59 -8.772 4.100 -9.675 438 HD3 ARG 59 HD3 ARG 59 -8.912 4.736 -8.029 439 HE ARG 59 HE ARG 59 -6.347 5.244 -8.690 440 HH11 ARG 59 HH11 ARG 59 -9.446 6.066 -10.130 441 HH12 ARG 59 HH12 ARG 59 -8.888 7.435 -10.969 442 HH21 ARG 59 HH21 ARG 59 -5.494 7.160 -9.894 443 HH22 ARG 59 HH22 ARG 59 -6.597 8.072 -10.797 444 H ARG 60 H ARG 60 -5.785 -0.422 -10.373 445 HA ARG 60 HA ARG 60 -3.503 0.570 -11.910 446 HB2 ARG 60 HB2 ARG 60 -2.699 -1.693 -12.391 447 HB3 ARG 60 HB3 ARG 60 -2.753 -1.471 -10.651 448 HG2 ARG 60 HG2 ARG 60 -4.751 -2.811 -10.494 449 HG3 ARG 60 HG3 ARG 60 -4.878 -2.891 -12.247 450 HD2 ARG 60 HD2 ARG 60 -2.764 -4.131 -12.341 451 HD3 ARG 60 HD3 ARG 60 -2.642 -4.046 -10.585 452 HE ARG 60 HE ARG 60 -5.084 -5.165 -11.078 453 HH11 ARG 60 HH11 ARG 60 -1.755 -6.076 -12.025 454 HH12 ARG 60 HH12 ARG 60 -2.060 -7.734 -11.892 455 HH21 ARG 60 HH21 ARG 60 -5.444 -7.498 -10.852 456 HH22 ARG 60 HH22 ARG 60 -4.176 -8.546 -11.232 457 H ALA 61 H ALA 61 -4.143 1.069 -13.850 458 HA ALA 61 HA ALA 61 -5.266 1.204 -15.810 459 HB1 ALA 61 HB1 ALA 61 -6.031 -1.678 -15.302 460 HB2 ALA 61 HB2 ALA 61 -4.539 -1.140 -16.073 461 HB3 ALA 61 HB3 ALA 61 -6.093 -0.837 -16.853 462 H GLY 62 H GLY 62 -6.636 1.569 -13.148 463 HA2 GLY 62 HA2 GLY 62 -8.693 2.742 -12.902 464 HA3 GLY 62 HA3 GLY 62 -9.352 1.809 -14.237 465 H GLY 63 H GLY 63 -7.810 -0.477 -12.563 466 HA2 GLY 63 HA2 GLY 63 -10.240 -1.193 -11.095 467 HA3 GLY 63 HA3 GLY 63 -8.932 -2.291 -11.540 468 H VAL 64 H VAL 64 -10.172 -1.951 -8.979 469 HA VAL 64 HA VAL 64 -8.127 -0.536 -7.432 470 HB VAL 64 HB VAL 64 -10.711 -1.810 -6.475 471 HG11 VAL 64 HG11 VAL 64 -10.374 -0.485 -4.438 472 HG12 VAL 64 HG12 VAL 64 -8.834 0.092 -5.076 473 HG13 VAL 64 HG13 VAL 64 -9.050 -1.619 -4.712 474 HG21 VAL 64 HG21 VAL 64 -11.189 0.030 -7.986 475 HG22 VAL 64 HG22 VAL 64 -10.123 1.090 -7.065 476 HG23 VAL 64 HG23 VAL 64 -11.603 0.472 -6.328 477 H VAL 65 H VAL 65 -6.544 -1.621 -6.571 478 HA VAL 65 HA VAL 65 -6.807 -4.485 -6.098 479 HB VAL 65 HB VAL 65 -4.463 -4.739 -7.001 480 HG11 VAL 65 HG11 VAL 65 -6.601 -3.884 -8.937 481 HG12 VAL 65 HG12 VAL 65 -6.402 -5.500 -8.256 482 HG13 VAL 65 HG13 VAL 65 -5.173 -4.839 -9.331 483 HG21 VAL 65 HG21 VAL 65 -3.855 -2.352 -6.986 484 HG22 VAL 65 HG22 VAL 65 -5.064 -2.062 -8.237 485 HG23 VAL 65 HG23 VAL 65 -3.658 -3.068 -8.591 486 H ILE 66 H ILE 66 -5.152 -5.302 -4.768 487 HA ILE 66 HA ILE 66 -3.872 -3.337 -3.030 488 HB ILE 66 HB ILE 66 -5.198 -5.941 -2.153 489 HG12 ILE 66 HG12 ILE 66 -5.936 -3.063 -1.551 490 HG13 ILE 66 HG13 ILE 66 -6.825 -4.153 -2.607 491 HG21 ILE 66 HG21 ILE 66 -3.736 -3.873 -0.504 492 HG22 ILE 66 HG22 ILE 66 -3.159 -5.492 -0.898 493 HG23 ILE 66 HG23 ILE 66 -4.582 -5.289 0.131 494 HD11 ILE 66 HD11 ILE 66 -7.310 -5.580 -0.645 495 HD12 ILE 66 HD12 ILE 66 -7.935 -3.938 -0.473 496 HD13 ILE 66 HD13 ILE 66 -6.462 -4.414 0.366 497 HA PRO 67 HA PRO 67 -0.337 -5.718 -4.445 498 HB2 PRO 67 HB2 PRO 67 0.901 -4.699 -1.948 499 HB3 PRO 67 HB3 PRO 67 1.473 -4.573 -3.616 500 HG2 PRO 67 HG2 PRO 67 0.462 -2.451 -2.371 501 HG3 PRO 67 HG3 PRO 67 0.111 -2.751 -4.083 502 HD2 PRO 67 HD2 PRO 67 -1.611 -3.217 -1.687 503 HD3 PRO 67 HD3 PRO 67 -2.039 -2.592 -3.296 504 H GLN 68 H GLN 68 0.181 -7.842 -4.094 505 HA GLN 68 HA GLN 68 -0.962 -9.313 -2.015 506 HB2 GLN 68 HB2 GLN 68 -0.537 -10.259 -4.138 507 HB3 GLN 68 HB3 GLN 68 1.168 -9.883 -4.047 508 HG2 GLN 68 HG2 GLN 68 1.559 -11.604 -2.473 509 HG3 GLN 68 HG3 GLN 68 -0.167 -11.823 -2.182 510 HE21 GLN 68 HE21 GLN 68 -0.937 -11.655 -4.973 511 HE22 GLN 68 HE22 GLN 68 -0.428 -13.114 -5.681 512 H VAL 69 H VAL 69 1.971 -7.650 -2.291 513 HA VAL 69 HA VAL 69 3.437 -8.984 -0.279 514 HB VAL 69 HB VAL 69 4.972 -7.097 -0.428 515 HG11 VAL 69 HG11 VAL 69 5.538 -7.306 -2.818 516 HG12 VAL 69 HG12 VAL 69 3.958 -8.029 -3.116 517 HG13 VAL 69 HG13 VAL 69 5.130 -8.862 -2.096 518 HG21 VAL 69 HG21 VAL 69 2.867 -5.858 -2.206 519 HG22 VAL 69 HG22 VAL 69 4.507 -5.235 -1.991 520 HG23 VAL 69 HG23 VAL 69 3.394 -5.276 -0.625 521 H PHE 70 H PHE 70 0.725 -7.041 -0.016 522 HA PHE 70 HA PHE 70 1.423 -5.846 2.530 523 HB2 PHE 70 HB2 PHE 70 -0.874 -5.652 0.643 524 HB3 PHE 70 HB3 PHE 70 -1.205 -5.338 2.341 525 HD1 PHE 70 HD1 PHE 70 1.733 -4.438 0.175 526 HD2 PHE 70 HD2 PHE 70 -1.492 -3.087 2.605 527 HE1 PHE 70 HE1 PHE 70 2.532 -2.124 -0.032 528 HE2 PHE 70 HE2 PHE 70 -0.682 -0.787 2.422 529 HZ PHE 70 HZ PHE 70 1.293 -0.288 1.114 530 H PHE 71 H PHE 71 0.610 -8.812 1.510 531 HA PHE 71 HA PHE 71 -0.723 -9.462 4.021 532 HB2 PHE 71 HB2 PHE 71 -1.053 -10.778 1.319 533 HB3 PHE 71 HB3 PHE 71 -1.722 -11.394 2.823 534 HD1 PHE 71 HD1 PHE 71 -3.533 -10.177 3.958 535 HD2 PHE 71 HD2 PHE 71 -2.056 -8.962 0.157 536 HE1 PHE 71 HE1 PHE 71 -5.555 -8.821 3.606 537 HE2 PHE 71 HE2 PHE 71 -4.073 -7.605 -0.198 538 HZ PHE 71 HZ PHE 71 -5.825 -7.532 1.528 539 H THR 72 H THR 72 -0.040 -11.326 5.003 540 HA THR 72 HA THR 72 2.701 -12.011 4.469 541 HB THR 72 HB THR 72 2.417 -13.417 6.527 542 HG1 THR 72 HG1 THR 72 0.417 -12.920 7.695 543 HG21 THR 72 HG21 THR 72 2.154 -11.529 8.085 544 HG22 THR 72 HG22 THR 72 1.495 -10.548 6.778 545 HG23 THR 72 HG23 THR 72 3.173 -11.085 6.716 546 H ASN 73 H ASN 73 3.178 -14.475 4.736 547 HA ASN 73 HA ASN 73 2.028 -15.865 2.545 548 HB2 ASN 73 HB2 ASN 73 4.368 -16.175 3.470 549 HB3 ASN 73 HB3 ASN 73 3.645 -17.017 4.832 550 HD21 ASN 73 HD21 ASN 73 4.668 -18.929 4.427 551 HD22 ASN 73 HD22 ASN 73 4.304 -19.930 3.071 552 H SER 74 H SER 74 1.155 -15.485 5.810 553 HA SER 74 HA SER 74 -0.394 -17.872 6.170 554 HB2 SER 74 HB2 SER 74 -0.487 -15.268 7.683 555 HB3 SER 74 HB3 SER 74 -1.016 -16.845 8.257 556 HG SER 74 HG SER 74 1.165 -17.539 8.000 557 H GLY 75 H GLY 75 -0.854 -15.057 4.367 558 HA2 GLY 75 HA2 GLY 75 -2.679 -14.383 3.135 559 HA3 GLY 75 HA3 GLY 75 -3.614 -15.675 3.886 560 H GLN 76 H GLN 76 -1.857 -13.376 5.771 561 HA GLN 76 HA GLN 76 -4.368 -12.053 6.532 562 HB2 GLN 76 HB2 GLN 76 -2.061 -12.889 8.297 563 HB3 GLN 76 HB3 GLN 76 -3.335 -11.799 8.816 564 HG2 GLN 76 HG2 GLN 76 -3.704 -14.658 7.950 565 HG3 GLN 76 HG3 GLN 76 -3.690 -14.073 9.613 566 HE21 GLN 76 HE21 GLN 76 -5.779 -15.459 8.147 567 HE22 GLN 76 HE22 GLN 76 -7.174 -14.452 8.195 568 H VAL 77 H VAL 77 -3.922 -9.895 7.537 569 HA VAL 77 HA VAL 77 -2.163 -8.395 5.849 570 HB VAL 77 HB VAL 77 -3.741 -7.501 8.298 571 HG11 VAL 77 HG11 VAL 77 -2.634 -5.871 6.022 572 HG12 VAL 77 HG12 VAL 77 -1.999 -5.917 7.666 573 HG13 VAL 77 HG13 VAL 77 -3.606 -5.251 7.358 574 HG21 VAL 77 HG21 VAL 77 -5.240 -8.476 6.648 575 HG22 VAL 77 HG22 VAL 77 -4.557 -7.446 5.391 576 HG23 VAL 77 HG23 VAL 77 -5.463 -6.726 6.720 577 H VAL 78 H VAL 78 -0.214 -7.461 6.454 578 HA VAL 78 HA VAL 78 1.314 -8.647 8.512 579 HB VAL 78 HB VAL 78 1.837 -5.929 7.269 580 HG11 VAL 78 HG11 VAL 78 3.736 -7.935 8.434 581 HG12 VAL 78 HG12 VAL 78 3.256 -6.398 9.156 582 HG13 VAL 78 HG13 VAL 78 4.190 -6.418 7.661 583 HG21 VAL 78 HG21 VAL 78 3.121 -7.007 5.546 584 HG22 VAL 78 HG22 VAL 78 1.451 -7.550 5.486 585 HG23 VAL 78 HG23 VAL 78 2.695 -8.607 6.172 586 H LYS 79 H LYS 79 1.523 -8.088 10.645 587 HA LYS 79 HA LYS 79 -0.540 -6.537 11.739 588 HB2 LYS 79 HB2 LYS 79 0.442 -7.009 13.934 589 HB3 LYS 79 HB3 LYS 79 0.246 -8.445 12.937 590 HG2 LYS 79 HG2 LYS 79 2.585 -8.233 12.299 591 HG3 LYS 79 HG3 LYS 79 2.748 -6.932 13.476 592 HD2 LYS 79 HD2 LYS 79 1.925 -9.791 14.105 593 HD3 LYS 79 HD3 LYS 79 3.512 -9.102 14.431 594 HE2 LYS 79 HE2 LYS 79 0.902 -8.174 15.659 595 HE3 LYS 79 HE3 LYS 79 2.102 -9.187 16.448 596 HZ1 LYS 79 HZ1 LYS 79 3.699 -7.343 16.241 597 HZ2 LYS 79 HZ2 LYS 79 2.340 -6.865 17.114 598 HZ3 LYS 79 HZ3 LYS 79 2.503 -6.393 15.536 599 H SER 80 H SER 80 2.678 -5.575 10.865 600 HA SER 80 HA SER 80 2.472 -3.171 12.458 601 HB2 SER 80 HB2 SER 80 4.763 -2.807 11.290 602 HB3 SER 80 HB3 SER 80 4.621 -4.050 12.536 603 HG SER 80 HG SER 80 5.176 -5.429 11.101 604 H LEU 81 H LEU 81 1.224 -4.120 9.611 605 HA LEU 81 HA LEU 81 1.923 -2.054 7.857 606 HB2 LEU 81 HB2 LEU 81 1.100 -4.244 7.201 607 HB3 LEU 81 HB3 LEU 81 -0.485 -3.865 7.820 608 HG LEU 81 HG LEU 81 0.772 -2.336 5.546 609 HD11 LEU 81 HD11 LEU 81 0.781 -4.728 5.059 610 HD12 LEU 81 HD12 LEU 81 -0.414 -3.880 4.084 611 HD13 LEU 81 HD13 LEU 81 -0.926 -4.820 5.486 612 HD21 LEU 81 HD21 LEU 81 -1.558 -1.884 4.965 613 HD22 LEU 81 HD22 LEU 81 -1.235 -1.352 6.614 614 HD23 LEU 81 HD23 LEU 81 -2.108 -2.858 6.327 615 HA PRO 82 HA PRO 82 -2.313 0.068 9.215 616 HB2 PRO 82 HB2 PRO 82 -2.836 -0.408 11.916 617 HB3 PRO 82 HB3 PRO 82 -3.732 -1.120 10.571 618 HG2 PRO 82 HG2 PRO 82 -1.518 -2.286 12.200 619 HG3 PRO 82 HG3 PRO 82 -2.971 -3.066 11.551 620 HD2 PRO 82 HD2 PRO 82 -0.588 -3.417 10.399 621 HD3 PRO 82 HD3 PRO 82 -2.065 -3.269 9.424 622 H GLY 83 H GLY 83 0.360 -0.665 11.341 623 HA2 GLY 83 HA2 GLY 83 0.478 1.770 12.763 624 HA3 GLY 83 HA3 GLY 83 1.811 0.642 12.546 625 H LEU 84 H LEU 84 2.074 0.695 9.768 626 HA LEU 84 HA LEU 84 3.564 3.085 9.506 627 HB2 LEU 84 HB2 LEU 84 4.262 2.333 7.341 628 HB3 LEU 84 HB3 LEU 84 4.222 0.940 8.388 629 HG LEU 84 HG LEU 84 1.829 0.643 7.265 630 HD11 LEU 84 HD11 LEU 84 1.877 1.225 4.888 631 HD12 LEU 84 HD12 LEU 84 3.377 2.111 5.143 632 HD13 LEU 84 HD13 LEU 84 1.893 2.647 5.931 633 HD21 LEU 84 HD21 LEU 84 3.637 -1.008 7.235 634 HD22 LEU 84 HD22 LEU 84 4.423 -0.121 5.930 635 HD23 LEU 84 HD23 LEU 84 2.857 -0.883 5.654 636 H LEU 85 H LEU 85 0.479 2.022 8.290 637 HA LEU 85 HA LEU 85 -0.016 4.219 6.625 638 HB2 LEU 85 HB2 LEU 85 -1.963 2.470 8.115 639 HB3 LEU 85 HB3 LEU 85 -2.431 3.639 6.898 640 HG LEU 85 HG LEU 85 -0.717 1.199 6.419 641 HD11 LEU 85 HD11 LEU 85 -2.667 0.375 5.204 642 HD12 LEU 85 HD12 LEU 85 -3.579 1.799 5.707 643 HD13 LEU 85 HD13 LEU 85 -3.018 0.634 6.911 644 HD21 LEU 85 HD21 LEU 85 -1.860 3.228 4.494 645 HD22 LEU 85 HD22 LEU 85 -1.010 1.750 4.047 646 HD23 LEU 85 HD23 LEU 85 -0.153 3.031 4.898 647 H THR 86 H THR 86 -0.520 3.677 9.996 648 HA THR 86 HA THR 86 -2.078 5.998 10.479 649 HB THR 86 HB THR 86 -0.456 4.338 12.437 650 HG1 THR 86 HG1 THR 86 -2.057 3.100 11.543 651 HG21 THR 86 HG21 THR 86 -2.676 6.338 12.956 652 HG22 THR 86 HG22 THR 86 -0.977 6.560 13.372 653 HG23 THR 86 HG23 THR 86 -1.922 5.308 14.175 654 H ILE 87 H ILE 87 1.431 5.412 10.796 655 HA ILE 87 HA ILE 87 1.912 8.030 11.744 656 HB ILE 87 HB ILE 87 3.493 6.275 12.296 657 HG12 ILE 87 HG12 ILE 87 4.410 8.646 12.025 658 HG13 ILE 87 HG13 ILE 87 5.590 7.348 12.054 659 HG21 ILE 87 HG21 ILE 87 5.013 5.221 10.706 660 HG22 ILE 87 HG22 ILE 87 4.116 5.992 9.394 661 HG23 ILE 87 HG23 ILE 87 3.308 4.840 10.453 662 HD11 ILE 87 HD11 ILE 87 4.587 8.727 9.574 663 HD12 ILE 87 HD12 ILE 87 5.867 7.519 9.644 664 HD13 ILE 87 HD13 ILE 87 6.100 9.103 10.395 665 H LEU 88 H LEU 88 2.021 6.655 8.501 666 HA LEU 88 HA LEU 88 2.809 9.082 7.303 667 HB2 LEU 88 HB2 LEU 88 1.615 6.580 6.219 668 HB3 LEU 88 HB3 LEU 88 1.661 7.998 5.204 669 HG LEU 88 HG LEU 88 3.510 6.553 4.684 670 HD11 LEU 88 HD11 LEU 88 3.916 8.910 4.457 671 HD12 LEU 88 HD12 LEU 88 5.389 8.057 4.923 672 HD13 LEU 88 HD13 LEU 88 4.502 8.996 6.119 673 HD21 LEU 88 HD21 LEU 88 5.278 6.052 6.232 674 HD22 LEU 88 HD22 LEU 88 3.747 5.404 6.821 675 HD23 LEU 88 HD23 LEU 88 4.410 6.886 7.526 676 H HIS 89 H HIS 89 -0.326 7.820 8.139 677 HA HIS 89 HA HIS 89 -1.966 9.697 6.842 678 HB2 HIS 89 HB2 HIS 89 -2.679 7.594 8.132 679 HB3 HIS 89 HB3 HIS 89 -2.467 8.530 9.598 680 HD1 HIS 89 HD1 HIS 89 -5.116 7.371 7.637 681 HD2 HIS 89 HD2 HIS 89 -4.163 11.109 9.159 682 HE1 HIS 89 HE1 HIS 89 -7.284 8.647 7.747 683 H ASP 90 H ASP 90 -0.115 9.888 9.843 684 HA ASP 90 HA ASP 90 -1.106 12.407 10.745 685 HB2 ASP 90 HB2 ASP 90 0.135 10.989 12.282 686 HB3 ASP 90 HB3 ASP 90 1.550 11.036 11.241 687 H GLY 91 H GLY 91 1.306 11.467 8.455 688 HA2 GLY 91 HA2 GLY 91 2.345 14.156 8.185 689 HA3 GLY 91 HA3 GLY 91 2.875 12.736 7.287 690 H GLY 92 H GLY 92 -0.263 12.468 6.962 691 HA2 GLY 92 HA2 GLY 92 -1.876 13.209 5.483 692 HA3 GLY 92 HA3 GLY 92 -0.857 14.601 5.130 693 H TYR 93 H TYR 93 0.125 11.256 4.863 694 HA TYR 93 HA TYR 93 0.590 11.752 2.032 695 HB2 TYR 93 HB2 TYR 93 1.678 9.647 3.887 696 HB3 TYR 93 HB3 TYR 93 1.942 9.615 2.153 697 HD1 TYR 93 HD1 TYR 93 3.369 11.279 1.080 698 HD2 TYR 93 HD2 TYR 93 2.805 11.268 5.293 699 HE1 TYR 93 HE1 TYR 93 5.314 12.751 1.333 700 HE2 TYR 93 HE2 TYR 93 4.737 12.746 5.559 701 HH TYR 93 HH TYR 93 6.894 13.208 4.168 702 H ARG 94 H ARG 94 -0.468 10.806 0.498 703 HA ARG 94 HA ARG 94 -2.661 9.056 1.156 704 HB2 ARG 94 HB2 ARG 94 -3.332 9.254 -1.168 705 HB3 ARG 94 HB3 ARG 94 -2.911 10.851 -0.569 706 HG2 ARG 94 HG2 ARG 94 -0.716 10.653 -1.679 707 HG3 ARG 94 HG3 ARG 94 -1.207 9.084 -2.311 708 HD2 ARG 94 HD2 ARG 94 -2.543 11.731 -2.882 709 HD3 ARG 94 HD3 ARG 94 -1.477 10.857 -3.970 710 HE ARG 94 HE ARG 94 -4.017 9.648 -3.071 711 HH11 ARG 94 HH11 ARG 94 -1.849 10.563 -5.717 712 HH12 ARG 94 HH12 ARG 94 -2.934 10.156 -6.950 713 HH21 ARG 94 HH21 ARG 94 -5.559 9.124 -4.798 714 HH22 ARG 94 HH22 ARG 94 -5.088 9.374 -6.412 715 H ASP 95 H ASP 95 -2.986 7.176 -0.458 716 HA ASP 95 HA ASP 95 -1.358 5.064 0.253 717 HB2 ASP 95 HB2 ASP 95 -2.599 3.852 -1.506 718 HB3 ASP 95 HB3 ASP 95 -3.661 4.855 -0.514 719 H THR 96 H THR 96 -1.383 6.963 -2.697 720 HA THR 96 HA THR 96 0.409 5.472 -4.182 721 HB THR 96 HB THR 96 -0.051 8.451 -4.322 722 HG1 THR 96 HG1 THR 96 -1.785 6.375 -4.568 723 HG21 THR 96 HG21 THR 96 0.450 8.142 -6.705 724 HG22 THR 96 HG22 THR 96 0.629 6.401 -6.444 725 HG23 THR 96 HG23 THR 96 1.778 7.509 -5.718 726 H GLU 97 H GLU 97 0.932 8.114 -1.914 727 HA GLU 97 HA GLU 97 3.721 8.360 -2.337 728 HB2 GLU 97 HB2 GLU 97 1.993 9.097 0.025 729 HB3 GLU 97 HB3 GLU 97 3.682 9.555 -0.153 730 HG2 GLU 97 HG2 GLU 97 1.524 10.313 -2.105 731 HG3 GLU 97 HG3 GLU 97 2.022 11.326 -0.748 732 H ILE 98 H ILE 98 1.701 6.408 -0.241 733 HA ILE 98 HA ILE 98 3.690 5.361 1.487 734 HB ILE 98 HB ILE 98 1.278 3.796 0.514 735 HG12 ILE 98 HG12 ILE 98 0.390 5.954 1.199 736 HG13 ILE 98 HG13 ILE 98 0.013 4.735 2.414 737 HG21 ILE 98 HG21 ILE 98 1.337 2.791 2.734 738 HG22 ILE 98 HG22 ILE 98 2.740 3.785 3.131 739 HG23 ILE 98 HG23 ILE 98 2.865 2.558 1.871 740 HD11 ILE 98 HD11 ILE 98 0.643 6.847 3.405 741 HD12 ILE 98 HD12 ILE 98 2.206 6.769 2.595 742 HD13 ILE 98 HD13 ILE 98 1.783 5.570 3.820 743 H MET 99 H MET 99 2.304 4.202 -1.527 744 HA MET 99 HA MET 99 3.880 1.848 -1.773 745 HB2 MET 99 HB2 MET 99 2.519 3.406 -3.974 746 HB3 MET 99 HB3 MET 99 3.050 1.738 -4.060 747 HG2 MET 99 HG2 MET 99 0.863 2.815 -2.295 748 HG3 MET 99 HG3 MET 99 0.665 1.916 -3.797 749 HE1 MET 99 HE1 MET 99 -0.593 -0.510 -0.984 750 HE2 MET 99 HE2 MET 99 -1.013 0.308 -2.489 751 HE3 MET 99 HE3 MET 99 -0.734 1.247 -1.023 752 H ARG 100 H ARG 100 4.420 5.171 -2.483 753 HA ARG 100 HA ARG 100 6.248 5.034 -4.571 754 HB2 ARG 100 HB2 ARG 100 5.071 7.039 -3.842 755 HB3 ARG 100 HB3 ARG 100 5.959 7.019 -2.336 756 HG2 ARG 100 HG2 ARG 100 8.016 7.501 -3.540 757 HG3 ARG 100 HG3 ARG 100 7.123 7.485 -5.071 758 HD2 ARG 100 HD2 ARG 100 5.700 9.289 -4.290 759 HD3 ARG 100 HD3 ARG 100 6.529 9.291 -2.739 760 HE ARG 100 HE ARG 100 8.399 9.685 -4.755 761 HH11 ARG 100 HH11 ARG 100 5.604 11.414 -3.360 762 HH12 ARG 100 HH12 ARG 100 6.308 12.947 -3.548 763 HH21 ARG 100 HH21 ARG 100 9.326 11.815 -5.026 764 HH22 ARG 100 HH22 ARG 100 8.471 13.187 -4.488 765 H TRP 101 H TRP 101 7.009 5.550 -1.141 766 HA TRP 101 HA TRP 101 9.705 4.847 -1.643 767 HB2 TRP 101 HB2 TRP 101 9.912 4.836 0.920 768 HB3 TRP 101 HB3 TRP 101 9.538 6.350 0.117 769 HD1 TRP 101 HD1 TRP 101 7.257 7.490 0.691 770 HE1 TRP 101 HE1 TRP 101 5.447 7.036 2.429 771 HE3 TRP 101 HE3 TRP 101 8.711 2.818 2.174 772 HZ2 TRP 101 HZ2 TRP 101 4.731 4.981 4.218 773 HZ3 TRP 101 HZ3 TRP 101 7.408 1.681 3.883 774 HH2 TRP 101 HH2 TRP 101 5.453 2.735 4.904 775 H LEU 102 H LEU 102 6.968 2.989 -0.541 776 HA LEU 102 HA LEU 102 8.260 0.785 0.562 777 HB2 LEU 102 HB2 LEU 102 5.645 1.308 -0.604 778 HB3 LEU 102 HB3 LEU 102 6.093 -0.394 -0.548 779 HG LEU 102 HG LEU 102 5.974 1.480 1.822 780 HD11 LEU 102 HD11 LEU 102 3.896 0.365 2.356 781 HD12 LEU 102 HD12 LEU 102 4.030 -0.627 0.903 782 HD13 LEU 102 HD13 LEU 102 3.781 1.114 0.763 783 HD21 LEU 102 HD21 LEU 102 5.971 -0.657 3.082 784 HD22 LEU 102 HD22 LEU 102 7.466 -0.369 2.187 785 HD23 LEU 102 HD23 LEU 102 6.272 -1.492 1.553 786 H PHE 103 H PHE 103 7.514 1.384 -2.838 787 HA PHE 103 HA PHE 103 8.603 -1.253 -3.396 788 HB2 PHE 103 HB2 PHE 103 6.988 0.592 -5.126 789 HB3 PHE 103 HB3 PHE 103 7.706 -0.903 -5.710 790 HD1 PHE 103 HD1 PHE 103 6.929 -3.057 -4.904 791 HD2 PHE 103 HD2 PHE 103 5.084 0.559 -3.651 792 HE1 PHE 103 HE1 PHE 103 4.982 -4.328 -4.103 793 HE2 PHE 103 HE2 PHE 103 3.141 -0.698 -2.856 794 HZ PHE 103 HZ PHE 103 3.077 -3.130 -3.085 795 H THR 104 H THR 104 9.791 1.772 -3.234 796 HA THR 104 HA THR 104 11.509 1.541 -5.537 797 HB THR 104 HB THR 104 11.333 3.656 -3.371 798 HG1 THR 104 HG1 THR 104 9.626 4.006 -4.578 799 HG21 THR 104 HG21 THR 104 12.892 3.682 -5.970 800 HG22 THR 104 HG22 THR 104 13.601 3.544 -4.362 801 HG23 THR 104 HG23 THR 104 12.762 5.022 -4.833 802 HA PRO 105 HA PRO 105 14.613 -0.624 -3.030 803 HB2 PRO 105 HB2 PRO 105 16.277 -0.004 -5.404 804 HB3 PRO 105 HB3 PRO 105 15.956 -1.570 -4.655 805 HG2 PRO 105 HG2 PRO 105 14.890 -0.913 -7.007 806 HG3 PRO 105 HG3 PRO 105 13.978 -1.864 -5.821 807 HD2 PRO 105 HD2 PRO 105 13.756 1.035 -6.502 808 HD3 PRO 105 HD3 PRO 105 12.480 -0.148 -6.130 809 H ASP 106 H ASP 106 15.873 0.456 -1.587 810 HA ASP 106 HA ASP 106 16.664 3.168 -2.337 811 HB2 ASP 106 HB2 ASP 106 15.190 3.004 -0.370 812 HB3 ASP 106 HB3 ASP 106 16.381 1.978 0.417 813 HA PRO 107 HA PRO 107 20.843 1.597 -2.633 814 HB2 PRO 107 HB2 PRO 107 22.056 4.065 -2.705 815 HB3 PRO 107 HB3 PRO 107 21.349 3.254 -4.105 816 HG2 PRO 107 HG2 PRO 107 20.185 5.387 -2.363 817 HG3 PRO 107 HG3 PRO 107 20.111 5.217 -4.125 818 HD2 PRO 107 HD2 PRO 107 18.052 4.581 -2.568 819 HD3 PRO 107 HD3 PRO 107 18.423 3.634 -4.026 820 H SER 108 H SER 108 19.693 3.759 -0.162 821 HA SER 108 HA SER 108 22.143 3.472 1.371 822 HB2 SER 108 HB2 SER 108 19.689 5.145 1.916 823 HB3 SER 108 HB3 SER 108 21.268 5.286 2.695 824 HG SER 108 HG SER 108 22.025 5.580 0.429 825 H LEU 109 H LEU 109 19.433 1.726 0.877 826 HA LEU 109 HA LEU 109 19.190 0.945 3.678 827 HB2 LEU 109 HB2 LEU 109 17.129 1.690 2.534 828 HB3 LEU 109 HB3 LEU 109 17.354 0.411 1.352 829 HG LEU 109 HG LEU 109 17.089 -1.252 3.150 830 HD11 LEU 109 HD11 LEU 109 16.135 -0.509 5.309 831 HD12 LEU 109 HD12 LEU 109 16.455 1.161 4.841 832 HD13 LEU 109 HD13 LEU 109 17.791 0.030 5.055 833 HD21 LEU 109 HD21 LEU 109 14.822 0.711 2.849 834 HD22 LEU 109 HD22 LEU 109 14.679 -0.953 3.424 835 HD23 LEU 109 HD23 LEU 109 15.204 -0.638 1.771 836 H THR 110 H THR 110 19.917 -0.968 4.228 837 HA THR 110 HA THR 110 20.424 -2.957 2.155 838 HB THR 110 HB THR 110 22.322 -2.322 4.437 839 HG1 THR 110 HG1 THR 110 22.487 -0.671 2.942 840 HG21 THR 110 HG21 THR 110 22.626 -4.124 2.025 841 HG22 THR 110 HG22 THR 110 22.391 -4.656 3.690 842 HG23 THR 110 HG23 THR 110 23.876 -3.822 3.237 843 H ILE 111 H ILE 111 19.259 -4.656 2.617 844 HA ILE 111 HA ILE 111 18.436 -5.134 5.405 845 HB ILE 111 HB ILE 111 16.958 -5.416 2.824 846 HG12 ILE 111 HG12 ILE 111 17.117 -3.156 3.687 847 HG13 ILE 111 HG13 ILE 111 15.450 -3.709 3.645 848 HG21 ILE 111 HG21 ILE 111 16.339 -7.260 4.180 849 HG22 ILE 111 HG22 ILE 111 15.005 -6.109 4.000 850 HG23 ILE 111 HG23 ILE 111 15.935 -6.166 5.517 851 HD11 ILE 111 HD11 ILE 111 15.624 -4.169 6.096 852 HD12 ILE 111 HD12 ILE 111 15.862 -2.471 5.685 853 HD13 ILE 111 HD13 ILE 111 17.250 -3.481 6.069 854 H THR 112 H THR 112 18.209 -7.229 5.987 855 HA THR 112 HA THR 112 19.735 -9.179 4.483 856 HB THR 112 HB THR 112 19.399 -10.551 6.606 857 HG1 THR 112 HG1 THR 112 17.744 -9.641 7.639 858 HG21 THR 112 HG21 THR 112 20.724 -7.865 6.862 859 HG22 THR 112 HG22 THR 112 21.457 -9.316 6.175 860 HG23 THR 112 HG23 THR 112 21.044 -9.262 7.896 861 H ARG 113 H ARG 113 18.817 -10.878 3.539 862 HA ARG 113 HA ARG 113 15.974 -10.621 3.120 863 HB2 ARG 113 HB2 ARG 113 17.746 -11.062 1.316 864 HB3 ARG 113 HB3 ARG 113 17.763 -12.716 1.900 865 HG2 ARG 113 HG2 ARG 113 15.436 -12.988 1.355 866 HG3 ARG 113 HG3 ARG 113 15.317 -11.288 0.906 867 HD2 ARG 113 HD2 ARG 113 17.108 -11.762 -0.823 868 HD3 ARG 113 HD3 ARG 113 16.853 -13.471 -0.479 869 HE ARG 113 HE ARG 113 14.629 -11.758 -1.299 870 HH11 ARG 113 HH11 ARG 113 16.650 -14.621 -1.894 871 HH12 ARG 113 HH12 ARG 113 15.737 -15.132 -3.234 872 HH21 ARG 113 HH21 ARG 113 13.395 -12.495 -3.196 873 HH22 ARG 113 HH22 ARG 113 13.901 -13.928 -3.979 874 H ASP 114 H ASP 114 14.474 -12.308 3.437 875 HA ASP 114 HA ASP 114 14.712 -13.714 5.853 876 HB2 ASP 114 HB2 ASP 114 12.514 -13.134 4.968 877 HB3 ASP 114 HB3 ASP 114 12.801 -14.144 3.557 878 H GLY 115 H GLY 115 15.954 -15.364 6.238 879 HA2 GLY 115 HA2 GLY 115 16.618 -17.602 6.047 880 HA3 GLY 115 HA3 GLY 115 16.009 -17.612 4.393 881 H SER 116 H SER 116 17.933 -14.937 5.276 882 HA SER 116 HA SER 116 20.366 -16.151 4.285 883 HB2 SER 116 HB2 SER 116 19.151 -13.605 3.186 884 HB3 SER 116 HB3 SER 116 20.686 -14.320 2.696 885 HG SER 116 HG SER 116 19.179 -16.250 2.376 886 H ARG 117 H ARG 117 22.054 -15.435 5.440 887 HA ARG 117 HA ARG 117 21.566 -13.456 7.490 888 HB2 ARG 117 HB2 ARG 117 23.839 -13.998 8.274 889 HB3 ARG 117 HB3 ARG 117 22.775 -15.390 8.203 890 HG2 ARG 117 HG2 ARG 117 23.851 -16.146 6.176 891 HG3 ARG 117 HG3 ARG 117 24.849 -14.696 6.136 892 HD2 ARG 117 HD2 ARG 117 26.099 -16.557 7.051 893 HD3 ARG 117 HD3 ARG 117 25.817 -15.289 8.250 894 HE ARG 117 HE ARG 117 23.853 -17.369 8.354 895 HH11 ARG 117 HH11 ARG 117 27.148 -16.614 9.377 896 HH12 ARG 117 HH12 ARG 117 27.064 -17.530 10.820 897 HH21 ARG 117 HH21 ARG 117 23.739 -18.616 10.286 898 HH22 ARG 117 HH22 ARG 117 25.067 -18.697 11.353 899 H ASP 118 H ASP 118 22.977 -13.627 4.421 900 HA ASP 118 HA ASP 118 24.582 -11.257 4.657 901 HB2 ASP 118 HB2 ASP 118 24.974 -11.406 2.265 902 HB3 ASP 118 HB3 ASP 118 25.106 -13.012 2.951 903 H ALA 119 H ALA 119 24.204 -9.235 3.739 904 HA ALA 119 HA ALA 119 21.354 -8.631 3.576 905 HB1 ALA 119 HB1 ALA 119 22.625 -7.594 5.451 906 HB2 ALA 119 HB2 ALA 119 21.825 -6.461 4.379 907 HB3 ALA 119 HB3 ALA 119 23.569 -6.703 4.248 908 H VAL 120 H VAL 120 20.573 -7.427 1.991 909 HA VAL 120 HA VAL 120 22.264 -7.080 -0.373 910 HB VAL 120 HB VAL 120 19.243 -7.258 -0.179 911 HG11 VAL 120 HG11 VAL 120 19.283 -7.503 -2.606 912 HG12 VAL 120 HG12 VAL 120 21.035 -7.323 -2.600 913 HG13 VAL 120 HG13 VAL 120 20.012 -5.977 -2.104 914 HG21 VAL 120 HG21 VAL 120 20.267 -9.384 0.416 915 HG22 VAL 120 HG22 VAL 120 21.206 -9.365 -1.074 916 HG23 VAL 120 HG23 VAL 120 19.445 -9.495 -1.139 917 H SER 121 H SER 121 22.664 -5.055 -0.929 918 HA SER 121 HA SER 121 21.346 -2.873 0.414 919 HB2 SER 121 HB2 SER 121 23.858 -2.975 -0.181 920 HB3 SER 121 HB3 SER 121 23.361 -2.720 -1.851 921 HG SER 121 HG SER 121 22.944 -1.037 0.366 922 H ASN 122 H ASN 122 20.199 -1.204 -0.825 923 HA ASN 122 HA ASN 122 18.663 -0.462 -2.261 924 HB2 ASN 122 HB2 ASN 122 19.860 -2.468 -4.196 925 HB3 ASN 122 HB3 ASN 122 18.562 -1.340 -4.567 926 HD21 ASN 122 HD21 ASN 122 19.049 0.755 -5.013 927 HD22 ASN 122 HD22 ASN 122 20.654 1.348 -5.149 928 H ALA 123 H ALA 123 18.027 -2.473 -0.344 929 HA ALA 123 HA ALA 123 16.235 -4.262 -1.673 930 HB1 ALA 123 HB1 ALA 123 16.586 -3.587 1.251 931 HB2 ALA 123 HB2 ALA 123 17.349 -4.930 0.401 932 HB3 ALA 123 HB3 ALA 123 15.598 -4.899 0.610 933 H ARG 124 H ARG 124 13.950 -4.130 -1.456 934 HA ARG 124 HA ARG 124 12.989 -1.393 -1.387 935 HB2 ARG 124 HB2 ARG 124 11.431 -3.970 -1.789 936 HB3 ARG 124 HB3 ARG 124 10.951 -2.351 -2.280 937 HG2 ARG 124 HG2 ARG 124 12.602 -2.296 -3.997 938 HG3 ARG 124 HG3 ARG 124 13.343 -3.773 -3.387 939 HD2 ARG 124 HD2 ARG 124 12.149 -4.497 -5.233 940 HD3 ARG 124 HD3 ARG 124 11.076 -4.870 -3.893 941 HE ARG 124 HE ARG 124 10.572 -2.330 -5.118 942 HH11 ARG 124 HH11 ARG 124 9.706 -5.799 -5.127 943 HH12 ARG 124 HH12 ARG 124 8.493 -5.604 -6.329 944 HH21 ARG 124 HH21 ARG 124 8.880 -2.155 -6.801 945 HH22 ARG 124 HH22 ARG 124 7.990 -3.552 -7.253 946 HA PRO 125 HA PRO 125 11.790 -1.801 2.965 947 HB2 PRO 125 HB2 PRO 125 9.342 -0.417 1.940 948 HB3 PRO 125 HB3 PRO 125 10.282 -0.058 3.400 949 HG2 PRO 125 HG2 PRO 125 10.587 1.471 1.276 950 HG3 PRO 125 HG3 PRO 125 12.021 0.926 2.163 951 HD2 PRO 125 HD2 PRO 125 10.927 -0.053 -0.445 952 HD3 PRO 125 HD3 PRO 125 12.616 0.168 0.063 953 H VAL 126 H VAL 126 9.646 -2.604 0.332 954 HA VAL 126 HA VAL 126 7.801 -4.257 1.676 955 HB VAL 126 HB VAL 126 8.790 -4.419 -1.191 956 HG11 VAL 126 HG11 VAL 126 6.366 -5.666 0.077 957 HG12 VAL 126 HG12 VAL 126 7.799 -6.546 -0.466 958 HG13 VAL 126 HG13 VAL 126 6.771 -5.712 -1.638 959 HG21 VAL 126 HG21 VAL 126 6.705 -3.275 -1.716 960 HG22 VAL 126 HG22 VAL 126 7.724 -2.331 -0.625 961 HG23 VAL 126 HG23 VAL 126 6.317 -3.196 0.006 962 H ASP 127 H ASP 127 10.950 -5.008 0.201 963 HA ASP 127 HA ASP 127 10.912 -7.815 0.623 964 HB2 ASP 127 HB2 ASP 127 13.282 -5.928 0.543 965 HB3 ASP 127 HB3 ASP 127 13.454 -7.662 0.715 966 H ALA 128 H ALA 128 11.781 -5.143 2.570 967 HA ALA 128 HA ALA 128 12.962 -6.524 4.714 968 HB1 ALA 128 HB1 ALA 128 11.701 -3.794 4.674 969 HB2 ALA 128 HB2 ALA 128 13.374 -4.164 4.259 970 HB3 ALA 128 HB3 ALA 128 12.803 -4.404 5.906 971 H LEU 129 H LEU 129 9.594 -5.579 4.071 972 HA LEU 129 HA LEU 129 8.806 -6.169 6.745 973 HB2 LEU 129 HB2 LEU 129 6.509 -5.851 6.054 974 HB3 LEU 129 HB3 LEU 129 7.506 -4.586 5.396 975 HG LEU 129 HG LEU 129 7.508 -6.127 3.281 976 HD11 LEU 129 HD11 LEU 129 5.389 -7.317 2.966 977 HD12 LEU 129 HD12 LEU 129 4.960 -6.952 4.644 978 HD13 LEU 129 HD13 LEU 129 6.354 -7.970 4.297 979 HD21 LEU 129 HD21 LEU 129 6.619 -3.842 3.369 980 HD22 LEU 129 HD22 LEU 129 5.121 -4.447 4.069 981 HD23 LEU 129 HD23 LEU 129 5.562 -4.884 2.419 982 H HIS 130 H HIS 130 8.828 -8.094 3.780 983 HA HIS 130 HA HIS 130 7.549 -10.358 4.928 984 HB2 HIS 130 HB2 HIS 130 9.486 -10.176 2.610 985 HB3 HIS 130 HB3 HIS 130 8.624 -11.634 3.064 986 HD1 HIS 130 HD1 HIS 130 5.944 -11.601 2.569 987 HD2 HIS 130 HD2 HIS 130 8.163 -8.419 1.062 988 HE1 HIS 130 HE1 HIS 130 4.508 -10.501 0.858 989 H ALA 131 H ALA 131 10.645 -9.034 5.099 990 HA ALA 131 HA ALA 131 11.860 -11.499 6.111 991 HB1 ALA 131 HB1 ALA 131 13.166 -10.140 4.540 992 HB2 ALA 131 HB2 ALA 131 13.975 -10.276 6.099 993 HB3 ALA 131 HB3 ALA 131 13.123 -8.792 5.676 994 H HIS 132 H HIS 132 9.876 -9.398 7.409 995 HA HIS 132 HA HIS 132 9.355 -8.589 9.410 996 HB2 HIS 132 HB2 HIS 132 11.009 -10.956 10.257 997 HB3 HIS 132 HB3 HIS 132 10.234 -9.909 11.446 998 HD1 HIS 132 HD1 HIS 132 9.516 -12.707 9.153 999 HD2 HIS 132 HD2 HIS 132 7.379 -9.845 11.260 1000 HE1 HIS 132 HE1 HIS 132 7.134 -13.478 9.143 1001 H GLN 133 H GLN 133 11.524 -7.460 8.085 1002 HA GLN 133 HA GLN 133 13.159 -6.268 10.196 1003 HB2 GLN 133 HB2 GLN 133 13.139 -5.934 7.186 1004 HB3 GLN 133 HB3 GLN 133 14.289 -5.159 8.271 1005 HG2 GLN 133 HG2 GLN 133 13.978 -8.125 7.863 1006 HG3 GLN 133 HG3 GLN 133 15.214 -7.124 7.109 1007 HE21 GLN 133 HE21 GLN 133 16.827 -6.255 8.396 1008 HE22 GLN 133 HE22 GLN 133 17.217 -6.936 9.930 1009 H ALA 134 H ALA 134 10.286 -6.048 9.800 1010 HA ALA 134 HA ALA 134 9.316 -3.763 8.608 1011 HB1 ALA 134 HB1 ALA 134 8.241 -5.125 11.066 1012 HB2 ALA 134 HB2 ALA 134 7.922 -5.599 9.399 1013 HB3 ALA 134 HB3 ALA 134 7.347 -4.044 9.997 1014 H ARG 135 H ARG 135 10.913 -4.070 11.704 1015 HA ARG 135 HA ARG 135 10.224 -1.710 12.982 1016 HB2 ARG 135 HB2 ARG 135 11.693 -3.587 13.822 1017 HB3 ARG 135 HB3 ARG 135 12.987 -2.911 12.846 1018 HG2 ARG 135 HG2 ARG 135 12.593 -0.767 14.060 1019 HG3 ARG 135 HG3 ARG 135 11.624 -1.691 15.216 1020 HD2 ARG 135 HD2 ARG 135 13.805 -1.605 16.133 1021 HD3 ARG 135 HD3 ARG 135 13.626 -3.220 15.433 1022 HE ARG 135 HE ARG 135 14.803 -1.256 13.662 1023 HH11 ARG 135 HH11 ARG 135 15.503 -3.874 15.938 1024 HH12 ARG 135 HH12 ARG 135 17.135 -3.988 15.483 1025 HH21 ARG 135 HH21 ARG 135 16.939 -1.402 13.077 1026 HH22 ARG 135 HH22 ARG 135 18.011 -2.533 13.785 1027 H GLU 136 H GLU 136 12.665 -2.370 10.496 1028 HA GLU 136 HA GLU 136 13.690 0.281 10.409 1029 HB2 GLU 136 HB2 GLU 136 14.031 -2.060 8.537 1030 HB3 GLU 136 HB3 GLU 136 14.925 -0.550 8.423 1031 HG2 GLU 136 HG2 GLU 136 14.974 -2.446 10.761 1032 HG3 GLU 136 HG3 GLU 136 16.221 -2.312 9.523 1033 H VAL 137 H VAL 137 11.224 -1.519 8.730 1034 HA VAL 137 HA VAL 137 10.808 0.282 6.587 1035 HB VAL 137 HB VAL 137 8.762 -1.517 7.947 1036 HG11 VAL 137 HG11 VAL 137 7.488 -1.360 5.848 1037 HG12 VAL 137 HG12 VAL 137 8.674 -0.213 5.220 1038 HG13 VAL 137 HG13 VAL 137 7.680 0.220 6.608 1039 HG21 VAL 137 HG21 VAL 137 10.426 -2.007 5.480 1040 HG22 VAL 137 HG22 VAL 137 9.211 -3.096 6.136 1041 HG23 VAL 137 HG23 VAL 137 10.687 -2.764 7.051 1042 H VAL 138 H VAL 138 9.372 0.019 9.802 1043 HA VAL 138 HA VAL 138 7.745 2.311 9.644 1044 HB VAL 138 HB VAL 138 9.013 1.110 12.136 1045 HG11 VAL 138 HG11 VAL 138 8.221 3.374 12.553 1046 HG12 VAL 138 HG12 VAL 138 7.153 2.215 13.350 1047 HG13 VAL 138 HG13 VAL 138 6.655 2.981 11.845 1048 HG21 VAL 138 HG21 VAL 138 6.301 0.619 10.897 1049 HG22 VAL 138 HG22 VAL 138 6.859 -0.035 12.436 1050 HG23 VAL 138 HG23 VAL 138 7.649 -0.516 10.932 1051 H ARG 139 H ARG 139 11.059 1.855 10.709 1052 HA ARG 139 HA ARG 139 11.675 4.439 11.577 1053 HB2 ARG 139 HB2 ARG 139 13.146 2.497 11.898 1054 HB3 ARG 139 HB3 ARG 139 13.426 2.414 10.167 1055 HG2 ARG 139 HG2 ARG 139 14.590 4.562 10.245 1056 HG3 ARG 139 HG3 ARG 139 14.296 4.656 11.983 1057 HD2 ARG 139 HD2 ARG 139 15.571 2.618 12.326 1058 HD3 ARG 139 HD3 ARG 139 15.845 2.465 10.594 1059 HE ARG 139 HE ARG 139 16.766 4.902 11.871 1060 HH11 ARG 139 HH11 ARG 139 17.690 1.605 10.769 1061 HH12 ARG 139 HH12 ARG 139 19.333 1.986 10.623 1062 HH21 ARG 139 HH21 ARG 139 19.088 5.346 11.697 1063 HH22 ARG 139 HH22 ARG 139 20.141 4.146 11.108 1064 H ARG 140 H ARG 140 11.911 3.018 8.339 1065 HA ARG 140 HA ARG 140 12.762 5.402 7.068 1066 HB2 ARG 140 HB2 ARG 140 11.534 2.883 5.958 1067 HB3 ARG 140 HB3 ARG 140 12.087 4.209 4.948 1068 HG2 ARG 140 HG2 ARG 140 13.830 2.663 6.860 1069 HG3 ARG 140 HG3 ARG 140 13.735 2.382 5.118 1070 HD2 ARG 140 HD2 ARG 140 14.508 4.681 4.715 1071 HD3 ARG 140 HD3 ARG 140 14.580 4.957 6.448 1072 HE ARG 140 HE ARG 140 16.357 3.402 6.595 1073 HH11 ARG 140 HH11 ARG 140 15.496 4.151 3.254 1074 HH12 ARG 140 HH12 ARG 140 17.064 3.992 2.624 1075 HH21 ARG 140 HH21 ARG 140 18.528 3.185 5.785 1076 HH22 ARG 140 HH22 ARG 140 18.872 3.408 4.140 1077 H ALA 141 H ALA 141 9.601 3.989 7.620 1078 HA ALA 141 HA ALA 141 8.028 5.720 6.097 1079 HB1 ALA 141 HB1 ALA 141 6.219 5.089 7.679 1080 HB2 ALA 141 HB2 ALA 141 7.433 4.368 8.731 1081 HB3 ALA 141 HB3 ALA 141 7.150 3.697 7.127 1082 H GLN 142 H GLN 142 9.168 5.972 9.415 1083 HA GLN 142 HA GLN 142 8.022 8.481 10.015 1084 HB2 GLN 142 HB2 GLN 142 10.530 7.226 11.125 1085 HB3 GLN 142 HB3 GLN 142 9.687 8.595 11.830 1086 HG2 GLN 142 HG2 GLN 142 7.761 7.224 12.289 1087 HG3 GLN 142 HG3 GLN 142 8.512 5.850 11.472 1088 HE21 GLN 142 HE21 GLN 142 7.603 6.079 14.206 1089 HE22 GLN 142 HE22 GLN 142 8.985 5.780 15.192 1090 H ALA 143 H ALA 143 11.081 7.555 8.575 1091 HA ALA 143 HA ALA 143 12.180 10.168 8.502 1092 HB1 ALA 143 HB1 ALA 143 12.919 7.764 6.834 1093 HB2 ALA 143 HB2 ALA 143 13.575 8.148 8.426 1094 HB3 ALA 143 HB3 ALA 143 13.894 9.215 7.059 1095 H MET 144 H MET 144 9.869 8.574 6.547 1096 HA MET 144 HA MET 144 10.233 10.393 4.318 1097 HB2 MET 144 HB2 MET 144 8.072 8.334 4.816 1098 HB3 MET 144 HB3 MET 144 8.216 9.288 3.353 1099 HG2 MET 144 HG2 MET 144 10.153 7.228 4.379 1100 HG3 MET 144 HG3 MET 144 9.087 7.091 2.985 1101 HE1 MET 144 HE1 MET 144 10.703 9.699 0.491 1102 HE2 MET 144 HE2 MET 144 9.394 10.007 1.632 1103 HE3 MET 144 HE3 MET 144 9.424 8.505 0.711 1104 H ALA 145 H ALA 145 8.253 10.069 7.124 1105 HA ALA 145 HA ALA 145 6.451 12.134 6.255 1106 HB1 ALA 145 HB1 ALA 145 6.677 10.825 8.958 1107 HB2 ALA 145 HB2 ALA 145 5.627 10.292 7.647 1108 HB3 ALA 145 HB3 ALA 145 5.359 11.860 8.412 1109 H TYR 146 H TYR 146 9.066 11.811 8.618 1110 HA TYR 146 HA TYR 146 8.970 14.714 8.982 1111 HB2 TYR 146 HB2 TYR 146 10.257 12.646 10.789 1112 HB3 TYR 146 HB3 TYR 146 9.995 14.349 11.142 1113 HD1 TYR 146 HD1 TYR 146 7.618 15.158 11.504 1114 HD2 TYR 146 HD2 TYR 146 8.595 11.025 11.228 1115 HE1 TYR 146 HE1 TYR 146 5.464 14.579 12.540 1116 HE2 TYR 146 HE2 TYR 146 6.453 10.436 12.253 1117 HH TYR 146 HH TYR 146 3.899 12.606 12.582 Start of MODEL 3 1 H MET 1 H MET 1 0.028 -23.878 4.060 2 HA MET 1 HA MET 1 -1.142 -21.998 3.047 3 HB2 MET 1 HB2 MET 1 -1.817 -24.600 1.626 4 HB3 MET 1 HB3 MET 1 -1.727 -23.018 0.892 5 HG2 MET 1 HG2 MET 1 0.599 -24.524 2.075 6 HG3 MET 1 HG3 MET 1 0.208 -24.417 0.366 7 HE1 MET 1 HE1 MET 1 0.389 -22.191 -1.074 8 HE2 MET 1 HE2 MET 1 0.862 -20.627 -0.413 9 HE3 MET 1 HE3 MET 1 -0.679 -21.350 0.047 10 HA PRO 2 HA PRO 2 -5.518 -22.051 4.060 11 HB2 PRO 2 HB2 PRO 2 -5.748 -19.805 2.169 12 HB3 PRO 2 HB3 PRO 2 -6.092 -19.827 3.900 13 HG2 PRO 2 HG2 PRO 2 -3.968 -18.525 2.858 14 HG3 PRO 2 HG3 PRO 2 -3.929 -19.281 4.460 15 HD2 PRO 2 HD2 PRO 2 -2.775 -20.251 1.879 16 HD3 PRO 2 HD3 PRO 2 -2.130 -20.345 3.531 17 H GLY 3 H GLY 3 -6.785 -23.525 3.067 18 HA2 GLY 3 HA2 GLY 3 -6.425 -24.207 0.293 19 HA3 GLY 3 HA3 GLY 3 -7.558 -24.949 1.408 20 H ARG 4 H ARG 4 -7.111 -21.774 -0.039 21 HA ARG 4 HA ARG 4 -9.934 -21.247 -0.263 22 HB2 ARG 4 HB2 ARG 4 -7.674 -19.751 -1.604 23 HB3 ARG 4 HB3 ARG 4 -9.305 -19.175 -1.331 24 HG2 ARG 4 HG2 ARG 4 -7.212 -19.714 0.756 25 HG3 ARG 4 HG3 ARG 4 -7.776 -18.135 0.220 26 HD2 ARG 4 HD2 ARG 4 -10.018 -18.669 1.097 27 HD3 ARG 4 HD3 ARG 4 -9.406 -20.230 1.657 28 HE ARG 4 HE ARG 4 -8.151 -17.757 2.577 29 HH11 ARG 4 HH11 ARG 4 -10.179 -20.570 3.375 30 HH12 ARG 4 HH12 ARG 4 -9.920 -20.458 5.041 31 HH21 ARG 4 HH21 ARG 4 -7.772 -17.624 4.894 32 HH22 ARG 4 HH22 ARG 4 -8.528 -18.764 5.921 33 H ALA 5 H ALA 5 -11.182 -21.283 -2.112 34 HA ALA 5 HA ALA 5 -9.916 -22.401 -4.507 35 HB1 ALA 5 HB1 ALA 5 -12.163 -23.248 -5.124 36 HB2 ALA 5 HB2 ALA 5 -12.804 -22.627 -3.601 37 HB3 ALA 5 HB3 ALA 5 -11.612 -23.920 -3.592 38 HA PRO 6 HA PRO 6 -10.708 -18.028 -5.427 39 HB2 PRO 6 HB2 PRO 6 -9.096 -18.691 -7.813 40 HB3 PRO 6 HB3 PRO 6 -8.872 -17.400 -6.627 41 HG2 PRO 6 HG2 PRO 6 -7.260 -19.515 -6.638 42 HG3 PRO 6 HG3 PRO 6 -7.810 -18.799 -5.110 43 HD2 PRO 6 HD2 PRO 6 -8.805 -21.250 -6.514 44 HD3 PRO 6 HD3 PRO 6 -8.461 -20.998 -4.787 45 H GLY 7 H GLY 7 -12.731 -17.826 -6.009 46 HA2 GLY 7 HA2 GLY 7 -13.486 -18.561 -8.770 47 HA3 GLY 7 HA3 GLY 7 -14.633 -18.490 -7.424 48 H SER 8 H SER 8 -12.080 -16.336 -7.498 49 HA SER 8 HA SER 8 -13.552 -14.033 -7.176 50 HB2 SER 8 HB2 SER 8 -10.790 -14.154 -8.319 51 HB3 SER 8 HB3 SER 8 -11.468 -13.013 -7.152 52 HG SER 8 HG SER 8 -11.741 -15.161 -5.842 53 H THR 9 H THR 9 -14.814 -13.134 -8.649 54 HA THR 9 HA THR 9 -14.026 -13.135 -11.456 55 HB THR 9 HB THR 9 -16.817 -12.985 -10.257 56 HG1 THR 9 HG1 THR 9 -15.538 -15.022 -9.993 57 HG21 THR 9 HG21 THR 9 -17.541 -13.524 -12.557 58 HG22 THR 9 HG22 THR 9 -15.859 -13.538 -13.085 59 HG23 THR 9 HG23 THR 9 -16.603 -12.033 -12.534 60 H LEU 10 H LEU 10 -14.165 -11.051 -12.440 61 HA LEU 10 HA LEU 10 -13.693 -8.969 -10.581 62 HB2 LEU 10 HB2 LEU 10 -13.797 -8.941 -13.602 63 HB3 LEU 10 HB3 LEU 10 -13.429 -7.536 -12.632 64 HG LEU 10 HG LEU 10 -11.408 -8.454 -13.556 65 HD11 LEU 10 HD11 LEU 10 -11.222 -7.460 -11.377 66 HD12 LEU 10 HD12 LEU 10 -10.070 -8.780 -11.566 67 HD13 LEU 10 HD13 LEU 10 -11.535 -9.019 -10.613 68 HD21 LEU 10 HD21 LEU 10 -12.110 -11.004 -12.140 69 HD22 LEU 10 HD22 LEU 10 -10.573 -10.699 -12.960 70 HD23 LEU 10 HD23 LEU 10 -12.078 -10.764 -13.890 71 H ALA 11 H ALA 11 -15.299 -8.446 -9.504 72 HA ALA 11 HA ALA 11 -17.839 -7.697 -10.740 73 HB1 ALA 11 HB1 ALA 11 -17.961 -9.227 -8.833 74 HB2 ALA 11 HB2 ALA 11 -18.720 -7.683 -8.448 75 HB3 ALA 11 HB3 ALA 11 -17.110 -8.052 -7.831 76 H ARG 12 H ARG 12 -18.665 -5.648 -10.503 77 HA ARG 12 HA ARG 12 -16.639 -3.660 -10.017 78 HB2 ARG 12 HB2 ARG 12 -18.248 -2.023 -10.960 79 HB3 ARG 12 HB3 ARG 12 -17.906 -3.354 -12.049 80 HG2 ARG 12 HG2 ARG 12 -20.044 -4.390 -11.417 81 HG3 ARG 12 HG3 ARG 12 -20.393 -3.010 -10.378 82 HD2 ARG 12 HD2 ARG 12 -20.080 -3.043 -13.374 83 HD3 ARG 12 HD3 ARG 12 -21.539 -2.691 -12.449 84 HE ARG 12 HE ARG 12 -19.221 -0.950 -12.126 85 HH11 ARG 12 HH11 ARG 12 -22.486 -1.354 -13.416 86 HH12 ARG 12 HH12 ARG 12 -22.713 0.292 -13.748 87 HH21 ARG 12 HH21 ARG 12 -19.498 1.282 -12.605 88 HH22 ARG 12 HH22 ARG 12 -20.936 1.849 -13.305 89 H VAL 13 H VAL 13 -16.331 -3.711 -7.948 90 HA VAL 13 HA VAL 13 -18.318 -2.411 -6.255 91 HB VAL 13 HB VAL 13 -18.599 -4.849 -6.061 92 HG11 VAL 13 HG11 VAL 13 -15.776 -4.932 -5.049 93 HG12 VAL 13 HG12 VAL 13 -16.415 -5.647 -6.529 94 HG13 VAL 13 HG13 VAL 13 -16.925 -6.271 -4.962 95 HG21 VAL 13 HG21 VAL 13 -17.541 -3.601 -3.524 96 HG22 VAL 13 HG22 VAL 13 -18.551 -5.044 -3.598 97 HG23 VAL 13 HG23 VAL 13 -19.189 -3.485 -4.135 98 H GLY 14 H GLY 14 -15.871 -1.735 -7.577 99 HA2 GLY 14 HA2 GLY 14 -13.789 -1.625 -5.532 100 HA3 GLY 14 HA3 GLY 14 -13.625 -1.120 -7.209 101 H SER 15 H SER 15 -15.902 -0.216 -4.680 102 HA SER 15 HA SER 15 -15.575 2.587 -5.358 103 HB2 SER 15 HB2 SER 15 -17.424 1.235 -3.385 104 HB3 SER 15 HB3 SER 15 -17.519 2.915 -3.938 105 HG SER 15 HG SER 15 -17.761 2.070 -6.064 106 H ILE 16 H ILE 16 -13.296 1.770 -4.380 107 HA ILE 16 HA ILE 16 -13.117 2.924 -1.681 108 HB ILE 16 HB ILE 16 -11.331 0.826 -2.975 109 HG12 ILE 16 HG12 ILE 16 -13.456 -0.109 -2.164 110 HG13 ILE 16 HG13 ILE 16 -12.102 -0.699 -1.212 111 HG21 ILE 16 HG21 ILE 16 -10.007 2.357 -1.617 112 HG22 ILE 16 HG22 ILE 16 -10.070 0.762 -0.874 113 HG23 ILE 16 HG23 ILE 16 -11.066 2.070 -0.236 114 HD11 ILE 16 HD11 ILE 16 -14.027 1.477 -0.403 115 HD12 ILE 16 HD12 ILE 16 -12.677 0.883 0.562 116 HD13 ILE 16 HD13 ILE 16 -14.028 -0.185 0.175 117 HA PRO 17 HA PRO 17 -10.902 5.960 -4.136 118 HB2 PRO 17 HB2 PRO 17 -9.502 6.752 -1.654 119 HB3 PRO 17 HB3 PRO 17 -10.566 7.706 -2.694 120 HG2 PRO 17 HG2 PRO 17 -11.354 6.889 -0.261 121 HG3 PRO 17 HG3 PRO 17 -12.481 7.000 -1.624 122 HD2 PRO 17 HD2 PRO 17 -11.140 4.591 -0.464 123 HD3 PRO 17 HD3 PRO 17 -12.809 4.795 -1.035 124 H ALA 18 H ALA 18 -9.059 5.778 -5.255 125 HA ALA 18 HA ALA 18 -6.766 4.414 -4.066 126 HB1 ALA 18 HB1 ALA 18 -7.920 3.881 -6.797 127 HB2 ALA 18 HB2 ALA 18 -8.025 2.798 -5.416 128 HB3 ALA 18 HB3 ALA 18 -6.456 3.155 -6.141 129 H GLY 19 H GLY 19 -4.760 5.238 -4.751 130 HA2 GLY 19 HA2 GLY 19 -4.941 7.647 -6.350 131 HA3 GLY 19 HA3 GLY 19 -3.578 7.126 -5.373 132 H ASP 20 H ASP 20 -1.921 6.712 -6.563 133 HA ASP 20 HA ASP 20 -2.264 5.754 -9.333 134 HB2 ASP 20 HB2 ASP 20 -1.336 8.060 -9.004 135 HB3 ASP 20 HB3 ASP 20 -0.020 7.358 -8.094 136 H ASP 21 H ASP 21 -0.840 4.070 -10.040 137 HA ASP 21 HA ASP 21 -0.034 2.377 -7.849 138 HB2 ASP 21 HB2 ASP 21 0.184 0.595 -9.497 139 HB3 ASP 21 HB3 ASP 21 -1.352 1.424 -9.685 140 H VAL 22 H VAL 22 1.954 2.151 -7.119 141 HA VAL 22 HA VAL 22 4.178 3.274 -8.660 142 HB VAL 22 HB VAL 22 4.108 2.375 -5.755 143 HG11 VAL 22 HG11 VAL 22 6.288 3.454 -5.515 144 HG12 VAL 22 HG12 VAL 22 6.282 3.881 -7.220 145 HG13 VAL 22 HG13 VAL 22 6.368 2.186 -6.741 146 HG21 VAL 22 HG21 VAL 22 2.754 4.365 -6.187 147 HG22 VAL 22 HG22 VAL 22 4.137 5.150 -6.946 148 HG23 VAL 22 HG23 VAL 22 4.176 4.763 -5.225 149 H LEU 23 H LEU 23 3.039 0.204 -7.460 150 HA LEU 23 HA LEU 23 5.477 -1.143 -7.965 151 HB2 LEU 23 HB2 LEU 23 3.997 -3.271 -7.846 152 HB3 LEU 23 HB3 LEU 23 4.325 -2.343 -6.410 153 HG LEU 23 HG LEU 23 2.071 -1.414 -6.458 154 HD11 LEU 23 HD11 LEU 23 1.687 -1.375 -8.878 155 HD12 LEU 23 HD12 LEU 23 0.392 -2.231 -8.038 156 HD13 LEU 23 HD13 LEU 23 1.638 -3.139 -8.903 157 HD21 LEU 23 HD21 LEU 23 0.855 -3.460 -5.973 158 HD22 LEU 23 HD22 LEU 23 2.489 -3.482 -5.305 159 HD23 LEU 23 HD23 LEU 23 2.125 -4.400 -6.769 160 H ASP 24 H ASP 24 5.399 -3.238 -9.403 161 HA ASP 24 HA ASP 24 5.181 -2.127 -12.067 162 HB2 ASP 24 HB2 ASP 24 7.243 -3.239 -11.472 163 HB3 ASP 24 HB3 ASP 24 6.399 -4.702 -11.021 164 HA PRO 25 HA PRO 25 1.259 -3.833 -13.210 165 HB2 PRO 25 HB2 PRO 25 2.673 -4.494 -15.752 166 HB3 PRO 25 HB3 PRO 25 1.124 -3.680 -15.502 167 HG2 PRO 25 HG2 PRO 25 3.264 -2.263 -16.120 168 HG3 PRO 25 HG3 PRO 25 2.123 -1.673 -14.896 169 HD2 PRO 25 HD2 PRO 25 4.827 -2.881 -14.536 170 HD3 PRO 25 HD3 PRO 25 4.023 -1.588 -13.621 171 H ASP 26 H ASP 26 4.143 -5.842 -13.533 172 HA ASP 26 HA ASP 26 2.561 -8.211 -14.061 173 HB2 ASP 26 HB2 ASP 26 4.778 -7.994 -15.108 174 HB3 ASP 26 HB3 ASP 26 5.517 -7.942 -13.516 175 H GLU 27 H GLU 27 3.817 -6.573 -11.313 176 HA GLU 27 HA GLU 27 4.150 -8.797 -9.638 177 HB2 GLU 27 HB2 GLU 27 3.639 -5.911 -8.902 178 HB3 GLU 27 HB3 GLU 27 4.164 -7.160 -7.775 179 HG2 GLU 27 HG2 GLU 27 6.165 -7.517 -9.154 180 HG3 GLU 27 HG3 GLU 27 5.655 -6.194 -10.187 181 HA PRO 28 HA PRO 28 0.079 -10.094 -9.014 182 HB2 PRO 28 HB2 PRO 28 0.403 -11.463 -6.674 183 HB3 PRO 28 HB3 PRO 28 0.935 -12.070 -8.244 184 HG2 PRO 28 HG2 PRO 28 2.519 -10.705 -6.111 185 HG3 PRO 28 HG3 PRO 28 2.944 -12.124 -7.086 186 HD2 PRO 28 HD2 PRO 28 3.903 -9.681 -7.647 187 HD3 PRO 28 HD3 PRO 28 3.510 -10.846 -8.927 188 H THR 29 H THR 29 -1.728 -9.488 -8.060 189 HA THR 29 HA THR 29 -1.607 -7.863 -5.661 190 HB THR 29 HB THR 29 -3.393 -6.443 -6.836 191 HG1 THR 29 HG1 THR 29 -3.167 -8.046 -8.751 192 HG21 THR 29 HG21 THR 29 -1.674 -4.934 -7.809 193 HG22 THR 29 HG22 THR 29 -0.486 -6.226 -7.658 194 HG23 THR 29 HG23 THR 29 -1.220 -5.528 -6.214 195 H TYR 30 H TYR 30 -3.891 -7.406 -4.980 196 HA TYR 30 HA TYR 30 -5.694 -9.630 -5.548 197 HB2 TYR 30 HB2 TYR 30 -5.194 -8.222 -2.907 198 HB3 TYR 30 HB3 TYR 30 -6.548 -9.301 -3.209 199 HD1 TYR 30 HD1 TYR 30 -5.574 -11.547 -4.472 200 HD2 TYR 30 HD2 TYR 30 -3.600 -9.194 -1.574 201 HE1 TYR 30 HE1 TYR 30 -4.268 -13.485 -3.842 202 HE2 TYR 30 HE2 TYR 30 -2.249 -11.133 -0.910 203 HH TYR 30 HH TYR 30 -2.380 -13.603 -1.022 204 H ASP 31 H ASP 31 -7.984 -8.871 -5.382 205 HA ASP 31 HA ASP 31 -8.293 -6.012 -5.240 206 HB2 ASP 31 HB2 ASP 31 -9.655 -5.923 -7.202 207 HB3 ASP 31 HB3 ASP 31 -8.225 -6.823 -7.675 208 H LEU 32 H LEU 32 -10.862 -5.737 -5.211 209 HA LEU 32 HA LEU 32 -11.634 -6.403 -2.736 210 HB2 LEU 32 HB2 LEU 32 -13.357 -5.824 -5.098 211 HB3 LEU 32 HB3 LEU 32 -14.067 -6.136 -3.535 212 HG LEU 32 HG LEU 32 -13.976 -3.820 -3.819 213 HD11 LEU 32 HD11 LEU 32 -11.754 -4.553 -1.948 214 HD12 LEU 32 HD12 LEU 32 -13.479 -4.542 -1.593 215 HD13 LEU 32 HD13 LEU 32 -12.647 -3.033 -1.963 216 HD21 LEU 32 HD21 LEU 32 -11.028 -4.034 -4.434 217 HD22 LEU 32 HD22 LEU 32 -11.927 -2.527 -4.254 218 HD23 LEU 32 HD23 LEU 32 -12.301 -3.626 -5.584 219 HA PRO 33 HA PRO 33 -14.104 -10.403 -3.693 220 HB2 PRO 33 HB2 PRO 33 -13.680 -11.679 -6.078 221 HB3 PRO 33 HB3 PRO 33 -15.013 -10.559 -5.797 222 HG2 PRO 33 HG2 PRO 33 -12.388 -10.076 -7.129 223 HG3 PRO 33 HG3 PRO 33 -14.000 -9.505 -7.599 224 HD2 PRO 33 HD2 PRO 33 -12.211 -7.923 -6.339 225 HD3 PRO 33 HD3 PRO 33 -13.958 -7.777 -6.070 226 H ARG 34 H ARG 34 -10.882 -10.155 -5.183 227 HA ARG 34 HA ARG 34 -10.070 -12.810 -4.585 228 HB2 ARG 34 HB2 ARG 34 -9.066 -11.077 -6.250 229 HB3 ARG 34 HB3 ARG 34 -8.233 -10.502 -4.806 230 HG2 ARG 34 HG2 ARG 34 -6.787 -11.940 -6.077 231 HG3 ARG 34 HG3 ARG 34 -7.207 -12.680 -4.519 232 HD2 ARG 34 HD2 ARG 34 -8.711 -14.161 -5.534 233 HD3 ARG 34 HD3 ARG 34 -8.679 -13.258 -7.051 234 HE ARG 34 HE ARG 34 -6.147 -14.384 -6.195 235 HH11 ARG 34 HH11 ARG 34 -9.076 -14.948 -8.039 236 HH12 ARG 34 HH12 ARG 34 -8.352 -15.983 -9.184 237 HH21 ARG 34 HH21 ARG 34 -5.128 -15.792 -7.701 238 HH22 ARG 34 HH22 ARG 34 -6.001 -16.482 -8.988 239 H VAL 35 H VAL 35 -9.822 -9.734 -2.844 240 HA VAL 35 HA VAL 35 -8.132 -10.748 -0.783 241 HB VAL 35 HB VAL 35 -10.066 -8.404 -0.578 242 HG11 VAL 35 HG11 VAL 35 -8.618 -7.627 1.256 243 HG12 VAL 35 HG12 VAL 35 -7.658 -9.101 1.106 244 HG13 VAL 35 HG13 VAL 35 -9.343 -9.198 1.609 245 HG21 VAL 35 HG21 VAL 35 -7.131 -8.388 -1.257 246 HG22 VAL 35 HG22 VAL 35 -8.161 -6.976 -1.040 247 HG23 VAL 35 HG23 VAL 35 -8.455 -8.079 -2.387 248 H ALA 36 H ALA 36 -11.578 -10.409 -1.189 249 HA ALA 36 HA ALA 36 -12.447 -11.327 1.302 250 HB1 ALA 36 HB1 ALA 36 -14.552 -11.820 0.155 251 HB2 ALA 36 HB2 ALA 36 -13.748 -11.659 -1.407 252 HB3 ALA 36 HB3 ALA 36 -13.914 -10.255 -0.351 253 H GLU 37 H GLU 37 -11.607 -12.949 -1.651 254 HA GLU 37 HA GLU 37 -12.222 -15.628 -1.129 255 HB2 GLU 37 HB2 GLU 37 -11.460 -14.407 -3.276 256 HB3 GLU 37 HB3 GLU 37 -9.848 -14.626 -2.660 257 HG2 GLU 37 HG2 GLU 37 -10.133 -16.378 -4.151 258 HG3 GLU 37 HG3 GLU 37 -10.356 -17.106 -2.558 259 H LEU 38 H LEU 38 -9.280 -13.715 -0.640 260 HA LEU 38 HA LEU 38 -7.635 -15.852 0.226 261 HB2 LEU 38 HB2 LEU 38 -6.749 -13.839 -0.817 262 HB3 LEU 38 HB3 LEU 38 -7.291 -12.880 0.544 263 HG LEU 38 HG LEU 38 -5.758 -14.267 1.986 264 HD11 LEU 38 HD11 LEU 38 -5.440 -16.168 0.527 265 HD12 LEU 38 HD12 LEU 38 -3.892 -15.399 0.886 266 HD13 LEU 38 HD13 LEU 38 -4.663 -15.134 -0.675 267 HD21 LEU 38 HD21 LEU 38 -5.214 -11.997 1.331 268 HD22 LEU 38 HD22 LEU 38 -4.536 -12.581 -0.189 269 HD23 LEU 38 HD23 LEU 38 -3.764 -13.001 1.338 270 H LEU 39 H LEU 39 -9.210 -13.193 1.984 271 HA LEU 39 HA LEU 39 -8.177 -14.183 4.497 272 HB2 LEU 39 HB2 LEU 39 -10.080 -11.927 3.930 273 HB3 LEU 39 HB3 LEU 39 -9.394 -12.296 5.499 274 HG LEU 39 HG LEU 39 -7.864 -11.377 3.062 275 HD11 LEU 39 HD11 LEU 39 -8.518 -9.971 5.646 276 HD12 LEU 39 HD12 LEU 39 -9.199 -9.610 4.060 277 HD13 LEU 39 HD13 LEU 39 -7.483 -9.342 4.365 278 HD21 LEU 39 HD21 LEU 39 -5.943 -11.218 4.604 279 HD22 LEU 39 HD22 LEU 39 -6.502 -12.879 4.408 280 HD23 LEU 39 HD23 LEU 39 -6.913 -11.976 5.864 281 H GLY 40 H GLY 40 -10.974 -14.684 2.653 282 HA2 GLY 40 HA2 GLY 40 -12.680 -16.144 3.031 283 HA3 GLY 40 HA3 GLY 40 -12.011 -16.489 4.626 284 H VAL 41 H VAL 41 -12.680 -13.292 3.502 285 HA VAL 41 HA VAL 41 -14.938 -13.102 5.398 286 HB VAL 41 HB VAL 41 -14.280 -10.876 6.089 287 HG11 VAL 41 HG11 VAL 41 -11.887 -12.670 6.238 288 HG12 VAL 41 HG12 VAL 41 -13.241 -12.605 7.363 289 HG13 VAL 41 HG13 VAL 41 -12.151 -11.228 7.219 290 HG21 VAL 41 HG21 VAL 41 -12.231 -9.749 5.307 291 HG22 VAL 41 HG22 VAL 41 -13.398 -9.994 4.014 292 HG23 VAL 41 HG23 VAL 41 -11.982 -11.041 4.125 293 HA PRO 42 HA PRO 42 -17.132 -11.414 1.983 294 HB2 PRO 42 HB2 PRO 42 -18.667 -9.435 3.052 295 HB3 PRO 42 HB3 PRO 42 -19.039 -11.153 3.220 296 HG2 PRO 42 HG2 PRO 42 -17.737 -9.300 5.164 297 HG3 PRO 42 HG3 PRO 42 -18.902 -10.605 5.454 298 HD2 PRO 42 HD2 PRO 42 -16.249 -10.872 5.922 299 HD3 PRO 42 HD3 PRO 42 -17.285 -12.230 5.443 300 H VAL 43 H VAL 43 -17.306 -9.685 0.544 301 HA VAL 43 HA VAL 43 -15.046 -8.078 0.230 302 HB VAL 43 HB VAL 43 -17.769 -7.690 -1.016 303 HG11 VAL 43 HG11 VAL 43 -16.524 -6.601 -2.864 304 HG12 VAL 43 HG12 VAL 43 -15.053 -6.724 -1.887 305 HG13 VAL 43 HG13 VAL 43 -16.394 -5.725 -1.335 306 HG21 VAL 43 HG21 VAL 43 -15.400 -9.295 -1.972 307 HG22 VAL 43 HG22 VAL 43 -16.859 -8.990 -2.912 308 HG23 VAL 43 HG23 VAL 43 -16.951 -9.934 -1.428 309 H SER 44 H SER 44 -18.196 -7.326 1.585 310 HA SER 44 HA SER 44 -17.857 -4.567 1.805 311 HB2 SER 44 HB2 SER 44 -20.045 -5.710 2.033 312 HB3 SER 44 HB3 SER 44 -19.516 -6.395 3.565 313 HG SER 44 HG SER 44 -19.874 -3.662 2.925 314 H LYS 45 H LYS 45 -16.778 -7.216 3.940 315 HA LYS 45 HA LYS 45 -16.026 -5.512 6.098 316 HB2 LYS 45 HB2 LYS 45 -16.157 -8.141 6.183 317 HB3 LYS 45 HB3 LYS 45 -14.541 -8.041 5.466 318 HG2 LYS 45 HG2 LYS 45 -13.698 -6.824 7.309 319 HG3 LYS 45 HG3 LYS 45 -15.287 -6.779 8.069 320 HD2 LYS 45 HD2 LYS 45 -15.272 -9.246 8.167 321 HD3 LYS 45 HD3 LYS 45 -13.649 -9.235 7.471 322 HE2 LYS 45 HE2 LYS 45 -13.475 -9.491 9.847 323 HE3 LYS 45 HE3 LYS 45 -12.873 -7.899 9.397 324 HZ1 LYS 45 HZ1 LYS 45 -15.078 -6.984 10.078 325 HZ2 LYS 45 HZ2 LYS 45 -14.229 -7.703 11.332 326 HZ3 LYS 45 HZ3 LYS 45 -15.522 -8.505 10.630 327 H VAL 46 H VAL 46 -14.465 -6.729 3.243 328 HA VAL 46 HA VAL 46 -11.863 -5.764 3.700 329 HB VAL 46 HB VAL 46 -13.290 -6.142 1.051 330 HG11 VAL 46 HG11 VAL 46 -11.050 -6.310 0.071 331 HG12 VAL 46 HG12 VAL 46 -10.346 -5.964 1.657 332 HG13 VAL 46 HG13 VAL 46 -11.330 -4.744 0.849 333 HG21 VAL 46 HG21 VAL 46 -12.172 -8.330 0.989 334 HG22 VAL 46 HG22 VAL 46 -13.256 -8.191 2.372 335 HG23 VAL 46 HG23 VAL 46 -11.515 -8.032 2.599 336 H ALA 47 H ALA 47 -14.666 -4.292 2.171 337 HA ALA 47 HA ALA 47 -13.508 -1.913 1.294 338 HB1 ALA 47 HB1 ALA 47 -15.763 -2.630 0.637 339 HB2 ALA 47 HB2 ALA 47 -15.792 -0.996 1.308 340 HB3 ALA 47 HB3 ALA 47 -16.329 -2.362 2.283 341 H GLN 48 H GLN 48 -14.941 -2.764 4.405 342 HA GLN 48 HA GLN 48 -14.530 -0.246 5.585 343 HB2 GLN 48 HB2 GLN 48 -15.269 -2.939 6.597 344 HB3 GLN 48 HB3 GLN 48 -14.672 -1.759 7.752 345 HG2 GLN 48 HG2 GLN 48 -17.084 -1.772 7.657 346 HG3 GLN 48 HG3 GLN 48 -16.428 -0.221 7.137 347 HE21 GLN 48 HE21 GLN 48 -16.663 0.339 4.988 348 HE22 GLN 48 HE22 GLN 48 -17.799 -0.441 3.928 349 H GLN 49 H GLN 49 -12.592 -3.181 5.524 350 HA GLN 49 HA GLN 49 -10.610 -2.474 7.399 351 HB2 GLN 49 HB2 GLN 49 -10.044 -3.974 4.822 352 HB3 GLN 49 HB3 GLN 49 -9.167 -4.101 6.332 353 HG2 GLN 49 HG2 GLN 49 -11.993 -5.026 5.873 354 HG3 GLN 49 HG3 GLN 49 -10.568 -6.053 5.837 355 HE21 GLN 49 HE21 GLN 49 -9.758 -6.784 7.702 356 HE22 GLN 49 HE22 GLN 49 -10.441 -6.471 9.252 357 H LEU 50 H LEU 50 -10.826 -1.913 3.937 358 HA LEU 50 HA LEU 50 -8.379 -0.605 3.537 359 HB2 LEU 50 HB2 LEU 50 -10.981 -0.520 2.038 360 HB3 LEU 50 HB3 LEU 50 -9.536 0.302 1.477 361 HG LEU 50 HG LEU 50 -9.606 -2.670 1.993 362 HD11 LEU 50 HD11 LEU 50 -10.001 -1.216 -0.625 363 HD12 LEU 50 HD12 LEU 50 -11.258 -2.084 0.256 364 HD13 LEU 50 HD13 LEU 50 -9.877 -2.959 -0.403 365 HD21 LEU 50 HD21 LEU 50 -7.434 -1.542 1.978 366 HD22 LEU 50 HD22 LEU 50 -7.785 -0.913 0.374 367 HD23 LEU 50 HD23 LEU 50 -7.632 -2.655 0.621 368 H ARG 51 H ARG 51 -11.584 0.656 4.246 369 HA ARG 51 HA ARG 51 -10.751 3.359 4.069 370 HB2 ARG 51 HB2 ARG 51 -13.246 2.125 5.199 371 HB3 ARG 51 HB3 ARG 51 -12.979 3.866 5.122 372 HG2 ARG 51 HG2 ARG 51 -12.811 3.754 2.705 373 HG3 ARG 51 HG3 ARG 51 -12.991 1.999 2.758 374 HD2 ARG 51 HD2 ARG 51 -15.189 2.269 3.766 375 HD3 ARG 51 HD3 ARG 51 -15.021 4.026 3.664 376 HE ARG 51 HE ARG 51 -14.732 3.445 1.147 377 HH11 ARG 51 HH11 ARG 51 -17.072 2.143 3.441 378 HH12 ARG 51 HH12 ARG 51 -18.144 1.567 2.247 379 HH21 ARG 51 HH21 ARG 51 -16.208 2.724 -0.503 380 HH22 ARG 51 HH22 ARG 51 -17.666 1.965 -0.042 381 H GLU 52 H GLU 52 -10.530 1.042 6.610 382 HA GLU 52 HA GLU 52 -10.254 3.110 8.634 383 HB2 GLU 52 HB2 GLU 52 -9.857 0.130 8.850 384 HB3 GLU 52 HB3 GLU 52 -9.802 1.262 10.190 385 HG2 GLU 52 HG2 GLU 52 -12.148 1.852 9.725 386 HG3 GLU 52 HG3 GLU 52 -12.175 0.610 8.473 387 H GLY 53 H GLY 53 -8.337 1.863 6.286 388 HA2 GLY 53 HA2 GLY 53 -6.093 2.240 5.887 389 HA3 GLY 53 HA3 GLY 53 -5.971 2.964 7.488 390 H HIS 54 H HIS 54 -7.215 -0.218 6.744 391 HA HIS 54 HA HIS 54 -5.260 -1.454 8.501 392 HB2 HIS 54 HB2 HIS 54 -7.736 -2.068 8.395 393 HB3 HIS 54 HB3 HIS 54 -7.423 -2.753 6.817 394 HD1 HIS 54 HD1 HIS 54 -7.809 -3.746 10.199 395 HD2 HIS 54 HD2 HIS 54 -5.312 -4.908 7.095 396 HE1 HIS 54 HE1 HIS 54 -6.991 -6.053 10.796 397 H LEU 55 H LEU 55 -5.969 -1.040 5.135 398 HA LEU 55 HA LEU 55 -3.377 -1.706 4.317 399 HB2 LEU 55 HB2 LEU 55 -3.912 -3.485 2.715 400 HB3 LEU 55 HB3 LEU 55 -4.291 -4.017 4.329 401 HG LEU 55 HG LEU 55 -6.313 -3.165 2.238 402 HD11 LEU 55 HD11 LEU 55 -5.184 -5.224 1.661 403 HD12 LEU 55 HD12 LEU 55 -6.866 -5.523 2.105 404 HD13 LEU 55 HD13 LEU 55 -5.572 -5.897 3.244 405 HD21 LEU 55 HD21 LEU 55 -6.731 -4.451 4.943 406 HD22 LEU 55 HD22 LEU 55 -7.986 -4.131 3.742 407 HD23 LEU 55 HD23 LEU 55 -7.143 -2.790 4.515 408 H VAL 56 H VAL 56 -3.352 -1.322 1.745 409 HA VAL 56 HA VAL 56 -5.374 0.735 1.235 410 HB VAL 56 HB VAL 56 -3.629 2.174 0.151 411 HG11 VAL 56 HG11 VAL 56 -4.439 2.722 2.372 412 HG12 VAL 56 HG12 VAL 56 -2.720 3.095 2.238 413 HG13 VAL 56 HG13 VAL 56 -3.244 1.643 3.090 414 HG21 VAL 56 HG21 VAL 56 -1.265 1.818 0.764 415 HG22 VAL 56 HG22 VAL 56 -1.908 0.502 -0.224 416 HG23 VAL 56 HG23 VAL 56 -1.720 0.285 1.512 417 H ALA 57 H ALA 57 -5.468 1.449 -1.025 418 HA ALA 57 HA ALA 57 -4.964 -0.767 -2.885 419 HB1 ALA 57 HB1 ALA 57 -7.298 -0.782 -2.128 420 HB2 ALA 57 HB2 ALA 57 -7.166 -0.361 -3.834 421 HB3 ALA 57 HB3 ALA 57 -7.468 0.897 -2.638 422 H VAL 58 H VAL 58 -4.581 -0.109 -4.997 423 HA VAL 58 HA VAL 58 -4.539 2.756 -5.560 424 HB VAL 58 HB VAL 58 -2.466 2.461 -6.930 425 HG11 VAL 58 HG11 VAL 58 -2.201 1.903 -3.984 426 HG12 VAL 58 HG12 VAL 58 -2.356 3.487 -4.741 427 HG13 VAL 58 HG13 VAL 58 -0.914 2.511 -5.026 428 HG21 VAL 58 HG21 VAL 58 -2.291 -0.195 -5.492 429 HG22 VAL 58 HG22 VAL 58 -1.016 0.519 -6.480 430 HG23 VAL 58 HG23 VAL 58 -2.541 0.035 -7.224 431 H ARG 59 H ARG 59 -4.423 3.166 -7.953 432 HA ARG 59 HA ARG 59 -6.206 1.219 -9.247 433 HB2 ARG 59 HB2 ARG 59 -7.169 3.441 -8.749 434 HB3 ARG 59 HB3 ARG 59 -5.884 4.177 -9.691 435 HG2 ARG 59 HG2 ARG 59 -6.745 2.859 -11.672 436 HG3 ARG 59 HG3 ARG 59 -8.128 2.436 -10.672 437 HD2 ARG 59 HD2 ARG 59 -7.275 5.260 -11.331 438 HD3 ARG 59 HD3 ARG 59 -8.567 4.377 -12.132 439 HE ARG 59 HE ARG 59 -9.849 4.489 -10.154 440 HH11 ARG 59 HH11 ARG 59 -6.858 6.376 -9.901 441 HH12 ARG 59 HH12 ARG 59 -7.451 7.410 -8.691 442 HH21 ARG 59 HH21 ARG 59 -10.650 5.911 -8.544 443 HH22 ARG 59 HH22 ARG 59 -9.678 7.150 -7.876 444 H ARG 60 H ARG 60 -5.214 0.108 -10.796 445 HA ARG 60 HA ARG 60 -3.377 1.597 -12.472 446 HB2 ARG 60 HB2 ARG 60 -2.003 -0.384 -12.887 447 HB3 ARG 60 HB3 ARG 60 -1.975 0.089 -11.208 448 HG2 ARG 60 HG2 ARG 60 -3.462 -1.774 -10.663 449 HG3 ARG 60 HG3 ARG 60 -3.511 -2.231 -12.374 450 HD2 ARG 60 HD2 ARG 60 -1.074 -2.485 -12.371 451 HD3 ARG 60 HD3 ARG 60 -1.037 -2.047 -10.669 452 HE ARG 60 HE ARG 60 -2.700 -4.291 -11.045 453 HH11 ARG 60 HH11 ARG 60 0.688 -3.349 -11.120 454 HH12 ARG 60 HH12 ARG 60 1.315 -4.865 -10.690 455 HH21 ARG 60 HH21 ARG 60 -1.883 -6.417 -10.406 456 HH22 ARG 60 HH22 ARG 60 -0.203 -6.661 -10.254 457 H ALA 61 H ALA 61 -3.905 1.713 -14.459 458 HA ALA 61 HA ALA 61 -4.976 1.476 -16.430 459 HB1 ALA 61 HB1 ALA 61 -5.363 -0.781 -17.298 460 HB2 ALA 61 HB2 ALA 61 -5.141 -1.453 -15.683 461 HB3 ALA 61 HB3 ALA 61 -3.786 -0.684 -16.513 462 H GLY 62 H GLY 62 -6.430 2.021 -13.984 463 HA2 GLY 62 HA2 GLY 62 -8.684 2.714 -13.790 464 HA3 GLY 62 HA3 GLY 62 -9.119 1.555 -15.033 465 H GLY 63 H GLY 63 -7.355 -0.384 -13.295 466 HA2 GLY 63 HA2 GLY 63 -9.671 -1.320 -11.779 467 HA3 GLY 63 HA3 GLY 63 -8.235 -2.257 -12.185 468 H VAL 64 H VAL 64 -9.712 -1.466 -9.613 469 HA VAL 64 HA VAL 64 -7.445 -0.253 -8.276 470 HB VAL 64 HB VAL 64 -9.564 0.837 -7.770 471 HG11 VAL 64 HG11 VAL 64 -10.563 -1.833 -6.813 472 HG12 VAL 64 HG12 VAL 64 -11.116 -0.944 -8.239 473 HG13 VAL 64 HG13 VAL 64 -11.394 -0.288 -6.624 474 HG21 VAL 64 HG21 VAL 64 -9.603 0.693 -5.333 475 HG22 VAL 64 HG22 VAL 64 -7.951 0.717 -5.953 476 HG23 VAL 64 HG23 VAL 64 -8.665 -0.801 -5.412 477 H VAL 65 H VAL 65 -6.085 -1.377 -7.199 478 HA VAL 65 HA VAL 65 -6.766 -4.106 -6.424 479 HB VAL 65 HB VAL 65 -4.473 -4.823 -7.213 480 HG11 VAL 65 HG11 VAL 65 -6.486 -5.434 -8.458 481 HG12 VAL 65 HG12 VAL 65 -5.156 -5.098 -9.567 482 HG13 VAL 65 HG13 VAL 65 -6.427 -3.900 -9.327 483 HG21 VAL 65 HG21 VAL 65 -4.628 -2.230 -8.735 484 HG22 VAL 65 HG22 VAL 65 -3.408 -3.480 -8.972 485 HG23 VAL 65 HG23 VAL 65 -3.484 -2.594 -7.442 486 H ILE 66 H ILE 66 -5.318 -5.041 -5.002 487 HA ILE 66 HA ILE 66 -4.152 -3.240 -2.989 488 HB ILE 66 HB ILE 66 -4.995 -6.125 -2.718 489 HG12 ILE 66 HG12 ILE 66 -7.018 -4.874 -3.265 490 HG13 ILE 66 HG13 ILE 66 -7.051 -5.381 -1.583 491 HG21 ILE 66 HG21 ILE 66 -3.418 -5.386 -1.045 492 HG22 ILE 66 HG22 ILE 66 -4.992 -5.705 -0.321 493 HG23 ILE 66 HG23 ILE 66 -4.477 -4.041 -0.611 494 HD11 ILE 66 HD11 ILE 66 -6.406 -2.651 -2.616 495 HD12 ILE 66 HD12 ILE 66 -6.367 -3.140 -0.922 496 HD13 ILE 66 HD13 ILE 66 -7.894 -3.156 -1.811 497 HA PRO 67 HA PRO 67 -0.343 -5.330 -4.383 498 HB2 PRO 67 HB2 PRO 67 0.798 -4.429 -1.827 499 HB3 PRO 67 HB3 PRO 67 1.306 -4.041 -3.472 500 HG2 PRO 67 HG2 PRO 67 0.113 -2.224 -1.897 501 HG3 PRO 67 HG3 PRO 67 -0.155 -2.270 -3.649 502 HD2 PRO 67 HD2 PRO 67 -1.912 -3.250 -1.437 503 HD3 PRO 67 HD3 PRO 67 -2.337 -2.400 -2.941 504 H GLN 68 H GLN 68 -0.239 -7.526 -4.193 505 HA GLN 68 HA GLN 68 -1.100 -8.993 -1.980 506 HB2 GLN 68 HB2 GLN 68 -1.122 -9.915 -4.146 507 HB3 GLN 68 HB3 GLN 68 0.589 -9.640 -4.372 508 HG2 GLN 68 HG2 GLN 68 1.149 -11.398 -2.863 509 HG3 GLN 68 HG3 GLN 68 -0.534 -11.571 -2.359 510 HE21 GLN 68 HE21 GLN 68 -1.605 -11.261 -5.030 511 HE22 GLN 68 HE22 GLN 68 -1.258 -12.703 -5.865 512 H VAL 69 H VAL 69 1.895 -7.549 -2.716 513 HA VAL 69 HA VAL 69 3.529 -9.070 -0.975 514 HB VAL 69 HB VAL 69 5.169 -7.159 -1.265 515 HG11 VAL 69 HG11 VAL 69 5.556 -7.633 -3.650 516 HG12 VAL 69 HG12 VAL 69 3.941 -8.336 -3.770 517 HG13 VAL 69 HG13 VAL 69 5.164 -9.107 -2.765 518 HG21 VAL 69 HG21 VAL 69 4.615 -5.457 -2.943 519 HG22 VAL 69 HG22 VAL 69 3.525 -5.377 -1.557 520 HG23 VAL 69 HG23 VAL 69 2.981 -6.113 -3.063 521 H PHE 70 H PHE 70 1.092 -6.888 -0.242 522 HA PHE 70 HA PHE 70 2.249 -5.887 2.229 523 HB2 PHE 70 HB2 PHE 70 -0.389 -5.551 0.828 524 HB3 PHE 70 HB3 PHE 70 -0.279 -5.193 2.542 525 HD1 PHE 70 HD1 PHE 70 2.330 -4.502 -0.025 526 HD2 PHE 70 HD2 PHE 70 -0.684 -2.903 2.513 527 HE1 PHE 70 HE1 PHE 70 3.088 -2.214 -0.557 528 HE2 PHE 70 HE2 PHE 70 0.067 -0.631 2.001 529 HZ PHE 70 HZ PHE 70 1.935 -0.272 0.468 530 H PHE 71 H PHE 71 1.081 -8.719 1.185 531 HA PHE 71 HA PHE 71 -0.022 -9.479 3.790 532 HB2 PHE 71 HB2 PHE 71 -0.389 -10.746 1.063 533 HB3 PHE 71 HB3 PHE 71 -0.967 -11.446 2.565 534 HD1 PHE 71 HD1 PHE 71 -1.335 -8.551 0.290 535 HD2 PHE 71 HD2 PHE 71 -3.024 -10.799 3.480 536 HE1 PHE 71 HE1 PHE 71 -3.448 -7.331 0.025 537 HE2 PHE 71 HE2 PHE 71 -5.143 -9.583 3.218 538 HZ PHE 71 HZ PHE 71 -5.359 -7.848 1.491 539 H THR 72 H THR 72 0.632 -11.580 4.498 540 HA THR 72 HA THR 72 3.414 -12.124 3.939 541 HB THR 72 HB THR 72 3.081 -13.934 5.667 542 HG1 THR 72 HG1 THR 72 0.563 -12.711 6.078 543 HG21 THR 72 HG21 THR 72 2.197 -11.160 6.509 544 HG22 THR 72 HG22 THR 72 3.869 -11.698 6.337 545 HG23 THR 72 HG23 THR 72 2.840 -12.406 7.579 546 H ASN 73 H ASN 73 4.018 -14.458 3.505 547 HA ASN 73 HA ASN 73 2.649 -15.417 1.215 548 HB2 ASN 73 HB2 ASN 73 5.088 -15.713 1.552 549 HB3 ASN 73 HB3 ASN 73 4.775 -16.789 2.904 550 HD21 ASN 73 HD21 ASN 73 4.181 -18.918 2.476 551 HD22 ASN 73 HD22 ASN 73 4.209 -19.580 0.885 552 H SER 74 H SER 74 2.189 -15.838 4.530 553 HA SER 74 HA SER 74 0.862 -18.356 4.473 554 HB2 SER 74 HB2 SER 74 0.726 -16.165 6.531 555 HB3 SER 74 HB3 SER 74 0.369 -17.879 6.769 556 HG SER 74 HG SER 74 2.704 -17.972 5.812 557 H GLY 75 H GLY 75 -0.038 -15.205 3.474 558 HA2 GLY 75 HA2 GLY 75 -2.048 -14.670 2.427 559 HA3 GLY 75 HA3 GLY 75 -2.796 -16.074 3.178 560 H GLN 76 H GLN 76 -1.041 -14.265 5.364 561 HA GLN 76 HA GLN 76 -3.496 -13.022 6.396 562 HB2 GLN 76 HB2 GLN 76 -0.962 -13.926 7.732 563 HB3 GLN 76 HB3 GLN 76 -1.952 -12.702 8.485 564 HG2 GLN 76 HG2 GLN 76 -2.418 -14.822 9.473 565 HG3 GLN 76 HG3 GLN 76 -3.824 -14.314 8.556 566 HE21 GLN 76 HE21 GLN 76 -1.204 -16.559 8.802 567 HE22 GLN 76 HE22 GLN 76 -1.816 -17.705 7.681 568 H VAL 77 H VAL 77 -3.518 -10.867 6.908 569 HA VAL 77 HA VAL 77 -1.809 -9.037 5.616 570 HB VAL 77 HB VAL 77 -3.780 -8.729 7.920 571 HG11 VAL 77 HG11 VAL 77 -2.051 -6.992 8.178 572 HG12 VAL 77 HG12 VAL 77 -3.593 -6.303 7.678 573 HG13 VAL 77 HG13 VAL 77 -2.299 -6.514 6.499 574 HG21 VAL 77 HG21 VAL 77 -4.716 -9.189 5.713 575 HG22 VAL 77 HG22 VAL 77 -3.825 -7.804 5.073 576 HG23 VAL 77 HG23 VAL 77 -5.107 -7.546 6.255 577 H VAL 78 H VAL 78 0.075 -8.076 6.289 578 HA VAL 78 HA VAL 78 1.632 -9.271 8.280 579 HB VAL 78 HB VAL 78 1.966 -6.515 7.026 580 HG11 VAL 78 HG11 VAL 78 3.272 -6.706 9.084 581 HG12 VAL 78 HG12 VAL 78 4.329 -6.693 7.671 582 HG13 VAL 78 HG13 VAL 78 3.984 -8.211 8.498 583 HG21 VAL 78 HG21 VAL 78 1.946 -8.311 5.373 584 HG22 VAL 78 HG22 VAL 78 3.190 -9.170 6.279 585 HG23 VAL 78 HG23 VAL 78 3.560 -7.620 5.529 586 H LYS 79 H LYS 79 1.925 -8.879 10.359 587 HA LYS 79 HA LYS 79 -0.105 -7.861 11.897 588 HB2 LYS 79 HB2 LYS 79 1.460 -8.071 13.828 589 HB3 LYS 79 HB3 LYS 79 1.306 -9.500 12.813 590 HG2 LYS 79 HG2 LYS 79 3.342 -8.961 11.696 591 HG3 LYS 79 HG3 LYS 79 3.490 -7.479 12.642 592 HD2 LYS 79 HD2 LYS 79 4.964 -9.226 13.582 593 HD3 LYS 79 HD3 LYS 79 3.677 -8.823 14.710 594 HE2 LYS 79 HE2 LYS 79 2.436 -10.823 14.003 595 HE3 LYS 79 HE3 LYS 79 3.726 -11.219 12.868 596 HZ1 LYS 79 HZ1 LYS 79 3.908 -12.472 14.947 597 HZ2 LYS 79 HZ2 LYS 79 4.015 -11.037 15.815 598 HZ3 LYS 79 HZ3 LYS 79 5.237 -11.473 14.748 599 H SER 80 H SER 80 2.571 -6.064 10.633 600 HA SER 80 HA SER 80 1.769 -3.827 12.348 601 HB2 SER 80 HB2 SER 80 4.105 -4.680 12.688 602 HB3 SER 80 HB3 SER 80 4.464 -4.230 11.024 603 HG SER 80 HG SER 80 3.892 -2.080 11.598 604 H LEU 81 H LEU 81 0.760 -4.791 9.610 605 HA LEU 81 HA LEU 81 1.602 -2.926 7.669 606 HB2 LEU 81 HB2 LEU 81 0.386 -5.112 7.240 607 HB3 LEU 81 HB3 LEU 81 -1.084 -4.303 7.735 608 HG LEU 81 HG LEU 81 -0.650 -2.637 5.879 609 HD11 LEU 81 HD11 LEU 81 1.276 -4.773 5.056 610 HD12 LEU 81 HD12 LEU 81 1.725 -3.146 5.582 611 HD13 LEU 81 HD13 LEU 81 0.810 -3.383 4.084 612 HD21 LEU 81 HD21 LEU 81 -2.301 -4.431 5.734 613 HD22 LEU 81 HD22 LEU 81 -1.053 -5.511 5.111 614 HD23 LEU 81 HD23 LEU 81 -1.551 -4.095 4.171 615 HA PRO 82 HA PRO 82 -2.402 -0.307 8.825 616 HB2 PRO 82 HB2 PRO 82 -3.195 -0.658 11.465 617 HB3 PRO 82 HB3 PRO 82 -4.031 -1.344 10.073 618 HG2 PRO 82 HG2 PRO 82 -2.056 -2.617 11.918 619 HG3 PRO 82 HG3 PRO 82 -3.519 -3.307 11.190 620 HD2 PRO 82 HD2 PRO 82 -1.088 -3.892 10.254 621 HD3 PRO 82 HD3 PRO 82 -2.476 -3.682 9.161 622 H GLY 83 H GLY 83 0.013 -1.251 11.131 623 HA2 GLY 83 HA2 GLY 83 0.190 1.146 12.621 624 HA3 GLY 83 HA3 GLY 83 1.450 -0.074 12.497 625 H LEU 84 H LEU 84 1.991 0.008 9.760 626 HA LEU 84 HA LEU 84 3.649 2.310 9.693 627 HB2 LEU 84 HB2 LEU 84 4.522 1.515 7.620 628 HB3 LEU 84 HB3 LEU 84 4.244 0.112 8.616 629 HG LEU 84 HG LEU 84 1.962 0.086 7.216 630 HD11 LEU 84 HD11 LEU 84 3.909 1.377 5.303 631 HD12 LEU 84 HD12 LEU 84 2.399 2.065 5.886 632 HD13 LEU 84 HD13 LEU 84 2.369 0.657 4.855 633 HD21 LEU 84 HD21 LEU 84 3.044 -1.547 5.709 634 HD22 LEU 84 HD22 LEU 84 3.512 -1.779 7.394 635 HD23 LEU 84 HD23 LEU 84 4.617 -0.991 6.270 636 H LEU 85 H LEU 85 0.661 1.409 8.158 637 HA LEU 85 HA LEU 85 0.434 3.571 6.397 638 HB2 LEU 85 HB2 LEU 85 -1.737 1.995 7.771 639 HB3 LEU 85 HB3 LEU 85 -1.988 3.080 6.420 640 HG LEU 85 HG LEU 85 -0.287 0.591 6.311 641 HD11 LEU 85 HD11 LEU 85 -2.093 -0.338 5.000 642 HD12 LEU 85 HD12 LEU 85 -3.073 1.100 5.300 643 HD13 LEU 85 HD13 LEU 85 -2.625 0.038 6.636 644 HD21 LEU 85 HD21 LEU 85 0.385 2.311 4.735 645 HD22 LEU 85 HD22 LEU 85 -1.269 2.438 4.142 646 HD23 LEU 85 HD23 LEU 85 -0.359 0.945 3.903 647 H THR 86 H THR 86 -0.596 3.159 9.693 648 HA THR 86 HA THR 86 -2.073 5.529 9.883 649 HB THR 86 HB THR 86 -0.788 3.922 12.098 650 HG1 THR 86 HG1 THR 86 -2.260 2.664 11.136 651 HG21 THR 86 HG21 THR 86 -1.406 6.211 12.843 652 HG22 THR 86 HG22 THR 86 -2.434 4.979 13.576 653 HG23 THR 86 HG23 THR 86 -3.035 5.955 12.236 654 H ILE 87 H ILE 87 1.403 5.046 10.471 655 HA ILE 87 HA ILE 87 1.627 7.635 11.585 656 HB ILE 87 HB ILE 87 3.273 5.970 12.210 657 HG12 ILE 87 HG12 ILE 87 4.013 8.384 12.196 658 HG13 ILE 87 HG13 ILE 87 5.304 7.198 12.226 659 HG21 ILE 87 HG21 ILE 87 4.282 5.923 9.414 660 HG22 ILE 87 HG22 ILE 87 3.386 4.651 10.237 661 HG23 ILE 87 HG23 ILE 87 5.009 5.087 10.786 662 HD11 ILE 87 HD11 ILE 87 5.847 9.087 10.784 663 HD12 ILE 87 HD12 ILE 87 4.393 8.792 9.829 664 HD13 ILE 87 HD13 ILE 87 5.703 7.608 9.832 665 H LEU 88 H LEU 88 2.173 6.456 8.289 666 HA LEU 88 HA LEU 88 2.791 9.045 7.275 667 HB2 LEU 88 HB2 LEU 88 1.714 6.629 5.858 668 HB3 LEU 88 HB3 LEU 88 2.093 8.114 5.030 669 HG LEU 88 HG LEU 88 3.856 6.670 4.608 670 HD11 LEU 88 HD11 LEU 88 5.806 7.695 5.611 671 HD12 LEU 88 HD12 LEU 88 4.788 8.452 6.831 672 HD13 LEU 88 HD13 LEU 88 4.607 8.897 5.135 673 HD21 LEU 88 HD21 LEU 88 5.111 5.495 6.377 674 HD22 LEU 88 HD22 LEU 88 3.425 4.986 6.241 675 HD23 LEU 88 HD23 LEU 88 3.906 6.076 7.530 676 H HIS 89 H HIS 89 -0.164 7.314 7.759 677 HA HIS 89 HA HIS 89 -1.965 8.916 6.355 678 HB2 HIS 89 HB2 HIS 89 -2.297 6.629 7.505 679 HB3 HIS 89 HB3 HIS 89 -2.534 7.537 8.983 680 HD1 HIS 89 HD1 HIS 89 -4.983 6.652 9.193 681 HD2 HIS 89 HD2 HIS 89 -4.216 8.768 5.693 682 HE1 HIS 89 HE1 HIS 89 -7.211 6.999 8.082 683 H ASP 90 H ASP 90 -0.679 9.154 9.636 684 HA ASP 90 HA ASP 90 -2.157 11.433 10.474 685 HB2 ASP 90 HB2 ASP 90 -0.979 9.905 12.041 686 HB3 ASP 90 HB3 ASP 90 0.563 10.465 11.411 687 H GLY 91 H GLY 91 0.769 10.982 8.674 688 HA2 GLY 91 HA2 GLY 91 1.606 13.741 8.676 689 HA3 GLY 91 HA3 GLY 91 2.267 12.436 7.714 690 H GLY 92 H GLY 92 -0.890 12.142 7.157 691 HA2 GLY 92 HA2 GLY 92 -2.429 12.981 5.660 692 HA3 GLY 92 HA3 GLY 92 -1.373 14.357 5.393 693 H TYR 93 H TYR 93 -0.082 11.171 5.035 694 HA TYR 93 HA TYR 93 0.336 11.755 2.234 695 HB2 TYR 93 HB2 TYR 93 1.367 9.540 3.976 696 HB3 TYR 93 HB3 TYR 93 1.756 9.685 2.266 697 HD1 TYR 93 HD1 TYR 93 2.964 11.795 1.509 698 HD2 TYR 93 HD2 TYR 93 2.615 10.685 5.596 699 HE1 TYR 93 HE1 TYR 93 4.847 13.268 2.065 700 HE2 TYR 93 HE2 TYR 93 4.493 12.156 6.164 701 HH TYR 93 HH TYR 93 6.548 13.092 4.852 702 H ARG 94 H ARG 94 -0.549 10.739 0.585 703 HA ARG 94 HA ARG 94 -2.876 9.121 1.055 704 HB2 ARG 94 HB2 ARG 94 -3.138 9.090 -1.399 705 HB3 ARG 94 HB3 ARG 94 -2.911 10.726 -0.792 706 HG2 ARG 94 HG2 ARG 94 -0.672 10.756 -1.512 707 HG3 ARG 94 HG3 ARG 94 -0.713 9.043 -1.966 708 HD2 ARG 94 HD2 ARG 94 -2.395 9.635 -3.694 709 HD3 ARG 94 HD3 ARG 94 -2.221 11.335 -3.234 710 HE ARG 94 HE ARG 94 0.337 10.397 -3.781 711 HH11 ARG 94 HH11 ARG 94 -2.635 10.901 -5.672 712 HH12 ARG 94 HH12 ARG 94 -1.781 11.084 -7.138 713 HH21 ARG 94 HH21 ARG 94 1.427 10.690 -5.741 714 HH22 ARG 94 HH22 ARG 94 0.552 10.989 -7.178 715 H ASP 95 H ASP 95 -3.188 7.152 -0.351 716 HA ASP 95 HA ASP 95 -1.687 5.003 0.513 717 HB2 ASP 95 HB2 ASP 95 -2.862 3.776 -1.377 718 HB3 ASP 95 HB3 ASP 95 -3.909 4.649 -0.263 719 H THR 96 H THR 96 -1.500 6.747 -2.501 720 HA THR 96 HA THR 96 0.311 5.202 -3.895 721 HB THR 96 HB THR 96 -0.017 8.185 -3.956 722 HG1 THR 96 HG1 THR 96 -1.842 6.242 -4.373 723 HG21 THR 96 HG21 THR 96 1.864 7.239 -5.288 724 HG22 THR 96 HG22 THR 96 0.608 7.981 -6.284 725 HG23 THR 96 HG23 THR 96 0.697 6.226 -6.143 726 H GLU 97 H GLU 97 0.817 7.878 -1.611 727 HA GLU 97 HA GLU 97 3.586 8.056 -2.095 728 HB2 GLU 97 HB2 GLU 97 2.123 9.021 0.350 729 HB3 GLU 97 HB3 GLU 97 3.721 9.529 -0.183 730 HG2 GLU 97 HG2 GLU 97 1.078 10.077 -1.464 731 HG3 GLU 97 HG3 GLU 97 2.189 11.248 -0.751 732 H ILE 98 H ILE 98 1.630 6.177 0.114 733 HA ILE 98 HA ILE 98 3.689 5.373 1.892 734 HB ILE 98 HB ILE 98 1.616 3.390 0.990 735 HG12 ILE 98 HG12 ILE 98 0.228 5.305 1.349 736 HG13 ILE 98 HG13 ILE 98 0.089 4.222 2.735 737 HG21 ILE 98 HG21 ILE 98 2.802 3.959 3.688 738 HG22 ILE 98 HG22 ILE 98 3.334 2.717 2.566 739 HG23 ILE 98 HG23 ILE 98 1.723 2.623 3.274 740 HD11 ILE 98 HD11 ILE 98 1.712 6.749 2.668 741 HD12 ILE 98 HD12 ILE 98 1.542 5.643 4.031 742 HD13 ILE 98 HD13 ILE 98 0.141 6.542 3.444 743 H MET 99 H MET 99 2.414 3.941 -1.076 744 HA MET 99 HA MET 99 4.399 1.922 -1.039 745 HB2 MET 99 HB2 MET 99 3.571 1.188 -3.239 746 HB3 MET 99 HB3 MET 99 2.341 1.288 -2.000 747 HG2 MET 99 HG2 MET 99 1.349 3.131 -2.990 748 HG3 MET 99 HG3 MET 99 2.762 3.474 -3.988 749 HE1 MET 99 HE1 MET 99 -0.059 0.824 -3.285 750 HE2 MET 99 HE2 MET 99 1.414 -0.146 -3.348 751 HE3 MET 99 HE3 MET 99 0.192 -0.311 -4.611 752 H ARG 100 H ARG 100 4.468 5.076 -2.035 753 HA ARG 100 HA ARG 100 6.122 5.042 -4.281 754 HB2 ARG 100 HB2 ARG 100 4.967 7.029 -3.616 755 HB3 ARG 100 HB3 ARG 100 5.735 7.017 -2.043 756 HG2 ARG 100 HG2 ARG 100 7.859 7.600 -3.083 757 HG3 ARG 100 HG3 ARG 100 7.081 7.594 -4.674 758 HD2 ARG 100 HD2 ARG 100 5.645 9.397 -4.065 759 HD3 ARG 100 HD3 ARG 100 6.138 9.305 -2.378 760 HE ARG 100 HE ARG 100 8.388 9.763 -3.919 761 HH11 ARG 100 HH11 ARG 100 5.422 11.497 -3.039 762 HH12 ARG 100 HH12 ARG 100 6.168 13.019 -3.077 763 HH21 ARG 100 HH21 ARG 100 9.387 11.863 -3.954 764 HH22 ARG 100 HH22 ARG 100 8.434 13.243 -3.607 765 H TRP 101 H TRP 101 7.143 5.736 -0.935 766 HA TRP 101 HA TRP 101 9.843 5.146 -1.556 767 HB2 TRP 101 HB2 TRP 101 10.156 5.249 0.993 768 HB3 TRP 101 HB3 TRP 101 9.617 6.710 0.177 769 HD1 TRP 101 HD1 TRP 101 7.265 7.656 0.802 770 HE1 TRP 101 HE1 TRP 101 5.555 7.084 2.612 771 HE3 TRP 101 HE3 TRP 101 9.185 3.175 2.385 772 HZ2 TRP 101 HZ2 TRP 101 5.082 5.034 4.456 773 HZ3 TRP 101 HZ3 TRP 101 8.039 1.995 4.168 774 HH2 TRP 101 HH2 TRP 101 6.018 2.908 5.202 775 H LEU 102 H LEU 102 7.244 3.253 -0.305 776 HA LEU 102 HA LEU 102 8.624 1.105 0.815 777 HB2 LEU 102 HB2 LEU 102 5.994 1.640 -0.189 778 HB3 LEU 102 HB3 LEU 102 6.366 -0.084 -0.188 779 HG LEU 102 HG LEU 102 6.381 1.806 2.186 780 HD11 LEU 102 HD11 LEU 102 4.383 0.643 2.849 781 HD12 LEU 102 HD12 LEU 102 4.456 -0.366 1.396 782 HD13 LEU 102 HD13 LEU 102 4.160 1.374 1.256 783 HD21 LEU 102 HD21 LEU 102 6.540 -0.242 3.499 784 HD22 LEU 102 HD22 LEU 102 7.936 -0.036 2.438 785 HD23 LEU 102 HD23 LEU 102 6.665 -1.173 2.002 786 H PHE 103 H PHE 103 7.695 1.596 -2.576 787 HA PHE 103 HA PHE 103 8.896 -0.979 -3.182 788 HB2 PHE 103 HB2 PHE 103 7.231 0.882 -4.857 789 HB3 PHE 103 HB3 PHE 103 8.081 -0.492 -5.554 790 HD1 PHE 103 HD1 PHE 103 5.459 0.486 -3.154 791 HD2 PHE 103 HD2 PHE 103 7.248 -2.695 -5.317 792 HE1 PHE 103 HE1 PHE 103 3.570 -0.976 -2.563 793 HE2 PHE 103 HE2 PHE 103 5.379 -4.158 -4.726 794 HZ PHE 103 HZ PHE 103 3.528 -3.293 -3.350 795 H THR 104 H THR 104 10.033 2.019 -2.827 796 HA THR 104 HA THR 104 11.925 1.891 -4.999 797 HB THR 104 HB THR 104 11.704 3.890 -2.717 798 HG1 THR 104 HG1 THR 104 9.897 4.050 -4.049 799 HG21 THR 104 HG21 THR 104 13.113 5.305 -4.127 800 HG22 THR 104 HG22 THR 104 13.213 4.023 -5.337 801 HG23 THR 104 HG23 THR 104 13.937 3.788 -3.744 802 HA PRO 105 HA PRO 105 14.548 -0.587 -2.246 803 HB2 PRO 105 HB2 PRO 105 16.538 -0.306 -4.394 804 HB3 PRO 105 HB3 PRO 105 15.820 -1.767 -3.717 805 HG2 PRO 105 HG2 PRO 105 15.182 -0.920 -6.173 806 HG3 PRO 105 HG3 PRO 105 13.977 -1.672 -5.110 807 HD2 PRO 105 HD2 PRO 105 14.416 1.233 -5.709 808 HD3 PRO 105 HD3 PRO 105 12.898 0.304 -5.595 809 H ASP 106 H ASP 106 16.020 -0.064 -0.763 810 HA ASP 106 HA ASP 106 17.363 2.527 -0.986 811 HB2 ASP 106 HB2 ASP 106 16.135 2.174 1.118 812 HB3 ASP 106 HB3 ASP 106 17.041 0.700 1.409 813 HA PRO 107 HA PRO 107 20.911 0.261 -2.381 814 HB2 PRO 107 HB2 PRO 107 22.731 2.312 -2.038 815 HB3 PRO 107 HB3 PRO 107 21.696 2.101 -3.454 816 HG2 PRO 107 HG2 PRO 107 21.316 3.875 -1.076 817 HG3 PRO 107 HG3 PRO 107 20.983 4.204 -2.786 818 HD2 PRO 107 HD2 PRO 107 19.046 3.629 -1.053 819 HD3 PRO 107 HD3 PRO 107 18.974 3.063 -2.735 820 H SER 108 H SER 108 20.731 1.754 0.742 821 HA SER 108 HA SER 108 23.138 0.354 1.578 822 HB2 SER 108 HB2 SER 108 22.884 1.885 3.617 823 HB3 SER 108 HB3 SER 108 23.351 2.636 2.089 824 HG SER 108 HG SER 108 20.604 2.457 2.600 825 H LEU 109 H LEU 109 19.996 -0.374 1.414 826 HA LEU 109 HA LEU 109 19.833 -1.501 4.102 827 HB2 LEU 109 HB2 LEU 109 18.013 -0.029 3.310 828 HB3 LEU 109 HB3 LEU 109 17.745 -1.125 1.974 829 HG LEU 109 HG LEU 109 16.903 -2.824 3.480 830 HD11 LEU 109 HD11 LEU 109 16.598 -2.364 5.859 831 HD12 LEU 109 HD12 LEU 109 17.478 -0.842 5.677 832 HD13 LEU 109 HD13 LEU 109 18.303 -2.382 5.416 833 HD21 LEU 109 HD21 LEU 109 15.717 -0.104 3.980 834 HD22 LEU 109 HD22 LEU 109 14.911 -1.644 4.281 835 HD23 LEU 109 HD23 LEU 109 15.347 -1.181 2.633 836 H THR 110 H THR 110 19.789 -3.663 4.406 837 HA THR 110 HA THR 110 19.891 -5.370 2.033 838 HB THR 110 HB THR 110 21.275 -5.856 4.696 839 HG1 THR 110 HG1 THR 110 22.323 -4.196 3.660 840 HG21 THR 110 HG21 THR 110 20.694 -7.903 3.455 841 HG22 THR 110 HG22 THR 110 22.440 -7.645 3.461 842 HG23 THR 110 HG23 THR 110 21.495 -7.261 2.021 843 H ILE 111 H ILE 111 18.178 -6.624 1.932 844 HA ILE 111 HA ILE 111 16.762 -7.303 4.421 845 HB ILE 111 HB ILE 111 15.527 -6.626 1.746 846 HG12 ILE 111 HG12 ILE 111 15.518 -5.025 4.308 847 HG13 ILE 111 HG13 ILE 111 16.412 -4.646 2.838 848 HG21 ILE 111 HG21 ILE 111 14.232 -8.258 2.946 849 HG22 ILE 111 HG22 ILE 111 13.407 -6.692 2.871 850 HG23 ILE 111 HG23 ILE 111 14.199 -7.206 4.373 851 HD11 ILE 111 HD11 ILE 111 13.420 -4.799 3.033 852 HD12 ILE 111 HD12 ILE 111 14.354 -4.291 1.636 853 HD13 ILE 111 HD13 ILE 111 14.358 -3.304 3.098 854 H THR 112 H THR 112 15.779 -9.314 4.378 855 HA THR 112 HA THR 112 16.702 -11.172 2.326 856 HB THR 112 HB THR 112 16.089 -12.871 4.116 857 HG1 THR 112 HG1 THR 112 14.739 -11.726 5.376 858 HG21 THR 112 HG21 THR 112 18.421 -12.170 3.808 859 HG22 THR 112 HG22 THR 112 18.075 -12.436 5.521 860 HG23 THR 112 HG23 THR 112 18.143 -10.792 4.878 861 H ARG 113 H ARG 113 15.043 -11.899 0.970 862 HA ARG 113 HA ARG 113 12.420 -10.972 1.649 863 HB2 ARG 113 HB2 ARG 113 13.115 -10.812 -0.691 864 HB3 ARG 113 HB3 ARG 113 13.316 -12.562 -0.760 865 HG2 ARG 113 HG2 ARG 113 10.973 -12.910 -0.445 866 HG3 ARG 113 HG3 ARG 113 10.711 -11.194 -0.150 867 HD2 ARG 113 HD2 ARG 113 11.763 -12.353 -2.704 868 HD3 ARG 113 HD3 ARG 113 10.063 -11.951 -2.394 869 HE ARG 113 HE ARG 113 11.632 -9.683 -1.874 870 HH11 ARG 113 HH11 ARG 113 10.665 -11.610 -4.675 871 HH12 ARG 113 HH12 ARG 113 10.729 -10.294 -5.744 872 HH21 ARG 113 HH21 ARG 113 11.686 -7.974 -3.241 873 HH22 ARG 113 HH22 ARG 113 11.335 -8.112 -4.922 874 H ASP 114 H ASP 114 10.922 -12.029 2.552 875 HA ASP 114 HA ASP 114 11.553 -14.289 4.055 876 HB2 ASP 114 HB2 ASP 114 9.880 -12.583 4.659 877 HB3 ASP 114 HB3 ASP 114 8.784 -13.291 3.481 878 H GLY 115 H GLY 115 11.487 -16.301 3.751 879 HA2 GLY 115 HA2 GLY 115 10.368 -18.286 2.843 880 HA3 GLY 115 HA3 GLY 115 10.182 -17.378 1.337 881 H SER 116 H SER 116 12.796 -16.082 1.788 882 HA SER 116 HA SER 116 14.550 -18.244 0.995 883 HB2 SER 116 HB2 SER 116 13.933 -16.800 -0.887 884 HB3 SER 116 HB3 SER 116 14.339 -15.369 0.052 885 HG SER 116 HG SER 116 16.069 -15.653 -1.059 886 H ARG 117 H ARG 117 16.483 -18.204 2.092 887 HA ARG 117 HA ARG 117 16.727 -16.204 4.199 888 HB2 ARG 117 HB2 ARG 117 18.438 -17.502 5.231 889 HB3 ARG 117 HB3 ARG 117 17.182 -18.621 4.746 890 HG2 ARG 117 HG2 ARG 117 19.728 -18.185 3.183 891 HG3 ARG 117 HG3 ARG 117 19.551 -19.402 4.439 892 HD2 ARG 117 HD2 ARG 117 17.719 -20.417 3.128 893 HD3 ARG 117 HD3 ARG 117 18.006 -19.219 1.864 894 HE ARG 117 HE ARG 117 20.245 -20.135 1.648 895 HH11 ARG 117 HH11 ARG 117 17.733 -22.231 3.097 896 HH12 ARG 117 HH12 ARG 117 18.571 -23.670 2.722 897 HH21 ARG 117 HH21 ARG 117 21.330 -22.169 1.150 898 HH22 ARG 117 HH22 ARG 117 20.576 -23.645 1.574 899 H ASP 118 H ASP 118 17.529 -16.422 1.113 900 HA ASP 118 HA ASP 118 20.192 -15.388 1.125 901 HB2 ASP 118 HB2 ASP 118 19.370 -16.720 -0.741 902 HB3 ASP 118 HB3 ASP 118 18.143 -15.490 -1.078 903 H ALA 119 H ALA 119 20.822 -13.413 0.918 904 HA ALA 119 HA ALA 119 18.872 -11.386 1.719 905 HB1 ALA 119 HB1 ALA 119 21.874 -11.280 1.847 906 HB2 ALA 119 HB2 ALA 119 20.807 -11.724 3.178 907 HB3 ALA 119 HB3 ALA 119 20.761 -10.088 2.517 908 H VAL 120 H VAL 120 18.589 -9.491 0.708 909 HA VAL 120 HA VAL 120 19.878 -9.140 -1.903 910 HB VAL 120 HB VAL 120 17.191 -8.069 -0.987 911 HG11 VAL 120 HG11 VAL 120 18.459 -8.104 -3.721 912 HG12 VAL 120 HG12 VAL 120 18.245 -6.694 -2.689 913 HG13 VAL 120 HG13 VAL 120 16.837 -7.519 -3.351 914 HG21 VAL 120 HG21 VAL 120 16.147 -9.710 -2.481 915 HG22 VAL 120 HG22 VAL 120 17.054 -10.500 -1.191 916 HG23 VAL 120 HG23 VAL 120 17.729 -10.405 -2.821 917 H SER 121 H SER 121 21.285 -7.512 -1.796 918 HA SER 121 HA SER 121 20.972 -5.418 0.178 919 HB2 SER 121 HB2 SER 121 23.113 -5.849 -1.924 920 HB3 SER 121 HB3 SER 121 23.191 -4.736 -0.554 921 HG SER 121 HG SER 121 22.757 -7.486 -0.171 922 H ASN 122 H ASN 122 20.224 -3.460 -0.352 923 HA ASN 122 HA ASN 122 19.187 -1.855 -1.437 924 HB2 ASN 122 HB2 ASN 122 20.991 -1.700 -3.134 925 HB3 ASN 122 HB3 ASN 122 20.323 -3.072 -3.994 926 HD21 ASN 122 HD21 ASN 122 18.662 -2.758 -5.385 927 HD22 ASN 122 HD22 ASN 122 18.040 -1.216 -5.850 928 H ALA 123 H ALA 123 17.539 -3.128 -0.403 929 HA ALA 123 HA ALA 123 15.746 -4.238 -2.398 930 HB1 ALA 123 HB1 ALA 123 14.817 -5.589 -0.555 931 HB2 ALA 123 HB2 ALA 123 16.054 -4.917 0.519 932 HB3 ALA 123 HB3 ALA 123 16.524 -5.924 -0.846 933 H ARG 124 H ARG 124 13.495 -3.999 -1.754 934 HA ARG 124 HA ARG 124 12.996 -1.221 -1.072 935 HB2 ARG 124 HB2 ARG 124 10.752 -1.641 -1.934 936 HB3 ARG 124 HB3 ARG 124 11.963 -2.209 -3.077 937 HG2 ARG 124 HG2 ARG 124 11.632 -4.510 -2.182 938 HG3 ARG 124 HG3 ARG 124 10.333 -3.875 -1.187 939 HD2 ARG 124 HD2 ARG 124 9.118 -3.200 -3.174 940 HD3 ARG 124 HD3 ARG 124 10.475 -3.755 -4.169 941 HE ARG 124 HE ARG 124 9.591 -5.827 -2.504 942 HH11 ARG 124 HH11 ARG 124 8.733 -4.106 -5.488 943 HH12 ARG 124 HH12 ARG 124 7.819 -5.383 -6.139 944 HH21 ARG 124 HH21 ARG 124 8.391 -7.550 -3.366 945 HH22 ARG 124 HH22 ARG 124 7.620 -7.430 -4.896 946 HA PRO 125 HA PRO 125 11.815 -2.039 3.135 947 HB2 PRO 125 HB2 PRO 125 9.744 0.058 2.650 948 HB3 PRO 125 HB3 PRO 125 10.937 -0.060 3.948 949 HG2 PRO 125 HG2 PRO 125 11.282 1.645 1.959 950 HG3 PRO 125 HG3 PRO 125 12.657 0.722 2.597 951 HD2 PRO 125 HD2 PRO 125 11.093 0.299 0.079 952 HD3 PRO 125 HD3 PRO 125 12.840 0.141 0.378 953 H VAL 126 H VAL 126 9.443 -2.271 0.559 954 HA VAL 126 HA VAL 126 7.283 -3.400 2.013 955 HB VAL 126 HB VAL 126 8.149 -4.117 -0.822 956 HG11 VAL 126 HG11 VAL 126 6.721 -5.844 0.140 957 HG12 VAL 126 HG12 VAL 126 5.870 -4.945 -1.120 958 HG13 VAL 126 HG13 VAL 126 5.526 -4.623 0.580 959 HG21 VAL 126 HG21 VAL 126 6.373 -2.625 -1.532 960 HG22 VAL 126 HG22 VAL 126 7.574 -1.775 -0.562 961 HG23 VAL 126 HG23 VAL 126 6.023 -2.235 0.151 962 H ASP 127 H ASP 127 10.174 -4.830 0.629 963 HA ASP 127 HA ASP 127 9.528 -7.508 1.199 964 HB2 ASP 127 HB2 ASP 127 12.181 -6.149 0.681 965 HB3 ASP 127 HB3 ASP 127 12.042 -7.879 0.960 966 H ALA 128 H ALA 128 10.934 -4.946 2.986 967 HA ALA 128 HA ALA 128 11.962 -6.451 5.137 968 HB1 ALA 128 HB1 ALA 128 11.975 -4.336 6.394 969 HB2 ALA 128 HB2 ALA 128 10.995 -3.590 5.132 970 HB3 ALA 128 HB3 ALA 128 12.634 -4.120 4.774 971 H LEU 129 H LEU 129 8.829 -4.775 4.723 972 HA LEU 129 HA LEU 129 7.835 -5.583 7.275 973 HB2 LEU 129 HB2 LEU 129 5.638 -4.830 6.533 974 HB3 LEU 129 HB3 LEU 129 6.841 -3.643 6.121 975 HG LEU 129 HG LEU 129 6.764 -4.925 3.814 976 HD11 LEU 129 HD11 LEU 129 5.216 -6.588 4.530 977 HD12 LEU 129 HD12 LEU 129 4.505 -5.627 3.225 978 HD13 LEU 129 HD13 LEU 129 4.000 -5.369 4.907 979 HD21 LEU 129 HD21 LEU 129 4.730 -2.880 4.695 980 HD22 LEU 129 HD22 LEU 129 5.139 -3.253 3.021 981 HD23 LEU 129 HD23 LEU 129 6.354 -2.551 4.090 982 H HIS 130 H HIS 130 7.701 -7.031 4.137 983 HA HIS 130 HA HIS 130 5.902 -9.120 4.767 984 HB2 HIS 130 HB2 HIS 130 6.398 -8.351 2.466 985 HB3 HIS 130 HB3 HIS 130 8.053 -8.896 2.635 986 HD1 HIS 130 HD1 HIS 130 4.547 -10.193 2.036 987 HD2 HIS 130 HD2 HIS 130 8.457 -11.600 2.234 988 HE1 HIS 130 HE1 HIS 130 4.499 -12.498 1.090 989 H ALA 131 H ALA 131 9.207 -8.551 5.340 990 HA ALA 131 HA ALA 131 9.728 -11.355 6.072 991 HB1 ALA 131 HB1 ALA 131 11.694 -9.114 5.734 992 HB2 ALA 131 HB2 ALA 131 11.296 -10.316 4.506 993 HB3 ALA 131 HB3 ALA 131 12.082 -10.812 6.009 994 H HIS 132 H HIS 132 8.415 -9.009 7.649 995 HA HIS 132 HA HIS 132 8.061 -8.569 9.855 996 HB2 HIS 132 HB2 HIS 132 8.272 -11.054 10.142 997 HB3 HIS 132 HB3 HIS 132 9.999 -10.871 10.363 998 HD1 HIS 132 HD1 HIS 132 10.748 -10.722 12.765 999 HD2 HIS 132 HD2 HIS 132 6.745 -9.716 12.280 1000 HE1 HIS 132 HE1 HIS 132 9.802 -10.482 15.080 1001 H GLN 133 H GLN 133 10.192 -7.347 8.305 1002 HA GLN 133 HA GLN 133 11.972 -6.359 10.409 1003 HB2 GLN 133 HB2 GLN 133 12.143 -6.213 7.394 1004 HB3 GLN 133 HB3 GLN 133 13.244 -5.352 8.461 1005 HG2 GLN 133 HG2 GLN 133 14.017 -7.461 9.386 1006 HG3 GLN 133 HG3 GLN 133 12.872 -8.333 8.373 1007 HE21 GLN 133 HE21 GLN 133 14.533 -9.476 7.448 1008 HE22 GLN 133 HE22 GLN 133 15.620 -8.807 6.297 1009 H ALA 134 H ALA 134 9.192 -5.789 10.037 1010 HA ALA 134 HA ALA 134 8.503 -3.439 8.766 1011 HB1 ALA 134 HB1 ALA 134 7.249 -4.514 11.275 1012 HB2 ALA 134 HB2 ALA 134 6.909 -5.081 9.640 1013 HB3 ALA 134 HB3 ALA 134 6.507 -3.427 10.100 1014 H ARG 135 H ARG 135 10.092 -3.773 11.880 1015 HA ARG 135 HA ARG 135 9.590 -1.226 12.945 1016 HB2 ARG 135 HB2 ARG 135 12.093 -2.903 13.153 1017 HB3 ARG 135 HB3 ARG 135 11.819 -1.439 14.075 1018 HG2 ARG 135 HG2 ARG 135 9.957 -2.460 15.217 1019 HG3 ARG 135 HG3 ARG 135 10.120 -3.922 14.248 1020 HD2 ARG 135 HD2 ARG 135 12.367 -4.279 15.158 1021 HD3 ARG 135 HD3 ARG 135 12.227 -2.798 16.104 1022 HE ARG 135 HE ARG 135 10.075 -4.452 16.715 1023 HH11 ARG 135 HH11 ARG 135 13.602 -4.519 17.175 1024 HH12 ARG 135 HH12 ARG 135 13.514 -5.346 18.657 1025 HH21 ARG 135 HH21 ARG 135 9.982 -5.565 18.719 1026 HH22 ARG 135 HH22 ARG 135 11.434 -5.969 19.554 1027 H GLU 136 H GLU 136 11.998 -2.244 10.550 1028 HA GLU 136 HA GLU 136 13.200 0.335 10.401 1029 HB2 GLU 136 HB2 GLU 136 13.406 -2.089 8.627 1030 HB3 GLU 136 HB3 GLU 136 14.263 -0.590 8.292 1031 HG2 GLU 136 HG2 GLU 136 14.539 -2.262 10.775 1032 HG3 GLU 136 HG3 GLU 136 15.687 -2.184 9.434 1033 H VAL 137 H VAL 137 10.511 -1.170 8.959 1034 HA VAL 137 HA VAL 137 10.221 0.635 6.775 1035 HB VAL 137 HB VAL 137 8.116 -1.064 8.165 1036 HG11 VAL 137 HG11 VAL 137 6.833 -0.850 6.088 1037 HG12 VAL 137 HG12 VAL 137 8.066 0.230 5.437 1038 HG13 VAL 137 HG13 VAL 137 7.106 0.727 6.832 1039 HG21 VAL 137 HG21 VAL 137 9.748 -1.625 5.701 1040 HG22 VAL 137 HG22 VAL 137 8.496 -2.667 6.363 1041 HG23 VAL 137 HG23 VAL 137 9.977 -2.377 7.277 1042 H VAL 138 H VAL 138 8.943 0.431 10.054 1043 HA VAL 138 HA VAL 138 7.450 2.821 10.037 1044 HB VAL 138 HB VAL 138 8.861 1.512 12.397 1045 HG11 VAL 138 HG11 VAL 138 6.593 3.509 12.384 1046 HG12 VAL 138 HG12 VAL 138 8.248 3.826 12.896 1047 HG13 VAL 138 HG13 VAL 138 7.244 2.703 13.812 1048 HG21 VAL 138 HG21 VAL 138 6.683 0.488 12.885 1049 HG22 VAL 138 HG22 VAL 138 7.293 -0.004 11.305 1050 HG23 VAL 138 HG23 VAL 138 6.020 1.212 11.419 1051 H ARG 139 H ARG 139 10.796 2.143 10.835 1052 HA ARG 139 HA ARG 139 11.655 4.696 11.634 1053 HB2 ARG 139 HB2 ARG 139 12.944 2.576 11.855 1054 HB3 ARG 139 HB3 ARG 139 13.192 2.579 10.123 1055 HG2 ARG 139 HG2 ARG 139 14.479 4.659 10.317 1056 HG3 ARG 139 HG3 ARG 139 14.247 4.618 12.070 1057 HD2 ARG 139 HD2 ARG 139 15.346 2.413 12.140 1058 HD3 ARG 139 HD3 ARG 139 15.624 2.516 10.406 1059 HE ARG 139 HE ARG 139 16.679 4.738 11.836 1060 HH11 ARG 139 HH11 ARG 139 17.385 1.368 10.820 1061 HH12 ARG 139 HH12 ARG 139 19.065 1.554 11.043 1062 HH21 ARG 139 HH21 ARG 139 18.999 4.901 12.099 1063 HH22 ARG 139 HH22 ARG 139 19.992 3.535 11.754 1064 H ARG 140 H ARG 140 11.644 3.155 8.454 1065 HA ARG 140 HA ARG 140 12.663 5.308 6.964 1066 HB2 ARG 140 HB2 ARG 140 12.541 2.928 6.219 1067 HB3 ARG 140 HB3 ARG 140 10.805 3.098 6.059 1068 HG2 ARG 140 HG2 ARG 140 11.888 3.240 3.897 1069 HG3 ARG 140 HG3 ARG 140 11.138 4.782 4.309 1070 HD2 ARG 140 HD2 ARG 140 13.383 5.019 3.307 1071 HD3 ARG 140 HD3 ARG 140 13.283 5.713 4.921 1072 HE ARG 140 HE ARG 140 14.325 3.494 5.643 1073 HH11 ARG 140 HH11 ARG 140 15.010 4.957 2.480 1074 HH12 ARG 140 HH12 ARG 140 16.588 4.307 2.399 1075 HH21 ARG 140 HH21 ARG 140 16.478 2.663 5.522 1076 HH22 ARG 140 HH22 ARG 140 17.469 2.999 4.175 1077 H ALA 141 H ALA 141 9.394 4.319 7.806 1078 HA ALA 141 HA ALA 141 7.887 6.120 6.332 1079 HB1 ALA 141 HB1 ALA 141 6.912 4.242 7.497 1080 HB2 ALA 141 HB2 ALA 141 6.168 5.746 8.076 1081 HB3 ALA 141 HB3 ALA 141 7.387 4.935 9.045 1082 H GLN 142 H GLN 142 9.207 6.421 9.610 1083 HA GLN 142 HA GLN 142 8.223 9.019 10.089 1084 HB2 GLN 142 HB2 GLN 142 10.633 7.638 11.250 1085 HB3 GLN 142 HB3 GLN 142 9.986 9.160 11.834 1086 HG2 GLN 142 HG2 GLN 142 7.886 8.031 12.405 1087 HG3 GLN 142 HG3 GLN 142 8.574 6.504 11.842 1088 HE21 GLN 142 HE21 GLN 142 7.652 7.234 14.508 1089 HE22 GLN 142 HE22 GLN 142 9.020 7.053 15.539 1090 H ALA 143 H ALA 143 11.205 7.837 8.684 1091 HA ALA 143 HA ALA 143 12.494 10.323 8.442 1092 HB1 ALA 143 HB1 ALA 143 13.663 8.164 8.263 1093 HB2 ALA 143 HB2 ALA 143 13.989 9.204 6.877 1094 HB3 ALA 143 HB3 ALA 143 12.851 7.865 6.727 1095 H MET 144 H MET 144 9.948 8.905 6.639 1096 HA MET 144 HA MET 144 10.273 10.801 4.450 1097 HB2 MET 144 HB2 MET 144 8.103 8.730 4.830 1098 HB3 MET 144 HB3 MET 144 8.384 9.682 3.380 1099 HG2 MET 144 HG2 MET 144 10.151 7.545 4.543 1100 HG3 MET 144 HG3 MET 144 9.246 7.478 3.038 1101 HE1 MET 144 HE1 MET 144 9.815 10.392 1.818 1102 HE2 MET 144 HE2 MET 144 9.895 8.911 0.864 1103 HE3 MET 144 HE3 MET 144 11.231 10.063 0.825 1104 H ALA 145 H ALA 145 8.500 10.466 7.361 1105 HA ALA 145 HA ALA 145 6.545 12.480 6.597 1106 HB1 ALA 145 HB1 ALA 145 5.822 10.554 7.964 1107 HB2 ALA 145 HB2 ALA 145 5.517 12.095 8.757 1108 HB3 ALA 145 HB3 ALA 145 6.887 11.100 9.262 1109 H TYR 146 H TYR 146 9.492 12.217 8.401 1110 HA TYR 146 HA TYR 146 9.312 15.071 8.981 1111 HB2 TYR 146 HB2 TYR 146 10.878 12.976 10.526 1112 HB3 TYR 146 HB3 TYR 146 10.726 14.677 10.939 1113 HD1 TYR 146 HD1 TYR 146 8.358 15.531 11.543 1114 HD2 TYR 146 HD2 TYR 146 9.368 11.406 11.370 1115 HE1 TYR 146 HE1 TYR 146 6.386 14.991 12.921 1116 HE2 TYR 146 HE2 TYR 146 7.407 10.855 12.734 1117 HH TYR 146 HH TYR 146 4.913 13.076 13.320 Start of MODEL 4 1 H MET 1 H MET 1 -4.587 20.398 39.913 2 HA MET 1 HA MET 1 -4.332 22.120 38.269 3 HB2 MET 1 HB2 MET 1 -1.889 22.399 38.507 4 HB3 MET 1 HB3 MET 1 -1.643 20.803 37.812 5 HG2 MET 1 HG2 MET 1 -2.721 21.607 35.724 6 HG3 MET 1 HG3 MET 1 -2.799 23.216 36.430 7 HE1 MET 1 HE1 MET 1 -0.621 24.629 37.105 8 HE2 MET 1 HE2 MET 1 1.028 24.062 36.840 9 HE3 MET 1 HE3 MET 1 0.008 23.277 38.043 10 HA PRO 2 HA PRO 2 -5.767 18.514 35.998 11 HB2 PRO 2 HB2 PRO 2 -7.656 19.963 34.545 12 HB3 PRO 2 HB3 PRO 2 -7.954 19.121 36.063 13 HG2 PRO 2 HG2 PRO 2 -7.903 21.953 35.571 14 HG3 PRO 2 HG3 PRO 2 -8.263 21.111 37.080 15 HD2 PRO 2 HD2 PRO 2 -5.820 22.486 36.263 16 HD3 PRO 2 HD3 PRO 2 -6.310 21.906 37.866 17 H GLY 3 H GLY 3 -4.812 17.774 34.221 18 HA2 GLY 3 HA2 GLY 3 -3.495 19.492 32.351 19 HA3 GLY 3 HA3 GLY 3 -3.661 17.737 32.221 20 H ARG 4 H ARG 4 -4.815 20.741 31.196 21 HA ARG 4 HA ARG 4 -7.457 19.918 30.582 22 HB2 ARG 4 HB2 ARG 4 -6.000 22.381 29.666 23 HB3 ARG 4 HB3 ARG 4 -7.728 22.093 29.550 24 HG2 ARG 4 HG2 ARG 4 -7.881 21.997 31.981 25 HG3 ARG 4 HG3 ARG 4 -6.144 22.281 32.097 26 HD2 ARG 4 HD2 ARG 4 -6.456 24.422 30.911 27 HD3 ARG 4 HD3 ARG 4 -8.195 24.131 30.910 28 HE ARG 4 HE ARG 4 -6.629 24.337 33.377 29 HH11 ARG 4 HH11 ARG 4 -9.431 25.291 31.427 30 HH12 ARG 4 HH12 ARG 4 -10.117 26.272 32.624 31 HH21 ARG 4 HH21 ARG 4 -7.566 25.766 35.023 32 HH22 ARG 4 HH22 ARG 4 -9.053 26.539 34.686 33 H ALA 5 H ALA 5 -8.392 19.465 28.751 34 HA ALA 5 HA ALA 5 -7.111 19.655 26.201 35 HB1 ALA 5 HB1 ALA 5 -7.618 17.291 25.629 36 HB2 ALA 5 HB2 ALA 5 -8.099 16.998 27.300 37 HB3 ALA 5 HB3 ALA 5 -6.423 17.391 26.923 38 HA PRO 6 HA PRO 6 -11.506 20.912 26.450 39 HB2 PRO 6 HB2 PRO 6 -10.716 22.576 24.139 40 HB3 PRO 6 HB3 PRO 6 -11.488 23.061 25.651 41 HG2 PRO 6 HG2 PRO 6 -8.929 23.669 25.167 42 HG3 PRO 6 HG3 PRO 6 -9.471 23.204 26.791 43 HD2 PRO 6 HD2 PRO 6 -8.072 21.539 24.722 44 HD3 PRO 6 HD3 PRO 6 -7.754 21.668 26.470 45 H GLY 7 H GLY 7 -12.330 19.027 25.748 46 HA2 GLY 7 HA2 GLY 7 -13.792 18.107 24.142 47 HA3 GLY 7 HA3 GLY 7 -12.874 18.940 22.891 48 H SER 8 H SER 8 -13.430 16.024 24.342 49 HA SER 8 HA SER 8 -10.857 14.859 23.896 50 HB2 SER 8 HB2 SER 8 -12.477 14.002 25.612 51 HB3 SER 8 HB3 SER 8 -13.567 13.541 24.311 52 HG SER 8 HG SER 8 -11.626 12.148 25.376 53 H THR 9 H THR 9 -10.236 15.050 21.834 54 HA THR 9 HA THR 9 -12.036 15.009 19.632 55 HB THR 9 HB THR 9 -9.009 14.962 19.572 56 HG1 THR 9 HG1 THR 9 -10.845 16.874 20.387 57 HG21 THR 9 HG21 THR 9 -11.065 16.159 17.688 58 HG22 THR 9 HG22 THR 9 -10.188 14.658 17.399 59 HG23 THR 9 HG23 THR 9 -9.314 16.189 17.464 60 H LEU 10 H LEU 10 -12.135 13.550 17.943 61 HA LEU 10 HA LEU 10 -11.174 10.837 18.517 62 HB2 LEU 10 HB2 LEU 10 -13.485 11.789 16.843 63 HB3 LEU 10 HB3 LEU 10 -13.070 10.110 17.121 64 HG LEU 10 HG LEU 10 -14.141 12.073 19.156 65 HD11 LEU 10 HD11 LEU 10 -15.355 9.608 17.937 66 HD12 LEU 10 HD12 LEU 10 -15.818 11.277 17.608 67 HD13 LEU 10 HD13 LEU 10 -16.071 10.589 19.215 68 HD21 LEU 10 HD21 LEU 10 -14.203 10.158 20.701 69 HD22 LEU 10 HD22 LEU 10 -12.555 10.583 20.237 70 HD23 LEU 10 HD23 LEU 10 -13.343 9.185 19.508 71 H ALA 11 H ALA 11 -11.085 9.645 16.208 72 HA ALA 11 HA ALA 11 -9.246 11.225 14.625 73 HB1 ALA 11 HB1 ALA 11 -8.765 9.123 13.460 74 HB2 ALA 11 HB2 ALA 11 -10.073 8.329 14.336 75 HB3 ALA 11 HB3 ALA 11 -8.654 8.904 15.207 76 H ARG 12 H ARG 12 -10.110 12.529 13.159 77 HA ARG 12 HA ARG 12 -12.573 11.774 11.838 78 HB2 ARG 12 HB2 ARG 12 -11.132 14.316 12.333 79 HB3 ARG 12 HB3 ARG 12 -12.091 14.207 10.873 80 HG2 ARG 12 HG2 ARG 12 -13.197 15.261 12.860 81 HG3 ARG 12 HG3 ARG 12 -14.101 13.966 12.081 82 HD2 ARG 12 HD2 ARG 12 -12.421 13.550 14.557 83 HD3 ARG 12 HD3 ARG 12 -14.106 14.054 14.643 84 HE ARG 12 HE ARG 12 -13.183 11.498 13.463 85 HH11 ARG 12 HH11 ARG 12 -15.620 13.331 15.269 86 HH12 ARG 12 HH12 ARG 12 -16.647 11.992 15.481 87 HH21 ARG 12 HH21 ARG 12 -14.601 9.641 13.795 88 HH22 ARG 12 HH22 ARG 12 -16.055 9.871 14.641 89 H VAL 13 H VAL 13 -12.163 10.375 10.289 90 HA VAL 13 HA VAL 13 -10.292 11.132 8.213 91 HB VAL 13 HB VAL 13 -9.630 8.761 7.960 92 HG11 VAL 13 HG11 VAL 13 -8.225 8.494 9.952 93 HG12 VAL 13 HG12 VAL 13 -9.146 9.761 10.759 94 HG13 VAL 13 HG13 VAL 13 -8.187 10.144 9.332 95 HG21 VAL 13 HG21 VAL 13 -10.178 7.078 9.681 96 HG22 VAL 13 HG22 VAL 13 -11.626 7.675 8.869 97 HG23 VAL 13 HG23 VAL 13 -11.219 8.249 10.485 98 H GLY 14 H GLY 14 -11.043 10.574 6.218 99 HA2 GLY 14 HA2 GLY 14 -13.874 9.954 6.043 100 HA3 GLY 14 HA3 GLY 14 -12.810 10.348 4.691 101 H SER 15 H SER 15 -11.025 8.704 4.396 102 HA SER 15 HA SER 15 -11.193 6.025 5.062 103 HB2 SER 15 HB2 SER 15 -13.309 6.050 3.713 104 HB3 SER 15 HB3 SER 15 -12.446 6.798 2.378 105 HG SER 15 HG SER 15 -11.100 4.806 2.408 106 H ILE 16 H ILE 16 -9.386 4.950 3.769 107 HA ILE 16 HA ILE 16 -7.746 6.997 2.587 108 HB ILE 16 HB ILE 16 -7.174 4.038 3.108 109 HG12 ILE 16 HG12 ILE 16 -5.357 4.926 4.612 110 HG13 ILE 16 HG13 ILE 16 -5.951 6.546 4.315 111 HG21 ILE 16 HG21 ILE 16 -5.380 6.088 1.813 112 HG22 ILE 16 HG22 ILE 16 -6.057 4.650 1.050 113 HG23 ILE 16 HG23 ILE 16 -4.863 4.490 2.338 114 HD11 ILE 16 HD11 ILE 16 -6.660 5.719 6.476 115 HD12 ILE 16 HD12 ILE 16 -7.432 4.326 5.718 116 HD13 ILE 16 HD13 ILE 16 -8.058 5.946 5.423 117 HA PRO 17 HA PRO 17 -9.581 5.969 -1.295 118 HB2 PRO 17 HB2 PRO 17 -8.286 7.783 -2.798 119 HB3 PRO 17 HB3 PRO 17 -9.554 8.242 -1.652 120 HG2 PRO 17 HG2 PRO 17 -6.581 8.385 -1.330 121 HG3 PRO 17 HG3 PRO 17 -7.816 9.574 -0.873 122 HD2 PRO 17 HD2 PRO 17 -6.667 7.828 0.880 123 HD3 PRO 17 HD3 PRO 17 -8.299 8.496 1.084 124 H ALA 18 H ALA 18 -8.901 5.218 -3.405 125 HA ALA 18 HA ALA 18 -6.233 3.998 -3.404 126 HB1 ALA 18 HB1 ALA 18 -8.621 3.455 -5.189 127 HB2 ALA 18 HB2 ALA 18 -8.114 2.470 -3.812 128 HB3 ALA 18 HB3 ALA 18 -7.069 2.608 -5.228 129 H GLY 19 H GLY 19 -4.693 4.978 -4.614 130 HA2 GLY 19 HA2 GLY 19 -5.622 6.963 -6.543 131 HA3 GLY 19 HA3 GLY 19 -4.074 6.959 -5.718 132 H ASP 20 H ASP 20 -2.387 6.128 -6.720 133 HA ASP 20 HA ASP 20 -2.927 4.967 -9.360 134 HB2 ASP 20 HB2 ASP 20 -1.955 7.179 -9.505 135 HB3 ASP 20 HB3 ASP 20 -0.643 6.701 -8.433 136 H ASP 21 H ASP 21 -2.064 3.102 -9.896 137 HA ASP 21 HA ASP 21 -0.699 1.484 -7.962 138 HB2 ASP 21 HB2 ASP 21 -2.313 0.555 -9.614 139 HB3 ASP 21 HB3 ASP 21 -1.234 1.014 -10.919 140 H VAL 22 H VAL 22 1.377 1.695 -7.566 141 HA VAL 22 HA VAL 22 3.108 3.067 -9.474 142 HB VAL 22 HB VAL 22 3.543 2.403 -6.539 143 HG11 VAL 22 HG11 VAL 22 5.184 4.216 -8.309 144 HG12 VAL 22 HG12 VAL 22 5.683 2.642 -7.683 145 HG13 VAL 22 HG13 VAL 22 5.389 3.980 -6.567 146 HG21 VAL 22 HG21 VAL 22 2.788 4.983 -7.879 147 HG22 VAL 22 HG22 VAL 22 3.154 4.788 -6.165 148 HG23 VAL 22 HG23 VAL 22 1.750 3.979 -6.867 149 H LEU 23 H LEU 23 2.460 -0.148 -8.785 150 HA LEU 23 HA LEU 23 5.262 -0.813 -9.069 151 HB2 LEU 23 HB2 LEU 23 4.687 -3.186 -8.394 152 HB3 LEU 23 HB3 LEU 23 4.523 -1.957 -7.182 153 HG LEU 23 HG LEU 23 2.131 -2.105 -7.246 154 HD11 LEU 23 HD11 LEU 23 2.495 -4.165 -9.434 155 HD12 LEU 23 HD12 LEU 23 1.811 -2.555 -9.664 156 HD13 LEU 23 HD13 LEU 23 0.967 -3.740 -8.665 157 HD21 LEU 23 HD21 LEU 23 3.239 -3.673 -5.851 158 HD22 LEU 23 HD22 LEU 23 3.456 -4.790 -7.203 159 HD23 LEU 23 HD23 LEU 23 1.840 -4.447 -6.608 160 H ASP 24 H ASP 24 5.321 -3.270 -10.068 161 HA ASP 24 HA ASP 24 4.633 -2.852 -12.859 162 HB2 ASP 24 HB2 ASP 24 6.429 -4.831 -11.437 163 HB3 ASP 24 HB3 ASP 24 6.066 -4.920 -13.149 164 HA PRO 25 HA PRO 25 1.121 -5.670 -12.348 165 HB2 PRO 25 HB2 PRO 25 1.769 -6.193 -15.210 166 HB3 PRO 25 HB3 PRO 25 0.208 -5.808 -14.472 167 HG2 PRO 25 HG2 PRO 25 1.498 -3.961 -15.841 168 HG3 PRO 25 HG3 PRO 25 0.701 -3.542 -14.315 169 HD2 PRO 25 HD2 PRO 25 3.607 -3.984 -14.868 170 HD3 PRO 25 HD3 PRO 25 2.823 -2.767 -13.831 171 H ASP 26 H ASP 26 4.213 -6.438 -13.627 172 HA ASP 26 HA ASP 26 4.177 -9.222 -13.857 173 HB2 ASP 26 HB2 ASP 26 6.106 -7.866 -14.533 174 HB3 ASP 26 HB3 ASP 26 6.408 -7.442 -12.852 175 H GLU 27 H GLU 27 4.551 -7.146 -11.017 176 HA GLU 27 HA GLU 27 5.053 -9.218 -9.157 177 HB2 GLU 27 HB2 GLU 27 4.027 -6.397 -8.836 178 HB3 GLU 27 HB3 GLU 27 4.325 -7.465 -7.475 179 HG2 GLU 27 HG2 GLU 27 6.406 -6.612 -9.475 180 HG3 GLU 27 HG3 GLU 27 6.139 -5.845 -7.911 181 HA PRO 28 HA PRO 28 0.944 -10.919 -8.956 182 HB2 PRO 28 HB2 PRO 28 1.682 -11.529 -6.148 183 HB3 PRO 28 HB3 PRO 28 1.126 -12.617 -7.419 184 HG2 PRO 28 HG2 PRO 28 3.666 -12.599 -6.640 185 HG3 PRO 28 HG3 PRO 28 3.229 -12.824 -8.345 186 HD2 PRO 28 HD2 PRO 28 4.297 -10.408 -6.964 187 HD3 PRO 28 HD3 PRO 28 4.631 -11.045 -8.591 188 H THR 29 H THR 29 -0.901 -9.873 -8.558 189 HA THR 29 HA THR 29 -1.046 -8.089 -6.253 190 HB THR 29 HB THR 29 -2.051 -7.506 -9.038 191 HG1 THR 29 HG1 THR 29 0.236 -7.375 -8.951 192 HG21 THR 29 HG21 THR 29 -2.421 -5.223 -8.231 193 HG22 THR 29 HG22 THR 29 -1.860 -5.691 -6.624 194 HG23 THR 29 HG23 THR 29 -3.335 -6.394 -7.273 195 H TYR 30 H TYR 30 -3.333 -7.636 -5.626 196 HA TYR 30 HA TYR 30 -5.120 -9.850 -6.228 197 HB2 TYR 30 HB2 TYR 30 -4.668 -8.415 -3.611 198 HB3 TYR 30 HB3 TYR 30 -6.002 -9.516 -3.920 199 HD1 TYR 30 HD1 TYR 30 -4.885 -11.735 -5.266 200 HD2 TYR 30 HD2 TYR 30 -3.163 -9.394 -2.180 201 HE1 TYR 30 HE1 TYR 30 -3.525 -13.642 -4.612 202 HE2 TYR 30 HE2 TYR 30 -1.775 -11.304 -1.503 203 HH TYR 30 HH TYR 30 -1.435 -14.074 -3.447 204 H ASP 31 H ASP 31 -7.383 -9.286 -5.794 205 HA ASP 31 HA ASP 31 -8.014 -6.493 -6.436 206 HB2 ASP 31 HB2 ASP 31 -7.962 -8.124 -8.479 207 HB3 ASP 31 HB3 ASP 31 -9.321 -8.923 -7.716 208 H LEU 32 H LEU 32 -10.526 -6.385 -6.054 209 HA LEU 32 HA LEU 32 -10.870 -6.781 -3.346 210 HB2 LEU 32 HB2 LEU 32 -12.947 -6.214 -5.417 211 HB3 LEU 32 HB3 LEU 32 -13.342 -6.356 -3.721 212 HG LEU 32 HG LEU 32 -13.190 -4.093 -4.162 213 HD11 LEU 32 HD11 LEU 32 -10.591 -4.830 -2.875 214 HD12 LEU 32 HD12 LEU 32 -12.162 -4.680 -2.091 215 HD13 LEU 32 HD13 LEU 32 -11.389 -3.260 -2.792 216 HD21 LEU 32 HD21 LEU 32 -11.275 -2.968 -5.198 217 HD22 LEU 32 HD22 LEU 32 -12.056 -4.108 -6.295 218 HD23 LEU 32 HD23 LEU 32 -10.536 -4.539 -5.509 219 HA PRO 33 HA PRO 33 -13.860 -10.608 -4.131 220 HB2 PRO 33 HB2 PRO 33 -12.937 -12.084 -6.335 221 HB3 PRO 33 HB3 PRO 33 -14.413 -11.115 -6.287 222 HG2 PRO 33 HG2 PRO 33 -11.712 -10.408 -7.347 223 HG3 PRO 33 HG3 PRO 33 -13.311 -10.017 -8.005 224 HD2 PRO 33 HD2 PRO 33 -11.894 -8.181 -6.706 225 HD3 PRO 33 HD3 PRO 33 -13.650 -8.304 -6.463 226 H ARG 34 H ARG 34 -10.496 -10.904 -5.445 227 HA ARG 34 HA ARG 34 -9.951 -13.284 -4.204 228 HB2 ARG 34 HB2 ARG 34 -8.769 -12.342 -6.144 229 HB3 ARG 34 HB3 ARG 34 -8.042 -11.135 -5.095 230 HG2 ARG 34 HG2 ARG 34 -6.537 -12.985 -5.590 231 HG3 ARG 34 HG3 ARG 34 -6.906 -12.883 -3.861 232 HD2 ARG 34 HD2 ARG 34 -8.517 -14.623 -4.064 233 HD3 ARG 34 HD3 ARG 34 -8.310 -14.650 -5.820 234 HE ARG 34 HE ARG 34 -5.824 -15.147 -4.869 235 HH11 ARG 34 HH11 ARG 34 -8.950 -16.747 -4.202 236 HH12 ARG 34 HH12 ARG 34 -8.211 -18.149 -3.608 237 HH21 ARG 34 HH21 ARG 34 -4.866 -17.106 -4.005 238 HH22 ARG 34 HH22 ARG 34 -5.846 -18.366 -3.485 239 H VAL 35 H VAL 35 -9.477 -9.962 -3.096 240 HA VAL 35 HA VAL 35 -7.906 -10.781 -0.876 241 HB VAL 35 HB VAL 35 -9.443 -8.179 -1.215 242 HG11 VAL 35 HG11 VAL 35 -7.281 -8.913 0.754 243 HG12 VAL 35 HG12 VAL 35 -8.968 -8.570 1.132 244 HG13 VAL 35 HG13 VAL 35 -7.920 -7.284 0.520 245 HG21 VAL 35 HG21 VAL 35 -7.761 -8.494 -2.932 246 HG22 VAL 35 HG22 VAL 35 -6.545 -8.839 -1.703 247 HG23 VAL 35 HG23 VAL 35 -7.254 -7.230 -1.814 248 H ALA 36 H ALA 36 -11.279 -10.146 -1.346 249 HA ALA 36 HA ALA 36 -12.143 -10.447 1.309 250 HB1 ALA 36 HB1 ALA 36 -14.339 -10.896 0.295 251 HB2 ALA 36 HB2 ALA 36 -13.572 -11.090 -1.279 252 HB3 ALA 36 HB3 ALA 36 -13.551 -9.519 -0.478 253 H GLU 37 H GLU 37 -11.567 -12.645 -1.307 254 HA GLU 37 HA GLU 37 -12.520 -15.027 -0.213 255 HB2 GLU 37 HB2 GLU 37 -11.868 -14.334 -2.609 256 HB3 GLU 37 HB3 GLU 37 -10.263 -14.701 -2.112 257 HG2 GLU 37 HG2 GLU 37 -10.601 -16.963 -1.873 258 HG3 GLU 37 HG3 GLU 37 -12.357 -16.796 -1.802 259 H LEU 38 H LEU 38 -9.271 -13.596 -0.285 260 HA LEU 38 HA LEU 38 -7.866 -15.685 0.948 261 HB2 LEU 38 HB2 LEU 38 -7.306 -12.726 0.961 262 HB3 LEU 38 HB3 LEU 38 -6.195 -13.932 1.560 263 HG LEU 38 HG LEU 38 -7.136 -13.715 -1.299 264 HD11 LEU 38 HD11 LEU 38 -5.757 -11.823 -0.619 265 HD12 LEU 38 HD12 LEU 38 -4.883 -12.884 -1.722 266 HD13 LEU 38 HD13 LEU 38 -4.536 -12.931 0.006 267 HD21 LEU 38 HD21 LEU 38 -6.518 -16.003 -0.677 268 HD22 LEU 38 HD22 LEU 38 -4.990 -15.409 -0.018 269 HD23 LEU 38 HD23 LEU 38 -5.310 -15.290 -1.746 270 H LEU 39 H LEU 39 -9.332 -12.792 2.317 271 HA LEU 39 HA LEU 39 -8.481 -13.525 4.968 272 HB2 LEU 39 HB2 LEU 39 -10.195 -11.257 4.010 273 HB3 LEU 39 HB3 LEU 39 -9.583 -11.435 5.648 274 HG LEU 39 HG LEU 39 -7.907 -11.024 3.164 275 HD11 LEU 39 HD11 LEU 39 -9.140 -9.041 3.761 276 HD12 LEU 39 HD12 LEU 39 -7.422 -8.837 4.117 277 HD13 LEU 39 HD13 LEU 39 -8.562 -9.159 5.422 278 HD21 LEU 39 HD21 LEU 39 -6.697 -12.347 4.797 279 HD22 LEU 39 HD22 LEU 39 -7.109 -11.196 6.071 280 HD23 LEU 39 HD23 LEU 39 -6.049 -10.711 4.750 281 H GLY 40 H GLY 40 -11.230 -14.106 3.041 282 HA2 GLY 40 HA2 GLY 40 -13.047 -15.446 3.511 283 HA3 GLY 40 HA3 GLY 40 -12.453 -15.621 5.161 284 H VAL 41 H VAL 41 -12.858 -12.576 3.654 285 HA VAL 41 HA VAL 41 -15.076 -11.948 5.493 286 HB VAL 41 HB VAL 41 -14.227 -9.673 5.677 287 HG11 VAL 41 HG11 VAL 41 -12.143 -10.019 6.897 288 HG12 VAL 41 HG12 VAL 41 -12.032 -11.644 6.216 289 HG13 VAL 41 HG13 VAL 41 -13.365 -11.228 7.292 290 HG21 VAL 41 HG21 VAL 41 -12.010 -9.025 4.706 291 HG22 VAL 41 HG22 VAL 41 -13.258 -9.340 3.494 292 HG23 VAL 41 HG23 VAL 41 -12.027 -10.548 3.806 293 HA PRO 42 HA PRO 42 -17.048 -10.517 1.738 294 HB2 PRO 42 HB2 PRO 42 -18.632 -8.513 2.640 295 HB3 PRO 42 HB3 PRO 42 -19.000 -10.210 2.966 296 HG2 PRO 42 HG2 PRO 42 -17.677 -8.189 4.722 297 HG3 PRO 42 HG3 PRO 42 -18.929 -9.373 5.143 298 HD2 PRO 42 HD2 PRO 42 -16.315 -9.772 5.705 299 HD3 PRO 42 HD3 PRO 42 -17.412 -11.106 5.308 300 H VAL 43 H VAL 43 -17.094 -8.703 0.293 301 HA VAL 43 HA VAL 43 -14.794 -7.164 0.083 302 HB VAL 43 HB VAL 43 -17.504 -6.407 -1.047 303 HG11 VAL 43 HG11 VAL 43 -14.723 -5.764 -2.017 304 HG12 VAL 43 HG12 VAL 43 -15.869 -4.639 -1.289 305 HG13 VAL 43 HG13 VAL 43 -16.219 -5.361 -2.861 306 HG21 VAL 43 HG21 VAL 43 -16.866 -7.698 -3.040 307 HG22 VAL 43 HG22 VAL 43 -17.033 -8.696 -1.593 308 HG23 VAL 43 HG23 VAL 43 -15.424 -8.264 -2.186 309 H SER 44 H SER 44 -17.847 -6.450 1.628 310 HA SER 44 HA SER 44 -17.627 -3.779 2.146 311 HB2 SER 44 HB2 SER 44 -18.804 -5.924 3.880 312 HB3 SER 44 HB3 SER 44 -19.332 -4.230 3.759 313 HG SER 44 HG SER 44 -19.767 -4.697 1.513 314 H LYS 45 H LYS 45 -16.272 -6.537 4.040 315 HA LYS 45 HA LYS 45 -15.255 -4.795 6.047 316 HB2 LYS 45 HB2 LYS 45 -14.531 -7.656 5.451 317 HB3 LYS 45 HB3 LYS 45 -13.829 -6.735 6.779 318 HG2 LYS 45 HG2 LYS 45 -16.213 -6.350 7.569 319 HG3 LYS 45 HG3 LYS 45 -16.687 -7.585 6.408 320 HD2 LYS 45 HD2 LYS 45 -16.438 -8.603 8.570 321 HD3 LYS 45 HD3 LYS 45 -15.125 -9.166 7.542 322 HE2 LYS 45 HE2 LYS 45 -14.349 -8.599 9.806 323 HE3 LYS 45 HE3 LYS 45 -13.585 -7.587 8.593 324 HZ1 LYS 45 HZ1 LYS 45 -15.113 -5.797 9.156 325 HZ2 LYS 45 HZ2 LYS 45 -14.293 -6.312 10.521 326 HZ3 LYS 45 HZ3 LYS 45 -15.901 -6.769 10.289 327 H VAL 46 H VAL 46 -14.016 -6.037 3.078 328 HA VAL 46 HA VAL 46 -11.333 -5.043 3.368 329 HB VAL 46 HB VAL 46 -12.939 -5.266 0.801 330 HG11 VAL 46 HG11 VAL 46 -9.960 -5.218 1.267 331 HG12 VAL 46 HG12 VAL 46 -10.940 -3.905 0.621 332 HG13 VAL 46 HG13 VAL 46 -10.758 -5.404 -0.302 333 HG21 VAL 46 HG21 VAL 46 -11.886 -7.467 0.494 334 HG22 VAL 46 HG22 VAL 46 -12.898 -7.424 1.937 335 HG23 VAL 46 HG23 VAL 46 -11.144 -7.330 2.087 336 H ALA 47 H ALA 47 -14.265 -3.568 2.193 337 HA ALA 47 HA ALA 47 -13.162 -1.061 1.610 338 HB1 ALA 47 HB1 ALA 47 -15.450 -0.227 1.737 339 HB2 ALA 47 HB2 ALA 47 -15.959 -1.711 2.545 340 HB3 ALA 47 HB3 ALA 47 -15.398 -1.764 0.876 341 H GLN 48 H GLN 48 -14.373 -2.450 4.593 342 HA GLN 48 HA GLN 48 -14.195 -0.110 6.187 343 HB2 GLN 48 HB2 GLN 48 -14.014 -3.000 7.002 344 HB3 GLN 48 HB3 GLN 48 -14.098 -1.665 8.138 345 HG2 GLN 48 HG2 GLN 48 -16.311 -1.089 7.237 346 HG3 GLN 48 HG3 GLN 48 -16.208 -2.481 6.156 347 HE21 GLN 48 HE21 GLN 48 -16.542 -1.447 9.453 348 HE22 GLN 48 HE22 GLN 48 -17.024 -2.976 10.082 349 H GLN 49 H GLN 49 -11.897 -2.648 5.426 350 HA GLN 49 HA GLN 49 -9.820 -1.803 7.147 351 HB2 GLN 49 HB2 GLN 49 -9.614 -3.199 4.479 352 HB3 GLN 49 HB3 GLN 49 -8.279 -2.984 5.604 353 HG2 GLN 49 HG2 GLN 49 -9.593 -4.173 7.277 354 HG3 GLN 49 HG3 GLN 49 -10.790 -4.544 6.048 355 HE21 GLN 49 HE21 GLN 49 -10.308 -5.998 4.450 356 HE22 GLN 49 HE22 GLN 49 -8.934 -7.042 4.500 357 H LEU 50 H LEU 50 -10.540 -1.099 3.872 358 HA LEU 50 HA LEU 50 -8.446 0.708 3.278 359 HB2 LEU 50 HB2 LEU 50 -11.247 0.498 2.211 360 HB3 LEU 50 HB3 LEU 50 -10.016 1.515 1.451 361 HG LEU 50 HG LEU 50 -10.085 -1.500 1.678 362 HD11 LEU 50 HD11 LEU 50 -11.629 -0.607 0.037 363 HD12 LEU 50 HD12 LEU 50 -10.291 -1.443 -0.748 364 HD13 LEU 50 HD13 LEU 50 -10.323 0.319 -0.705 365 HD21 LEU 50 HD21 LEU 50 -7.780 -0.730 1.830 366 HD22 LEU 50 HD22 LEU 50 -8.009 0.268 0.391 367 HD23 LEU 50 HD23 LEU 50 -8.083 -1.489 0.269 368 H ARG 51 H ARG 51 -11.690 1.238 4.589 369 HA ARG 51 HA ARG 51 -11.656 3.955 4.880 370 HB2 ARG 51 HB2 ARG 51 -13.731 3.085 5.168 371 HB3 ARG 51 HB3 ARG 51 -13.123 1.623 5.906 372 HG2 ARG 51 HG2 ARG 51 -14.511 2.794 7.452 373 HG3 ARG 51 HG3 ARG 51 -12.848 2.830 8.018 374 HD2 ARG 51 HD2 ARG 51 -12.664 5.101 7.022 375 HD3 ARG 51 HD3 ARG 51 -14.401 5.009 6.702 376 HE ARG 51 HE ARG 51 -13.606 4.405 9.401 377 HH11 ARG 51 HH11 ARG 51 -14.606 7.045 7.253 378 HH12 ARG 51 HH12 ARG 51 -15.065 8.082 8.528 379 HH21 ARG 51 HH21 ARG 51 -14.220 5.845 11.126 380 HH22 ARG 51 HH22 ARG 51 -14.882 7.372 10.790 381 H GLU 52 H GLU 52 -10.378 1.443 7.100 382 HA GLU 52 HA GLU 52 -9.871 3.515 9.106 383 HB2 GLU 52 HB2 GLU 52 -9.519 0.526 9.262 384 HB3 GLU 52 HB3 GLU 52 -9.274 1.644 10.590 385 HG2 GLU 52 HG2 GLU 52 -11.876 1.141 9.162 386 HG3 GLU 52 HG3 GLU 52 -11.424 0.487 10.728 387 H GLY 53 H GLY 53 -8.199 2.035 6.625 388 HA2 GLY 53 HA2 GLY 53 -5.986 2.379 5.990 389 HA3 GLY 53 HA3 GLY 53 -5.690 3.143 7.549 390 H HIS 54 H HIS 54 -7.144 0.020 7.100 391 HA HIS 54 HA HIS 54 -4.943 -1.194 8.612 392 HB2 HIS 54 HB2 HIS 54 -7.356 -1.695 9.216 393 HB3 HIS 54 HB3 HIS 54 -7.525 -2.502 7.665 394 HD1 HIS 54 HD1 HIS 54 -6.955 -5.027 7.682 395 HD2 HIS 54 HD2 HIS 54 -5.379 -2.953 10.924 396 HE1 HIS 54 HE1 HIS 54 -5.965 -6.752 9.202 397 H LEU 55 H LEU 55 -6.088 -0.764 5.478 398 HA LEU 55 HA LEU 55 -3.965 -2.227 4.270 399 HB2 LEU 55 HB2 LEU 55 -5.725 -3.968 4.653 400 HB3 LEU 55 HB3 LEU 55 -6.869 -2.970 3.791 401 HG LEU 55 HG LEU 55 -5.584 -3.291 1.717 402 HD11 LEU 55 HD11 LEU 55 -3.812 -4.987 1.646 403 HD12 LEU 55 HD12 LEU 55 -3.881 -5.125 3.404 404 HD13 LEU 55 HD13 LEU 55 -3.368 -3.612 2.652 405 HD21 LEU 55 HD21 LEU 55 -6.156 -5.657 1.414 406 HD22 LEU 55 HD22 LEU 55 -7.433 -4.776 2.253 407 HD23 LEU 55 HD23 LEU 55 -6.347 -5.825 3.159 408 H VAL 56 H VAL 56 -3.802 -1.428 2.009 409 HA VAL 56 HA VAL 56 -5.699 0.687 1.370 410 HB VAL 56 HB VAL 56 -3.904 2.099 0.432 411 HG11 VAL 56 HG11 VAL 56 -3.403 1.438 3.316 412 HG12 VAL 56 HG12 VAL 56 -4.668 2.494 2.714 413 HG13 VAL 56 HG13 VAL 56 -2.969 2.947 2.508 414 HG21 VAL 56 HG21 VAL 56 -2.244 0.396 -0.060 415 HG22 VAL 56 HG22 VAL 56 -2.012 0.106 1.663 416 HG23 VAL 56 HG23 VAL 56 -1.542 1.654 0.959 417 H ALA 57 H ALA 57 -5.587 1.275 -0.978 418 HA ALA 57 HA ALA 57 -4.840 -1.008 -2.618 419 HB1 ALA 57 HB1 ALA 57 -7.187 -1.317 -1.982 420 HB2 ALA 57 HB2 ALA 57 -7.025 -0.948 -3.701 421 HB3 ALA 57 HB3 ALA 57 -7.556 0.301 -2.575 422 H VAL 58 H VAL 58 -4.876 -0.409 -4.896 423 HA VAL 58 HA VAL 58 -4.792 2.452 -5.398 424 HB VAL 58 HB VAL 58 -2.840 2.059 -6.966 425 HG11 VAL 58 HG11 VAL 58 -2.378 1.610 -4.028 426 HG12 VAL 58 HG12 VAL 58 -2.622 3.164 -4.813 427 HG13 VAL 58 HG13 VAL 58 -1.173 2.210 -5.177 428 HG21 VAL 58 HG21 VAL 58 -2.961 -0.376 -7.122 429 HG22 VAL 58 HG22 VAL 58 -2.628 -0.520 -5.395 430 HG23 VAL 58 HG23 VAL 58 -1.391 0.110 -6.479 431 H ARG 59 H ARG 59 -4.786 2.836 -7.853 432 HA ARG 59 HA ARG 59 -6.653 0.863 -8.964 433 HB2 ARG 59 HB2 ARG 59 -7.529 3.120 -8.070 434 HB3 ARG 59 HB3 ARG 59 -6.756 3.809 -9.487 435 HG2 ARG 59 HG2 ARG 59 -8.141 2.417 -10.924 436 HG3 ARG 59 HG3 ARG 59 -8.904 1.709 -9.500 437 HD2 ARG 59 HD2 ARG 59 -9.570 4.011 -8.815 438 HD3 ARG 59 HD3 ARG 59 -8.996 4.579 -10.382 439 HE ARG 59 HE ARG 59 -10.962 2.443 -10.392 440 HH11 ARG 59 HH11 ARG 59 -10.310 5.882 -10.808 441 HH12 ARG 59 HH12 ARG 59 -11.843 6.216 -11.468 442 HH21 ARG 59 HH21 ARG 59 -13.040 2.898 -11.262 443 HH22 ARG 59 HH22 ARG 59 -13.436 4.485 -11.761 444 H ARG 60 H ARG 60 -6.169 0.132 -10.884 445 HA ARG 60 HA ARG 60 -4.265 1.607 -12.558 446 HB2 ARG 60 HB2 ARG 60 -3.294 -0.520 -13.342 447 HB3 ARG 60 HB3 ARG 60 -3.105 -0.375 -11.602 448 HG2 ARG 60 HG2 ARG 60 -4.884 -1.957 -11.234 449 HG3 ARG 60 HG3 ARG 60 -5.266 -1.982 -12.951 450 HD2 ARG 60 HD2 ARG 60 -4.028 -3.966 -12.456 451 HD3 ARG 60 HD3 ARG 60 -2.977 -2.884 -13.364 452 HE ARG 60 HE ARG 60 -2.288 -2.308 -10.834 453 HH11 ARG 60 HH11 ARG 60 -2.595 -5.438 -12.510 454 HH12 ARG 60 HH12 ARG 60 -1.498 -6.213 -11.468 455 HH21 ARG 60 HH21 ARG 60 -0.879 -3.314 -9.521 456 HH22 ARG 60 HH22 ARG 60 -0.484 -4.991 -9.648 457 H ALA 61 H ALA 61 -5.286 2.267 -14.329 458 HA ALA 61 HA ALA 61 -6.606 2.388 -16.150 459 HB1 ALA 61 HB1 ALA 61 -5.360 0.363 -16.800 460 HB2 ALA 61 HB2 ALA 61 -7.009 0.348 -17.432 461 HB3 ALA 61 HB3 ALA 61 -6.595 -0.632 -16.026 462 H GLY 62 H GLY 62 -7.862 2.140 -13.420 463 HA2 GLY 62 HA2 GLY 62 -10.174 2.775 -13.131 464 HA3 GLY 62 HA3 GLY 62 -10.586 1.632 -14.399 465 H GLY 63 H GLY 63 -8.509 -0.192 -12.956 466 HA2 GLY 63 HA2 GLY 63 -10.560 -1.432 -11.267 467 HA3 GLY 63 HA3 GLY 63 -9.145 -2.227 -11.942 468 H VAL 64 H VAL 64 -10.274 -1.914 -9.211 469 HA VAL 64 HA VAL 64 -8.080 -0.496 -7.890 470 HB VAL 64 HB VAL 64 -10.612 -1.685 -6.716 471 HG11 VAL 64 HG11 VAL 64 -10.071 -0.372 -4.716 472 HG12 VAL 64 HG12 VAL 64 -8.562 0.146 -5.471 473 HG13 VAL 64 HG13 VAL 64 -8.813 -1.554 -5.076 474 HG21 VAL 64 HG21 VAL 64 -11.106 0.168 -8.202 475 HG22 VAL 64 HG22 VAL 64 -9.954 1.188 -7.340 476 HG23 VAL 64 HG23 VAL 64 -11.411 0.608 -6.524 477 H VAL 65 H VAL 65 -6.455 -1.621 -7.154 478 HA VAL 65 HA VAL 65 -6.758 -4.488 -6.647 479 HB VAL 65 HB VAL 65 -4.487 -4.782 -7.713 480 HG11 VAL 65 HG11 VAL 65 -5.356 -4.880 -10.016 481 HG12 VAL 65 HG12 VAL 65 -6.741 -3.901 -9.529 482 HG13 VAL 65 HG13 VAL 65 -6.525 -5.516 -8.858 483 HG21 VAL 65 HG21 VAL 65 -5.130 -2.083 -8.874 484 HG22 VAL 65 HG22 VAL 65 -3.784 -3.117 -9.362 485 HG23 VAL 65 HG23 VAL 65 -3.826 -2.434 -7.729 486 H ILE 66 H ILE 66 -5.205 -5.358 -5.310 487 HA ILE 66 HA ILE 66 -3.766 -3.444 -3.621 488 HB ILE 66 HB ILE 66 -5.261 -5.927 -2.680 489 HG12 ILE 66 HG12 ILE 66 -5.831 -2.991 -2.191 490 HG13 ILE 66 HG13 ILE 66 -6.751 -4.034 -3.261 491 HG21 ILE 66 HG21 ILE 66 -3.726 -3.855 -1.099 492 HG22 ILE 66 HG22 ILE 66 -3.198 -5.506 -1.408 493 HG23 ILE 66 HG23 ILE 66 -4.631 -5.207 -0.418 494 HD11 ILE 66 HD11 ILE 66 -6.517 -4.326 -0.275 495 HD12 ILE 66 HD12 ILE 66 -7.484 -5.349 -1.335 496 HD13 ILE 66 HD13 ILE 66 -7.888 -3.645 -1.144 497 HA PRO 67 HA PRO 67 -0.401 -6.038 -5.226 498 HB2 PRO 67 HB2 PRO 67 0.932 -4.596 -2.987 499 HB3 PRO 67 HB3 PRO 67 1.474 -4.807 -4.651 500 HG2 PRO 67 HG2 PRO 67 0.502 -2.484 -3.900 501 HG3 PRO 67 HG3 PRO 67 0.007 -3.171 -5.459 502 HD2 PRO 67 HD2 PRO 67 -1.492 -3.074 -2.876 503 HD3 PRO 67 HD3 PRO 67 -2.072 -2.821 -4.538 504 H GLN 68 H GLN 68 0.138 -8.137 -4.653 505 HA GLN 68 HA GLN 68 -0.642 -9.323 -2.289 506 HB2 GLN 68 HB2 GLN 68 -0.238 -10.609 -4.235 507 HB3 GLN 68 HB3 GLN 68 1.443 -10.108 -4.299 508 HG2 GLN 68 HG2 GLN 68 1.970 -11.389 -2.349 509 HG3 GLN 68 HG3 GLN 68 0.272 -11.765 -2.077 510 HE21 GLN 68 HE21 GLN 68 -0.308 -12.208 -4.890 511 HE22 GLN 68 HE22 GLN 68 0.420 -13.690 -5.275 512 H VAL 69 H VAL 69 2.236 -7.506 -2.914 513 HA VAL 69 HA VAL 69 3.856 -8.555 -0.915 514 HB VAL 69 HB VAL 69 5.072 -6.385 -0.923 515 HG11 VAL 69 HG11 VAL 69 5.834 -6.574 -3.271 516 HG12 VAL 69 HG12 VAL 69 4.476 -7.661 -3.588 517 HG13 VAL 69 HG13 VAL 69 5.725 -8.123 -2.440 518 HG21 VAL 69 HG21 VAL 69 4.443 -4.705 -2.606 519 HG22 VAL 69 HG22 VAL 69 3.223 -4.886 -1.344 520 HG23 VAL 69 HG23 VAL 69 2.961 -5.612 -2.930 521 H PHE 70 H PHE 70 1.020 -6.727 -0.523 522 HA PHE 70 HA PHE 70 1.658 -5.647 2.066 523 HB2 PHE 70 HB2 PHE 70 -0.805 -5.710 0.348 524 HB3 PHE 70 HB3 PHE 70 -0.923 -5.245 2.040 525 HD1 PHE 70 HD1 PHE 70 1.187 -4.454 -0.947 526 HD2 PHE 70 HD2 PHE 70 -0.801 -3.049 2.514 527 HE1 PHE 70 HE1 PHE 70 1.892 -2.155 -1.484 528 HE2 PHE 70 HE2 PHE 70 -0.100 -0.759 2.019 529 HZ PHE 70 HZ PHE 70 1.235 -0.293 0.011 530 H PHE 71 H PHE 71 0.992 -8.663 0.954 531 HA PHE 71 HA PHE 71 -0.210 -9.546 3.482 532 HB2 PHE 71 HB2 PHE 71 -0.554 -10.741 0.715 533 HB3 PHE 71 HB3 PHE 71 -1.162 -11.451 2.201 534 HD1 PHE 71 HD1 PHE 71 -1.576 -8.758 -0.243 535 HD2 PHE 71 HD2 PHE 71 -3.118 -10.567 3.284 536 HE1 PHE 71 HE1 PHE 71 -3.667 -7.497 -0.516 537 HE2 PHE 71 HE2 PHE 71 -5.213 -9.309 3.013 538 HZ PHE 71 HZ PHE 71 -5.485 -7.771 1.110 539 H THR 72 H THR 72 0.463 -11.715 4.067 540 HA THR 72 HA THR 72 3.251 -12.175 3.465 541 HB THR 72 HB THR 72 3.011 -13.973 5.197 542 HG1 THR 72 HG1 THR 72 0.834 -13.290 6.357 543 HG21 THR 72 HG21 THR 72 2.028 -11.233 6.026 544 HG22 THR 72 HG22 THR 72 3.716 -11.711 5.849 545 HG23 THR 72 HG23 THR 72 2.720 -12.444 7.106 546 H ASN 73 H ASN 73 3.807 -14.628 3.267 547 HA ASN 73 HA ASN 73 2.869 -15.618 0.812 548 HB2 ASN 73 HB2 ASN 73 5.082 -16.155 1.830 549 HB3 ASN 73 HB3 ASN 73 4.266 -17.142 3.031 550 HD21 ASN 73 HD21 ASN 73 5.399 -18.990 2.409 551 HD22 ASN 73 HD22 ASN 73 5.076 -19.810 0.925 552 H SER 74 H SER 74 1.477 -15.854 3.919 553 HA SER 74 HA SER 74 -0.056 -18.248 3.265 554 HB2 SER 74 HB2 SER 74 0.062 -16.668 5.834 555 HB3 SER 74 HB3 SER 74 -0.695 -18.248 5.604 556 HG SER 74 HG SER 74 1.386 -18.976 4.912 557 H GLY 75 H GLY 75 -0.416 -15.104 2.518 558 HA2 GLY 75 HA2 GLY 75 -2.265 -13.926 1.789 559 HA3 GLY 75 HA3 GLY 75 -3.248 -15.334 2.166 560 H GLN 76 H GLN 76 -1.190 -13.779 4.451 561 HA GLN 76 HA GLN 76 -3.543 -12.845 5.973 562 HB2 GLN 76 HB2 GLN 76 -2.214 -14.574 7.097 563 HB3 GLN 76 HB3 GLN 76 -0.761 -13.624 6.876 564 HG2 GLN 76 HG2 GLN 76 -1.899 -11.842 8.282 565 HG3 GLN 76 HG3 GLN 76 -3.083 -13.082 8.686 566 HE21 GLN 76 HE21 GLN 76 -2.422 -14.859 9.867 567 HE22 GLN 76 HE22 GLN 76 -0.974 -14.841 10.806 568 H VAL 77 H VAL 77 -3.482 -10.703 6.730 569 HA VAL 77 HA VAL 77 -1.823 -8.843 5.388 570 HB VAL 77 HB VAL 77 -3.775 -8.579 7.707 571 HG11 VAL 77 HG11 VAL 77 -2.123 -6.370 6.485 572 HG12 VAL 77 HG12 VAL 77 -1.987 -6.952 8.144 573 HG13 VAL 77 HG13 VAL 77 -3.461 -6.134 7.610 574 HG21 VAL 77 HG21 VAL 77 -5.012 -7.218 6.117 575 HG22 VAL 77 HG22 VAL 77 -4.670 -8.816 5.434 576 HG23 VAL 77 HG23 VAL 77 -3.710 -7.406 4.950 577 H VAL 78 H VAL 78 0.090 -8.059 5.891 578 HA VAL 78 HA VAL 78 1.806 -9.246 7.740 579 HB VAL 78 HB VAL 78 2.027 -6.447 6.581 580 HG11 VAL 78 HG11 VAL 78 4.440 -6.703 6.914 581 HG12 VAL 78 HG12 VAL 78 4.165 -8.276 7.654 582 HG13 VAL 78 HG13 VAL 78 3.563 -6.817 8.440 583 HG21 VAL 78 HG21 VAL 78 3.064 -9.063 5.494 584 HG22 VAL 78 HG22 VAL 78 3.397 -7.463 4.828 585 HG23 VAL 78 HG23 VAL 78 1.751 -8.095 4.819 586 H LYS 79 H LYS 79 2.173 -8.925 9.832 587 HA LYS 79 HA LYS 79 0.266 -7.730 11.425 588 HB2 LYS 79 HB2 LYS 79 1.697 -8.209 13.324 589 HB3 LYS 79 HB3 LYS 79 1.606 -9.538 12.180 590 HG2 LYS 79 HG2 LYS 79 3.721 -9.064 11.325 591 HG3 LYS 79 HG3 LYS 79 3.804 -7.551 12.241 592 HD2 LYS 79 HD2 LYS 79 5.145 -9.279 13.378 593 HD3 LYS 79 HD3 LYS 79 3.750 -8.840 14.358 594 HE2 LYS 79 HE2 LYS 79 2.575 -10.851 13.356 595 HE3 LYS 79 HE3 LYS 79 4.137 -11.297 12.667 596 HZ1 LYS 79 HZ1 LYS 79 3.724 -12.440 14.726 597 HZ2 LYS 79 HZ2 LYS 79 3.507 -10.974 15.532 598 HZ3 LYS 79 HZ3 LYS 79 5.033 -11.371 14.937 599 H SER 80 H SER 80 3.010 -6.182 10.058 600 HA SER 80 HA SER 80 2.682 -3.962 11.930 601 HB2 SER 80 HB2 SER 80 4.958 -4.945 11.697 602 HB3 SER 80 HB3 SER 80 4.953 -4.479 10.000 603 HG SER 80 HG SER 80 4.532 -2.296 10.862 604 H LEU 81 H LEU 81 1.191 -4.783 9.263 605 HA LEU 81 HA LEU 81 1.767 -2.749 7.417 606 HB2 LEU 81 HB2 LEU 81 0.704 -4.856 6.786 607 HB3 LEU 81 HB3 LEU 81 -0.746 -4.392 7.646 608 HG LEU 81 HG LEU 81 -0.935 -2.436 6.094 609 HD11 LEU 81 HD11 LEU 81 0.321 -2.481 4.050 610 HD12 LEU 81 HD12 LEU 81 1.154 -3.940 4.578 611 HD13 LEU 81 HD13 LEU 81 1.432 -2.408 5.423 612 HD21 LEU 81 HD21 LEU 81 -1.783 -3.768 4.235 613 HD22 LEU 81 HD22 LEU 81 -2.253 -4.435 5.798 614 HD23 LEU 81 HD23 LEU 81 -0.940 -5.182 4.879 615 HA PRO 82 HA PRO 82 -2.339 -0.519 8.915 616 HB2 PRO 82 HB2 PRO 82 -2.862 -0.922 11.620 617 HB3 PRO 82 HB3 PRO 82 -3.776 -1.625 10.287 618 HG2 PRO 82 HG2 PRO 82 -1.657 -2.833 11.983 619 HG3 PRO 82 HG3 PRO 82 -3.074 -3.586 11.244 620 HD2 PRO 82 HD2 PRO 82 -0.585 -3.923 10.256 621 HD3 PRO 82 HD3 PRO 82 -2.030 -3.882 9.218 622 H GLY 83 H GLY 83 0.250 -1.147 11.220 623 HA2 GLY 83 HA2 GLY 83 0.227 1.322 12.548 624 HA3 GLY 83 HA3 GLY 83 1.613 0.247 12.410 625 H LEU 84 H LEU 84 2.031 0.289 9.658 626 HA LEU 84 HA LEU 84 3.411 2.768 9.458 627 HB2 LEU 84 HB2 LEU 84 4.336 2.003 7.399 628 HB3 LEU 84 HB3 LEU 84 4.261 0.624 8.464 629 HG LEU 84 HG LEU 84 1.965 0.266 7.098 630 HD11 LEU 84 HD11 LEU 84 2.211 2.215 5.682 631 HD12 LEU 84 HD12 LEU 84 2.305 0.755 4.725 632 HD13 LEU 84 HD13 LEU 84 3.773 1.638 5.116 633 HD21 LEU 84 HD21 LEU 84 3.226 -1.323 5.679 634 HD22 LEU 84 HD22 LEU 84 3.720 -1.409 7.371 635 HD23 LEU 84 HD23 LEU 84 4.727 -0.563 6.199 636 H LEU 85 H LEU 85 0.507 1.477 8.059 637 HA LEU 85 HA LEU 85 0.020 3.535 6.208 638 HB2 LEU 85 HB2 LEU 85 -1.916 1.691 7.593 639 HB3 LEU 85 HB3 LEU 85 -2.299 2.683 6.202 640 HG LEU 85 HG LEU 85 -0.260 0.456 6.217 641 HD11 LEU 85 HD11 LEU 85 -1.911 -0.752 4.860 642 HD12 LEU 85 HD12 LEU 85 -3.080 0.537 5.165 643 HD13 LEU 85 HD13 LEU 85 -2.473 -0.440 6.498 644 HD21 LEU 85 HD21 LEU 85 0.238 2.186 4.579 645 HD22 LEU 85 HD22 LEU 85 -1.411 2.094 3.962 646 HD23 LEU 85 HD23 LEU 85 -0.325 0.717 3.785 647 H THR 86 H THR 86 -0.937 3.081 9.523 648 HA THR 86 HA THR 86 -2.723 5.271 9.649 649 HB THR 86 HB THR 86 -1.225 3.950 11.936 650 HG1 THR 86 HG1 THR 86 -2.462 2.464 10.862 651 HG21 THR 86 HG21 THR 86 -3.071 4.786 13.342 652 HG22 THR 86 HG22 THR 86 -3.768 5.606 11.945 653 HG23 THR 86 HG23 THR 86 -2.210 6.125 12.585 654 H ILE 87 H ILE 87 0.740 5.064 10.509 655 HA ILE 87 HA ILE 87 0.848 7.732 11.424 656 HB ILE 87 HB ILE 87 2.520 6.213 12.240 657 HG12 ILE 87 HG12 ILE 87 3.251 8.647 11.789 658 HG13 ILE 87 HG13 ILE 87 4.501 7.478 12.162 659 HG21 ILE 87 HG21 ILE 87 4.281 5.188 10.879 660 HG22 ILE 87 HG22 ILE 87 3.461 5.782 9.432 661 HG23 ILE 87 HG23 ILE 87 2.655 4.629 10.486 662 HD11 ILE 87 HD11 ILE 87 3.791 8.504 9.409 663 HD12 ILE 87 HD12 ILE 87 5.070 7.348 9.759 664 HD13 ILE 87 HD13 ILE 87 5.181 9.003 10.368 665 H LEU 88 H LEU 88 1.553 6.308 8.302 666 HA LEU 88 HA LEU 88 2.465 8.687 7.087 667 HB2 LEU 88 HB2 LEU 88 1.321 6.149 6.012 668 HB3 LEU 88 HB3 LEU 88 1.862 7.450 4.974 669 HG LEU 88 HG LEU 88 3.773 6.164 6.952 670 HD11 LEU 88 HD11 LEU 88 3.495 5.354 4.131 671 HD12 LEU 88 HD12 LEU 88 2.614 4.576 5.443 672 HD13 LEU 88 HD13 LEU 88 4.359 4.579 5.486 673 HD21 LEU 88 HD21 LEU 88 4.153 7.636 4.357 674 HD22 LEU 88 HD22 LEU 88 5.408 7.102 5.476 675 HD23 LEU 88 HD23 LEU 88 4.296 8.385 5.947 676 H HIS 89 H HIS 89 -0.738 7.232 7.371 677 HA HIS 89 HA HIS 89 -2.064 9.008 5.651 678 HB2 HIS 89 HB2 HIS 89 -3.066 6.881 6.461 679 HB3 HIS 89 HB3 HIS 89 -3.188 7.568 8.075 680 HD1 HIS 89 HD1 HIS 89 -5.537 8.324 8.558 681 HD2 HIS 89 HD2 HIS 89 -4.525 8.729 4.543 682 HE1 HIS 89 HE1 HIS 89 -7.572 9.274 7.398 683 H ASP 90 H ASP 90 -1.400 9.134 9.113 684 HA ASP 90 HA ASP 90 -2.767 11.592 9.563 685 HB2 ASP 90 HB2 ASP 90 -2.276 10.037 11.403 686 HB3 ASP 90 HB3 ASP 90 -0.551 10.319 11.180 687 H GLY 91 H GLY 91 0.404 10.756 8.483 688 HA2 GLY 91 HA2 GLY 91 1.561 13.345 8.888 689 HA3 GLY 91 HA3 GLY 91 2.266 12.009 7.995 690 H GLY 92 H GLY 92 -0.695 12.308 6.718 691 HA2 GLY 92 HA2 GLY 92 -1.668 13.714 5.118 692 HA3 GLY 92 HA3 GLY 92 -0.185 14.654 5.065 693 H TYR 93 H TYR 93 0.001 11.220 4.810 694 HA TYR 93 HA TYR 93 0.697 11.586 2.010 695 HB2 TYR 93 HB2 TYR 93 1.487 9.417 3.965 696 HB3 TYR 93 HB3 TYR 93 1.857 9.354 2.250 697 HD1 TYR 93 HD1 TYR 93 3.506 10.833 1.275 698 HD2 TYR 93 HD2 TYR 93 2.636 11.013 5.428 699 HE1 TYR 93 HE1 TYR 93 5.523 12.178 1.627 700 HE2 TYR 93 HE2 TYR 93 4.648 12.364 5.797 701 HH TYR 93 HH TYR 93 6.853 12.804 4.688 702 H ARG 94 H ARG 94 -0.117 10.343 0.450 703 HA ARG 94 HA ARG 94 -2.629 8.983 1.056 704 HB2 ARG 94 HB2 ARG 94 -3.112 9.101 -1.356 705 HB3 ARG 94 HB3 ARG 94 -2.756 10.699 -0.715 706 HG2 ARG 94 HG2 ARG 94 -0.616 10.711 -1.685 707 HG3 ARG 94 HG3 ARG 94 -0.716 8.998 -2.130 708 HD2 ARG 94 HD2 ARG 94 -2.552 9.589 -3.676 709 HD3 ARG 94 HD3 ARG 94 -2.347 11.286 -3.232 710 HE ARG 94 HE ARG 94 0.144 10.545 -4.009 711 HH11 ARG 94 HH11 ARG 94 -3.011 10.269 -5.612 712 HH12 ARG 94 HH12 ARG 94 -2.377 10.448 -7.183 713 HH21 ARG 94 HH21 ARG 94 1.004 10.794 -6.160 714 HH22 ARG 94 HH22 ARG 94 -0.053 10.759 -7.492 715 H ASP 95 H ASP 95 -3.026 7.100 -0.560 716 HA ASP 95 HA ASP 95 -1.610 4.872 0.246 717 HB2 ASP 95 HB2 ASP 95 -2.847 3.776 -1.619 718 HB3 ASP 95 HB3 ASP 95 -3.877 4.820 -0.641 719 H THR 96 H THR 96 -1.383 6.707 -2.730 720 HA THR 96 HA THR 96 0.425 5.138 -4.103 721 HB THR 96 HB THR 96 -0.032 8.120 -4.302 722 HG1 THR 96 HG1 THR 96 -1.776 6.120 -4.650 723 HG21 THR 96 HG21 THR 96 1.926 7.286 -5.570 724 HG22 THR 96 HG22 THR 96 0.637 7.835 -6.649 725 HG23 THR 96 HG23 THR 96 0.888 6.110 -6.368 726 H GLU 97 H GLU 97 0.906 7.803 -1.817 727 HA GLU 97 HA GLU 97 3.700 8.034 -2.257 728 HB2 GLU 97 HB2 GLU 97 2.252 8.811 0.264 729 HB3 GLU 97 HB3 GLU 97 3.820 9.383 -0.279 730 HG2 GLU 97 HG2 GLU 97 1.114 10.025 -1.329 731 HG3 GLU 97 HG3 GLU 97 2.310 11.132 -0.665 732 H ILE 98 H ILE 98 1.700 6.050 -0.196 733 HA ILE 98 HA ILE 98 3.603 5.247 1.740 734 HB ILE 98 HB ILE 98 1.548 3.385 0.556 735 HG12 ILE 98 HG12 ILE 98 0.217 5.302 1.006 736 HG13 ILE 98 HG13 ILE 98 -0.024 4.141 2.319 737 HG21 ILE 98 HG21 ILE 98 3.044 2.370 2.103 738 HG22 ILE 98 HG22 ILE 98 1.424 2.451 2.790 739 HG23 ILE 98 HG23 ILE 98 2.664 3.590 3.317 740 HD11 ILE 98 HD11 ILE 98 0.073 6.442 3.112 741 HD12 ILE 98 HD12 ILE 98 1.710 6.584 2.474 742 HD13 ILE 98 HD13 ILE 98 1.366 5.443 3.776 743 H MET 99 H MET 99 2.546 3.805 -1.322 744 HA MET 99 HA MET 99 4.598 1.833 -1.217 745 HB2 MET 99 HB2 MET 99 3.812 1.081 -3.433 746 HB3 MET 99 HB3 MET 99 2.556 1.159 -2.210 747 HG2 MET 99 HG2 MET 99 1.644 3.121 -3.190 748 HG3 MET 99 HG3 MET 99 2.995 3.248 -4.318 749 HE1 MET 99 HE1 MET 99 -0.024 0.997 -3.185 750 HE2 MET 99 HE2 MET 99 1.307 -0.158 -3.253 751 HE3 MET 99 HE3 MET 99 -0.015 -0.265 -4.414 752 H ARG 100 H ARG 100 4.530 5.000 -2.290 753 HA ARG 100 HA ARG 100 6.184 5.002 -4.519 754 HB2 ARG 100 HB2 ARG 100 4.922 6.930 -3.716 755 HB3 ARG 100 HB3 ARG 100 5.943 7.015 -2.295 756 HG2 ARG 100 HG2 ARG 100 7.850 7.582 -3.697 757 HG3 ARG 100 HG3 ARG 100 6.826 7.475 -5.135 758 HD2 ARG 100 HD2 ARG 100 5.403 9.239 -4.274 759 HD3 ARG 100 HD3 ARG 100 6.374 9.331 -2.810 760 HE ARG 100 HE ARG 100 8.051 9.689 -4.973 761 HH11 ARG 100 HH11 ARG 100 5.273 11.379 -3.477 762 HH12 ARG 100 HH12 ARG 100 5.859 12.924 -3.874 763 HH21 ARG 100 HH21 ARG 100 8.826 11.836 -5.519 764 HH22 ARG 100 HH22 ARG 100 7.903 13.190 -5.064 765 H TRP 101 H TRP 101 7.226 5.855 -1.225 766 HA TRP 101 HA TRP 101 9.933 5.377 -1.894 767 HB2 TRP 101 HB2 TRP 101 10.361 5.710 0.605 768 HB3 TRP 101 HB3 TRP 101 9.656 7.059 -0.271 769 HD1 TRP 101 HD1 TRP 101 7.319 7.922 0.523 770 HE1 TRP 101 HE1 TRP 101 5.785 7.307 2.525 771 HE3 TRP 101 HE3 TRP 101 9.606 3.618 2.136 772 HZ2 TRP 101 HZ2 TRP 101 5.608 5.389 4.412 773 HZ3 TRP 101 HZ3 TRP 101 8.662 2.459 4.038 774 HH2 TRP 101 HH2 TRP 101 6.675 3.339 5.185 775 H LEU 102 H LEU 102 7.479 3.414 -0.470 776 HA LEU 102 HA LEU 102 9.057 1.431 0.689 777 HB2 LEU 102 HB2 LEU 102 6.309 1.745 -0.121 778 HB3 LEU 102 HB3 LEU 102 6.803 0.055 -0.133 779 HG LEU 102 HG LEU 102 6.947 1.974 2.207 780 HD11 LEU 102 HD11 LEU 102 5.062 -0.312 1.657 781 HD12 LEU 102 HD12 LEU 102 4.686 1.408 1.513 782 HD13 LEU 102 HD13 LEU 102 5.097 0.728 3.094 783 HD21 LEU 102 HD21 LEU 102 7.378 -0.998 2.062 784 HD22 LEU 102 HD22 LEU 102 7.420 0.002 3.516 785 HD23 LEU 102 HD23 LEU 102 8.631 0.226 2.247 786 H PHE 103 H PHE 103 7.936 1.713 -2.652 787 HA PHE 103 HA PHE 103 9.184 -0.806 -3.274 788 HB2 PHE 103 HB2 PHE 103 7.616 1.149 -4.928 789 HB3 PHE 103 HB3 PHE 103 8.506 -0.169 -5.677 790 HD1 PHE 103 HD1 PHE 103 5.983 0.433 -2.989 791 HD2 PHE 103 HD2 PHE 103 7.445 -2.185 -5.994 792 HE1 PHE 103 HE1 PHE 103 4.083 -1.071 -2.594 793 HE2 PHE 103 HE2 PHE 103 5.538 -3.692 -5.601 794 HZ PHE 103 HZ PHE 103 3.863 -3.132 -3.901 795 H THR 104 H THR 104 10.378 2.200 -2.830 796 HA THR 104 HA THR 104 12.329 2.059 -4.958 797 HB THR 104 HB THR 104 12.103 4.015 -2.643 798 HG1 THR 104 HG1 THR 104 10.483 3.818 -4.584 799 HG21 THR 104 HG21 THR 104 13.633 5.417 -3.981 800 HG22 THR 104 HG22 THR 104 13.743 4.139 -5.188 801 HG23 THR 104 HG23 THR 104 14.382 3.878 -3.568 802 HA PRO 105 HA PRO 105 14.951 -0.547 -2.345 803 HB2 PRO 105 HB2 PRO 105 16.972 0.255 -4.370 804 HB3 PRO 105 HB3 PRO 105 16.507 -1.362 -3.835 805 HG2 PRO 105 HG2 PRO 105 15.764 -0.456 -6.224 806 HG3 PRO 105 HG3 PRO 105 14.665 -1.441 -5.240 807 HD2 PRO 105 HD2 PRO 105 14.668 1.515 -5.687 808 HD3 PRO 105 HD3 PRO 105 13.301 0.382 -5.576 809 H ASP 106 H ASP 106 16.052 0.105 -0.614 810 HA ASP 106 HA ASP 106 16.978 2.865 -0.551 811 HB2 ASP 106 HB2 ASP 106 15.444 2.198 1.236 812 HB3 ASP 106 HB3 ASP 106 16.563 0.909 1.698 813 HA PRO 107 HA PRO 107 21.212 1.532 -1.081 814 HB2 PRO 107 HB2 PRO 107 21.713 4.114 0.289 815 HB3 PRO 107 HB3 PRO 107 22.367 3.512 -1.235 816 HG2 PRO 107 HG2 PRO 107 20.478 5.388 -1.177 817 HG3 PRO 107 HG3 PRO 107 20.488 4.132 -2.433 818 HD2 PRO 107 HD2 PRO 107 18.738 4.434 -0.047 819 HD3 PRO 107 HD3 PRO 107 18.384 3.770 -1.655 820 H SER 108 H SER 108 19.996 2.873 1.962 821 HA SER 108 HA SER 108 22.264 1.731 3.345 822 HB2 SER 108 HB2 SER 108 21.227 2.891 5.375 823 HB3 SER 108 HB3 SER 108 21.851 3.918 4.088 824 HG SER 108 HG SER 108 19.148 3.205 3.883 825 H LEU 109 H LEU 109 19.534 0.417 2.303 826 HA LEU 109 HA LEU 109 19.036 -1.065 4.757 827 HB2 LEU 109 HB2 LEU 109 17.109 -0.046 3.613 828 HB3 LEU 109 HB3 LEU 109 17.468 -1.006 2.189 829 HG LEU 109 HG LEU 109 17.066 -3.057 3.549 830 HD11 LEU 109 HD11 LEU 109 15.832 -2.831 5.655 831 HD12 LEU 109 HD12 LEU 109 16.072 -1.085 5.600 832 HD13 LEU 109 HD13 LEU 109 17.460 -2.163 5.765 833 HD21 LEU 109 HD21 LEU 109 14.632 -2.844 3.526 834 HD22 LEU 109 HD22 LEU 109 15.363 -2.163 2.073 835 HD23 LEU 109 HD23 LEU 109 14.789 -1.096 3.359 836 H THR 110 H THR 110 19.702 -3.052 4.957 837 HA THR 110 HA THR 110 20.286 -4.656 2.597 838 HB THR 110 HB THR 110 21.916 -4.626 5.161 839 HG1 THR 110 HG1 THR 110 21.994 -2.843 3.354 840 HG21 THR 110 HG21 THR 110 22.378 -6.002 2.501 841 HG22 THR 110 HG22 THR 110 21.881 -6.783 4.002 842 HG23 THR 110 HG23 THR 110 23.479 -6.044 3.882 843 H ILE 111 H ILE 111 18.895 -6.316 2.686 844 HA ILE 111 HA ILE 111 18.092 -7.304 5.327 845 HB ILE 111 HB ILE 111 15.789 -7.676 4.372 846 HG12 ILE 111 HG12 ILE 111 16.740 -5.582 2.402 847 HG13 ILE 111 HG13 ILE 111 16.339 -7.247 2.016 848 HG21 ILE 111 HG21 ILE 111 15.045 -5.434 4.996 849 HG22 ILE 111 HG22 ILE 111 16.736 -4.896 4.963 850 HG23 ILE 111 HG23 ILE 111 16.221 -6.144 6.103 851 HD11 ILE 111 HD11 ILE 111 14.012 -6.805 2.675 852 HD12 ILE 111 HD12 ILE 111 14.560 -5.765 1.360 853 HD13 ILE 111 HD13 ILE 111 14.455 -5.124 2.992 854 H THR 112 H THR 112 17.748 -9.368 5.510 855 HA THR 112 HA THR 112 18.361 -11.059 3.249 856 HB THR 112 HB THR 112 19.562 -11.588 5.247 857 HG1 THR 112 HG1 THR 112 19.300 -13.607 4.925 858 HG21 THR 112 HG21 THR 112 18.024 -10.550 6.888 859 HG22 THR 112 HG22 THR 112 18.484 -12.186 7.384 860 HG23 THR 112 HG23 THR 112 16.907 -11.879 6.657 861 H ARG 113 H ARG 113 16.969 -12.370 2.372 862 HA ARG 113 HA ARG 113 14.169 -11.810 2.861 863 HB2 ARG 113 HB2 ARG 113 15.615 -13.129 0.640 864 HB3 ARG 113 HB3 ARG 113 13.957 -13.629 0.932 865 HG2 ARG 113 HG2 ARG 113 14.806 -10.788 0.549 866 HG3 ARG 113 HG3 ARG 113 14.220 -11.835 -0.767 867 HD2 ARG 113 HD2 ARG 113 12.699 -10.938 1.701 868 HD3 ARG 113 HD3 ARG 113 12.429 -10.405 0.047 869 HE ARG 113 HE ARG 113 12.146 -13.257 0.541 870 HH11 ARG 113 HH11 ARG 113 10.467 -10.198 -0.221 871 HH12 ARG 113 HH12 ARG 113 8.927 -10.941 -0.222 872 HH21 ARG 113 HH21 ARG 113 9.997 -14.202 0.460 873 HH22 ARG 113 HH22 ARG 113 8.659 -13.190 0.144 874 H ASP 114 H ASP 114 12.619 -13.332 3.138 875 HA ASP 114 HA ASP 114 13.508 -15.409 4.939 876 HB2 ASP 114 HB2 ASP 114 11.163 -15.697 5.524 877 HB3 ASP 114 HB3 ASP 114 11.552 -13.987 5.528 878 H GLY 115 H GLY 115 13.225 -17.576 4.592 879 HA2 GLY 115 HA2 GLY 115 12.887 -19.488 3.307 880 HA3 GLY 115 HA3 GLY 115 12.292 -18.472 1.992 881 H SER 116 H SER 116 15.090 -17.216 3.284 882 HA SER 116 HA SER 116 16.934 -18.666 1.645 883 HB2 SER 116 HB2 SER 116 15.826 -16.949 0.143 884 HB3 SER 116 HB3 SER 116 16.407 -15.697 1.237 885 HG SER 116 HG SER 116 17.663 -16.364 -0.754 886 H ARG 117 H ARG 117 19.075 -17.024 1.950 887 HA ARG 117 HA ARG 117 19.055 -16.170 4.743 888 HB2 ARG 117 HB2 ARG 117 21.310 -17.094 5.035 889 HB3 ARG 117 HB3 ARG 117 20.060 -18.323 4.863 890 HG2 ARG 117 HG2 ARG 117 20.803 -18.907 2.723 891 HG3 ARG 117 HG3 ARG 117 21.707 -17.402 2.546 892 HD2 ARG 117 HD2 ARG 117 23.189 -19.299 2.930 893 HD3 ARG 117 HD3 ARG 117 23.261 -18.093 4.216 894 HE ARG 117 HE ARG 117 21.454 -20.190 4.832 895 HH11 ARG 117 HH11 ARG 117 24.905 -19.418 4.635 896 HH12 ARG 117 HH12 ARG 117 25.371 -20.453 5.890 897 HH21 ARG 117 HH21 ARG 117 22.097 -21.672 6.584 898 HH22 ARG 117 HH22 ARG 117 23.744 -21.778 7.002 899 H ASP 118 H ASP 118 20.207 -15.660 1.494 900 HA ASP 118 HA ASP 118 22.382 -13.986 2.216 901 HB2 ASP 118 HB2 ASP 118 22.294 -15.150 0.037 902 HB3 ASP 118 HB3 ASP 118 20.950 -14.104 -0.440 903 H ALA 119 H ALA 119 22.591 -11.878 2.221 904 HA ALA 119 HA ALA 119 20.151 -10.370 2.697 905 HB1 ALA 119 HB1 ALA 119 21.906 -10.365 4.432 906 HB2 ALA 119 HB2 ALA 119 21.550 -8.761 3.810 907 HB3 ALA 119 HB3 ALA 119 23.010 -9.601 3.283 908 H VAL 120 H VAL 120 19.458 -8.889 1.368 909 HA VAL 120 HA VAL 120 20.960 -8.348 -1.060 910 HB VAL 120 HB VAL 120 18.140 -7.509 -0.358 911 HG11 VAL 120 HG11 VAL 120 17.845 -7.235 -2.771 912 HG12 VAL 120 HG12 VAL 120 19.526 -7.705 -3.026 913 HG13 VAL 120 HG13 VAL 120 19.151 -6.219 -2.155 914 HG21 VAL 120 HG21 VAL 120 17.339 -9.411 -1.686 915 HG22 VAL 120 HG22 VAL 120 18.276 -9.952 -0.295 916 HG23 VAL 120 HG23 VAL 120 18.996 -9.965 -1.906 917 H SER 121 H SER 121 22.175 -6.596 -1.069 918 HA SER 121 HA SER 121 21.688 -4.368 0.727 919 HB2 SER 121 HB2 SER 121 23.708 -4.634 -1.523 920 HB3 SER 121 HB3 SER 121 23.731 -3.446 -0.224 921 HG SER 121 HG SER 121 25.023 -5.579 -0.191 922 H ASN 122 H ASN 122 20.657 -2.524 0.160 923 HA ASN 122 HA ASN 122 19.515 -1.016 -0.998 924 HB2 ASN 122 HB2 ASN 122 21.557 -0.770 -2.411 925 HB3 ASN 122 HB3 ASN 122 20.995 -2.069 -3.442 926 HD21 ASN 122 HD21 ASN 122 19.374 -1.645 -4.916 927 HD22 ASN 122 HD22 ASN 122 18.884 -0.059 -5.358 928 H ALA 123 H ALA 123 17.997 -2.610 -0.238 929 HA ALA 123 HA ALA 123 16.457 -3.782 -2.449 930 HB1 ALA 123 HB1 ALA 123 15.540 -5.329 -0.761 931 HB2 ALA 123 HB2 ALA 123 16.578 -4.586 0.454 932 HB3 ALA 123 HB3 ALA 123 17.293 -5.463 -0.896 933 H ARG 124 H ARG 124 14.102 -3.775 -1.999 934 HA ARG 124 HA ARG 124 13.371 -1.130 -1.113 935 HB2 ARG 124 HB2 ARG 124 11.127 -1.649 -1.996 936 HB3 ARG 124 HB3 ARG 124 12.371 -1.983 -3.185 937 HG2 ARG 124 HG2 ARG 124 12.239 -4.375 -2.583 938 HG3 ARG 124 HG3 ARG 124 10.918 -3.991 -1.490 939 HD2 ARG 124 HD2 ARG 124 9.604 -3.158 -3.374 940 HD3 ARG 124 HD3 ARG 124 10.937 -3.535 -4.468 941 HE ARG 124 HE ARG 124 10.211 -5.780 -2.933 942 HH11 ARG 124 HH11 ARG 124 9.268 -3.957 -5.873 943 HH12 ARG 124 HH12 ARG 124 8.374 -5.245 -6.523 944 HH21 ARG 124 HH21 ARG 124 8.957 -7.510 -3.914 945 HH22 ARG 124 HH22 ARG 124 8.165 -7.265 -5.419 946 HA PRO 125 HA PRO 125 12.406 -2.268 3.036 947 HB2 PRO 125 HB2 PRO 125 10.281 -0.211 2.979 948 HB3 PRO 125 HB3 PRO 125 11.678 -0.356 4.029 949 HG2 PRO 125 HG2 PRO 125 11.582 1.479 2.062 950 HG3 PRO 125 HG3 PRO 125 13.090 0.708 2.574 951 HD2 PRO 125 HD2 PRO 125 11.444 0.221 0.142 952 HD3 PRO 125 HD3 PRO 125 13.205 0.143 0.372 953 H VAL 126 H VAL 126 10.000 -2.378 0.574 954 HA VAL 126 HA VAL 126 7.805 -3.442 1.989 955 HB VAL 126 HB VAL 126 8.688 -4.110 -0.846 956 HG11 VAL 126 HG11 VAL 126 6.016 -4.505 0.486 957 HG12 VAL 126 HG12 VAL 126 7.142 -5.779 0.010 958 HG13 VAL 126 HG13 VAL 126 6.373 -4.773 -1.220 959 HG21 VAL 126 HG21 VAL 126 7.019 -2.480 -1.537 960 HG22 VAL 126 HG22 VAL 126 8.254 -1.740 -0.521 961 HG23 VAL 126 HG23 VAL 126 6.666 -2.125 0.151 962 H ASP 127 H ASP 127 10.663 -4.996 0.631 963 HA ASP 127 HA ASP 127 9.805 -7.612 1.310 964 HB2 ASP 127 HB2 ASP 127 12.467 -6.498 0.459 965 HB3 ASP 127 HB3 ASP 127 12.296 -8.178 0.952 966 H ALA 128 H ALA 128 11.472 -5.122 2.968 967 HA ALA 128 HA ALA 128 12.643 -6.656 5.038 968 HB1 ALA 128 HB1 ALA 128 12.941 -4.561 6.216 969 HB2 ALA 128 HB2 ALA 128 11.777 -3.775 5.155 970 HB3 ALA 128 HB3 ALA 128 13.313 -4.327 4.505 971 H LEU 129 H LEU 129 9.493 -5.101 4.711 972 HA LEU 129 HA LEU 129 8.738 -5.638 7.399 973 HB2 LEU 129 HB2 LEU 129 6.465 -4.988 6.741 974 HB3 LEU 129 HB3 LEU 129 7.658 -3.813 6.250 975 HG LEU 129 HG LEU 129 7.525 -5.140 3.997 976 HD11 LEU 129 HD11 LEU 129 4.793 -5.621 5.127 977 HD12 LEU 129 HD12 LEU 129 6.042 -6.824 4.842 978 HD13 LEU 129 HD13 LEU 129 5.317 -5.970 3.467 979 HD21 LEU 129 HD21 LEU 129 7.053 -2.773 4.208 980 HD22 LEU 129 HD22 LEU 129 5.464 -3.119 4.887 981 HD23 LEU 129 HD23 LEU 129 5.813 -3.532 3.210 982 H HIS 130 H HIS 130 8.430 -7.464 4.453 983 HA HIS 130 HA HIS 130 6.760 -9.488 5.617 984 HB2 HIS 130 HB2 HIS 130 6.951 -9.062 3.130 985 HB3 HIS 130 HB3 HIS 130 8.572 -9.745 3.195 986 HD1 HIS 130 HD1 HIS 130 8.738 -12.404 3.152 987 HD2 HIS 130 HD2 HIS 130 4.873 -10.899 3.629 988 HE1 HIS 130 HE1 HIS 130 7.210 -14.322 2.857 989 H ALA 131 H ALA 131 10.050 -8.739 5.511 990 HA ALA 131 HA ALA 131 10.995 -11.363 6.334 991 HB1 ALA 131 HB1 ALA 131 12.516 -8.765 6.112 992 HB2 ALA 131 HB2 ALA 131 12.370 -9.976 4.843 993 HB3 ALA 131 HB3 ALA 131 13.223 -10.364 6.338 994 H HIS 132 H HIS 132 9.320 -9.203 7.908 995 HA HIS 132 HA HIS 132 8.862 -8.655 10.041 996 HB2 HIS 132 HB2 HIS 132 10.689 -10.987 10.661 997 HB3 HIS 132 HB3 HIS 132 9.756 -10.139 11.886 998 HD1 HIS 132 HD1 HIS 132 9.524 -12.921 9.530 999 HD2 HIS 132 HD2 HIS 132 6.872 -10.334 11.398 1000 HE1 HIS 132 HE1 HIS 132 7.274 -14.008 9.376 1001 H GLN 133 H GLN 133 11.053 -7.442 8.644 1002 HA GLN 133 HA GLN 133 12.577 -6.357 10.903 1003 HB2 GLN 133 HB2 GLN 133 13.167 -6.231 7.933 1004 HB3 GLN 133 HB3 GLN 133 14.167 -5.538 9.201 1005 HG2 GLN 133 HG2 GLN 133 14.460 -7.832 10.120 1006 HG3 GLN 133 HG3 GLN 133 13.620 -8.444 8.696 1007 HE21 GLN 133 HE21 GLN 133 15.402 -9.585 8.021 1008 HE22 GLN 133 HE22 GLN 133 16.809 -8.792 7.384 1009 H ALA 134 H ALA 134 9.896 -5.947 10.078 1010 HA ALA 134 HA ALA 134 9.302 -3.718 8.580 1011 HB1 ALA 134 HB1 ALA 134 7.789 -4.707 10.968 1012 HB2 ALA 134 HB2 ALA 134 7.681 -5.382 9.341 1013 HB3 ALA 134 HB3 ALA 134 7.163 -3.723 9.646 1014 H ARG 135 H ARG 135 10.482 -3.841 11.879 1015 HA ARG 135 HA ARG 135 9.722 -1.359 12.818 1016 HB2 ARG 135 HB2 ARG 135 10.907 -3.288 14.000 1017 HB3 ARG 135 HB3 ARG 135 12.389 -2.681 13.277 1018 HG2 ARG 135 HG2 ARG 135 10.659 -0.980 15.048 1019 HG3 ARG 135 HG3 ARG 135 11.880 -2.092 15.668 1020 HD2 ARG 135 HD2 ARG 135 13.633 -0.875 14.638 1021 HD3 ARG 135 HD3 ARG 135 12.503 0.064 13.663 1022 HE ARG 135 HE ARG 135 11.782 0.627 16.202 1023 HH11 ARG 135 HH11 ARG 135 14.979 0.710 14.698 1024 HH12 ARG 135 HH12 ARG 135 15.424 2.195 15.422 1025 HH21 ARG 135 HH21 ARG 135 12.410 2.627 17.175 1026 HH22 ARG 135 HH22 ARG 135 13.947 3.322 16.833 1027 H GLU 136 H GLU 136 12.352 -2.264 10.635 1028 HA GLU 136 HA GLU 136 13.662 0.248 10.522 1029 HB2 GLU 136 HB2 GLU 136 13.506 -2.036 8.552 1030 HB3 GLU 136 HB3 GLU 136 14.568 -0.648 8.346 1031 HG2 GLU 136 HG2 GLU 136 14.657 -2.583 10.651 1032 HG3 GLU 136 HG3 GLU 136 15.709 -2.639 9.234 1033 H VAL 137 H VAL 137 11.042 -1.217 8.802 1034 HA VAL 137 HA VAL 137 10.763 0.731 6.745 1035 HB VAL 137 HB VAL 137 8.691 -1.190 7.827 1036 HG11 VAL 137 HG11 VAL 137 8.884 0.181 5.154 1037 HG12 VAL 137 HG12 VAL 137 7.727 0.546 6.432 1038 HG13 VAL 137 HG13 VAL 137 7.669 -1.016 5.609 1039 HG21 VAL 137 HG21 VAL 137 10.684 -2.403 7.194 1040 HG22 VAL 137 HG22 VAL 137 10.713 -1.586 5.632 1041 HG23 VAL 137 HG23 VAL 137 9.403 -2.698 6.016 1042 H VAL 138 H VAL 138 9.117 0.078 9.780 1043 HA VAL 138 HA VAL 138 7.272 2.177 9.683 1044 HB VAL 138 HB VAL 138 8.452 0.854 12.150 1045 HG11 VAL 138 HG11 VAL 138 5.941 2.510 11.855 1046 HG12 VAL 138 HG12 VAL 138 7.410 2.999 12.695 1047 HG13 VAL 138 HG13 VAL 138 6.440 1.658 13.318 1048 HG21 VAL 138 HG21 VAL 138 5.906 0.291 10.631 1049 HG22 VAL 138 HG22 VAL 138 6.394 -0.493 12.132 1050 HG23 VAL 138 HG23 VAL 138 7.343 -0.732 10.664 1051 H ARG 139 H ARG 139 10.498 2.025 11.205 1052 HA ARG 139 HA ARG 139 10.325 4.671 12.102 1053 HB2 ARG 139 HB2 ARG 139 12.681 4.605 12.654 1054 HB3 ARG 139 HB3 ARG 139 11.960 3.051 13.021 1055 HG2 ARG 139 HG2 ARG 139 12.994 2.013 11.198 1056 HG3 ARG 139 HG3 ARG 139 13.525 3.560 10.524 1057 HD2 ARG 139 HD2 ARG 139 14.948 3.940 12.460 1058 HD3 ARG 139 HD3 ARG 139 14.367 2.458 13.198 1059 HE ARG 139 HE ARG 139 15.511 1.219 11.502 1060 HH11 ARG 139 HH11 ARG 139 16.402 4.667 11.584 1061 HH12 ARG 139 HH12 ARG 139 17.990 4.373 11.028 1062 HH21 ARG 139 HH21 ARG 139 17.598 0.864 10.743 1063 HH22 ARG 139 HH22 ARG 139 18.713 2.150 10.529 1064 H ARG 140 H ARG 140 11.465 3.329 9.062 1065 HA ARG 140 HA ARG 140 12.526 5.720 8.033 1066 HB2 ARG 140 HB2 ARG 140 12.776 3.362 7.063 1067 HB3 ARG 140 HB3 ARG 140 11.164 3.568 6.398 1068 HG2 ARG 140 HG2 ARG 140 12.799 4.048 4.691 1069 HG3 ARG 140 HG3 ARG 140 11.978 5.547 5.143 1070 HD2 ARG 140 HD2 ARG 140 13.847 6.147 6.599 1071 HD3 ARG 140 HD3 ARG 140 14.641 4.625 6.195 1072 HE ARG 140 HE ARG 140 14.063 6.221 3.911 1073 HH11 ARG 140 HH11 ARG 140 16.367 5.699 6.522 1074 HH12 ARG 140 HH12 ARG 140 17.655 6.507 5.752 1075 HH21 ARG 140 HH21 ARG 140 15.841 7.287 2.834 1076 HH22 ARG 140 HH22 ARG 140 17.359 7.412 3.603 1077 H ALA 141 H ALA 141 9.281 4.308 7.963 1078 HA ALA 141 HA ALA 141 7.985 6.199 6.383 1079 HB1 ALA 141 HB1 ALA 141 5.921 5.389 7.417 1080 HB2 ALA 141 HB2 ALA 141 6.854 4.639 8.708 1081 HB3 ALA 141 HB3 ALA 141 7.001 4.037 7.060 1082 H GLN 142 H GLN 142 8.475 5.997 9.864 1083 HA GLN 142 HA GLN 142 7.088 8.327 10.605 1084 HB2 GLN 142 HB2 GLN 142 9.344 6.910 12.022 1085 HB3 GLN 142 HB3 GLN 142 8.353 8.174 12.739 1086 HG2 GLN 142 HG2 GLN 142 6.379 6.792 12.528 1087 HG3 GLN 142 HG3 GLN 142 7.311 5.545 11.706 1088 HE21 GLN 142 HE21 GLN 142 5.749 5.340 14.120 1089 HE22 GLN 142 HE22 GLN 142 6.819 4.846 15.367 1090 H ALA 143 H ALA 143 10.447 7.807 9.715 1091 HA ALA 143 HA ALA 143 11.309 10.452 10.318 1092 HB1 ALA 143 HB1 ALA 143 12.887 8.577 10.156 1093 HB2 ALA 143 HB2 ALA 143 13.324 9.869 9.038 1094 HB3 ALA 143 HB3 ALA 143 12.520 8.417 8.439 1095 H MET 144 H MET 144 9.971 8.878 7.530 1096 HA MET 144 HA MET 144 10.393 10.938 5.636 1097 HB2 MET 144 HB2 MET 144 9.934 8.654 4.941 1098 HB3 MET 144 HB3 MET 144 8.379 8.685 5.752 1099 HG2 MET 144 HG2 MET 144 8.071 8.870 3.373 1100 HG3 MET 144 HG3 MET 144 7.599 10.376 4.150 1101 HE1 MET 144 HE1 MET 144 7.596 11.583 1.814 1102 HE2 MET 144 HE2 MET 144 8.060 10.073 1.032 1103 HE3 MET 144 HE3 MET 144 8.945 11.559 0.684 1104 H ALA 145 H ALA 145 7.926 10.339 8.022 1105 HA ALA 145 HA ALA 145 6.266 12.437 6.892 1106 HB1 ALA 145 HB1 ALA 145 5.181 10.345 7.579 1107 HB2 ALA 145 HB2 ALA 145 4.537 11.749 8.433 1108 HB3 ALA 145 HB3 ALA 145 5.669 10.666 9.242 1109 H TYR 146 H TYR 146 7.621 11.743 10.151 1110 HA TYR 146 HA TYR 146 7.421 14.621 10.606 1111 HB2 TYR 146 HB2 TYR 146 6.922 12.367 12.566 1112 HB3 TYR 146 HB3 TYR 146 7.098 14.051 13.042 1113 HD1 TYR 146 HD1 TYR 146 5.354 15.684 12.500 1114 HD2 TYR 146 HD2 TYR 146 4.893 11.581 11.465 1115 HE1 TYR 146 HE1 TYR 146 2.953 16.056 12.116 1116 HE2 TYR 146 HE2 TYR 146 2.495 11.940 11.078 1117 HH TYR 146 HH TYR 146 0.708 13.495 11.706 Start of MODEL 5 1 H MET 1 H MET 1 -23.721 -3.539 37.180 2 HA MET 1 HA MET 1 -24.843 -1.463 37.208 3 HB2 MET 1 HB2 MET 1 -22.917 -0.115 38.043 4 HB3 MET 1 HB3 MET 1 -22.121 -0.323 36.494 5 HG2 MET 1 HG2 MET 1 -23.116 1.874 36.663 6 HG3 MET 1 HG3 MET 1 -23.912 0.928 35.406 7 HE1 MET 1 HE1 MET 1 -25.875 2.778 35.429 8 HE2 MET 1 HE2 MET 1 -25.025 3.635 36.715 9 HE3 MET 1 HE3 MET 1 -26.735 3.243 36.896 10 HA PRO 2 HA PRO 2 -24.570 -3.093 33.013 11 HB2 PRO 2 HB2 PRO 2 -27.106 -3.833 32.756 12 HB3 PRO 2 HB3 PRO 2 -26.004 -4.719 33.818 13 HG2 PRO 2 HG2 PRO 2 -28.187 -2.828 34.511 14 HG3 PRO 2 HG3 PRO 2 -27.583 -4.224 35.415 15 HD2 PRO 2 HD2 PRO 2 -26.916 -1.488 35.828 16 HD3 PRO 2 HD3 PRO 2 -26.187 -2.902 36.613 17 H GLY 3 H GLY 3 -26.064 -2.759 31.013 18 HA2 GLY 3 HA2 GLY 3 -27.915 -1.100 30.371 19 HA3 GLY 3 HA3 GLY 3 -26.699 0.078 30.852 20 H ARG 4 H ARG 4 -26.356 0.964 28.910 21 HA ARG 4 HA ARG 4 -25.849 -0.534 26.530 22 HB2 ARG 4 HB2 ARG 4 -26.895 1.716 26.501 23 HB3 ARG 4 HB3 ARG 4 -25.458 2.407 27.213 24 HG2 ARG 4 HG2 ARG 4 -25.382 1.074 24.517 25 HG3 ARG 4 HG3 ARG 4 -25.874 2.755 24.702 26 HD2 ARG 4 HD2 ARG 4 -23.713 3.252 25.751 27 HD3 ARG 4 HD3 ARG 4 -23.238 1.566 25.558 28 HE ARG 4 HE ARG 4 -23.977 2.548 23.075 29 HH11 ARG 4 HH11 ARG 4 -21.404 3.054 25.467 30 HH12 ARG 4 HH12 ARG 4 -20.246 3.546 24.332 31 HH21 ARG 4 HH21 ARG 4 -22.362 3.231 21.501 32 HH22 ARG 4 HH22 ARG 4 -20.816 3.696 22.034 33 H ALA 5 H ALA 5 -23.888 -1.182 25.738 34 HA ALA 5 HA ALA 5 -21.500 -0.314 27.173 35 HB1 ALA 5 HB1 ALA 5 -20.680 -2.607 27.211 36 HB2 ALA 5 HB2 ALA 5 -22.150 -3.168 26.417 37 HB3 ALA 5 HB3 ALA 5 -22.228 -2.505 28.047 38 HA PRO 6 HA PRO 6 -20.065 0.030 22.944 39 HB2 PRO 6 HB2 PRO 6 -17.514 0.691 23.378 40 HB3 PRO 6 HB3 PRO 6 -18.818 1.780 23.860 41 HG2 PRO 6 HG2 PRO 6 -17.197 -0.087 25.540 42 HG3 PRO 6 HG3 PRO 6 -17.736 1.559 25.905 43 HD2 PRO 6 HD2 PRO 6 -18.977 -0.755 26.795 44 HD3 PRO 6 HD3 PRO 6 -19.750 0.838 26.691 45 H GLY 7 H GLY 7 -17.683 -0.645 21.878 46 HA2 GLY 7 HA2 GLY 7 -16.649 -3.141 22.734 47 HA3 GLY 7 HA3 GLY 7 -17.725 -3.312 21.347 48 H SER 8 H SER 8 -16.147 -3.843 19.891 49 HA SER 8 HA SER 8 -13.893 -2.125 19.498 50 HB2 SER 8 HB2 SER 8 -14.944 -4.376 17.764 51 HB3 SER 8 HB3 SER 8 -13.330 -3.664 17.697 52 HG SER 8 HG SER 8 -12.929 -5.276 18.997 53 H THR 9 H THR 9 -14.538 -0.139 18.915 54 HA THR 9 HA THR 9 -16.569 0.320 16.946 55 HB THR 9 HB THR 9 -14.618 2.291 18.183 56 HG1 THR 9 HG1 THR 9 -15.592 1.866 19.992 57 HG21 THR 9 HG21 THR 9 -16.003 3.139 16.309 58 HG22 THR 9 HG22 THR 9 -16.447 3.897 17.839 59 HG23 THR 9 HG23 THR 9 -17.453 2.616 17.165 60 H LEU 10 H LEU 10 -16.090 1.474 14.927 61 HA LEU 10 HA LEU 10 -14.054 0.342 13.418 62 HB2 LEU 10 HB2 LEU 10 -15.712 2.816 12.914 63 HB3 LEU 10 HB3 LEU 10 -14.550 2.216 11.762 64 HG LEU 10 HG LEU 10 -16.766 1.572 11.095 65 HD11 LEU 10 HD11 LEU 10 -15.264 -0.821 12.125 66 HD12 LEU 10 HD12 LEU 10 -14.983 0.015 10.598 67 HD13 LEU 10 HD13 LEU 10 -16.504 -0.829 10.871 68 HD21 LEU 10 HD21 LEU 10 -18.161 0.064 12.455 69 HD22 LEU 10 HD22 LEU 10 -17.873 1.616 13.263 70 HD23 LEU 10 HD23 LEU 10 -16.955 0.186 13.746 71 H ALA 11 H ALA 11 -12.077 0.681 13.318 72 HA ALA 11 HA ALA 11 -10.791 2.629 14.948 73 HB1 ALA 11 HB1 ALA 11 -8.697 1.699 14.096 74 HB2 ALA 11 HB2 ALA 11 -9.584 0.799 12.868 75 HB3 ALA 11 HB3 ALA 11 -9.806 0.416 14.574 76 H ARG 12 H ARG 12 -9.937 4.546 14.433 77 HA ARG 12 HA ARG 12 -10.285 5.368 11.662 78 HB2 ARG 12 HB2 ARG 12 -10.081 7.098 14.113 79 HB3 ARG 12 HB3 ARG 12 -10.303 7.668 12.469 80 HG2 ARG 12 HG2 ARG 12 -12.159 5.824 13.839 81 HG3 ARG 12 HG3 ARG 12 -12.381 7.587 13.921 82 HD2 ARG 12 HD2 ARG 12 -13.828 6.902 12.193 83 HD3 ARG 12 HD3 ARG 12 -12.388 7.396 11.320 84 HE ARG 12 HE ARG 12 -11.963 4.764 11.669 85 HH11 ARG 12 HH11 ARG 12 -14.746 6.517 10.406 86 HH12 ARG 12 HH12 ARG 12 -15.276 5.249 9.404 87 HH21 ARG 12 HH21 ARG 12 -12.668 3.027 10.327 88 HH22 ARG 12 HH22 ARG 12 -14.059 3.208 9.349 89 H VAL 13 H VAL 13 -8.437 4.297 11.211 90 HA VAL 13 HA VAL 13 -5.949 5.550 12.077 91 HB VAL 13 HB VAL 13 -6.376 3.210 10.191 92 HG11 VAL 13 HG11 VAL 13 -3.970 2.816 10.325 93 HG12 VAL 13 HG12 VAL 13 -3.786 4.272 11.303 94 HG13 VAL 13 HG13 VAL 13 -4.321 4.398 9.625 95 HG21 VAL 13 HG21 VAL 13 -5.460 1.836 12.005 96 HG22 VAL 13 HG22 VAL 13 -6.933 2.671 12.496 97 HG23 VAL 13 HG23 VAL 13 -5.363 3.269 13.026 98 H GLY 14 H GLY 14 -7.889 5.145 9.386 99 HA2 GLY 14 HA2 GLY 14 -7.638 7.592 8.264 100 HA3 GLY 14 HA3 GLY 14 -6.303 6.662 7.586 101 H SER 15 H SER 15 -8.206 7.614 6.040 102 HA SER 15 HA SER 15 -9.133 5.124 4.854 103 HB2 SER 15 HB2 SER 15 -11.102 6.156 6.083 104 HB3 SER 15 HB3 SER 15 -10.928 7.580 5.062 105 HG SER 15 HG SER 15 -11.064 5.562 3.400 106 H ILE 16 H ILE 16 -7.737 5.193 3.222 107 HA ILE 16 HA ILE 16 -7.334 7.745 1.876 108 HB ILE 16 HB ILE 16 -5.548 5.281 1.735 109 HG12 ILE 16 HG12 ILE 16 -3.877 6.843 2.970 110 HG13 ILE 16 HG13 ILE 16 -5.296 7.769 3.426 111 HG21 ILE 16 HG21 ILE 16 -5.099 8.081 0.734 112 HG22 ILE 16 HG22 ILE 16 -5.406 6.648 -0.245 113 HG23 ILE 16 HG23 ILE 16 -3.916 6.776 0.692 114 HD11 ILE 16 HD11 ILE 16 -4.618 6.266 5.213 115 HD12 ILE 16 HD12 ILE 16 -4.762 4.883 4.123 116 HD13 ILE 16 HD13 ILE 16 -6.197 5.801 4.577 117 HA PRO 17 HA PRO 17 -9.413 5.728 -1.604 118 HB2 PRO 17 HB2 PRO 17 -8.739 8.087 -3.151 119 HB3 PRO 17 HB3 PRO 17 -10.330 7.546 -2.622 120 HG2 PRO 17 HG2 PRO 17 -9.114 9.790 -1.651 121 HG3 PRO 17 HG3 PRO 17 -10.281 8.832 -0.728 122 HD2 PRO 17 HD2 PRO 17 -7.301 8.873 -0.554 123 HD3 PRO 17 HD3 PRO 17 -8.528 8.742 0.731 124 H ALA 18 H ALA 18 -8.720 5.186 -3.867 125 HA ALA 18 HA ALA 18 -5.878 4.660 -3.924 126 HB1 ALA 18 HB1 ALA 18 -8.075 3.878 -5.840 127 HB2 ALA 18 HB2 ALA 18 -7.484 2.906 -4.490 128 HB3 ALA 18 HB3 ALA 18 -6.416 3.269 -5.845 129 H GLY 19 H GLY 19 -4.433 5.662 -5.236 130 HA2 GLY 19 HA2 GLY 19 -5.540 7.733 -7.029 131 HA3 GLY 19 HA3 GLY 19 -4.059 7.921 -6.106 132 H ASP 20 H ASP 20 -2.227 6.494 -6.723 133 HA ASP 20 HA ASP 20 -2.378 5.629 -9.518 134 HB2 ASP 20 HB2 ASP 20 -1.492 7.902 -9.557 135 HB3 ASP 20 HB3 ASP 20 -0.295 7.485 -8.343 136 H ASP 21 H ASP 21 -1.438 3.750 -9.863 137 HA ASP 21 HA ASP 21 -0.369 2.245 -7.697 138 HB2 ASP 21 HB2 ASP 21 -1.596 1.077 -9.384 139 HB3 ASP 21 HB3 ASP 21 -0.517 1.651 -10.650 140 H VAL 22 H VAL 22 1.614 1.562 -7.272 141 HA VAL 22 HA VAL 22 3.774 3.163 -8.455 142 HB VAL 22 HB VAL 22 3.642 1.928 -5.685 143 HG11 VAL 22 HG11 VAL 22 5.649 3.170 -5.185 144 HG12 VAL 22 HG12 VAL 22 5.684 3.844 -6.815 145 HG13 VAL 22 HG13 VAL 22 5.943 2.113 -6.568 146 HG21 VAL 22 HG21 VAL 22 2.083 3.767 -5.911 147 HG22 VAL 22 HG22 VAL 22 3.357 4.792 -6.569 148 HG23 VAL 22 HG23 VAL 22 3.443 4.246 -4.897 149 H LEU 23 H LEU 23 2.609 -0.084 -8.109 150 HA LEU 23 HA LEU 23 5.311 -0.968 -8.524 151 HB2 LEU 23 HB2 LEU 23 4.424 -3.346 -8.324 152 HB3 LEU 23 HB3 LEU 23 4.451 -2.378 -6.881 153 HG LEU 23 HG LEU 23 2.006 -2.130 -7.012 154 HD11 LEU 23 HD11 LEU 23 2.224 -4.023 -9.363 155 HD12 LEU 23 HD12 LEU 23 1.734 -2.334 -9.456 156 HD13 LEU 23 HD13 LEU 23 0.728 -3.499 -8.593 157 HD21 LEU 23 HD21 LEU 23 1.444 -4.437 -6.497 158 HD22 LEU 23 HD22 LEU 23 2.957 -3.932 -5.748 159 HD23 LEU 23 HD23 LEU 23 2.986 -4.959 -7.179 160 H ASP 24 H ASP 24 5.244 -3.107 -10.014 161 HA ASP 24 HA ASP 24 4.669 -1.894 -12.615 162 HB2 ASP 24 HB2 ASP 24 6.383 -4.329 -12.008 163 HB3 ASP 24 HB3 ASP 24 6.183 -3.530 -13.554 164 HA PRO 25 HA PRO 25 1.320 -4.730 -13.542 165 HB2 PRO 25 HB2 PRO 25 2.752 -5.220 -16.109 166 HB3 PRO 25 HB3 PRO 25 1.068 -4.764 -15.838 167 HG2 PRO 25 HG2 PRO 25 2.804 -2.964 -16.702 168 HG3 PRO 25 HG3 PRO 25 1.581 -2.541 -15.490 169 HD2 PRO 25 HD2 PRO 25 4.504 -3.037 -15.137 170 HD3 PRO 25 HD3 PRO 25 3.447 -1.863 -14.329 171 H ASP 26 H ASP 26 4.644 -5.727 -13.933 172 HA ASP 26 HA ASP 26 4.095 -8.531 -14.150 173 HB2 ASP 26 HB2 ASP 26 6.174 -7.551 -15.007 174 HB3 ASP 26 HB3 ASP 26 6.648 -7.137 -13.362 175 H GLU 27 H GLU 27 4.350 -6.338 -11.495 176 HA GLU 27 HA GLU 27 5.071 -8.267 -9.539 177 HB2 GLU 27 HB2 GLU 27 3.803 -5.545 -9.217 178 HB3 GLU 27 HB3 GLU 27 4.430 -6.521 -7.897 179 HG2 GLU 27 HG2 GLU 27 6.037 -5.372 -10.170 180 HG3 GLU 27 HG3 GLU 27 5.969 -4.745 -8.527 181 HA PRO 28 HA PRO 28 1.092 -10.201 -9.070 182 HB2 PRO 28 HB2 PRO 28 1.900 -10.664 -6.258 183 HB3 PRO 28 HB3 PRO 28 1.470 -11.837 -7.498 184 HG2 PRO 28 HG2 PRO 28 3.990 -11.532 -6.711 185 HG3 PRO 28 HG3 PRO 28 3.593 -11.838 -8.414 186 HD2 PRO 28 HD2 PRO 28 4.338 -9.272 -7.076 187 HD3 PRO 28 HD3 PRO 28 4.833 -9.937 -8.653 188 H THR 29 H THR 29 -0.915 -9.557 -8.457 189 HA THR 29 HA THR 29 -1.159 -7.529 -6.367 190 HB THR 29 HB THR 29 -2.944 -6.469 -7.853 191 HG1 THR 29 HG1 THR 29 -1.609 -7.406 -10.101 192 HG21 THR 29 HG21 THR 29 -0.060 -6.330 -8.771 193 HG22 THR 29 HG22 THR 29 -0.779 -5.381 -7.470 194 HG23 THR 29 HG23 THR 29 -1.305 -5.137 -9.136 195 H TYR 30 H TYR 30 -3.496 -7.207 -5.761 196 HA TYR 30 HA TYR 30 -5.125 -9.557 -6.099 197 HB2 TYR 30 HB2 TYR 30 -4.505 -8.076 -3.548 198 HB3 TYR 30 HB3 TYR 30 -5.997 -8.975 -3.761 199 HD1 TYR 30 HD1 TYR 30 -5.276 -11.404 -5.024 200 HD2 TYR 30 HD2 TYR 30 -3.113 -9.190 -2.138 201 HE1 TYR 30 HE1 TYR 30 -4.194 -13.468 -4.285 202 HE2 TYR 30 HE2 TYR 30 -2.006 -11.244 -1.382 203 HH TYR 30 HH TYR 30 -2.408 -13.652 -1.405 204 H ASP 31 H ASP 31 -7.356 -8.999 -5.726 205 HA ASP 31 HA ASP 31 -8.029 -6.192 -6.281 206 HB2 ASP 31 HB2 ASP 31 -7.988 -7.837 -8.323 207 HB3 ASP 31 HB3 ASP 31 -9.361 -8.606 -7.549 208 H LEU 32 H LEU 32 -10.482 -6.077 -5.780 209 HA LEU 32 HA LEU 32 -10.679 -6.661 -3.079 210 HB2 LEU 32 HB2 LEU 32 -12.890 -5.894 -4.963 211 HB3 LEU 32 HB3 LEU 32 -13.083 -5.985 -3.225 212 HG LEU 32 HG LEU 32 -11.262 -4.097 -4.723 213 HD11 LEU 32 HD11 LEU 32 -12.748 -2.374 -3.873 214 HD12 LEU 32 HD12 LEU 32 -13.752 -3.605 -3.106 215 HD13 LEU 32 HD13 LEU 32 -13.629 -3.540 -4.862 216 HD21 LEU 32 HD21 LEU 32 -11.734 -4.408 -1.754 217 HD22 LEU 32 HD22 LEU 32 -10.857 -3.077 -2.512 218 HD23 LEU 32 HD23 LEU 32 -10.224 -4.713 -2.622 219 HA PRO 33 HA PRO 33 -13.707 -10.387 -3.861 220 HB2 PRO 33 HB2 PRO 33 -13.190 -11.718 -6.231 221 HB3 PRO 33 HB3 PRO 33 -14.554 -10.628 -5.976 222 HG2 PRO 33 HG2 PRO 33 -11.913 -10.091 -7.261 223 HG3 PRO 33 HG3 PRO 33 -13.530 -9.554 -7.755 224 HD2 PRO 33 HD2 PRO 33 -11.842 -7.905 -6.508 225 HD3 PRO 33 HD3 PRO 33 -13.584 -7.869 -6.160 226 H ARG 34 H ARG 34 -10.505 -10.394 -5.430 227 HA ARG 34 HA ARG 34 -9.834 -12.971 -4.588 228 HB2 ARG 34 HB2 ARG 34 -8.849 -11.624 -6.500 229 HB3 ARG 34 HB3 ARG 34 -7.891 -10.797 -5.280 230 HG2 ARG 34 HG2 ARG 34 -6.598 -12.561 -6.283 231 HG3 ARG 34 HG3 ARG 34 -6.942 -12.961 -4.595 232 HD2 ARG 34 HD2 ARG 34 -8.749 -14.396 -5.266 233 HD3 ARG 34 HD3 ARG 34 -8.525 -13.909 -6.949 234 HE ARG 34 HE ARG 34 -6.405 -15.263 -5.427 235 HH11 ARG 34 HH11 ARG 34 -8.642 -15.303 -8.187 236 HH12 ARG 34 HH12 ARG 34 -7.990 -16.718 -8.867 237 HH21 ARG 34 HH21 ARG 34 -5.553 -17.248 -6.349 238 HH22 ARG 34 HH22 ARG 34 -6.227 -17.888 -7.766 239 H VAL 35 H VAL 35 -9.364 -9.774 -3.166 240 HA VAL 35 HA VAL 35 -7.679 -10.671 -1.069 241 HB VAL 35 HB VAL 35 -9.532 -8.248 -1.090 242 HG11 VAL 35 HG11 VAL 35 -7.232 -8.895 0.755 243 HG12 VAL 35 HG12 VAL 35 -8.940 -8.864 1.191 244 HG13 VAL 35 HG13 VAL 35 -8.125 -7.373 0.721 245 HG21 VAL 35 HG21 VAL 35 -7.495 -6.966 -1.557 246 HG22 VAL 35 HG22 VAL 35 -7.862 -8.120 -2.841 247 HG23 VAL 35 HG23 VAL 35 -6.587 -8.470 -1.669 248 H ALA 36 H ALA 36 -11.140 -10.246 -1.390 249 HA ALA 36 HA ALA 36 -11.951 -11.062 1.152 250 HB1 ALA 36 HB1 ALA 36 -14.083 -11.620 0.072 251 HB2 ALA 36 HB2 ALA 36 -13.306 -11.523 -1.510 252 HB3 ALA 36 HB3 ALA 36 -13.456 -10.077 -0.511 253 H GLU 37 H GLU 37 -11.186 -12.852 -1.732 254 HA GLU 37 HA GLU 37 -11.766 -15.495 -1.007 255 HB2 GLU 37 HB2 GLU 37 -11.086 -14.485 -3.271 256 HB3 GLU 37 HB3 GLU 37 -9.461 -14.536 -2.671 257 HG2 GLU 37 HG2 GLU 37 -9.756 -16.446 -4.050 258 HG3 GLU 37 HG3 GLU 37 -9.642 -16.984 -2.375 259 H LEU 38 H LEU 38 -8.875 -13.519 -0.673 260 HA LEU 38 HA LEU 38 -7.159 -15.551 0.282 261 HB2 LEU 38 HB2 LEU 38 -6.479 -13.476 -0.894 262 HB3 LEU 38 HB3 LEU 38 -6.899 -12.577 0.548 263 HG LEU 38 HG LEU 38 -5.203 -13.944 1.779 264 HD11 LEU 38 HD11 LEU 38 -5.025 -15.810 0.216 265 HD12 LEU 38 HD12 LEU 38 -3.458 -15.033 0.452 266 HD13 LEU 38 HD13 LEU 38 -4.379 -14.722 -1.015 267 HD21 LEU 38 HD21 LEU 38 -4.262 -12.222 -0.496 268 HD22 LEU 38 HD22 LEU 38 -3.323 -12.628 0.936 269 HD23 LEU 38 HD23 LEU 38 -4.789 -11.660 1.091 270 H LEU 39 H LEU 39 -8.893 -12.913 1.881 271 HA LEU 39 HA LEU 39 -7.896 -13.643 4.488 272 HB2 LEU 39 HB2 LEU 39 -9.957 -11.656 3.590 273 HB3 LEU 39 HB3 LEU 39 -9.463 -11.845 5.264 274 HG LEU 39 HG LEU 39 -7.651 -10.969 2.998 275 HD11 LEU 39 HD11 LEU 39 -8.972 -9.366 5.183 276 HD12 LEU 39 HD12 LEU 39 -9.385 -9.315 3.472 277 HD13 LEU 39 HD13 LEU 39 -7.804 -8.753 4.013 278 HD21 LEU 39 HD21 LEU 39 -7.245 -11.009 5.989 279 HD22 LEU 39 HD22 LEU 39 -6.124 -10.339 4.805 280 HD23 LEU 39 HD23 LEU 39 -6.454 -12.070 4.822 281 H GLY 40 H GLY 40 -10.561 -14.554 2.556 282 HA2 GLY 40 HA2 GLY 40 -12.186 -16.140 2.973 283 HA3 GLY 40 HA3 GLY 40 -11.504 -16.352 4.585 284 H VAL 41 H VAL 41 -12.414 -13.278 3.352 285 HA VAL 41 HA VAL 41 -14.753 -13.208 5.143 286 HB VAL 41 HB VAL 41 -14.227 -10.906 5.794 287 HG11 VAL 41 HG11 VAL 41 -13.250 -12.612 7.176 288 HG12 VAL 41 HG12 VAL 41 -12.203 -11.196 7.102 289 HG13 VAL 41 HG13 VAL 41 -11.809 -12.637 6.164 290 HG21 VAL 41 HG21 VAL 41 -12.111 -9.804 5.119 291 HG22 VAL 41 HG22 VAL 41 -13.197 -10.100 3.757 292 HG23 VAL 41 HG23 VAL 41 -11.810 -11.147 4.015 293 HA PRO 42 HA PRO 42 -16.771 -11.459 1.545 294 HB2 PRO 42 HB2 PRO 42 -18.379 -9.523 2.588 295 HB3 PRO 42 HB3 PRO 42 -18.739 -11.248 2.728 296 HG2 PRO 42 HG2 PRO 42 -17.460 -9.412 4.700 297 HG3 PRO 42 HG3 PRO 42 -18.729 -10.621 4.976 298 HD2 PRO 42 HD2 PRO 42 -16.168 -11.111 5.586 299 HD3 PRO 42 HD3 PRO 42 -17.221 -12.384 4.947 300 H VAL 43 H VAL 43 -16.798 -9.613 0.195 301 HA VAL 43 HA VAL 43 -14.510 -7.996 0.154 302 HB VAL 43 HB VAL 43 -17.164 -7.454 -1.217 303 HG11 VAL 43 HG11 VAL 43 -14.390 -6.509 -1.863 304 HG12 VAL 43 HG12 VAL 43 -15.737 -5.513 -1.303 305 HG13 VAL 43 HG13 VAL 43 -15.796 -6.265 -2.900 306 HG21 VAL 43 HG21 VAL 43 -14.790 -9.032 -2.190 307 HG22 VAL 43 HG22 VAL 43 -16.226 -8.636 -3.141 308 HG23 VAL 43 HG23 VAL 43 -16.366 -9.675 -1.718 309 H SER 44 H SER 44 -17.722 -7.468 1.390 310 HA SER 44 HA SER 44 -17.672 -4.766 1.911 311 HB2 SER 44 HB2 SER 44 -18.956 -7.009 3.422 312 HB3 SER 44 HB3 SER 44 -19.430 -5.302 3.561 313 HG SER 44 HG SER 44 -20.716 -6.547 2.073 314 H LYS 45 H LYS 45 -16.443 -7.470 3.941 315 HA LYS 45 HA LYS 45 -15.709 -5.715 6.054 316 HB2 LYS 45 HB2 LYS 45 -14.888 -8.555 5.497 317 HB3 LYS 45 HB3 LYS 45 -14.235 -7.628 6.836 318 HG2 LYS 45 HG2 LYS 45 -16.581 -7.316 7.653 319 HG3 LYS 45 HG3 LYS 45 -17.113 -8.439 6.410 320 HD2 LYS 45 HD2 LYS 45 -16.843 -9.642 8.492 321 HD3 LYS 45 HD3 LYS 45 -15.572 -10.152 7.383 322 HE2 LYS 45 HE2 LYS 45 -13.998 -8.608 8.496 323 HE3 LYS 45 HE3 LYS 45 -15.277 -8.127 9.604 324 HZ1 LYS 45 HZ1 LYS 45 -15.352 -10.409 10.412 325 HZ2 LYS 45 HZ2 LYS 45 -13.807 -9.754 10.572 326 HZ3 LYS 45 HZ3 LYS 45 -14.122 -10.849 9.347 327 H VAL 46 H VAL 46 -14.115 -6.900 3.223 328 HA VAL 46 HA VAL 46 -11.492 -6.044 3.831 329 HB VAL 46 HB VAL 46 -12.852 -6.171 1.115 330 HG11 VAL 46 HG11 VAL 46 -10.587 -6.307 0.177 331 HG12 VAL 46 HG12 VAL 46 -9.916 -6.085 1.797 332 HG13 VAL 46 HG13 VAL 46 -10.858 -4.795 1.047 333 HG21 VAL 46 HG21 VAL 46 -11.153 -8.220 2.539 334 HG22 VAL 46 HG22 VAL 46 -11.746 -8.356 0.884 335 HG23 VAL 46 HG23 VAL 46 -12.885 -8.327 2.231 336 H ALA 47 H ALA 47 -14.198 -4.451 2.241 337 HA ALA 47 HA ALA 47 -12.957 -1.985 1.761 338 HB1 ALA 47 HB1 ALA 47 -15.220 -1.105 1.482 339 HB2 ALA 47 HB2 ALA 47 -15.878 -2.572 2.217 340 HB3 ALA 47 HB3 ALA 47 -15.034 -2.659 0.671 341 H GLN 48 H GLN 48 -14.684 -3.247 4.531 342 HA GLN 48 HA GLN 48 -14.751 -0.886 6.073 343 HB2 GLN 48 HB2 GLN 48 -14.657 -3.772 6.960 344 HB3 GLN 48 HB3 GLN 48 -14.913 -2.423 8.053 345 HG2 GLN 48 HG2 GLN 48 -16.984 -1.871 6.944 346 HG3 GLN 48 HG3 GLN 48 -16.705 -3.131 5.744 347 HE21 GLN 48 HE21 GLN 48 -17.530 -2.469 9.036 348 HE22 GLN 48 HE22 GLN 48 -18.100 -4.040 9.435 349 H GLN 49 H GLN 49 -12.321 -3.413 5.749 350 HA GLN 49 HA GLN 49 -10.521 -2.478 7.725 351 HB2 GLN 49 HB2 GLN 49 -9.899 -4.003 5.187 352 HB3 GLN 49 HB3 GLN 49 -8.828 -3.854 6.571 353 HG2 GLN 49 HG2 GLN 49 -10.532 -4.912 7.939 354 HG3 GLN 49 HG3 GLN 49 -11.504 -5.182 6.510 355 HE21 GLN 49 HE21 GLN 49 -11.457 -7.384 6.708 356 HE22 GLN 49 HE22 GLN 49 -10.045 -8.334 6.390 357 H LEU 50 H LEU 50 -10.812 -1.918 4.344 358 HA LEU 50 HA LEU 50 -8.660 -0.111 3.974 359 HB2 LEU 50 HB2 LEU 50 -9.872 -1.134 2.095 360 HB3 LEU 50 HB3 LEU 50 -11.318 -0.252 2.528 361 HG LEU 50 HG LEU 50 -10.139 1.872 1.969 362 HD11 LEU 50 HD11 LEU 50 -8.081 1.775 0.655 363 HD12 LEU 50 HD12 LEU 50 -7.975 0.039 0.953 364 HD13 LEU 50 HD13 LEU 50 -7.847 1.168 2.294 365 HD21 LEU 50 HD21 LEU 50 -10.246 1.568 -0.459 366 HD22 LEU 50 HD22 LEU 50 -11.612 0.804 0.355 367 HD23 LEU 50 HD23 LEU 50 -10.273 -0.180 -0.235 368 H ARG 51 H ARG 51 -12.026 0.386 4.867 369 HA ARG 51 HA ARG 51 -11.920 3.194 5.107 370 HB2 ARG 51 HB2 ARG 51 -13.833 1.148 6.170 371 HB3 ARG 51 HB3 ARG 51 -13.998 2.849 6.560 372 HG2 ARG 51 HG2 ARG 51 -14.037 1.668 3.791 373 HG3 ARG 51 HG3 ARG 51 -15.448 2.204 4.706 374 HD2 ARG 51 HD2 ARG 51 -14.382 4.463 4.840 375 HD3 ARG 51 HD3 ARG 51 -13.167 3.883 3.703 376 HE ARG 51 HE ARG 51 -15.806 3.468 2.771 377 HH11 ARG 51 HH11 ARG 51 -13.188 5.867 3.016 378 HH12 ARG 51 HH12 ARG 51 -13.821 6.862 1.788 379 HH21 ARG 51 HH21 ARG 51 -16.655 4.859 1.109 380 HH22 ARG 51 HH22 ARG 51 -15.814 6.286 0.686 381 H GLU 52 H GLU 52 -10.878 0.700 7.252 382 HA GLU 52 HA GLU 52 -10.843 2.582 9.471 383 HB2 GLU 52 HB2 GLU 52 -10.002 -0.308 9.342 384 HB3 GLU 52 HB3 GLU 52 -9.897 0.693 10.779 385 HG2 GLU 52 HG2 GLU 52 -12.359 0.990 10.677 386 HG3 GLU 52 HG3 GLU 52 -12.391 -0.147 9.324 387 H GLY 53 H GLY 53 -8.848 1.706 6.935 388 HA2 GLY 53 HA2 GLY 53 -6.717 2.501 6.456 389 HA3 GLY 53 HA3 GLY 53 -6.600 3.118 8.101 390 H HIS 54 H HIS 54 -7.540 -0.114 7.411 391 HA HIS 54 HA HIS 54 -5.243 -1.198 8.847 392 HB2 HIS 54 HB2 HIS 54 -7.622 -1.950 9.229 393 HB3 HIS 54 HB3 HIS 54 -7.635 -2.568 7.591 394 HD1 HIS 54 HD1 HIS 54 -7.225 -3.692 10.946 395 HD2 HIS 54 HD2 HIS 54 -5.441 -4.625 7.322 396 HE1 HIS 54 HE1 HIS 54 -6.261 -6.007 11.219 397 H LEU 55 H LEU 55 -6.471 -0.800 5.642 398 HA LEU 55 HA LEU 55 -4.098 -2.000 4.500 399 HB2 LEU 55 HB2 LEU 55 -5.858 -3.778 4.648 400 HB3 LEU 55 HB3 LEU 55 -6.921 -2.758 3.708 401 HG LEU 55 HG LEU 55 -5.318 -2.922 1.811 402 HD11 LEU 55 HD11 LEU 55 -3.290 -3.407 3.054 403 HD12 LEU 55 HD12 LEU 55 -3.607 -4.679 1.876 404 HD13 LEU 55 HD13 LEU 55 -3.962 -4.948 3.582 405 HD21 LEU 55 HD21 LEU 55 -6.369 -5.537 2.890 406 HD22 LEU 55 HD22 LEU 55 -5.926 -5.217 1.215 407 HD23 LEU 55 HD23 LEU 55 -7.286 -4.365 1.945 408 H VAL 56 H VAL 56 -3.894 -1.223 2.187 409 HA VAL 56 HA VAL 56 -5.713 0.908 1.491 410 HB VAL 56 HB VAL 56 -3.724 1.888 2.676 411 HG11 VAL 56 HG11 VAL 56 -2.162 0.861 0.337 412 HG12 VAL 56 HG12 VAL 56 -2.003 0.389 2.029 413 HG13 VAL 56 HG13 VAL 56 -1.567 2.024 1.524 414 HG21 VAL 56 HG21 VAL 56 -4.012 2.688 -0.212 415 HG22 VAL 56 HG22 VAL 56 -3.280 3.676 1.052 416 HG23 VAL 56 HG23 VAL 56 -4.995 3.259 1.134 417 H ALA 57 H ALA 57 -5.456 1.474 -0.840 418 HA ALA 57 HA ALA 57 -4.484 -0.755 -2.451 419 HB1 ALA 57 HB1 ALA 57 -6.848 -1.198 -1.907 420 HB2 ALA 57 HB2 ALA 57 -6.604 -0.879 -3.622 421 HB3 ALA 57 HB3 ALA 57 -7.277 0.373 -2.577 422 H VAL 58 H VAL 58 -4.518 -0.169 -4.789 423 HA VAL 58 HA VAL 58 -4.348 2.720 -5.182 424 HB VAL 58 HB VAL 58 -2.497 2.275 -6.876 425 HG11 VAL 58 HG11 VAL 58 -1.920 1.784 -3.971 426 HG12 VAL 58 HG12 VAL 58 -2.119 3.354 -4.744 427 HG13 VAL 58 HG13 VAL 58 -0.746 2.323 -5.176 428 HG21 VAL 58 HG21 VAL 58 -2.306 -0.324 -5.344 429 HG22 VAL 58 HG22 VAL 58 -1.117 0.274 -6.503 430 HG23 VAL 58 HG23 VAL 58 -2.740 -0.154 -7.045 431 H ARG 59 H ARG 59 -4.269 3.281 -7.514 432 HA ARG 59 HA ARG 59 -6.439 1.835 -8.877 433 HB2 ARG 59 HB2 ARG 59 -7.052 4.077 -8.136 434 HB3 ARG 59 HB3 ARG 59 -5.622 4.749 -8.881 435 HG2 ARG 59 HG2 ARG 59 -7.499 5.305 -10.236 436 HG3 ARG 59 HG3 ARG 59 -6.549 4.103 -11.102 437 HD2 ARG 59 HD2 ARG 59 -8.113 2.370 -10.452 438 HD3 ARG 59 HD3 ARG 59 -9.034 3.529 -9.493 439 HE ARG 59 HE ARG 59 -8.679 4.014 -12.359 440 HH11 ARG 59 HH11 ARG 59 -10.903 3.307 -9.664 441 HH12 ARG 59 HH12 ARG 59 -12.308 3.509 -10.602 442 HH21 ARG 59 HH21 ARG 59 -10.606 4.352 -13.604 443 HH22 ARG 59 HH22 ARG 59 -12.136 4.173 -12.867 444 H ARG 60 H ARG 60 -5.866 0.879 -10.697 445 HA ARG 60 HA ARG 60 -3.979 2.049 -12.540 446 HB2 ARG 60 HB2 ARG 60 -2.806 -0.213 -12.752 447 HB3 ARG 60 HB3 ARG 60 -2.359 0.796 -11.388 448 HG2 ARG 60 HG2 ARG 60 -3.779 -0.500 -9.923 449 HG3 ARG 60 HG3 ARG 60 -4.320 -1.475 -11.288 450 HD2 ARG 60 HD2 ARG 60 -1.421 -1.259 -10.697 451 HD3 ARG 60 HD3 ARG 60 -2.415 -2.302 -9.693 452 HE ARG 60 HE ARG 60 -3.110 -3.122 -12.087 453 HH11 ARG 60 HH11 ARG 60 0.140 -2.252 -11.045 454 HH12 ARG 60 HH12 ARG 60 0.905 -3.624 -11.689 455 HH21 ARG 60 HH21 ARG 60 -2.131 -5.022 -12.990 456 HH22 ARG 60 HH22 ARG 60 -0.480 -5.318 -12.846 457 H ALA 61 H ALA 61 -4.362 1.649 -14.493 458 HA ALA 61 HA ALA 61 -5.286 0.967 -16.421 459 HB1 ALA 61 HB1 ALA 61 -6.243 -1.466 -14.889 460 HB2 ALA 61 HB2 ALA 61 -4.725 -1.352 -15.782 461 HB3 ALA 61 HB3 ALA 61 -6.262 -1.289 -16.643 462 H GLY 62 H GLY 62 -7.395 0.108 -13.897 463 HA2 GLY 62 HA2 GLY 62 -9.279 2.143 -14.150 464 HA3 GLY 62 HA3 GLY 62 -9.826 0.836 -15.196 465 H GLY 63 H GLY 63 -8.024 0.121 -12.278 466 HA2 GLY 63 HA2 GLY 63 -10.495 -0.563 -10.914 467 HA3 GLY 63 HA3 GLY 63 -9.358 -1.849 -11.290 468 H VAL 64 H VAL 64 -10.150 -1.202 -8.757 469 HA VAL 64 HA VAL 64 -7.825 0.131 -7.577 470 HB VAL 64 HB VAL 64 -10.474 -0.710 -6.327 471 HG11 VAL 64 HG11 VAL 64 -8.678 -0.727 -4.690 472 HG12 VAL 64 HG12 VAL 64 -9.771 0.628 -4.391 473 HG13 VAL 64 HG13 VAL 64 -8.212 0.906 -5.163 474 HG21 VAL 64 HG21 VAL 64 -10.991 1.684 -6.229 475 HG22 VAL 64 HG22 VAL 64 -10.757 1.133 -7.888 476 HG23 VAL 64 HG23 VAL 64 -9.482 2.039 -7.073 477 H VAL 65 H VAL 65 -6.292 -1.185 -6.842 478 HA VAL 65 HA VAL 65 -6.970 -3.944 -6.097 479 HB VAL 65 HB VAL 65 -4.922 -4.727 -7.318 480 HG11 VAL 65 HG11 VAL 65 -7.150 -5.150 -8.250 481 HG12 VAL 65 HG12 VAL 65 -5.992 -4.831 -9.540 482 HG13 VAL 65 HG13 VAL 65 -7.126 -3.576 -9.044 483 HG21 VAL 65 HG21 VAL 65 -3.842 -2.578 -7.607 484 HG22 VAL 65 HG22 VAL 65 -5.171 -2.057 -8.649 485 HG23 VAL 65 HG23 VAL 65 -4.117 -3.368 -9.172 486 H ILE 66 H ILE 66 -5.315 -4.996 -4.964 487 HA ILE 66 HA ILE 66 -3.711 -3.118 -3.369 488 HB ILE 66 HB ILE 66 -4.943 -5.749 -2.432 489 HG12 ILE 66 HG12 ILE 66 -6.193 -4.253 -0.756 490 HG13 ILE 66 HG13 ILE 66 -5.732 -2.900 -1.772 491 HG21 ILE 66 HG21 ILE 66 -2.818 -5.331 -1.369 492 HG22 ILE 66 HG22 ILE 66 -4.133 -5.151 -0.208 493 HG23 ILE 66 HG23 ILE 66 -3.351 -3.721 -0.877 494 HD11 ILE 66 HD11 ILE 66 -7.023 -3.835 -3.613 495 HD12 ILE 66 HD12 ILE 66 -8.031 -3.622 -2.183 496 HD13 ILE 66 HD13 ILE 66 -7.453 -5.230 -2.627 497 HA PRO 67 HA PRO 67 -0.295 -5.557 -5.080 498 HB2 PRO 67 HB2 PRO 67 0.953 -4.539 -2.576 499 HB3 PRO 67 HB3 PRO 67 1.589 -4.526 -4.223 500 HG2 PRO 67 HG2 PRO 67 0.661 -2.292 -3.172 501 HG3 PRO 67 HG3 PRO 67 0.279 -2.708 -4.854 502 HD2 PRO 67 HD2 PRO 67 -1.444 -2.899 -2.420 503 HD3 PRO 67 HD3 PRO 67 -1.868 -2.413 -4.076 504 H GLN 68 H GLN 68 0.126 -7.705 -4.746 505 HA GLN 68 HA GLN 68 -1.044 -9.131 -2.655 506 HB2 GLN 68 HB2 GLN 68 -0.687 -10.060 -4.809 507 HB3 GLN 68 HB3 GLN 68 1.040 -9.808 -4.682 508 HG2 GLN 68 HG2 GLN 68 1.312 -11.579 -3.171 509 HG3 GLN 68 HG3 GLN 68 -0.414 -11.650 -2.816 510 HE21 GLN 68 HE21 GLN 68 -1.243 -11.429 -5.586 511 HE22 GLN 68 HE22 GLN 68 -0.879 -12.922 -6.302 512 H VAL 69 H VAL 69 1.993 -7.654 -2.933 513 HA VAL 69 HA VAL 69 3.382 -9.170 -0.981 514 HB VAL 69 HB VAL 69 5.063 -7.375 -1.085 515 HG11 VAL 69 HG11 VAL 69 5.656 -7.684 -3.461 516 HG12 VAL 69 HG12 VAL 69 4.034 -8.302 -3.771 517 HG13 VAL 69 HG13 VAL 69 5.128 -9.190 -2.711 518 HG21 VAL 69 HG21 VAL 69 4.751 -5.515 -2.683 519 HG22 VAL 69 HG22 VAL 69 3.577 -5.468 -1.364 520 HG23 VAL 69 HG23 VAL 69 3.088 -6.054 -2.950 521 H PHE 70 H PHE 70 0.865 -7.016 -0.603 522 HA PHE 70 HA PHE 70 1.671 -5.884 1.933 523 HB2 PHE 70 HB2 PHE 70 -0.722 -5.713 0.162 524 HB3 PHE 70 HB3 PHE 70 -0.976 -5.424 1.876 525 HD1 PHE 70 HD1 PHE 70 1.650 -4.416 -0.607 526 HD2 PHE 70 HD2 PHE 70 -1.143 -3.212 2.362 527 HE1 PHE 70 HE1 PHE 70 2.374 -2.073 -0.856 528 HE2 PHE 70 HE2 PHE 70 -0.408 -0.894 2.141 529 HZ PHE 70 HZ PHE 70 1.316 -0.306 0.538 530 H PHE 71 H PHE 71 0.750 -8.848 0.930 531 HA PHE 71 HA PHE 71 -0.519 -9.444 3.491 532 HB2 PHE 71 HB2 PHE 71 -0.964 -10.775 0.823 533 HB3 PHE 71 HB3 PHE 71 -1.611 -11.357 2.350 534 HD1 PHE 71 HD1 PHE 71 -3.414 -10.188 3.462 535 HD2 PHE 71 HD2 PHE 71 -1.856 -8.816 -0.245 536 HE1 PHE 71 HE1 PHE 71 -5.392 -8.762 3.160 537 HE2 PHE 71 HE2 PHE 71 -3.827 -7.387 -0.550 538 HZ PHE 71 HZ PHE 71 -5.595 -7.360 1.154 539 H THR 72 H THR 72 -0.132 -11.543 4.259 540 HA THR 72 HA THR 72 2.609 -12.390 3.827 541 HB THR 72 HB THR 72 2.142 -13.795 5.854 542 HG1 THR 72 HG1 THR 72 -0.234 -12.367 6.177 543 HG21 THR 72 HG21 THR 72 1.399 -10.875 6.135 544 HG22 THR 72 HG22 THR 72 3.040 -11.515 6.137 545 HG23 THR 72 HG23 THR 72 1.927 -11.918 7.447 546 H ASN 73 H ASN 73 2.888 -14.875 3.764 547 HA ASN 73 HA ASN 73 1.274 -15.916 1.683 548 HB2 ASN 73 HB2 ASN 73 3.480 -17.178 3.295 549 HB3 ASN 73 HB3 ASN 73 2.559 -18.093 2.103 550 HD21 ASN 73 HD21 ASN 73 2.716 -17.530 -0.063 551 HD22 ASN 73 HD22 ASN 73 4.014 -16.587 -0.691 552 H SER 74 H SER 74 0.892 -15.864 4.989 553 HA SER 74 HA SER 74 -0.781 -18.163 5.226 554 HB2 SER 74 HB2 SER 74 -0.643 -15.693 6.962 555 HB3 SER 74 HB3 SER 74 -1.193 -17.302 7.437 556 HG SER 74 HG SER 74 0.874 -18.068 7.199 557 H GLY 75 H GLY 75 -1.117 -15.124 3.749 558 HA2 GLY 75 HA2 GLY 75 -2.935 -14.241 2.648 559 HA3 GLY 75 HA3 GLY 75 -3.944 -15.501 3.352 560 H GLN 76 H GLN 76 -1.887 -13.588 5.289 561 HA GLN 76 HA GLN 76 -4.230 -12.266 6.502 562 HB2 GLN 76 HB2 GLN 76 -3.059 -13.961 7.899 563 HB3 GLN 76 HB3 GLN 76 -1.570 -13.058 7.706 564 HG2 GLN 76 HG2 GLN 76 -2.645 -11.154 8.888 565 HG3 GLN 76 HG3 GLN 76 -4.053 -12.181 9.160 566 HE21 GLN 76 HE21 GLN 76 -3.853 -13.969 10.524 567 HE22 GLN 76 HE22 GLN 76 -2.589 -14.088 11.683 568 H VAL 77 H VAL 77 -3.984 -10.039 6.942 569 HA VAL 77 HA VAL 77 -2.085 -8.579 5.381 570 HB VAL 77 HB VAL 77 -3.749 -7.566 7.718 571 HG11 VAL 77 HG11 VAL 77 -3.579 -5.374 6.628 572 HG12 VAL 77 HG12 VAL 77 -2.575 -6.091 5.369 573 HG13 VAL 77 HG13 VAL 77 -1.991 -6.032 7.030 574 HG21 VAL 77 HG21 VAL 77 -5.443 -6.875 6.077 575 HG22 VAL 77 HG22 VAL 77 -5.231 -8.626 6.099 576 HG23 VAL 77 HG23 VAL 77 -4.514 -7.666 4.804 577 H VAL 78 H VAL 78 -0.127 -7.709 6.082 578 HA VAL 78 HA VAL 78 1.174 -8.958 8.253 579 HB VAL 78 HB VAL 78 1.999 -6.273 7.135 580 HG11 VAL 78 HG11 VAL 78 3.239 -6.974 9.066 581 HG12 VAL 78 HG12 VAL 78 4.270 -7.032 7.638 582 HG13 VAL 78 HG13 VAL 78 3.608 -8.523 8.307 583 HG21 VAL 78 HG21 VAL 78 3.305 -7.410 5.430 584 HG22 VAL 78 HG22 VAL 78 1.586 -7.729 5.227 585 HG23 VAL 78 HG23 VAL 78 2.633 -8.969 5.929 586 H LYS 79 H LYS 79 1.111 -8.512 10.350 587 HA LYS 79 HA LYS 79 -0.724 -6.789 11.483 588 HB2 LYS 79 HB2 LYS 79 0.415 -7.157 13.638 589 HB3 LYS 79 HB3 LYS 79 0.079 -8.624 12.726 590 HG2 LYS 79 HG2 LYS 79 2.306 -8.787 12.019 591 HG3 LYS 79 HG3 LYS 79 2.690 -7.204 12.704 592 HD2 LYS 79 HD2 LYS 79 3.513 -9.013 14.178 593 HD3 LYS 79 HD3 LYS 79 2.246 -8.071 14.962 594 HE2 LYS 79 HE2 LYS 79 0.611 -9.817 14.309 595 HE3 LYS 79 HE3 LYS 79 1.942 -10.758 13.637 596 HZ1 LYS 79 HZ1 LYS 79 1.328 -11.460 15.859 597 HZ2 LYS 79 HZ2 LYS 79 1.695 -9.941 16.478 598 HZ3 LYS 79 HZ3 LYS 79 2.913 -10.913 15.833 599 H SER 80 H SER 80 2.587 -6.030 10.667 600 HA SER 80 HA SER 80 2.603 -3.600 12.209 601 HB2 SER 80 HB2 SER 80 4.572 -4.550 10.133 602 HB3 SER 80 HB3 SER 80 4.861 -3.427 11.468 603 HG SER 80 HG SER 80 4.149 -5.300 12.822 604 H LEU 81 H LEU 81 1.227 -4.448 9.300 605 HA LEU 81 HA LEU 81 2.058 -2.349 7.644 606 HB2 LEU 81 HB2 LEU 81 1.221 -4.529 6.886 607 HB3 LEU 81 HB3 LEU 81 -0.393 -4.091 7.368 608 HG LEU 81 HG LEU 81 1.137 -2.582 5.256 609 HD11 LEU 81 HD11 LEU 81 1.022 -4.982 4.751 610 HD12 LEU 81 HD12 LEU 81 0.057 -4.014 3.656 611 HD13 LEU 81 HD13 LEU 81 -0.728 -4.923 4.951 612 HD21 LEU 81 HD21 LEU 81 -0.883 -1.488 6.180 613 HD22 LEU 81 HD22 LEU 81 -1.822 -2.929 5.793 614 HD23 LEU 81 HD23 LEU 81 -1.105 -1.970 4.499 615 HA PRO 82 HA PRO 82 -2.246 -0.202 8.894 616 HB2 PRO 82 HB2 PRO 82 -2.298 -1.203 11.710 617 HB3 PRO 82 HB3 PRO 82 -3.649 -0.814 10.643 618 HG2 PRO 82 HG2 PRO 82 -3.021 -3.340 11.119 619 HG3 PRO 82 HG3 PRO 82 -3.479 -2.828 9.484 620 HD2 PRO 82 HD2 PRO 82 -0.775 -3.428 10.599 621 HD3 PRO 82 HD3 PRO 82 -1.451 -3.794 8.997 622 H GLY 83 H GLY 83 0.371 -0.963 11.087 623 HA2 GLY 83 HA2 GLY 83 0.499 1.428 12.561 624 HA3 GLY 83 HA3 GLY 83 1.832 0.310 12.323 625 H LEU 84 H LEU 84 2.127 0.488 9.553 626 HA LEU 84 HA LEU 84 3.586 2.912 9.373 627 HB2 LEU 84 HB2 LEU 84 4.289 2.242 7.177 628 HB3 LEU 84 HB3 LEU 84 4.283 0.819 8.188 629 HG LEU 84 HG LEU 84 1.890 0.503 7.062 630 HD11 LEU 84 HD11 LEU 84 1.917 2.552 5.774 631 HD12 LEU 84 HD12 LEU 84 1.888 1.150 4.720 632 HD13 LEU 84 HD13 LEU 84 3.387 2.035 4.951 633 HD21 LEU 84 HD21 LEU 84 3.716 -1.106 6.994 634 HD22 LEU 84 HD22 LEU 84 4.496 -0.175 5.716 635 HD23 LEU 84 HD23 LEU 84 2.939 -0.956 5.413 636 H LEU 85 H LEU 85 0.515 1.826 8.125 637 HA LEU 85 HA LEU 85 -0.038 4.074 6.553 638 HB2 LEU 85 HB2 LEU 85 -1.935 2.214 7.972 639 HB3 LEU 85 HB3 LEU 85 -2.435 3.420 6.808 640 HG LEU 85 HG LEU 85 -0.645 1.060 6.216 641 HD11 LEU 85 HD11 LEU 85 -3.520 1.598 5.507 642 HD12 LEU 85 HD12 LEU 85 -2.937 0.416 6.679 643 HD13 LEU 85 HD13 LEU 85 -2.561 0.218 4.967 644 HD21 LEU 85 HD21 LEU 85 -0.130 2.965 4.783 645 HD22 LEU 85 HD22 LEU 85 -1.840 3.147 4.386 646 HD23 LEU 85 HD23 LEU 85 -0.964 1.709 3.873 647 H THR 86 H THR 86 -0.467 3.395 9.922 648 HA THR 86 HA THR 86 -2.139 5.546 10.665 649 HB THR 86 HB THR 86 0.067 4.361 12.389 650 HG1 THR 86 HG1 THR 86 -1.768 2.966 11.368 651 HG21 THR 86 HG21 THR 86 -1.377 5.005 14.273 652 HG22 THR 86 HG22 THR 86 -2.536 5.704 13.145 653 HG23 THR 86 HG23 THR 86 -0.930 6.412 13.309 654 H ILE 87 H ILE 87 1.407 5.334 10.623 655 HA ILE 87 HA ILE 87 1.697 7.990 11.534 656 HB ILE 87 HB ILE 87 3.399 6.336 12.072 657 HG12 ILE 87 HG12 ILE 87 4.144 8.757 11.858 658 HG13 ILE 87 HG13 ILE 87 5.418 7.554 11.809 659 HG21 ILE 87 HG21 ILE 87 3.349 4.876 10.270 660 HG22 ILE 87 HG22 ILE 87 5.010 5.438 10.484 661 HG23 ILE 87 HG23 ILE 87 4.013 6.087 9.181 662 HD11 ILE 87 HD11 ILE 87 5.774 9.356 10.217 663 HD12 ILE 87 HD12 ILE 87 4.239 8.968 9.436 664 HD13 ILE 87 HD13 ILE 87 5.570 7.806 9.398 665 H LEU 88 H LEU 88 1.886 6.579 8.295 666 HA LEU 88 HA LEU 88 2.575 9.034 7.069 667 HB2 LEU 88 HB2 LEU 88 1.552 6.456 6.009 668 HB3 LEU 88 HB3 LEU 88 1.541 7.864 4.980 669 HG LEU 88 HG LEU 88 3.473 6.480 4.539 670 HD11 LEU 88 HD11 LEU 88 3.732 8.862 4.214 671 HD12 LEU 88 HD12 LEU 88 5.243 8.123 4.741 672 HD13 LEU 88 HD13 LEU 88 4.275 9.046 5.883 673 HD21 LEU 88 HD21 LEU 88 5.230 6.179 6.156 674 HD22 LEU 88 HD22 LEU 88 3.725 5.459 6.730 675 HD23 LEU 88 HD23 LEU 88 4.270 7.017 7.374 676 H HIS 89 H HIS 89 -0.546 7.597 7.801 677 HA HIS 89 HA HIS 89 -1.991 9.514 6.261 678 HB2 HIS 89 HB2 HIS 89 -2.998 7.323 6.961 679 HB3 HIS 89 HB3 HIS 89 -3.032 7.911 8.620 680 HD1 HIS 89 HD1 HIS 89 -5.079 9.250 9.295 681 HD2 HIS 89 HD2 HIS 89 -4.705 8.812 5.186 682 HE1 HIS 89 HE1 HIS 89 -7.165 10.278 8.281 683 H ASP 90 H ASP 90 -0.833 9.340 9.540 684 HA ASP 90 HA ASP 90 -2.068 11.654 10.570 685 HB2 ASP 90 HB2 ASP 90 -0.912 10.039 12.010 686 HB3 ASP 90 HB3 ASP 90 0.615 10.408 11.225 687 H GLY 91 H GLY 91 0.725 11.104 8.591 688 HA2 GLY 91 HA2 GLY 91 1.645 13.847 8.689 689 HA3 GLY 91 HA3 GLY 91 2.321 12.549 7.722 690 H GLY 92 H GLY 92 -0.737 12.225 6.960 691 HA2 GLY 92 HA2 GLY 92 -2.200 13.130 5.402 692 HA3 GLY 92 HA3 GLY 92 -1.140 14.523 5.259 693 H TYR 93 H TYR 93 -0.087 11.196 4.821 694 HA TYR 93 HA TYR 93 0.528 11.843 2.040 695 HB2 TYR 93 HB2 TYR 93 1.613 9.743 3.905 696 HB3 TYR 93 HB3 TYR 93 1.913 9.695 2.183 697 HD1 TYR 93 HD1 TYR 93 2.507 11.693 5.257 698 HD2 TYR 93 HD2 TYR 93 3.547 11.067 1.189 699 HE1 TYR 93 HE1 TYR 93 4.450 13.170 5.529 700 HE2 TYR 93 HE2 TYR 93 5.495 12.530 1.446 701 HH TYR 93 HH TYR 93 6.780 13.391 4.356 702 H ARG 94 H ARG 94 -0.277 10.757 0.382 703 HA ARG 94 HA ARG 94 -2.520 9.038 0.953 704 HB2 ARG 94 HB2 ARG 94 -3.263 9.329 -1.273 705 HB3 ARG 94 HB3 ARG 94 -2.755 10.897 -0.682 706 HG2 ARG 94 HG2 ARG 94 -0.776 10.835 -2.025 707 HG3 ARG 94 HG3 ARG 94 -1.060 9.139 -2.434 708 HD2 ARG 94 HD2 ARG 94 -2.795 11.478 -3.192 709 HD3 ARG 94 HD3 ARG 94 -1.777 10.508 -4.266 710 HE ARG 94 HE ARG 94 -3.270 8.562 -3.436 711 HH11 ARG 94 HH11 ARG 94 -4.537 11.832 -3.967 712 HH12 ARG 94 HH12 ARG 94 -6.121 11.247 -4.181 713 HH21 ARG 94 HH21 ARG 94 -5.309 7.867 -3.636 714 HH22 ARG 94 HH22 ARG 94 -6.594 8.961 -3.997 715 H ASP 95 H ASP 95 -2.892 7.315 -0.881 716 HA ASP 95 HA ASP 95 -1.496 5.045 -0.151 717 HB2 ASP 95 HB2 ASP 95 -2.664 3.990 -2.058 718 HB3 ASP 95 HB3 ASP 95 -3.749 5.041 -1.153 719 H THR 96 H THR 96 -1.135 7.047 -2.991 720 HA THR 96 HA THR 96 0.712 5.471 -4.336 721 HB THR 96 HB THR 96 0.360 8.462 -4.481 722 HG1 THR 96 HG1 THR 96 -1.321 6.389 -5.014 723 HG21 THR 96 HG21 THR 96 1.114 8.166 -6.792 724 HG22 THR 96 HG22 THR 96 1.225 6.419 -6.543 725 HG23 THR 96 HG23 THR 96 2.314 7.492 -5.679 726 H GLU 97 H GLU 97 1.084 8.099 -2.009 727 HA GLU 97 HA GLU 97 3.907 8.248 -2.223 728 HB2 GLU 97 HB2 GLU 97 2.106 9.103 0.040 729 HB3 GLU 97 HB3 GLU 97 3.826 9.449 -0.067 730 HG2 GLU 97 HG2 GLU 97 1.680 10.415 -1.939 731 HG3 GLU 97 HG3 GLU 97 2.513 11.373 -0.720 732 H ILE 98 H ILE 98 1.685 6.382 -0.250 733 HA ILE 98 HA ILE 98 3.485 5.432 1.708 734 HB ILE 98 HB ILE 98 1.259 3.767 0.527 735 HG12 ILE 98 HG12 ILE 98 0.142 5.837 1.060 736 HG13 ILE 98 HG13 ILE 98 -0.187 4.661 2.339 737 HG21 ILE 98 HG21 ILE 98 1.108 2.814 2.764 738 HG22 ILE 98 HG22 ILE 98 2.444 3.851 3.271 739 HG23 ILE 98 HG23 ILE 98 2.713 2.607 2.046 740 HD11 ILE 98 HD11 ILE 98 1.813 6.878 2.494 741 HD12 ILE 98 HD12 ILE 98 1.410 5.729 3.769 742 HD13 ILE 98 HD13 ILE 98 0.199 6.885 3.208 743 H MET 99 H MET 99 2.424 4.080 -1.354 744 HA MET 99 HA MET 99 4.175 1.858 -1.131 745 HB2 MET 99 HB2 MET 99 2.545 2.774 -3.492 746 HB3 MET 99 HB3 MET 99 3.368 1.223 -3.359 747 HG2 MET 99 HG2 MET 99 2.015 0.737 -1.347 748 HG3 MET 99 HG3 MET 99 1.124 2.228 -1.633 749 HE1 MET 99 HE1 MET 99 -1.169 1.189 -1.728 750 HE2 MET 99 HE2 MET 99 -0.455 -0.351 -1.255 751 HE3 MET 99 HE3 MET 99 -1.581 -0.284 -2.614 752 H ARG 100 H ARG 100 4.553 5.024 -2.250 753 HA ARG 100 HA ARG 100 6.360 4.799 -4.342 754 HB2 ARG 100 HB2 ARG 100 5.208 6.834 -3.643 755 HB3 ARG 100 HB3 ARG 100 6.170 6.877 -2.180 756 HG2 ARG 100 HG2 ARG 100 8.174 7.190 -3.531 757 HG3 ARG 100 HG3 ARG 100 7.169 7.189 -4.987 758 HD2 ARG 100 HD2 ARG 100 5.890 9.076 -4.081 759 HD3 ARG 100 HD3 ARG 100 6.952 9.095 -2.673 760 HE ARG 100 HE ARG 100 8.504 9.231 -4.974 761 HH11 ARG 100 HH11 ARG 100 6.173 11.282 -3.192 762 HH12 ARG 100 HH12 ARG 100 6.894 12.709 -3.756 763 HH21 ARG 100 HH21 ARG 100 9.414 11.211 -5.701 764 HH22 ARG 100 HH22 ARG 100 8.764 12.689 -5.189 765 H TRP 101 H TRP 101 7.192 5.499 -0.948 766 HA TRP 101 HA TRP 101 9.929 4.867 -1.369 767 HB2 TRP 101 HB2 TRP 101 10.032 4.926 1.210 768 HB3 TRP 101 HB3 TRP 101 9.604 6.409 0.373 769 HD1 TRP 101 HD1 TRP 101 7.237 7.413 0.814 770 HE1 TRP 101 HE1 TRP 101 5.373 6.909 2.478 771 HE3 TRP 101 HE3 TRP 101 8.862 2.846 2.530 772 HZ2 TRP 101 HZ2 TRP 101 4.681 4.866 4.311 773 HZ3 TRP 101 HZ3 TRP 101 7.545 1.719 4.244 774 HH2 TRP 101 HH2 TRP 101 5.495 2.698 5.113 775 H LEU 102 H LEU 102 7.210 3.064 -0.397 776 HA LEU 102 HA LEU 102 8.425 0.950 0.981 777 HB2 LEU 102 HB2 LEU 102 6.027 1.712 0.992 778 HB3 LEU 102 HB3 LEU 102 5.888 0.975 -0.570 779 HG LEU 102 HG LEU 102 6.070 -1.215 0.298 780 HD11 LEU 102 HD11 LEU 102 6.705 0.094 2.956 781 HD12 LEU 102 HD12 LEU 102 7.810 -0.882 1.966 782 HD13 LEU 102 HD13 LEU 102 6.408 -1.628 2.716 783 HD21 LEU 102 HD21 LEU 102 3.922 -0.114 0.513 784 HD22 LEU 102 HD22 LEU 102 4.418 0.495 2.093 785 HD23 LEU 102 HD23 LEU 102 4.192 -1.247 1.854 786 H PHE 103 H PHE 103 7.637 1.364 -2.438 787 HA PHE 103 HA PHE 103 8.580 -1.323 -2.979 788 HB2 PHE 103 HB2 PHE 103 7.152 0.698 -4.654 789 HB3 PHE 103 HB3 PHE 103 7.901 -0.724 -5.370 790 HD1 PHE 103 HD1 PHE 103 5.364 0.364 -2.883 791 HD2 PHE 103 HD2 PHE 103 6.848 -2.786 -5.321 792 HE1 PHE 103 HE1 PHE 103 3.356 -0.955 -2.400 793 HE2 PHE 103 HE2 PHE 103 4.852 -4.112 -4.827 794 HZ PHE 103 HZ PHE 103 3.095 -3.197 -3.384 795 H THR 104 H THR 104 10.087 1.541 -2.646 796 HA THR 104 HA THR 104 11.788 1.285 -4.953 797 HB THR 104 HB THR 104 11.838 3.275 -2.665 798 HG1 THR 104 HG1 THR 104 10.118 3.807 -3.923 799 HG21 THR 104 HG21 THR 104 14.093 3.000 -3.660 800 HG22 THR 104 HG22 THR 104 13.403 4.572 -4.068 801 HG23 THR 104 HG23 THR 104 13.412 3.273 -5.262 802 HA PRO 105 HA PRO 105 14.541 -1.421 -2.615 803 HB2 PRO 105 HB2 PRO 105 16.281 -1.841 -4.678 804 HB3 PRO 105 HB3 PRO 105 14.761 -2.725 -4.506 805 HG2 PRO 105 HG2 PRO 105 15.411 -0.399 -6.261 806 HG3 PRO 105 HG3 PRO 105 14.424 -1.825 -6.609 807 HD2 PRO 105 HD2 PRO 105 13.387 0.597 -5.976 808 HD3 PRO 105 HD3 PRO 105 12.563 -0.933 -5.604 809 H ASP 106 H ASP 106 16.409 -0.959 -1.523 810 HA ASP 106 HA ASP 106 17.715 1.576 -2.277 811 HB2 ASP 106 HB2 ASP 106 16.538 1.521 -0.049 812 HB3 ASP 106 HB3 ASP 106 17.695 0.294 0.450 813 HA PRO 107 HA PRO 107 21.329 -0.939 -3.284 814 HB2 PRO 107 HB2 PRO 107 22.730 1.603 -2.760 815 HB3 PRO 107 HB3 PRO 107 22.772 0.582 -4.200 816 HG2 PRO 107 HG2 PRO 107 21.455 2.899 -4.166 817 HG3 PRO 107 HG3 PRO 107 20.826 1.490 -5.050 818 HD2 PRO 107 HD2 PRO 107 19.956 2.670 -2.461 819 HD3 PRO 107 HD3 PRO 107 19.003 1.899 -3.751 820 H SER 108 H SER 108 21.088 1.136 -0.476 821 HA SER 108 HA SER 108 23.405 -0.127 0.772 822 HB2 SER 108 HB2 SER 108 21.675 2.157 1.723 823 HB3 SER 108 HB3 SER 108 23.209 1.634 2.426 824 HG SER 108 HG SER 108 22.681 3.146 0.194 825 H LEU 109 H LEU 109 20.340 -1.008 0.372 826 HA LEU 109 HA LEU 109 20.061 -1.871 3.144 827 HB2 LEU 109 HB2 LEU 109 18.250 -0.385 2.337 828 HB3 LEU 109 HB3 LEU 109 17.912 -1.560 1.077 829 HG LEU 109 HG LEU 109 17.201 -3.186 2.722 830 HD11 LEU 109 HD11 LEU 109 16.983 -2.577 5.077 831 HD12 LEU 109 HD12 LEU 109 17.821 -1.050 4.758 832 HD13 LEU 109 HD13 LEU 109 18.665 -2.589 4.551 833 HD21 LEU 109 HD21 LEU 109 15.954 -0.483 3.105 834 HD22 LEU 109 HD22 LEU 109 15.220 -2.030 3.539 835 HD23 LEU 109 HD23 LEU 109 15.565 -1.659 1.844 836 H THR 110 H THR 110 20.265 -3.872 3.495 837 HA THR 110 HA THR 110 20.046 -5.813 1.295 838 HB THR 110 HB THR 110 21.896 -5.984 3.695 839 HG1 THR 110 HG1 THR 110 22.649 -4.305 2.615 840 HG21 THR 110 HG21 THR 110 21.924 -7.347 0.992 841 HG22 THR 110 HG22 THR 110 21.344 -8.070 2.492 842 HG23 THR 110 HG23 THR 110 23.047 -7.637 2.324 843 H ILE 111 H ILE 111 18.513 -7.209 1.638 844 HA ILE 111 HA ILE 111 17.471 -7.626 4.366 845 HB ILE 111 HB ILE 111 15.897 -7.349 1.800 846 HG12 ILE 111 HG12 ILE 111 16.047 -5.439 4.141 847 HG13 ILE 111 HG13 ILE 111 16.749 -5.189 2.548 848 HG21 ILE 111 HG21 ILE 111 14.829 -8.895 3.289 849 HG22 ILE 111 HG22 ILE 111 13.902 -7.393 3.167 850 HG23 ILE 111 HG23 ILE 111 14.883 -7.707 4.605 851 HD11 ILE 111 HD11 ILE 111 13.813 -5.483 3.105 852 HD12 ILE 111 HD12 ILE 111 14.550 -5.100 1.556 853 HD13 ILE 111 HD13 ILE 111 14.650 -3.944 2.885 854 H THR 112 H THR 112 16.722 -9.719 4.643 855 HA THR 112 HA THR 112 17.191 -11.531 2.408 856 HB THR 112 HB THR 112 18.907 -11.960 4.137 857 HG1 THR 112 HG1 THR 112 18.614 -13.874 3.316 858 HG21 THR 112 HG21 THR 112 18.275 -12.847 6.365 859 HG22 THR 112 HG22 THR 112 16.577 -12.562 5.979 860 HG23 THR 112 HG23 THR 112 17.684 -11.200 6.133 861 H ARG 113 H ARG 113 15.692 -13.255 2.286 862 HA ARG 113 HA ARG 113 13.293 -12.928 3.861 863 HB2 ARG 113 HB2 ARG 113 11.835 -12.692 1.875 864 HB3 ARG 113 HB3 ARG 113 12.924 -11.329 2.046 865 HG2 ARG 113 HG2 ARG 113 14.369 -12.304 0.295 866 HG3 ARG 113 HG3 ARG 113 13.222 -13.629 0.120 867 HD2 ARG 113 HD2 ARG 113 11.465 -11.956 -0.471 868 HD3 ARG 113 HD3 ARG 113 12.694 -10.693 -0.415 869 HE ARG 113 HE ARG 113 13.509 -12.777 -2.130 870 HH11 ARG 113 HH11 ARG 113 11.408 -9.880 -2.104 871 HH12 ARG 113 HH12 ARG 113 11.226 -9.869 -3.794 872 HH21 ARG 113 HH21 ARG 113 13.314 -12.625 -4.433 873 HH22 ARG 113 HH22 ARG 113 12.357 -11.388 -5.151 874 H ASP 114 H ASP 114 11.624 -14.591 2.986 875 HA ASP 114 HA ASP 114 12.667 -17.150 3.359 876 HB2 ASP 114 HB2 ASP 114 10.335 -16.640 3.803 877 HB3 ASP 114 HB3 ASP 114 10.062 -16.269 2.107 878 H GLY 115 H GLY 115 13.612 -18.546 2.028 879 HA2 GLY 115 HA2 GLY 115 13.916 -19.644 -0.040 880 HA3 GLY 115 HA3 GLY 115 13.251 -18.234 -0.859 881 H SER 116 H SER 116 15.207 -16.945 1.357 882 HA SER 116 HA SER 116 17.572 -17.128 -0.342 883 HB2 SER 116 HB2 SER 116 16.529 -14.753 1.210 884 HB3 SER 116 HB3 SER 116 18.052 -14.799 0.323 885 HG SER 116 HG SER 116 15.970 -15.611 -1.213 886 H ARG 117 H ARG 117 19.069 -18.202 0.672 887 HA ARG 117 HA ARG 117 19.268 -18.415 3.584 888 HB2 ARG 117 HB2 ARG 117 21.457 -19.059 1.575 889 HB3 ARG 117 HB3 ARG 117 21.330 -19.641 3.212 890 HG2 ARG 117 HG2 ARG 117 20.883 -21.462 1.833 891 HG3 ARG 117 HG3 ARG 117 19.311 -20.933 2.454 892 HD2 ARG 117 HD2 ARG 117 19.333 -21.553 0.028 893 HD3 ARG 117 HD3 ARG 117 18.742 -19.934 0.357 894 HE ARG 117 HE ARG 117 21.201 -19.276 -0.242 895 HH11 ARG 117 HH11 ARG 117 19.431 -21.907 -1.813 896 HH12 ARG 117 HH12 ARG 117 20.254 -21.705 -3.291 897 HH21 ARG 117 HH21 ARG 117 22.246 -19.022 -2.171 898 HH22 ARG 117 HH22 ARG 117 21.896 -20.008 -3.528 899 H ASP 118 H ASP 118 20.730 -17.030 0.897 900 HA ASP 118 HA ASP 118 22.756 -15.434 2.086 901 HB2 ASP 118 HB2 ASP 118 21.471 -15.069 -0.622 902 HB3 ASP 118 HB3 ASP 118 23.098 -14.619 -0.133 903 H ALA 119 H ALA 119 22.599 -12.990 1.224 904 HA ALA 119 HA ALA 119 20.020 -11.997 2.128 905 HB1 ALA 119 HB1 ALA 119 21.162 -9.991 2.815 906 HB2 ALA 119 HB2 ALA 119 22.679 -10.574 2.141 907 HB3 ALA 119 HB3 ALA 119 21.963 -11.385 3.538 908 H VAL 120 H VAL 120 19.083 -10.281 0.953 909 HA VAL 120 HA VAL 120 19.887 -10.250 -1.837 910 HB VAL 120 HB VAL 120 17.302 -9.319 -0.528 911 HG11 VAL 120 HG11 VAL 120 17.949 -9.741 -3.440 912 HG12 VAL 120 HG12 VAL 120 17.772 -8.185 -2.631 913 HG13 VAL 120 HG13 VAL 120 16.382 -9.258 -2.785 914 HG21 VAL 120 HG21 VAL 120 17.831 -11.865 -2.049 915 HG22 VAL 120 HG22 VAL 120 16.258 -11.332 -1.458 916 HG23 VAL 120 HG23 VAL 120 17.541 -11.739 -0.312 917 H SER 121 H SER 121 21.009 -8.521 -2.389 918 HA SER 121 HA SER 121 21.051 -6.164 -0.730 919 HB2 SER 121 HB2 SER 121 22.389 -6.731 -3.380 920 HB3 SER 121 HB3 SER 121 22.796 -5.444 -2.239 921 HG SER 121 HG SER 121 22.757 -7.959 -1.160 922 H ASN 122 H ASN 122 20.430 -4.099 -1.584 923 HA ASN 122 HA ASN 122 18.788 -2.856 -2.189 924 HB2 ASN 122 HB2 ASN 122 18.688 -2.058 -4.472 925 HB3 ASN 122 HB3 ASN 122 20.342 -2.431 -4.082 926 HD21 ASN 122 HD21 ASN 122 19.965 -5.351 -4.715 927 HD22 ASN 122 HD22 ASN 122 19.903 -5.406 -6.423 928 H ALA 123 H ALA 123 17.450 -4.238 -1.024 929 HA ALA 123 HA ALA 123 15.354 -5.305 -2.728 930 HB1 ALA 123 HB1 ALA 123 16.233 -6.879 -1.105 931 HB2 ALA 123 HB2 ALA 123 14.599 -6.408 -0.621 932 HB3 ALA 123 HB3 ALA 123 16.009 -5.711 0.190 933 H ARG 124 H ARG 124 13.149 -4.920 -1.483 934 HA ARG 124 HA ARG 124 13.114 -2.026 -1.050 935 HB2 ARG 124 HB2 ARG 124 10.662 -2.214 -1.673 936 HB3 ARG 124 HB3 ARG 124 11.790 -2.550 -2.977 937 HG2 ARG 124 HG2 ARG 124 11.438 -4.912 -2.741 938 HG3 ARG 124 HG3 ARG 124 10.439 -4.662 -1.314 939 HD2 ARG 124 HD2 ARG 124 9.119 -5.122 -3.335 940 HD3 ARG 124 HD3 ARG 124 8.765 -3.549 -2.639 941 HE ARG 124 HE ARG 124 10.355 -2.682 -4.416 942 HH11 ARG 124 HH11 ARG 124 8.574 -5.683 -4.956 943 HH12 ARG 124 HH12 ARG 124 8.187 -5.403 -6.566 944 HH21 ARG 124 HH21 ARG 124 9.911 -2.220 -6.656 945 HH22 ARG 124 HH22 ARG 124 8.987 -3.322 -7.571 946 HA PRO 125 HA PRO 125 11.926 -2.460 3.179 947 HB2 PRO 125 HB2 PRO 125 9.622 -0.661 2.523 948 HB3 PRO 125 HB3 PRO 125 10.794 -0.542 3.835 949 HG2 PRO 125 HG2 PRO 125 11.010 1.025 1.710 950 HG3 PRO 125 HG3 PRO 125 12.453 0.314 2.457 951 HD2 PRO 125 HD2 PRO 125 11.061 -0.436 -0.073 952 HD3 PRO 125 HD3 PRO 125 12.791 -0.463 0.323 953 H VAL 126 H VAL 126 9.556 -3.043 0.699 954 HA VAL 126 HA VAL 126 7.481 -4.228 2.186 955 HB VAL 126 HB VAL 126 8.449 -4.941 -0.606 956 HG11 VAL 126 HG11 VAL 126 7.108 -6.739 0.313 957 HG12 VAL 126 HG12 VAL 126 6.252 -5.862 -0.961 958 HG13 VAL 126 HG13 VAL 126 5.831 -5.584 0.730 959 HG21 VAL 126 HG21 VAL 126 6.631 -3.543 -1.387 960 HG22 VAL 126 HG22 VAL 126 7.736 -2.617 -0.367 961 HG23 VAL 126 HG23 VAL 126 6.190 -3.186 0.282 962 H ASP 127 H ASP 127 10.497 -5.570 0.882 963 HA ASP 127 HA ASP 127 10.036 -8.289 1.447 964 HB2 ASP 127 HB2 ASP 127 12.649 -6.764 1.264 965 HB3 ASP 127 HB3 ASP 127 12.525 -8.514 1.334 966 H ALA 128 H ALA 128 11.412 -5.675 3.231 967 HA ALA 128 HA ALA 128 12.307 -7.203 5.456 968 HB1 ALA 128 HB1 ALA 128 12.543 -5.029 6.597 969 HB2 ALA 128 HB2 ALA 128 11.693 -4.249 5.266 970 HB3 ALA 128 HB3 ALA 128 13.264 -5.002 4.991 971 H LEU 129 H LEU 129 9.413 -5.276 4.777 972 HA LEU 129 HA LEU 129 8.167 -5.368 7.248 973 HB2 LEU 129 HB2 LEU 129 7.425 -3.855 5.705 974 HB3 LEU 129 HB3 LEU 129 7.413 -5.029 4.410 975 HG LEU 129 HG LEU 129 5.536 -6.106 5.568 976 HD11 LEU 129 HD11 LEU 129 5.729 -5.104 7.755 977 HD12 LEU 129 HD12 LEU 129 4.165 -4.664 7.069 978 HD13 LEU 129 HD13 LEU 129 5.479 -3.481 7.098 979 HD21 LEU 129 HD21 LEU 129 3.917 -4.512 4.567 980 HD22 LEU 129 HD22 LEU 129 5.351 -4.858 3.580 981 HD23 LEU 129 HD23 LEU 129 5.256 -3.340 4.464 982 H HIS 130 H HIS 130 7.931 -7.528 4.444 983 HA HIS 130 HA HIS 130 5.855 -9.123 5.512 984 HB2 HIS 130 HB2 HIS 130 6.233 -8.941 3.089 985 HB3 HIS 130 HB3 HIS 130 7.826 -9.649 3.255 986 HD1 HIS 130 HD1 HIS 130 4.320 -10.565 2.527 987 HD2 HIS 130 HD2 HIS 130 7.740 -12.484 3.932 988 HE1 HIS 130 HE1 HIS 130 3.936 -13.017 2.195 989 H ALA 131 H ALA 131 9.164 -9.016 5.910 990 HA ALA 131 HA ALA 131 9.379 -11.790 6.918 991 HB1 ALA 131 HB1 ALA 131 11.792 -11.566 6.727 992 HB2 ALA 131 HB2 ALA 131 11.614 -9.866 6.297 993 HB3 ALA 131 HB3 ALA 131 11.011 -11.117 5.210 994 H HIS 132 H HIS 132 8.476 -9.103 8.252 995 HA HIS 132 HA HIS 132 8.313 -8.260 10.344 996 HB2 HIS 132 HB2 HIS 132 7.961 -10.669 10.969 997 HB3 HIS 132 HB3 HIS 132 9.688 -10.835 11.233 998 HD1 HIS 132 HD1 HIS 132 10.481 -10.362 13.598 999 HD2 HIS 132 HD2 HIS 132 6.691 -8.833 12.850 1000 HE1 HIS 132 HE1 HIS 132 9.637 -9.504 15.793 1001 H GLN 133 H GLN 133 10.615 -7.774 8.689 1002 HA GLN 133 HA GLN 133 12.657 -6.891 10.612 1003 HB2 GLN 133 HB2 GLN 133 12.667 -6.987 7.574 1004 HB3 GLN 133 HB3 GLN 133 14.020 -6.444 8.558 1005 HG2 GLN 133 HG2 GLN 133 14.293 -8.658 9.470 1006 HG3 GLN 133 HG3 GLN 133 12.849 -9.214 8.628 1007 HE21 GLN 133 HE21 GLN 133 13.918 -10.779 7.548 1008 HE22 GLN 133 HE22 GLN 133 14.963 -10.492 6.216 1009 H ALA 134 H ALA 134 10.046 -5.974 10.313 1010 HA ALA 134 HA ALA 134 9.438 -3.883 8.669 1011 HB1 ALA 134 HB1 ALA 134 7.577 -3.439 10.096 1012 HB2 ALA 134 HB2 ALA 134 8.330 -4.332 11.416 1013 HB3 ALA 134 HB3 ALA 134 7.824 -5.178 9.955 1014 H ARG 135 H ARG 135 11.383 -3.643 11.599 1015 HA ARG 135 HA ARG 135 10.741 -0.995 12.168 1016 HB2 ARG 135 HB2 ARG 135 13.247 -2.509 12.845 1017 HB3 ARG 135 HB3 ARG 135 12.976 -0.848 13.353 1018 HG2 ARG 135 HG2 ARG 135 10.880 -1.578 14.449 1019 HG3 ARG 135 HG3 ARG 135 11.299 -3.243 14.051 1020 HD2 ARG 135 HD2 ARG 135 13.319 -3.079 15.379 1021 HD3 ARG 135 HD3 ARG 135 12.990 -1.375 15.701 1022 HE ARG 135 HE ARG 135 10.895 -3.173 16.491 1023 HH11 ARG 135 HH11 ARG 135 13.858 -1.547 17.536 1024 HH12 ARG 135 HH12 ARG 135 13.524 -1.614 19.186 1025 HH21 ARG 135 HH21 ARG 135 10.373 -3.258 18.766 1026 HH22 ARG 135 HH22 ARG 135 11.428 -2.609 19.924 1027 H GLU 136 H GLU 136 13.092 -2.095 9.743 1028 HA GLU 136 HA GLU 136 14.148 0.510 9.265 1029 HB2 GLU 136 HB2 GLU 136 14.406 -2.082 8.088 1030 HB3 GLU 136 HB3 GLU 136 14.025 -0.941 6.809 1031 HG2 GLU 136 HG2 GLU 136 16.327 -0.780 8.741 1032 HG3 GLU 136 HG3 GLU 136 16.404 -1.209 7.040 1033 H VAL 137 H VAL 137 11.345 -1.194 8.243 1034 HA VAL 137 HA VAL 137 10.519 0.520 6.113 1035 HB VAL 137 HB VAL 137 8.756 -1.245 7.810 1036 HG11 VAL 137 HG11 VAL 137 7.548 0.212 6.303 1037 HG12 VAL 137 HG12 VAL 137 7.411 -1.466 5.777 1038 HG13 VAL 137 HG13 VAL 137 8.509 -0.370 4.942 1039 HG21 VAL 137 HG21 VAL 137 10.427 -2.055 5.440 1040 HG22 VAL 137 HG22 VAL 137 9.237 -3.075 6.246 1041 HG23 VAL 137 HG23 VAL 137 10.676 -2.547 7.111 1042 H VAL 138 H VAL 138 9.569 0.085 9.487 1043 HA VAL 138 HA VAL 138 7.702 2.180 9.592 1044 HB VAL 138 HB VAL 138 9.346 1.050 11.883 1045 HG11 VAL 138 HG11 VAL 138 8.290 3.184 12.453 1046 HG12 VAL 138 HG12 VAL 138 7.523 1.857 13.328 1047 HG13 VAL 138 HG13 VAL 138 6.727 2.565 11.922 1048 HG21 VAL 138 HG21 VAL 138 7.401 -0.386 12.328 1049 HG22 VAL 138 HG22 VAL 138 8.097 -0.699 10.736 1050 HG23 VAL 138 HG23 VAL 138 6.612 0.242 10.880 1051 H ARG 139 H ARG 139 11.152 2.050 10.400 1052 HA ARG 139 HA ARG 139 11.510 4.666 11.237 1053 HB2 ARG 139 HB2 ARG 139 13.269 3.046 11.462 1054 HB3 ARG 139 HB3 ARG 139 13.373 2.845 9.721 1055 HG2 ARG 139 HG2 ARG 139 14.039 5.252 9.564 1056 HG3 ARG 139 HG3 ARG 139 14.153 5.265 11.324 1057 HD2 ARG 139 HD2 ARG 139 15.867 3.615 11.288 1058 HD3 ARG 139 HD3 ARG 139 15.645 3.353 9.557 1059 HE ARG 139 HE ARG 139 16.547 5.899 10.688 1060 HH11 ARG 139 HH11 ARG 139 16.934 3.252 8.310 1061 HH12 ARG 139 HH12 ARG 139 18.123 4.058 7.418 1062 HH21 ARG 139 HH21 ARG 139 18.206 7.007 9.408 1063 HH22 ARG 139 HH22 ARG 139 18.873 6.221 8.058 1064 H ARG 140 H ARG 140 11.734 3.329 7.937 1065 HA ARG 140 HA ARG 140 12.316 5.801 6.737 1066 HB2 ARG 140 HB2 ARG 140 11.224 3.265 5.555 1067 HB3 ARG 140 HB3 ARG 140 11.618 4.683 4.587 1068 HG2 ARG 140 HG2 ARG 140 13.938 4.575 5.392 1069 HG3 ARG 140 HG3 ARG 140 13.534 3.127 6.315 1070 HD2 ARG 140 HD2 ARG 140 12.936 1.987 4.292 1071 HD3 ARG 140 HD3 ARG 140 13.306 3.421 3.334 1072 HE ARG 140 HE ARG 140 15.357 2.057 4.965 1073 HH11 ARG 140 HH11 ARG 140 14.275 3.151 1.752 1074 HH12 ARG 140 HH12 ARG 140 15.838 3.168 1.085 1075 HH21 ARG 140 HH21 ARG 140 17.490 2.062 3.978 1076 HH22 ARG 140 HH22 ARG 140 17.661 2.565 2.333 1077 H ALA 141 H ALA 141 9.318 4.216 7.495 1078 HA ALA 141 HA ALA 141 7.558 5.906 6.105 1079 HB1 ALA 141 HB1 ALA 141 7.214 4.344 8.665 1080 HB2 ALA 141 HB2 ALA 141 6.870 3.757 7.039 1081 HB3 ALA 141 HB3 ALA 141 5.893 5.048 7.743 1082 H GLN 142 H GLN 142 8.815 5.925 9.393 1083 HA GLN 142 HA GLN 142 7.579 8.260 10.331 1084 HB2 GLN 142 HB2 GLN 142 10.155 6.921 11.155 1085 HB3 GLN 142 HB3 GLN 142 9.404 8.222 12.060 1086 HG2 GLN 142 HG2 GLN 142 7.493 6.874 12.549 1087 HG3 GLN 142 HG3 GLN 142 8.047 5.607 11.458 1088 HE21 GLN 142 HE21 GLN 142 7.396 5.457 14.265 1089 HE22 GLN 142 HE22 GLN 142 8.813 4.867 15.063 1090 H ALA 143 H ALA 143 10.768 7.726 8.927 1091 HA ALA 143 HA ALA 143 11.628 10.405 9.068 1092 HB1 ALA 143 HB1 ALA 143 13.167 8.494 8.884 1093 HB2 ALA 143 HB2 ALA 143 13.473 9.721 7.656 1094 HB3 ALA 143 HB3 ALA 143 12.621 8.238 7.227 1095 H MET 144 H MET 144 9.560 8.817 6.873 1096 HA MET 144 HA MET 144 9.965 10.654 4.701 1097 HB2 MET 144 HB2 MET 144 9.177 8.341 4.316 1098 HB3 MET 144 HB3 MET 144 7.707 8.701 5.206 1099 HG2 MET 144 HG2 MET 144 7.271 8.759 2.841 1100 HG3 MET 144 HG3 MET 144 7.117 10.382 3.511 1101 HE1 MET 144 HE1 MET 144 7.378 9.787 0.374 1102 HE2 MET 144 HE2 MET 144 8.510 11.057 -0.097 1103 HE3 MET 144 HE3 MET 144 7.221 11.407 1.051 1104 H ALA 145 H ALA 145 7.551 10.176 7.239 1105 HA ALA 145 HA ALA 145 6.075 12.445 6.290 1106 HB1 ALA 145 HB1 ALA 145 5.585 10.846 8.780 1107 HB2 ALA 145 HB2 ALA 145 4.882 10.515 7.196 1108 HB3 ALA 145 HB3 ALA 145 4.482 12.008 8.046 1109 H TYR 146 H TYR 146 8.115 11.751 9.120 1110 HA TYR 146 HA TYR 146 8.300 14.631 9.532 1111 HB2 TYR 146 HB2 TYR 146 7.844 12.641 11.778 1112 HB3 TYR 146 HB3 TYR 146 8.086 14.372 11.956 1113 HD1 TYR 146 HD1 TYR 146 6.317 15.921 11.073 1114 HD2 TYR 146 HD2 TYR 146 5.742 11.727 11.390 1115 HE1 TYR 146 HE1 TYR 146 3.884 16.245 10.920 1116 HE2 TYR 146 HE2 TYR 146 3.320 12.039 11.232 1117 HH TYR 146 HH TYR 146 1.708 13.664 11.577 Start of MODEL 6 1 H MET 1 H MET 1 -35.088 2.888 28.609 2 HA MET 1 HA MET 1 -34.102 1.274 29.960 3 HB2 MET 1 HB2 MET 1 -35.193 -0.707 27.925 4 HB3 MET 1 HB3 MET 1 -34.091 -1.103 29.229 5 HG2 MET 1 HG2 MET 1 -35.820 -0.482 30.859 6 HG3 MET 1 HG3 MET 1 -36.922 -0.134 29.524 7 HE1 MET 1 HE1 MET 1 -38.725 -1.773 30.568 8 HE2 MET 1 HE2 MET 1 -37.635 -2.122 31.909 9 HE3 MET 1 HE3 MET 1 -38.384 -3.445 31.015 10 HA PRO 2 HA PRO 2 -30.743 2.079 27.210 11 HB2 PRO 2 HB2 PRO 2 -28.853 0.316 28.161 12 HB3 PRO 2 HB3 PRO 2 -29.234 1.862 28.927 13 HG2 PRO 2 HG2 PRO 2 -30.171 -0.884 29.625 14 HG3 PRO 2 HG3 PRO 2 -29.679 0.431 30.704 15 HD2 PRO 2 HD2 PRO 2 -32.267 -0.167 30.267 16 HD3 PRO 2 HD3 PRO 2 -31.730 1.503 30.533 17 H GLY 3 H GLY 3 -29.951 1.366 25.276 18 HA2 GLY 3 HA2 GLY 3 -29.505 -1.237 24.454 19 HA3 GLY 3 HA3 GLY 3 -31.160 -0.799 24.004 20 H ARG 4 H ARG 4 -29.946 -1.152 21.809 21 HA ARG 4 HA ARG 4 -28.241 1.003 21.066 22 HB2 ARG 4 HB2 ARG 4 -28.397 0.261 18.722 23 HB3 ARG 4 HB3 ARG 4 -27.978 -1.049 19.805 24 HG2 ARG 4 HG2 ARG 4 -30.846 -0.767 19.210 25 HG3 ARG 4 HG3 ARG 4 -29.817 -1.231 17.851 26 HD2 ARG 4 HD2 ARG 4 -29.901 -2.610 20.526 27 HD3 ARG 4 HD3 ARG 4 -30.709 -3.168 19.056 28 HE ARG 4 HE ARG 4 -27.915 -2.710 18.693 29 HH11 ARG 4 HH11 ARG 4 -30.246 -5.109 19.843 30 HH12 ARG 4 HH12 ARG 4 -29.242 -6.439 19.466 31 HH21 ARG 4 HH21 ARG 4 -26.580 -4.468 18.202 32 HH22 ARG 4 HH22 ARG 4 -27.096 -6.064 18.500 33 H ALA 5 H ALA 5 -28.617 2.840 20.102 34 HA ALA 5 HA ALA 5 -31.406 3.648 19.908 35 HB1 ALA 5 HB1 ALA 5 -30.539 5.938 20.049 36 HB2 ALA 5 HB2 ALA 5 -28.891 5.320 20.057 37 HB3 ALA 5 HB3 ALA 5 -29.969 4.968 21.407 38 HA PRO 6 HA PRO 6 -31.047 3.521 15.428 39 HB2 PRO 6 HB2 PRO 6 -33.081 5.685 15.618 40 HB3 PRO 6 HB3 PRO 6 -33.137 4.173 14.707 41 HG2 PRO 6 HG2 PRO 6 -34.574 4.484 16.932 42 HG3 PRO 6 HG3 PRO 6 -33.806 2.934 16.550 43 HD2 PRO 6 HD2 PRO 6 -32.996 5.014 18.525 44 HD3 PRO 6 HD3 PRO 6 -32.892 3.243 18.620 45 H GLY 7 H GLY 7 -29.589 4.580 14.212 46 HA2 GLY 7 HA2 GLY 7 -29.049 7.374 14.889 47 HA3 GLY 7 HA3 GLY 7 -27.781 6.199 14.571 48 H SER 8 H SER 8 -29.539 8.581 13.273 49 HA SER 8 HA SER 8 -29.842 7.628 10.610 50 HB2 SER 8 HB2 SER 8 -31.125 9.581 11.498 51 HB3 SER 8 HB3 SER 8 -29.627 10.498 11.596 52 HG SER 8 HG SER 8 -31.101 9.660 9.379 53 H THR 9 H THR 9 -27.347 9.184 12.407 54 HA THR 9 HA THR 9 -25.568 9.159 10.097 55 HB THR 9 HB THR 9 -25.082 10.292 12.863 56 HG1 THR 9 HG1 THR 9 -26.631 11.236 11.006 57 HG21 THR 9 HG21 THR 9 -23.127 11.362 11.850 58 HG22 THR 9 HG22 THR 9 -23.542 10.650 10.283 59 HG23 THR 9 HG23 THR 9 -23.053 9.609 11.599 60 H LEU 10 H LEU 10 -24.178 7.598 9.891 61 HA LEU 10 HA LEU 10 -23.696 5.664 12.013 62 HB2 LEU 10 HB2 LEU 10 -23.064 5.835 9.116 63 HB3 LEU 10 HB3 LEU 10 -22.348 4.591 10.118 64 HG LEU 10 HG LEU 10 -24.681 3.747 10.565 65 HD11 LEU 10 HD11 LEU 10 -25.429 5.643 8.359 66 HD12 LEU 10 HD12 LEU 10 -25.876 5.785 10.059 67 HD13 LEU 10 HD13 LEU 10 -26.475 4.420 9.102 68 HD21 LEU 10 HD21 LEU 10 -23.232 2.688 8.952 69 HD22 LEU 10 HD22 LEU 10 -23.746 3.829 7.712 70 HD23 LEU 10 HD23 LEU 10 -24.898 2.674 8.378 71 H ALA 11 H ALA 11 -21.489 5.066 12.365 72 HA ALA 11 HA ALA 11 -19.689 7.333 12.280 73 HB1 ALA 11 HB1 ALA 11 -18.106 5.895 13.456 74 HB2 ALA 11 HB2 ALA 11 -19.202 4.526 13.271 75 HB3 ALA 11 HB3 ALA 11 -19.668 5.902 14.289 76 H ARG 12 H ARG 12 -19.650 7.483 10.067 77 HA ARG 12 HA ARG 12 -18.421 5.248 8.678 78 HB2 ARG 12 HB2 ARG 12 -19.070 6.149 6.561 79 HB3 ARG 12 HB3 ARG 12 -20.455 6.311 7.616 80 HG2 ARG 12 HG2 ARG 12 -18.559 8.572 7.003 81 HG3 ARG 12 HG3 ARG 12 -19.991 8.226 6.044 82 HD2 ARG 12 HD2 ARG 12 -21.407 8.660 7.965 83 HD3 ARG 12 HD3 ARG 12 -19.991 8.890 8.993 84 HE ARG 12 HE ARG 12 -19.463 10.708 7.260 85 HH11 ARG 12 HH11 ARG 12 -22.743 9.967 8.373 86 HH12 ARG 12 HH12 ARG 12 -23.290 11.573 8.285 87 HH21 ARG 12 HH21 ARG 12 -20.227 12.914 7.114 88 HH22 ARG 12 HH22 ARG 12 -21.807 13.304 7.559 89 H VAL 13 H VAL 13 -16.420 5.204 8.050 90 HA VAL 13 HA VAL 13 -14.905 7.642 8.250 91 HB VAL 13 HB VAL 13 -12.944 6.198 8.773 92 HG11 VAL 13 HG11 VAL 13 -14.107 7.304 10.589 93 HG12 VAL 13 HG12 VAL 13 -13.562 5.709 11.121 94 HG13 VAL 13 HG13 VAL 13 -15.254 5.973 10.695 95 HG21 VAL 13 HG21 VAL 13 -13.748 4.085 7.833 96 HG22 VAL 13 HG22 VAL 13 -15.000 4.003 9.075 97 HG23 VAL 13 HG23 VAL 13 -13.298 3.891 9.529 98 H GLY 14 H GLY 14 -13.219 7.744 6.774 99 HA2 GLY 14 HA2 GLY 14 -13.596 6.138 4.391 100 HA3 GLY 14 HA3 GLY 14 -13.611 7.901 4.295 101 H SER 15 H SER 15 -11.859 7.213 2.857 102 HA SER 15 HA SER 15 -9.350 7.601 4.157 103 HB2 SER 15 HB2 SER 15 -9.754 5.082 4.255 104 HB3 SER 15 HB3 SER 15 -9.778 5.085 2.498 105 HG SER 15 HG SER 15 -7.747 4.582 3.081 106 H ILE 16 H ILE 16 -7.714 7.307 2.120 107 HA ILE 16 HA ILE 16 -8.762 9.186 0.179 108 HB ILE 16 HB ILE 16 -5.976 7.966 0.311 109 HG12 ILE 16 HG12 ILE 16 -6.410 9.141 2.411 110 HG13 ILE 16 HG13 ILE 16 -5.263 10.054 1.441 111 HG21 ILE 16 HG21 ILE 16 -7.007 10.434 -1.086 112 HG22 ILE 16 HG22 ILE 16 -6.461 8.943 -1.857 113 HG23 ILE 16 HG23 ILE 16 -5.314 9.969 -0.996 114 HD11 ILE 16 HD11 ILE 16 -8.198 10.637 1.749 115 HD12 ILE 16 HD12 ILE 16 -7.065 11.569 0.768 116 HD13 ILE 16 HD13 ILE 16 -6.873 11.517 2.521 117 HA PRO 17 HA PRO 17 -9.741 5.852 -2.662 118 HB2 PRO 17 HB2 PRO 17 -9.690 7.358 -4.977 119 HB3 PRO 17 HB3 PRO 17 -11.083 7.256 -3.895 120 HG2 PRO 17 HG2 PRO 17 -8.979 9.370 -4.085 121 HG3 PRO 17 HG3 PRO 17 -10.725 9.545 -3.839 122 HD2 PRO 17 HD2 PRO 17 -8.991 9.780 -1.817 123 HD3 PRO 17 HD3 PRO 17 -10.588 9.042 -1.586 124 H ALA 18 H ALA 18 -8.730 4.839 -4.540 125 HA ALA 18 HA ALA 18 -5.876 4.812 -4.148 126 HB1 ALA 18 HB1 ALA 18 -7.706 3.218 -5.931 127 HB2 ALA 18 HB2 ALA 18 -7.110 2.733 -4.341 128 HB3 ALA 18 HB3 ALA 18 -5.992 2.898 -5.697 129 H GLY 19 H GLY 19 -4.522 5.914 -5.344 130 HA2 GLY 19 HA2 GLY 19 -5.541 7.265 -7.727 131 HA3 GLY 19 HA3 GLY 19 -4.098 7.701 -6.827 132 H ASP 20 H ASP 20 -2.182 6.401 -7.128 133 HA ASP 20 HA ASP 20 -2.250 5.140 -9.781 134 HB2 ASP 20 HB2 ASP 20 -1.360 7.408 -9.938 135 HB3 ASP 20 HB3 ASP 20 -0.157 7.020 -8.719 136 H ASP 21 H ASP 21 -1.024 3.417 -10.106 137 HA ASP 21 HA ASP 21 -0.000 2.050 -7.784 138 HB2 ASP 21 HB2 ASP 21 -1.231 0.714 -9.369 139 HB3 ASP 21 HB3 ASP 21 -0.186 1.229 -10.685 140 H VAL 22 H VAL 22 2.022 1.666 -7.296 141 HA VAL 22 HA VAL 22 4.035 3.190 -8.802 142 HB VAL 22 HB VAL 22 4.061 2.497 -5.842 143 HG11 VAL 22 HG11 VAL 22 6.300 2.749 -6.789 144 HG12 VAL 22 HG12 VAL 22 5.919 4.038 -5.653 145 HG13 VAL 22 HG13 VAL 22 5.865 4.351 -7.392 146 HG21 VAL 22 HG21 VAL 22 3.453 5.123 -7.195 147 HG22 VAL 22 HG22 VAL 22 3.601 4.878 -5.457 148 HG23 VAL 22 HG23 VAL 22 2.293 4.100 -6.351 149 H LEU 23 H LEU 23 3.118 -0.023 -7.926 150 HA LEU 23 HA LEU 23 5.872 -0.825 -7.943 151 HB2 LEU 23 HB2 LEU 23 5.077 -3.194 -7.570 152 HB3 LEU 23 HB3 LEU 23 4.782 -2.059 -6.293 153 HG LEU 23 HG LEU 23 2.406 -2.028 -6.822 154 HD11 LEU 23 HD11 LEU 23 2.553 -2.460 -9.258 155 HD12 LEU 23 HD12 LEU 23 1.497 -3.629 -8.462 156 HD13 LEU 23 HD13 LEU 23 3.136 -4.087 -8.923 157 HD21 LEU 23 HD21 LEU 23 1.898 -4.308 -6.210 158 HD22 LEU 23 HD22 LEU 23 3.251 -3.656 -5.286 159 HD23 LEU 23 HD23 LEU 23 3.550 -4.780 -6.614 160 H ASP 24 H ASP 24 5.924 -3.254 -9.173 161 HA ASP 24 HA ASP 24 6.214 -2.181 -11.838 162 HB2 ASP 24 HB2 ASP 24 8.017 -3.440 -10.588 163 HB3 ASP 24 HB3 ASP 24 7.043 -4.886 -10.813 164 HA PRO 25 HA PRO 25 2.452 -4.014 -13.467 165 HB2 PRO 25 HB2 PRO 25 4.161 -4.420 -15.879 166 HB3 PRO 25 HB3 PRO 25 2.558 -3.685 -15.751 167 HG2 PRO 25 HG2 PRO 25 4.702 -2.161 -16.059 168 HG3 PRO 25 HG3 PRO 25 3.408 -1.677 -14.952 169 HD2 PRO 25 HD2 PRO 25 6.095 -2.813 -14.337 170 HD3 PRO 25 HD3 PRO 25 5.147 -1.585 -13.469 171 H ASP 26 H ASP 26 5.535 -5.689 -13.636 172 HA ASP 26 HA ASP 26 4.574 -8.207 -14.550 173 HB2 ASP 26 HB2 ASP 26 6.960 -7.618 -14.644 174 HB3 ASP 26 HB3 ASP 26 7.024 -7.557 -12.889 175 H GLU 27 H GLU 27 4.669 -6.647 -11.469 176 HA GLU 27 HA GLU 27 4.223 -8.991 -9.932 177 HB2 GLU 27 HB2 GLU 27 3.996 -6.062 -9.256 178 HB3 GLU 27 HB3 GLU 27 3.807 -7.359 -8.085 179 HG2 GLU 27 HG2 GLU 27 6.089 -8.082 -8.506 180 HG3 GLU 27 HG3 GLU 27 6.271 -6.814 -9.715 181 HA PRO 28 HA PRO 28 -0.193 -8.922 -10.770 182 HB2 PRO 28 HB2 PRO 28 -0.417 -11.100 -8.854 183 HB3 PRO 28 HB3 PRO 28 -0.655 -11.149 -10.604 184 HG2 PRO 28 HG2 PRO 28 1.432 -12.365 -9.352 185 HG3 PRO 28 HG3 PRO 28 1.514 -11.749 -11.011 186 HD2 PRO 28 HD2 PRO 28 2.539 -10.534 -8.482 187 HD3 PRO 28 HD3 PRO 28 3.268 -10.609 -10.106 188 H THR 29 H THR 29 -2.185 -9.024 -9.212 189 HA THR 29 HA THR 29 -1.462 -7.883 -6.653 190 HB THR 29 HB THR 29 -3.322 -6.218 -7.065 191 HG1 THR 29 HG1 THR 29 -3.008 -5.815 -9.631 192 HG21 THR 29 HG21 THR 29 -1.801 -4.581 -8.154 193 HG22 THR 29 HG22 THR 29 -0.731 -5.908 -8.609 194 HG23 THR 29 HG23 THR 29 -0.976 -5.519 -6.908 195 H TYR 30 H TYR 30 -3.567 -7.390 -5.492 196 HA TYR 30 HA TYR 30 -5.382 -9.661 -5.586 197 HB2 TYR 30 HB2 TYR 30 -4.507 -7.826 -3.357 198 HB3 TYR 30 HB3 TYR 30 -5.924 -8.856 -3.233 199 HD1 TYR 30 HD1 TYR 30 -5.327 -11.357 -4.056 200 HD2 TYR 30 HD2 TYR 30 -2.651 -8.602 -2.284 201 HE1 TYR 30 HE1 TYR 30 -3.988 -13.213 -3.270 202 HE2 TYR 30 HE2 TYR 30 -1.271 -10.458 -1.466 203 HH TYR 30 HH TYR 30 -1.732 -13.652 -2.583 204 H ASP 31 H ASP 31 -7.568 -9.048 -4.990 205 HA ASP 31 HA ASP 31 -8.325 -6.298 -5.653 206 HB2 ASP 31 HB2 ASP 31 -8.509 -8.030 -7.589 207 HB3 ASP 31 HB3 ASP 31 -9.781 -8.767 -6.633 208 H LEU 32 H LEU 32 -10.729 -6.187 -4.907 209 HA LEU 32 HA LEU 32 -10.690 -6.777 -2.172 210 HB2 LEU 32 HB2 LEU 32 -13.015 -5.861 -3.866 211 HB3 LEU 32 HB3 LEU 32 -13.149 -6.118 -2.143 212 HG LEU 32 HG LEU 32 -11.372 -4.363 -1.825 213 HD11 LEU 32 HD11 LEU 32 -10.962 -2.774 -3.633 214 HD12 LEU 32 HD12 LEU 32 -11.863 -3.808 -4.744 215 HD13 LEU 32 HD13 LEU 32 -10.359 -4.384 -4.027 216 HD21 LEU 32 HD21 LEU 32 -12.918 -2.494 -2.190 217 HD22 LEU 32 HD22 LEU 32 -13.716 -3.890 -1.466 218 HD23 LEU 32 HD23 LEU 32 -13.933 -3.541 -3.179 219 HA PRO 33 HA PRO 33 -13.918 -10.384 -2.952 220 HB2 PRO 33 HB2 PRO 33 -13.502 -11.576 -5.419 221 HB3 PRO 33 HB3 PRO 33 -14.856 -10.511 -5.029 222 HG2 PRO 33 HG2 PRO 33 -12.273 -9.875 -6.391 223 HG3 PRO 33 HG3 PRO 33 -13.912 -9.312 -6.780 224 HD2 PRO 33 HD2 PRO 33 -12.206 -7.731 -5.508 225 HD3 PRO 33 HD3 PRO 33 -13.918 -7.779 -5.031 226 H ARG 34 H ARG 34 -10.752 -10.384 -4.586 227 HA ARG 34 HA ARG 34 -10.009 -13.021 -4.001 228 HB2 ARG 34 HB2 ARG 34 -9.031 -11.468 -5.718 229 HB3 ARG 34 HB3 ARG 34 -8.282 -10.598 -4.398 230 HG2 ARG 34 HG2 ARG 34 -6.693 -12.053 -5.482 231 HG3 ARG 34 HG3 ARG 34 -6.989 -12.576 -3.818 232 HD2 ARG 34 HD2 ARG 34 -8.257 -14.398 -4.500 233 HD3 ARG 34 HD3 ARG 34 -8.490 -13.715 -6.114 234 HE ARG 34 HE ARG 34 -5.773 -14.046 -5.851 235 HH11 ARG 34 HH11 ARG 34 -8.442 -16.396 -5.536 236 HH12 ARG 34 HH12 ARG 34 -7.541 -17.645 -6.243 237 HH21 ARG 34 HH21 ARG 34 -4.592 -15.787 -6.762 238 HH22 ARG 34 HH22 ARG 34 -5.307 -17.328 -6.929 239 H VAL 35 H VAL 35 -9.567 -9.941 -2.294 240 HA VAL 35 HA VAL 35 -7.950 -11.031 -0.228 241 HB VAL 35 HB VAL 35 -9.657 -8.514 -0.223 242 HG11 VAL 35 HG11 VAL 35 -9.211 -9.232 2.063 243 HG12 VAL 35 HG12 VAL 35 -8.292 -7.774 1.682 244 HG13 VAL 35 HG13 VAL 35 -7.489 -9.349 1.702 245 HG21 VAL 35 HG21 VAL 35 -6.713 -8.925 -0.719 246 HG22 VAL 35 HG22 VAL 35 -7.507 -7.358 -0.556 247 HG23 VAL 35 HG23 VAL 35 -7.928 -8.426 -1.898 248 H ALA 36 H ALA 36 -11.350 -10.456 -0.633 249 HA ALA 36 HA ALA 36 -12.313 -11.208 1.873 250 HB1 ALA 36 HB1 ALA 36 -13.583 -11.574 -0.846 251 HB2 ALA 36 HB2 ALA 36 -13.684 -10.125 0.156 252 HB3 ALA 36 HB3 ALA 36 -14.431 -11.626 0.701 253 H GLU 37 H GLU 37 -11.495 -13.011 -0.959 254 HA GLU 37 HA GLU 37 -12.387 -15.585 -0.294 255 HB2 GLU 37 HB2 GLU 37 -11.649 -14.476 -2.517 256 HB3 GLU 37 HB3 GLU 37 -10.047 -14.899 -2.016 257 HG2 GLU 37 HG2 GLU 37 -10.513 -17.229 -2.055 258 HG3 GLU 37 HG3 GLU 37 -12.228 -16.920 -2.344 259 H LEU 38 H LEU 38 -9.389 -13.851 0.283 260 HA LEU 38 HA LEU 38 -7.933 -16.109 1.253 261 HB2 LEU 38 HB2 LEU 38 -7.384 -13.160 1.468 262 HB3 LEU 38 HB3 LEU 38 -6.305 -14.391 2.079 263 HG LEU 38 HG LEU 38 -7.053 -14.061 -0.827 264 HD11 LEU 38 HD11 LEU 38 -4.574 -13.263 0.694 265 HD12 LEU 38 HD12 LEU 38 -5.781 -12.161 0.034 266 HD13 LEU 38 HD13 LEU 38 -4.797 -13.147 -1.050 267 HD21 LEU 38 HD21 LEU 38 -6.404 -16.360 -0.227 268 HD22 LEU 38 HD22 LEU 38 -4.941 -15.737 0.541 269 HD23 LEU 38 HD23 LEU 38 -5.158 -15.575 -1.197 270 H LEU 39 H LEU 39 -9.510 -13.325 2.752 271 HA LEU 39 HA LEU 39 -8.687 -14.173 5.392 272 HB2 LEU 39 HB2 LEU 39 -10.370 -11.846 4.530 273 HB3 LEU 39 HB3 LEU 39 -9.781 -12.118 6.157 274 HG LEU 39 HG LEU 39 -8.069 -11.579 3.727 275 HD11 LEU 39 HD11 LEU 39 -9.319 -9.628 4.402 276 HD12 LEU 39 HD12 LEU 39 -7.617 -9.433 4.824 277 HD13 LEU 39 HD13 LEU 39 -8.798 -9.842 6.070 278 HD21 LEU 39 HD21 LEU 39 -7.318 -11.879 6.640 279 HD22 LEU 39 HD22 LEU 39 -6.230 -11.366 5.352 280 HD23 LEU 39 HD23 LEU 39 -6.900 -12.993 5.336 281 H GLY 40 H GLY 40 -11.453 -14.682 3.450 282 HA2 GLY 40 HA2 GLY 40 -13.326 -15.931 3.972 283 HA3 GLY 40 HA3 GLY 40 -12.699 -16.119 5.610 284 H VAL 41 H VAL 41 -13.050 -13.104 4.024 285 HA VAL 41 HA VAL 41 -15.270 -12.372 5.836 286 HB VAL 41 HB VAL 41 -14.464 -10.045 5.796 287 HG11 VAL 41 HG11 VAL 41 -13.640 -11.406 7.590 288 HG12 VAL 41 HG12 VAL 41 -12.400 -10.259 7.085 289 HG13 VAL 41 HG13 VAL 41 -12.292 -11.951 6.593 290 HG21 VAL 41 HG21 VAL 41 -12.182 -11.083 4.111 291 HG22 VAL 41 HG22 VAL 41 -12.258 -9.466 4.819 292 HG23 VAL 41 HG23 VAL 41 -13.439 -9.955 3.609 293 HA PRO 42 HA PRO 42 -17.348 -11.303 2.014 294 HB2 PRO 42 HB2 PRO 42 -18.895 -9.185 2.781 295 HB3 PRO 42 HB3 PRO 42 -19.294 -10.856 3.188 296 HG2 PRO 42 HG2 PRO 42 -17.952 -8.764 4.846 297 HG3 PRO 42 HG3 PRO 42 -19.209 -9.928 5.313 298 HD2 PRO 42 HD2 PRO 42 -16.598 -10.302 5.904 299 HD3 PRO 42 HD3 PRO 42 -17.693 -11.654 5.557 300 H VAL 43 H VAL 43 -17.517 -9.524 0.441 301 HA VAL 43 HA VAL 43 -15.154 -8.041 0.097 302 HB VAL 43 HB VAL 43 -17.875 -7.513 -1.173 303 HG11 VAL 43 HG11 VAL 43 -15.123 -6.755 -2.135 304 HG12 VAL 43 HG12 VAL 43 -16.336 -5.650 -1.485 305 HG13 VAL 43 HG13 VAL 43 -16.634 -6.492 -3.007 306 HG21 VAL 43 HG21 VAL 43 -15.614 -9.270 -2.123 307 HG22 VAL 43 HG22 VAL 43 -17.077 -8.904 -3.037 308 HG23 VAL 43 HG23 VAL 43 -17.180 -9.818 -1.534 309 H SER 44 H SER 44 -18.201 -7.298 1.512 310 HA SER 44 HA SER 44 -18.096 -4.562 1.877 311 HB2 SER 44 HB2 SER 44 -20.091 -5.942 2.289 312 HB3 SER 44 HB3 SER 44 -19.304 -6.676 3.681 313 HG SER 44 HG SER 44 -19.325 -3.952 3.797 314 H LYS 45 H LYS 45 -16.681 -7.168 3.894 315 HA LYS 45 HA LYS 45 -15.777 -5.328 5.867 316 HB2 LYS 45 HB2 LYS 45 -15.233 -8.218 5.403 317 HB3 LYS 45 HB3 LYS 45 -14.185 -7.319 6.494 318 HG2 LYS 45 HG2 LYS 45 -16.241 -6.665 7.774 319 HG3 LYS 45 HG3 LYS 45 -17.152 -7.770 6.750 320 HD2 LYS 45 HD2 LYS 45 -15.885 -9.662 7.542 321 HD3 LYS 45 HD3 LYS 45 -14.749 -8.614 8.364 322 HE2 LYS 45 HE2 LYS 45 -17.672 -8.846 9.048 323 HE3 LYS 45 HE3 LYS 45 -16.383 -9.721 9.857 324 HZ1 LYS 45 HZ1 LYS 45 -15.441 -7.670 10.594 325 HZ2 LYS 45 HZ2 LYS 45 -17.040 -7.749 11.066 326 HZ3 LYS 45 HZ3 LYS 45 -16.605 -6.744 9.786 327 H VAL 46 H VAL 46 -14.340 -6.727 3.011 328 HA VAL 46 HA VAL 46 -11.705 -5.737 3.429 329 HB VAL 46 HB VAL 46 -13.123 -6.064 0.761 330 HG11 VAL 46 HG11 VAL 46 -10.861 -6.348 -0.152 331 HG12 VAL 46 HG12 VAL 46 -10.184 -6.042 1.448 332 HG13 VAL 46 HG13 VAL 46 -11.074 -4.770 0.609 333 HG21 VAL 46 HG21 VAL 46 -11.488 -8.070 2.313 334 HG22 VAL 46 HG22 VAL 46 -12.109 -8.304 0.680 335 HG23 VAL 46 HG23 VAL 46 -13.227 -8.138 2.035 336 H ALA 47 H ALA 47 -14.500 -4.333 1.841 337 HA ALA 47 HA ALA 47 -13.369 -1.871 1.148 338 HB1 ALA 47 HB1 ALA 47 -15.542 -2.635 0.303 339 HB2 ALA 47 HB2 ALA 47 -15.669 -1.032 1.031 340 HB3 ALA 47 HB3 ALA 47 -16.236 -2.451 1.914 341 H GLN 48 H GLN 48 -14.799 -3.005 4.135 342 HA GLN 48 HA GLN 48 -14.739 -0.511 5.458 343 HB2 GLN 48 HB2 GLN 48 -14.927 -3.318 6.519 344 HB3 GLN 48 HB3 GLN 48 -14.876 -1.919 7.579 345 HG2 GLN 48 HG2 GLN 48 -16.883 -1.029 6.514 346 HG3 GLN 48 HG3 GLN 48 -16.929 -2.425 5.440 347 HE21 GLN 48 HE21 GLN 48 -18.807 -1.407 7.428 348 HE22 GLN 48 HE22 GLN 48 -19.160 -2.705 8.493 349 H GLN 49 H GLN 49 -12.451 -3.213 5.365 350 HA GLN 49 HA GLN 49 -10.548 -2.251 7.194 351 HB2 GLN 49 HB2 GLN 49 -10.076 -3.825 4.655 352 HB3 GLN 49 HB3 GLN 49 -8.904 -3.621 5.949 353 HG2 GLN 49 HG2 GLN 49 -10.439 -4.704 7.461 354 HG3 GLN 49 HG3 GLN 49 -11.560 -4.999 6.143 355 HE21 GLN 49 HE21 GLN 49 -10.183 -6.915 7.844 356 HE22 GLN 49 HE22 GLN 49 -9.265 -7.936 6.805 357 H LEU 50 H LEU 50 -10.843 -1.821 3.802 358 HA LEU 50 HA LEU 50 -8.619 -0.151 3.303 359 HB2 LEU 50 HB2 LEU 50 -11.283 -0.340 1.917 360 HB3 LEU 50 HB3 LEU 50 -9.946 0.604 1.279 361 HG LEU 50 HG LEU 50 -9.974 -2.396 1.681 362 HD11 LEU 50 HD11 LEU 50 -10.208 -0.739 -0.829 363 HD12 LEU 50 HD12 LEU 50 -11.501 -1.683 -0.086 364 HD13 LEU 50 HD13 LEU 50 -10.092 -2.497 -0.762 365 HD21 LEU 50 HD21 LEU 50 -7.970 -0.596 0.321 366 HD22 LEU 50 HD22 LEU 50 -7.924 -2.356 0.351 367 HD23 LEU 50 HD23 LEU 50 -7.730 -1.449 1.846 368 H ARG 51 H ARG 51 -11.977 0.656 4.041 369 HA ARG 51 HA ARG 51 -11.540 3.453 4.018 370 HB2 ARG 51 HB2 ARG 51 -13.844 1.786 4.985 371 HB3 ARG 51 HB3 ARG 51 -13.821 3.540 5.140 372 HG2 ARG 51 HG2 ARG 51 -13.692 3.812 2.759 373 HG3 ARG 51 HG3 ARG 51 -13.488 2.077 2.529 374 HD2 ARG 51 HD2 ARG 51 -15.772 2.846 2.014 375 HD3 ARG 51 HD3 ARG 51 -15.731 1.672 3.329 376 HE ARG 51 HE ARG 51 -15.698 3.996 4.656 377 HH11 ARG 51 HH11 ARG 51 -17.787 3.024 1.929 378 HH12 ARG 51 HH12 ARG 51 -19.161 3.788 2.556 379 HH21 ARG 51 HH21 ARG 51 -17.555 4.980 5.484 380 HH22 ARG 51 HH22 ARG 51 -19.049 4.951 4.632 381 H GLU 52 H GLU 52 -10.982 1.084 6.482 382 HA GLU 52 HA GLU 52 -11.026 3.157 8.539 383 HB2 GLU 52 HB2 GLU 52 -10.524 0.188 8.796 384 HB3 GLU 52 HB3 GLU 52 -10.592 1.325 10.133 385 HG2 GLU 52 HG2 GLU 52 -12.923 1.825 9.584 386 HG3 GLU 52 HG3 GLU 52 -12.847 0.665 8.258 387 H GLY 53 H GLY 53 -8.935 2.141 6.289 388 HA2 GLY 53 HA2 GLY 53 -6.708 2.622 5.979 389 HA3 GLY 53 HA3 GLY 53 -6.727 3.445 7.534 390 H HIS 54 H HIS 54 -7.656 0.125 7.037 391 HA HIS 54 HA HIS 54 -5.351 -0.765 8.661 392 HB2 HIS 54 HB2 HIS 54 -7.785 -1.300 9.336 393 HB3 HIS 54 HB3 HIS 54 -7.839 -2.331 7.918 394 HD1 HIS 54 HD1 HIS 54 -6.917 -2.372 11.474 395 HD2 HIS 54 HD2 HIS 54 -5.899 -4.468 8.048 396 HE1 HIS 54 HE1 HIS 54 -5.924 -4.537 12.275 397 H LEU 55 H LEU 55 -6.610 -0.605 5.540 398 HA LEU 55 HA LEU 55 -4.445 -2.149 4.436 399 HB2 LEU 55 HB2 LEU 55 -6.306 -3.773 4.790 400 HB3 LEU 55 HB3 LEU 55 -7.382 -2.723 3.907 401 HG LEU 55 HG LEU 55 -6.109 -3.165 1.837 402 HD11 LEU 55 HD11 LEU 55 -4.441 -4.957 1.804 403 HD12 LEU 55 HD12 LEU 55 -4.504 -5.039 3.566 404 HD13 LEU 55 HD13 LEU 55 -3.925 -3.577 2.766 405 HD21 LEU 55 HD21 LEU 55 -7.023 -5.622 3.327 406 HD22 LEU 55 HD22 LEU 55 -6.801 -5.510 1.582 407 HD23 LEU 55 HD23 LEU 55 -8.035 -4.536 2.376 408 H VAL 56 H VAL 56 -4.154 -1.404 2.122 409 HA VAL 56 HA VAL 56 -5.944 0.722 1.318 410 HB VAL 56 HB VAL 56 -4.030 1.735 2.602 411 HG11 VAL 56 HG11 VAL 56 -2.269 0.295 2.059 412 HG12 VAL 56 HG12 VAL 56 -1.831 1.924 1.526 413 HG13 VAL 56 HG13 VAL 56 -2.357 0.714 0.350 414 HG21 VAL 56 HG21 VAL 56 -5.246 3.101 1.015 415 HG22 VAL 56 HG22 VAL 56 -4.198 2.555 -0.293 416 HG23 VAL 56 HG23 VAL 56 -3.540 3.541 1.015 417 H ALA 57 H ALA 57 -5.448 1.365 -1.038 418 HA ALA 57 HA ALA 57 -4.541 -0.940 -2.577 419 HB1 ALA 57 HB1 ALA 57 -7.236 0.384 -2.887 420 HB2 ALA 57 HB2 ALA 57 -6.955 -1.204 -2.182 421 HB3 ALA 57 HB3 ALA 57 -6.594 -0.920 -3.885 422 H VAL 58 H VAL 58 -4.416 -0.404 -4.915 423 HA VAL 58 HA VAL 58 -3.997 2.450 -5.457 424 HB VAL 58 HB VAL 58 -2.204 1.760 -7.092 425 HG11 VAL 58 HG11 VAL 58 -0.450 1.458 -5.409 426 HG12 VAL 58 HG12 VAL 58 -1.715 1.213 -4.188 427 HG13 VAL 58 HG13 VAL 58 -1.577 2.758 -5.024 428 HG21 VAL 58 HG21 VAL 58 -2.346 -0.873 -5.619 429 HG22 VAL 58 HG22 VAL 58 -1.091 -0.412 -6.769 430 HG23 VAL 58 HG23 VAL 58 -2.758 -0.599 -7.311 431 H ARG 59 H ARG 59 -4.029 2.818 -7.917 432 HA ARG 59 HA ARG 59 -6.079 1.063 -9.071 433 HB2 ARG 59 HB2 ARG 59 -6.889 3.323 -8.209 434 HB3 ARG 59 HB3 ARG 59 -5.895 4.050 -9.457 435 HG2 ARG 59 HG2 ARG 59 -7.201 2.768 -11.150 436 HG3 ARG 59 HG3 ARG 59 -8.264 2.238 -9.845 437 HD2 ARG 59 HD2 ARG 59 -7.792 5.052 -10.809 438 HD3 ARG 59 HD3 ARG 59 -9.284 4.130 -10.916 439 HE ARG 59 HE ARG 59 -8.110 4.978 -8.342 440 HH11 ARG 59 HH11 ARG 59 -10.972 4.630 -10.399 441 HH12 ARG 59 HH12 ARG 59 -11.994 5.509 -9.383 442 HH21 ARG 59 HH21 ARG 59 -9.530 6.182 -6.928 443 HH22 ARG 59 HH22 ARG 59 -11.172 6.394 -7.343 444 H ARG 60 H ARG 60 -5.592 0.358 -11.065 445 HA ARG 60 HA ARG 60 -3.929 1.917 -12.811 446 HB2 ARG 60 HB2 ARG 60 -2.259 0.218 -13.244 447 HB3 ARG 60 HB3 ARG 60 -2.251 0.593 -11.534 448 HG2 ARG 60 HG2 ARG 60 -3.475 -1.483 -11.077 449 HG3 ARG 60 HG3 ARG 60 -3.493 -1.849 -12.807 450 HD2 ARG 60 HD2 ARG 60 -1.002 -1.735 -12.782 451 HD3 ARG 60 HD3 ARG 60 -1.078 -1.550 -11.036 452 HE ARG 60 HE ARG 60 -2.426 -3.900 -11.971 453 HH11 ARG 60 HH11 ARG 60 0.671 -2.539 -10.888 454 HH12 ARG 60 HH12 ARG 60 1.442 -4.039 -10.741 455 HH21 ARG 60 HH21 ARG 60 -1.350 -5.981 -11.743 456 HH22 ARG 60 HH22 ARG 60 0.274 -6.060 -11.208 457 H ALA 61 H ALA 61 -4.382 1.543 -14.913 458 HA ALA 61 HA ALA 61 -5.506 0.907 -16.745 459 HB1 ALA 61 HB1 ALA 61 -4.242 -1.186 -16.409 460 HB2 ALA 61 HB2 ALA 61 -5.810 -1.473 -17.166 461 HB3 ALA 61 HB3 ALA 61 -5.579 -1.826 -15.451 462 H GLY 62 H GLY 62 -7.010 1.723 -14.264 463 HA2 GLY 62 HA2 GLY 62 -9.270 2.313 -14.059 464 HA3 GLY 62 HA3 GLY 62 -9.648 1.137 -15.307 465 H GLY 63 H GLY 63 -7.657 -0.230 -12.986 466 HA2 GLY 63 HA2 GLY 63 -10.015 -1.292 -11.592 467 HA3 GLY 63 HA3 GLY 63 -8.613 -2.271 -12.020 468 H VAL 64 H VAL 64 -9.912 -1.486 -9.422 469 HA VAL 64 HA VAL 64 -7.647 -0.178 -8.115 470 HB VAL 64 HB VAL 64 -10.368 -0.968 -6.994 471 HG11 VAL 64 HG11 VAL 64 -8.660 -0.889 -5.260 472 HG12 VAL 64 HG12 VAL 64 -9.784 0.459 -5.082 473 HG13 VAL 64 HG13 VAL 64 -8.188 0.730 -5.777 474 HG21 VAL 64 HG21 VAL 64 -10.901 1.425 -7.038 475 HG22 VAL 64 HG22 VAL 64 -10.581 0.804 -8.657 476 HG23 VAL 64 HG23 VAL 64 -9.357 1.759 -7.816 477 H VAL 65 H VAL 65 -6.187 -1.439 -7.175 478 HA VAL 65 HA VAL 65 -6.892 -4.150 -6.395 479 HB VAL 65 HB VAL 65 -4.747 -4.962 -7.445 480 HG11 VAL 65 HG11 VAL 65 -5.711 -5.232 -9.699 481 HG12 VAL 65 HG12 VAL 65 -6.917 -4.000 -9.315 482 HG13 VAL 65 HG13 VAL 65 -6.894 -5.524 -8.424 483 HG21 VAL 65 HG21 VAL 65 -4.939 -2.351 -8.955 484 HG22 VAL 65 HG22 VAL 65 -3.849 -3.677 -9.357 485 HG23 VAL 65 HG23 VAL 65 -3.663 -2.814 -7.831 486 H ILE 66 H ILE 66 -5.126 -5.164 -5.203 487 HA ILE 66 HA ILE 66 -3.692 -3.213 -3.521 488 HB ILE 66 HB ILE 66 -4.978 -5.841 -2.682 489 HG12 ILE 66 HG12 ILE 66 -5.779 -3.007 -1.998 490 HG13 ILE 66 HG13 ILE 66 -6.584 -4.010 -3.195 491 HG21 ILE 66 HG21 ILE 66 -2.972 -5.364 -1.372 492 HG22 ILE 66 HG22 ILE 66 -4.423 -5.156 -0.384 493 HG23 ILE 66 HG23 ILE 66 -3.578 -3.746 -1.013 494 HD11 ILE 66 HD11 ILE 66 -6.405 -4.568 -0.249 495 HD12 ILE 66 HD12 ILE 66 -7.219 -5.575 -1.447 496 HD13 ILE 66 HD13 ILE 66 -7.814 -3.951 -1.121 497 HA PRO 67 HA PRO 67 -0.023 -5.523 -4.953 498 HB2 PRO 67 HB2 PRO 67 0.994 -4.582 -2.327 499 HB3 PRO 67 HB3 PRO 67 1.727 -4.436 -3.927 500 HG2 PRO 67 HG2 PRO 67 0.634 -2.313 -2.803 501 HG3 PRO 67 HG3 PRO 67 0.362 -2.637 -4.525 502 HD2 PRO 67 HD2 PRO 67 -1.472 -3.081 -2.205 503 HD3 PRO 67 HD3 PRO 67 -1.828 -2.474 -3.837 504 H GLN 68 H GLN 68 0.754 -7.460 -4.715 505 HA GLN 68 HA GLN 68 -0.296 -9.504 -3.138 506 HB2 GLN 68 HB2 GLN 68 2.396 -9.190 -4.429 507 HB3 GLN 68 HB3 GLN 68 1.818 -10.716 -3.771 508 HG2 GLN 68 HG2 GLN 68 0.227 -9.287 -5.837 509 HG3 GLN 68 HG3 GLN 68 1.679 -10.151 -6.318 510 HE21 GLN 68 HE21 GLN 68 -0.239 -11.362 -3.686 511 HE22 GLN 68 HE22 GLN 68 -0.907 -12.679 -4.576 512 H VAL 69 H VAL 69 2.471 -7.450 -2.719 513 HA VAL 69 HA VAL 69 3.659 -8.797 -0.538 514 HB VAL 69 HB VAL 69 5.088 -6.799 -0.358 515 HG11 VAL 69 HG11 VAL 69 5.688 -8.582 -1.893 516 HG12 VAL 69 HG12 VAL 69 6.101 -7.024 -2.611 517 HG13 VAL 69 HG13 VAL 69 4.660 -7.890 -3.143 518 HG21 VAL 69 HG21 VAL 69 4.813 -5.007 -2.075 519 HG22 VAL 69 HG22 VAL 69 3.494 -5.078 -0.904 520 HG23 VAL 69 HG23 VAL 69 3.268 -5.733 -2.521 521 H PHE 70 H PHE 70 0.874 -6.948 -0.503 522 HA PHE 70 HA PHE 70 1.331 -5.788 2.104 523 HB2 PHE 70 HB2 PHE 70 -0.855 -5.663 0.096 524 HB3 PHE 70 HB3 PHE 70 -1.306 -5.424 1.783 525 HD1 PHE 70 HD1 PHE 70 1.596 -4.355 -0.326 526 HD2 PHE 70 HD2 PHE 70 -1.547 -3.245 2.294 527 HE1 PHE 70 HE1 PHE 70 2.371 -2.015 -0.392 528 HE2 PHE 70 HE2 PHE 70 -0.777 -0.925 2.255 529 HZ PHE 70 HZ PHE 70 1.153 -0.297 0.921 530 H PHE 71 H PHE 71 0.717 -8.736 1.007 531 HA PHE 71 HA PHE 71 -0.507 -9.534 3.526 532 HB2 PHE 71 HB2 PHE 71 -0.962 -10.727 0.783 533 HB3 PHE 71 HB3 PHE 71 -1.474 -11.482 2.287 534 HD1 PHE 71 HD1 PHE 71 -1.959 -8.548 0.102 535 HD2 PHE 71 HD2 PHE 71 -3.457 -10.808 3.370 536 HE1 PHE 71 HE1 PHE 71 -4.048 -7.283 0.002 537 HE2 PHE 71 HE2 PHE 71 -5.558 -9.543 3.278 538 HZ PHE 71 HZ PHE 71 -5.855 -7.774 1.594 539 H THR 72 H THR 72 0.293 -11.393 4.376 540 HA THR 72 HA THR 72 3.036 -11.939 3.783 541 HB THR 72 HB THR 72 2.740 -13.664 5.605 542 HG1 THR 72 HG1 THR 72 0.250 -12.518 6.156 543 HG21 THR 72 HG21 THR 72 3.442 -11.368 6.154 544 HG22 THR 72 HG22 THR 72 2.398 -12.019 7.415 545 HG23 THR 72 HG23 THR 72 1.754 -10.869 6.250 546 H ASN 73 H ASN 73 3.720 -14.285 3.462 547 HA ASN 73 HA ASN 73 2.508 -15.425 1.210 548 HB2 ASN 73 HB2 ASN 73 3.994 -17.331 1.491 549 HB3 ASN 73 HB3 ASN 73 4.877 -15.859 1.860 550 HD21 ASN 73 HD21 ASN 73 5.584 -15.499 4.025 551 HD22 ASN 73 HD22 ASN 73 5.551 -16.773 5.178 552 H SER 74 H SER 74 1.659 -15.695 4.517 553 HA SER 74 HA SER 74 0.214 -18.153 4.362 554 HB2 SER 74 HB2 SER 74 0.006 -15.930 6.390 555 HB3 SER 74 HB3 SER 74 -0.424 -17.625 6.614 556 HG SER 74 HG SER 74 1.843 -18.085 6.194 557 H GLY 75 H GLY 75 -0.389 -15.006 3.208 558 HA2 GLY 75 HA2 GLY 75 -2.275 -14.248 2.096 559 HA3 GLY 75 HA3 GLY 75 -3.181 -15.607 2.748 560 H GLN 76 H GLN 76 -1.382 -13.913 5.042 561 HA GLN 76 HA GLN 76 -3.850 -12.682 6.038 562 HB2 GLN 76 HB2 GLN 76 -1.349 -13.553 7.475 563 HB3 GLN 76 HB3 GLN 76 -2.610 -12.591 8.231 564 HG2 GLN 76 HG2 GLN 76 -2.978 -15.334 7.058 565 HG3 GLN 76 HG3 GLN 76 -2.799 -14.964 8.777 566 HE21 GLN 76 HE21 GLN 76 -5.021 -16.226 7.390 567 HE22 GLN 76 HE22 GLN 76 -6.404 -15.254 7.711 568 H VAL 77 H VAL 77 -3.858 -10.590 6.756 569 HA VAL 77 HA VAL 77 -2.256 -8.713 5.408 570 HB VAL 77 HB VAL 77 -4.135 -8.445 7.795 571 HG11 VAL 77 HG11 VAL 77 -4.084 -6.026 7.468 572 HG12 VAL 77 HG12 VAL 77 -2.855 -6.218 6.219 573 HG13 VAL 77 HG13 VAL 77 -2.476 -6.625 7.893 574 HG21 VAL 77 HG21 VAL 77 -5.606 -7.382 6.177 575 HG22 VAL 77 HG22 VAL 77 -5.169 -9.020 5.662 576 HG23 VAL 77 HG23 VAL 77 -4.379 -7.609 4.934 577 H VAL 78 H VAL 78 -0.451 -7.633 6.020 578 HA VAL 78 HA VAL 78 1.262 -8.672 8.002 579 HB VAL 78 HB VAL 78 1.315 -5.906 6.750 580 HG11 VAL 78 HG11 VAL 78 2.776 -6.055 8.682 581 HG12 VAL 78 HG12 VAL 78 3.723 -5.937 7.200 582 HG13 VAL 78 HG13 VAL 78 3.546 -7.491 8.010 583 HG21 VAL 78 HG21 VAL 78 2.649 -8.437 5.793 584 HG22 VAL 78 HG22 VAL 78 2.840 -6.838 5.077 585 HG23 VAL 78 HG23 VAL 78 1.271 -7.645 5.031 586 H LYS 79 H LYS 79 1.311 -8.279 10.106 587 HA LYS 79 HA LYS 79 -0.810 -6.904 11.405 588 HB2 LYS 79 HB2 LYS 79 0.157 -7.459 13.491 589 HB3 LYS 79 HB3 LYS 79 0.397 -8.824 12.416 590 HG2 LYS 79 HG2 LYS 79 2.373 -6.726 12.791 591 HG3 LYS 79 HG3 LYS 79 2.328 -8.080 13.949 592 HD2 LYS 79 HD2 LYS 79 2.896 -8.170 10.949 593 HD3 LYS 79 HD3 LYS 79 4.077 -8.438 12.223 594 HE2 LYS 79 HE2 LYS 79 1.694 -10.204 11.591 595 HE3 LYS 79 HE3 LYS 79 3.379 -10.554 11.237 596 HZ1 LYS 79 HZ1 LYS 79 3.836 -10.573 13.606 597 HZ2 LYS 79 HZ2 LYS 79 2.653 -11.701 13.199 598 HZ3 LYS 79 HZ3 LYS 79 2.208 -10.264 13.947 599 H SER 80 H SER 80 2.236 -5.775 10.391 600 HA SER 80 HA SER 80 2.101 -3.390 12.020 601 HB2 SER 80 HB2 SER 80 4.071 -4.142 9.866 602 HB3 SER 80 HB3 SER 80 4.295 -2.964 11.169 603 HG SER 80 HG SER 80 4.482 -4.557 12.613 604 H LEU 81 H LEU 81 0.483 -4.333 9.326 605 HA LEU 81 HA LEU 81 1.023 -2.315 7.435 606 HB2 LEU 81 HB2 LEU 81 -0.179 -4.570 7.105 607 HB3 LEU 81 HB3 LEU 81 -1.610 -3.736 7.663 608 HG LEU 81 HG LEU 81 -1.188 -2.076 5.786 609 HD11 LEU 81 HD11 LEU 81 1.141 -2.750 5.363 610 HD12 LEU 81 HD12 LEU 81 0.117 -2.923 3.927 611 HD13 LEU 81 HD13 LEU 81 0.543 -4.340 4.876 612 HD21 LEU 81 HD21 LEU 81 -1.779 -4.921 5.044 613 HD22 LEU 81 HD22 LEU 81 -2.285 -3.480 4.173 614 HD23 LEU 81 HD23 LEU 81 -2.942 -3.807 5.782 615 HA PRO 82 HA PRO 82 -2.970 -0.030 9.159 616 HB2 PRO 82 HB2 PRO 82 -3.507 -0.566 11.808 617 HB3 PRO 82 HB3 PRO 82 -4.383 -1.306 10.465 618 HG2 PRO 82 HG2 PRO 82 -2.094 -2.395 12.062 619 HG3 PRO 82 HG3 PRO 82 -3.576 -3.216 11.531 620 HD2 PRO 82 HD2 PRO 82 -1.294 -3.607 10.243 621 HD3 PRO 82 HD3 PRO 82 -2.820 -3.425 9.348 622 H GLY 83 H GLY 83 -0.302 -0.989 11.154 623 HA2 GLY 83 HA2 GLY 83 -0.104 1.368 12.708 624 HA3 GLY 83 HA3 GLY 83 1.167 0.174 12.489 625 H LEU 84 H LEU 84 1.577 0.291 9.751 626 HA LEU 84 HA LEU 84 3.127 2.641 9.608 627 HB2 LEU 84 HB2 LEU 84 3.910 1.909 7.470 628 HB3 LEU 84 HB3 LEU 84 3.765 0.504 8.487 629 HG LEU 84 HG LEU 84 1.416 0.338 7.236 630 HD11 LEU 84 HD11 LEU 84 1.646 0.921 4.857 631 HD12 LEU 84 HD12 LEU 84 3.178 1.711 5.198 632 HD13 LEU 84 HD13 LEU 84 1.688 2.347 5.888 633 HD21 LEU 84 HD21 LEU 84 3.074 -1.434 7.313 634 HD22 LEU 84 HD22 LEU 84 4.073 -0.584 6.131 635 HD23 LEU 84 HD23 LEU 84 2.504 -1.228 5.656 636 H LEU 85 H LEU 85 0.067 1.690 8.189 637 HA LEU 85 HA LEU 85 -0.244 3.907 6.505 638 HB2 LEU 85 HB2 LEU 85 -2.339 2.207 7.845 639 HB3 LEU 85 HB3 LEU 85 -2.682 3.379 6.590 640 HG LEU 85 HG LEU 85 -0.947 0.932 6.241 641 HD11 LEU 85 HD11 LEU 85 -3.285 0.336 6.566 642 HD12 LEU 85 HD12 LEU 85 -2.800 0.077 4.892 643 HD13 LEU 85 HD13 LEU 85 -3.763 1.488 5.324 644 HD21 LEU 85 HD21 LEU 85 -1.102 1.475 3.850 645 HD22 LEU 85 HD22 LEU 85 -0.292 2.749 4.758 646 HD23 LEU 85 HD23 LEU 85 -1.967 2.956 4.251 647 H THR 86 H THR 86 -1.048 3.420 9.829 648 HA THR 86 HA THR 86 -2.443 5.889 10.072 649 HB THR 86 HB THR 86 -1.319 4.095 12.234 650 HG1 THR 86 HG1 THR 86 -2.866 2.963 11.386 651 HG21 THR 86 HG21 THR 86 -1.699 6.369 13.110 652 HG22 THR 86 HG22 THR 86 -2.910 5.254 13.742 653 HG23 THR 86 HG23 THR 86 -3.324 6.366 12.433 654 H ILE 87 H ILE 87 0.934 4.970 10.786 655 HA ILE 87 HA ILE 87 1.513 7.503 11.905 656 HB ILE 87 HB ILE 87 2.874 5.487 12.444 657 HG12 ILE 87 HG12 ILE 87 3.906 7.792 12.720 658 HG13 ILE 87 HG13 ILE 87 5.033 6.454 12.624 659 HG21 ILE 87 HG21 ILE 87 4.000 5.667 9.688 660 HG22 ILE 87 HG22 ILE 87 2.886 4.454 10.285 661 HG23 ILE 87 HG23 ILE 87 4.528 4.554 10.955 662 HD11 ILE 87 HD11 ILE 87 4.356 8.342 10.387 663 HD12 ILE 87 HD12 ILE 87 5.552 7.051 10.320 664 HD13 ILE 87 HD13 ILE 87 5.806 8.426 11.399 665 H LEU 88 H LEU 88 1.800 6.197 8.645 666 HA LEU 88 HA LEU 88 2.938 8.519 7.518 667 HB2 LEU 88 HB2 LEU 88 1.511 6.169 6.415 668 HB3 LEU 88 HB3 LEU 88 1.664 7.565 5.386 669 HG LEU 88 HG LEU 88 3.373 5.983 4.868 670 HD11 LEU 88 HD11 LEU 88 4.586 8.305 6.342 671 HD12 LEU 88 HD12 LEU 88 3.996 8.309 4.682 672 HD13 LEU 88 HD13 LEU 88 5.380 7.313 5.121 673 HD21 LEU 88 HD21 LEU 88 3.473 4.801 6.984 674 HD22 LEU 88 HD22 LEU 88 4.237 6.209 7.721 675 HD23 LEU 88 HD23 LEU 88 5.077 5.315 6.450 676 H HIS 89 H HIS 89 -0.345 7.593 8.171 677 HA HIS 89 HA HIS 89 -1.601 9.625 6.691 678 HB2 HIS 89 HB2 HIS 89 -2.750 7.597 7.677 679 HB3 HIS 89 HB3 HIS 89 -2.651 8.375 9.250 680 HD1 HIS 89 HD1 HIS 89 -4.622 9.902 9.841 681 HD2 HIS 89 HD2 HIS 89 -4.334 9.098 5.767 682 HE1 HIS 89 HE1 HIS 89 -6.663 10.904 8.780 683 H ASP 90 H ASP 90 -0.320 9.523 9.971 684 HA ASP 90 HA ASP 90 -1.216 12.106 10.777 685 HB2 ASP 90 HB2 ASP 90 -0.401 10.330 12.365 686 HB3 ASP 90 HB3 ASP 90 1.233 10.616 11.777 687 H GLY 91 H GLY 91 1.402 10.997 8.841 688 HA2 GLY 91 HA2 GLY 91 2.819 13.528 8.898 689 HA3 GLY 91 HA3 GLY 91 3.239 12.119 7.936 690 H GLY 92 H GLY 92 0.077 12.451 7.429 691 HA2 GLY 92 HA2 GLY 92 -1.261 13.675 5.976 692 HA3 GLY 92 HA3 GLY 92 0.136 14.646 5.542 693 H TYR 93 H TYR 93 0.464 11.204 5.439 694 HA TYR 93 HA TYR 93 0.825 11.412 2.591 695 HB2 TYR 93 HB2 TYR 93 1.554 9.340 4.603 696 HB3 TYR 93 HB3 TYR 93 1.519 8.920 2.895 697 HD1 TYR 93 HD1 TYR 93 2.824 11.754 4.994 698 HD2 TYR 93 HD2 TYR 93 3.528 8.990 1.849 699 HE1 TYR 93 HE1 TYR 93 5.064 12.708 4.657 700 HE2 TYR 93 HE2 TYR 93 5.759 9.933 1.498 701 HH TYR 93 HH TYR 93 7.188 12.081 3.718 702 H ARG 94 H ARG 94 -0.039 10.029 1.085 703 HA ARG 94 HA ARG 94 -2.588 8.810 1.777 704 HB2 ARG 94 HB2 ARG 94 -3.571 9.489 -0.239 705 HB3 ARG 94 HB3 ARG 94 -2.871 10.933 0.475 706 HG2 ARG 94 HG2 ARG 94 -1.177 11.029 -1.142 707 HG3 ARG 94 HG3 ARG 94 -1.442 9.342 -1.618 708 HD2 ARG 94 HD2 ARG 94 -3.648 9.911 -2.372 709 HD3 ARG 94 HD3 ARG 94 -3.360 11.618 -1.994 710 HE ARG 94 HE ARG 94 -1.594 11.515 -3.661 711 HH11 ARG 94 HH11 ARG 94 -3.957 8.812 -3.736 712 HH12 ARG 94 HH12 ARG 94 -3.989 8.726 -5.408 713 HH21 ARG 94 HH21 ARG 94 -1.655 11.349 -5.980 714 HH22 ARG 94 HH22 ARG 94 -2.624 10.188 -6.749 715 H ASP 95 H ASP 95 -3.271 7.466 -0.351 716 HA ASP 95 HA ASP 95 -2.016 5.029 -0.061 717 HB2 ASP 95 HB2 ASP 95 -3.379 4.360 -1.989 718 HB3 ASP 95 HB3 ASP 95 -4.308 5.411 -0.920 719 H THR 96 H THR 96 -1.669 7.275 -2.807 720 HA THR 96 HA THR 96 0.147 5.644 -4.172 721 HB THR 96 HB THR 96 -0.386 8.615 -4.485 722 HG1 THR 96 HG1 THR 96 -2.061 6.677 -4.828 723 HG21 THR 96 HG21 THR 96 0.507 8.333 -6.764 724 HG22 THR 96 HG22 THR 96 0.841 6.632 -6.430 725 HG23 THR 96 HG23 THR 96 1.729 7.887 -5.571 726 H GLU 97 H GLU 97 0.479 8.219 -1.887 727 HA GLU 97 HA GLU 97 3.299 8.509 -2.151 728 HB2 GLU 97 HB2 GLU 97 1.476 9.294 0.122 729 HB3 GLU 97 HB3 GLU 97 3.183 9.694 0.024 730 HG2 GLU 97 HG2 GLU 97 1.080 10.562 -1.929 731 HG3 GLU 97 HG3 GLU 97 1.781 11.555 -0.655 732 H ILE 98 H ILE 98 1.255 6.447 -0.161 733 HA ILE 98 HA ILE 98 3.228 5.466 1.621 734 HB ILE 98 HB ILE 98 0.946 3.808 0.484 735 HG12 ILE 98 HG12 ILE 98 -0.113 5.789 1.366 736 HG13 ILE 98 HG13 ILE 98 -0.337 4.471 2.515 737 HG21 ILE 98 HG21 ILE 98 2.426 3.598 3.091 738 HG22 ILE 98 HG22 ILE 98 2.554 2.503 1.712 739 HG23 ILE 98 HG23 ILE 98 1.045 2.606 2.619 740 HD11 ILE 98 HD11 ILE 98 0.148 6.563 3.624 741 HD12 ILE 98 HD12 ILE 98 1.678 6.672 2.755 742 HD13 ILE 98 HD13 ILE 98 1.413 5.366 3.913 743 H MET 99 H MET 99 2.104 4.362 -1.499 744 HA MET 99 HA MET 99 3.807 2.100 -1.700 745 HB2 MET 99 HB2 MET 99 2.445 3.619 -3.920 746 HB3 MET 99 HB3 MET 99 3.059 1.980 -4.000 747 HG2 MET 99 HG2 MET 99 0.777 2.934 -2.298 748 HG3 MET 99 HG3 MET 99 0.642 2.052 -3.814 749 HE1 MET 99 HE1 MET 99 -0.937 0.197 -2.683 750 HE2 MET 99 HE2 MET 99 -0.870 1.247 -1.261 751 HE3 MET 99 HE3 MET 99 -0.566 -0.480 -1.102 752 H ARG 100 H ARG 100 4.209 5.464 -2.285 753 HA ARG 100 HA ARG 100 6.052 5.574 -4.359 754 HB2 ARG 100 HB2 ARG 100 4.914 7.525 -3.471 755 HB3 ARG 100 HB3 ARG 100 5.728 7.337 -1.932 756 HG2 ARG 100 HG2 ARG 100 7.857 7.842 -3.020 757 HG3 ARG 100 HG3 ARG 100 7.005 8.075 -4.556 758 HD2 ARG 100 HD2 ARG 100 5.680 9.862 -3.533 759 HD3 ARG 100 HD3 ARG 100 6.530 9.620 -2.010 760 HE ARG 100 HE ARG 100 8.492 10.074 -3.818 761 HH11 ARG 100 HH11 ARG 100 5.584 11.893 -2.830 762 HH12 ARG 100 HH12 ARG 100 6.262 13.399 -3.230 763 HH21 ARG 100 HH21 ARG 100 9.417 12.233 -4.271 764 HH22 ARG 100 HH22 ARG 100 8.416 13.594 -4.037 765 H TRP 101 H TRP 101 6.855 5.903 -0.923 766 HA TRP 101 HA TRP 101 9.580 5.377 -1.434 767 HB2 TRP 101 HB2 TRP 101 9.806 5.345 1.096 768 HB3 TRP 101 HB3 TRP 101 9.202 6.826 0.374 769 HD1 TRP 101 HD1 TRP 101 6.780 7.598 1.028 770 HE1 TRP 101 HE1 TRP 101 5.106 6.804 2.790 771 HE3 TRP 101 HE3 TRP 101 8.956 3.150 2.303 772 HZ2 TRP 101 HZ2 TRP 101 4.746 4.595 4.491 773 HZ3 TRP 101 HZ3 TRP 101 7.884 1.766 3.976 774 HH2 TRP 101 HH2 TRP 101 5.816 2.468 5.075 775 H LEU 102 H LEU 102 6.937 3.339 -0.517 776 HA LEU 102 HA LEU 102 8.434 1.204 0.502 777 HB2 LEU 102 HB2 LEU 102 5.710 1.664 -0.358 778 HB3 LEU 102 HB3 LEU 102 6.207 -0.021 -0.524 779 HG LEU 102 HG LEU 102 6.280 1.635 2.009 780 HD11 LEU 102 HD11 LEU 102 4.352 -0.509 1.123 781 HD12 LEU 102 HD12 LEU 102 4.016 1.222 1.171 782 HD13 LEU 102 HD13 LEU 102 4.345 0.347 2.669 783 HD21 LEU 102 HD21 LEU 102 7.924 -0.164 1.963 784 HD22 LEU 102 HD22 LEU 102 6.659 -1.290 1.483 785 HD23 LEU 102 HD23 LEU 102 6.607 -0.545 3.085 786 H PHE 103 H PHE 103 7.447 1.913 -2.804 787 HA PHE 103 HA PHE 103 8.733 -0.579 -3.547 788 HB2 PHE 103 HB2 PHE 103 6.898 1.199 -5.100 789 HB3 PHE 103 HB3 PHE 103 7.700 -0.218 -5.778 790 HD1 PHE 103 HD1 PHE 103 7.250 -2.449 -4.797 791 HD2 PHE 103 HD2 PHE 103 4.974 0.975 -3.751 792 HE1 PHE 103 HE1 PHE 103 5.443 -3.901 -3.983 793 HE2 PHE 103 HE2 PHE 103 3.164 -0.459 -2.952 794 HZ PHE 103 HZ PHE 103 3.380 -2.892 -3.080 795 H THR 104 H THR 104 9.564 2.621 -3.390 796 HA THR 104 HA THR 104 11.440 2.383 -5.593 797 HB THR 104 HB THR 104 11.242 4.622 -3.543 798 HG1 THR 104 HG1 THR 104 9.312 4.451 -4.711 799 HG21 THR 104 HG21 THR 104 12.469 5.939 -5.204 800 HG22 THR 104 HG22 THR 104 12.463 4.569 -6.315 801 HG23 THR 104 HG23 THR 104 13.370 4.470 -4.817 802 HA PRO 105 HA PRO 105 14.122 0.167 -2.663 803 HB2 PRO 105 HB2 PRO 105 16.038 0.614 -4.910 804 HB3 PRO 105 HB3 PRO 105 15.666 -0.881 -4.041 805 HG2 PRO 105 HG2 PRO 105 14.702 -0.550 -6.469 806 HG3 PRO 105 HG3 PRO 105 13.657 -1.196 -5.194 807 HD2 PRO 105 HD2 PRO 105 13.760 1.589 -6.298 808 HD3 PRO 105 HD3 PRO 105 12.352 0.568 -5.916 809 H ASP 106 H ASP 106 15.301 1.006 -1.098 810 HA ASP 106 HA ASP 106 16.161 3.771 -1.379 811 HB2 ASP 106 HB2 ASP 106 14.833 3.095 0.616 812 HB3 ASP 106 HB3 ASP 106 16.128 2.014 1.085 813 HA PRO 107 HA PRO 107 20.265 2.312 -2.332 814 HB2 PRO 107 HB2 PRO 107 21.495 4.767 -2.103 815 HB3 PRO 107 HB3 PRO 107 20.642 4.220 -3.549 816 HG2 PRO 107 HG2 PRO 107 19.692 6.005 -1.354 817 HG3 PRO 107 HG3 PRO 107 19.424 6.141 -3.095 818 HD2 PRO 107 HD2 PRO 107 17.546 5.222 -1.435 819 HD3 PRO 107 HD3 PRO 107 17.714 4.575 -3.076 820 H SER 108 H SER 108 19.390 4.129 0.483 821 HA SER 108 HA SER 108 21.875 3.439 1.795 822 HB2 SER 108 HB2 SER 108 20.725 4.931 3.637 823 HB3 SER 108 HB3 SER 108 21.470 5.675 2.221 824 HG SER 108 HG SER 108 18.729 4.940 2.178 825 H LEU 109 H LEU 109 19.228 1.770 1.204 826 HA LEU 109 HA LEU 109 19.076 0.638 3.883 827 HB2 LEU 109 HB2 LEU 109 16.948 1.197 2.827 828 HB3 LEU 109 HB3 LEU 109 17.342 0.167 1.459 829 HG LEU 109 HG LEU 109 17.359 -1.776 3.023 830 HD11 LEU 109 HD11 LEU 109 17.776 -0.621 5.107 831 HD12 LEU 109 HD12 LEU 109 16.258 -1.516 5.206 832 HD13 LEU 109 HD13 LEU 109 16.241 0.230 4.968 833 HD21 LEU 109 HD21 LEU 109 14.943 -1.933 3.203 834 HD22 LEU 109 HD22 LEU 109 15.442 -1.292 1.636 835 HD23 LEU 109 HD23 LEU 109 14.806 -0.199 2.871 836 H THR 110 H THR 110 20.119 -1.141 4.262 837 HA THR 110 HA THR 110 20.699 -2.963 2.079 838 HB THR 110 HB THR 110 22.636 -2.225 4.290 839 HG1 THR 110 HG1 THR 110 22.048 -0.997 2.067 840 HG21 THR 110 HG21 THR 110 24.228 -3.579 2.994 841 HG22 THR 110 HG22 THR 110 22.948 -3.989 1.854 842 HG23 THR 110 HG23 THR 110 22.849 -4.552 3.523 843 H ILE 111 H ILE 111 19.620 -4.704 2.538 844 HA ILE 111 HA ILE 111 19.392 -5.605 5.328 845 HB ILE 111 HB ILE 111 17.064 -6.392 4.728 846 HG12 ILE 111 HG12 ILE 111 17.318 -4.343 2.521 847 HG13 ILE 111 HG13 ILE 111 17.317 -6.066 2.230 848 HG21 ILE 111 HG21 ILE 111 16.013 -4.220 5.192 849 HG22 ILE 111 HG22 ILE 111 17.577 -3.436 4.921 850 HG23 ILE 111 HG23 ILE 111 17.377 -4.590 6.243 851 HD11 ILE 111 HD11 ILE 111 15.068 -4.408 3.356 852 HD12 ILE 111 HD12 ILE 111 15.017 -6.162 3.165 853 HD13 ILE 111 HD13 ILE 111 15.152 -5.117 1.749 854 H THR 112 H THR 112 18.894 -7.871 5.498 855 HA THR 112 HA THR 112 19.902 -9.390 3.256 856 HB THR 112 HB THR 112 20.799 -10.149 5.297 857 HG1 THR 112 HG1 THR 112 19.914 -11.884 3.966 858 HG21 THR 112 HG21 THR 112 18.025 -10.223 6.493 859 HG22 THR 112 HG22 THR 112 19.270 -9.041 6.869 860 HG23 THR 112 HG23 THR 112 19.491 -10.732 7.323 861 H ARG 113 H ARG 113 18.601 -10.405 1.997 862 HA ARG 113 HA ARG 113 15.864 -9.519 2.261 863 HB2 ARG 113 HB2 ARG 113 17.273 -10.677 -0.113 864 HB3 ARG 113 HB3 ARG 113 15.552 -10.355 -0.079 865 HG2 ARG 113 HG2 ARG 113 16.216 -7.965 0.573 866 HG3 ARG 113 HG3 ARG 113 17.829 -8.423 -0.002 867 HD2 ARG 113 HD2 ARG 113 16.437 -7.387 -1.765 868 HD3 ARG 113 HD3 ARG 113 16.921 -9.045 -2.155 869 HE ARG 113 HE ARG 113 14.462 -8.971 -0.759 870 HH11 ARG 113 HH11 ARG 113 15.780 -8.471 -3.997 871 HH12 ARG 113 HH12 ARG 113 14.326 -8.864 -4.802 872 HH21 ARG 113 HH21 ARG 113 12.529 -9.579 -1.829 873 HH22 ARG 113 HH22 ARG 113 12.412 -9.545 -3.532 874 H ASP 114 H ASP 114 14.116 -10.813 1.407 875 HA ASP 114 HA ASP 114 13.572 -13.048 2.971 876 HB2 ASP 114 HB2 ASP 114 11.824 -11.681 1.915 877 HB3 ASP 114 HB3 ASP 114 12.349 -12.204 0.326 878 H GLY 115 H GLY 115 14.905 -14.731 2.917 879 HA2 GLY 115 HA2 GLY 115 15.854 -16.685 2.169 880 HA3 GLY 115 HA3 GLY 115 14.928 -16.506 0.685 881 H SER 116 H SER 116 17.282 -14.249 2.058 882 HA SER 116 HA SER 116 19.214 -14.997 0.016 883 HB2 SER 116 HB2 SER 116 18.367 -12.151 0.555 884 HB3 SER 116 HB3 SER 116 19.560 -12.679 -0.634 885 HG SER 116 HG SER 116 17.112 -13.879 -0.840 886 H ARG 117 H ARG 117 20.774 -15.667 1.333 887 HA ARG 117 HA ARG 117 21.338 -14.775 3.912 888 HB2 ARG 117 HB2 ARG 117 23.573 -15.863 3.596 889 HB3 ARG 117 HB3 ARG 117 22.183 -16.877 3.252 890 HG2 ARG 117 HG2 ARG 117 22.510 -16.609 0.878 891 HG3 ARG 117 HG3 ARG 117 23.800 -15.444 1.167 892 HD2 ARG 117 HD2 ARG 117 23.892 -18.240 2.214 893 HD3 ARG 117 HD3 ARG 117 24.486 -17.815 0.606 894 HE ARG 117 HE ARG 117 25.990 -16.222 1.769 895 HH11 ARG 117 HH11 ARG 117 24.755 -18.961 3.687 896 HH12 ARG 117 HH12 ARG 117 26.201 -19.115 4.568 897 HH21 ARG 117 HH21 ARG 117 27.916 -16.461 3.002 898 HH22 ARG 117 HH22 ARG 117 28.007 -17.656 4.221 899 H ASP 118 H ASP 118 22.291 -13.467 0.870 900 HA ASP 118 HA ASP 118 24.364 -11.827 1.992 901 HB2 ASP 118 HB2 ASP 118 24.560 -10.959 -0.326 902 HB3 ASP 118 HB3 ASP 118 24.734 -12.701 -0.217 903 H ALA 119 H ALA 119 24.297 -9.652 2.225 904 HA ALA 119 HA ALA 119 21.654 -8.517 2.539 905 HB1 ALA 119 HB1 ALA 119 24.360 -7.371 3.254 906 HB2 ALA 119 HB2 ALA 119 23.300 -8.251 4.353 907 HB3 ALA 119 HB3 ALA 119 22.789 -6.698 3.698 908 H VAL 120 H VAL 120 20.816 -7.131 1.191 909 HA VAL 120 HA VAL 120 22.414 -6.401 -1.145 910 HB VAL 120 HB VAL 120 19.408 -6.461 -0.844 911 HG11 VAL 120 HG11 VAL 120 19.381 -6.338 -3.297 912 HG12 VAL 120 HG12 VAL 120 21.136 -6.171 -3.299 913 HG13 VAL 120 HG13 VAL 120 20.134 -4.920 -2.568 914 HG21 VAL 120 HG21 VAL 120 20.323 -8.702 -0.647 915 HG22 VAL 120 HG22 VAL 120 21.230 -8.483 -2.141 916 HG23 VAL 120 HG23 VAL 120 19.464 -8.515 -2.174 917 H SER 121 H SER 121 23.038 -4.365 -1.261 918 HA SER 121 HA SER 121 21.759 -2.280 0.251 919 HB2 SER 121 HB2 SER 121 23.951 -2.120 -1.849 920 HB3 SER 121 HB3 SER 121 23.516 -0.888 -0.661 921 HG SER 121 HG SER 121 24.169 -2.283 0.967 922 H ASN 122 H ASN 122 20.446 -0.763 -0.613 923 HA ASN 122 HA ASN 122 18.921 0.168 -1.928 924 HB2 ASN 122 HB2 ASN 122 20.708 0.658 -3.603 925 HB3 ASN 122 HB3 ASN 122 20.511 -0.948 -4.279 926 HD21 ASN 122 HD21 ASN 122 18.817 -1.340 -5.657 927 HD22 ASN 122 HD22 ASN 122 17.770 -0.109 -6.285 928 H ALA 123 H ALA 123 17.784 -1.452 -0.762 929 HA ALA 123 HA ALA 123 16.564 -3.367 -2.600 930 HB1 ALA 123 HB1 ALA 123 16.031 -4.739 -0.654 931 HB2 ALA 123 HB2 ALA 123 16.809 -3.557 0.400 932 HB3 ALA 123 HB3 ALA 123 17.769 -4.459 -0.770 933 H ARG 124 H ARG 124 14.335 -3.773 -2.226 934 HA ARG 124 HA ARG 124 12.855 -1.360 -1.873 935 HB2 ARG 124 HB2 ARG 124 10.921 -2.687 -2.549 936 HB3 ARG 124 HB3 ARG 124 12.272 -3.096 -3.588 937 HG2 ARG 124 HG2 ARG 124 12.634 -5.078 -1.975 938 HG3 ARG 124 HG3 ARG 124 11.007 -4.723 -1.413 939 HD2 ARG 124 HD2 ARG 124 11.872 -5.511 -4.188 940 HD3 ARG 124 HD3 ARG 124 10.897 -6.446 -3.074 941 HE ARG 124 HE ARG 124 9.923 -3.890 -4.142 942 HH11 ARG 124 HH11 ARG 124 9.372 -7.355 -3.617 943 HH12 ARG 124 HH12 ARG 124 8.019 -7.446 -4.621 944 HH21 ARG 124 HH21 ARG 124 8.030 -4.017 -5.536 945 HH22 ARG 124 HH22 ARG 124 7.226 -5.502 -5.752 946 HA PRO 125 HA PRO 125 12.443 -1.672 2.605 947 HB2 PRO 125 HB2 PRO 125 9.980 -0.095 1.991 948 HB3 PRO 125 HB3 PRO 125 11.236 0.222 3.192 949 HG2 PRO 125 HG2 PRO 125 11.190 1.632 0.959 950 HG3 PRO 125 HG3 PRO 125 12.733 1.040 1.601 951 HD2 PRO 125 HD2 PRO 125 11.119 0.015 -0.699 952 HD3 PRO 125 HD3 PRO 125 12.882 0.163 -0.519 953 H VAL 126 H VAL 126 9.967 -2.457 0.359 954 HA VAL 126 HA VAL 126 7.968 -3.582 1.968 955 HB VAL 126 HB VAL 126 8.828 -4.458 -0.797 956 HG11 VAL 126 HG11 VAL 126 6.597 -5.366 -1.006 957 HG12 VAL 126 HG12 VAL 126 6.244 -4.907 0.661 958 HG13 VAL 126 HG13 VAL 126 7.473 -6.127 0.322 959 HG21 VAL 126 HG21 VAL 126 6.622 -2.582 0.003 960 HG22 VAL 126 HG22 VAL 126 7.073 -3.039 -1.633 961 HG23 VAL 126 HG23 VAL 126 8.185 -2.072 -0.652 962 H ASP 127 H ASP 127 10.928 -5.015 0.660 963 HA ASP 127 HA ASP 127 10.175 -7.711 1.150 964 HB2 ASP 127 HB2 ASP 127 11.963 -6.864 -0.458 965 HB3 ASP 127 HB3 ASP 127 13.013 -6.727 0.946 966 H ALA 128 H ALA 128 11.694 -5.270 3.007 967 HA ALA 128 HA ALA 128 12.865 -6.806 5.038 968 HB1 ALA 128 HB1 ALA 128 13.407 -4.448 4.663 969 HB2 ALA 128 HB2 ALA 128 12.915 -4.738 6.332 970 HB3 ALA 128 HB3 ALA 128 11.790 -3.998 5.194 971 H LEU 129 H LEU 129 9.553 -5.613 4.637 972 HA LEU 129 HA LEU 129 8.862 -6.226 7.347 973 HB2 LEU 129 HB2 LEU 129 6.557 -5.714 6.770 974 HB3 LEU 129 HB3 LEU 129 7.629 -4.461 6.202 975 HG LEU 129 HG LEU 129 7.472 -5.809 3.964 976 HD11 LEU 129 HD11 LEU 129 5.250 -6.776 3.591 977 HD12 LEU 129 HD12 LEU 129 4.913 -6.560 5.321 978 HD13 LEU 129 HD13 LEU 129 6.210 -7.631 4.809 979 HD21 LEU 129 HD21 LEU 129 5.283 -3.985 4.960 980 HD22 LEU 129 HD22 LEU 129 5.601 -4.360 3.268 981 HD23 LEU 129 HD23 LEU 129 6.803 -3.488 4.216 982 H HIS 130 H HIS 130 8.638 -8.002 4.355 983 HA HIS 130 HA HIS 130 7.103 -10.127 5.547 984 HB2 HIS 130 HB2 HIS 130 7.160 -9.599 3.042 985 HB3 HIS 130 HB3 HIS 130 8.774 -10.295 3.013 986 HD1 HIS 130 HD1 HIS 130 8.887 -12.873 2.664 987 HD2 HIS 130 HD2 HIS 130 5.109 -11.499 3.796 988 HE1 HIS 130 HE1 HIS 130 7.344 -14.828 2.475 989 H ALA 131 H ALA 131 10.332 -9.198 5.309 990 HA ALA 131 HA ALA 131 11.400 -11.773 6.141 991 HB1 ALA 131 HB1 ALA 131 13.596 -10.730 5.966 992 HB2 ALA 131 HB2 ALA 131 12.838 -9.156 5.716 993 HB3 ALA 131 HB3 ALA 131 12.648 -10.424 4.508 994 H HIS 132 H HIS 132 9.771 -9.547 7.749 995 HA HIS 132 HA HIS 132 9.425 -9.035 9.928 996 HB2 HIS 132 HB2 HIS 132 11.366 -11.315 10.454 997 HB3 HIS 132 HB3 HIS 132 10.375 -10.545 11.690 998 HD1 HIS 132 HD1 HIS 132 10.181 -12.999 8.855 999 HD2 HIS 132 HD2 HIS 132 7.633 -11.175 11.591 1000 HE1 HIS 132 HE1 HIS 132 8.025 -14.232 8.712 1001 H GLN 133 H GLN 133 11.496 -7.743 8.437 1002 HA GLN 133 HA GLN 133 13.236 -6.676 10.553 1003 HB2 GLN 133 HB2 GLN 133 13.478 -6.444 7.536 1004 HB3 GLN 133 HB3 GLN 133 14.637 -5.822 8.704 1005 HG2 GLN 133 HG2 GLN 133 15.111 -8.096 9.441 1006 HG3 GLN 133 HG3 GLN 133 13.931 -8.714 8.288 1007 HE21 GLN 133 HE21 GLN 133 15.350 -9.913 7.173 1008 HE22 GLN 133 HE22 GLN 133 16.532 -9.235 6.123 1009 H ALA 134 H ALA 134 10.489 -6.267 10.120 1010 HA ALA 134 HA ALA 134 9.581 -4.083 8.731 1011 HB1 ALA 134 HB1 ALA 134 8.145 -5.774 9.773 1012 HB2 ALA 134 HB2 ALA 134 7.638 -4.131 10.162 1013 HB3 ALA 134 HB3 ALA 134 8.510 -5.088 11.358 1014 H ARG 135 H ARG 135 11.335 -4.068 11.763 1015 HA ARG 135 HA ARG 135 10.705 -1.611 12.870 1016 HB2 ARG 135 HB2 ARG 135 12.262 -3.290 13.798 1017 HB3 ARG 135 HB3 ARG 135 13.431 -2.843 12.562 1018 HG2 ARG 135 HG2 ARG 135 13.174 -0.482 13.470 1019 HG3 ARG 135 HG3 ARG 135 12.462 -1.254 14.891 1020 HD2 ARG 135 HD2 ARG 135 14.782 -0.991 15.329 1021 HD3 ARG 135 HD3 ARG 135 14.491 -2.699 14.993 1022 HE ARG 135 HE ARG 135 15.427 -0.933 12.829 1023 HH11 ARG 135 HH11 ARG 135 16.003 -3.788 14.812 1024 HH12 ARG 135 HH12 ARG 135 17.467 -4.196 14.032 1025 HH21 ARG 135 HH21 ARG 135 17.299 -1.524 11.731 1026 HH22 ARG 135 HH22 ARG 135 18.212 -2.909 12.166 1027 H GLU 136 H GLU 136 12.946 -2.416 10.203 1028 HA GLU 136 HA GLU 136 13.910 0.220 9.880 1029 HB2 GLU 136 HB2 GLU 136 14.021 -2.187 8.084 1030 HB3 GLU 136 HB3 GLU 136 14.682 -0.631 7.605 1031 HG2 GLU 136 HG2 GLU 136 15.513 -2.271 9.986 1032 HG3 GLU 136 HG3 GLU 136 16.430 -2.022 8.500 1033 H VAL 137 H VAL 137 11.160 -1.436 8.704 1034 HA VAL 137 HA VAL 137 10.535 0.428 6.632 1035 HB VAL 137 HB VAL 137 8.687 -1.506 8.083 1036 HG11 VAL 137 HG11 VAL 137 7.460 0.239 6.893 1037 HG12 VAL 137 HG12 VAL 137 7.255 -1.326 6.103 1038 HG13 VAL 137 HG13 VAL 137 8.348 -0.131 5.415 1039 HG21 VAL 137 HG21 VAL 137 10.555 -2.679 7.043 1040 HG22 VAL 137 HG22 VAL 137 10.219 -1.877 5.509 1041 HG23 VAL 137 HG23 VAL 137 9.054 -3.010 6.175 1042 H VAL 138 H VAL 138 9.488 -0.121 9.969 1043 HA VAL 138 HA VAL 138 7.695 2.011 10.203 1044 HB VAL 138 HB VAL 138 9.458 0.837 12.382 1045 HG11 VAL 138 HG11 VAL 138 6.916 2.448 12.607 1046 HG12 VAL 138 HG12 VAL 138 8.536 3.001 13.021 1047 HG13 VAL 138 HG13 VAL 138 7.783 1.705 13.955 1048 HG21 VAL 138 HG21 VAL 138 6.634 0.137 11.564 1049 HG22 VAL 138 HG22 VAL 138 7.492 -0.530 12.951 1050 HG23 VAL 138 HG23 VAL 138 8.066 -0.861 11.317 1051 H ARG 139 H ARG 139 11.150 1.882 11.010 1052 HA ARG 139 HA ARG 139 11.202 4.591 11.629 1053 HB2 ARG 139 HB2 ARG 139 13.705 4.474 11.646 1054 HB3 ARG 139 HB3 ARG 139 12.868 3.312 12.651 1055 HG2 ARG 139 HG2 ARG 139 14.609 2.195 11.800 1056 HG3 ARG 139 HG3 ARG 139 13.235 1.689 10.819 1057 HD2 ARG 139 HD2 ARG 139 15.274 2.085 9.447 1058 HD3 ARG 139 HD3 ARG 139 13.944 3.153 9.010 1059 HE ARG 139 HE ARG 139 15.044 4.895 10.281 1060 HH11 ARG 139 HH11 ARG 139 17.136 2.103 9.459 1061 HH12 ARG 139 HH12 ARG 139 18.537 3.043 9.410 1062 HH21 ARG 139 HH21 ARG 139 16.979 6.140 10.205 1063 HH22 ARG 139 HH22 ARG 139 18.457 5.415 9.842 1064 H ARG 140 H ARG 140 11.759 3.046 8.553 1065 HA ARG 140 HA ARG 140 12.556 5.373 7.144 1066 HB2 ARG 140 HB2 ARG 140 11.723 2.691 6.467 1067 HB3 ARG 140 HB3 ARG 140 10.924 3.842 5.413 1068 HG2 ARG 140 HG2 ARG 140 12.953 3.064 4.381 1069 HG3 ARG 140 HG3 ARG 140 13.117 4.767 4.795 1070 HD2 ARG 140 HD2 ARG 140 14.394 4.148 6.799 1071 HD3 ARG 140 HD3 ARG 140 14.218 2.443 6.381 1072 HE ARG 140 HE ARG 140 15.360 4.012 4.293 1073 HH11 ARG 140 HH11 ARG 140 16.182 2.166 7.237 1074 HH12 ARG 140 HH12 ARG 140 17.797 1.948 6.814 1075 HH21 ARG 140 HH21 ARG 140 17.582 3.641 3.693 1076 HH22 ARG 140 HH22 ARG 140 18.632 2.840 4.751 1077 H ALA 141 H ALA 141 9.424 4.014 7.975 1078 HA ALA 141 HA ALA 141 7.757 5.771 6.595 1079 HB1 ALA 141 HB1 ALA 141 7.306 4.278 9.177 1080 HB2 ALA 141 HB2 ALA 141 6.959 3.685 7.552 1081 HB3 ALA 141 HB3 ALA 141 6.042 5.037 8.219 1082 H GLN 142 H GLN 142 9.073 5.887 9.863 1083 HA GLN 142 HA GLN 142 7.942 8.241 10.860 1084 HB2 GLN 142 HB2 GLN 142 10.738 7.160 11.270 1085 HB3 GLN 142 HB3 GLN 142 10.022 8.437 12.233 1086 HG2 GLN 142 HG2 GLN 142 8.807 5.699 12.040 1087 HG3 GLN 142 HG3 GLN 142 10.060 6.096 13.210 1088 HE21 GLN 142 HE21 GLN 142 8.715 5.706 14.896 1089 HE22 GLN 142 HE22 GLN 142 7.429 6.767 15.357 1090 H ALA 143 H ALA 143 10.956 7.784 9.077 1091 HA ALA 143 HA ALA 143 11.729 10.473 8.965 1092 HB1 ALA 143 HB1 ALA 143 13.332 9.763 7.271 1093 HB2 ALA 143 HB2 ALA 143 12.460 8.243 7.076 1094 HB3 ALA 143 HB3 ALA 143 13.272 8.600 8.598 1095 H MET 144 H MET 144 9.670 8.574 6.883 1096 HA MET 144 HA MET 144 9.589 10.568 4.811 1097 HB2 MET 144 HB2 MET 144 7.740 8.222 5.273 1098 HB3 MET 144 HB3 MET 144 7.695 9.264 3.866 1099 HG2 MET 144 HG2 MET 144 9.882 7.377 4.681 1100 HG3 MET 144 HG3 MET 144 8.802 7.246 3.309 1101 HE1 MET 144 HE1 MET 144 9.998 10.196 0.990 1102 HE2 MET 144 HE2 MET 144 8.737 10.280 2.217 1103 HE3 MET 144 HE3 MET 144 8.860 8.862 1.181 1104 H ALA 145 H ALA 145 7.419 9.564 7.391 1105 HA ALA 145 HA ALA 145 5.313 11.300 6.688 1106 HB1 ALA 145 HB1 ALA 145 4.361 10.717 8.837 1107 HB2 ALA 145 HB2 ALA 145 5.909 10.060 9.354 1108 HB3 ALA 145 HB3 ALA 145 5.022 9.286 8.045 1109 H TYR 146 H TYR 146 8.044 11.646 8.899 1110 HA TYR 146 HA TYR 146 7.068 14.330 9.462 1111 HB2 TYR 146 HB2 TYR 146 8.988 12.572 10.998 1112 HB3 TYR 146 HB3 TYR 146 8.581 14.229 11.431 1113 HD1 TYR 146 HD1 TYR 146 6.133 14.754 11.922 1114 HD2 TYR 146 HD2 TYR 146 7.637 10.780 11.752 1115 HE1 TYR 146 HE1 TYR 146 4.195 13.971 13.200 1116 HE2 TYR 146 HE2 TYR 146 5.687 9.992 13.038 1117 HH TYR 146 HH TYR 146 2.940 11.948 13.560 Start of MODEL 7 1 H MET 1 H MET 1 -20.021 39.422 17.249 2 HA MET 1 HA MET 1 -20.477 38.334 15.200 3 HB2 MET 1 HB2 MET 1 -18.612 38.044 13.543 4 HB3 MET 1 HB3 MET 1 -19.188 39.690 13.666 5 HG2 MET 1 HG2 MET 1 -17.251 40.283 15.025 6 HG3 MET 1 HG3 MET 1 -16.678 38.618 14.942 7 HE1 MET 1 HE1 MET 1 -14.322 39.396 14.084 8 HE2 MET 1 HE2 MET 1 -14.836 41.077 14.201 9 HE3 MET 1 HE3 MET 1 -14.078 40.491 12.720 10 HA PRO 2 HA PRO 2 -18.351 35.330 17.856 11 HB2 PRO 2 HB2 PRO 2 -20.848 33.986 18.276 12 HB3 PRO 2 HB3 PRO 2 -19.961 34.966 19.440 13 HG2 PRO 2 HG2 PRO 2 -22.410 35.660 18.365 14 HG3 PRO 2 HG3 PRO 2 -21.258 36.805 19.066 15 HD2 PRO 2 HD2 PRO 2 -21.746 36.137 16.184 16 HD3 PRO 2 HD3 PRO 2 -21.429 37.716 16.943 17 H GLY 3 H GLY 3 -17.288 34.227 16.223 18 HA2 GLY 3 HA2 GLY 3 -18.873 32.699 14.316 19 HA3 GLY 3 HA3 GLY 3 -17.163 33.071 14.183 20 H ARG 4 H ARG 4 -18.990 31.601 16.805 21 HA ARG 4 HA ARG 4 -17.047 29.503 17.013 22 HB2 ARG 4 HB2 ARG 4 -18.506 28.547 18.769 23 HB3 ARG 4 HB3 ARG 4 -18.147 30.239 19.059 24 HG2 ARG 4 HG2 ARG 4 -20.361 30.869 18.291 25 HG3 ARG 4 HG3 ARG 4 -20.713 29.192 17.873 26 HD2 ARG 4 HD2 ARG 4 -20.487 28.550 20.212 27 HD3 ARG 4 HD3 ARG 4 -20.091 30.215 20.642 28 HE ARG 4 HE ARG 4 -22.486 30.428 19.411 29 HH11 ARG 4 HH11 ARG 4 -21.403 28.377 22.073 30 HH12 ARG 4 HH12 ARG 4 -22.886 28.422 22.908 31 HH21 ARG 4 HH21 ARG 4 -24.488 30.486 20.513 32 HH22 ARG 4 HH22 ARG 4 -24.702 29.638 21.987 33 H ALA 5 H ALA 5 -17.087 27.539 16.130 34 HA ALA 5 HA ALA 5 -19.555 26.598 14.905 35 HB1 ALA 5 HB1 ALA 5 -18.209 27.612 13.101 36 HB2 ALA 5 HB2 ALA 5 -18.330 25.864 12.905 37 HB3 ALA 5 HB3 ALA 5 -16.849 26.577 13.543 38 HA PRO 6 HA PRO 6 -17.621 23.311 17.321 39 HB2 PRO 6 HB2 PRO 6 -19.729 22.700 18.835 40 HB3 PRO 6 HB3 PRO 6 -18.750 24.139 19.145 41 HG2 PRO 6 HG2 PRO 6 -21.470 23.937 17.989 42 HG3 PRO 6 HG3 PRO 6 -20.722 25.259 18.900 43 HD2 PRO 6 HD2 PRO 6 -20.996 25.026 16.062 44 HD3 PRO 6 HD3 PRO 6 -20.183 26.311 16.974 45 H GLY 7 H GLY 7 -18.701 21.054 17.873 46 HA2 GLY 7 HA2 GLY 7 -19.732 19.136 17.166 47 HA3 GLY 7 HA3 GLY 7 -20.609 20.089 15.977 48 H SER 8 H SER 8 -17.119 20.180 16.173 49 HA SER 8 HA SER 8 -16.921 19.331 13.503 50 HB2 SER 8 HB2 SER 8 -14.397 19.464 14.203 51 HB3 SER 8 HB3 SER 8 -15.349 20.943 14.075 52 HG SER 8 HG SER 8 -14.160 20.863 15.962 53 H THR 9 H THR 9 -17.052 17.337 12.898 54 HA THR 9 HA THR 9 -16.726 15.183 14.774 55 HB THR 9 HB THR 9 -17.465 15.114 11.842 56 HG1 THR 9 HG1 THR 9 -18.733 16.232 13.802 57 HG21 THR 9 HG21 THR 9 -16.804 12.929 12.773 58 HG22 THR 9 HG22 THR 9 -18.536 12.976 12.450 59 HG23 THR 9 HG23 THR 9 -17.946 13.149 14.101 60 H LEU 10 H LEU 10 -14.926 13.956 14.909 61 HA LEU 10 HA LEU 10 -12.605 14.541 13.397 62 HB2 LEU 10 HB2 LEU 10 -13.236 12.181 15.171 63 HB3 LEU 10 HB3 LEU 10 -11.658 12.516 14.499 64 HG LEU 10 HG LEU 10 -13.134 14.240 16.487 65 HD11 LEU 10 HD11 LEU 10 -10.715 12.473 16.794 66 HD12 LEU 10 HD12 LEU 10 -12.321 12.165 17.456 67 HD13 LEU 10 HD13 LEU 10 -11.378 13.538 18.032 68 HD21 LEU 10 HD21 LEU 10 -11.027 15.506 16.612 69 HD22 LEU 10 HD22 LEU 10 -11.742 15.596 15.004 70 HD23 LEU 10 HD23 LEU 10 -10.370 14.533 15.300 71 H ALA 11 H ALA 11 -11.451 13.002 12.068 72 HA ALA 11 HA ALA 11 -13.231 11.209 10.617 73 HB1 ALA 11 HB1 ALA 11 -11.430 13.278 9.360 74 HB2 ALA 11 HB2 ALA 11 -13.196 13.307 9.383 75 HB3 ALA 11 HB3 ALA 11 -12.342 12.050 8.487 76 H ARG 12 H ARG 12 -12.215 9.432 11.466 77 HA ARG 12 HA ARG 12 -9.396 9.167 10.705 78 HB2 ARG 12 HB2 ARG 12 -9.054 7.578 12.540 79 HB3 ARG 12 HB3 ARG 12 -9.623 9.129 13.138 80 HG2 ARG 12 HG2 ARG 12 -11.866 8.241 13.374 81 HG3 ARG 12 HG3 ARG 12 -11.333 6.691 12.719 82 HD2 ARG 12 HD2 ARG 12 -11.473 6.593 15.118 83 HD3 ARG 12 HD3 ARG 12 -9.790 6.448 14.614 84 HE ARG 12 HE ARG 12 -9.709 8.936 15.158 85 HH11 ARG 12 HH11 ARG 12 -11.815 6.653 16.879 86 HH12 ARG 12 HH12 ARG 12 -11.789 7.527 18.338 87 HH21 ARG 12 HH21 ARG 12 -9.649 10.098 17.162 88 HH22 ARG 12 HH22 ARG 12 -10.552 9.547 18.505 89 H VAL 13 H VAL 13 -12.074 8.461 9.657 90 HA VAL 13 HA VAL 13 -11.641 5.637 9.047 91 HB VAL 13 HB VAL 13 -13.933 7.435 8.131 92 HG11 VAL 13 HG11 VAL 13 -13.649 4.445 8.007 93 HG12 VAL 13 HG12 VAL 13 -13.567 5.550 6.630 94 HG13 VAL 13 HG13 VAL 13 -15.073 5.368 7.532 95 HG21 VAL 13 HG21 VAL 13 -13.930 7.131 10.553 96 HG22 VAL 13 HG22 VAL 13 -13.867 5.385 10.344 97 HG23 VAL 13 HG23 VAL 13 -15.286 6.287 9.810 98 H GLY 14 H GLY 14 -10.107 5.393 7.660 99 HA2 GLY 14 HA2 GLY 14 -9.339 7.438 5.833 100 HA3 GLY 14 HA3 GLY 14 -8.583 5.868 6.039 101 H SER 15 H SER 15 -11.082 7.629 4.470 102 HA SER 15 HA SER 15 -11.621 5.381 2.739 103 HB2 SER 15 HB2 SER 15 -13.450 6.971 3.478 104 HB3 SER 15 HB3 SER 15 -12.644 8.233 2.553 105 HG SER 15 HG SER 15 -12.915 6.760 0.705 106 H ILE 16 H ILE 16 -9.456 5.195 2.073 107 HA ILE 16 HA ILE 16 -8.098 7.345 0.768 108 HB ILE 16 HB ILE 16 -7.478 4.371 0.865 109 HG12 ILE 16 HG12 ILE 16 -5.381 5.262 2.117 110 HG13 ILE 16 HG13 ILE 16 -6.323 6.727 2.339 111 HG21 ILE 16 HG21 ILE 16 -5.296 4.814 -0.101 112 HG22 ILE 16 HG22 ILE 16 -5.764 6.495 -0.366 113 HG23 ILE 16 HG23 ILE 16 -6.609 5.201 -1.216 114 HD11 ILE 16 HD11 ILE 16 -7.052 3.976 3.297 115 HD12 ILE 16 HD12 ILE 16 -8.018 5.434 3.521 116 HD13 ILE 16 HD13 ILE 16 -6.432 5.302 4.282 117 HA PRO 17 HA PRO 17 -9.968 6.412 -3.260 118 HB2 PRO 17 HB2 PRO 17 -8.486 8.766 -4.168 119 HB3 PRO 17 HB3 PRO 17 -10.236 8.536 -4.107 120 HG2 PRO 17 HG2 PRO 17 -8.931 10.280 -2.482 121 HG3 PRO 17 HG3 PRO 17 -10.418 9.443 -2.009 122 HD2 PRO 17 HD2 PRO 17 -7.583 8.816 -1.279 123 HD3 PRO 17 HD3 PRO 17 -9.055 8.780 -0.279 124 H ALA 18 H ALA 18 -8.914 5.266 -4.875 125 HA ALA 18 HA ALA 18 -6.113 4.789 -4.350 126 HB1 ALA 18 HB1 ALA 18 -6.333 2.993 -5.997 127 HB2 ALA 18 HB2 ALA 18 -7.987 3.511 -6.352 128 HB3 ALA 18 HB3 ALA 18 -7.579 2.885 -4.760 129 H GLY 19 H GLY 19 -4.484 5.725 -5.424 130 HA2 GLY 19 HA2 GLY 19 -5.231 7.439 -7.656 131 HA3 GLY 19 HA3 GLY 19 -3.829 7.642 -6.620 132 H ASP 20 H ASP 20 -1.927 6.674 -7.183 133 HA ASP 20 HA ASP 20 -2.079 5.172 -9.689 134 HB2 ASP 20 HB2 ASP 20 -1.194 7.434 -10.043 135 HB3 ASP 20 HB3 ASP 20 0.075 7.118 -8.866 136 H ASP 21 H ASP 21 -0.949 3.393 -9.901 137 HA ASP 21 HA ASP 21 0.088 2.130 -7.533 138 HB2 ASP 21 HB2 ASP 21 -1.255 0.776 -8.995 139 HB3 ASP 21 HB3 ASP 21 -0.253 1.188 -10.379 140 H VAL 22 H VAL 22 2.141 1.390 -7.221 141 HA VAL 22 HA VAL 22 4.180 2.798 -8.787 142 HB VAL 22 HB VAL 22 4.238 2.210 -5.801 143 HG11 VAL 22 HG11 VAL 22 6.223 3.733 -7.475 144 HG12 VAL 22 HG12 VAL 22 6.474 2.131 -6.788 145 HG13 VAL 22 HG13 VAL 22 6.289 3.528 -5.722 146 HG21 VAL 22 HG21 VAL 22 3.952 4.820 -7.276 147 HG22 VAL 22 HG22 VAL 22 4.111 4.645 -5.530 148 HG23 VAL 22 HG23 VAL 22 2.691 4.001 -6.359 149 H LEU 23 H LEU 23 3.057 -0.318 -7.819 150 HA LEU 23 HA LEU 23 5.737 -1.312 -8.129 151 HB2 LEU 23 HB2 LEU 23 4.780 -3.630 -7.669 152 HB3 LEU 23 HB3 LEU 23 4.790 -2.495 -6.350 153 HG LEU 23 HG LEU 23 2.352 -2.205 -6.588 154 HD11 LEU 23 HD11 LEU 23 2.601 -4.358 -8.689 155 HD12 LEU 23 HD12 LEU 23 2.130 -2.683 -8.975 156 HD13 LEU 23 HD13 LEU 23 1.092 -3.740 -8.019 157 HD21 LEU 23 HD21 LEU 23 1.706 -4.434 -5.828 158 HD22 LEU 23 HD22 LEU 23 3.196 -3.871 -5.070 159 HD23 LEU 23 HD23 LEU 23 3.258 -5.059 -6.372 160 H ASP 24 H ASP 24 5.783 -3.525 -9.432 161 HA ASP 24 HA ASP 24 5.295 -2.601 -12.129 162 HB2 ASP 24 HB2 ASP 24 7.427 -3.724 -11.551 163 HB3 ASP 24 HB3 ASP 24 6.555 -5.194 -11.160 164 HA PRO 25 HA PRO 25 1.331 -4.478 -12.749 165 HB2 PRO 25 HB2 PRO 25 2.450 -5.336 -15.375 166 HB3 PRO 25 HB3 PRO 25 0.927 -4.522 -15.016 167 HG2 PRO 25 HG2 PRO 25 2.977 -3.150 -16.001 168 HG3 PRO 25 HG3 PRO 25 1.931 -2.451 -14.755 169 HD2 PRO 25 HD2 PRO 25 4.698 -3.527 -14.517 170 HD3 PRO 25 HD3 PRO 25 3.918 -2.196 -13.641 171 H ASP 26 H ASP 26 4.210 -6.433 -13.432 172 HA ASP 26 HA ASP 26 2.612 -8.831 -13.373 173 HB2 ASP 26 HB2 ASP 26 5.491 -8.374 -13.926 174 HB3 ASP 26 HB3 ASP 26 4.973 -9.976 -13.413 175 H GLU 27 H GLU 27 3.953 -6.958 -10.982 176 HA GLU 27 HA GLU 27 4.611 -8.993 -9.135 177 HB2 GLU 27 HB2 GLU 27 3.569 -6.188 -8.640 178 HB3 GLU 27 HB3 GLU 27 4.215 -7.243 -7.396 179 HG2 GLU 27 HG2 GLU 27 5.763 -6.271 -9.771 180 HG3 GLU 27 HG3 GLU 27 5.795 -5.498 -8.184 181 HA PRO 28 HA PRO 28 0.631 -10.804 -8.457 182 HB2 PRO 28 HB2 PRO 28 1.566 -10.935 -5.624 183 HB3 PRO 28 HB3 PRO 28 0.903 -12.216 -6.642 184 HG2 PRO 28 HG2 PRO 28 3.498 -12.128 -6.167 185 HG3 PRO 28 HG3 PRO 28 2.901 -12.513 -7.791 186 HD2 PRO 28 HD2 PRO 28 4.072 -9.968 -6.762 187 HD3 PRO 28 HD3 PRO 28 4.266 -10.759 -8.342 188 H THR 29 H THR 29 -1.341 -9.974 -8.033 189 HA THR 29 HA THR 29 -1.587 -7.871 -6.040 190 HB THR 29 HB THR 29 -3.230 -6.768 -7.678 191 HG1 THR 29 HG1 THR 29 -1.674 -7.987 -9.692 192 HG21 THR 29 HG21 THR 29 -1.447 -5.497 -8.815 193 HG22 THR 29 HG22 THR 29 -0.272 -6.721 -8.335 194 HG23 THR 29 HG23 THR 29 -1.077 -5.738 -7.109 195 H TYR 30 H TYR 30 -3.892 -7.409 -5.594 196 HA TYR 30 HA TYR 30 -5.722 -9.663 -5.930 197 HB2 TYR 30 HB2 TYR 30 -5.115 -8.125 -3.405 198 HB3 TYR 30 HB3 TYR 30 -6.603 -9.030 -3.652 199 HD1 TYR 30 HD1 TYR 30 -5.823 -11.505 -4.807 200 HD2 TYR 30 HD2 TYR 30 -3.783 -9.192 -1.889 201 HE1 TYR 30 HE1 TYR 30 -4.751 -13.527 -3.984 202 HE2 TYR 30 HE2 TYR 30 -2.697 -11.211 -1.034 203 HH TYR 30 HH TYR 30 -3.114 -13.660 -1.025 204 H ASP 31 H ASP 31 -7.915 -8.964 -5.708 205 HA ASP 31 HA ASP 31 -8.338 -6.106 -5.946 206 HB2 ASP 31 HB2 ASP 31 -10.064 -6.497 -7.731 207 HB3 ASP 31 HB3 ASP 31 -8.444 -6.893 -8.274 208 H LEU 32 H LEU 32 -10.845 -5.756 -5.674 209 HA LEU 32 HA LEU 32 -11.207 -6.264 -3.040 210 HB2 LEU 32 HB2 LEU 32 -13.222 -5.447 -5.069 211 HB3 LEU 32 HB3 LEU 32 -13.694 -5.698 -3.407 212 HG LEU 32 HG LEU 32 -13.339 -3.390 -3.749 213 HD11 LEU 32 HD11 LEU 32 -12.668 -4.222 -1.595 214 HD12 LEU 32 HD12 LEU 32 -11.698 -2.837 -2.076 215 HD13 LEU 32 HD13 LEU 32 -11.014 -4.455 -2.172 216 HD21 LEU 32 HD21 LEU 32 -11.883 -3.426 -5.699 217 HD22 LEU 32 HD22 LEU 32 -10.553 -4.033 -4.712 218 HD23 LEU 32 HD23 LEU 32 -11.190 -2.410 -4.435 219 HA PRO 33 HA PRO 33 -14.316 -9.905 -3.458 220 HB2 PRO 33 HB2 PRO 33 -14.222 -11.298 -5.839 221 HB3 PRO 33 HB3 PRO 33 -15.451 -10.104 -5.422 222 HG2 PRO 33 HG2 PRO 33 -13.007 -9.796 -7.102 223 HG3 PRO 33 HG3 PRO 33 -14.628 -9.118 -7.338 224 HD2 PRO 33 HD2 PRO 33 -12.580 -7.654 -6.387 225 HD3 PRO 33 HD3 PRO 33 -14.255 -7.396 -5.856 226 H ARG 34 H ARG 34 -11.219 -9.968 -5.176 227 HA ARG 34 HA ARG 34 -10.638 -12.665 -4.538 228 HB2 ARG 34 HB2 ARG 34 -9.589 -11.086 -6.339 229 HB3 ARG 34 HB3 ARG 34 -8.527 -10.604 -5.023 230 HG2 ARG 34 HG2 ARG 34 -7.439 -12.312 -6.294 231 HG3 ARG 34 HG3 ARG 34 -7.905 -12.991 -4.729 232 HD2 ARG 34 HD2 ARG 34 -9.841 -14.037 -5.698 233 HD3 ARG 34 HD3 ARG 34 -9.533 -13.253 -7.247 234 HE ARG 34 HE ARG 34 -8.136 -15.479 -6.022 235 HH11 ARG 34 HH11 ARG 34 -8.396 -13.250 -8.788 236 HH12 ARG 34 HH12 ARG 34 -7.567 -14.269 -9.864 237 HH21 ARG 34 HH21 ARG 34 -7.009 -16.864 -7.531 238 HH22 ARG 34 HH22 ARG 34 -6.740 -16.381 -9.145 239 H VAL 35 H VAL 35 -10.013 -9.563 -2.993 240 HA VAL 35 HA VAL 35 -8.370 -10.658 -0.954 241 HB VAL 35 HB VAL 35 -9.982 -8.080 -0.810 242 HG11 VAL 35 HG11 VAL 35 -7.603 -8.973 0.819 243 HG12 VAL 35 HG12 VAL 35 -9.259 -8.823 1.396 244 HG13 VAL 35 HG13 VAL 35 -8.359 -7.383 0.911 245 HG21 VAL 35 HG21 VAL 35 -8.448 -8.057 -2.703 246 HG22 VAL 35 HG22 VAL 35 -7.116 -8.493 -1.633 247 HG23 VAL 35 HG23 VAL 35 -7.920 -6.934 -1.448 248 H ALA 36 H ALA 36 -11.773 -10.036 -1.259 249 HA ALA 36 HA ALA 36 -12.632 -10.705 1.307 250 HB1 ALA 36 HB1 ALA 36 -14.010 -11.240 -1.334 251 HB2 ALA 36 HB2 ALA 36 -14.090 -9.737 -0.410 252 HB3 ALA 36 HB3 ALA 36 -14.783 -11.214 0.256 253 H GLU 37 H GLU 37 -11.924 -12.655 -1.480 254 HA GLU 37 HA GLU 37 -12.588 -15.226 -0.576 255 HB2 GLU 37 HB2 GLU 37 -12.003 -14.451 -2.896 256 HB3 GLU 37 HB3 GLU 37 -10.364 -14.370 -2.360 257 HG2 GLU 37 HG2 GLU 37 -10.281 -16.735 -1.881 258 HG3 GLU 37 HG3 GLU 37 -11.955 -16.913 -2.406 259 H LEU 38 H LEU 38 -9.603 -13.399 -0.506 260 HA LEU 38 HA LEU 38 -7.913 -15.382 0.521 261 HB2 LEU 38 HB2 LEU 38 -7.165 -13.388 -0.661 262 HB3 LEU 38 HB3 LEU 38 -7.710 -12.393 0.676 263 HG LEU 38 HG LEU 38 -6.052 -13.629 2.117 264 HD11 LEU 38 HD11 LEU 38 -5.065 -14.584 -0.554 265 HD12 LEU 38 HD12 LEU 38 -5.710 -15.581 0.754 266 HD13 LEU 38 HD13 LEU 38 -4.191 -14.712 0.970 267 HD21 LEU 38 HD21 LEU 38 -5.672 -11.378 1.306 268 HD22 LEU 38 HD22 LEU 38 -5.010 -12.021 -0.195 269 HD23 LEU 38 HD23 LEU 38 -4.166 -12.302 1.330 270 H LEU 39 H LEU 39 -9.622 -12.719 2.098 271 HA LEU 39 HA LEU 39 -8.597 -13.530 4.673 272 HB2 LEU 39 HB2 LEU 39 -10.448 -11.299 3.912 273 HB3 LEU 39 HB3 LEU 39 -9.860 -11.586 5.539 274 HG LEU 39 HG LEU 39 -8.202 -10.811 3.135 275 HD11 LEU 39 HD11 LEU 39 -8.913 -9.291 5.634 276 HD12 LEU 39 HD12 LEU 39 -9.534 -8.981 4.013 277 HD13 LEU 39 HD13 LEU 39 -7.825 -8.732 4.366 278 HD21 LEU 39 HD21 LEU 39 -6.899 -12.278 4.567 279 HD22 LEU 39 HD22 LEU 39 -7.358 -11.337 5.989 280 HD23 LEU 39 HD23 LEU 39 -6.338 -10.621 4.747 281 H GLY 40 H GLY 40 -11.373 -14.231 2.861 282 HA2 GLY 40 HA2 GLY 40 -13.055 -15.730 3.418 283 HA3 GLY 40 HA3 GLY 40 -12.312 -15.904 5.001 284 H VAL 41 H VAL 41 -13.158 -12.857 3.657 285 HA VAL 41 HA VAL 41 -15.531 -12.670 5.379 286 HB VAL 41 HB VAL 41 -14.971 -10.303 5.921 287 HG11 VAL 41 HG11 VAL 41 -13.186 -10.699 7.539 288 HG12 VAL 41 HG12 VAL 41 -12.804 -12.221 6.740 289 HG13 VAL 41 HG13 VAL 41 -14.367 -12.009 7.533 290 HG21 VAL 41 HG21 VAL 41 -12.326 -10.890 4.591 291 HG22 VAL 41 HG22 VAL 41 -12.706 -9.429 5.506 292 HG23 VAL 41 HG23 VAL 41 -13.560 -9.779 4.003 293 HA PRO 42 HA PRO 42 -17.460 -10.921 1.741 294 HB2 PRO 42 HB2 PRO 42 -18.985 -8.920 2.822 295 HB3 PRO 42 HB3 PRO 42 -19.462 -10.620 2.819 296 HG2 PRO 42 HG2 PRO 42 -18.201 -9.017 5.012 297 HG3 PRO 42 HG3 PRO 42 -19.502 -10.218 5.115 298 HD2 PRO 42 HD2 PRO 42 -16.983 -10.840 5.805 299 HD3 PRO 42 HD3 PRO 42 -18.024 -12.008 4.976 300 H VAL 43 H VAL 43 -17.538 -9.020 0.435 301 HA VAL 43 HA VAL 43 -15.148 -7.551 0.331 302 HB VAL 43 HB VAL 43 -17.768 -6.944 -1.047 303 HG11 VAL 43 HG11 VAL 43 -16.381 -5.829 -2.771 304 HG12 VAL 43 HG12 VAL 43 -14.952 -6.117 -1.774 305 HG13 VAL 43 HG13 VAL 43 -16.234 -5.056 -1.191 306 HG21 VAL 43 HG21 VAL 43 -16.862 -8.213 -2.956 307 HG22 VAL 43 HG22 VAL 43 -17.050 -9.217 -1.519 308 HG23 VAL 43 HG23 VAL 43 -15.453 -8.634 -1.987 309 H SER 44 H SER 44 -18.238 -6.782 1.691 310 HA SER 44 HA SER 44 -17.980 -4.058 2.063 311 HB2 SER 44 HB2 SER 44 -19.607 -4.518 3.946 312 HB3 SER 44 HB3 SER 44 -20.028 -5.143 2.339 313 HG SER 44 HG SER 44 -20.311 -6.921 3.419 314 H LYS 45 H LYS 45 -16.909 -6.763 4.076 315 HA LYS 45 HA LYS 45 -15.902 -5.098 6.072 316 HB2 LYS 45 HB2 LYS 45 -15.456 -8.001 5.538 317 HB3 LYS 45 HB3 LYS 45 -14.668 -7.160 6.874 318 HG2 LYS 45 HG2 LYS 45 -16.832 -6.481 7.722 319 HG3 LYS 45 HG3 LYS 45 -17.618 -7.326 6.394 320 HD2 LYS 45 HD2 LYS 45 -16.636 -9.428 7.162 321 HD3 LYS 45 HD3 LYS 45 -15.884 -8.563 8.506 322 HE2 LYS 45 HE2 LYS 45 -18.829 -8.627 7.977 323 HE3 LYS 45 HE3 LYS 45 -18.003 -9.727 9.078 324 HZ1 LYS 45 HZ1 LYS 45 -17.344 -7.883 10.410 325 HZ2 LYS 45 HZ2 LYS 45 -19.000 -7.847 10.211 326 HZ3 LYS 45 HZ3 LYS 45 -18.036 -6.752 9.361 327 H VAL 46 H VAL 46 -14.534 -6.505 3.225 328 HA VAL 46 HA VAL 46 -11.827 -5.936 3.733 329 HB VAL 46 HB VAL 46 -13.290 -5.954 1.068 330 HG11 VAL 46 HG11 VAL 46 -11.093 -6.283 0.040 331 HG12 VAL 46 HG12 VAL 46 -10.335 -6.128 1.633 332 HG13 VAL 46 HG13 VAL 46 -11.187 -4.755 0.926 333 HG21 VAL 46 HG21 VAL 46 -12.392 -8.234 0.845 334 HG22 VAL 46 HG22 VAL 46 -13.457 -8.081 2.243 335 HG23 VAL 46 HG23 VAL 46 -11.706 -8.113 2.463 336 H ALA 47 H ALA 47 -14.413 -4.045 2.320 337 HA ALA 47 HA ALA 47 -12.962 -1.736 1.684 338 HB1 ALA 47 HB1 ALA 47 -15.876 -1.962 2.450 339 HB2 ALA 47 HB2 ALA 47 -15.229 -2.203 0.834 340 HB3 ALA 47 HB3 ALA 47 -15.130 -0.609 1.597 341 H GLN 48 H GLN 48 -14.585 -2.732 4.653 342 HA GLN 48 HA GLN 48 -13.946 -0.256 5.866 343 HB2 GLN 48 HB2 GLN 48 -14.838 -1.078 8.031 344 HB3 GLN 48 HB3 GLN 48 -15.945 -1.335 6.705 345 HG2 GLN 48 HG2 GLN 48 -16.149 -3.278 7.947 346 HG3 GLN 48 HG3 GLN 48 -15.037 -3.639 6.624 347 HE21 GLN 48 HE21 GLN 48 -13.898 -1.848 9.391 348 HE22 GLN 48 HE22 GLN 48 -12.918 -3.117 10.010 349 H GLN 49 H GLN 49 -12.304 -3.313 5.810 350 HA GLN 49 HA GLN 49 -10.299 -2.831 7.727 351 HB2 GLN 49 HB2 GLN 49 -10.033 -4.187 5.031 352 HB3 GLN 49 HB3 GLN 49 -8.853 -4.295 6.324 353 HG2 GLN 49 HG2 GLN 49 -11.695 -5.232 6.555 354 HG3 GLN 49 HG3 GLN 49 -10.342 -6.249 6.071 355 HE21 GLN 49 HE21 GLN 49 -12.161 -6.307 8.378 356 HE22 GLN 49 HE22 GLN 49 -11.164 -6.330 9.789 357 H LEU 50 H LEU 50 -10.525 -1.951 4.363 358 HA LEU 50 HA LEU 50 -8.104 -0.562 3.973 359 HB2 LEU 50 HB2 LEU 50 -9.528 -1.180 2.125 360 HB3 LEU 50 HB3 LEU 50 -10.862 -0.257 2.771 361 HG LEU 50 HG LEU 50 -9.545 1.829 2.299 362 HD11 LEU 50 HD11 LEU 50 -7.753 -0.054 0.796 363 HD12 LEU 50 HD12 LEU 50 -7.330 0.883 2.230 364 HD13 LEU 50 HD13 LEU 50 -7.709 1.708 0.719 365 HD21 LEU 50 HD21 LEU 50 -10.196 0.048 -0.043 366 HD22 LEU 50 HD22 LEU 50 -10.005 1.801 -0.101 367 HD23 LEU 50 HD23 LEU 50 -11.322 1.088 0.830 368 H ARG 51 H ARG 51 -11.285 0.520 4.965 369 HA ARG 51 HA ARG 51 -10.539 3.219 5.345 370 HB2 ARG 51 HB2 ARG 51 -13.006 1.715 6.178 371 HB3 ARG 51 HB3 ARG 51 -12.789 3.443 6.420 372 HG2 ARG 51 HG2 ARG 51 -12.529 3.768 4.021 373 HG3 ARG 51 HG3 ARG 51 -12.717 2.038 3.756 374 HD2 ARG 51 HD2 ARG 51 -14.971 2.129 4.644 375 HD3 ARG 51 HD3 ARG 51 -14.782 3.847 4.997 376 HE ARG 51 HE ARG 51 -14.309 3.212 2.249 377 HH11 ARG 51 HH11 ARG 51 -16.927 3.786 4.562 378 HH12 ARG 51 HH12 ARG 51 -17.980 4.475 3.410 379 HH21 ARG 51 HH21 ARG 51 -15.758 4.144 0.662 380 HH22 ARG 51 HH22 ARG 51 -17.284 4.696 1.144 381 H GLU 52 H GLU 52 -10.260 0.485 7.406 382 HA GLU 52 HA GLU 52 -10.022 2.074 9.812 383 HB2 GLU 52 HB2 GLU 52 -9.534 -0.840 9.219 384 HB3 GLU 52 HB3 GLU 52 -9.228 -0.126 10.789 385 HG2 GLU 52 HG2 GLU 52 -11.890 -0.220 9.393 386 HG3 GLU 52 HG3 GLU 52 -11.373 -1.302 10.680 387 H GLY 53 H GLY 53 -8.102 1.505 7.178 388 HA2 GLY 53 HA2 GLY 53 -5.930 2.184 6.812 389 HA3 GLY 53 HA3 GLY 53 -5.757 2.471 8.542 390 H HIS 54 H HIS 54 -6.999 -0.555 7.498 391 HA HIS 54 HA HIS 54 -4.606 -1.873 8.528 392 HB2 HIS 54 HB2 HIS 54 -7.283 -3.009 7.688 393 HB3 HIS 54 HB3 HIS 54 -5.948 -3.975 8.288 394 HD1 HIS 54 HD1 HIS 54 -8.309 -4.422 9.879 395 HD2 HIS 54 HD2 HIS 54 -5.935 -1.084 10.589 396 HE1 HIS 54 HE1 HIS 54 -8.788 -3.714 12.246 397 H LEU 55 H LEU 55 -5.990 -0.963 5.577 398 HA LEU 55 HA LEU 55 -4.038 -2.470 4.086 399 HB2 LEU 55 HB2 LEU 55 -6.057 -3.945 4.336 400 HB3 LEU 55 HB3 LEU 55 -7.005 -2.711 3.541 401 HG LEU 55 HG LEU 55 -5.626 -3.020 1.499 402 HD11 LEU 55 HD11 LEU 55 -3.589 -3.859 2.535 403 HD12 LEU 55 HD12 LEU 55 -4.192 -5.015 1.349 404 HD13 LEU 55 HD13 LEU 55 -4.440 -5.308 3.068 405 HD21 LEU 55 HD21 LEU 55 -6.964 -5.503 2.579 406 HD22 LEU 55 HD22 LEU 55 -6.609 -5.186 0.880 407 HD23 LEU 55 HD23 LEU 55 -7.762 -4.172 1.744 408 H VAL 56 H VAL 56 -3.832 -1.567 1.924 409 HA VAL 56 HA VAL 56 -5.357 0.831 1.301 410 HB VAL 56 HB VAL 56 -2.296 0.698 1.336 411 HG11 VAL 56 HG11 VAL 56 -4.005 2.906 0.181 412 HG12 VAL 56 HG12 VAL 56 -3.011 1.777 -0.739 413 HG13 VAL 56 HG13 VAL 56 -2.248 2.927 0.355 414 HG21 VAL 56 HG21 VAL 56 -3.283 1.319 3.464 415 HG22 VAL 56 HG22 VAL 56 -4.222 2.585 2.673 416 HG23 VAL 56 HG23 VAL 56 -2.465 2.707 2.731 417 H ALA 57 H ALA 57 -5.467 1.226 -0.950 418 HA ALA 57 HA ALA 57 -4.592 -0.982 -2.657 419 HB1 ALA 57 HB1 ALA 57 -6.979 -1.278 -2.054 420 HB2 ALA 57 HB2 ALA 57 -6.752 -0.957 -3.772 421 HB3 ALA 57 HB3 ALA 57 -7.315 0.328 -2.702 422 H VAL 58 H VAL 58 -4.453 -0.351 -4.911 423 HA VAL 58 HA VAL 58 -4.286 2.528 -5.347 424 HB VAL 58 HB VAL 58 -2.302 2.067 -6.879 425 HG11 VAL 58 HG11 VAL 58 -2.064 3.184 -4.751 426 HG12 VAL 58 HG12 VAL 58 -0.683 2.112 -5.024 427 HG13 VAL 58 HG13 VAL 58 -1.988 1.633 -3.922 428 HG21 VAL 58 HG21 VAL 58 -2.540 -0.366 -7.019 429 HG22 VAL 58 HG22 VAL 58 -2.212 -0.506 -5.292 430 HG23 VAL 58 HG23 VAL 58 -0.952 0.071 -6.388 431 H ARG 59 H ARG 59 -4.148 2.977 -7.774 432 HA ARG 59 HA ARG 59 -6.025 1.130 -9.098 433 HB2 ARG 59 HB2 ARG 59 -6.965 3.300 -8.159 434 HB3 ARG 59 HB3 ARG 59 -5.957 4.121 -9.331 435 HG2 ARG 59 HG2 ARG 59 -7.185 3.028 -11.144 436 HG3 ARG 59 HG3 ARG 59 -8.191 2.199 -9.951 437 HD2 ARG 59 HD2 ARG 59 -8.881 4.388 -9.046 438 HD3 ARG 59 HD3 ARG 59 -7.905 5.160 -10.290 439 HE ARG 59 HE ARG 59 -10.090 3.390 -11.045 440 HH11 ARG 59 HH11 ARG 59 -8.686 6.657 -10.927 441 HH12 ARG 59 HH12 ARG 59 -9.810 7.358 -11.969 442 HH21 ARG 59 HH21 ARG 59 -11.714 4.379 -12.513 443 HH22 ARG 59 HH22 ARG 59 -11.578 6.035 -12.874 444 H ARG 60 H ARG 60 -5.541 0.618 -11.110 445 HA ARG 60 HA ARG 60 -3.815 2.240 -12.708 446 HB2 ARG 60 HB2 ARG 60 -2.179 0.505 -13.185 447 HB3 ARG 60 HB3 ARG 60 -2.196 0.834 -11.461 448 HG2 ARG 60 HG2 ARG 60 -3.574 -1.191 -11.128 449 HG3 ARG 60 HG3 ARG 60 -3.443 -1.516 -12.859 450 HD2 ARG 60 HD2 ARG 60 -0.962 -1.488 -12.585 451 HD3 ARG 60 HD3 ARG 60 -1.214 -1.393 -10.846 452 HE ARG 60 HE ARG 60 -2.618 -3.554 -12.010 453 HH11 ARG 60 HH11 ARG 60 0.483 -2.541 -10.635 454 HH12 ARG 60 HH12 ARG 60 1.165 -4.087 -10.581 455 HH21 ARG 60 HH21 ARG 60 -1.699 -5.742 -11.952 456 HH22 ARG 60 HH22 ARG 60 -0.121 -5.993 -11.397 457 H ALA 61 H ALA 61 -4.281 1.993 -14.842 458 HA ALA 61 HA ALA 61 -5.412 1.446 -16.705 459 HB1 ALA 61 HB1 ALA 61 -5.731 -1.279 -15.426 460 HB2 ALA 61 HB2 ALA 61 -4.384 -0.778 -16.447 461 HB3 ALA 61 HB3 ALA 61 -6.008 -0.906 -17.127 462 H GLY 62 H GLY 62 -6.733 2.283 -14.119 463 HA2 GLY 62 HA2 GLY 62 -8.885 3.159 -13.843 464 HA3 GLY 62 HA3 GLY 62 -9.471 2.055 -15.080 465 H GLY 63 H GLY 63 -7.644 0.125 -13.214 466 HA2 GLY 63 HA2 GLY 63 -10.016 -0.726 -11.703 467 HA3 GLY 63 HA3 GLY 63 -8.715 -1.778 -12.251 468 H VAL 64 H VAL 64 -9.882 -1.173 -9.585 469 HA VAL 64 HA VAL 64 -7.498 -0.128 -8.318 470 HB VAL 64 HB VAL 64 -9.526 0.979 -7.564 471 HG11 VAL 64 HG11 VAL 64 -10.547 -1.742 -6.808 472 HG12 VAL 64 HG12 VAL 64 -11.206 -0.645 -8.032 473 HG13 VAL 64 HG13 VAL 64 -11.278 -0.217 -6.323 474 HG21 VAL 64 HG21 VAL 64 -7.795 0.678 -5.896 475 HG22 VAL 64 HG22 VAL 64 -8.488 -0.876 -5.434 476 HG23 VAL 64 HG23 VAL 64 -9.391 0.615 -5.143 477 H VAL 65 H VAL 65 -6.134 -1.353 -7.377 478 HA VAL 65 HA VAL 65 -6.843 -4.106 -6.799 479 HB VAL 65 HB VAL 65 -4.499 -4.728 -7.650 480 HG11 VAL 65 HG11 VAL 65 -5.265 -4.977 -9.968 481 HG12 VAL 65 HG12 VAL 65 -6.573 -3.835 -9.661 482 HG13 VAL 65 HG13 VAL 65 -6.541 -5.385 -8.820 483 HG21 VAL 65 HG21 VAL 65 -3.577 -3.287 -9.421 484 HG22 VAL 65 HG22 VAL 65 -3.620 -2.448 -7.864 485 HG23 VAL 65 HG23 VAL 65 -4.842 -2.105 -9.092 486 H ILE 66 H ILE 66 -5.584 -5.068 -5.305 487 HA ILE 66 HA ILE 66 -4.319 -3.240 -3.421 488 HB ILE 66 HB ILE 66 -5.540 -5.996 -2.991 489 HG12 ILE 66 HG12 ILE 66 -7.053 -4.752 -1.352 490 HG13 ILE 66 HG13 ILE 66 -6.452 -3.263 -2.053 491 HG21 ILE 66 HG21 ILE 66 -4.183 -4.226 -0.979 492 HG22 ILE 66 HG22 ILE 66 -3.610 -5.777 -1.587 493 HG23 ILE 66 HG23 ILE 66 -5.077 -5.698 -0.606 494 HD11 ILE 66 HD11 ILE 66 -8.633 -3.853 -2.949 495 HD12 ILE 66 HD12 ILE 66 -8.007 -5.413 -3.488 496 HD13 ILE 66 HD13 ILE 66 -7.408 -3.923 -4.217 497 HA PRO 67 HA PRO 67 -0.515 -5.323 -4.678 498 HB2 PRO 67 HB2 PRO 67 0.456 -4.172 -2.119 499 HB3 PRO 67 HB3 PRO 67 1.133 -3.997 -3.739 500 HG2 PRO 67 HG2 PRO 67 -0.139 -1.975 -2.580 501 HG3 PRO 67 HG3 PRO 67 -0.341 -2.296 -4.312 502 HD2 PRO 67 HD2 PRO 67 -2.183 -2.931 -2.041 503 HD3 PRO 67 HD3 PRO 67 -2.551 -2.322 -3.673 504 H GLN 68 H GLN 68 -0.422 -7.483 -4.320 505 HA GLN 68 HA GLN 68 -1.441 -8.800 -2.084 506 HB2 GLN 68 HB2 GLN 68 -1.312 -9.840 -4.207 507 HB3 GLN 68 HB3 GLN 68 0.425 -9.657 -4.268 508 HG2 GLN 68 HG2 GLN 68 0.743 -11.349 -2.627 509 HG3 GLN 68 HG3 GLN 68 -0.981 -11.401 -2.255 510 HE21 GLN 68 HE21 GLN 68 -1.822 -11.214 -5.037 511 HE22 GLN 68 HE22 GLN 68 -1.456 -12.704 -5.763 512 H VAL 69 H VAL 69 1.586 -7.407 -2.665 513 HA VAL 69 HA VAL 69 3.159 -8.844 -0.816 514 HB VAL 69 HB VAL 69 4.784 -7.037 -1.077 515 HG11 VAL 69 HG11 VAL 69 5.025 -7.171 -3.543 516 HG12 VAL 69 HG12 VAL 69 3.405 -7.860 -3.631 517 HG13 VAL 69 HG13 VAL 69 4.689 -8.732 -2.795 518 HG21 VAL 69 HG21 VAL 69 4.272 -5.097 -2.497 519 HG22 VAL 69 HG22 VAL 69 3.257 -5.134 -1.056 520 HG23 VAL 69 HG23 VAL 69 2.593 -5.631 -2.613 521 H PHE 70 H PHE 70 0.624 -6.714 -0.226 522 HA PHE 70 HA PHE 70 1.557 -5.690 2.302 523 HB2 PHE 70 HB2 PHE 70 -1.010 -5.605 0.769 524 HB3 PHE 70 HB3 PHE 70 -1.078 -5.322 2.501 525 HD1 PHE 70 HD1 PHE 70 1.563 -4.249 0.091 526 HD2 PHE 70 HD2 PHE 70 -1.640 -3.075 2.639 527 HE1 PHE 70 HE1 PHE 70 2.130 -1.876 -0.267 528 HE2 PHE 70 HE2 PHE 70 -1.073 -0.732 2.298 529 HZ PHE 70 HZ PHE 70 0.797 -0.112 0.853 530 H PHE 71 H PHE 71 0.415 -8.590 1.130 531 HA PHE 71 HA PHE 71 -0.449 -9.494 3.766 532 HB2 PHE 71 HB2 PHE 71 -0.932 -10.706 1.031 533 HB3 PHE 71 HB3 PHE 71 -1.482 -11.382 2.558 534 HD1 PHE 71 HD1 PHE 71 -3.320 -10.359 3.776 535 HD2 PHE 71 HD2 PHE 71 -2.015 -8.803 0.042 536 HE1 PHE 71 HE1 PHE 71 -5.401 -9.056 3.591 537 HE2 PHE 71 HE2 PHE 71 -4.085 -7.504 -0.147 538 HZ PHE 71 HZ PHE 71 -5.783 -7.628 1.628 539 H THR 72 H THR 72 0.476 -11.436 4.498 540 HA THR 72 HA THR 72 3.192 -11.823 3.717 541 HB THR 72 HB THR 72 3.100 -13.670 5.424 542 HG1 THR 72 HG1 THR 72 0.848 -13.001 6.643 543 HG21 THR 72 HG21 THR 72 2.859 -12.176 7.363 544 HG22 THR 72 HG22 THR 72 2.044 -10.989 6.347 545 HG23 THR 72 HG23 THR 72 3.740 -11.371 6.065 546 H ASN 73 H ASN 73 3.907 -14.204 3.417 547 HA ASN 73 HA ASN 73 2.744 -15.282 1.092 548 HB2 ASN 73 HB2 ASN 73 5.108 -15.653 1.867 549 HB3 ASN 73 HB3 ASN 73 4.489 -16.736 3.099 550 HD21 ASN 73 HD21 ASN 73 5.541 -18.508 2.310 551 HD22 ASN 73 HD22 ASN 73 5.130 -19.293 0.842 552 H SER 74 H SER 74 1.846 -15.555 4.381 553 HA SER 74 HA SER 74 0.374 -18.015 4.119 554 HB2 SER 74 HB2 SER 74 0.375 -15.954 6.326 555 HB3 SER 74 HB3 SER 74 -0.275 -17.592 6.428 556 HG SER 74 HG SER 74 2.265 -17.688 5.547 557 H GLY 75 H GLY 75 -0.158 -14.902 3.048 558 HA2 GLY 75 HA2 GLY 75 -2.010 -14.048 1.994 559 HA3 GLY 75 HA3 GLY 75 -2.902 -15.482 2.488 560 H GLN 76 H GLN 76 -1.239 -13.586 4.837 561 HA GLN 76 HA GLN 76 -3.808 -12.430 5.693 562 HB2 GLN 76 HB2 GLN 76 -3.187 -14.300 7.166 563 HB3 GLN 76 HB3 GLN 76 -1.607 -13.593 7.434 564 HG2 GLN 76 HG2 GLN 76 -3.043 -13.246 9.359 565 HG3 GLN 76 HG3 GLN 76 -2.660 -11.704 8.600 566 HE21 GLN 76 HE21 GLN 76 -5.090 -14.022 9.246 567 HE22 GLN 76 HE22 GLN 76 -6.460 -13.057 8.815 568 H VAL 77 H VAL 77 -3.600 -10.390 6.804 569 HA VAL 77 HA VAL 77 -1.743 -8.608 5.662 570 HB VAL 77 HB VAL 77 -3.677 -8.355 8.000 571 HG11 VAL 77 HG11 VAL 77 -2.005 -6.160 6.780 572 HG12 VAL 77 HG12 VAL 77 -1.828 -6.801 8.412 573 HG13 VAL 77 HG13 VAL 77 -3.295 -5.932 7.960 574 HG21 VAL 77 HG21 VAL 77 -4.904 -6.920 6.461 575 HG22 VAL 77 HG22 VAL 77 -4.657 -8.532 5.776 576 HG23 VAL 77 HG23 VAL 77 -3.655 -7.170 5.246 577 H VAL 78 H VAL 78 0.205 -7.904 6.344 578 HA VAL 78 HA VAL 78 1.673 -9.366 8.266 579 HB VAL 78 HB VAL 78 2.371 -6.546 7.344 580 HG11 VAL 78 HG11 VAL 78 4.674 -7.274 7.596 581 HG12 VAL 78 HG12 VAL 78 4.113 -8.869 8.100 582 HG13 VAL 78 HG13 VAL 78 3.759 -7.462 9.096 583 HG21 VAL 78 HG21 VAL 78 2.935 -9.109 5.852 584 HG22 VAL 78 HG22 VAL 78 3.542 -7.511 5.426 585 HG23 VAL 78 HG23 VAL 78 1.814 -7.848 5.343 586 H LYS 79 H LYS 79 2.245 -8.768 10.430 587 HA LYS 79 HA LYS 79 0.036 -7.976 11.887 588 HB2 LYS 79 HB2 LYS 79 1.696 -9.394 12.848 589 HB3 LYS 79 HB3 LYS 79 2.906 -8.117 12.776 590 HG2 LYS 79 HG2 LYS 79 1.655 -6.815 14.306 591 HG3 LYS 79 HG3 LYS 79 0.393 -8.058 14.433 592 HD2 LYS 79 HD2 LYS 79 2.309 -9.597 15.177 593 HD3 LYS 79 HD3 LYS 79 3.249 -8.114 15.361 594 HE2 LYS 79 HE2 LYS 79 0.667 -8.791 16.726 595 HE3 LYS 79 HE3 LYS 79 2.258 -8.728 17.474 596 HZ1 LYS 79 HZ1 LYS 79 0.725 -6.423 16.360 597 HZ2 LYS 79 HZ2 LYS 79 2.302 -6.320 16.959 598 HZ3 LYS 79 HZ3 LYS 79 1.028 -6.743 17.966 599 H SER 80 H SER 80 2.869 -5.995 11.155 600 HA SER 80 HA SER 80 1.397 -3.851 12.450 601 HB2 SER 80 HB2 SER 80 4.367 -4.239 12.159 602 HB3 SER 80 HB3 SER 80 3.616 -2.776 12.846 603 HG SER 80 HG SER 80 2.475 -4.695 14.071 604 H LEU 81 H LEU 81 1.258 -4.847 9.657 605 HA LEU 81 HA LEU 81 2.130 -2.911 7.828 606 HB2 LEU 81 HB2 LEU 81 1.117 -5.060 7.184 607 HB3 LEU 81 HB3 LEU 81 -0.438 -4.515 7.749 608 HG LEU 81 HG LEU 81 -0.144 -2.611 6.046 609 HD11 LEU 81 HD11 LEU 81 1.183 -3.189 4.110 610 HD12 LEU 81 HD12 LEU 81 1.757 -4.633 4.936 611 HD13 LEU 81 HD13 LEU 81 2.208 -3.034 5.548 612 HD21 LEU 81 HD21 LEU 81 -0.615 -5.453 5.243 613 HD22 LEU 81 HD22 LEU 81 -1.070 -4.034 4.290 614 HD23 LEU 81 HD23 LEU 81 -1.804 -4.298 5.873 615 HA PRO 82 HA PRO 82 -2.190 -0.620 8.702 616 HB2 PRO 82 HB2 PRO 82 -2.460 -1.271 11.590 617 HB3 PRO 82 HB3 PRO 82 -3.719 -1.088 10.366 618 HG2 PRO 82 HG2 PRO 82 -3.068 -3.496 11.255 619 HG3 PRO 82 HG3 PRO 82 -3.390 -3.239 9.531 620 HD2 PRO 82 HD2 PRO 82 -0.775 -3.492 10.950 621 HD3 PRO 82 HD3 PRO 82 -1.293 -4.199 9.404 622 H GLY 83 H GLY 83 0.364 -1.115 10.994 623 HA2 GLY 83 HA2 GLY 83 0.237 1.344 12.364 624 HA3 GLY 83 HA3 GLY 83 1.651 0.307 12.247 625 H LEU 84 H LEU 84 2.105 0.342 9.507 626 HA LEU 84 HA LEU 84 3.426 2.863 9.280 627 HB2 LEU 84 HB2 LEU 84 4.444 2.074 7.305 628 HB3 LEU 84 HB3 LEU 84 4.250 0.644 8.283 629 HG LEU 84 HG LEU 84 2.029 0.445 6.824 630 HD11 LEU 84 HD11 LEU 84 2.370 2.476 5.502 631 HD12 LEU 84 HD12 LEU 84 2.457 1.073 4.468 632 HD13 LEU 84 HD13 LEU 84 3.935 1.884 4.958 633 HD21 LEU 84 HD21 LEU 84 4.781 -0.428 5.918 634 HD22 LEU 84 HD22 LEU 84 3.257 -1.097 5.335 635 HD23 LEU 84 HD23 LEU 84 3.718 -1.296 7.026 636 H LEU 85 H LEU 85 0.580 1.449 7.920 637 HA LEU 85 HA LEU 85 0.006 3.404 5.994 638 HB2 LEU 85 HB2 LEU 85 -1.923 1.613 7.470 639 HB3 LEU 85 HB3 LEU 85 -2.228 2.420 5.949 640 HG LEU 85 HG LEU 85 -0.168 0.247 6.362 641 HD11 LEU 85 HD11 LEU 85 -2.391 -0.647 6.582 642 HD12 LEU 85 HD12 LEU 85 -1.688 -1.149 5.047 643 HD13 LEU 85 HD13 LEU 85 -2.889 0.141 5.090 644 HD21 LEU 85 HD21 LEU 85 -0.003 0.222 3.947 645 HD22 LEU 85 HD22 LEU 85 0.412 1.813 4.574 646 HD23 LEU 85 HD23 LEU 85 -1.165 1.541 3.830 647 H THR 86 H THR 86 -0.982 3.003 9.322 648 HA THR 86 HA THR 86 -2.802 5.166 9.339 649 HB THR 86 HB THR 86 -1.424 3.859 11.705 650 HG1 THR 86 HG1 THR 86 -2.653 2.437 10.346 651 HG21 THR 86 HG21 THR 86 -3.365 4.677 12.986 652 HG22 THR 86 HG22 THR 86 -3.977 5.482 11.537 653 HG23 THR 86 HG23 THR 86 -2.463 6.014 12.270 654 H ILE 87 H ILE 87 0.613 4.941 10.397 655 HA ILE 87 HA ILE 87 0.684 7.555 11.402 656 HB ILE 87 HB ILE 87 2.359 5.976 12.142 657 HG12 ILE 87 HG12 ILE 87 3.050 8.478 11.870 658 HG13 ILE 87 HG13 ILE 87 4.283 7.296 12.266 659 HG21 ILE 87 HG21 ILE 87 2.566 4.572 10.243 660 HG22 ILE 87 HG22 ILE 87 4.172 5.118 10.737 661 HG23 ILE 87 HG23 ILE 87 3.379 5.838 9.335 662 HD11 ILE 87 HD11 ILE 87 3.729 8.402 9.523 663 HD12 ILE 87 HD12 ILE 87 5.026 7.285 9.936 664 HD13 ILE 87 HD13 ILE 87 5.039 8.925 10.590 665 H LEU 88 H LEU 88 1.541 6.366 8.185 666 HA LEU 88 HA LEU 88 2.280 8.896 7.166 667 HB2 LEU 88 HB2 LEU 88 1.558 6.297 5.951 668 HB3 LEU 88 HB3 LEU 88 1.547 7.719 4.936 669 HG LEU 88 HG LEU 88 3.586 6.462 4.714 670 HD11 LEU 88 HD11 LEU 88 5.209 8.272 5.077 671 HD12 LEU 88 HD12 LEU 88 3.982 9.151 5.990 672 HD13 LEU 88 HD13 LEU 88 3.726 8.791 4.285 673 HD21 LEU 88 HD21 LEU 88 4.060 7.076 7.620 674 HD22 LEU 88 HD22 LEU 88 5.236 6.376 6.510 675 HD23 LEU 88 HD23 LEU 88 3.767 5.482 6.920 676 H HIS 89 H HIS 89 -0.793 7.184 7.191 677 HA HIS 89 HA HIS 89 -2.142 8.985 5.468 678 HB2 HIS 89 HB2 HIS 89 -3.003 6.696 6.010 679 HB3 HIS 89 HB3 HIS 89 -3.375 7.257 7.634 680 HD1 HIS 89 HD1 HIS 89 -5.596 8.621 7.931 681 HD2 HIS 89 HD2 HIS 89 -4.685 7.687 3.982 682 HE1 HIS 89 HE1 HIS 89 -7.613 9.224 6.591 683 H ASP 90 H ASP 90 -1.876 8.781 8.979 684 HA ASP 90 HA ASP 90 -3.514 11.033 9.536 685 HB2 ASP 90 HB2 ASP 90 -2.870 9.201 11.162 686 HB3 ASP 90 HB3 ASP 90 -1.269 9.914 11.234 687 H GLY 91 H GLY 91 -0.202 10.607 8.630 688 HA2 GLY 91 HA2 GLY 91 0.724 13.238 9.336 689 HA3 GLY 91 HA3 GLY 91 1.564 12.044 8.377 690 H GLY 92 H GLY 92 -1.165 12.077 6.773 691 HA2 GLY 92 HA2 GLY 92 -2.163 13.470 5.146 692 HA3 GLY 92 HA3 GLY 92 -0.875 14.640 5.394 693 H TYR 93 H TYR 93 -0.930 11.201 4.460 694 HA TYR 93 HA TYR 93 0.397 11.961 1.983 695 HB2 TYR 93 HB2 TYR 93 1.234 9.742 3.850 696 HB3 TYR 93 HB3 TYR 93 1.743 9.797 2.168 697 HD1 TYR 93 HD1 TYR 93 2.016 11.444 5.438 698 HD2 TYR 93 HD2 TYR 93 3.337 11.420 1.401 699 HE1 TYR 93 HE1 TYR 93 3.807 13.008 6.017 700 HE2 TYR 93 HE2 TYR 93 5.136 12.984 1.973 701 HH TYR 93 HH TYR 93 6.006 13.648 5.168 702 H ARG 94 H ARG 94 -0.213 11.007 0.228 703 HA ARG 94 HA ARG 94 -2.672 9.513 0.246 704 HB2 ARG 94 HB2 ARG 94 -2.571 9.725 -2.198 705 HB3 ARG 94 HB3 ARG 94 -2.302 11.279 -1.424 706 HG2 ARG 94 HG2 ARG 94 0.079 10.968 -1.682 707 HG3 ARG 94 HG3 ARG 94 -0.195 9.476 -2.594 708 HD2 ARG 94 HD2 ARG 94 -1.547 10.923 -4.206 709 HD3 ARG 94 HD3 ARG 94 -0.935 12.303 -3.309 710 HE ARG 94 HE ARG 94 1.365 11.141 -3.905 711 HH11 ARG 94 HH11 ARG 94 -1.415 11.725 -6.031 712 HH12 ARG 94 HH12 ARG 94 -0.462 11.777 -7.440 713 HH21 ARG 94 HH21 ARG 94 2.602 11.205 -5.799 714 HH22 ARG 94 HH22 ARG 94 1.888 11.459 -7.317 715 H ASP 95 H ASP 95 -2.846 7.660 -1.348 716 HA ASP 95 HA ASP 95 -1.567 5.392 -0.405 717 HB2 ASP 95 HB2 ASP 95 -2.627 4.240 -2.318 718 HB3 ASP 95 HB3 ASP 95 -3.743 5.348 -1.529 719 H THR 96 H THR 96 -0.979 7.220 -3.330 720 HA THR 96 HA THR 96 0.947 5.564 -4.421 721 HB THR 96 HB THR 96 0.617 8.544 -4.839 722 HG1 THR 96 HG1 THR 96 -0.811 6.261 -5.604 723 HG21 THR 96 HG21 THR 96 1.512 8.060 -7.075 724 HG22 THR 96 HG22 THR 96 1.676 6.355 -6.651 725 HG23 THR 96 HG23 THR 96 2.671 7.560 -5.838 726 H GLU 97 H GLU 97 1.254 8.253 -2.136 727 HA GLU 97 HA GLU 97 4.080 8.360 -2.271 728 HB2 GLU 97 HB2 GLU 97 2.275 9.265 -0.033 729 HB3 GLU 97 HB3 GLU 97 3.989 9.628 -0.158 730 HG2 GLU 97 HG2 GLU 97 1.819 10.493 -2.022 731 HG3 GLU 97 HG3 GLU 97 2.699 11.538 -0.891 732 H ILE 98 H ILE 98 1.825 6.461 -0.352 733 HA ILE 98 HA ILE 98 3.695 5.491 1.557 734 HB ILE 98 HB ILE 98 1.455 3.775 0.453 735 HG12 ILE 98 HG12 ILE 98 0.225 5.754 0.977 736 HG13 ILE 98 HG13 ILE 98 0.076 4.640 2.336 737 HG21 ILE 98 HG21 ILE 98 2.672 3.973 3.182 738 HG22 ILE 98 HG22 ILE 98 2.987 2.714 1.987 739 HG23 ILE 98 HG23 ILE 98 1.382 2.867 2.711 740 HD11 ILE 98 HD11 ILE 98 1.655 5.880 3.613 741 HD12 ILE 98 HD12 ILE 98 0.364 6.944 3.060 742 HD13 ILE 98 HD13 ILE 98 1.938 6.979 2.264 743 H MET 99 H MET 99 2.569 4.304 -1.527 744 HA MET 99 HA MET 99 4.151 1.946 -1.619 745 HB2 MET 99 HB2 MET 99 2.993 3.455 -3.964 746 HB3 MET 99 HB3 MET 99 3.470 1.766 -3.912 747 HG2 MET 99 HG2 MET 99 1.180 3.011 -2.427 748 HG3 MET 99 HG3 MET 99 1.070 2.045 -3.891 749 HE1 MET 99 HE1 MET 99 -0.633 1.551 -1.322 750 HE2 MET 99 HE2 MET 99 -0.543 -0.204 -1.155 751 HE3 MET 99 HE3 MET 99 -0.742 0.514 -2.747 752 H ARG 100 H ARG 100 4.779 5.250 -2.259 753 HA ARG 100 HA ARG 100 6.626 5.192 -4.354 754 HB2 ARG 100 HB2 ARG 100 5.485 7.164 -3.309 755 HB3 ARG 100 HB3 ARG 100 6.617 7.039 -1.980 756 HG2 ARG 100 HG2 ARG 100 8.429 7.316 -3.756 757 HG3 ARG 100 HG3 ARG 100 7.113 7.845 -4.815 758 HD2 ARG 100 HD2 ARG 100 7.850 9.864 -3.817 759 HD3 ARG 100 HD3 ARG 100 6.448 9.355 -2.855 760 HE ARG 100 HE ARG 100 8.992 8.443 -1.907 761 HH11 ARG 100 HH11 ARG 100 6.374 10.869 -1.555 762 HH12 ARG 100 HH12 ARG 100 6.966 11.432 -0.081 763 HH21 ARG 100 HH21 ARG 100 9.741 9.225 0.128 764 HH22 ARG 100 HH22 ARG 100 8.881 10.456 0.939 765 H TRP 101 H TRP 101 7.364 5.655 -0.916 766 HA TRP 101 HA TRP 101 10.063 4.913 -1.326 767 HB2 TRP 101 HB2 TRP 101 10.198 4.996 1.238 768 HB3 TRP 101 HB3 TRP 101 9.855 6.485 0.383 769 HD1 TRP 101 HD1 TRP 101 7.573 7.648 0.848 770 HE1 TRP 101 HE1 TRP 101 5.731 7.265 2.555 771 HE3 TRP 101 HE3 TRP 101 8.971 3.020 2.493 772 HZ2 TRP 101 HZ2 TRP 101 4.967 5.241 4.402 773 HZ3 TRP 101 HZ3 TRP 101 7.634 1.935 4.202 774 HH2 TRP 101 HH2 TRP 101 5.669 3.024 5.160 775 H LEU 102 H LEU 102 7.271 3.149 -0.309 776 HA LEU 102 HA LEU 102 8.552 0.921 0.792 777 HB2 LEU 102 HB2 LEU 102 5.912 1.497 -0.313 778 HB3 LEU 102 HB3 LEU 102 6.330 -0.215 -0.231 779 HG LEU 102 HG LEU 102 6.203 1.756 2.064 780 HD11 LEU 102 HD11 LEU 102 4.373 -0.517 1.297 781 HD12 LEU 102 HD12 LEU 102 4.032 1.196 1.051 782 HD13 LEU 102 HD13 LEU 102 4.198 0.557 2.691 783 HD21 LEU 102 HD21 LEU 102 6.690 -1.210 1.960 784 HD22 LEU 102 HD22 LEU 102 6.372 -0.294 3.443 785 HD23 LEU 102 HD23 LEU 102 7.820 0.036 2.495 786 H PHE 103 H PHE 103 7.761 1.647 -2.560 787 HA PHE 103 HA PHE 103 8.920 -0.918 -3.233 788 HB2 PHE 103 HB2 PHE 103 7.216 0.941 -4.853 789 HB3 PHE 103 HB3 PHE 103 8.003 -0.482 -5.534 790 HD1 PHE 103 HD1 PHE 103 5.398 0.703 -3.235 791 HD2 PHE 103 HD2 PHE 103 7.270 -2.691 -4.973 792 HE1 PHE 103 HE1 PHE 103 3.536 -0.696 -2.488 793 HE2 PHE 103 HE2 PHE 103 5.411 -4.100 -4.212 794 HZ PHE 103 HZ PHE 103 3.535 -3.094 -2.971 795 H THR 104 H THR 104 9.929 2.233 -3.045 796 HA THR 104 HA THR 104 11.822 1.921 -5.190 797 HB THR 104 HB THR 104 11.607 4.131 -3.108 798 HG1 THR 104 HG1 THR 104 9.862 4.178 -4.438 799 HG21 THR 104 HG21 THR 104 13.196 4.008 -5.687 800 HG22 THR 104 HG22 THR 104 13.878 3.948 -4.063 801 HG23 THR 104 HG23 THR 104 13.067 5.410 -4.631 802 HA PRO 105 HA PRO 105 14.387 -0.450 -2.383 803 HB2 PRO 105 HB2 PRO 105 16.399 -0.305 -4.503 804 HB3 PRO 105 HB3 PRO 105 15.588 -1.716 -3.825 805 HG2 PRO 105 HG2 PRO 105 15.063 -0.839 -6.305 806 HG3 PRO 105 HG3 PRO 105 13.817 -1.562 -5.273 807 HD2 PRO 105 HD2 PRO 105 14.326 1.320 -5.877 808 HD3 PRO 105 HD3 PRO 105 12.795 0.412 -5.756 809 H ASP 106 H ASP 106 16.232 -0.199 -1.192 810 HA ASP 106 HA ASP 106 17.383 2.492 -1.250 811 HB2 ASP 106 HB2 ASP 106 16.482 1.714 0.915 812 HB3 ASP 106 HB3 ASP 106 17.598 0.358 0.885 813 HA PRO 107 HA PRO 107 20.806 0.639 -3.450 814 HB2 PRO 107 HB2 PRO 107 22.236 3.064 -2.574 815 HB3 PRO 107 HB3 PRO 107 21.959 2.451 -4.204 816 HG2 PRO 107 HG2 PRO 107 20.654 4.580 -3.233 817 HG3 PRO 107 HG3 PRO 107 19.882 3.442 -4.366 818 HD2 PRO 107 HD2 PRO 107 19.541 3.789 -1.434 819 HD3 PRO 107 HD3 PRO 107 18.361 3.336 -2.688 820 H SER 108 H SER 108 21.023 1.844 -0.200 821 HA SER 108 HA SER 108 23.598 0.512 0.149 822 HB2 SER 108 HB2 SER 108 23.568 1.854 2.362 823 HB3 SER 108 HB3 SER 108 23.809 2.738 0.856 824 HG SER 108 HG SER 108 21.151 2.432 1.628 825 H LEU 109 H LEU 109 20.552 -0.401 0.372 826 HA LEU 109 HA LEU 109 20.778 -1.734 2.960 827 HB2 LEU 109 HB2 LEU 109 18.774 -0.395 2.402 828 HB3 LEU 109 HB3 LEU 109 18.475 -1.466 1.050 829 HG LEU 109 HG LEU 109 18.115 -3.312 2.649 830 HD11 LEU 109 HD11 LEU 109 19.473 -2.523 4.480 831 HD12 LEU 109 HD12 LEU 109 17.809 -2.762 5.025 832 HD13 LEU 109 HD13 LEU 109 18.410 -1.136 4.697 833 HD21 LEU 109 HD21 LEU 109 16.230 -2.023 1.786 834 HD22 LEU 109 HD22 LEU 109 16.414 -0.864 3.104 835 HD23 LEU 109 HD23 LEU 109 15.939 -2.530 3.450 836 H THR 110 H THR 110 20.926 -3.943 3.068 837 HA THR 110 HA THR 110 20.579 -5.442 0.597 838 HB THR 110 HB THR 110 22.780 -5.873 2.644 839 HG1 THR 110 HG1 THR 110 22.589 -4.147 0.797 840 HG21 THR 110 HG21 THR 110 23.622 -7.533 1.004 841 HG22 THR 110 HG22 THR 110 22.208 -7.241 -0.004 842 HG23 THR 110 HG23 THR 110 22.015 -7.976 1.586 843 H ILE 111 H ILE 111 19.087 -6.904 0.798 844 HA ILE 111 HA ILE 111 18.311 -7.919 3.462 845 HB ILE 111 HB ILE 111 16.550 -7.122 1.142 846 HG12 ILE 111 HG12 ILE 111 17.505 -5.178 2.247 847 HG13 ILE 111 HG13 ILE 111 15.759 -5.249 2.445 848 HG21 ILE 111 HG21 ILE 111 15.719 -8.031 3.877 849 HG22 ILE 111 HG22 ILE 111 15.540 -8.916 2.348 850 HG23 ILE 111 HG23 ILE 111 14.654 -7.405 2.608 851 HD11 ILE 111 HD11 ILE 111 17.845 -5.968 4.512 852 HD12 ILE 111 HD12 ILE 111 16.102 -6.130 4.732 853 HD13 ILE 111 HD13 ILE 111 16.811 -4.536 4.506 854 H THR 112 H THR 112 17.467 -10.074 3.321 855 HA THR 112 HA THR 112 18.188 -11.573 0.939 856 HB THR 112 HB THR 112 17.385 -13.507 2.394 857 HG1 THR 112 HG1 THR 112 16.058 -12.029 3.663 858 HG21 THR 112 HG21 THR 112 19.774 -12.908 2.312 859 HG22 THR 112 HG22 THR 112 19.320 -13.446 3.931 860 HG23 THR 112 HG23 THR 112 19.519 -11.724 3.595 861 H ARG 113 H ARG 113 16.604 -12.097 -0.538 862 HA ARG 113 HA ARG 113 13.982 -10.982 0.103 863 HB2 ARG 113 HB2 ARG 113 15.465 -10.311 -1.972 864 HB3 ARG 113 HB3 ARG 113 14.819 -11.783 -2.673 865 HG2 ARG 113 HG2 ARG 113 13.130 -9.505 -1.633 866 HG3 ARG 113 HG3 ARG 113 13.591 -9.717 -3.314 867 HD2 ARG 113 HD2 ARG 113 12.297 -11.689 -3.508 868 HD3 ARG 113 HD3 ARG 113 12.092 -11.811 -1.761 869 HE ARG 113 HE ARG 113 11.028 -9.413 -2.374 870 HH11 ARG 113 HH11 ARG 113 10.410 -12.698 -3.552 871 HH12 ARG 113 HH12 ARG 113 8.755 -12.432 -3.846 872 HH21 ARG 113 HH21 ARG 113 8.780 -9.081 -2.738 873 HH22 ARG 113 HH22 ARG 113 7.798 -10.321 -3.391 874 H ASP 114 H ASP 114 12.313 -12.235 0.410 875 HA ASP 114 HA ASP 114 12.347 -14.980 0.686 876 HB2 ASP 114 HB2 ASP 114 9.992 -13.185 0.098 877 HB3 ASP 114 HB3 ASP 114 9.824 -14.903 0.433 878 H GLY 115 H GLY 115 12.436 -16.580 -0.571 879 HA2 GLY 115 HA2 GLY 115 11.445 -17.556 -2.679 880 HA3 GLY 115 HA3 GLY 115 12.155 -16.131 -3.452 881 H SER 116 H SER 116 14.339 -16.028 -1.570 882 HA SER 116 HA SER 116 15.812 -18.444 -2.030 883 HB2 SER 116 HB2 SER 116 16.275 -16.985 -4.017 884 HB3 SER 116 HB3 SER 116 16.750 -15.683 -2.932 885 HG SER 116 HG SER 116 18.046 -18.143 -3.449 886 H ARG 117 H ARG 117 17.893 -18.138 -0.752 887 HA ARG 117 HA ARG 117 17.323 -16.529 1.637 888 HB2 ARG 117 HB2 ARG 117 18.875 -18.054 2.842 889 HB3 ARG 117 HB3 ARG 117 17.521 -18.910 2.116 890 HG2 ARG 117 HG2 ARG 117 19.281 -20.320 1.644 891 HG3 ARG 117 HG3 ARG 117 19.223 -19.339 0.181 892 HD2 ARG 117 HD2 ARG 117 21.501 -19.508 0.823 893 HD3 ARG 117 HD3 ARG 117 20.972 -17.873 1.221 894 HE ARG 117 HE ARG 117 21.171 -20.063 3.151 895 HH11 ARG 117 HH11 ARG 117 21.473 -16.568 2.469 896 HH12 ARG 117 HH12 ARG 117 22.332 -16.246 3.902 897 HH21 ARG 117 HH21 ARG 117 22.335 -19.537 5.124 898 HH22 ARG 117 HH22 ARG 117 22.799 -17.921 5.438 899 H ASP 118 H ASP 118 18.702 -16.176 -1.055 900 HA ASP 118 HA ASP 118 21.376 -15.333 -0.514 901 HB2 ASP 118 HB2 ASP 118 20.774 -16.143 -2.699 902 HB3 ASP 118 HB3 ASP 118 19.567 -14.876 -2.869 903 H ALA 119 H ALA 119 22.172 -13.339 -0.416 904 HA ALA 119 HA ALA 119 20.394 -11.289 0.611 905 HB1 ALA 119 HB1 ALA 119 22.446 -11.783 1.848 906 HB2 ALA 119 HB2 ALA 119 22.466 -10.125 1.244 907 HB3 ALA 119 HB3 ALA 119 23.408 -11.370 0.429 908 H VAL 120 H VAL 120 19.688 -9.696 -0.587 909 HA VAL 120 HA VAL 120 20.958 -9.152 -3.171 910 HB VAL 120 HB VAL 120 18.094 -8.653 -2.309 911 HG11 VAL 120 HG11 VAL 120 19.389 -8.401 -5.017 912 HG12 VAL 120 HG12 VAL 120 18.850 -7.075 -3.989 913 HG13 VAL 120 HG13 VAL 120 17.670 -8.189 -4.677 914 HG21 VAL 120 HG21 VAL 120 19.181 -10.814 -4.122 915 HG22 VAL 120 HG22 VAL 120 17.475 -10.480 -3.827 916 HG23 VAL 120 HG23 VAL 120 18.506 -11.052 -2.512 917 H SER 121 H SER 121 22.006 -7.266 -3.192 918 HA SER 121 HA SER 121 21.449 -5.257 -1.225 919 HB2 SER 121 HB2 SER 121 23.347 -5.295 -3.587 920 HB3 SER 121 HB3 SER 121 23.307 -4.069 -2.316 921 HG SER 121 HG SER 121 23.836 -5.657 -0.815 922 H ASN 122 H ASN 122 20.432 -3.402 -1.575 923 HA ASN 122 HA ASN 122 19.066 -1.925 -2.406 924 HB2 ASN 122 HB2 ASN 122 20.660 -1.543 -4.239 925 HB3 ASN 122 HB3 ASN 122 20.003 -2.903 -5.128 926 HD21 ASN 122 HD21 ASN 122 18.207 -2.610 -6.357 927 HD22 ASN 122 HD22 ASN 122 17.473 -1.077 -6.622 928 H ALA 123 H ALA 123 17.678 -3.428 -1.250 929 HA ALA 123 HA ALA 123 15.659 -4.568 -3.027 930 HB1 ALA 123 HB1 ALA 123 14.957 -5.880 -1.062 931 HB2 ALA 123 HB2 ALA 123 16.219 -5.111 -0.101 932 HB3 ALA 123 HB3 ALA 123 16.655 -6.168 -1.447 933 H ARG 124 H ARG 124 13.396 -4.349 -1.981 934 HA ARG 124 HA ARG 124 13.112 -1.503 -1.352 935 HB2 ARG 124 HB2 ARG 124 10.776 -1.743 -2.057 936 HB3 ARG 124 HB3 ARG 124 11.829 -2.392 -3.302 937 HG2 ARG 124 HG2 ARG 124 11.367 -4.663 -2.455 938 HG3 ARG 124 HG3 ARG 124 10.267 -3.967 -1.273 939 HD2 ARG 124 HD2 ARG 124 9.010 -4.831 -3.130 940 HD3 ARG 124 HD3 ARG 124 8.895 -3.077 -3.139 941 HE ARG 124 HE ARG 124 10.791 -3.283 -4.869 942 HH11 ARG 124 HH11 ARG 124 8.082 -5.582 -4.598 943 HH12 ARG 124 HH12 ARG 124 8.126 -6.070 -6.218 944 HH21 ARG 124 HH21 ARG 124 10.838 -3.918 -7.079 945 HH22 ARG 124 HH22 ARG 124 9.787 -5.097 -7.698 946 HA PRO 125 HA PRO 125 12.137 -2.088 2.955 947 HB2 PRO 125 HB2 PRO 125 9.737 -0.431 2.303 948 HB3 PRO 125 HB3 PRO 125 10.864 -0.269 3.660 949 HG2 PRO 125 HG2 PRO 125 11.084 1.371 1.620 950 HG3 PRO 125 HG3 PRO 125 12.544 0.639 2.308 951 HD2 PRO 125 HD2 PRO 125 11.099 -0.044 -0.220 952 HD3 PRO 125 HD3 PRO 125 12.847 -0.020 0.114 953 H VAL 126 H VAL 126 9.604 -2.593 0.574 954 HA VAL 126 HA VAL 126 7.774 -4.030 2.171 955 HB VAL 126 HB VAL 126 8.304 -4.519 -0.785 956 HG11 VAL 126 HG11 VAL 126 6.012 -5.338 -0.861 957 HG12 VAL 126 HG12 VAL 126 5.856 -5.089 0.874 958 HG13 VAL 126 HG13 VAL 126 6.985 -6.295 0.258 959 HG21 VAL 126 HG21 VAL 126 6.313 -2.671 0.510 960 HG22 VAL 126 HG22 VAL 126 6.490 -2.965 -1.220 961 HG23 VAL 126 HG23 VAL 126 7.789 -2.174 -0.325 962 H ASP 127 H ASP 127 10.707 -5.068 0.519 963 HA ASP 127 HA ASP 127 10.337 -7.864 0.975 964 HB2 ASP 127 HB2 ASP 127 12.918 -6.334 0.493 965 HB3 ASP 127 HB3 ASP 127 12.768 -8.082 0.465 966 H ALA 128 H ALA 128 11.790 -5.238 2.665 967 HA ALA 128 HA ALA 128 13.060 -6.764 4.678 968 HB1 ALA 128 HB1 ALA 128 13.751 -4.474 4.128 969 HB2 ALA 128 HB2 ALA 128 13.376 -4.647 5.844 970 HB3 ALA 128 HB3 ALA 128 12.222 -3.866 4.762 971 H LEU 129 H LEU 129 9.868 -5.215 4.491 972 HA LEU 129 HA LEU 129 9.255 -5.764 7.203 973 HB2 LEU 129 HB2 LEU 129 6.961 -5.138 6.727 974 HB3 LEU 129 HB3 LEU 129 8.058 -3.977 6.040 975 HG LEU 129 HG LEU 129 7.688 -5.397 3.873 976 HD11 LEU 129 HD11 LEU 129 5.146 -5.924 5.388 977 HD12 LEU 129 HD12 LEU 129 6.370 -7.106 4.944 978 HD13 LEU 129 HD13 LEU 129 5.433 -6.294 3.677 979 HD21 LEU 129 HD21 LEU 129 5.670 -3.429 4.957 980 HD22 LEU 129 HD22 LEU 129 5.840 -3.876 3.261 981 HD23 LEU 129 HD23 LEU 129 7.152 -3.036 4.086 982 H HIS 130 H HIS 130 8.682 -7.651 4.278 983 HA HIS 130 HA HIS 130 7.182 -9.623 5.728 984 HB2 HIS 130 HB2 HIS 130 6.951 -9.253 3.237 985 HB3 HIS 130 HB3 HIS 130 8.550 -9.955 3.035 986 HD1 HIS 130 HD1 HIS 130 8.656 -12.480 2.844 987 HD2 HIS 130 HD2 HIS 130 5.022 -11.130 4.320 988 HE1 HIS 130 HE1 HIS 130 7.140 -14.502 2.923 989 H ALA 131 H ALA 131 10.405 -8.869 5.319 990 HA ALA 131 HA ALA 131 11.429 -11.491 6.064 991 HB1 ALA 131 HB1 ALA 131 13.640 -10.442 6.032 992 HB2 ALA 131 HB2 ALA 131 12.890 -8.857 5.851 993 HB3 ALA 131 HB3 ALA 131 12.748 -10.048 4.561 994 H HIS 132 H HIS 132 9.768 -9.306 7.667 995 HA HIS 132 HA HIS 132 9.319 -8.822 9.782 996 HB2 HIS 132 HB2 HIS 132 11.145 -11.170 10.345 997 HB3 HIS 132 HB3 HIS 132 10.264 -10.321 11.615 998 HD1 HIS 132 HD1 HIS 132 9.746 -12.755 8.772 999 HD2 HIS 132 HD2 HIS 132 7.505 -10.738 11.643 1000 HE1 HIS 132 HE1 HIS 132 7.466 -13.768 8.702 1001 H GLN 133 H GLN 133 11.435 -7.550 8.377 1002 HA GLN 133 HA GLN 133 13.051 -6.445 10.559 1003 HB2 GLN 133 HB2 GLN 133 13.291 -6.222 7.557 1004 HB3 GLN 133 HB3 GLN 133 14.283 -5.303 8.679 1005 HG2 GLN 133 HG2 GLN 133 15.202 -7.373 9.568 1006 HG3 GLN 133 HG3 GLN 133 14.187 -8.301 8.465 1007 HE21 GLN 133 HE21 GLN 133 14.720 -8.388 6.325 1008 HE22 GLN 133 HE22 GLN 133 16.240 -7.835 5.719 1009 H ALA 134 H ALA 134 10.243 -6.089 10.065 1010 HA ALA 134 HA ALA 134 9.417 -3.774 8.824 1011 HB1 ALA 134 HB1 ALA 134 7.908 -5.506 9.665 1012 HB2 ALA 134 HB2 ALA 134 7.424 -3.895 10.206 1013 HB3 ALA 134 HB3 ALA 134 8.242 -4.990 11.317 1014 H ARG 135 H ARG 135 11.035 -4.082 11.907 1015 HA ARG 135 HA ARG 135 10.391 -1.753 13.218 1016 HB2 ARG 135 HB2 ARG 135 11.658 -3.606 14.144 1017 HB3 ARG 135 HB3 ARG 135 12.966 -3.309 13.020 1018 HG2 ARG 135 HG2 ARG 135 13.536 -2.585 15.195 1019 HG3 ARG 135 HG3 ARG 135 13.398 -1.175 14.136 1020 HD2 ARG 135 HD2 ARG 135 11.190 -0.701 15.048 1021 HD3 ARG 135 HD3 ARG 135 11.280 -2.141 16.068 1022 HE ARG 135 HE ARG 135 13.473 -0.735 16.757 1023 HH11 ARG 135 HH11 ARG 135 10.048 0.134 16.619 1024 HH12 ARG 135 HH12 ARG 135 10.134 1.293 17.856 1025 HH21 ARG 135 HH21 ARG 135 13.609 0.777 18.457 1026 HH22 ARG 135 HH22 ARG 135 12.246 1.682 18.960 1027 H GLU 136 H GLU 136 12.910 -2.319 10.699 1028 HA GLU 136 HA GLU 136 13.955 0.319 10.778 1029 HB2 GLU 136 HB2 GLU 136 14.911 -2.023 9.985 1030 HB3 GLU 136 HB3 GLU 136 14.206 -1.555 8.454 1031 HG2 GLU 136 HG2 GLU 136 16.308 -0.002 9.961 1032 HG3 GLU 136 HG3 GLU 136 16.580 -1.108 8.620 1033 H VAL 137 H VAL 137 11.470 -1.376 8.991 1034 HA VAL 137 HA VAL 137 11.043 0.556 6.954 1035 HB VAL 137 HB VAL 137 9.064 -1.471 8.066 1036 HG11 VAL 137 HG11 VAL 137 7.903 -1.257 5.912 1037 HG12 VAL 137 HG12 VAL 137 9.030 0.008 5.432 1038 HG13 VAL 137 HG13 VAL 137 7.933 0.274 6.787 1039 HG21 VAL 137 HG21 VAL 137 10.912 -1.677 5.689 1040 HG22 VAL 137 HG22 VAL 137 9.737 -2.885 6.179 1041 HG23 VAL 137 HG23 VAL 137 11.119 -2.522 7.219 1042 H VAL 138 H VAL 138 9.544 0.025 10.099 1043 HA VAL 138 HA VAL 138 7.700 2.144 10.081 1044 HB VAL 138 HB VAL 138 9.201 1.012 12.483 1045 HG11 VAL 138 HG11 VAL 138 8.220 3.190 13.006 1046 HG12 VAL 138 HG12 VAL 138 7.373 1.897 13.853 1047 HG13 VAL 138 HG13 VAL 138 6.654 2.631 12.417 1048 HG21 VAL 138 HG21 VAL 138 7.926 -0.692 11.295 1049 HG22 VAL 138 HG22 VAL 138 6.483 0.320 11.370 1050 HG23 VAL 138 HG23 VAL 138 7.181 -0.332 12.853 1051 H ARG 139 H ARG 139 11.067 2.015 10.964 1052 HA ARG 139 HA ARG 139 11.514 4.582 11.967 1053 HB2 ARG 139 HB2 ARG 139 13.141 2.758 12.065 1054 HB3 ARG 139 HB3 ARG 139 13.276 2.766 10.323 1055 HG2 ARG 139 HG2 ARG 139 14.241 5.053 10.468 1056 HG3 ARG 139 HG3 ARG 139 14.232 4.886 12.229 1057 HD2 ARG 139 HD2 ARG 139 15.636 2.900 12.059 1058 HD3 ARG 139 HD3 ARG 139 15.615 3.030 10.301 1059 HE ARG 139 HE ARG 139 16.695 5.205 11.924 1060 HH11 ARG 139 HH11 ARG 139 17.189 2.712 9.416 1061 HH12 ARG 139 HH12 ARG 139 18.779 3.193 9.078 1062 HH21 ARG 139 HH21 ARG 139 18.886 5.864 11.403 1063 HH22 ARG 139 HH22 ARG 139 19.752 5.015 10.210 1064 H ARG 140 H ARG 140 11.730 3.358 8.620 1065 HA ARG 140 HA ARG 140 12.357 5.873 7.482 1066 HB2 ARG 140 HB2 ARG 140 11.232 3.426 6.138 1067 HB3 ARG 140 HB3 ARG 140 11.864 4.840 5.303 1068 HG2 ARG 140 HG2 ARG 140 14.029 4.450 6.449 1069 HG3 ARG 140 HG3 ARG 140 13.375 2.926 7.048 1070 HD2 ARG 140 HD2 ARG 140 12.920 2.290 4.716 1071 HD3 ARG 140 HD3 ARG 140 13.763 3.742 4.182 1072 HE ARG 140 HE ARG 140 15.054 1.705 5.864 1073 HH11 ARG 140 HH11 ARG 140 15.164 3.745 2.954 1074 HH12 ARG 140 HH12 ARG 140 16.765 3.308 2.563 1075 HH21 ARG 140 HH21 ARG 140 17.170 1.145 5.351 1076 HH22 ARG 140 HH22 ARG 140 17.974 1.780 3.989 1077 H ALA 141 H ALA 141 9.311 4.217 8.061 1078 HA ALA 141 HA ALA 141 7.676 5.867 6.512 1079 HB1 ALA 141 HB1 ALA 141 6.960 3.710 7.419 1080 HB2 ALA 141 HB2 ALA 141 5.849 4.999 7.877 1081 HB3 ALA 141 HB3 ALA 141 7.007 4.374 9.054 1082 H GLN 142 H GLN 142 8.687 6.065 9.878 1083 HA GLN 142 HA GLN 142 7.324 8.398 10.635 1084 HB2 GLN 142 HB2 GLN 142 10.034 7.400 11.516 1085 HB3 GLN 142 HB3 GLN 142 9.136 8.681 12.307 1086 HG2 GLN 142 HG2 GLN 142 8.247 5.825 12.052 1087 HG3 GLN 142 HG3 GLN 142 8.973 6.548 13.481 1088 HE21 GLN 142 HE21 GLN 142 6.433 5.297 13.307 1089 HE22 GLN 142 HE22 GLN 142 5.248 6.490 13.704 1090 H ALA 143 H ALA 143 10.501 7.928 9.195 1091 HA ALA 143 HA ALA 143 11.350 10.609 9.203 1092 HB1 ALA 143 HB1 ALA 143 13.103 9.876 7.700 1093 HB2 ALA 143 HB2 ALA 143 12.223 8.384 7.373 1094 HB3 ALA 143 HB3 ALA 143 12.861 8.692 8.987 1095 H MET 144 H MET 144 9.575 8.727 6.863 1096 HA MET 144 HA MET 144 9.723 10.711 4.798 1097 HB2 MET 144 HB2 MET 144 7.988 8.260 5.058 1098 HB3 MET 144 HB3 MET 144 8.005 9.307 3.649 1099 HG2 MET 144 HG2 MET 144 10.330 7.721 4.715 1100 HG3 MET 144 HG3 MET 144 9.343 7.323 3.310 1101 HE1 MET 144 HE1 MET 144 12.496 7.471 3.286 1102 HE2 MET 144 HE2 MET 144 12.827 8.353 1.792 1103 HE3 MET 144 HE3 MET 144 11.576 7.114 1.825 1104 H ALA 145 H ALA 145 7.565 10.062 7.422 1105 HA ALA 145 HA ALA 145 5.426 11.544 6.217 1106 HB1 ALA 145 HB1 ALA 145 5.608 10.547 9.036 1107 HB2 ALA 145 HB2 ALA 145 4.991 9.613 7.681 1108 HB3 ALA 145 HB3 ALA 145 4.154 11.083 8.193 1109 H TYR 146 H TYR 146 7.297 12.022 9.196 1110 HA TYR 146 HA TYR 146 6.126 14.653 9.328 1111 HB2 TYR 146 HB2 TYR 146 7.752 13.186 11.406 1112 HB3 TYR 146 HB3 TYR 146 6.915 14.722 11.640 1113 HD1 TYR 146 HD1 TYR 146 4.323 14.537 10.719 1114 HD2 TYR 146 HD2 TYR 146 6.650 11.371 12.351 1115 HE1 TYR 146 HE1 TYR 146 2.265 13.335 11.293 1116 HE2 TYR 146 HE2 TYR 146 4.588 10.157 12.930 1117 HH TYR 146 HH TYR 146 1.594 10.949 11.663 Start of MODEL 8 1 H MET 1 H MET 1 7.816 8.547 -11.153 2 HA MET 1 HA MET 1 5.909 10.030 -11.113 3 HB2 MET 1 HB2 MET 1 4.269 8.462 -10.227 4 HB3 MET 1 HB3 MET 1 5.528 7.579 -11.073 5 HG2 MET 1 HG2 MET 1 6.478 6.811 -9.036 6 HG3 MET 1 HG3 MET 1 5.510 7.935 -8.088 7 HE1 MET 1 HE1 MET 1 3.667 4.347 -10.336 8 HE2 MET 1 HE2 MET 1 5.396 4.693 -10.357 9 HE3 MET 1 HE3 MET 1 4.259 5.797 -11.132 10 HA PRO 2 HA PRO 2 5.234 12.034 -7.144 11 HB2 PRO 2 HB2 PRO 2 2.671 13.030 -7.882 12 HB3 PRO 2 HB3 PRO 2 4.204 13.898 -7.960 13 HG2 PRO 2 HG2 PRO 2 2.659 13.112 -10.150 14 HG3 PRO 2 HG3 PRO 2 4.354 13.622 -10.207 15 HD2 PRO 2 HD2 PRO 2 3.186 10.887 -10.251 16 HD3 PRO 2 HD3 PRO 2 4.650 11.519 -11.043 17 H GLY 3 H GLY 3 4.316 11.294 -5.285 18 HA2 GLY 3 HA2 GLY 3 2.426 9.100 -5.493 19 HA3 GLY 3 HA3 GLY 3 3.205 9.673 -4.019 20 H ARG 4 H ARG 4 2.648 12.243 -3.994 21 HA ARG 4 HA ARG 4 -0.137 12.374 -3.352 22 HB2 ARG 4 HB2 ARG 4 0.351 14.785 -2.875 23 HB3 ARG 4 HB3 ARG 4 1.430 13.683 -2.037 24 HG2 ARG 4 HG2 ARG 4 3.185 14.125 -3.659 25 HG3 ARG 4 HG3 ARG 4 2.105 15.181 -4.565 26 HD2 ARG 4 HD2 ARG 4 3.073 15.616 -1.734 27 HD3 ARG 4 HD3 ARG 4 3.665 16.446 -3.163 28 HE ARG 4 HE ARG 4 0.828 16.660 -2.644 29 HH11 ARG 4 HH11 ARG 4 4.010 18.176 -2.287 30 HH12 ARG 4 HH12 ARG 4 3.409 19.737 -2.049 31 HH21 ARG 4 HH21 ARG 4 -0.023 18.816 -2.283 32 HH22 ARG 4 HH22 ARG 4 1.039 20.117 -2.060 33 H ALA 5 H ALA 5 -1.791 13.088 -4.654 34 HA ALA 5 HA ALA 5 -1.442 14.795 -6.884 35 HB1 ALA 5 HB1 ALA 5 -1.876 11.877 -7.562 36 HB2 ALA 5 HB2 ALA 5 -0.401 12.787 -7.869 37 HB3 ALA 5 HB3 ALA 5 -1.892 13.221 -8.706 38 HA PRO 6 HA PRO 6 -5.844 14.545 -5.782 39 HB2 PRO 6 HB2 PRO 6 -5.975 17.356 -6.444 40 HB3 PRO 6 HB3 PRO 6 -6.151 16.620 -4.850 41 HG2 PRO 6 HG2 PRO 6 -4.039 18.220 -5.584 42 HG3 PRO 6 HG3 PRO 6 -3.955 16.987 -4.315 43 HD2 PRO 6 HD2 PRO 6 -3.007 16.856 -7.148 44 HD3 PRO 6 HD3 PRO 6 -2.264 16.222 -5.658 45 H GLY 7 H GLY 7 -6.983 13.708 -7.451 46 HA2 GLY 7 HA2 GLY 7 -7.033 15.193 -9.967 47 HA3 GLY 7 HA3 GLY 7 -6.571 13.497 -9.995 48 H SER 8 H SER 8 -8.147 12.337 -10.759 49 HA SER 8 HA SER 8 -10.810 13.179 -10.885 50 HB2 SER 8 HB2 SER 8 -9.648 10.444 -11.384 51 HB3 SER 8 HB3 SER 8 -11.141 11.115 -12.055 52 HG SER 8 HG SER 8 -8.946 11.186 -13.262 53 H THR 9 H THR 9 -11.999 13.286 -9.042 54 HA THR 9 HA THR 9 -11.894 11.082 -7.143 55 HB THR 9 HB THR 9 -13.261 13.790 -6.955 56 HG1 THR 9 HG1 THR 9 -11.109 12.919 -5.380 57 HG21 THR 9 HG21 THR 9 -12.850 11.673 -4.820 58 HG22 THR 9 HG22 THR 9 -14.387 12.053 -5.594 59 HG23 THR 9 HG23 THR 9 -13.592 13.258 -4.582 60 H LEU 10 H LEU 10 -13.581 9.693 -6.932 61 HA LEU 10 HA LEU 10 -15.661 9.760 -8.963 62 HB2 LEU 10 HB2 LEU 10 -15.126 7.795 -6.754 63 HB3 LEU 10 HB3 LEU 10 -16.249 7.547 -8.077 64 HG LEU 10 HG LEU 10 -13.234 7.662 -8.249 65 HD11 LEU 10 HD11 LEU 10 -14.102 5.603 -7.305 66 HD12 LEU 10 HD12 LEU 10 -13.433 5.329 -8.914 67 HD13 LEU 10 HD13 LEU 10 -15.181 5.407 -8.688 68 HD21 LEU 10 HD21 LEU 10 -13.516 7.091 -10.615 69 HD22 LEU 10 HD22 LEU 10 -14.229 8.662 -10.249 70 HD23 LEU 10 HD23 LEU 10 -15.263 7.244 -10.446 71 H ALA 11 H ALA 11 -17.937 9.217 -8.195 72 HA ALA 11 HA ALA 11 -18.762 10.934 -6.052 73 HB1 ALA 11 HB1 ALA 11 -21.014 9.986 -6.498 74 HB2 ALA 11 HB2 ALA 11 -20.286 8.818 -7.606 75 HB3 ALA 11 HB3 ALA 11 -20.240 10.541 -7.985 76 H ARG 12 H ARG 12 -18.377 10.373 -4.032 77 HA ARG 12 HA ARG 12 -17.690 7.645 -3.524 78 HB2 ARG 12 HB2 ARG 12 -17.453 10.045 -1.751 79 HB3 ARG 12 HB3 ARG 12 -17.068 8.416 -1.223 80 HG2 ARG 12 HG2 ARG 12 -15.412 8.283 -3.092 81 HG3 ARG 12 HG3 ARG 12 -15.712 9.997 -3.395 82 HD2 ARG 12 HD2 ARG 12 -13.744 9.645 -1.969 83 HD3 ARG 12 HD3 ARG 12 -15.015 10.541 -1.133 84 HE ARG 12 HE ARG 12 -15.161 7.715 -0.719 85 HH11 ARG 12 HH11 ARG 12 -13.406 10.581 0.410 86 HH12 ARG 12 HH12 ARG 12 -13.307 10.088 2.029 87 HH21 ARG 12 HH21 ARG 12 -15.069 7.008 1.558 88 HH22 ARG 12 HH22 ARG 12 -14.331 8.040 2.695 89 H VAL 13 H VAL 13 -19.525 6.610 -3.721 90 HA VAL 13 HA VAL 13 -21.212 6.702 -1.319 91 HB VAL 13 HB VAL 13 -21.979 5.601 -4.041 92 HG11 VAL 13 HG11 VAL 13 -23.644 5.992 -1.551 93 HG12 VAL 13 HG12 VAL 13 -23.113 4.453 -2.223 94 HG13 VAL 13 HG13 VAL 13 -24.262 5.452 -3.114 95 HG21 VAL 13 HG21 VAL 13 -23.539 7.498 -4.222 96 HG22 VAL 13 HG22 VAL 13 -21.855 8.021 -4.166 97 HG23 VAL 13 HG23 VAL 13 -22.871 8.171 -2.734 98 H GLY 14 H GLY 14 -19.600 5.489 -0.354 99 HA2 GLY 14 HA2 GLY 14 -18.800 3.464 0.440 100 HA3 GLY 14 HA3 GLY 14 -19.770 2.641 -0.781 101 H SER 15 H SER 15 -17.820 5.183 -1.843 102 HA SER 15 HA SER 15 -16.132 3.320 -3.303 103 HB2 SER 15 HB2 SER 15 -16.226 6.307 -3.617 104 HB3 SER 15 HB3 SER 15 -15.813 5.085 -4.817 105 HG SER 15 HG SER 15 -17.841 5.189 -5.390 106 H ILE 16 H ILE 16 -14.022 3.097 -2.777 107 HA ILE 16 HA ILE 16 -12.937 4.742 -0.629 108 HB ILE 16 HB ILE 16 -11.831 2.177 -1.864 109 HG12 ILE 16 HG12 ILE 16 -12.328 1.207 0.476 110 HG13 ILE 16 HG13 ILE 16 -13.350 2.616 0.712 111 HG21 ILE 16 HG21 ILE 16 -10.049 3.567 -1.004 112 HG22 ILE 16 HG22 ILE 16 -10.245 2.125 -0.008 113 HG23 ILE 16 HG23 ILE 16 -10.860 3.677 0.560 114 HD11 ILE 16 HD11 ILE 16 -14.734 1.920 -1.182 115 HD12 ILE 16 HD12 ILE 16 -14.652 0.678 0.064 116 HD13 ILE 16 HD13 ILE 16 -13.701 0.505 -1.408 117 HA PRO 17 HA PRO 17 -10.710 6.821 -3.934 118 HB2 PRO 17 HB2 PRO 17 -9.010 7.997 -1.862 119 HB3 PRO 17 HB3 PRO 17 -10.133 8.796 -2.963 120 HG2 PRO 17 HG2 PRO 17 -10.591 8.566 -0.298 121 HG3 PRO 17 HG3 PRO 17 -11.885 8.636 -1.507 122 HD2 PRO 17 HD2 PRO 17 -10.780 6.269 -0.055 123 HD3 PRO 17 HD3 PRO 17 -12.455 6.649 -0.524 124 H ALA 18 H ALA 18 -9.032 6.176 -5.040 125 HA ALA 18 HA ALA 18 -6.754 4.848 -3.764 126 HB1 ALA 18 HB1 ALA 18 -8.247 4.013 -6.258 127 HB2 ALA 18 HB2 ALA 18 -8.208 3.128 -4.732 128 HB3 ALA 18 HB3 ALA 18 -6.738 3.297 -5.693 129 H GLY 19 H GLY 19 -4.813 5.562 -4.641 130 HA2 GLY 19 HA2 GLY 19 -5.039 7.762 -6.487 131 HA3 GLY 19 HA3 GLY 19 -3.603 7.237 -5.617 132 H ASP 20 H ASP 20 -2.108 6.652 -6.973 133 HA ASP 20 HA ASP 20 -2.946 5.336 -9.457 134 HB2 ASP 20 HB2 ASP 20 -1.897 7.569 -9.789 135 HB3 ASP 20 HB3 ASP 20 -0.443 6.975 -8.994 136 H ASP 21 H ASP 21 -1.723 3.611 -10.188 137 HA ASP 21 HA ASP 21 -0.749 2.018 -7.998 138 HB2 ASP 21 HB2 ASP 21 -2.166 0.922 -9.636 139 HB3 ASP 21 HB3 ASP 21 -1.026 1.326 -10.919 140 H VAL 22 H VAL 22 1.167 1.715 -7.429 141 HA VAL 22 HA VAL 22 3.371 2.948 -8.886 142 HB VAL 22 HB VAL 22 3.377 1.616 -6.153 143 HG11 VAL 22 HG11 VAL 22 5.604 1.794 -7.110 144 HG12 VAL 22 HG12 VAL 22 5.428 2.881 -5.734 145 HG13 VAL 22 HG13 VAL 22 5.372 3.523 -7.379 146 HG21 VAL 22 HG21 VAL 22 3.050 4.539 -6.830 147 HG22 VAL 22 HG22 VAL 22 3.258 3.889 -5.204 148 HG23 VAL 22 HG23 VAL 22 1.821 3.481 -6.140 149 H LEU 23 H LEU 23 1.877 -0.063 -8.539 150 HA LEU 23 HA LEU 23 4.270 -1.625 -8.695 151 HB2 LEU 23 HB2 LEU 23 1.387 -2.261 -8.383 152 HB3 LEU 23 HB3 LEU 23 2.526 -3.501 -8.860 153 HG LEU 23 HG LEU 23 2.614 -1.930 -6.266 154 HD11 LEU 23 HD11 LEU 23 2.033 -4.802 -6.900 155 HD12 LEU 23 HD12 LEU 23 0.835 -3.602 -6.406 156 HD13 LEU 23 HD13 LEU 23 2.129 -4.077 -5.297 157 HD21 LEU 23 HD21 LEU 23 4.379 -3.608 -5.787 158 HD22 LEU 23 HD22 LEU 23 4.836 -2.400 -7.006 159 HD23 LEU 23 HD23 LEU 23 4.323 -4.005 -7.510 160 H ASP 24 H ASP 24 4.145 -3.513 -10.028 161 HA ASP 24 HA ASP 24 3.589 -2.883 -12.816 162 HB2 ASP 24 HB2 ASP 24 5.917 -3.466 -12.287 163 HB3 ASP 24 HB3 ASP 24 5.385 -4.944 -11.495 164 HA PRO 25 HA PRO 25 0.106 -5.703 -12.585 165 HB2 PRO 25 HB2 PRO 25 1.055 -6.616 -15.255 166 HB3 PRO 25 HB3 PRO 25 -0.558 -6.096 -14.751 167 HG2 PRO 25 HG2 PRO 25 0.958 -4.459 -16.176 168 HG3 PRO 25 HG3 PRO 25 0.008 -3.838 -14.814 169 HD2 PRO 25 HD2 PRO 25 2.933 -4.402 -14.977 170 HD3 PRO 25 HD3 PRO 25 2.071 -3.068 -14.178 171 H ASP 26 H ASP 26 3.314 -6.940 -13.402 172 HA ASP 26 HA ASP 26 2.453 -9.698 -12.988 173 HB2 ASP 26 HB2 ASP 26 3.955 -9.105 -14.886 174 HB3 ASP 26 HB3 ASP 26 5.174 -8.617 -13.721 175 H GLU 27 H GLU 27 3.714 -7.134 -11.178 176 HA GLU 27 HA GLU 27 5.144 -8.733 -9.248 177 HB2 GLU 27 HB2 GLU 27 5.665 -6.294 -9.662 178 HB3 GLU 27 HB3 GLU 27 4.066 -5.885 -9.085 179 HG2 GLU 27 HG2 GLU 27 5.578 -5.398 -7.320 180 HG3 GLU 27 HG3 GLU 27 4.735 -6.874 -6.855 181 HA PRO 28 HA PRO 28 1.713 -10.766 -7.316 182 HB2 PRO 28 HB2 PRO 28 3.060 -9.553 -4.931 183 HB3 PRO 28 HB3 PRO 28 2.352 -11.165 -5.109 184 HG2 PRO 28 HG2 PRO 28 4.979 -10.777 -5.396 185 HG3 PRO 28 HG3 PRO 28 4.096 -11.938 -6.398 186 HD2 PRO 28 HD2 PRO 28 5.315 -9.381 -7.155 187 HD3 PRO 28 HD3 PRO 28 4.796 -10.726 -8.187 188 H THR 29 H THR 29 -0.195 -9.770 -7.755 189 HA THR 29 HA THR 29 -0.998 -7.676 -5.925 190 HB THR 29 HB THR 29 -2.416 -7.053 -8.196 191 HG1 THR 29 HG1 THR 29 0.266 -7.670 -8.962 192 HG21 THR 29 HG21 THR 29 0.203 -5.874 -7.258 193 HG22 THR 29 HG22 THR 29 -1.399 -5.453 -6.656 194 HG23 THR 29 HG23 THR 29 -0.952 -5.072 -8.319 195 H TYR 30 H TYR 30 -3.238 -7.457 -5.604 196 HA TYR 30 HA TYR 30 -4.905 -9.750 -6.262 197 HB2 TYR 30 HB2 TYR 30 -4.578 -8.363 -3.604 198 HB3 TYR 30 HB3 TYR 30 -6.010 -9.290 -4.017 199 HD1 TYR 30 HD1 TYR 30 -5.039 -11.647 -5.287 200 HD2 TYR 30 HD2 TYR 30 -3.373 -9.491 -2.041 201 HE1 TYR 30 HE1 TYR 30 -3.990 -13.693 -4.489 202 HE2 TYR 30 HE2 TYR 30 -2.304 -11.536 -1.223 203 HH TYR 30 HH TYR 30 -2.642 -14.013 -1.430 204 H ASP 31 H ASP 31 -7.191 -9.115 -6.158 205 HA ASP 31 HA ASP 31 -7.640 -6.247 -6.199 206 HB2 ASP 31 HB2 ASP 31 -8.977 -6.333 -8.197 207 HB3 ASP 31 HB3 ASP 31 -7.484 -7.178 -8.577 208 H LEU 32 H LEU 32 -10.224 -6.048 -6.239 209 HA LEU 32 HA LEU 32 -10.853 -6.631 -3.663 210 HB2 LEU 32 HB2 LEU 32 -12.816 -6.075 -5.875 211 HB3 LEU 32 HB3 LEU 32 -13.236 -6.077 -4.176 212 HG LEU 32 HG LEU 32 -11.296 -4.191 -5.526 213 HD11 LEU 32 HD11 LEU 32 -14.034 -3.725 -4.364 214 HD12 LEU 32 HD12 LEU 32 -13.609 -3.717 -6.076 215 HD13 LEU 32 HD13 LEU 32 -12.959 -2.481 -5.000 216 HD21 LEU 32 HD21 LEU 32 -11.268 -3.018 -3.343 217 HD22 LEU 32 HD22 LEU 32 -10.568 -4.636 -3.246 218 HD23 LEU 32 HD23 LEU 32 -12.199 -4.340 -2.646 219 HA PRO 33 HA PRO 33 -13.655 -10.495 -4.530 220 HB2 PRO 33 HB2 PRO 33 -12.873 -11.861 -6.833 221 HB3 PRO 33 HB3 PRO 33 -14.368 -10.941 -6.648 222 HG2 PRO 33 HG2 PRO 33 -11.803 -10.175 -7.933 223 HG3 PRO 33 HG3 PRO 33 -13.461 -9.729 -8.366 224 HD2 PRO 33 HD2 PRO 33 -11.803 -8.010 -7.129 225 HD3 PRO 33 HD3 PRO 33 -13.550 -8.030 -6.805 226 H ARG 34 H ARG 34 -10.326 -10.378 -5.740 227 HA ARG 34 HA ARG 34 -9.678 -13.015 -4.835 228 HB2 ARG 34 HB2 ARG 34 -8.054 -10.768 -5.930 229 HB3 ARG 34 HB3 ARG 34 -7.222 -12.021 -5.022 230 HG2 ARG 34 HG2 ARG 34 -7.146 -12.449 -7.414 231 HG3 ARG 34 HG3 ARG 34 -8.050 -13.704 -6.574 232 HD2 ARG 34 HD2 ARG 34 -10.123 -12.717 -7.255 233 HD3 ARG 34 HD3 ARG 34 -9.276 -11.357 -7.991 234 HE ARG 34 HE ARG 34 -8.881 -14.109 -8.921 235 HH11 ARG 34 HH11 ARG 34 -9.373 -10.666 -9.637 236 HH12 ARG 34 HH12 ARG 34 -9.654 -10.906 -11.301 237 HH21 ARG 34 HH21 ARG 34 -9.209 -14.440 -11.202 238 HH22 ARG 34 HH22 ARG 34 -9.524 -13.112 -12.222 239 H VAL 35 H VAL 35 -9.380 -9.838 -3.433 240 HA VAL 35 HA VAL 35 -7.936 -10.790 -1.183 241 HB VAL 35 HB VAL 35 -9.617 -8.264 -1.408 242 HG11 VAL 35 HG11 VAL 35 -8.335 -7.452 0.533 243 HG12 VAL 35 HG12 VAL 35 -7.558 -9.034 0.662 244 HG13 VAL 35 HG13 VAL 35 -9.292 -8.880 0.925 245 HG21 VAL 35 HG21 VAL 35 -7.813 -8.243 -3.000 246 HG22 VAL 35 HG22 VAL 35 -6.663 -8.730 -1.752 247 HG23 VAL 35 HG23 VAL 35 -7.420 -7.149 -1.671 248 H ALA 36 H ALA 36 -11.309 -10.246 -1.852 249 HA ALA 36 HA ALA 36 -12.369 -10.972 0.638 250 HB1 ALA 36 HB1 ALA 36 -13.680 -9.886 -1.144 251 HB2 ALA 36 HB2 ALA 36 -14.449 -11.364 -0.577 252 HB3 ALA 36 HB3 ALA 36 -13.576 -11.361 -2.111 253 H GLU 37 H GLU 37 -11.482 -12.837 -2.188 254 HA GLU 37 HA GLU 37 -12.289 -15.435 -1.542 255 HB2 GLU 37 HB2 GLU 37 -11.342 -14.414 -3.691 256 HB3 GLU 37 HB3 GLU 37 -9.795 -14.550 -2.932 257 HG2 GLU 37 HG2 GLU 37 -10.000 -16.386 -4.402 258 HG3 GLU 37 HG3 GLU 37 -10.081 -16.988 -2.750 259 H LEU 38 H LEU 38 -9.296 -13.665 -0.994 260 HA LEU 38 HA LEU 38 -7.781 -15.797 0.062 261 HB2 LEU 38 HB2 LEU 38 -6.921 -13.789 -1.113 262 HB3 LEU 38 HB3 LEU 38 -7.341 -12.833 0.287 263 HG LEU 38 HG LEU 38 -5.750 -14.253 1.608 264 HD11 LEU 38 HD11 LEU 38 -4.031 -15.474 0.361 265 HD12 LEU 38 HD12 LEU 38 -4.895 -15.156 -1.140 266 HD13 LEU 38 HD13 LEU 38 -5.632 -16.173 0.102 267 HD21 LEU 38 HD21 LEU 38 -4.650 -12.654 -0.694 268 HD22 LEU 38 HD22 LEU 38 -3.783 -13.054 0.785 269 HD23 LEU 38 HD23 LEU 38 -5.202 -12.006 0.848 270 H LEU 39 H LEU 39 -9.418 -13.022 1.553 271 HA LEU 39 HA LEU 39 -8.560 -13.862 4.188 272 HB2 LEU 39 HB2 LEU 39 -10.320 -11.609 3.302 273 HB3 LEU 39 HB3 LEU 39 -9.842 -11.885 4.965 274 HG LEU 39 HG LEU 39 -7.992 -11.202 2.671 275 HD11 LEU 39 HD11 LEU 39 -8.968 -9.555 4.995 276 HD12 LEU 39 HD12 LEU 39 -9.407 -9.337 3.304 277 HD13 LEU 39 HD13 LEU 39 -7.747 -9.055 3.828 278 HD21 LEU 39 HD21 LEU 39 -6.862 -12.586 4.340 279 HD22 LEU 39 HD22 LEU 39 -7.438 -11.523 5.626 280 HD23 LEU 39 HD23 LEU 39 -6.293 -10.921 4.431 281 H GLY 40 H GLY 40 -11.262 -14.444 2.203 282 HA2 GLY 40 HA2 GLY 40 -13.092 -15.791 2.592 283 HA3 GLY 40 HA3 GLY 40 -12.495 -16.064 4.228 284 H VAL 41 H VAL 41 -12.968 -12.930 2.881 285 HA VAL 41 HA VAL 41 -15.288 -12.499 4.640 286 HB VAL 41 HB VAL 41 -14.507 -10.314 5.266 287 HG11 VAL 41 HG11 VAL 41 -12.502 -10.849 6.604 288 HG12 VAL 41 HG12 VAL 41 -12.339 -12.351 5.697 289 HG13 VAL 41 HG13 VAL 41 -13.761 -12.079 6.703 290 HG21 VAL 41 HG21 VAL 41 -12.102 -10.816 3.506 291 HG22 VAL 41 HG22 VAL 41 -12.245 -9.465 4.641 292 HG23 VAL 41 HG23 VAL 41 -13.358 -9.600 3.288 293 HA PRO 42 HA PRO 42 -16.980 -10.519 1.033 294 HB2 PRO 42 HB2 PRO 42 -18.333 -8.408 2.386 295 HB3 PRO 42 HB3 PRO 42 -19.019 -9.918 1.802 296 HG2 PRO 42 HG2 PRO 42 -18.736 -9.211 4.465 297 HG3 PRO 42 HG3 PRO 42 -18.995 -10.856 3.869 298 HD2 PRO 42 HD2 PRO 42 -16.508 -9.546 4.813 299 HD3 PRO 42 HD3 PRO 42 -16.981 -11.254 4.881 300 H VAL 43 H VAL 43 -17.091 -8.536 -0.176 301 HA VAL 43 HA VAL 43 -14.653 -7.126 -0.202 302 HB VAL 43 HB VAL 43 -17.273 -6.407 -1.534 303 HG11 VAL 43 HG11 VAL 43 -15.878 -5.231 -3.201 304 HG12 VAL 43 HG12 VAL 43 -14.441 -5.623 -2.262 305 HG13 VAL 43 HG13 VAL 43 -15.670 -4.554 -1.586 306 HG21 VAL 43 HG21 VAL 43 -16.639 -8.657 -2.089 307 HG22 VAL 43 HG22 VAL 43 -15.011 -8.134 -2.528 308 HG23 VAL 43 HG23 VAL 43 -16.397 -7.616 -3.494 309 H SER 44 H SER 44 -17.827 -6.435 1.056 310 HA SER 44 HA SER 44 -17.535 -3.769 1.742 311 HB2 SER 44 HB2 SER 44 -19.077 -5.960 3.088 312 HB3 SER 44 HB3 SER 44 -19.340 -4.229 3.377 313 HG SER 44 HG SER 44 -19.327 -4.663 0.765 314 H LYS 45 H LYS 45 -16.478 -6.672 3.548 315 HA LYS 45 HA LYS 45 -15.670 -5.157 5.824 316 HB2 LYS 45 HB2 LYS 45 -16.129 -7.569 6.080 317 HB3 LYS 45 HB3 LYS 45 -14.793 -7.938 5.001 318 HG2 LYS 45 HG2 LYS 45 -13.189 -7.072 6.562 319 HG3 LYS 45 HG3 LYS 45 -14.468 -6.477 7.610 320 HD2 LYS 45 HD2 LYS 45 -14.080 -9.397 6.964 321 HD3 LYS 45 HD3 LYS 45 -13.322 -8.617 8.340 322 HE2 LYS 45 HE2 LYS 45 -16.289 -8.749 7.827 323 HE3 LYS 45 HE3 LYS 45 -15.416 -9.817 8.919 324 HZ1 LYS 45 HZ1 LYS 45 -14.818 -7.845 10.241 325 HZ2 LYS 45 HZ2 LYS 45 -16.480 -8.047 10.138 326 HZ3 LYS 45 HZ3 LYS 45 -15.718 -6.858 9.233 327 H VAL 46 H VAL 46 -14.079 -6.238 2.912 328 HA VAL 46 HA VAL 46 -11.451 -5.382 3.592 329 HB VAL 46 HB VAL 46 -12.722 -5.488 0.834 330 HG11 VAL 46 HG11 VAL 46 -10.668 -4.210 0.869 331 HG12 VAL 46 HG12 VAL 46 -10.427 -5.729 -0.001 332 HG13 VAL 46 HG13 VAL 46 -9.819 -5.544 1.648 333 HG21 VAL 46 HG21 VAL 46 -11.717 -7.726 0.631 334 HG22 VAL 46 HG22 VAL 46 -12.911 -7.651 1.927 335 HG23 VAL 46 HG23 VAL 46 -11.191 -7.630 2.311 336 H ALA 47 H ALA 47 -14.161 -3.816 2.029 337 HA ALA 47 HA ALA 47 -13.048 -1.335 1.465 338 HB1 ALA 47 HB1 ALA 47 -15.868 -2.032 2.260 339 HB2 ALA 47 HB2 ALA 47 -15.217 -2.006 0.618 340 HB3 ALA 47 HB3 ALA 47 -15.367 -0.508 1.539 341 H GLN 48 H GLN 48 -14.431 -2.599 4.416 342 HA GLN 48 HA GLN 48 -14.346 -0.184 5.897 343 HB2 GLN 48 HB2 GLN 48 -14.356 -3.059 6.791 344 HB3 GLN 48 HB3 GLN 48 -14.417 -1.703 7.906 345 HG2 GLN 48 HG2 GLN 48 -16.504 -0.966 6.946 346 HG3 GLN 48 HG3 GLN 48 -16.422 -2.250 5.738 347 HE21 GLN 48 HE21 GLN 48 -16.908 -1.510 9.076 348 HE22 GLN 48 HE22 GLN 48 -17.608 -3.019 9.525 349 H GLN 49 H GLN 49 -12.108 -2.900 5.637 350 HA GLN 49 HA GLN 49 -10.153 -1.974 7.421 351 HB2 GLN 49 HB2 GLN 49 -9.756 -3.609 4.911 352 HB3 GLN 49 HB3 GLN 49 -8.585 -3.468 6.212 353 HG2 GLN 49 HG2 GLN 49 -10.343 -4.383 7.715 354 HG3 GLN 49 HG3 GLN 49 -11.289 -4.750 6.293 355 HE21 GLN 49 HE21 GLN 49 -11.221 -6.942 6.694 356 HE22 GLN 49 HE22 GLN 49 -9.810 -7.905 6.439 357 H LEU 50 H LEU 50 -10.531 -1.538 4.024 358 HA LEU 50 HA LEU 50 -8.232 0.001 3.453 359 HB2 LEU 50 HB2 LEU 50 -10.941 0.034 2.129 360 HB3 LEU 50 HB3 LEU 50 -9.515 0.810 1.460 361 HG LEU 50 HG LEU 50 -9.904 -2.159 1.882 362 HD11 LEU 50 HD11 LEU 50 -9.931 -0.497 -0.631 363 HD12 LEU 50 HD12 LEU 50 -11.323 -1.283 0.112 364 HD13 LEU 50 HD13 LEU 50 -10.013 -2.256 -0.559 365 HD21 LEU 50 HD21 LEU 50 -7.858 -2.395 0.569 366 HD22 LEU 50 HD22 LEU 50 -7.559 -1.502 2.059 367 HD23 LEU 50 HD23 LEU 50 -7.679 -0.639 0.529 368 H ARG 51 H ARG 51 -11.497 0.972 4.352 369 HA ARG 51 HA ARG 51 -10.985 3.727 4.252 370 HB2 ARG 51 HB2 ARG 51 -13.208 2.050 5.275 371 HB3 ARG 51 HB3 ARG 51 -13.138 3.753 5.716 372 HG2 ARG 51 HG2 ARG 51 -13.032 2.760 2.888 373 HG3 ARG 51 HG3 ARG 51 -14.525 3.247 3.704 374 HD2 ARG 51 HD2 ARG 51 -12.093 4.997 3.260 375 HD3 ARG 51 HD3 ARG 51 -13.628 5.096 2.404 376 HE ARG 51 HE ARG 51 -14.494 5.334 4.853 377 HH11 ARG 51 HH11 ARG 51 -11.721 6.993 3.410 378 HH12 ARG 51 HH12 ARG 51 -11.826 8.343 4.434 379 HH21 ARG 51 HH21 ARG 51 -14.588 7.150 6.277 380 HH22 ARG 51 HH22 ARG 51 -13.461 8.424 6.110 381 H GLU 52 H GLU 52 -10.522 1.382 6.794 382 HA GLU 52 HA GLU 52 -10.368 3.545 8.718 383 HB2 GLU 52 HB2 GLU 52 -10.356 0.561 9.075 384 HB3 GLU 52 HB3 GLU 52 -10.134 1.699 10.401 385 HG2 GLU 52 HG2 GLU 52 -12.325 2.651 9.980 386 HG3 GLU 52 HG3 GLU 52 -12.535 1.595 8.591 387 H GLY 53 H GLY 53 -8.327 1.908 6.725 388 HA2 GLY 53 HA2 GLY 53 -6.065 2.499 6.461 389 HA3 GLY 53 HA3 GLY 53 -6.073 3.142 8.099 390 H HIS 54 H HIS 54 -7.263 0.000 7.237 391 HA HIS 54 HA HIS 54 -5.054 -1.204 8.752 392 HB2 HIS 54 HB2 HIS 54 -7.386 -1.880 9.350 393 HB3 HIS 54 HB3 HIS 54 -7.611 -2.496 7.721 394 HD1 HIS 54 HD1 HIS 54 -7.116 -5.020 7.477 395 HD2 HIS 54 HD2 HIS 54 -5.249 -3.304 10.783 396 HE1 HIS 54 HE1 HIS 54 -5.984 -6.887 8.690 397 H LEU 55 H LEU 55 -6.232 -0.695 5.586 398 HA LEU 55 HA LEU 55 -4.012 -2.029 4.367 399 HB2 LEU 55 HB2 LEU 55 -5.748 -3.813 4.699 400 HB3 LEU 55 HB3 LEU 55 -6.880 -2.839 3.798 401 HG LEU 55 HG LEU 55 -5.461 -3.109 1.783 402 HD11 LEU 55 HD11 LEU 55 -3.687 -4.789 1.797 403 HD12 LEU 55 HD12 LEU 55 -3.878 -4.981 3.541 404 HD13 LEU 55 HD13 LEU 55 -3.317 -3.446 2.877 405 HD21 LEU 55 HD21 LEU 55 -6.019 -5.476 1.413 406 HD22 LEU 55 HD22 LEU 55 -7.344 -4.597 2.179 407 HD23 LEU 55 HD23 LEU 55 -6.320 -5.660 3.139 408 H VAL 56 H VAL 56 -3.877 -1.230 2.083 409 HA VAL 56 HA VAL 56 -5.812 0.843 1.400 410 HB VAL 56 HB VAL 56 -3.947 2.280 0.455 411 HG11 VAL 56 HG11 VAL 56 -5.029 2.893 2.546 412 HG12 VAL 56 HG12 VAL 56 -3.311 3.292 2.600 413 HG13 VAL 56 HG13 VAL 56 -3.912 1.864 3.442 414 HG21 VAL 56 HG21 VAL 56 -2.198 0.500 2.147 415 HG22 VAL 56 HG22 VAL 56 -1.679 1.976 1.338 416 HG23 VAL 56 HG23 VAL 56 -2.187 0.578 0.385 417 H ALA 57 H ALA 57 -5.651 1.493 -0.977 418 HA ALA 57 HA ALA 57 -4.815 -0.759 -2.633 419 HB1 ALA 57 HB1 ALA 57 -7.580 0.454 -2.651 420 HB2 ALA 57 HB2 ALA 57 -7.175 -1.126 -1.997 421 HB3 ALA 57 HB3 ALA 57 -6.989 -0.813 -3.725 422 H VAL 58 H VAL 58 -4.784 -0.175 -4.906 423 HA VAL 58 HA VAL 58 -4.727 2.693 -5.435 424 HB VAL 58 HB VAL 58 -2.800 2.250 -7.049 425 HG11 VAL 58 HG11 VAL 58 -1.087 2.390 -5.310 426 HG12 VAL 58 HG12 VAL 58 -2.275 1.877 -4.108 427 HG13 VAL 58 HG13 VAL 58 -2.474 3.418 -4.943 428 HG21 VAL 58 HG21 VAL 58 -2.953 -0.180 -7.144 429 HG22 VAL 58 HG22 VAL 58 -2.575 -0.293 -5.426 430 HG23 VAL 58 HG23 VAL 58 -1.361 0.299 -6.556 431 H ARG 59 H ARG 59 -4.724 3.101 -7.872 432 HA ARG 59 HA ARG 59 -6.602 1.195 -9.100 433 HB2 ARG 59 HB2 ARG 59 -7.710 3.227 -8.289 434 HB3 ARG 59 HB3 ARG 59 -6.617 4.206 -9.246 435 HG2 ARG 59 HG2 ARG 59 -7.544 3.130 -11.291 436 HG3 ARG 59 HG3 ARG 59 -8.711 2.298 -10.263 437 HD2 ARG 59 HD2 ARG 59 -8.393 5.285 -10.518 438 HD3 ARG 59 HD3 ARG 59 -9.681 4.323 -11.237 439 HE ARG 59 HE ARG 59 -10.026 3.694 -8.714 440 HH11 ARG 59 HH11 ARG 59 -9.420 6.894 -10.096 441 HH12 ARG 59 HH12 ARG 59 -10.219 7.751 -8.867 442 HH21 ARG 59 HH21 ARG 59 -11.165 4.846 -7.039 443 HH22 ARG 59 HH22 ARG 59 -11.262 6.549 -7.079 444 H ARG 60 H ARG 60 -6.017 0.468 -11.018 445 HA ARG 60 HA ARG 60 -4.367 2.123 -12.759 446 HB2 ARG 60 HB2 ARG 60 -2.985 0.204 -13.440 447 HB3 ARG 60 HB3 ARG 60 -2.785 0.568 -11.741 448 HG2 ARG 60 HG2 ARG 60 -4.231 -1.349 -11.174 449 HG3 ARG 60 HG3 ARG 60 -4.407 -1.705 -12.895 450 HD2 ARG 60 HD2 ARG 60 -1.989 -1.996 -13.080 451 HD3 ARG 60 HD3 ARG 60 -1.813 -1.621 -11.374 452 HE ARG 60 HE ARG 60 -3.441 -3.909 -12.153 453 HH11 ARG 60 HH11 ARG 60 -0.496 -2.636 -10.593 454 HH12 ARG 60 HH12 ARG 60 0.034 -4.143 -10.031 455 HH21 ARG 60 HH21 ARG 60 -2.707 -6.013 -11.389 456 HH22 ARG 60 HH22 ARG 60 -1.293 -6.172 -10.474 457 H ALA 61 H ALA 61 -5.236 2.316 -14.684 458 HA ALA 61 HA ALA 61 -6.599 2.111 -16.470 459 HB1 ALA 61 HB1 ALA 61 -6.873 -0.118 -17.452 460 HB2 ALA 61 HB2 ALA 61 -6.365 -0.857 -15.934 461 HB3 ALA 61 HB3 ALA 61 -5.221 0.105 -16.870 462 H GLY 62 H GLY 62 -7.787 2.339 -13.813 463 HA2 GLY 62 HA2 GLY 62 -10.015 2.665 -13.179 464 HA3 GLY 62 HA3 GLY 62 -10.521 1.658 -14.527 465 H GLY 63 H GLY 63 -8.162 -0.075 -13.129 466 HA2 GLY 63 HA2 GLY 63 -10.077 -1.696 -11.627 467 HA3 GLY 63 HA3 GLY 63 -8.504 -2.200 -12.226 468 H VAL 64 H VAL 64 -9.910 -2.068 -9.544 469 HA VAL 64 HA VAL 64 -7.933 -0.501 -8.088 470 HB VAL 64 HB VAL 64 -10.426 -1.926 -7.079 471 HG11 VAL 64 HG11 VAL 64 -8.595 0.016 -5.669 472 HG12 VAL 64 HG12 VAL 64 -8.722 -1.709 -5.341 473 HG13 VAL 64 HG13 VAL 64 -10.088 -0.646 -5.007 474 HG21 VAL 64 HG21 VAL 64 -9.961 1.015 -7.577 475 HG22 VAL 64 HG22 VAL 64 -11.410 0.308 -6.863 476 HG23 VAL 64 HG23 VAL 64 -10.986 -0.046 -8.541 477 H VAL 65 H VAL 65 -6.265 -1.493 -7.229 478 HA VAL 65 HA VAL 65 -6.418 -4.365 -6.782 479 HB VAL 65 HB VAL 65 -3.986 -4.514 -7.574 480 HG11 VAL 65 HG11 VAL 65 -4.598 -4.780 -9.922 481 HG12 VAL 65 HG12 VAL 65 -6.079 -3.868 -9.644 482 HG13 VAL 65 HG13 VAL 65 -5.855 -5.440 -8.872 483 HG21 VAL 65 HG21 VAL 65 -3.519 -2.131 -7.630 484 HG22 VAL 65 HG22 VAL 65 -4.748 -1.920 -8.886 485 HG23 VAL 65 HG23 VAL 65 -3.286 -2.857 -9.230 486 H ILE 66 H ILE 66 -5.040 -5.159 -5.276 487 HA ILE 66 HA ILE 66 -3.845 -3.217 -3.448 488 HB ILE 66 HB ILE 66 -5.351 -5.770 -2.731 489 HG12 ILE 66 HG12 ILE 66 -6.023 -2.878 -2.154 490 HG13 ILE 66 HG13 ILE 66 -6.789 -3.846 -3.402 491 HG21 ILE 66 HG21 ILE 66 -3.432 -5.355 -1.245 492 HG22 ILE 66 HG22 ILE 66 -4.962 -5.130 -0.396 493 HG23 ILE 66 HG23 ILE 66 -4.034 -3.727 -0.929 494 HD11 ILE 66 HD11 ILE 66 -8.142 -3.583 -1.372 495 HD12 ILE 66 HD12 ILE 66 -6.903 -4.422 -0.447 496 HD13 ILE 66 HD13 ILE 66 -7.793 -5.263 -1.732 497 HA PRO 67 HA PRO 67 -0.210 -5.646 -4.499 498 HB2 PRO 67 HB2 PRO 67 0.663 -4.531 -1.893 499 HB3 PRO 67 HB3 PRO 67 1.514 -4.538 -3.439 500 HG2 PRO 67 HG2 PRO 67 0.392 -2.314 -2.565 501 HG3 PRO 67 HG3 PRO 67 0.242 -2.764 -4.272 502 HD2 PRO 67 HD2 PRO 67 -1.776 -2.986 -2.080 503 HD3 PRO 67 HD3 PRO 67 -1.984 -2.520 -3.783 504 H GLN 68 H GLN 68 0.103 -7.737 -4.114 505 HA GLN 68 HA GLN 68 -1.111 -9.158 -2.027 506 HB2 GLN 68 HB2 GLN 68 -0.724 -10.136 -4.134 507 HB3 GLN 68 HB3 GLN 68 0.997 -9.831 -4.044 508 HG2 GLN 68 HG2 GLN 68 1.265 -11.513 -2.364 509 HG3 GLN 68 HG3 GLN 68 -0.482 -11.729 -2.239 510 HE21 GLN 68 HE21 GLN 68 -0.876 -11.489 -5.151 511 HE22 GLN 68 HE22 GLN 68 -0.334 -12.986 -5.767 512 H VAL 69 H VAL 69 1.904 -7.606 -2.318 513 HA VAL 69 HA VAL 69 3.290 -8.993 -0.262 514 HB VAL 69 HB VAL 69 4.893 -7.098 -0.382 515 HG11 VAL 69 HG11 VAL 69 5.593 -7.510 -2.705 516 HG12 VAL 69 HG12 VAL 69 4.021 -8.229 -3.049 517 HG13 VAL 69 HG13 VAL 69 5.113 -9.003 -1.904 518 HG21 VAL 69 HG21 VAL 69 3.302 -5.323 -0.817 519 HG22 VAL 69 HG22 VAL 69 2.927 -6.020 -2.395 520 HG23 VAL 69 HG23 VAL 69 4.539 -5.375 -2.067 521 H PHE 70 H PHE 70 0.681 -6.915 -0.034 522 HA PHE 70 HA PHE 70 1.393 -5.835 2.560 523 HB2 PHE 70 HB2 PHE 70 -1.009 -5.614 0.761 524 HB3 PHE 70 HB3 PHE 70 -1.161 -5.205 2.464 525 HD1 PHE 70 HD1 PHE 70 1.507 -4.538 -0.071 526 HD2 PHE 70 HD2 PHE 70 -1.272 -2.952 2.705 527 HE1 PHE 70 HE1 PHE 70 2.378 -2.278 -0.503 528 HE2 PHE 70 HE2 PHE 70 -0.408 -0.694 2.303 529 HZ PHE 70 HZ PHE 70 1.400 -0.339 0.699 530 H PHE 71 H PHE 71 0.548 -8.678 1.340 531 HA PHE 71 HA PHE 71 -0.782 -9.613 3.754 532 HB2 PHE 71 HB2 PHE 71 -0.883 -10.744 0.942 533 HB3 PHE 71 HB3 PHE 71 -1.641 -11.460 2.355 534 HD1 PHE 71 HD1 PHE 71 -1.755 -8.677 -0.035 535 HD2 PHE 71 HD2 PHE 71 -3.718 -10.637 3.186 536 HE1 PHE 71 HE1 PHE 71 -3.796 -7.401 -0.512 537 HE2 PHE 71 HE2 PHE 71 -5.763 -9.359 2.716 538 HZ PHE 71 HZ PHE 71 -5.802 -7.737 0.864 539 H THR 72 H THR 72 0.032 -11.493 4.518 540 HA THR 72 HA THR 72 2.816 -11.994 3.980 541 HB THR 72 HB THR 72 2.550 -13.672 5.834 542 HG1 THR 72 HG1 THR 72 -0.054 -12.558 6.078 543 HG21 THR 72 HG21 THR 72 2.171 -12.014 7.618 544 HG22 THR 72 HG22 THR 72 1.479 -10.917 6.421 545 HG23 THR 72 HG23 THR 72 3.194 -11.346 6.341 546 H ASN 73 H ASN 73 3.403 -14.442 3.871 547 HA ASN 73 HA ASN 73 2.332 -15.531 1.498 548 HB2 ASN 73 HB2 ASN 73 3.805 -17.448 1.931 549 HB3 ASN 73 HB3 ASN 73 4.662 -15.942 2.238 550 HD21 ASN 73 HD21 ASN 73 5.185 -18.638 3.233 551 HD22 ASN 73 HD22 ASN 73 5.118 -18.533 4.953 552 H SER 74 H SER 74 1.354 -15.723 4.744 553 HA SER 74 HA SER 74 -0.083 -18.183 4.573 554 HB2 SER 74 HB2 SER 74 -0.254 -15.959 6.593 555 HB3 SER 74 HB3 SER 74 -0.804 -17.625 6.803 556 HG SER 74 HG SER 74 1.094 -17.793 7.623 557 H GLY 75 H GLY 75 -0.647 -15.173 3.245 558 HA2 GLY 75 HA2 GLY 75 -2.479 -14.506 2.028 559 HA3 GLY 75 HA3 GLY 75 -3.366 -15.886 2.656 560 H GLN 76 H GLN 76 -1.805 -13.763 4.869 561 HA GLN 76 HA GLN 76 -4.376 -12.420 5.384 562 HB2 GLN 76 HB2 GLN 76 -2.417 -13.338 7.497 563 HB3 GLN 76 HB3 GLN 76 -3.911 -12.462 7.788 564 HG2 GLN 76 HG2 GLN 76 -5.125 -14.414 6.787 565 HG3 GLN 76 HG3 GLN 76 -3.586 -15.276 6.803 566 HE21 GLN 76 HE21 GLN 76 -2.656 -15.830 8.837 567 HE22 GLN 76 HE22 GLN 76 -3.624 -15.818 10.255 568 H VAL 77 H VAL 77 -4.129 -10.284 6.354 569 HA VAL 77 HA VAL 77 -2.124 -8.789 5.047 570 HB VAL 77 HB VAL 77 -3.946 -7.957 7.354 571 HG11 VAL 77 HG11 VAL 77 -3.576 -5.660 6.620 572 HG12 VAL 77 HG12 VAL 77 -2.431 -6.232 5.406 573 HG13 VAL 77 HG13 VAL 77 -2.064 -6.421 7.121 574 HG21 VAL 77 HG21 VAL 77 -4.256 -7.568 4.396 575 HG22 VAL 77 HG22 VAL 77 -5.356 -6.972 5.635 576 HG23 VAL 77 HG23 VAL 77 -5.178 -8.715 5.377 577 H VAL 78 H VAL 78 -0.271 -7.851 5.783 578 HA VAL 78 HA VAL 78 1.333 -9.139 7.663 579 HB VAL 78 HB VAL 78 1.539 -6.256 6.706 580 HG11 VAL 78 HG11 VAL 78 3.702 -8.006 7.869 581 HG12 VAL 78 HG12 VAL 78 2.900 -6.685 8.714 582 HG13 VAL 78 HG13 VAL 78 3.888 -6.348 7.294 583 HG21 VAL 78 HG21 VAL 78 3.110 -7.114 5.047 584 HG22 VAL 78 HG22 VAL 78 1.520 -7.851 4.864 585 HG23 VAL 78 HG23 VAL 78 2.832 -8.756 5.622 586 H LYS 79 H LYS 79 1.706 -8.891 9.771 587 HA LYS 79 HA LYS 79 -0.397 -8.147 11.412 588 HB2 LYS 79 HB2 LYS 79 1.321 -9.778 12.034 589 HB3 LYS 79 HB3 LYS 79 2.510 -8.492 12.140 590 HG2 LYS 79 HG2 LYS 79 1.312 -7.499 14.002 591 HG3 LYS 79 HG3 LYS 79 0.065 -8.742 13.856 592 HD2 LYS 79 HD2 LYS 79 1.699 -10.464 14.382 593 HD3 LYS 79 HD3 LYS 79 2.966 -9.241 14.488 594 HE2 LYS 79 HE2 LYS 79 2.128 -9.892 16.705 595 HE3 LYS 79 HE3 LYS 79 1.849 -8.190 16.356 596 HZ1 LYS 79 HZ1 LYS 79 -0.049 -9.245 17.380 597 HZ2 LYS 79 HZ2 LYS 79 -0.199 -10.334 16.115 598 HZ3 LYS 79 HZ3 LYS 79 -0.451 -8.677 15.863 599 H SER 80 H SER 80 2.536 -6.345 10.669 600 HA SER 80 HA SER 80 1.586 -4.141 12.305 601 HB2 SER 80 HB2 SER 80 3.980 -3.304 11.773 602 HB3 SER 80 HB3 SER 80 3.772 -4.666 12.880 603 HG SER 80 HG SER 80 4.944 -4.558 10.413 604 H LEU 81 H LEU 81 0.635 -4.895 9.457 605 HA LEU 81 HA LEU 81 1.392 -2.877 7.632 606 HB2 LEU 81 HB2 LEU 81 -0.051 -5.067 7.400 607 HB3 LEU 81 HB3 LEU 81 -1.367 -3.958 7.675 608 HG LEU 81 HG LEU 81 -1.085 -4.353 5.380 609 HD11 LEU 81 HD11 LEU 81 -0.227 -1.570 6.058 610 HD12 LEU 81 HD12 LEU 81 -1.876 -2.160 5.855 611 HD13 LEU 81 HD13 LEU 81 -0.791 -2.072 4.469 612 HD21 LEU 81 HD21 LEU 81 1.761 -3.445 5.668 613 HD22 LEU 81 HD22 LEU 81 0.923 -3.634 4.122 614 HD23 LEU 81 HD23 LEU 81 1.136 -5.024 5.163 615 HA PRO 82 HA PRO 82 -2.515 -0.336 9.274 616 HB2 PRO 82 HB2 PRO 82 -3.077 -0.791 11.942 617 HB3 PRO 82 HB3 PRO 82 -3.989 -1.495 10.603 618 HG2 PRO 82 HG2 PRO 82 -1.763 -2.692 12.214 619 HG3 PRO 82 HG3 PRO 82 -3.290 -3.438 11.700 620 HD2 PRO 82 HD2 PRO 82 -1.035 -3.960 10.407 621 HD3 PRO 82 HD3 PRO 82 -2.550 -3.711 9.504 622 H GLY 83 H GLY 83 0.154 -1.348 11.264 623 HA2 GLY 83 HA2 GLY 83 0.408 0.964 12.884 624 HA3 GLY 83 HA3 GLY 83 1.667 -0.225 12.573 625 H LEU 84 H LEU 84 1.957 0.004 9.839 626 HA LEU 84 HA LEU 84 3.533 2.362 9.716 627 HB2 LEU 84 HB2 LEU 84 4.214 1.690 7.508 628 HB3 LEU 84 HB3 LEU 84 4.149 0.262 8.509 629 HG LEU 84 HG LEU 84 1.749 0.062 7.384 630 HD11 LEU 84 HD11 LEU 84 1.807 0.717 5.021 631 HD12 LEU 84 HD12 LEU 84 3.334 1.551 5.297 632 HD13 LEU 84 HD13 LEU 84 1.873 2.109 6.099 633 HD21 LEU 84 HD21 LEU 84 4.336 -0.738 6.057 634 HD22 LEU 84 HD22 LEU 84 2.748 -1.423 5.713 635 HD23 LEU 84 HD23 LEU 84 3.473 -1.642 7.309 636 H LEU 85 H LEU 85 0.430 1.443 8.414 637 HA LEU 85 HA LEU 85 0.034 3.744 6.882 638 HB2 LEU 85 HB2 LEU 85 -1.992 1.945 8.191 639 HB3 LEU 85 HB3 LEU 85 -2.396 3.207 7.049 640 HG LEU 85 HG LEU 85 -0.697 0.788 6.441 641 HD11 LEU 85 HD11 LEU 85 -3.527 1.475 5.687 642 HD12 LEU 85 HD12 LEU 85 -3.021 0.232 6.828 643 HD13 LEU 85 HD13 LEU 85 -2.619 0.074 5.117 644 HD21 LEU 85 HD21 LEU 85 -0.921 1.514 4.105 645 HD22 LEU 85 HD22 LEU 85 -0.068 2.715 5.073 646 HD23 LEU 85 HD23 LEU 85 -1.759 2.970 4.641 647 H THR 86 H THR 86 -0.525 3.032 10.221 648 HA THR 86 HA THR 86 -2.081 5.280 10.891 649 HB THR 86 HB THR 86 -0.220 3.665 12.660 650 HG1 THR 86 HG1 THR 86 -1.932 2.486 11.804 651 HG21 THR 86 HG21 THR 86 -1.501 4.584 14.564 652 HG22 THR 86 HG22 THR 86 -2.398 5.624 13.459 653 HG23 THR 86 HG23 THR 86 -0.668 5.868 13.688 654 H ILE 87 H ILE 87 1.469 4.879 11.033 655 HA ILE 87 HA ILE 87 1.817 7.502 12.017 656 HB ILE 87 HB ILE 87 3.494 5.819 12.518 657 HG12 ILE 87 HG12 ILE 87 4.289 8.224 12.288 658 HG13 ILE 87 HG13 ILE 87 5.540 6.994 12.268 659 HG21 ILE 87 HG21 ILE 87 3.393 4.383 10.660 660 HG22 ILE 87 HG22 ILE 87 5.069 4.892 10.888 661 HG23 ILE 87 HG23 ILE 87 4.100 5.606 9.605 662 HD11 ILE 87 HD11 ILE 87 5.950 8.789 10.652 663 HD12 ILE 87 HD12 ILE 87 4.424 8.415 9.859 664 HD13 ILE 87 HD13 ILE 87 5.735 7.233 9.843 665 H LEU 88 H LEU 88 1.960 6.177 8.756 666 HA LEU 88 HA LEU 88 2.636 8.629 7.511 667 HB2 LEU 88 HB2 LEU 88 1.478 6.077 6.511 668 HB3 LEU 88 HB3 LEU 88 1.471 7.477 5.473 669 HG LEU 88 HG LEU 88 3.312 6.027 4.950 670 HD11 LEU 88 HD11 LEU 88 4.267 8.577 6.218 671 HD12 LEU 88 HD12 LEU 88 3.666 8.373 4.575 672 HD13 LEU 88 HD13 LEU 88 5.174 7.601 5.066 673 HD21 LEU 88 HD21 LEU 88 4.323 6.516 7.736 674 HD22 LEU 88 HD22 LEU 88 5.160 5.638 6.460 675 HD23 LEU 88 HD23 LEU 88 3.659 4.990 7.134 676 H HIS 89 H HIS 89 -0.438 7.229 8.383 677 HA HIS 89 HA HIS 89 -2.080 9.018 6.958 678 HB2 HIS 89 HB2 HIS 89 -2.911 6.886 7.953 679 HB3 HIS 89 HB3 HIS 89 -2.710 7.579 9.556 680 HD1 HIS 89 HD1 HIS 89 -5.032 7.979 10.423 681 HD2 HIS 89 HD2 HIS 89 -4.637 9.049 6.423 682 HE1 HIS 89 HE1 HIS 89 -7.240 8.984 9.739 683 H ASP 90 H ASP 90 -0.486 9.234 10.051 684 HA ASP 90 HA ASP 90 -1.795 11.579 10.989 685 HB2 ASP 90 HB2 ASP 90 -0.477 10.083 12.456 686 HB3 ASP 90 HB3 ASP 90 0.991 10.585 11.628 687 H GLY 91 H GLY 91 0.890 10.992 8.868 688 HA2 GLY 91 HA2 GLY 91 1.657 13.786 8.745 689 HA3 GLY 91 HA3 GLY 91 2.348 12.469 7.805 690 H GLY 92 H GLY 92 -0.703 11.887 7.385 691 HA2 GLY 92 HA2 GLY 92 -2.361 12.454 5.890 692 HA3 GLY 92 HA3 GLY 92 -1.532 13.978 5.601 693 H TYR 93 H TYR 93 -0.761 10.542 5.113 694 HA TYR 93 HA TYR 93 0.010 11.258 2.383 695 HB2 TYR 93 HB2 TYR 93 1.119 9.170 4.225 696 HB3 TYR 93 HB3 TYR 93 1.465 9.192 2.500 697 HD1 TYR 93 HD1 TYR 93 2.676 11.063 1.523 698 HD2 TYR 93 HD2 TYR 93 2.161 10.739 5.719 699 HE1 TYR 93 HE1 TYR 93 4.451 12.675 1.850 700 HE2 TYR 93 HE2 TYR 93 3.937 12.388 6.067 701 HH TYR 93 HH TYR 93 6.046 13.116 4.615 702 H ARG 94 H ARG 94 -0.732 10.181 0.719 703 HA ARG 94 HA ARG 94 -2.994 8.422 1.156 704 HB2 ARG 94 HB2 ARG 94 -3.500 8.692 -1.182 705 HB3 ARG 94 HB3 ARG 94 -3.186 10.265 -0.478 706 HG2 ARG 94 HG2 ARG 94 -0.875 10.148 -1.442 707 HG3 ARG 94 HG3 ARG 94 -1.364 8.667 -2.260 708 HD2 ARG 94 HD2 ARG 94 -1.605 10.590 -3.739 709 HD3 ARG 94 HD3 ARG 94 -3.176 9.866 -3.379 710 HE ARG 94 HE ARG 94 -2.263 12.104 -1.759 711 HH11 ARG 94 HH11 ARG 94 -4.474 10.961 -4.285 712 HH12 ARG 94 HH12 ARG 94 -5.563 12.257 -4.081 713 HH21 ARG 94 HH21 ARG 94 -3.758 13.847 -1.527 714 HH22 ARG 94 HH22 ARG 94 -5.170 13.935 -2.461 715 H ASP 95 H ASP 95 -3.238 6.654 -0.555 716 HA ASP 95 HA ASP 95 -1.642 4.513 0.106 717 HB2 ASP 95 HB2 ASP 95 -2.758 3.445 -1.891 718 HB3 ASP 95 HB3 ASP 95 -3.852 4.201 -0.733 719 H THR 96 H THR 96 -1.541 6.483 -2.837 720 HA THR 96 HA THR 96 0.418 5.106 -4.209 721 HB THR 96 HB THR 96 0.041 8.099 -4.305 722 HG1 THR 96 HG1 THR 96 -1.805 6.088 -4.734 723 HG21 THR 96 HG21 THR 96 0.563 7.791 -6.678 724 HG22 THR 96 HG22 THR 96 0.621 6.037 -6.448 725 HG23 THR 96 HG23 THR 96 1.827 7.056 -5.681 726 H GLU 97 H GLU 97 0.676 7.701 -1.823 727 HA GLU 97 HA GLU 97 3.466 8.129 -1.987 728 HB2 GLU 97 HB2 GLU 97 1.449 8.623 0.196 729 HB3 GLU 97 HB3 GLU 97 3.147 9.023 0.388 730 HG2 GLU 97 HG2 GLU 97 1.509 10.083 -1.884 731 HG3 GLU 97 HG3 GLU 97 1.565 10.889 -0.319 732 H ILE 98 H ILE 98 1.469 6.018 0.006 733 HA ILE 98 HA ILE 98 3.463 5.079 1.778 734 HB ILE 98 HB ILE 98 1.164 3.386 0.768 735 HG12 ILE 98 HG12 ILE 98 0.117 5.468 1.428 736 HG13 ILE 98 HG13 ILE 98 -0.165 4.245 2.670 737 HG21 ILE 98 HG21 ILE 98 2.591 3.429 3.410 738 HG22 ILE 98 HG22 ILE 98 2.761 2.216 2.142 739 HG23 ILE 98 HG23 ILE 98 1.227 2.390 2.998 740 HD11 ILE 98 HD11 ILE 98 1.877 6.434 2.815 741 HD12 ILE 98 HD12 ILE 98 1.533 5.232 4.059 742 HD13 ILE 98 HD13 ILE 98 0.307 6.424 3.619 743 H MET 99 H MET 99 2.215 3.805 -1.253 744 HA MET 99 HA MET 99 3.964 1.552 -1.262 745 HB2 MET 99 HB2 MET 99 2.268 2.644 -3.503 746 HB3 MET 99 HB3 MET 99 3.023 1.055 -3.456 747 HG2 MET 99 HG2 MET 99 1.683 0.522 -1.454 748 HG3 MET 99 HG3 MET 99 0.878 2.078 -1.618 749 HE1 MET 99 HE1 MET 99 -0.876 -0.383 -1.359 750 HE2 MET 99 HE2 MET 99 -2.008 -0.192 -2.697 751 HE3 MET 99 HE3 MET 99 -1.514 1.214 -1.755 752 H ARG 100 H ARG 100 4.238 4.794 -2.294 753 HA ARG 100 HA ARG 100 5.968 4.614 -4.450 754 HB2 ARG 100 HB2 ARG 100 4.877 6.657 -3.862 755 HB3 ARG 100 HB3 ARG 100 5.617 6.658 -2.277 756 HG2 ARG 100 HG2 ARG 100 7.786 7.083 -3.312 757 HG3 ARG 100 HG3 ARG 100 7.006 7.117 -4.902 758 HD2 ARG 100 HD2 ARG 100 5.672 8.982 -4.296 759 HD3 ARG 100 HD3 ARG 100 6.153 8.859 -2.609 760 HE ARG 100 HE ARG 100 8.346 9.274 -4.363 761 HH11 ARG 100 HH11 ARG 100 5.663 10.917 -2.661 762 HH12 ARG 100 HH12 ARG 100 6.472 12.383 -2.500 763 HH21 ARG 100 HH21 ARG 100 9.483 11.368 -4.107 764 HH22 ARG 100 HH22 ARG 100 8.690 12.652 -3.336 765 H TRP 101 H TRP 101 6.921 5.360 -1.089 766 HA TRP 101 HA TRP 101 9.617 4.739 -1.691 767 HB2 TRP 101 HB2 TRP 101 9.950 4.919 0.854 768 HB3 TRP 101 HB3 TRP 101 9.460 6.356 -0.028 769 HD1 TRP 101 HD1 TRP 101 7.199 7.428 0.583 770 HE1 TRP 101 HE1 TRP 101 5.482 7.039 2.452 771 HE3 TRP 101 HE3 TRP 101 8.856 2.905 2.283 772 HZ2 TRP 101 HZ2 TRP 101 4.918 5.096 4.369 773 HZ3 TRP 101 HZ3 TRP 101 7.667 1.846 4.119 774 HH2 TRP 101 HH2 TRP 101 5.736 2.917 5.167 775 H LEU 102 H LEU 102 7.032 2.868 -0.355 776 HA LEU 102 HA LEU 102 8.436 0.774 0.810 777 HB2 LEU 102 HB2 LEU 102 5.773 1.175 -0.283 778 HB3 LEU 102 HB3 LEU 102 6.257 -0.515 -0.191 779 HG LEU 102 HG LEU 102 6.149 1.449 2.110 780 HD11 LEU 102 HD11 LEU 102 4.169 0.234 2.775 781 HD12 LEU 102 HD12 LEU 102 4.313 -0.823 1.364 782 HD13 LEU 102 HD13 LEU 102 3.949 0.893 1.151 783 HD21 LEU 102 HD21 LEU 102 6.601 -1.511 1.965 784 HD22 LEU 102 HD22 LEU 102 6.369 -0.600 3.465 785 HD23 LEU 102 HD23 LEU 102 7.775 -0.287 2.448 786 H PHE 103 H PHE 103 7.564 1.227 -2.569 787 HA PHE 103 HA PHE 103 8.841 -1.320 -3.149 788 HB2 PHE 103 HB2 PHE 103 7.067 0.431 -4.808 789 HB3 PHE 103 HB3 PHE 103 7.861 -1.015 -5.428 790 HD1 PHE 103 HD1 PHE 103 7.260 -3.216 -4.556 791 HD2 PHE 103 HD2 PHE 103 5.177 0.280 -3.357 792 HE1 PHE 103 HE1 PHE 103 5.403 -4.595 -3.750 793 HE2 PHE 103 HE2 PHE 103 3.313 -1.084 -2.562 794 HZ PHE 103 HZ PHE 103 3.411 -3.512 -2.759 795 H THR 104 H THR 104 9.908 1.649 -2.804 796 HA THR 104 HA THR 104 11.543 1.704 -5.173 797 HB THR 104 HB THR 104 11.355 3.570 -2.794 798 HG1 THR 104 HG1 THR 104 9.635 3.803 -4.176 799 HG21 THR 104 HG21 THR 104 13.663 3.586 -3.670 800 HG22 THR 104 HG22 THR 104 12.834 5.099 -4.045 801 HG23 THR 104 HG23 THR 104 13.042 3.872 -5.293 802 HA PRO 105 HA PRO 105 14.713 -0.699 -3.043 803 HB2 PRO 105 HB2 PRO 105 16.245 0.180 -5.440 804 HB3 PRO 105 HB3 PRO 105 16.017 -1.452 -4.807 805 HG2 PRO 105 HG2 PRO 105 14.768 -0.693 -7.026 806 HG3 PRO 105 HG3 PRO 105 13.935 -1.695 -5.819 807 HD2 PRO 105 HD2 PRO 105 13.708 1.250 -6.310 808 HD3 PRO 105 HD3 PRO 105 12.435 0.050 -5.973 809 H ASP 106 H ASP 106 16.017 0.219 -1.581 810 HA ASP 106 HA ASP 106 16.655 3.025 -1.998 811 HB2 ASP 106 HB2 ASP 106 15.397 2.501 0.041 812 HB3 ASP 106 HB3 ASP 106 16.679 1.422 0.561 813 HA PRO 107 HA PRO 107 20.779 1.830 -3.045 814 HB2 PRO 107 HB2 PRO 107 21.908 4.325 -2.736 815 HB3 PRO 107 HB3 PRO 107 21.042 3.787 -4.177 816 HG2 PRO 107 HG2 PRO 107 20.071 5.435 -1.883 817 HG3 PRO 107 HG3 PRO 107 19.759 5.640 -3.618 818 HD2 PRO 107 HD2 PRO 107 17.945 4.567 -1.984 819 HD3 PRO 107 HD3 PRO 107 18.150 3.968 -3.647 820 H SER 108 H SER 108 19.916 3.250 -0.022 821 HA SER 108 HA SER 108 22.539 2.570 1.036 822 HB2 SER 108 HB2 SER 108 21.741 4.057 2.980 823 HB3 SER 108 HB3 SER 108 22.179 4.839 1.463 824 HG SER 108 HG SER 108 19.486 4.076 1.851 825 H LEU 109 H LEU 109 19.712 1.071 0.670 826 HA LEU 109 HA LEU 109 19.549 0.090 3.411 827 HB2 LEU 109 HB2 LEU 109 17.478 0.930 2.405 828 HB3 LEU 109 HB3 LEU 109 17.636 -0.259 1.120 829 HG LEU 109 HG LEU 109 17.370 -2.059 2.802 830 HD11 LEU 109 HD11 LEU 109 16.532 -1.500 5.027 831 HD12 LEU 109 HD12 LEU 109 16.801 0.216 4.694 832 HD13 LEU 109 HD13 LEU 109 18.167 -0.894 4.767 833 HD21 LEU 109 HD21 LEU 109 15.453 -1.283 1.524 834 HD22 LEU 109 HD22 LEU 109 15.155 -0.017 2.717 835 HD23 LEU 109 HD23 LEU 109 14.970 -1.711 3.165 836 H THR 110 H THR 110 20.187 -1.831 3.889 837 HA THR 110 HA THR 110 20.469 -3.891 1.841 838 HB THR 110 HB THR 110 22.373 -3.361 4.148 839 HG1 THR 110 HG1 THR 110 22.138 -2.183 1.753 840 HG21 THR 110 HG21 THR 110 23.823 -4.980 3.002 841 HG22 THR 110 HG22 THR 110 22.602 -5.188 1.744 842 HG23 THR 110 HG23 THR 110 22.267 -5.706 3.394 843 H ILE 111 H ILE 111 19.192 -5.589 2.401 844 HA ILE 111 HA ILE 111 18.597 -6.061 5.223 845 HB ILE 111 HB ILE 111 16.176 -6.504 4.552 846 HG12 ILE 111 HG12 ILE 111 17.011 -4.690 2.282 847 HG13 ILE 111 HG13 ILE 111 16.491 -6.362 2.129 848 HG21 ILE 111 HG21 ILE 111 15.558 -4.172 5.009 849 HG22 ILE 111 HG22 ILE 111 17.240 -3.703 4.723 850 HG23 ILE 111 HG23 ILE 111 16.841 -4.790 6.056 851 HD11 ILE 111 HD11 ILE 111 14.730 -4.857 1.468 852 HD12 ILE 111 HD12 ILE 111 14.819 -4.036 3.026 853 HD13 ILE 111 HD13 ILE 111 14.269 -5.711 2.945 854 H THR 112 H THR 112 17.312 -8.044 5.558 855 HA THR 112 HA THR 112 18.559 -10.195 3.978 856 HB THR 112 HB THR 112 18.498 -11.510 6.031 857 HG1 THR 112 HG1 THR 112 16.869 -9.366 6.892 858 HG21 THR 112 HG21 THR 112 19.516 -8.722 6.538 859 HG22 THR 112 HG22 THR 112 20.420 -10.018 5.756 860 HG23 THR 112 HG23 THR 112 19.988 -10.148 7.470 861 H ARG 113 H ARG 113 17.188 -12.174 3.788 862 HA ARG 113 HA ARG 113 14.351 -11.712 4.334 863 HB2 ARG 113 HB2 ARG 113 13.736 -12.721 2.186 864 HB3 ARG 113 HB3 ARG 113 14.780 -11.340 1.894 865 HG2 ARG 113 HG2 ARG 113 16.680 -12.863 1.609 866 HG3 ARG 113 HG3 ARG 113 15.598 -14.228 1.851 867 HD2 ARG 113 HD2 ARG 113 15.941 -13.935 -0.492 868 HD3 ARG 113 HD3 ARG 113 14.287 -13.467 -0.112 869 HE ARG 113 HE ARG 113 15.078 -11.141 -0.184 870 HH11 ARG 113 HH11 ARG 113 17.062 -13.596 -1.853 871 HH12 ARG 113 HH12 ARG 113 17.614 -12.510 -3.034 872 HH21 ARG 113 HH21 ARG 113 15.810 -9.709 -1.819 873 HH22 ARG 113 HH22 ARG 113 16.859 -10.268 -3.061 874 H ASP 114 H ASP 114 13.342 -14.136 3.740 875 HA ASP 114 HA ASP 114 14.796 -15.912 5.530 876 HB2 ASP 114 HB2 ASP 114 12.821 -17.362 5.512 877 HB3 ASP 114 HB3 ASP 114 12.339 -15.709 5.852 878 H GLY 115 H GLY 115 15.389 -18.030 4.973 879 HA2 GLY 115 HA2 GLY 115 15.990 -19.750 3.517 880 HA3 GLY 115 HA3 GLY 115 15.427 -18.770 2.159 881 H SER 116 H SER 116 16.649 -16.811 1.791 882 HA SER 116 HA SER 116 19.484 -17.326 2.104 883 HB2 SER 116 HB2 SER 116 19.761 -15.524 0.347 884 HB3 SER 116 HB3 SER 116 18.834 -16.917 -0.211 885 HG SER 116 HG SER 116 17.700 -14.614 0.889 886 H ARG 117 H ARG 117 20.173 -16.535 3.920 887 HA ARG 117 HA ARG 117 18.789 -14.271 5.122 888 HB2 ARG 117 HB2 ARG 117 20.045 -14.812 7.215 889 HB3 ARG 117 HB3 ARG 117 18.925 -16.054 6.674 890 HG2 ARG 117 HG2 ARG 117 21.824 -16.240 5.964 891 HG3 ARG 117 HG3 ARG 117 21.290 -16.688 7.585 892 HD2 ARG 117 HD2 ARG 117 19.873 -18.390 6.731 893 HD3 ARG 117 HD3 ARG 117 20.077 -17.875 5.067 894 HE ARG 117 HE ARG 117 22.539 -18.541 6.300 895 HH11 ARG 117 HH11 ARG 117 19.638 -20.071 4.906 896 HH12 ARG 117 HH12 ARG 117 20.464 -21.432 4.335 897 HH21 ARG 117 HH21 ARG 117 23.676 -20.416 5.463 898 HH22 ARG 117 HH22 ARG 117 22.809 -21.627 4.641 899 H ASP 118 H ASP 118 21.192 -14.507 3.151 900 HA ASP 118 HA ASP 118 23.113 -12.718 4.325 901 HB2 ASP 118 HB2 ASP 118 22.660 -13.407 1.398 902 HB3 ASP 118 HB3 ASP 118 24.039 -12.516 2.023 903 H ALA 119 H ALA 119 23.272 -10.490 4.001 904 HA ALA 119 HA ALA 119 20.708 -9.286 3.518 905 HB1 ALA 119 HB1 ALA 119 23.290 -7.923 4.275 906 HB2 ALA 119 HB2 ALA 119 22.126 -8.605 5.410 907 HB3 ALA 119 HB3 ALA 119 21.652 -7.265 4.384 908 H VAL 120 H VAL 120 20.066 -8.417 1.776 909 HA VAL 120 HA VAL 120 21.836 -8.182 -0.507 910 HB VAL 120 HB VAL 120 18.804 -8.118 -0.351 911 HG11 VAL 120 HG11 VAL 120 18.871 -8.471 -2.779 912 HG12 VAL 120 HG12 VAL 120 20.629 -8.349 -2.742 913 HG13 VAL 120 HG13 VAL 120 19.640 -6.953 -2.314 914 HG21 VAL 120 HG21 VAL 120 20.641 -10.378 -1.150 915 HG22 VAL 120 HG22 VAL 120 18.880 -10.400 -1.263 916 HG23 VAL 120 HG23 VAL 120 19.662 -10.300 0.315 917 H SER 121 H SER 121 22.368 -6.294 -1.235 918 HA SER 121 HA SER 121 21.572 -3.872 0.057 919 HB2 SER 121 HB2 SER 121 23.290 -3.022 -1.670 920 HB3 SER 121 HB3 SER 121 23.854 -4.086 -0.376 921 HG SER 121 HG SER 121 24.264 -4.478 -2.847 922 H ASN 122 H ASN 122 20.688 -2.042 -1.038 923 HA ASN 122 HA ASN 122 19.410 -0.842 -2.426 924 HB2 ASN 122 HB2 ASN 122 20.375 -2.776 -4.556 925 HB3 ASN 122 HB3 ASN 122 19.536 -1.251 -4.836 926 HD21 ASN 122 HD21 ASN 122 22.192 -2.160 -5.672 927 HD22 ASN 122 HD22 ASN 122 23.313 -1.003 -5.082 928 H ALA 123 H ALA 123 18.139 -2.729 -0.930 929 HA ALA 123 HA ALA 123 16.199 -3.934 -2.755 930 HB1 ALA 123 HB1 ALA 123 15.520 -5.350 -0.888 931 HB2 ALA 123 HB2 ALA 123 16.649 -4.499 0.171 932 HB3 ALA 123 HB3 ALA 123 17.258 -5.467 -1.169 933 H ARG 124 H ARG 124 13.922 -4.072 -1.623 934 HA ARG 124 HA ARG 124 13.205 -1.288 -1.115 935 HB2 ARG 124 HB2 ARG 124 10.941 -1.919 -1.888 936 HB3 ARG 124 HB3 ARG 124 12.171 -2.225 -3.100 937 HG2 ARG 124 HG2 ARG 124 12.150 -4.604 -2.517 938 HG3 ARG 124 HG3 ARG 124 10.908 -4.290 -1.307 939 HD2 ARG 124 HD2 ARG 124 9.400 -3.509 -3.061 940 HD3 ARG 124 HD3 ARG 124 10.654 -3.793 -4.265 941 HE ARG 124 HE ARG 124 10.019 -6.107 -2.700 942 HH11 ARG 124 HH11 ARG 124 9.263 -4.282 -5.671 943 HH12 ARG 124 HH12 ARG 124 8.403 -5.566 -6.407 944 HH21 ARG 124 HH21 ARG 124 8.770 -7.857 -3.766 945 HH22 ARG 124 HH22 ARG 124 8.071 -7.595 -5.302 946 HA PRO 125 HA PRO 125 12.066 -2.006 3.137 947 HB2 PRO 125 HB2 PRO 125 9.681 -0.355 2.453 948 HB3 PRO 125 HB3 PRO 125 10.814 -0.173 3.796 949 HG2 PRO 125 HG2 PRO 125 10.982 1.448 1.721 950 HG3 PRO 125 HG3 PRO 125 12.456 0.780 2.441 951 HD2 PRO 125 HD2 PRO 125 11.066 -0.000 -0.086 952 HD3 PRO 125 HD3 PRO 125 12.806 0.111 0.272 953 H VAL 126 H VAL 126 9.679 -2.636 0.638 954 HA VAL 126 HA VAL 126 7.703 -3.976 2.150 955 HB VAL 126 HB VAL 126 8.574 -4.487 -0.720 956 HG11 VAL 126 HG11 VAL 126 6.448 -5.630 -1.025 957 HG12 VAL 126 HG12 VAL 126 6.080 -5.418 0.690 958 HG13 VAL 126 HG13 VAL 126 7.423 -6.445 0.201 959 HG21 VAL 126 HG21 VAL 126 6.240 -2.968 0.407 960 HG22 VAL 126 HG22 VAL 126 6.593 -3.219 -1.304 961 HG23 VAL 126 HG23 VAL 126 7.696 -2.264 -0.307 962 H ASP 127 H ASP 127 10.667 -5.112 0.740 963 HA ASP 127 HA ASP 127 10.291 -7.838 1.398 964 HB2 ASP 127 HB2 ASP 127 12.712 -6.233 0.598 965 HB3 ASP 127 HB3 ASP 127 12.783 -7.948 0.975 966 H ALA 128 H ALA 128 11.569 -5.095 3.024 967 HA ALA 128 HA ALA 128 12.939 -6.462 5.094 968 HB1 ALA 128 HB1 ALA 128 11.811 -3.669 5.123 969 HB2 ALA 128 HB2 ALA 128 13.406 -4.113 4.527 970 HB3 ALA 128 HB3 ALA 128 13.017 -4.312 6.234 971 H LEU 129 H LEU 129 9.635 -5.254 4.767 972 HA LEU 129 HA LEU 129 8.994 -5.706 7.496 973 HB2 LEU 129 HB2 LEU 129 6.663 -5.316 6.893 974 HB3 LEU 129 HB3 LEU 129 7.711 -4.099 6.209 975 HG LEU 129 HG LEU 129 7.606 -5.656 4.121 976 HD11 LEU 129 HD11 LEU 129 6.369 -7.407 5.146 977 HD12 LEU 129 HD12 LEU 129 5.423 -6.713 3.818 978 HD13 LEU 129 HD13 LEU 129 5.028 -6.320 5.502 979 HD21 LEU 129 HD21 LEU 129 5.366 -3.796 4.921 980 HD22 LEU 129 HD22 LEU 129 5.705 -4.319 3.273 981 HD23 LEU 129 HD23 LEU 129 6.880 -3.333 4.147 982 H HIS 130 H HIS 130 8.732 -7.750 4.667 983 HA HIS 130 HA HIS 130 7.365 -9.890 5.920 984 HB2 HIS 130 HB2 HIS 130 9.195 -9.740 3.531 985 HB3 HIS 130 HB3 HIS 130 8.565 -11.274 4.097 986 HD1 HIS 130 HD1 HIS 130 7.650 -8.333 2.026 987 HD2 HIS 130 HD2 HIS 130 5.739 -11.516 3.902 988 HE1 HIS 130 HE1 HIS 130 5.392 -8.525 0.963 989 H ALA 131 H ALA 131 10.569 -8.806 5.879 990 HA ALA 131 HA ALA 131 11.728 -11.244 6.994 991 HB1 ALA 131 HB1 ALA 131 13.837 -10.039 6.923 992 HB2 ALA 131 HB2 ALA 131 12.984 -8.557 6.505 993 HB3 ALA 131 HB3 ALA 131 12.993 -9.917 5.383 994 H HIS 132 H HIS 132 9.922 -8.911 8.255 995 HA HIS 132 HA HIS 132 9.475 -8.021 10.251 996 HB2 HIS 132 HB2 HIS 132 9.733 -10.483 10.971 997 HB3 HIS 132 HB3 HIS 132 11.352 -10.053 11.505 998 HD1 HIS 132 HD1 HIS 132 7.705 -9.334 12.326 999 HD2 HIS 132 HD2 HIS 132 11.487 -8.848 13.984 1000 HE1 HIS 132 HE1 HIS 132 7.339 -8.507 14.655 1001 H GLN 133 H GLN 133 11.662 -7.150 8.656 1002 HA GLN 133 HA GLN 133 13.326 -5.848 10.604 1003 HB2 GLN 133 HB2 GLN 133 13.499 -5.980 7.584 1004 HB3 GLN 133 HB3 GLN 133 14.532 -4.915 8.539 1005 HG2 GLN 133 HG2 GLN 133 15.292 -6.944 9.811 1006 HG3 GLN 133 HG3 GLN 133 14.400 -7.920 8.656 1007 HE21 GLN 133 HE21 GLN 133 17.122 -5.866 9.139 1008 HE22 GLN 133 HE22 GLN 133 17.999 -6.292 7.735 1009 H ALA 134 H ALA 134 10.599 -5.502 10.339 1010 HA ALA 134 HA ALA 134 9.615 -3.258 9.081 1011 HB1 ALA 134 HB1 ALA 134 8.226 -4.970 10.136 1012 HB2 ALA 134 HB2 ALA 134 7.773 -3.340 10.641 1013 HB3 ALA 134 HB3 ALA 134 8.710 -4.372 11.724 1014 H ARG 135 H ARG 135 11.550 -3.374 12.052 1015 HA ARG 135 HA ARG 135 10.839 -0.794 13.038 1016 HB2 ARG 135 HB2 ARG 135 13.519 -2.183 13.349 1017 HB3 ARG 135 HB3 ARG 135 12.899 -0.889 14.343 1018 HG2 ARG 135 HG2 ARG 135 11.449 -3.504 14.185 1019 HG3 ARG 135 HG3 ARG 135 12.829 -3.309 15.250 1020 HD2 ARG 135 HD2 ARG 135 10.744 -2.988 16.451 1021 HD3 ARG 135 HD3 ARG 135 11.669 -1.498 16.410 1022 HE ARG 135 HE ARG 135 10.122 -0.604 14.894 1023 HH11 ARG 135 HH11 ARG 135 9.085 -3.836 15.956 1024 HH12 ARG 135 HH12 ARG 135 7.422 -3.456 15.917 1025 HH21 ARG 135 HH21 ARG 135 7.824 -0.113 14.852 1026 HH22 ARG 135 HH22 ARG 135 6.683 -1.323 15.278 1027 H GLU 136 H GLU 136 13.246 -1.967 10.749 1028 HA GLU 136 HA GLU 136 14.579 0.445 10.191 1029 HB2 GLU 136 HB2 GLU 136 14.097 -2.059 8.561 1030 HB3 GLU 136 HB3 GLU 136 15.010 -0.706 7.931 1031 HG2 GLU 136 HG2 GLU 136 16.437 -2.540 8.752 1032 HG3 GLU 136 HG3 GLU 136 16.716 -1.021 9.582 1033 H VAL 137 H VAL 137 11.744 -1.099 8.851 1034 HA VAL 137 HA VAL 137 11.236 0.760 6.782 1035 HB VAL 137 HB VAL 137 9.231 -1.013 8.221 1036 HG11 VAL 137 HG11 VAL 137 7.867 -0.801 6.187 1037 HG12 VAL 137 HG12 VAL 137 9.036 0.339 5.526 1038 HG13 VAL 137 HG13 VAL 137 8.117 0.758 6.973 1039 HG21 VAL 137 HG21 VAL 137 10.791 -1.512 5.686 1040 HG22 VAL 137 HG22 VAL 137 9.555 -2.569 6.356 1041 HG23 VAL 137 HG23 VAL 137 11.060 -2.307 7.238 1042 H VAL 138 H VAL 138 9.947 0.491 10.071 1043 HA VAL 138 HA VAL 138 8.208 2.680 9.958 1044 HB VAL 138 HB VAL 138 9.630 1.593 12.406 1045 HG11 VAL 138 HG11 VAL 138 7.193 3.381 12.219 1046 HG12 VAL 138 HG12 VAL 138 8.779 3.846 12.836 1047 HG13 VAL 138 HG13 VAL 138 7.808 2.655 13.704 1048 HG21 VAL 138 HG21 VAL 138 8.249 -0.081 11.294 1049 HG22 VAL 138 HG22 VAL 138 6.873 1.023 11.310 1050 HG23 VAL 138 HG23 VAL 138 7.520 0.399 12.828 1051 H ARG 139 H ARG 139 11.621 2.568 10.960 1052 HA ARG 139 HA ARG 139 11.645 5.281 11.699 1053 HB2 ARG 139 HB2 ARG 139 14.024 5.163 11.868 1054 HB3 ARG 139 HB3 ARG 139 13.356 3.627 12.399 1055 HG2 ARG 139 HG2 ARG 139 13.975 2.614 10.291 1056 HG3 ARG 139 HG3 ARG 139 14.634 4.159 9.738 1057 HD2 ARG 139 HD2 ARG 139 16.421 2.739 10.567 1058 HD3 ARG 139 HD3 ARG 139 16.211 4.139 11.610 1059 HE ARG 139 HE ARG 139 15.075 2.732 13.182 1060 HH11 ARG 139 HH11 ARG 139 17.015 1.061 10.706 1061 HH12 ARG 139 HH12 ARG 139 17.030 -0.404 11.586 1062 HH21 ARG 139 HH21 ARG 139 15.218 0.718 14.359 1063 HH22 ARG 139 HH22 ARG 139 16.066 -0.589 13.681 1064 H ARG 140 H ARG 140 12.260 3.740 8.609 1065 HA ARG 140 HA ARG 140 13.062 6.131 7.285 1066 HB2 ARG 140 HB2 ARG 140 11.883 3.583 6.150 1067 HB3 ARG 140 HB3 ARG 140 12.571 4.881 5.186 1068 HG2 ARG 140 HG2 ARG 140 14.085 3.238 7.212 1069 HG3 ARG 140 HG3 ARG 140 14.103 2.974 5.472 1070 HD2 ARG 140 HD2 ARG 140 15.062 5.460 6.909 1071 HD3 ARG 140 HD3 ARG 140 16.085 4.212 6.206 1072 HE ARG 140 HE ARG 140 14.493 6.197 4.763 1073 HH11 ARG 140 HH11 ARG 140 16.866 3.534 4.614 1074 HH12 ARG 140 HH12 ARG 140 17.274 3.823 2.988 1075 HH21 ARG 140 HH21 ARG 140 15.076 6.581 2.532 1076 HH22 ARG 140 HH22 ARG 140 16.215 5.542 1.787 1077 H ALA 141 H ALA 141 10.004 4.532 7.843 1078 HA ALA 141 HA ALA 141 8.323 6.133 6.277 1079 HB1 ALA 141 HB1 ALA 141 7.787 4.702 8.875 1080 HB2 ALA 141 HB2 ALA 141 7.555 4.042 7.252 1081 HB3 ALA 141 HB3 ALA 141 6.543 5.369 7.830 1082 H GLN 142 H GLN 142 9.366 6.410 9.644 1083 HA GLN 142 HA GLN 142 8.020 8.757 10.362 1084 HB2 GLN 142 HB2 GLN 142 10.681 7.712 11.310 1085 HB3 GLN 142 HB3 GLN 142 9.847 9.074 12.033 1086 HG2 GLN 142 HG2 GLN 142 8.013 7.645 12.681 1087 HG3 GLN 142 HG3 GLN 142 8.773 6.272 11.871 1088 HE21 GLN 142 HE21 GLN 142 8.061 6.683 14.694 1089 HE22 GLN 142 HE22 GLN 142 9.521 6.435 15.573 1090 H ALA 143 H ALA 143 11.182 8.321 8.882 1091 HA ALA 143 HA ALA 143 11.881 11.060 8.839 1092 HB1 ALA 143 HB1 ALA 143 13.628 10.389 7.274 1093 HB2 ALA 143 HB2 ALA 143 12.851 8.818 7.071 1094 HB3 ALA 143 HB3 ALA 143 13.530 9.272 8.635 1095 H MET 144 H MET 144 9.922 9.117 6.783 1096 HA MET 144 HA MET 144 9.928 10.965 4.570 1097 HB2 MET 144 HB2 MET 144 9.664 8.446 4.389 1098 HB3 MET 144 HB3 MET 144 8.076 8.625 5.106 1099 HG2 MET 144 HG2 MET 144 8.893 9.897 2.490 1100 HG3 MET 144 HG3 MET 144 8.131 8.317 2.646 1101 HE1 MET 144 HE1 MET 144 7.130 10.761 0.818 1102 HE2 MET 144 HE2 MET 144 5.387 10.683 1.078 1103 HE3 MET 144 HE3 MET 144 6.303 9.202 0.844 1104 H ALA 145 H ALA 145 7.829 10.120 7.257 1105 HA ALA 145 HA ALA 145 5.765 11.898 6.385 1106 HB1 ALA 145 HB1 ALA 145 5.983 10.464 9.014 1107 HB2 ALA 145 HB2 ALA 145 5.239 9.808 7.557 1108 HB3 ALA 145 HB3 ALA 145 4.536 11.220 8.349 1109 H TYR 146 H TYR 146 8.248 11.988 8.887 1110 HA TYR 146 HA TYR 146 7.360 14.695 9.531 1111 HB2 TYR 146 HB2 TYR 146 8.947 12.740 11.211 1112 HB3 TYR 146 HB3 TYR 146 8.539 14.384 11.684 1113 HD1 TYR 146 HD1 TYR 146 6.201 14.945 12.280 1114 HD2 TYR 146 HD2 TYR 146 7.342 10.959 11.329 1115 HE1 TYR 146 HE1 TYR 146 4.123 14.115 13.291 1116 HE2 TYR 146 HE2 TYR 146 5.263 10.124 12.337 1117 HH TYR 146 HH TYR 146 2.660 12.106 13.083 Start of MODEL 9 1 H MET 1 H MET 1 3.992 22.668 33.129 2 HA MET 1 HA MET 1 5.946 21.768 31.971 3 HB2 MET 1 HB2 MET 1 3.921 19.662 32.758 4 HB3 MET 1 HB3 MET 1 5.635 19.359 32.549 5 HG2 MET 1 HG2 MET 1 6.117 20.835 34.431 6 HG3 MET 1 HG3 MET 1 4.393 21.155 34.626 7 HE1 MET 1 HE1 MET 1 4.502 20.461 37.180 8 HE2 MET 1 HE2 MET 1 6.232 20.182 37.009 9 HE3 MET 1 HE3 MET 1 5.214 18.951 37.752 10 HA PRO 2 HA PRO 2 5.043 20.635 27.753 11 HB2 PRO 2 HB2 PRO 2 7.490 19.545 27.127 12 HB3 PRO 2 HB3 PRO 2 7.166 21.281 27.129 13 HG2 PRO 2 HG2 PRO 2 8.526 19.602 29.187 14 HG3 PRO 2 HG3 PRO 2 8.890 21.253 28.668 15 HD2 PRO 2 HD2 PRO 2 7.563 20.656 30.973 16 HD3 PRO 2 HD3 PRO 2 7.331 22.171 30.078 17 H GLY 3 H GLY 3 3.757 18.922 27.436 18 HA2 GLY 3 HA2 GLY 3 4.826 16.261 27.963 19 HA3 GLY 3 HA3 GLY 3 3.295 16.707 28.698 20 H ARG 4 H ARG 4 4.332 14.874 26.437 21 HA ARG 4 HA ARG 4 2.856 15.688 24.126 22 HB2 ARG 4 HB2 ARG 4 4.001 12.994 24.887 23 HB3 ARG 4 HB3 ARG 4 3.221 13.321 23.353 24 HG2 ARG 4 HG2 ARG 4 4.976 15.020 22.889 25 HG3 ARG 4 HG3 ARG 4 5.769 14.551 24.390 26 HD2 ARG 4 HD2 ARG 4 6.802 13.420 22.505 27 HD3 ARG 4 HD3 ARG 4 5.985 12.252 23.544 28 HE ARG 4 HE ARG 4 4.276 13.123 21.472 29 HH11 ARG 4 HH11 ARG 4 7.012 10.944 22.061 30 HH12 ARG 4 HH12 ARG 4 6.704 9.960 20.713 31 HH21 ARG 4 HH21 ARG 4 3.848 11.738 19.599 32 HH22 ARG 4 HH22 ARG 4 4.862 10.419 19.287 33 H ALA 5 H ALA 5 0.873 14.995 23.433 34 HA ALA 5 HA ALA 5 -0.928 14.033 25.456 35 HB1 ALA 5 HB1 ALA 5 -2.643 14.309 23.703 36 HB2 ALA 5 HB2 ALA 5 -1.380 14.646 22.523 37 HB3 ALA 5 HB3 ALA 5 -1.656 15.759 23.863 38 HA PRO 6 HA PRO 6 -0.436 9.641 24.607 39 HB2 PRO 6 HB2 PRO 6 -3.391 9.660 25.040 40 HB3 PRO 6 HB3 PRO 6 -2.165 8.602 25.747 41 HG2 PRO 6 HG2 PRO 6 -3.179 10.551 27.202 42 HG3 PRO 6 HG3 PRO 6 -1.436 10.229 27.245 43 HD2 PRO 6 HD2 PRO 6 -2.924 12.421 25.855 44 HD3 PRO 6 HD3 PRO 6 -1.360 12.464 26.700 45 H GLY 7 H GLY 7 -0.985 8.080 23.034 46 HA2 GLY 7 HA2 GLY 7 -1.519 9.192 20.485 47 HA3 GLY 7 HA3 GLY 7 -1.231 7.499 20.854 48 H SER 8 H SER 8 -3.640 10.010 20.812 49 HA SER 8 HA SER 8 -5.613 8.084 19.950 50 HB2 SER 8 HB2 SER 8 -6.077 10.080 22.192 51 HB3 SER 8 HB3 SER 8 -7.306 9.038 21.473 52 HG SER 8 HG SER 8 -5.232 7.546 22.201 53 H THR 9 H THR 9 -7.406 9.237 18.890 54 HA THR 9 HA THR 9 -7.146 11.985 18.274 55 HB THR 9 HB THR 9 -5.318 11.074 16.859 56 HG1 THR 9 HG1 THR 9 -6.130 12.715 15.830 57 HG21 THR 9 HG21 THR 9 -5.806 9.526 14.990 58 HG22 THR 9 HG22 THR 9 -7.457 9.355 15.592 59 HG23 THR 9 HG23 THR 9 -6.098 8.785 16.564 60 H LEU 10 H LEU 10 -8.598 11.752 15.833 61 HA LEU 10 HA LEU 10 -11.196 11.169 16.901 62 HB2 LEU 10 HB2 LEU 10 -10.396 11.839 14.074 63 HB3 LEU 10 HB3 LEU 10 -12.034 11.804 14.688 64 HG LEU 10 HG LEU 10 -9.868 13.765 15.439 65 HD11 LEU 10 HD11 LEU 10 -11.370 15.383 14.403 66 HD12 LEU 10 HD12 LEU 10 -12.474 14.055 14.022 67 HD13 LEU 10 HD13 LEU 10 -10.880 14.116 13.262 68 HD21 LEU 10 HD21 LEU 10 -11.593 14.886 16.783 69 HD22 LEU 10 HD22 LEU 10 -11.246 13.271 17.403 70 HD23 LEU 10 HD23 LEU 10 -12.705 13.560 16.455 71 H ALA 11 H ALA 11 -12.592 9.580 16.217 72 HA ALA 11 HA ALA 11 -11.147 7.183 15.362 73 HB1 ALA 11 HB1 ALA 11 -12.896 5.865 16.417 74 HB2 ALA 11 HB2 ALA 11 -13.823 7.326 16.748 75 HB3 ALA 11 HB3 ALA 11 -12.275 7.062 17.554 76 H ARG 12 H ARG 12 -12.581 9.383 13.807 77 HA ARG 12 HA ARG 12 -14.386 7.804 12.240 78 HB2 ARG 12 HB2 ARG 12 -15.072 10.053 12.648 79 HB3 ARG 12 HB3 ARG 12 -13.501 10.670 12.154 80 HG2 ARG 12 HG2 ARG 12 -15.082 11.113 10.430 81 HG3 ARG 12 HG3 ARG 12 -13.905 9.890 9.923 82 HD2 ARG 12 HD2 ARG 12 -16.133 9.215 9.162 83 HD3 ARG 12 HD3 ARG 12 -15.561 8.113 10.409 84 HE ARG 12 HE ARG 12 -17.215 10.332 11.259 85 HH11 ARG 12 HH11 ARG 12 -17.093 6.855 10.454 86 HH12 ARG 12 HH12 ARG 12 -18.568 6.512 11.219 87 HH21 ARG 12 HH21 ARG 12 -19.258 9.794 12.293 88 HH22 ARG 12 HH22 ARG 12 -19.808 8.177 12.260 89 H VAL 13 H VAL 13 -13.408 6.434 10.939 90 HA VAL 13 HA VAL 13 -11.227 7.441 9.333 91 HB VAL 13 HB VAL 13 -10.573 4.977 9.031 92 HG11 VAL 13 HG11 VAL 13 -10.388 6.130 11.818 93 HG12 VAL 13 HG12 VAL 13 -9.295 6.470 10.477 94 HG13 VAL 13 HG13 VAL 13 -9.367 4.847 11.165 95 HG21 VAL 13 HG21 VAL 13 -12.404 4.635 11.410 96 HG22 VAL 13 HG22 VAL 13 -11.290 3.410 10.812 97 HG23 VAL 13 HG23 VAL 13 -12.644 3.933 9.811 98 H GLY 14 H GLY 14 -11.769 7.782 7.353 99 HA2 GLY 14 HA2 GLY 14 -14.198 6.522 6.371 100 HA3 GLY 14 HA3 GLY 14 -13.564 8.076 5.840 101 H SER 15 H SER 15 -13.829 7.150 3.822 102 HA SER 15 HA SER 15 -12.571 4.804 2.868 103 HB2 SER 15 HB2 SER 15 -13.474 7.179 1.262 104 HB3 SER 15 HB3 SER 15 -13.378 5.493 0.750 105 HG SER 15 HG SER 15 -15.222 6.764 2.439 106 H ILE 16 H ILE 16 -10.350 4.633 2.999 107 HA ILE 16 HA ILE 16 -8.681 6.750 2.111 108 HB ILE 16 HB ILE 16 -8.155 3.827 2.751 109 HG12 ILE 16 HG12 ILE 16 -6.466 4.787 4.340 110 HG13 ILE 16 HG13 ILE 16 -6.966 6.390 3.847 111 HG21 ILE 16 HG21 ILE 16 -5.779 4.050 2.183 112 HG22 ILE 16 HG22 ILE 16 -6.096 5.640 1.493 113 HG23 ILE 16 HG23 ILE 16 -6.813 4.204 0.763 114 HD11 ILE 16 HD11 ILE 16 -7.946 5.794 5.964 115 HD12 ILE 16 HD12 ILE 16 -8.659 4.345 5.253 116 HD13 ILE 16 HD13 ILE 16 -9.203 5.940 4.734 117 HA PRO 17 HA PRO 17 -9.645 6.097 -2.142 118 HB2 PRO 17 HB2 PRO 17 -7.966 7.908 -3.198 119 HB3 PRO 17 HB3 PRO 17 -9.398 8.381 -2.275 120 HG2 PRO 17 HG2 PRO 17 -6.549 8.213 -1.376 121 HG3 PRO 17 HG3 PRO 17 -7.731 9.505 -1.093 122 HD2 PRO 17 HD2 PRO 17 -7.173 7.605 0.756 123 HD3 PRO 17 HD3 PRO 17 -8.773 8.358 0.606 124 H ALA 18 H ALA 18 -8.612 5.488 -4.139 125 HA ALA 18 HA ALA 18 -5.950 4.296 -3.802 126 HB1 ALA 18 HB1 ALA 18 -7.661 2.579 -4.219 127 HB2 ALA 18 HB2 ALA 18 -6.598 2.755 -5.611 128 HB3 ALA 18 HB3 ALA 18 -8.213 3.467 -5.644 129 H GLY 19 H GLY 19 -4.457 5.375 -4.986 130 HA2 GLY 19 HA2 GLY 19 -5.507 7.111 -7.076 131 HA3 GLY 19 HA3 GLY 19 -4.101 7.451 -6.079 132 H ASP 20 H ASP 20 -2.172 6.871 -6.795 133 HA ASP 20 HA ASP 20 -2.171 5.839 -9.519 134 HB2 ASP 20 HB2 ASP 20 -0.089 7.425 -8.013 135 HB3 ASP 20 HB3 ASP 20 0.110 6.833 -9.657 136 H ASP 21 H ASP 21 -1.556 3.915 -9.913 137 HA ASP 21 HA ASP 21 -0.500 2.073 -8.080 138 HB2 ASP 21 HB2 ASP 21 -1.640 1.175 -9.900 139 HB3 ASP 21 HB3 ASP 21 -0.706 2.104 -11.074 140 H VAL 22 H VAL 22 1.454 1.587 -7.426 141 HA VAL 22 HA VAL 22 3.772 2.864 -8.727 142 HB VAL 22 HB VAL 22 3.518 1.897 -5.848 143 HG11 VAL 22 HG11 VAL 22 5.670 3.586 -7.119 144 HG12 VAL 22 HG12 VAL 22 5.800 1.880 -6.698 145 HG13 VAL 22 HG13 VAL 22 5.595 3.081 -5.421 146 HG21 VAL 22 HG21 VAL 22 2.058 3.805 -6.232 147 HG22 VAL 22 HG22 VAL 22 3.403 4.708 -6.927 148 HG23 VAL 22 HG23 VAL 22 3.425 4.270 -5.218 149 H LEU 23 H LEU 23 2.188 0.039 -8.505 150 HA LEU 23 HA LEU 23 4.269 -1.819 -7.904 151 HB2 LEU 23 HB2 LEU 23 1.462 -2.016 -8.800 152 HB3 LEU 23 HB3 LEU 23 2.513 -3.395 -9.013 153 HG LEU 23 HG LEU 23 2.016 -2.102 -6.324 154 HD11 LEU 23 HD11 LEU 23 0.498 -4.016 -5.996 155 HD12 LEU 23 HD12 LEU 23 0.792 -4.508 -7.663 156 HD13 LEU 23 HD13 LEU 23 -0.056 -2.998 -7.329 157 HD21 LEU 23 HD21 LEU 23 2.922 -4.202 -5.522 158 HD22 LEU 23 HD22 LEU 23 4.088 -3.405 -6.569 159 HD23 LEU 23 HD23 LEU 23 3.146 -4.765 -7.176 160 H ASP 24 H ASP 24 4.840 -3.517 -9.271 161 HA ASP 24 HA ASP 24 5.334 -2.770 -12.027 162 HB2 ASP 24 HB2 ASP 24 7.195 -3.677 -10.672 163 HB3 ASP 24 HB3 ASP 24 6.245 -5.105 -10.315 164 HA PRO 25 HA PRO 25 1.589 -4.916 -13.226 165 HB2 PRO 25 HB2 PRO 25 3.177 -5.767 -15.595 166 HB3 PRO 25 HB3 PRO 25 1.603 -4.967 -15.525 167 HG2 PRO 25 HG2 PRO 25 3.762 -3.576 -16.177 168 HG3 PRO 25 HG3 PRO 25 2.545 -2.878 -15.096 169 HD2 PRO 25 HD2 PRO 25 5.220 -4.038 -14.441 170 HD3 PRO 25 HD3 PRO 25 4.405 -2.606 -13.778 171 H ASP 26 H ASP 26 4.627 -6.654 -13.056 172 HA ASP 26 HA ASP 26 3.318 -9.207 -13.484 173 HB2 ASP 26 HB2 ASP 26 5.532 -8.834 -14.427 174 HB3 ASP 26 HB3 ASP 26 6.169 -8.563 -12.808 175 H GLU 27 H GLU 27 4.183 -7.217 -10.807 176 HA GLU 27 HA GLU 27 4.623 -9.296 -8.947 177 HB2 GLU 27 HB2 GLU 27 3.916 -6.401 -8.540 178 HB3 GLU 27 HB3 GLU 27 4.282 -7.509 -7.219 179 HG2 GLU 27 HG2 GLU 27 6.102 -6.803 -9.488 180 HG3 GLU 27 HG3 GLU 27 6.228 -6.190 -7.831 181 HA PRO 28 HA PRO 28 0.699 -10.959 -8.225 182 HB2 PRO 28 HB2 PRO 28 0.907 -11.468 -5.515 183 HB3 PRO 28 HB3 PRO 28 1.542 -12.503 -6.791 184 HG2 PRO 28 HG2 PRO 28 2.960 -10.442 -5.152 185 HG3 PRO 28 HG3 PRO 28 3.516 -12.050 -5.646 186 HD2 PRO 28 HD2 PRO 28 4.368 -9.861 -6.889 187 HD3 PRO 28 HD3 PRO 28 4.014 -11.347 -7.802 188 H THR 29 H THR 29 -1.226 -10.019 -8.013 189 HA THR 29 HA THR 29 -1.506 -7.936 -6.004 190 HB THR 29 HB THR 29 -3.182 -6.887 -7.568 191 HG1 THR 29 HG1 THR 29 -1.888 -8.157 -9.706 192 HG21 THR 29 HG21 THR 29 -1.474 -5.754 -8.941 193 HG22 THR 29 HG22 THR 29 -0.306 -6.990 -8.478 194 HG23 THR 29 HG23 THR 29 -0.976 -5.906 -7.258 195 H TYR 30 H TYR 30 -3.752 -7.479 -5.580 196 HA TYR 30 HA TYR 30 -5.546 -9.740 -5.674 197 HB2 TYR 30 HB2 TYR 30 -4.884 -7.964 -3.335 198 HB3 TYR 30 HB3 TYR 30 -6.402 -8.840 -3.453 199 HD1 TYR 30 HD1 TYR 30 -5.750 -11.444 -4.346 200 HD2 TYR 30 HD2 TYR 30 -3.530 -8.904 -1.771 201 HE1 TYR 30 HE1 TYR 30 -4.739 -13.403 -3.318 202 HE2 TYR 30 HE2 TYR 30 -2.497 -10.861 -0.727 203 HH TYR 30 HH TYR 30 -2.957 -13.208 -0.415 204 H ASP 31 H ASP 31 -7.722 -8.999 -5.420 205 HA ASP 31 HA ASP 31 -8.241 -6.221 -6.145 206 HB2 ASP 31 HB2 ASP 31 -8.290 -7.777 -8.179 207 HB3 ASP 31 HB3 ASP 31 -9.535 -8.702 -7.363 208 H LEU 32 H LEU 32 -10.618 -5.900 -5.587 209 HA LEU 32 HA LEU 32 -10.907 -6.514 -2.874 210 HB2 LEU 32 HB2 LEU 32 -13.128 -5.587 -4.708 211 HB3 LEU 32 HB3 LEU 32 -13.125 -5.493 -2.958 212 HG LEU 32 HG LEU 32 -11.351 -3.946 -4.844 213 HD11 LEU 32 HD11 LEU 32 -13.619 -3.130 -4.752 214 HD12 LEU 32 HD12 LEU 32 -12.515 -2.001 -3.969 215 HD13 LEU 32 HD13 LEU 32 -13.544 -3.050 -2.993 216 HD21 LEU 32 HD21 LEU 32 -10.093 -4.511 -2.837 217 HD22 LEU 32 HD22 LEU 32 -11.414 -3.918 -1.827 218 HD23 LEU 32 HD23 LEU 32 -10.510 -2.799 -2.846 219 HA PRO 33 HA PRO 33 -14.253 -9.952 -4.056 220 HB2 PRO 33 HB2 PRO 33 -13.583 -11.104 -6.515 221 HB3 PRO 33 HB3 PRO 33 -14.948 -10.018 -6.242 222 HG2 PRO 33 HG2 PRO 33 -12.227 -9.417 -7.309 223 HG3 PRO 33 HG3 PRO 33 -13.801 -8.792 -7.835 224 HD2 PRO 33 HD2 PRO 33 -12.187 -7.302 -6.351 225 HD3 PRO 33 HD3 PRO 33 -13.939 -7.308 -6.048 226 H ARG 34 H ARG 34 -10.923 -9.997 -5.290 227 HA ARG 34 HA ARG 34 -10.458 -12.732 -4.742 228 HB2 ARG 34 HB2 ARG 34 -9.193 -11.161 -6.347 229 HB3 ARG 34 HB3 ARG 34 -8.313 -10.646 -4.920 230 HG2 ARG 34 HG2 ARG 34 -7.052 -12.333 -6.103 231 HG3 ARG 34 HG3 ARG 34 -7.587 -12.963 -4.539 232 HD2 ARG 34 HD2 ARG 34 -9.375 -14.175 -5.554 233 HD3 ARG 34 HD3 ARG 34 -9.086 -13.388 -7.103 234 HE ARG 34 HE ARG 34 -6.873 -14.911 -6.068 235 HH11 ARG 34 HH11 ARG 34 -9.806 -15.028 -8.100 236 HH12 ARG 34 HH12 ARG 34 -9.370 -16.475 -8.863 237 HH21 ARG 34 HH21 ARG 34 -6.274 -16.931 -7.221 238 HH22 ARG 34 HH22 ARG 34 -7.361 -17.521 -8.398 239 H VAL 35 H VAL 35 -9.855 -9.732 -2.963 240 HA VAL 35 HA VAL 35 -8.441 -10.990 -0.850 241 HB VAL 35 HB VAL 35 -9.982 -8.366 -0.737 242 HG11 VAL 35 HG11 VAL 35 -7.811 -9.402 1.087 243 HG12 VAL 35 HG12 VAL 35 -9.517 -9.228 1.501 244 HG13 VAL 35 HG13 VAL 35 -8.541 -7.799 1.171 245 HG21 VAL 35 HG21 VAL 35 -7.075 -8.890 -1.318 246 HG22 VAL 35 HG22 VAL 35 -7.794 -7.304 -1.054 247 HG23 VAL 35 HG23 VAL 35 -8.287 -8.273 -2.444 248 H ALA 36 H ALA 36 -11.790 -10.251 -1.415 249 HA ALA 36 HA ALA 36 -12.899 -11.012 1.012 250 HB1 ALA 36 HB1 ALA 36 -14.945 -11.430 -0.262 251 HB2 ALA 36 HB2 ALA 36 -14.024 -11.411 -1.767 252 HB3 ALA 36 HB3 ALA 36 -14.166 -9.940 -0.801 253 H GLU 37 H GLU 37 -11.985 -12.896 -1.786 254 HA GLU 37 HA GLU 37 -12.856 -15.474 -0.999 255 HB2 GLU 37 HB2 GLU 37 -11.989 -14.557 -3.273 256 HB3 GLU 37 HB3 GLU 37 -10.418 -14.842 -2.606 257 HG2 GLU 37 HG2 GLU 37 -10.918 -16.736 -3.932 258 HG3 GLU 37 HG3 GLU 37 -10.980 -17.232 -2.241 259 H LEU 38 H LEU 38 -9.781 -13.770 -0.745 260 HA LEU 38 HA LEU 38 -8.175 -15.789 0.319 261 HB2 LEU 38 HB2 LEU 38 -7.289 -13.808 -0.724 262 HB3 LEU 38 HB3 LEU 38 -7.980 -12.801 0.527 263 HG LEU 38 HG LEU 38 -6.475 -13.964 2.162 264 HD11 LEU 38 HD11 LEU 38 -5.975 -15.954 0.899 265 HD12 LEU 38 HD12 LEU 38 -4.493 -15.084 1.293 266 HD13 LEU 38 HD13 LEU 38 -5.161 -14.994 -0.337 267 HD21 LEU 38 HD21 LEU 38 -6.014 -11.729 1.341 268 HD22 LEU 38 HD22 LEU 38 -5.202 -12.398 -0.072 269 HD23 LEU 38 HD23 LEU 38 -4.516 -12.636 1.537 270 H LEU 39 H LEU 39 -9.844 -13.126 1.968 271 HA LEU 39 HA LEU 39 -8.943 -14.172 4.516 272 HB2 LEU 39 HB2 LEU 39 -10.549 -11.713 3.896 273 HB3 LEU 39 HB3 LEU 39 -9.991 -12.168 5.494 274 HG LEU 39 HG LEU 39 -8.251 -11.419 3.139 275 HD11 LEU 39 HD11 LEU 39 -8.849 -9.966 5.707 276 HD12 LEU 39 HD12 LEU 39 -9.414 -9.524 4.097 277 HD13 LEU 39 HD13 LEU 39 -7.692 -9.456 4.477 278 HD21 LEU 39 HD21 LEU 39 -6.390 -11.500 4.756 279 HD22 LEU 39 HD22 LEU 39 -7.130 -13.083 4.523 280 HD23 LEU 39 HD23 LEU 39 -7.490 -12.148 5.973 281 H GLY 40 H GLY 40 -11.624 -14.587 2.581 282 HA2 GLY 40 HA2 GLY 40 -13.493 -15.866 2.964 283 HA3 GLY 40 HA3 GLY 40 -12.914 -16.163 4.602 284 H VAL 41 H VAL 41 -13.321 -13.043 3.222 285 HA VAL 41 HA VAL 41 -15.614 -12.503 5.003 286 HB VAL 41 HB VAL 41 -14.783 -10.231 5.358 287 HG11 VAL 41 HG11 VAL 41 -12.644 -12.258 5.914 288 HG12 VAL 41 HG12 VAL 41 -14.021 -11.853 6.945 289 HG13 VAL 41 HG13 VAL 41 -12.754 -10.661 6.646 290 HG21 VAL 41 HG21 VAL 41 -13.685 -9.818 3.230 291 HG22 VAL 41 HG22 VAL 41 -12.440 -11.007 3.614 292 HG23 VAL 41 HG23 VAL 41 -12.554 -9.514 4.548 293 HA PRO 42 HA PRO 42 -17.457 -10.916 1.260 294 HB2 PRO 42 HB2 PRO 42 -19.046 -8.913 2.167 295 HB3 PRO 42 HB3 PRO 42 -19.432 -10.620 2.434 296 HG2 PRO 42 HG2 PRO 42 -18.166 -8.644 4.277 297 HG3 PRO 42 HG3 PRO 42 -19.420 -9.850 4.625 298 HD2 PRO 42 HD2 PRO 42 -16.806 -10.227 5.246 299 HD3 PRO 42 HD3 PRO 42 -17.892 -11.562 4.816 300 H VAL 43 H VAL 43 -17.595 -9.012 -0.109 301 HA VAL 43 HA VAL 43 -15.185 -7.578 -0.334 302 HB VAL 43 HB VAL 43 -17.862 -6.860 -1.577 303 HG11 VAL 43 HG11 VAL 43 -16.542 -5.820 -3.357 304 HG12 VAL 43 HG12 VAL 43 -15.063 -6.220 -2.481 305 HG13 VAL 43 HG13 VAL 43 -16.219 -5.087 -1.783 306 HG21 VAL 43 HG21 VAL 43 -17.177 -8.208 -3.489 307 HG22 VAL 43 HG22 VAL 43 -17.303 -9.170 -2.014 308 HG23 VAL 43 HG23 VAL 43 -15.712 -8.694 -2.620 309 H SER 44 H SER 44 -18.257 -6.839 1.081 310 HA SER 44 HA SER 44 -18.125 -4.151 1.564 311 HB2 SER 44 HB2 SER 44 -19.188 -6.303 3.362 312 HB3 SER 44 HB3 SER 44 -19.760 -4.627 3.264 313 HG SER 44 HG SER 44 -20.672 -5.042 1.352 314 H LYS 45 H LYS 45 -16.809 -6.864 3.536 315 HA LYS 45 HA LYS 45 -15.807 -5.097 5.526 316 HB2 LYS 45 HB2 LYS 45 -15.202 -8.020 5.084 317 HB3 LYS 45 HB3 LYS 45 -14.491 -7.073 6.383 318 HG2 LYS 45 HG2 LYS 45 -16.814 -6.557 7.163 319 HG3 LYS 45 HG3 LYS 45 -17.410 -7.708 5.977 320 HD2 LYS 45 HD2 LYS 45 -17.275 -8.814 8.103 321 HD3 LYS 45 HD3 LYS 45 -15.992 -9.459 7.082 322 HE2 LYS 45 HE2 LYS 45 -14.355 -8.045 8.202 323 HE3 LYS 45 HE3 LYS 45 -15.628 -7.298 9.165 324 HZ1 LYS 45 HZ1 LYS 45 -14.402 -8.981 10.375 325 HZ2 LYS 45 HZ2 LYS 45 -14.832 -10.167 9.277 326 HZ3 LYS 45 HZ3 LYS 45 -16.014 -9.437 10.241 327 H VAL 46 H VAL 46 -14.504 -6.426 2.623 328 HA VAL 46 HA VAL 46 -11.790 -5.599 3.047 329 HB VAL 46 HB VAL 46 -13.254 -5.738 0.392 330 HG11 VAL 46 HG11 VAL 46 -11.033 -6.090 -0.563 331 HG12 VAL 46 HG12 VAL 46 -10.322 -5.957 1.051 332 HG13 VAL 46 HG13 VAL 46 -11.123 -4.563 0.325 333 HG21 VAL 46 HG21 VAL 46 -11.742 -7.925 1.823 334 HG22 VAL 46 HG22 VAL 46 -12.374 -8.029 0.179 335 HG23 VAL 46 HG23 VAL 46 -13.480 -7.873 1.547 336 H ALA 47 H ALA 47 -14.534 -3.945 1.633 337 HA ALA 47 HA ALA 47 -13.220 -1.532 1.118 338 HB1 ALA 47 HB1 ALA 47 -15.448 -0.518 1.098 339 HB2 ALA 47 HB2 ALA 47 -16.120 -1.954 1.864 340 HB3 ALA 47 HB3 ALA 47 -15.453 -2.054 0.232 341 H GLN 48 H GLN 48 -14.712 -2.811 4.006 342 HA GLN 48 HA GLN 48 -14.562 -0.463 5.569 343 HB2 GLN 48 HB2 GLN 48 -14.535 -3.324 6.500 344 HB3 GLN 48 HB3 GLN 48 -14.705 -1.935 7.557 345 HG2 GLN 48 HG2 GLN 48 -16.781 -1.342 6.327 346 HG3 GLN 48 HG3 GLN 48 -16.614 -2.852 5.433 347 HE21 GLN 48 HE21 GLN 48 -15.513 -4.204 7.877 348 HE22 GLN 48 HE22 GLN 48 -16.908 -4.492 8.852 349 H GLN 49 H GLN 49 -12.272 -3.121 5.145 350 HA GLN 49 HA GLN 49 -10.356 -2.299 7.052 351 HB2 GLN 49 HB2 GLN 49 -9.843 -3.668 4.410 352 HB3 GLN 49 HB3 GLN 49 -8.717 -3.586 5.756 353 HG2 GLN 49 HG2 GLN 49 -10.404 -4.773 7.111 354 HG3 GLN 49 HG3 GLN 49 -11.343 -5.010 5.648 355 HE21 GLN 49 HE21 GLN 49 -10.609 -6.409 4.071 356 HE22 GLN 49 HE22 GLN 49 -9.305 -7.513 4.344 357 H LEU 50 H LEU 50 -10.767 -1.580 3.732 358 HA LEU 50 HA LEU 50 -8.579 0.157 3.323 359 HB2 LEU 50 HB2 LEU 50 -11.269 -0.077 2.033 360 HB3 LEU 50 HB3 LEU 50 -10.081 1.088 1.440 361 HG LEU 50 HG LEU 50 -9.834 -1.932 1.477 362 HD11 LEU 50 HD11 LEU 50 -10.002 -1.733 -0.945 363 HD12 LEU 50 HD12 LEU 50 -10.255 0.007 -0.793 364 HD13 LEU 50 HD13 LEU 50 -11.452 -1.121 -0.152 365 HD21 LEU 50 HD21 LEU 50 -7.826 -1.567 0.123 366 HD22 LEU 50 HD22 LEU 50 -7.652 -0.858 1.726 367 HD23 LEU 50 HD23 LEU 50 -7.996 0.173 0.338 368 H ARG 51 H ARG 51 -11.876 0.744 4.364 369 HA ARG 51 HA ARG 51 -11.586 3.550 4.698 370 HB2 ARG 51 HB2 ARG 51 -13.633 1.626 5.775 371 HB3 ARG 51 HB3 ARG 51 -13.733 3.373 5.978 372 HG2 ARG 51 HG2 ARG 51 -13.923 3.696 3.628 373 HG3 ARG 51 HG3 ARG 51 -13.584 1.991 3.317 374 HD2 ARG 51 HD2 ARG 51 -15.657 1.420 4.485 375 HD3 ARG 51 HD3 ARG 51 -15.978 3.142 4.731 376 HE ARG 51 HE ARG 51 -15.629 2.996 2.102 377 HH11 ARG 51 HH11 ARG 51 -17.655 1.049 4.266 378 HH12 ARG 51 HH12 ARG 51 -18.863 0.736 3.109 379 HH21 ARG 51 HH21 ARG 51 -17.292 2.622 0.538 380 HH22 ARG 51 HH22 ARG 51 -18.662 1.675 0.919 381 H GLU 52 H GLU 52 -10.701 0.882 6.687 382 HA GLU 52 HA GLU 52 -10.663 2.394 9.149 383 HB2 GLU 52 HB2 GLU 52 -9.508 -0.279 8.396 384 HB3 GLU 52 HB3 GLU 52 -9.333 0.436 9.985 385 HG2 GLU 52 HG2 GLU 52 -11.749 0.358 10.278 386 HG3 GLU 52 HG3 GLU 52 -11.913 -0.346 8.664 387 H GLY 53 H GLY 53 -8.727 2.210 6.430 388 HA2 GLY 53 HA2 GLY 53 -6.638 3.045 5.964 389 HA3 GLY 53 HA3 GLY 53 -6.580 3.670 7.612 390 H HIS 54 H HIS 54 -7.301 0.361 7.100 391 HA HIS 54 HA HIS 54 -4.660 -0.323 8.158 392 HB2 HIS 54 HB2 HIS 54 -7.313 -1.739 8.557 393 HB3 HIS 54 HB3 HIS 54 -5.768 -2.427 9.038 394 HD1 HIS 54 HD1 HIS 54 -8.433 -1.066 10.794 395 HD2 HIS 54 HD2 HIS 54 -4.410 0.025 10.562 396 HE1 HIS 54 HE1 HIS 54 -7.933 0.246 12.867 397 H LEU 55 H LEU 55 -6.114 -0.172 5.373 398 HA LEU 55 HA LEU 55 -4.398 -2.143 4.198 399 HB2 LEU 55 HB2 LEU 55 -6.563 -3.344 4.657 400 HB3 LEU 55 HB3 LEU 55 -7.395 -2.144 3.698 401 HG LEU 55 HG LEU 55 -6.178 -2.914 1.692 402 HD11 LEU 55 HD11 LEU 55 -5.046 -5.010 3.542 403 HD12 LEU 55 HD12 LEU 55 -4.136 -3.724 2.741 404 HD13 LEU 55 HD13 LEU 55 -4.891 -4.997 1.786 405 HD21 LEU 55 HD21 LEU 55 -7.604 -5.079 3.236 406 HD22 LEU 55 HD22 LEU 55 -7.317 -5.085 1.496 407 HD23 LEU 55 HD23 LEU 55 -8.352 -3.851 2.214 408 H VAL 56 H VAL 56 -4.074 -1.553 1.905 409 HA VAL 56 HA VAL 56 -5.203 1.016 1.112 410 HB VAL 56 HB VAL 56 -2.230 0.366 1.297 411 HG11 VAL 56 HG11 VAL 56 -1.764 2.514 0.265 412 HG12 VAL 56 HG12 VAL 56 -3.491 2.792 0.048 413 HG13 VAL 56 HG13 VAL 56 -2.696 1.488 -0.831 414 HG21 VAL 56 HG21 VAL 56 -3.175 1.202 3.363 415 HG22 VAL 56 HG22 VAL 56 -3.861 2.585 2.510 416 HG23 VAL 56 HG23 VAL 56 -2.112 2.413 2.638 417 H ALA 57 H ALA 57 -5.145 1.336 -1.168 418 HA ALA 57 HA ALA 57 -4.398 -0.923 -2.845 419 HB1 ALA 57 HB1 ALA 57 -7.138 0.341 -2.820 420 HB2 ALA 57 HB2 ALA 57 -6.765 -1.241 -2.166 421 HB3 ALA 57 HB3 ALA 57 -6.587 -0.943 -3.900 422 H VAL 58 H VAL 58 -4.443 -0.241 -5.161 423 HA VAL 58 HA VAL 58 -4.413 2.657 -5.531 424 HB VAL 58 HB VAL 58 -2.510 2.347 -7.197 425 HG11 VAL 58 HG11 VAL 58 -0.776 2.461 -5.460 426 HG12 VAL 58 HG12 VAL 58 -1.944 1.845 -4.286 427 HG13 VAL 58 HG13 VAL 58 -2.203 3.416 -5.041 428 HG21 VAL 58 HG21 VAL 58 -2.205 -0.268 -5.709 429 HG22 VAL 58 HG22 VAL 58 -1.013 0.412 -6.818 430 HG23 VAL 58 HG23 VAL 58 -2.596 -0.081 -7.417 431 H ARG 59 H ARG 59 -4.608 3.295 -7.859 432 HA ARG 59 HA ARG 59 -6.342 1.346 -9.172 433 HB2 ARG 59 HB2 ARG 59 -7.637 3.199 -8.287 434 HB3 ARG 59 HB3 ARG 59 -6.554 4.345 -9.056 435 HG2 ARG 59 HG2 ARG 59 -7.294 3.677 -11.240 436 HG3 ARG 59 HG3 ARG 59 -8.273 2.383 -10.555 437 HD2 ARG 59 HD2 ARG 59 -8.700 5.300 -9.918 438 HD3 ARG 59 HD3 ARG 59 -9.493 4.468 -11.247 439 HE ARG 59 HE ARG 59 -10.383 2.919 -9.472 440 HH11 ARG 59 HH11 ARG 59 -9.602 6.271 -8.661 441 HH12 ARG 59 HH12 ARG 59 -10.882 6.446 -7.557 442 HH21 ARG 59 HH21 ARG 59 -12.092 3.155 -7.943 443 HH22 ARG 59 HH22 ARG 59 -12.331 4.628 -7.115 444 H ARG 60 H ARG 60 -5.577 0.591 -10.958 445 HA ARG 60 HA ARG 60 -4.080 2.375 -12.714 446 HB2 ARG 60 HB2 ARG 60 -2.607 0.552 -13.420 447 HB3 ARG 60 HB3 ARG 60 -2.434 0.880 -11.711 448 HG2 ARG 60 HG2 ARG 60 -3.840 -1.099 -11.233 449 HG3 ARG 60 HG3 ARG 60 -3.896 -1.429 -12.969 450 HD2 ARG 60 HD2 ARG 60 -1.429 -1.516 -12.993 451 HD3 ARG 60 HD3 ARG 60 -1.431 -1.298 -11.247 452 HE ARG 60 HE ARG 60 -2.893 -3.541 -12.360 453 HH11 ARG 60 HH11 ARG 60 -0.199 -2.376 -10.379 454 HH12 ARG 60 HH12 ARG 60 0.430 -3.920 -10.055 455 HH21 ARG 60 HH21 ARG 60 -2.088 -5.662 -11.931 456 HH22 ARG 60 HH22 ARG 60 -0.711 -5.906 -10.977 457 H ALA 61 H ALA 61 -4.781 2.459 -14.723 458 HA ALA 61 HA ALA 61 -6.065 2.180 -16.553 459 HB1 ALA 61 HB1 ALA 61 -4.931 -0.015 -16.745 460 HB2 ALA 61 HB2 ALA 61 -6.598 -0.094 -17.321 461 HB3 ALA 61 HB3 ALA 61 -6.181 -0.733 -15.731 462 H GLY 62 H GLY 62 -7.175 2.670 -13.861 463 HA2 GLY 62 HA2 GLY 62 -9.355 3.419 -13.376 464 HA3 GLY 62 HA3 GLY 62 -9.976 2.340 -14.616 465 H GLY 63 H GLY 63 -8.060 0.279 -13.194 466 HA2 GLY 63 HA2 GLY 63 -10.211 -0.699 -11.457 467 HA3 GLY 63 HA3 GLY 63 -8.903 -1.658 -12.135 468 H VAL 64 H VAL 64 -9.942 -1.210 -9.371 469 HA VAL 64 HA VAL 64 -7.578 -0.100 -8.056 470 HB VAL 64 HB VAL 64 -10.288 -0.929 -6.954 471 HG11 VAL 64 HG11 VAL 64 -8.540 -1.359 -5.287 472 HG12 VAL 64 HG12 VAL 64 -9.546 0.014 -4.815 473 HG13 VAL 64 HG13 VAL 64 -7.942 0.286 -5.493 474 HG21 VAL 64 HG21 VAL 64 -10.599 1.427 -6.541 475 HG22 VAL 64 HG22 VAL 64 -10.237 1.142 -8.244 476 HG23 VAL 64 HG23 VAL 64 -8.985 1.770 -7.170 477 H VAL 65 H VAL 65 -6.064 -1.380 -7.394 478 HA VAL 65 HA VAL 65 -6.687 -4.141 -6.726 479 HB VAL 65 HB VAL 65 -4.414 -4.774 -7.751 480 HG11 VAL 65 HG11 VAL 65 -5.396 -5.097 -9.993 481 HG12 VAL 65 HG12 VAL 65 -6.682 -3.960 -9.580 482 HG13 VAL 65 HG13 VAL 65 -6.541 -5.489 -8.710 483 HG21 VAL 65 HG21 VAL 65 -3.578 -2.491 -8.112 484 HG22 VAL 65 HG22 VAL 65 -4.907 -2.190 -9.232 485 HG23 VAL 65 HG23 VAL 65 -3.665 -3.375 -9.640 486 H ILE 66 H ILE 66 -5.250 -5.125 -5.347 487 HA ILE 66 HA ILE 66 -3.795 -3.258 -3.597 488 HB ILE 66 HB ILE 66 -5.233 -5.852 -2.894 489 HG12 ILE 66 HG12 ILE 66 -5.890 -3.015 -2.131 490 HG13 ILE 66 HG13 ILE 66 -6.710 -3.901 -3.408 491 HG21 ILE 66 HG21 ILE 66 -3.808 -3.889 -1.090 492 HG22 ILE 66 HG22 ILE 66 -3.271 -5.526 -1.466 493 HG23 ILE 66 HG23 ILE 66 -4.762 -5.269 -0.551 494 HD11 ILE 66 HD11 ILE 66 -7.568 -5.465 -1.786 495 HD12 ILE 66 HD12 ILE 66 -7.995 -3.821 -1.326 496 HD13 ILE 66 HD13 ILE 66 -6.678 -4.656 -0.491 497 HA PRO 67 HA PRO 67 -0.325 -5.911 -4.774 498 HB2 PRO 67 HB2 PRO 67 1.047 -4.853 -2.417 499 HB3 PRO 67 HB3 PRO 67 1.482 -4.686 -4.114 500 HG2 PRO 67 HG2 PRO 67 0.558 -2.619 -2.636 501 HG3 PRO 67 HG3 PRO 67 0.238 -2.752 -4.370 502 HD2 PRO 67 HD2 PRO 67 -1.549 -3.339 -2.054 503 HD3 PRO 67 HD3 PRO 67 -1.919 -2.616 -3.636 504 H GLN 68 H GLN 68 -0.074 -8.071 -4.221 505 HA GLN 68 HA GLN 68 -1.174 -9.154 -1.903 506 HB2 GLN 68 HB2 GLN 68 -0.894 -10.390 -3.950 507 HB3 GLN 68 HB3 GLN 68 0.849 -10.248 -3.832 508 HG2 GLN 68 HG2 GLN 68 0.939 -11.712 -1.959 509 HG3 GLN 68 HG3 GLN 68 -0.813 -11.683 -1.775 510 HE21 GLN 68 HE21 GLN 68 -1.325 -11.880 -4.620 511 HE22 GLN 68 HE22 GLN 68 -0.966 -13.501 -5.034 512 H VAL 69 H VAL 69 1.861 -7.768 -2.530 513 HA VAL 69 HA VAL 69 3.363 -8.984 -0.480 514 HB VAL 69 HB VAL 69 4.976 -7.142 -0.824 515 HG11 VAL 69 HG11 VAL 69 5.483 -7.651 -3.169 516 HG12 VAL 69 HG12 VAL 69 3.862 -8.313 -3.375 517 HG13 VAL 69 HG13 VAL 69 5.001 -9.103 -2.289 518 HG21 VAL 69 HG21 VAL 69 4.529 -5.454 -2.538 519 HG22 VAL 69 HG22 VAL 69 3.375 -5.336 -1.208 520 HG23 VAL 69 HG23 VAL 69 2.894 -6.087 -2.731 521 H PHE 70 H PHE 70 0.792 -6.815 -0.212 522 HA PHE 70 HA PHE 70 1.609 -5.571 2.266 523 HB2 PHE 70 HB2 PHE 70 -0.857 -5.583 0.572 524 HB3 PHE 70 HB3 PHE 70 -1.041 -5.177 2.272 525 HD1 PHE 70 HD1 PHE 70 1.463 -4.283 -0.382 526 HD2 PHE 70 HD2 PHE 70 -1.261 -2.942 2.589 527 HE1 PHE 70 HE1 PHE 70 2.128 -1.951 -0.818 528 HE2 PHE 70 HE2 PHE 70 -0.594 -0.625 2.181 529 HZ PHE 70 HZ PHE 70 1.080 -0.113 0.477 530 H PHE 71 H PHE 71 0.605 -8.543 1.295 531 HA PHE 71 HA PHE 71 -0.444 -9.259 3.919 532 HB2 PHE 71 HB2 PHE 71 -0.895 -10.541 1.210 533 HB3 PHE 71 HB3 PHE 71 -1.415 -11.244 2.731 534 HD1 PHE 71 HD1 PHE 71 -1.926 -8.420 0.403 535 HD2 PHE 71 HD2 PHE 71 -3.405 -10.534 3.786 536 HE1 PHE 71 HE1 PHE 71 -4.055 -7.204 0.226 537 HE2 PHE 71 HE2 PHE 71 -5.538 -9.320 3.614 538 HZ PHE 71 HZ PHE 71 -5.865 -7.655 1.831 539 H THR 72 H THR 72 0.169 -11.432 4.504 540 HA THR 72 HA THR 72 2.991 -11.856 4.119 541 HB THR 72 HB THR 72 2.607 -13.776 5.689 542 HG1 THR 72 HG1 THR 72 0.020 -12.680 5.912 543 HG21 THR 72 HG21 THR 72 3.220 -11.557 6.575 544 HG22 THR 72 HG22 THR 72 2.121 -12.398 7.668 545 HG23 THR 72 HG23 THR 72 1.511 -11.116 6.622 546 H ASN 73 H ASN 73 3.758 -14.015 3.579 547 HA ASN 73 HA ASN 73 2.669 -15.103 1.222 548 HB2 ASN 73 HB2 ASN 73 4.364 -16.822 1.428 549 HB3 ASN 73 HB3 ASN 73 5.066 -15.299 1.947 550 HD21 ASN 73 HD21 ASN 73 4.156 -18.475 2.882 551 HD22 ASN 73 HD22 ASN 73 4.769 -18.408 4.496 552 H SER 74 H SER 74 1.935 -15.583 4.536 553 HA SER 74 HA SER 74 0.707 -18.143 4.338 554 HB2 SER 74 HB2 SER 74 0.358 -16.011 6.448 555 HB3 SER 74 HB3 SER 74 0.087 -17.746 6.626 556 HG SER 74 HG SER 74 2.055 -17.074 7.491 557 H GLY 75 H GLY 75 -0.244 -14.870 3.650 558 HA2 GLY 75 HA2 GLY 75 -2.202 -14.513 2.318 559 HA3 GLY 75 HA3 GLY 75 -2.979 -15.838 3.167 560 H GLN 76 H GLN 76 -1.541 -14.229 5.569 561 HA GLN 76 HA GLN 76 -3.990 -12.684 6.093 562 HB2 GLN 76 HB2 GLN 76 -3.277 -12.542 8.410 563 HB3 GLN 76 HB3 GLN 76 -3.234 -14.221 7.894 564 HG2 GLN 76 HG2 GLN 76 -0.860 -14.194 7.753 565 HG3 GLN 76 HG3 GLN 76 -0.812 -12.445 7.947 566 HE21 GLN 76 HE21 GLN 76 -1.115 -11.555 9.980 567 HE22 GLN 76 HE22 GLN 76 -1.013 -12.508 11.411 568 H VAL 77 H VAL 77 -3.681 -10.539 7.168 569 HA VAL 77 HA VAL 77 -1.933 -8.855 5.713 570 HB VAL 77 HB VAL 77 -3.665 -8.429 8.181 571 HG11 VAL 77 HG11 VAL 77 -3.227 -6.017 8.006 572 HG12 VAL 77 HG12 VAL 77 -2.024 -6.339 6.752 573 HG13 VAL 77 HG13 VAL 77 -1.752 -6.906 8.395 574 HG21 VAL 77 HG21 VAL 77 -4.977 -7.035 6.684 575 HG22 VAL 77 HG22 VAL 77 -4.808 -8.673 6.034 576 HG23 VAL 77 HG23 VAL 77 -3.824 -7.342 5.390 577 H VAL 78 H VAL 78 0.052 -8.004 6.286 578 HA VAL 78 HA VAL 78 1.649 -9.485 8.113 579 HB VAL 78 HB VAL 78 2.294 -6.747 6.968 580 HG11 VAL 78 HG11 VAL 78 4.095 -8.981 7.878 581 HG12 VAL 78 HG12 VAL 78 3.784 -7.472 8.737 582 HG13 VAL 78 HG13 VAL 78 4.628 -7.445 7.191 583 HG21 VAL 78 HG21 VAL 78 3.411 -7.889 5.102 584 HG22 VAL 78 HG22 VAL 78 1.679 -8.217 5.121 585 HG23 VAL 78 HG23 VAL 78 2.812 -9.437 5.698 586 H LYS 79 H LYS 79 2.182 -9.013 10.181 587 HA LYS 79 HA LYS 79 0.451 -7.606 11.800 588 HB2 LYS 79 HB2 LYS 79 1.848 -9.360 12.683 589 HB3 LYS 79 HB3 LYS 79 3.303 -8.452 12.309 590 HG2 LYS 79 HG2 LYS 79 2.819 -8.377 14.692 591 HG3 LYS 79 HG3 LYS 79 2.697 -6.775 13.960 592 HD2 LYS 79 HD2 LYS 79 0.235 -7.072 13.824 593 HD3 LYS 79 HD3 LYS 79 0.403 -8.613 14.663 594 HE2 LYS 79 HE2 LYS 79 1.341 -7.462 16.590 595 HE3 LYS 79 HE3 LYS 79 1.220 -5.922 15.736 596 HZ1 LYS 79 HZ1 LYS 79 -1.182 -6.220 15.644 597 HZ2 LYS 79 HZ2 LYS 79 -0.647 -6.227 17.241 598 HZ3 LYS 79 HZ3 LYS 79 -1.064 -7.663 16.475 599 H SER 80 H SER 80 3.406 -6.472 10.292 600 HA SER 80 HA SER 80 3.377 -4.041 11.813 601 HB2 SER 80 HB2 SER 80 5.476 -3.659 10.413 602 HB3 SER 80 HB3 SER 80 5.462 -5.022 11.544 603 HG SER 80 HG SER 80 6.147 -5.973 9.717 604 H LEU 81 H LEU 81 1.637 -5.031 9.197 605 HA LEU 81 HA LEU 81 2.007 -2.899 7.381 606 HB2 LEU 81 HB2 LEU 81 0.950 -5.054 6.756 607 HB3 LEU 81 HB3 LEU 81 -0.478 -4.619 7.658 608 HG LEU 81 HG LEU 81 -0.561 -2.544 6.169 609 HD11 LEU 81 HD11 LEU 81 0.472 -2.792 3.997 610 HD12 LEU 81 HD12 LEU 81 1.222 -4.289 4.532 611 HD13 LEU 81 HD13 LEU 81 1.691 -2.754 5.282 612 HD21 LEU 81 HD21 LEU 81 -1.034 -5.274 5.008 613 HD22 LEU 81 HD22 LEU 81 -1.741 -3.765 4.418 614 HD23 LEU 81 HD23 LEU 81 -2.148 -4.354 6.030 615 HA PRO 82 HA PRO 82 -1.959 -0.879 9.437 616 HB2 PRO 82 HB2 PRO 82 -1.726 -1.959 12.201 617 HB3 PRO 82 HB3 PRO 82 -3.181 -1.636 11.252 618 HG2 PRO 82 HG2 PRO 82 -2.378 -4.120 11.655 619 HG3 PRO 82 HG3 PRO 82 -2.997 -3.626 10.066 620 HD2 PRO 82 HD2 PRO 82 -0.171 -4.013 10.967 621 HD3 PRO 82 HD3 PRO 82 -0.950 -4.519 9.458 622 H GLY 83 H GLY 83 0.893 -1.699 11.270 623 HA2 GLY 83 HA2 GLY 83 1.089 0.649 12.799 624 HA3 GLY 83 HA3 GLY 83 2.410 -0.450 12.430 625 H LEU 84 H LEU 84 2.576 -0.216 9.666 626 HA LEU 84 HA LEU 84 3.923 2.280 9.485 627 HB2 LEU 84 HB2 LEU 84 4.652 1.645 7.333 628 HB3 LEU 84 HB3 LEU 84 4.559 0.152 8.225 629 HG LEU 84 HG LEU 84 2.153 0.090 7.028 630 HD11 LEU 84 HD11 LEU 84 3.884 1.624 5.089 631 HD12 LEU 84 HD12 LEU 84 2.421 2.213 5.862 632 HD13 LEU 84 HD13 LEU 84 2.327 0.900 4.713 633 HD21 LEU 84 HD21 LEU 84 3.831 -1.673 6.925 634 HD22 LEU 84 HD22 LEU 84 4.776 -0.720 5.780 635 HD23 LEU 84 HD23 LEU 84 3.198 -1.338 5.308 636 H LEU 85 H LEU 85 0.864 1.078 8.329 637 HA LEU 85 HA LEU 85 0.180 3.306 6.776 638 HB2 LEU 85 HB2 LEU 85 -1.613 1.352 8.205 639 HB3 LEU 85 HB3 LEU 85 -2.143 2.484 6.977 640 HG LEU 85 HG LEU 85 -0.203 0.209 6.553 641 HD11 LEU 85 HD11 LEU 85 -1.972 -0.755 5.196 642 HD12 LEU 85 HD12 LEU 85 -3.047 0.561 5.657 643 HD13 LEU 85 HD13 LEU 85 -2.464 -0.569 6.878 644 HD21 LEU 85 HD21 LEU 85 0.334 2.073 5.097 645 HD22 LEU 85 HD22 LEU 85 -1.357 2.202 4.614 646 HD23 LEU 85 HD23 LEU 85 -0.419 0.777 4.174 647 H THR 86 H THR 86 -0.343 2.579 10.148 648 HA THR 86 HA THR 86 -2.002 4.734 10.788 649 HB THR 86 HB THR 86 0.009 3.278 12.524 650 HG1 THR 86 HG1 THR 86 -1.632 1.945 11.885 651 HG21 THR 86 HG21 THR 86 -1.210 4.191 14.469 652 HG22 THR 86 HG22 THR 86 -2.200 5.169 13.382 653 HG23 THR 86 HG23 THR 86 -0.469 5.480 13.522 654 H ILE 87 H ILE 87 1.553 4.593 10.833 655 HA ILE 87 HA ILE 87 1.724 7.232 11.811 656 HB ILE 87 HB ILE 87 3.500 5.684 12.350 657 HG12 ILE 87 HG12 ILE 87 4.126 8.135 12.074 658 HG13 ILE 87 HG13 ILE 87 5.460 6.988 12.088 659 HG21 ILE 87 HG21 ILE 87 3.491 4.220 10.518 660 HG22 ILE 87 HG22 ILE 87 5.134 4.821 10.768 661 HG23 ILE 87 HG23 ILE 87 4.148 5.460 9.453 662 HD11 ILE 87 HD11 ILE 87 5.753 8.769 10.445 663 HD12 ILE 87 HD12 ILE 87 4.258 8.276 9.652 664 HD13 ILE 87 HD13 ILE 87 5.649 7.187 9.666 665 H LEU 88 H LEU 88 1.936 5.931 8.515 666 HA LEU 88 HA LEU 88 2.452 8.474 7.366 667 HB2 LEU 88 HB2 LEU 88 1.428 5.926 6.207 668 HB3 LEU 88 HB3 LEU 88 1.401 7.390 5.259 669 HG LEU 88 HG LEU 88 3.308 6.113 4.649 670 HD11 LEU 88 HD11 LEU 88 5.132 7.654 5.052 671 HD12 LEU 88 HD12 LEU 88 4.215 8.428 6.334 672 HD13 LEU 88 HD13 LEU 88 3.638 8.507 4.665 673 HD21 LEU 88 HD21 LEU 88 3.530 4.765 6.647 674 HD22 LEU 88 HD22 LEU 88 4.107 6.176 7.532 675 HD23 LEU 88 HD23 LEU 88 5.065 5.509 6.201 676 H HIS 89 H HIS 89 -0.522 6.822 8.122 677 HA HIS 89 HA HIS 89 -2.162 8.739 6.853 678 HB2 HIS 89 HB2 HIS 89 -2.835 6.692 8.972 679 HB3 HIS 89 HB3 HIS 89 -4.031 7.827 8.356 680 HD1 HIS 89 HD1 HIS 89 -3.572 4.469 7.884 681 HD2 HIS 89 HD2 HIS 89 -3.437 7.641 5.196 682 HE1 HIS 89 HE1 HIS 89 -4.033 3.496 5.622 683 H ASP 90 H ASP 90 -0.731 8.593 9.998 684 HA ASP 90 HA ASP 90 -2.111 10.746 11.191 685 HB2 ASP 90 HB2 ASP 90 -0.611 9.216 12.446 686 HB3 ASP 90 HB3 ASP 90 0.773 9.885 11.592 687 H GLY 91 H GLY 91 0.468 10.590 8.879 688 HA2 GLY 91 HA2 GLY 91 0.873 13.496 8.924 689 HA3 GLY 91 HA3 GLY 91 1.861 12.325 8.059 690 H GLY 92 H GLY 92 -1.343 11.591 7.598 691 HA2 GLY 92 HA2 GLY 92 -2.879 11.914 5.936 692 HA3 GLY 92 HA3 GLY 92 -2.183 13.505 5.715 693 H TYR 93 H TYR 93 -0.398 10.494 5.261 694 HA TYR 93 HA TYR 93 0.089 11.365 2.559 695 HB2 TYR 93 HB2 TYR 93 1.380 9.268 4.259 696 HB3 TYR 93 HB3 TYR 93 1.641 9.287 2.520 697 HD1 TYR 93 HD1 TYR 93 2.184 11.143 5.654 698 HD2 TYR 93 HD2 TYR 93 2.936 10.994 1.476 699 HE1 TYR 93 HE1 TYR 93 3.882 12.896 5.897 700 HE2 TYR 93 HE2 TYR 93 4.639 12.736 1.706 701 HH TYR 93 HH TYR 93 6.003 13.559 4.572 702 H ARG 94 H ARG 94 -0.611 10.562 0.785 703 HA ARG 94 HA ARG 94 -2.884 8.841 0.849 704 HB2 ARG 94 HB2 ARG 94 -2.985 9.129 -1.574 705 HB3 ARG 94 HB3 ARG 94 -2.724 10.682 -0.795 706 HG2 ARG 94 HG2 ARG 94 -0.425 10.660 -1.374 707 HG3 ARG 94 HG3 ARG 94 -0.540 9.019 -2.020 708 HD2 ARG 94 HD2 ARG 94 -2.115 9.902 -3.733 709 HD3 ARG 94 HD3 ARG 94 -1.832 11.524 -3.087 710 HE ARG 94 HE ARG 94 0.649 10.889 -3.629 711 HH11 ARG 94 HH11 ARG 94 -2.154 10.116 -5.640 712 HH12 ARG 94 HH12 ARG 94 -1.279 10.073 -7.099 713 HH21 ARG 94 HH21 ARG 94 1.823 10.901 -5.525 714 HH22 ARG 94 HH22 ARG 94 1.089 10.617 -7.048 715 H ASP 95 H ASP 95 -3.042 7.112 -0.855 716 HA ASP 95 HA ASP 95 -1.732 4.835 -0.032 717 HB2 ASP 95 HB2 ASP 95 -2.814 3.858 -2.065 718 HB3 ASP 95 HB3 ASP 95 -3.911 4.817 -1.076 719 H THR 96 H THR 96 -1.240 6.800 -2.869 720 HA THR 96 HA THR 96 0.609 5.249 -4.207 721 HB THR 96 HB THR 96 0.339 8.239 -4.221 722 HG1 THR 96 HG1 THR 96 -1.512 6.345 -4.822 723 HG21 THR 96 HG21 THR 96 2.280 7.290 -5.448 724 HG22 THR 96 HG22 THR 96 1.111 8.064 -6.519 725 HG23 THR 96 HG23 THR 96 1.169 6.304 -6.394 726 H GLU 97 H GLU 97 0.996 7.799 -1.780 727 HA GLU 97 HA GLU 97 3.804 8.020 -2.129 728 HB2 GLU 97 HB2 GLU 97 2.203 8.821 0.303 729 HB3 GLU 97 HB3 GLU 97 3.842 9.322 -0.077 730 HG2 GLU 97 HG2 GLU 97 1.342 10.030 -1.554 731 HG3 GLU 97 HG3 GLU 97 2.309 11.118 -0.560 732 H ILE 98 H ILE 98 1.719 6.061 -0.119 733 HA ILE 98 HA ILE 98 3.624 5.131 1.756 734 HB ILE 98 HB ILE 98 1.447 3.377 0.608 735 HG12 ILE 98 HG12 ILE 98 0.200 5.358 1.169 736 HG13 ILE 98 HG13 ILE 98 -0.002 4.174 2.461 737 HG21 ILE 98 HG21 ILE 98 2.970 2.285 2.101 738 HG22 ILE 98 HG22 ILE 98 1.378 2.419 2.850 739 HG23 ILE 98 HG23 ILE 98 2.675 3.512 3.333 740 HD11 ILE 98 HD11 ILE 98 1.864 6.508 2.576 741 HD12 ILE 98 HD12 ILE 98 1.517 5.346 3.857 742 HD13 ILE 98 HD13 ILE 98 0.252 6.443 3.294 743 H MET 99 H MET 99 2.532 3.870 -1.332 744 HA MET 99 HA MET 99 4.317 1.640 -1.303 745 HB2 MET 99 HB2 MET 99 2.699 2.757 -3.586 746 HB3 MET 99 HB3 MET 99 3.490 1.190 -3.563 747 HG2 MET 99 HG2 MET 99 2.066 0.572 -1.631 748 HG3 MET 99 HG3 MET 99 1.215 2.099 -1.830 749 HE1 MET 99 HE1 MET 99 -1.095 1.116 -2.110 750 HE2 MET 99 HE2 MET 99 -0.426 -0.472 -1.742 751 HE3 MET 99 HE3 MET 99 -1.498 -0.270 -3.128 752 H ARG 100 H ARG 100 4.643 4.881 -2.158 753 HA ARG 100 HA ARG 100 6.300 4.767 -4.408 754 HB2 ARG 100 HB2 ARG 100 5.039 6.723 -3.465 755 HB3 ARG 100 HB3 ARG 100 6.295 6.866 -2.252 756 HG2 ARG 100 HG2 ARG 100 7.926 7.343 -3.955 757 HG3 ARG 100 HG3 ARG 100 6.711 7.087 -5.217 758 HD2 ARG 100 HD2 ARG 100 5.353 8.892 -4.136 759 HD3 ARG 100 HD3 ARG 100 6.740 9.227 -3.100 760 HE ARG 100 HE ARG 100 7.697 9.269 -5.654 761 HH11 ARG 100 HH11 ARG 100 5.255 11.104 -3.814 762 HH12 ARG 100 HH12 ARG 100 5.400 12.482 -4.796 763 HH21 ARG 100 HH21 ARG 100 7.874 11.132 -6.956 764 HH22 ARG 100 HH22 ARG 100 6.929 12.516 -6.642 765 H TRP 101 H TRP 101 7.294 5.499 -1.067 766 HA TRP 101 HA TRP 101 10.000 4.899 -1.649 767 HB2 TRP 101 HB2 TRP 101 10.249 4.997 0.940 768 HB3 TRP 101 HB3 TRP 101 9.823 6.467 0.075 769 HD1 TRP 101 HD1 TRP 101 7.477 7.519 0.539 770 HE1 TRP 101 HE1 TRP 101 5.653 7.082 2.271 771 HE3 TRP 101 HE3 TRP 101 9.157 3.061 2.378 772 HZ2 TRP 101 HZ2 TRP 101 5.010 5.120 4.179 773 HZ3 TRP 101 HZ3 TRP 101 7.877 1.976 4.139 774 HH2 TRP 101 HH2 TRP 101 5.845 2.986 5.044 775 H LEU 102 H LEU 102 7.380 3.007 -0.421 776 HA LEU 102 HA LEU 102 8.777 0.870 0.698 777 HB2 LEU 102 HB2 LEU 102 6.083 1.315 -0.302 778 HB3 LEU 102 HB3 LEU 102 6.560 -0.378 -0.223 779 HG LEU 102 HG LEU 102 6.480 1.609 2.057 780 HD11 LEU 102 HD11 LEU 102 4.709 -0.747 1.415 781 HD12 LEU 102 HD12 LEU 102 4.279 0.946 1.196 782 HD13 LEU 102 HD13 LEU 102 4.581 0.318 2.822 783 HD21 LEU 102 HD21 LEU 102 7.102 -1.325 1.959 784 HD22 LEU 102 HD22 LEU 102 6.820 -0.404 3.444 785 HD23 LEU 102 HD23 LEU 102 8.201 -0.020 2.419 786 H PHE 103 H PHE 103 7.845 1.366 -2.669 787 HA PHE 103 HA PHE 103 8.973 -1.239 -3.257 788 HB2 PHE 103 HB2 PHE 103 7.280 0.613 -4.903 789 HB3 PHE 103 HB3 PHE 103 8.050 -0.817 -5.579 790 HD1 PHE 103 HD1 PHE 103 5.521 0.377 -3.171 791 HD2 PHE 103 HD2 PHE 103 7.234 -2.985 -5.101 792 HE1 PHE 103 HE1 PHE 103 3.634 -1.005 -2.421 793 HE2 PHE 103 HE2 PHE 103 5.357 -4.376 -4.341 794 HZ PHE 103 HZ PHE 103 3.560 -3.383 -2.996 795 H THR 104 H THR 104 10.152 1.773 -3.052 796 HA THR 104 HA THR 104 11.963 1.517 -5.290 797 HB THR 104 HB THR 104 11.836 3.639 -3.118 798 HG1 THR 104 HG1 THR 104 10.046 3.976 -4.291 799 HG21 THR 104 HG21 THR 104 14.056 3.462 -4.237 800 HG22 THR 104 HG22 THR 104 13.228 4.969 -4.639 801 HG23 THR 104 HG23 THR 104 13.252 3.643 -5.796 802 HA PRO 105 HA PRO 105 14.649 -1.014 -2.606 803 HB2 PRO 105 HB2 PRO 105 16.413 -0.729 -4.984 804 HB3 PRO 105 HB3 PRO 105 15.914 -2.189 -4.130 805 HG2 PRO 105 HG2 PRO 105 14.871 -1.631 -6.495 806 HG3 PRO 105 HG3 PRO 105 13.841 -2.260 -5.197 807 HD2 PRO 105 HD2 PRO 105 14.136 0.562 -6.164 808 HD3 PRO 105 HD3 PRO 105 12.667 -0.349 -5.742 809 H ASP 106 H ASP 106 16.397 -0.496 -1.345 810 HA ASP 106 HA ASP 106 17.552 2.163 -1.820 811 HB2 ASP 106 HB2 ASP 106 16.342 1.946 0.320 812 HB3 ASP 106 HB3 ASP 106 17.383 0.612 0.775 813 HA PRO 107 HA PRO 107 21.239 0.031 -3.033 814 HB2 PRO 107 HB2 PRO 107 22.933 2.179 -2.821 815 HB3 PRO 107 HB3 PRO 107 21.862 1.880 -4.197 816 HG2 PRO 107 HG2 PRO 107 21.463 3.668 -1.838 817 HG3 PRO 107 HG3 PRO 107 21.122 3.985 -3.552 818 HD2 PRO 107 HD2 PRO 107 19.191 3.340 -1.833 819 HD3 PRO 107 HD3 PRO 107 19.159 2.739 -3.509 820 H SER 108 H SER 108 20.990 1.720 0.027 821 HA SER 108 HA SER 108 23.540 0.599 0.933 822 HB2 SER 108 HB2 SER 108 21.778 2.649 2.274 823 HB3 SER 108 HB3 SER 108 23.468 2.283 2.619 824 HG SER 108 HG SER 108 23.623 2.846 0.203 825 H LEU 109 H LEU 109 20.388 -0.256 0.802 826 HA LEU 109 HA LEU 109 20.208 -1.178 3.562 827 HB2 LEU 109 HB2 LEU 109 18.379 0.132 2.540 828 HB3 LEU 109 HB3 LEU 109 18.180 -1.141 1.350 829 HG LEU 109 HG LEU 109 17.561 -2.684 3.153 830 HD11 LEU 109 HD11 LEU 109 17.708 -0.213 4.864 831 HD12 LEU 109 HD12 LEU 109 18.717 -1.662 4.993 832 HD13 LEU 109 HD13 LEU 109 16.991 -1.751 5.346 833 HD21 LEU 109 HD21 LEU 109 15.921 -0.163 2.997 834 HD22 LEU 109 HD22 LEU 109 15.351 -1.733 3.571 835 HD23 LEU 109 HD23 LEU 109 15.845 -1.539 1.889 836 H THR 110 H THR 110 20.394 -3.243 4.025 837 HA THR 110 HA THR 110 20.360 -5.199 1.862 838 HB THR 110 HB THR 110 22.301 -5.187 4.188 839 HG1 THR 110 HG1 THR 110 22.279 -3.821 1.875 840 HG21 THR 110 HG21 THR 110 22.211 -6.802 1.631 841 HG22 THR 110 HG22 THR 110 21.774 -7.380 3.237 842 HG23 THR 110 HG23 THR 110 23.446 -6.928 2.890 843 H ILE 111 H ILE 111 18.732 -6.469 2.234 844 HA ILE 111 HA ILE 111 17.803 -7.006 4.988 845 HB ILE 111 HB ILE 111 16.312 -6.504 2.444 846 HG12 ILE 111 HG12 ILE 111 17.165 -4.518 3.498 847 HG13 ILE 111 HG13 ILE 111 15.405 -4.517 3.486 848 HG21 ILE 111 HG21 ILE 111 15.098 -8.180 3.583 849 HG22 ILE 111 HG22 ILE 111 14.230 -6.643 3.618 850 HG23 ILE 111 HG23 ILE 111 15.074 -7.213 5.068 851 HD11 ILE 111 HD11 ILE 111 16.221 -3.666 5.606 852 HD12 ILE 111 HD12 ILE 111 17.234 -5.094 5.827 853 HD13 ILE 111 HD13 ILE 111 15.480 -5.242 5.872 854 H THR 112 H THR 112 17.002 -9.010 5.277 855 HA THR 112 HA THR 112 17.575 -11.022 3.207 856 HB THR 112 HB THR 112 18.737 -11.478 5.336 857 HG1 THR 112 HG1 THR 112 18.434 -13.441 4.793 858 HG21 THR 112 HG21 THR 112 17.243 -10.398 6.911 859 HG22 THR 112 HG22 THR 112 17.454 -12.090 7.361 860 HG23 THR 112 HG23 THR 112 15.975 -11.567 6.551 861 H ARG 113 H ARG 113 15.881 -12.716 2.925 862 HA ARG 113 HA ARG 113 13.224 -11.563 3.529 863 HB2 ARG 113 HB2 ARG 113 14.322 -10.914 1.254 864 HB3 ARG 113 HB3 ARG 113 13.913 -12.546 0.773 865 HG2 ARG 113 HG2 ARG 113 11.859 -10.622 1.808 866 HG3 ARG 113 HG3 ARG 113 12.326 -10.660 0.112 867 HD2 ARG 113 HD2 ARG 113 11.541 -12.963 -0.028 868 HD3 ARG 113 HD3 ARG 113 11.148 -12.948 1.693 869 HE ARG 113 HE ARG 113 9.917 -10.817 0.299 870 HH11 ARG 113 HH11 ARG 113 9.599 -14.341 0.771 871 HH12 ARG 113 HH12 ARG 113 7.919 -14.348 0.549 872 HH21 ARG 113 HH21 ARG 113 7.608 -10.859 0.012 873 HH22 ARG 113 HH22 ARG 113 6.751 -12.319 0.143 874 H ASP 114 H ASP 114 11.498 -13.109 3.527 875 HA ASP 114 HA ASP 114 12.083 -15.796 4.129 876 HB2 ASP 114 HB2 ASP 114 9.490 -14.604 3.099 877 HB3 ASP 114 HB3 ASP 114 9.660 -16.186 3.843 878 H GLY 115 H GLY 115 13.203 -16.887 2.621 879 HA2 GLY 115 HA2 GLY 115 12.607 -18.338 0.630 880 HA3 GLY 115 HA3 GLY 115 12.259 -16.798 -0.162 881 H SER 116 H SER 116 14.315 -15.303 0.984 882 HA SER 116 HA SER 116 16.727 -16.598 -0.056 883 HB2 SER 116 HB2 SER 116 16.038 -13.642 -0.211 884 HB3 SER 116 HB3 SER 116 17.484 -14.414 -0.864 885 HG SER 116 HG SER 116 14.851 -15.086 -1.615 886 H ARG 117 H ARG 117 17.570 -17.234 1.856 887 HA ARG 117 HA ARG 117 17.498 -15.705 4.278 888 HB2 ARG 117 HB2 ARG 117 19.182 -18.065 3.474 889 HB3 ARG 117 HB3 ARG 117 19.126 -17.391 5.099 890 HG2 ARG 117 HG2 ARG 117 16.797 -17.933 5.284 891 HG3 ARG 117 HG3 ARG 117 16.791 -18.484 3.599 892 HD2 ARG 117 HD2 ARG 117 18.316 -20.213 4.099 893 HD3 ARG 117 HD3 ARG 117 18.494 -19.662 5.767 894 HE ARG 117 HE ARG 117 16.088 -20.196 6.023 895 HH11 ARG 117 HH11 ARG 117 17.930 -21.826 3.474 896 HH12 ARG 117 HH12 ARG 117 17.080 -23.278 3.546 897 HH21 ARG 117 HH21 ARG 117 14.843 -22.193 6.130 898 HH22 ARG 117 HH22 ARG 117 15.204 -23.482 5.093 899 H ASP 118 H ASP 118 19.712 -16.220 1.739 900 HA ASP 118 HA ASP 118 21.958 -14.780 2.639 901 HB2 ASP 118 HB2 ASP 118 20.849 -14.836 -0.172 902 HB3 ASP 118 HB3 ASP 118 22.474 -14.358 0.277 903 H ALA 119 H ALA 119 22.282 -12.679 2.878 904 HA ALA 119 HA ALA 119 20.065 -10.935 2.922 905 HB1 ALA 119 HB1 ALA 119 21.610 -9.240 3.642 906 HB2 ALA 119 HB2 ALA 119 22.981 -10.201 3.095 907 HB3 ALA 119 HB3 ALA 119 21.998 -10.755 4.452 908 H VAL 120 H VAL 120 19.371 -9.457 1.517 909 HA VAL 120 HA VAL 120 20.648 -9.390 -1.105 910 HB VAL 120 HB VAL 120 17.799 -8.722 -0.293 911 HG11 VAL 120 HG11 VAL 120 18.496 -7.449 -2.235 912 HG12 VAL 120 HG12 VAL 120 17.329 -8.686 -2.704 913 HG13 VAL 120 HG13 VAL 120 19.047 -8.925 -3.022 914 HG21 VAL 120 HG21 VAL 120 18.232 -11.115 -0.093 915 HG22 VAL 120 HG22 VAL 120 18.867 -11.150 -1.738 916 HG23 VAL 120 HG23 VAL 120 17.165 -10.788 -1.459 917 H SER 121 H SER 121 21.764 -7.613 -1.474 918 HA SER 121 HA SER 121 21.287 -5.182 -0.005 919 HB2 SER 121 HB2 SER 121 23.599 -5.979 -0.657 920 HB3 SER 121 HB3 SER 121 23.157 -5.728 -2.341 921 HG SER 121 HG SER 121 24.160 -4.003 -0.676 922 H ASN 122 H ASN 122 20.556 -3.245 -1.028 923 HA ASN 122 HA ASN 122 19.225 -1.981 -2.315 924 HB2 ASN 122 HB2 ASN 122 19.723 -3.988 -4.551 925 HB3 ASN 122 HB3 ASN 122 18.999 -2.392 -4.691 926 HD21 ASN 122 HD21 ASN 122 21.900 -4.180 -4.324 927 HD22 ASN 122 HD22 ASN 122 22.994 -2.883 -4.621 928 H ALA 123 H ALA 123 18.062 -3.802 -0.585 929 HA ALA 123 HA ALA 123 16.084 -5.270 -2.049 930 HB1 ALA 123 HB1 ALA 123 17.057 -6.200 -0.012 931 HB2 ALA 123 HB2 ALA 123 15.316 -5.986 0.153 932 HB3 ALA 123 HB3 ALA 123 16.423 -4.839 0.911 933 H ARG 124 H ARG 124 13.903 -4.902 -1.957 934 HA ARG 124 HA ARG 124 13.093 -2.152 -1.682 935 HB2 ARG 124 HB2 ARG 124 10.835 -3.005 -2.413 936 HB3 ARG 124 HB3 ARG 124 12.126 -3.401 -3.539 937 HG2 ARG 124 HG2 ARG 124 12.222 -5.669 -2.584 938 HG3 ARG 124 HG3 ARG 124 10.902 -5.255 -1.507 939 HD2 ARG 124 HD2 ARG 124 9.422 -4.930 -3.420 940 HD3 ARG 124 HD3 ARG 124 10.757 -5.276 -4.526 941 HE ARG 124 HE ARG 124 10.550 -7.361 -2.700 942 HH11 ARG 124 HH11 ARG 124 8.571 -6.089 -5.385 943 HH12 ARG 124 HH12 ARG 124 7.980 -7.617 -5.841 944 HH21 ARG 124 HH21 ARG 124 9.706 -9.417 -3.337 945 HH22 ARG 124 HH22 ARG 124 8.630 -9.550 -4.662 946 HA PRO 125 HA PRO 125 12.250 -2.267 2.689 947 HB2 PRO 125 HB2 PRO 125 10.099 -0.383 1.843 948 HB3 PRO 125 HB3 PRO 125 11.253 -0.230 3.172 949 HG2 PRO 125 HG2 PRO 125 11.661 1.116 0.949 950 HG3 PRO 125 HG3 PRO 125 13.020 0.302 1.744 951 HD2 PRO 125 HD2 PRO 125 11.521 -0.481 -0.720 952 HD3 PRO 125 HD3 PRO 125 13.249 -0.659 -0.329 953 H VAL 126 H VAL 126 9.672 -2.859 0.377 954 HA VAL 126 HA VAL 126 7.632 -3.624 2.163 955 HB VAL 126 HB VAL 126 8.136 -4.790 -0.599 956 HG11 VAL 126 HG11 VAL 126 5.636 -4.712 1.087 957 HG12 VAL 126 HG12 VAL 126 6.585 -6.146 0.683 958 HG13 VAL 126 HG13 VAL 126 5.731 -5.257 -0.584 959 HG21 VAL 126 HG21 VAL 126 7.924 -2.354 -0.647 960 HG22 VAL 126 HG22 VAL 126 6.396 -2.479 0.225 961 HG23 VAL 126 HG23 VAL 126 6.539 -3.145 -1.403 962 H ASP 127 H ASP 127 10.344 -5.433 0.847 963 HA ASP 127 HA ASP 127 9.459 -7.928 1.893 964 HB2 ASP 127 HB2 ASP 127 12.068 -7.021 0.731 965 HB3 ASP 127 HB3 ASP 127 11.935 -8.599 1.500 966 H ALA 128 H ALA 128 11.295 -5.323 3.091 967 HA ALA 128 HA ALA 128 12.518 -6.631 5.265 968 HB1 ALA 128 HB1 ALA 128 13.263 -4.438 4.455 969 HB2 ALA 128 HB2 ALA 128 12.903 -4.402 6.179 970 HB3 ALA 128 HB3 ALA 128 11.759 -3.720 5.023 971 H LEU 129 H LEU 129 9.449 -4.855 5.007 972 HA LEU 129 HA LEU 129 8.800 -5.113 7.763 973 HB2 LEU 129 HB2 LEU 129 6.560 -4.384 7.182 974 HB3 LEU 129 HB3 LEU 129 7.742 -3.380 6.388 975 HG LEU 129 HG LEU 129 7.290 -5.104 4.425 976 HD11 LEU 129 HD11 LEU 129 5.766 -6.443 5.646 977 HD12 LEU 129 HD12 LEU 129 4.925 -5.689 4.281 978 HD13 LEU 129 HD13 LEU 129 4.691 -5.074 5.930 979 HD21 LEU 129 HD21 LEU 129 5.522 -2.750 5.080 980 HD22 LEU 129 HD22 LEU 129 5.697 -3.482 3.486 981 HD23 LEU 129 HD23 LEU 129 7.078 -2.692 4.247 982 H HIS 130 H HIS 130 8.157 -7.149 5.011 983 HA HIS 130 HA HIS 130 6.359 -8.925 6.298 984 HB2 HIS 130 HB2 HIS 130 6.631 -8.727 3.810 985 HB3 HIS 130 HB3 HIS 130 8.219 -9.468 3.963 986 HD1 HIS 130 HD1 HIS 130 8.233 -12.142 4.569 987 HD2 HIS 130 HD2 HIS 130 4.497 -10.424 3.863 988 HE1 HIS 130 HE1 HIS 130 6.659 -14.029 4.213 989 H ALA 131 H ALA 131 9.777 -8.708 5.962 990 HA ALA 131 HA ALA 131 10.196 -11.323 7.193 991 HB1 ALA 131 HB1 ALA 131 12.535 -11.058 6.579 992 HB2 ALA 131 HB2 ALA 131 12.207 -9.402 6.050 993 HB3 ALA 131 HB3 ALA 131 11.472 -10.758 5.202 994 H HIS 132 H HIS 132 9.295 -8.833 8.631 995 HA HIS 132 HA HIS 132 9.333 -8.047 10.772 996 HB2 HIS 132 HB2 HIS 132 9.600 -10.572 11.193 997 HB3 HIS 132 HB3 HIS 132 11.310 -10.266 11.412 998 HD1 HIS 132 HD1 HIS 132 8.002 -9.962 13.121 999 HD2 HIS 132 HD2 HIS 132 11.979 -9.001 13.842 1000 HE1 HIS 132 HE1 HIS 132 8.151 -9.405 15.571 1001 H GLN 133 H GLN 133 11.267 -7.152 8.798 1002 HA GLN 133 HA GLN 133 13.324 -5.967 10.519 1003 HB2 GLN 133 HB2 GLN 133 13.219 -6.458 7.536 1004 HB3 GLN 133 HB3 GLN 133 14.462 -5.470 8.299 1005 HG2 GLN 133 HG2 GLN 133 15.343 -7.316 9.481 1006 HG3 GLN 133 HG3 GLN 133 13.934 -8.307 9.118 1007 HE21 GLN 133 HE21 GLN 133 13.729 -9.184 7.216 1008 HE22 GLN 133 HE22 GLN 133 14.946 -9.356 6.025 1009 H ALA 134 H ALA 134 10.592 -5.432 10.229 1010 HA ALA 134 HA ALA 134 9.735 -3.274 8.764 1011 HB1 ALA 134 HB1 ALA 134 7.967 -3.037 10.404 1012 HB2 ALA 134 HB2 ALA 134 8.887 -4.005 11.553 1013 HB3 ALA 134 HB3 ALA 134 8.277 -4.742 10.070 1014 H ARG 135 H ARG 135 11.790 -3.273 11.504 1015 HA ARG 135 HA ARG 135 11.422 -0.752 12.638 1016 HB2 ARG 135 HB2 ARG 135 14.052 -2.183 12.238 1017 HB3 ARG 135 HB3 ARG 135 13.695 -0.969 13.460 1018 HG2 ARG 135 HG2 ARG 135 12.197 -2.434 14.591 1019 HG3 ARG 135 HG3 ARG 135 12.273 -3.612 13.280 1020 HD2 ARG 135 HD2 ARG 135 14.712 -3.856 13.758 1021 HD3 ARG 135 HD3 ARG 135 14.477 -2.829 15.173 1022 HE ARG 135 HE ARG 135 13.121 -4.468 16.133 1023 HH11 ARG 135 HH11 ARG 135 14.709 -5.592 13.126 1024 HH12 ARG 135 HH12 ARG 135 14.546 -7.228 13.520 1025 HH21 ARG 135 HH21 ARG 135 12.944 -6.761 16.625 1026 HH22 ARG 135 HH22 ARG 135 13.563 -7.920 15.530 1027 H GLU 136 H GLU 136 13.400 -1.693 9.809 1028 HA GLU 136 HA GLU 136 14.451 0.894 9.280 1029 HB2 GLU 136 HB2 GLU 136 14.297 -1.673 7.812 1030 HB3 GLU 136 HB3 GLU 136 14.512 -0.225 6.844 1031 HG2 GLU 136 HG2 GLU 136 16.287 -1.054 9.119 1032 HG3 GLU 136 HG3 GLU 136 16.633 -1.317 7.410 1033 H VAL 137 H VAL 137 11.553 -0.745 8.424 1034 HA VAL 137 HA VAL 137 10.750 1.069 6.376 1035 HB VAL 137 HB VAL 137 9.067 -0.903 7.954 1036 HG11 VAL 137 HG11 VAL 137 7.516 -0.814 6.067 1037 HG12 VAL 137 HG12 VAL 137 8.536 0.390 5.285 1038 HG13 VAL 137 HG13 VAL 137 7.710 0.784 6.795 1039 HG21 VAL 137 HG21 VAL 137 10.508 -1.228 5.328 1040 HG22 VAL 137 HG22 VAL 137 9.405 -2.411 6.024 1041 HG23 VAL 137 HG23 VAL 137 10.912 -2.018 6.847 1042 H VAL 138 H VAL 138 10.018 0.640 9.793 1043 HA VAL 138 HA VAL 138 8.110 2.690 10.025 1044 HB VAL 138 HB VAL 138 10.000 1.666 12.174 1045 HG11 VAL 138 HG11 VAL 138 7.409 3.198 12.439 1046 HG12 VAL 138 HG12 VAL 138 9.018 3.832 12.750 1047 HG13 VAL 138 HG13 VAL 138 8.363 2.553 13.778 1048 HG21 VAL 138 HG21 VAL 138 8.620 -0.121 11.236 1049 HG22 VAL 138 HG22 VAL 138 7.169 0.845 11.497 1050 HG23 VAL 138 HG23 VAL 138 8.099 0.264 12.876 1051 H ARG 139 H ARG 139 11.628 2.737 10.584 1052 HA ARG 139 HA ARG 139 11.670 5.474 11.229 1053 HB2 ARG 139 HB2 ARG 139 14.111 5.401 10.974 1054 HB3 ARG 139 HB3 ARG 139 13.496 3.998 11.831 1055 HG2 ARG 139 HG2 ARG 139 13.763 2.634 9.904 1056 HG3 ARG 139 HG3 ARG 139 14.312 4.017 8.953 1057 HD2 ARG 139 HD2 ARG 139 16.171 2.596 9.809 1058 HD3 ARG 139 HD3 ARG 139 16.253 4.279 10.337 1059 HE ARG 139 HE ARG 139 15.121 3.395 12.426 1060 HH11 ARG 139 HH11 ARG 139 17.408 1.393 10.539 1061 HH12 ARG 139 HH12 ARG 139 17.963 0.569 11.920 1062 HH21 ARG 139 HH21 ARG 139 15.908 2.171 14.274 1063 HH22 ARG 139 HH22 ARG 139 17.081 0.964 14.019 1064 H ARG 140 H ARG 140 11.938 3.819 8.170 1065 HA ARG 140 HA ARG 140 12.628 6.021 6.548 1066 HB2 ARG 140 HB2 ARG 140 12.535 3.462 6.046 1067 HB3 ARG 140 HB3 ARG 140 10.848 3.760 5.686 1068 HG2 ARG 140 HG2 ARG 140 12.066 3.764 3.638 1069 HG3 ARG 140 HG3 ARG 140 11.563 5.421 3.982 1070 HD2 ARG 140 HD2 ARG 140 13.901 5.252 3.183 1071 HD3 ARG 140 HD3 ARG 140 13.776 5.986 4.776 1072 HE ARG 140 HE ARG 140 14.324 3.624 5.604 1073 HH11 ARG 140 HH11 ARG 140 15.631 4.983 2.611 1074 HH12 ARG 140 HH12 ARG 140 17.015 4.022 2.570 1075 HH21 ARG 140 HH21 ARG 140 16.328 2.325 5.666 1076 HH22 ARG 140 HH22 ARG 140 17.439 2.521 4.400 1077 H ALA 141 H ALA 141 9.576 4.618 7.597 1078 HA ALA 141 HA ALA 141 7.798 6.261 6.204 1079 HB1 ALA 141 HB1 ALA 141 6.171 5.487 7.903 1080 HB2 ALA 141 HB2 ALA 141 7.506 4.772 8.807 1081 HB3 ALA 141 HB3 ALA 141 7.113 4.178 7.192 1082 H GLN 142 H GLN 142 9.158 6.443 9.458 1083 HA GLN 142 HA GLN 142 7.827 8.762 10.305 1084 HB2 GLN 142 HB2 GLN 142 10.470 7.617 11.185 1085 HB3 GLN 142 HB3 GLN 142 9.691 8.979 11.970 1086 HG2 GLN 142 HG2 GLN 142 7.788 7.619 12.565 1087 HG3 GLN 142 HG3 GLN 142 8.458 6.251 11.683 1088 HE21 GLN 142 HE21 GLN 142 7.723 6.552 14.484 1089 HE22 GLN 142 HE22 GLN 142 9.124 6.134 15.397 1090 H ALA 143 H ALA 143 10.858 8.341 8.602 1091 HA ALA 143 HA ALA 143 11.626 11.054 8.678 1092 HB1 ALA 143 HB1 ALA 143 13.201 9.249 8.167 1093 HB2 ALA 143 HB2 ALA 143 13.190 10.469 6.898 1094 HB3 ALA 143 HB3 ALA 143 12.354 8.935 6.653 1095 H MET 144 H MET 144 9.720 9.160 6.440 1096 HA MET 144 HA MET 144 9.396 11.141 4.443 1097 HB2 MET 144 HB2 MET 144 9.036 8.752 4.038 1098 HB3 MET 144 HB3 MET 144 7.686 8.756 5.157 1099 HG2 MET 144 HG2 MET 144 6.820 8.735 2.940 1100 HG3 MET 144 HG3 MET 144 6.508 10.324 3.626 1101 HE1 MET 144 HE1 MET 144 5.935 11.160 1.151 1102 HE2 MET 144 HE2 MET 144 6.308 9.560 0.512 1103 HE3 MET 144 HE3 MET 144 7.033 10.994 -0.214 1104 H ALA 145 H ALA 145 7.545 10.267 7.305 1105 HA ALA 145 HA ALA 145 5.457 12.115 6.615 1106 HB1 ALA 145 HB1 ALA 145 4.901 9.972 7.662 1107 HB2 ALA 145 HB2 ALA 145 4.273 11.350 8.564 1108 HB3 ALA 145 HB3 ALA 145 5.711 10.504 9.134 1109 H TYR 146 H TYR 146 7.792 11.910 9.317 1110 HA TYR 146 HA TYR 146 6.961 14.597 10.077 1111 HB2 TYR 146 HB2 TYR 146 8.684 12.606 11.578 1112 HB3 TYR 146 HB3 TYR 146 8.158 14.169 12.187 1113 HD1 TYR 146 HD1 TYR 146 5.617 14.508 12.469 1114 HD2 TYR 146 HD2 TYR 146 7.404 10.688 11.937 1115 HE1 TYR 146 HE1 TYR 146 3.616 13.445 13.423 1116 HE2 TYR 146 HE2 TYR 146 5.411 9.615 12.891 1117 HH TYR 146 HH TYR 146 2.471 11.274 13.371 Start of MODEL 10 1 H MET 1 H MET 1 4.022 -16.182 27.157 2 HA MET 1 HA MET 1 4.798 -14.640 28.802 3 HB2 MET 1 HB2 MET 1 3.480 -13.412 26.370 4 HB3 MET 1 HB3 MET 1 4.553 -12.513 27.419 5 HG2 MET 1 HG2 MET 1 6.376 -14.030 26.889 6 HG3 MET 1 HG3 MET 1 5.310 -14.980 25.861 7 HE1 MET 1 HE1 MET 1 7.682 -13.226 23.280 8 HE2 MET 1 HE2 MET 1 7.054 -14.761 23.877 9 HE3 MET 1 HE3 MET 1 8.119 -13.792 24.893 10 HA PRO 2 HA PRO 2 1.401 -13.021 31.244 11 HB2 PRO 2 HB2 PRO 2 3.277 -11.647 32.955 12 HB3 PRO 2 HB3 PRO 2 2.372 -13.121 33.302 13 HG2 PRO 2 HG2 PRO 2 5.103 -13.020 32.975 14 HG3 PRO 2 HG3 PRO 2 4.118 -14.470 32.740 15 HD2 PRO 2 HD2 PRO 2 5.245 -12.590 30.716 16 HD3 PRO 2 HD3 PRO 2 5.069 -14.357 30.660 17 H GLY 3 H GLY 3 0.279 -11.284 30.644 18 HA2 GLY 3 HA2 GLY 3 1.369 -8.689 30.734 19 HA3 GLY 3 HA3 GLY 3 1.166 -9.247 29.075 20 H ARG 4 H ARG 4 -0.242 -7.438 31.255 21 HA ARG 4 HA ARG 4 -2.922 -8.400 31.083 22 HB2 ARG 4 HB2 ARG 4 -3.579 -6.316 32.167 23 HB3 ARG 4 HB3 ARG 4 -2.192 -7.008 32.997 24 HG2 ARG 4 HG2 ARG 4 -0.747 -5.385 31.790 25 HG3 ARG 4 HG3 ARG 4 -2.203 -4.679 31.091 26 HD2 ARG 4 HD2 ARG 4 -3.038 -4.228 33.366 27 HD3 ARG 4 HD3 ARG 4 -1.528 -4.860 34.018 28 HE ARG 4 HE ARG 4 -1.426 -2.654 32.124 29 HH11 ARG 4 HH11 ARG 4 -0.915 -3.802 35.443 30 HH12 ARG 4 HH12 ARG 4 -0.267 -2.329 35.991 31 HH21 ARG 4 HH21 ARG 4 -0.470 -0.656 32.891 32 HH22 ARG 4 HH22 ARG 4 0.057 -0.537 34.510 33 H ALA 5 H ALA 5 -4.507 -7.777 29.701 34 HA ALA 5 HA ALA 5 -3.606 -6.634 27.220 35 HB1 ALA 5 HB1 ALA 5 -5.871 -7.166 26.420 36 HB2 ALA 5 HB2 ALA 5 -6.339 -7.624 28.057 37 HB3 ALA 5 HB3 ALA 5 -5.117 -8.562 27.193 38 HA PRO 6 HA PRO 6 -4.874 -2.603 28.637 39 HB2 PRO 6 HB2 PRO 6 -4.417 -1.302 26.238 40 HB3 PRO 6 HB3 PRO 6 -3.184 -1.586 27.468 41 HG2 PRO 6 HG2 PRO 6 -3.655 -2.988 24.901 42 HG3 PRO 6 HG3 PRO 6 -2.149 -2.733 25.784 43 HD2 PRO 6 HD2 PRO 6 -3.548 -5.112 25.722 44 HD3 PRO 6 HD3 PRO 6 -2.391 -4.654 26.983 45 H GLY 7 H GLY 7 -6.950 -2.197 28.846 46 HA2 GLY 7 HA2 GLY 7 -8.910 -3.031 26.949 47 HA3 GLY 7 HA3 GLY 7 -9.187 -2.085 28.406 48 H SER 8 H SER 8 -7.603 0.052 27.974 49 HA SER 8 HA SER 8 -9.144 1.581 26.187 50 HB2 SER 8 HB2 SER 8 -6.513 2.257 27.517 51 HB3 SER 8 HB3 SER 8 -7.658 3.408 26.826 52 HG SER 8 HG SER 8 -8.957 1.816 28.549 53 H THR 9 H THR 9 -8.986 1.024 24.106 54 HA THR 9 HA THR 9 -6.332 0.916 22.846 55 HB THR 9 HB THR 9 -8.862 -0.542 21.986 56 HG1 THR 9 HG1 THR 9 -8.076 -1.386 23.926 57 HG21 THR 9 HG21 THR 9 -7.247 -0.094 20.168 58 HG22 THR 9 HG22 THR 9 -7.347 -1.818 20.530 59 HG23 THR 9 HG23 THR 9 -5.980 -0.874 21.114 60 H LEU 10 H LEU 10 -6.149 2.243 20.984 61 HA LEU 10 HA LEU 10 -8.238 4.197 20.654 62 HB2 LEU 10 HB2 LEU 10 -5.651 3.833 19.161 63 HB3 LEU 10 HB3 LEU 10 -6.745 5.179 18.962 64 HG LEU 10 HG LEU 10 -5.149 4.536 21.441 65 HD11 LEU 10 HD11 LEU 10 -4.006 6.631 20.891 66 HD12 LEU 10 HD12 LEU 10 -4.974 6.732 19.410 67 HD13 LEU 10 HD13 LEU 10 -3.826 5.411 19.624 68 HD21 LEU 10 HD21 LEU 10 -6.001 6.676 22.299 69 HD22 LEU 10 HD22 LEU 10 -7.310 5.525 22.040 70 HD23 LEU 10 HD23 LEU 10 -7.042 6.829 20.885 71 H ALA 11 H ALA 11 -9.376 4.551 18.796 72 HA ALA 11 HA ALA 11 -9.992 2.111 17.365 73 HB1 ALA 11 HB1 ALA 11 -11.826 3.488 18.236 74 HB2 ALA 11 HB2 ALA 11 -11.895 3.360 16.479 75 HB3 ALA 11 HB3 ALA 11 -11.284 4.832 17.232 76 H ARG 12 H ARG 12 -9.857 1.902 15.129 77 HA ARG 12 HA ARG 12 -8.153 3.900 13.841 78 HB2 ARG 12 HB2 ARG 12 -8.388 0.943 13.199 79 HB3 ARG 12 HB3 ARG 12 -7.454 2.095 12.273 80 HG2 ARG 12 HG2 ARG 12 -5.927 0.838 13.581 81 HG3 ARG 12 HG3 ARG 12 -6.032 2.428 14.332 82 HD2 ARG 12 HD2 ARG 12 -6.038 0.549 15.953 83 HD3 ARG 12 HD3 ARG 12 -7.475 1.570 16.059 84 HE ARG 12 HE ARG 12 -7.806 -0.668 14.318 85 HH11 ARG 12 HH11 ARG 12 -7.950 0.290 17.753 86 HH12 ARG 12 HH12 ARG 12 -9.085 -0.927 18.150 87 HH21 ARG 12 HH21 ARG 12 -9.412 -2.303 14.947 88 HH22 ARG 12 HH22 ARG 12 -9.914 -2.365 16.570 89 H VAL 13 H VAL 13 -9.484 5.143 12.719 90 HA VAL 13 HA VAL 13 -11.149 3.804 10.771 91 HB VAL 13 HB VAL 13 -12.806 5.756 10.906 92 HG11 VAL 13 HG11 VAL 13 -14.055 4.839 12.801 93 HG12 VAL 13 HG12 VAL 13 -12.611 3.969 13.326 94 HG13 VAL 13 HG13 VAL 13 -13.377 3.565 11.788 95 HG21 VAL 13 HG21 VAL 13 -11.478 6.211 13.582 96 HG22 VAL 13 HG22 VAL 13 -12.953 6.997 13.022 97 HG23 VAL 13 HG23 VAL 13 -11.419 7.317 12.210 98 H GLY 14 H GLY 14 -10.270 4.157 8.907 99 HA2 GLY 14 HA2 GLY 14 -9.428 6.854 8.260 100 HA3 GLY 14 HA3 GLY 14 -8.212 5.583 8.197 101 H SER 15 H SER 15 -10.911 6.999 6.677 102 HA SER 15 HA SER 15 -11.291 4.952 4.757 103 HB2 SER 15 HB2 SER 15 -12.498 6.905 3.558 104 HB3 SER 15 HB3 SER 15 -13.139 6.383 5.119 105 HG SER 15 HG SER 15 -11.169 8.360 5.113 106 H ILE 16 H ILE 16 -9.415 4.411 3.811 107 HA ILE 16 HA ILE 16 -7.583 6.386 2.825 108 HB ILE 16 HB ILE 16 -7.569 3.372 2.518 109 HG12 ILE 16 HG12 ILE 16 -7.430 4.010 4.880 110 HG13 ILE 16 HG13 ILE 16 -5.900 3.346 4.329 111 HG21 ILE 16 HG21 ILE 16 -5.197 3.596 1.976 112 HG22 ILE 16 HG22 ILE 16 -5.347 5.350 2.046 113 HG23 ILE 16 HG23 ILE 16 -6.215 4.439 0.807 114 HD11 ILE 16 HD11 ILE 16 -6.532 6.267 4.741 115 HD12 ILE 16 HD12 ILE 16 -4.997 5.622 4.155 116 HD13 ILE 16 HD13 ILE 16 -5.548 5.243 5.788 117 HA PRO 17 HA PRO 17 -9.565 6.321 -1.214 118 HB2 PRO 17 HB2 PRO 17 -8.094 8.308 -2.289 119 HB3 PRO 17 HB3 PRO 17 -9.408 8.639 -1.157 120 HG2 PRO 17 HG2 PRO 17 -6.462 8.574 -0.680 121 HG3 PRO 17 HG3 PRO 17 -7.673 9.696 -0.034 122 HD2 PRO 17 HD2 PRO 17 -6.639 7.568 1.350 123 HD3 PRO 17 HD3 PRO 17 -8.229 8.284 1.677 124 H ALA 18 H ALA 18 -8.735 5.892 -3.402 125 HA ALA 18 HA ALA 18 -5.996 4.832 -3.417 126 HB1 ALA 18 HB1 ALA 18 -8.408 3.769 -4.915 127 HB2 ALA 18 HB2 ALA 18 -7.630 3.000 -3.529 128 HB3 ALA 18 HB3 ALA 18 -6.758 3.159 -5.053 129 H GLY 19 H GLY 19 -4.749 5.901 -4.807 130 HA2 GLY 19 HA2 GLY 19 -6.114 7.593 -6.782 131 HA3 GLY 19 HA3 GLY 19 -4.508 7.881 -6.136 132 H ASP 20 H ASP 20 -2.773 6.539 -6.851 133 HA ASP 20 HA ASP 20 -3.334 5.304 -9.446 134 HB2 ASP 20 HB2 ASP 20 -2.438 7.553 -9.822 135 HB3 ASP 20 HB3 ASP 20 -1.051 7.183 -8.810 136 H ASP 21 H ASP 21 -2.126 3.584 -9.977 137 HA ASP 21 HA ASP 21 -0.947 2.114 -7.828 138 HB2 ASP 21 HB2 ASP 21 -2.240 0.876 -9.371 139 HB3 ASP 21 HB3 ASP 21 -1.333 1.495 -10.744 140 H VAL 22 H VAL 22 1.065 1.502 -7.508 141 HA VAL 22 HA VAL 22 3.130 2.994 -8.951 142 HB VAL 22 HB VAL 22 3.104 2.204 -6.016 143 HG11 VAL 22 HG11 VAL 22 5.167 3.494 -5.784 144 HG12 VAL 22 HG12 VAL 22 5.181 3.793 -7.523 145 HG13 VAL 22 HG13 VAL 22 5.382 2.152 -6.911 146 HG21 VAL 22 HG21 VAL 22 3.044 4.649 -5.624 147 HG22 VAL 22 HG22 VAL 22 1.614 4.039 -6.464 148 HG23 VAL 22 HG23 VAL 22 2.876 4.883 -7.358 149 H LEU 23 H LEU 23 1.979 -0.175 -8.263 150 HA LEU 23 HA LEU 23 4.675 -1.152 -8.670 151 HB2 LEU 23 HB2 LEU 23 3.787 -3.452 -8.103 152 HB3 LEU 23 HB3 LEU 23 3.865 -2.308 -6.796 153 HG LEU 23 HG LEU 23 1.435 -2.062 -6.842 154 HD11 LEU 23 HD11 LEU 23 0.045 -3.588 -8.204 155 HD12 LEU 23 HD12 LEU 23 1.498 -4.195 -9.002 156 HD13 LEU 23 HD13 LEU 23 1.000 -2.520 -9.234 157 HD21 LEU 23 HD21 LEU 23 2.364 -4.917 -6.741 158 HD22 LEU 23 HD22 LEU 23 0.869 -4.297 -6.042 159 HD23 LEU 23 HD23 LEU 23 2.426 -3.740 -5.430 160 H ASP 24 H ASP 24 4.525 -3.418 -9.887 161 HA ASP 24 HA ASP 24 3.241 -2.735 -12.409 162 HB2 ASP 24 HB2 ASP 24 5.723 -3.036 -12.478 163 HB3 ASP 24 HB3 ASP 24 5.498 -4.700 -11.935 164 HA PRO 25 HA PRO 25 0.227 -5.903 -11.630 165 HB2 PRO 25 HB2 PRO 25 -0.010 -6.803 -14.272 166 HB3 PRO 25 HB3 PRO 25 -0.941 -5.507 -13.518 167 HG2 PRO 25 HG2 PRO 25 1.489 -5.338 -15.242 168 HG3 PRO 25 HG3 PRO 25 0.070 -4.275 -15.196 169 HD2 PRO 25 HD2 PRO 25 2.363 -3.526 -14.096 170 HD3 PRO 25 HD3 PRO 25 0.822 -3.158 -13.291 171 H ASP 26 H ASP 26 3.241 -6.644 -13.215 172 HA ASP 26 HA ASP 26 2.917 -9.493 -13.250 173 HB2 ASP 26 HB2 ASP 26 4.474 -8.388 -14.760 174 HB3 ASP 26 HB3 ASP 26 5.426 -7.815 -13.398 175 H GLU 27 H GLU 27 3.688 -7.250 -10.793 176 HA GLU 27 HA GLU 27 5.050 -9.248 -9.202 177 HB2 GLU 27 HB2 GLU 27 4.395 -6.358 -8.581 178 HB3 GLU 27 HB3 GLU 27 5.360 -7.411 -7.555 179 HG2 GLU 27 HG2 GLU 27 6.832 -7.705 -9.672 180 HG3 GLU 27 HG3 GLU 27 6.027 -6.237 -10.213 181 HA PRO 28 HA PRO 28 1.726 -10.926 -6.860 182 HB2 PRO 28 HB2 PRO 28 2.555 -10.145 -4.247 183 HB3 PRO 28 HB3 PRO 28 2.859 -11.687 -5.054 184 HG2 PRO 28 HG2 PRO 28 4.584 -9.277 -4.810 185 HG3 PRO 28 HG3 PRO 28 5.046 -10.986 -4.886 186 HD2 PRO 28 HD2 PRO 28 5.418 -9.389 -6.973 187 HD3 PRO 28 HD3 PRO 28 4.857 -11.057 -7.202 188 H THR 29 H THR 29 -0.183 -9.958 -7.154 189 HA THR 29 HA THR 29 -0.848 -7.525 -5.653 190 HB THR 29 HB THR 29 -2.474 -7.137 -7.555 191 HG1 THR 29 HG1 THR 29 -1.993 -8.213 -9.513 192 HG21 THR 29 HG21 THR 29 -0.395 -5.839 -7.383 193 HG22 THR 29 HG22 THR 29 -0.789 -6.170 -9.070 194 HG23 THR 29 HG23 THR 29 0.470 -7.102 -8.261 195 H TYR 30 H TYR 30 -3.211 -7.360 -5.222 196 HA TYR 30 HA TYR 30 -4.730 -9.807 -5.496 197 HB2 TYR 30 HB2 TYR 30 -4.507 -8.015 -3.089 198 HB3 TYR 30 HB3 TYR 30 -5.983 -8.904 -3.424 199 HD1 TYR 30 HD1 TYR 30 -5.121 -11.503 -4.257 200 HD2 TYR 30 HD2 TYR 30 -3.438 -8.962 -1.304 201 HE1 TYR 30 HE1 TYR 30 -4.223 -13.463 -3.104 202 HE2 TYR 30 HE2 TYR 30 -2.538 -10.919 -0.130 203 HH TYR 30 HH TYR 30 -2.986 -13.289 0.051 204 H ASP 31 H ASP 31 -7.020 -9.327 -5.624 205 HA ASP 31 HA ASP 31 -7.708 -6.594 -6.411 206 HB2 ASP 31 HB2 ASP 31 -7.173 -8.132 -8.452 207 HB3 ASP 31 HB3 ASP 31 -8.581 -9.062 -7.967 208 H LEU 32 H LEU 32 -10.265 -6.692 -6.555 209 HA LEU 32 HA LEU 32 -11.090 -7.177 -3.952 210 HB2 LEU 32 HB2 LEU 32 -12.776 -6.719 -6.387 211 HB3 LEU 32 HB3 LEU 32 -13.452 -6.886 -4.785 212 HG LEU 32 HG LEU 32 -13.376 -4.622 -5.192 213 HD11 LEU 32 HD11 LEU 32 -10.957 -5.181 -3.521 214 HD12 LEU 32 HD12 LEU 32 -12.636 -5.136 -2.985 215 HD13 LEU 32 HD13 LEU 32 -11.859 -3.667 -3.571 216 HD21 LEU 32 HD21 LEU 32 -11.428 -3.353 -5.965 217 HD22 LEU 32 HD22 LEU 32 -11.921 -4.572 -7.139 218 HD23 LEU 32 HD23 LEU 32 -10.513 -4.852 -6.111 219 HA PRO 33 HA PRO 33 -13.564 -11.176 -5.359 220 HB2 PRO 33 HB2 PRO 33 -12.320 -12.460 -7.496 221 HB3 PRO 33 HB3 PRO 33 -13.802 -11.513 -7.615 222 HG2 PRO 33 HG2 PRO 33 -10.984 -10.710 -8.191 223 HG3 PRO 33 HG3 PRO 33 -12.466 -10.331 -9.093 224 HD2 PRO 33 HD2 PRO 33 -11.351 -8.525 -7.500 225 HD3 PRO 33 HD3 PRO 33 -13.119 -8.704 -7.559 226 H ARG 34 H ARG 34 -10.061 -11.009 -6.051 227 HA ARG 34 HA ARG 34 -9.551 -13.548 -5.018 228 HB2 ARG 34 HB2 ARG 34 -8.125 -12.264 -6.666 229 HB3 ARG 34 HB3 ARG 34 -7.520 -11.346 -5.292 230 HG2 ARG 34 HG2 ARG 34 -6.008 -13.168 -5.900 231 HG3 ARG 34 HG3 ARG 34 -6.674 -13.398 -4.280 232 HD2 ARG 34 HD2 ARG 34 -8.292 -14.960 -5.095 233 HD3 ARG 34 HD3 ARG 34 -7.821 -14.618 -6.764 234 HE ARG 34 HE ARG 34 -5.671 -15.574 -5.161 235 HH11 ARG 34 HH11 ARG 34 -8.551 -16.765 -6.904 236 HH12 ARG 34 HH12 ARG 34 -7.913 -18.339 -7.084 237 HH21 ARG 34 HH21 ARG 34 -4.876 -17.762 -5.424 238 HH22 ARG 34 HH22 ARG 34 -5.845 -18.910 -6.250 239 H VAL 35 H VAL 35 -9.435 -10.315 -3.556 240 HA VAL 35 HA VAL 35 -8.271 -11.283 -1.150 241 HB VAL 35 HB VAL 35 -9.972 -8.772 -1.443 242 HG11 VAL 35 HG11 VAL 35 -8.789 -7.969 0.557 243 HG12 VAL 35 HG12 VAL 35 -7.956 -9.520 0.674 244 HG13 VAL 35 HG13 VAL 35 -9.705 -9.442 0.881 245 HG21 VAL 35 HG21 VAL 35 -8.082 -8.710 -2.963 246 HG22 VAL 35 HG22 VAL 35 -6.990 -9.078 -1.627 247 HG23 VAL 35 HG23 VAL 35 -7.873 -7.550 -1.648 248 H ALA 36 H ALA 36 -11.507 -10.816 -2.293 249 HA ALA 36 HA ALA 36 -12.930 -11.448 -0.008 250 HB1 ALA 36 HB1 ALA 36 -13.596 -12.120 -2.882 251 HB2 ALA 36 HB2 ALA 36 -13.925 -10.581 -2.084 252 HB3 ALA 36 HB3 ALA 36 -14.737 -12.046 -1.533 253 H GLU 37 H GLU 37 -11.523 -13.499 -2.475 254 HA GLU 37 HA GLU 37 -12.314 -16.056 -1.588 255 HB2 GLU 37 HB2 GLU 37 -11.183 -15.298 -3.776 256 HB3 GLU 37 HB3 GLU 37 -9.731 -15.259 -2.860 257 HG2 GLU 37 HG2 GLU 37 -9.783 -17.329 -4.080 258 HG3 GLU 37 HG3 GLU 37 -9.835 -17.621 -2.349 259 H LEU 38 H LEU 38 -9.457 -14.099 -0.979 260 HA LEU 38 HA LEU 38 -7.887 -15.903 0.468 261 HB2 LEU 38 HB2 LEU 38 -7.051 -13.886 -0.610 262 HB3 LEU 38 HB3 LEU 38 -7.935 -12.893 0.528 263 HG LEU 38 HG LEU 38 -6.525 -13.932 2.344 264 HD11 LEU 38 HD11 LEU 38 -4.886 -14.846 -0.011 265 HD12 LEU 38 HD12 LEU 38 -5.734 -15.886 1.134 266 HD13 LEU 38 HD13 LEU 38 -4.377 -14.898 1.674 267 HD21 LEU 38 HD21 LEU 38 -4.614 -12.455 1.889 268 HD22 LEU 38 HD22 LEU 38 -6.152 -11.666 1.538 269 HD23 LEU 38 HD23 LEU 38 -5.157 -12.283 0.222 270 H LEU 39 H LEU 39 -10.147 -13.424 1.558 271 HA LEU 39 HA LEU 39 -9.621 -14.181 4.319 272 HB2 LEU 39 HB2 LEU 39 -11.219 -11.905 3.199 273 HB3 LEU 39 HB3 LEU 39 -10.883 -12.160 4.904 274 HG LEU 39 HG LEU 39 -8.873 -11.519 2.745 275 HD11 LEU 39 HD11 LEU 39 -8.609 -9.407 3.945 276 HD12 LEU 39 HD12 LEU 39 -9.912 -9.874 5.040 277 HD13 LEU 39 HD13 LEU 39 -10.246 -9.619 3.328 278 HD21 LEU 39 HD21 LEU 39 -7.862 -12.966 4.416 279 HD22 LEU 39 HD22 LEU 39 -8.475 -11.933 5.710 280 HD23 LEU 39 HD23 LEU 39 -7.257 -11.321 4.590 281 H GLY 40 H GLY 40 -11.883 -14.858 1.891 282 HA2 GLY 40 HA2 GLY 40 -13.710 -16.253 1.959 283 HA3 GLY 40 HA3 GLY 40 -13.504 -16.396 3.700 284 H VAL 41 H VAL 41 -13.619 -13.287 2.358 285 HA VAL 41 HA VAL 41 -16.255 -12.838 3.600 286 HB VAL 41 HB VAL 41 -15.545 -10.578 4.132 287 HG11 VAL 41 HG11 VAL 41 -13.498 -12.573 5.058 288 HG12 VAL 41 HG12 VAL 41 -15.055 -12.220 5.814 289 HG13 VAL 41 HG13 VAL 41 -13.786 -10.996 5.790 290 HG21 VAL 41 HG21 VAL 41 -13.145 -9.868 3.775 291 HG22 VAL 41 HG22 VAL 41 -14.106 -10.039 2.298 292 HG23 VAL 41 HG23 VAL 41 -12.979 -11.299 2.743 293 HA PRO 42 HA PRO 42 -17.360 -11.269 -0.401 294 HB2 PRO 42 HB2 PRO 42 -19.248 -9.424 0.142 295 HB3 PRO 42 HB3 PRO 42 -19.541 -11.154 0.379 296 HG2 PRO 42 HG2 PRO 42 -18.792 -9.070 2.390 297 HG3 PRO 42 HG3 PRO 42 -20.016 -10.348 2.512 298 HD2 PRO 42 HD2 PRO 42 -17.541 -10.552 3.614 299 HD3 PRO 42 HD3 PRO 42 -18.452 -11.959 3.034 300 H VAL 43 H VAL 43 -17.489 -9.224 -1.672 301 HA VAL 43 HA VAL 43 -15.169 -7.665 -1.470 302 HB VAL 43 HB VAL 43 -17.719 -6.899 -2.913 303 HG11 VAL 43 HG11 VAL 43 -14.865 -6.060 -3.409 304 HG12 VAL 43 HG12 VAL 43 -16.165 -5.045 -2.784 305 HG13 VAL 43 HG13 VAL 43 -16.242 -5.654 -4.436 306 HG21 VAL 43 HG21 VAL 43 -16.742 -8.028 -4.862 307 HG22 VAL 43 HG22 VAL 43 -17.047 -9.114 -3.508 308 HG23 VAL 43 HG23 VAL 43 -15.401 -8.576 -3.843 309 H SER 44 H SER 44 -18.382 -7.142 -0.271 310 HA SER 44 HA SER 44 -18.407 -4.497 0.428 311 HB2 SER 44 HB2 SER 44 -19.494 -6.818 1.996 312 HB3 SER 44 HB3 SER 44 -20.179 -5.179 1.912 313 HG SER 44 HG SER 44 -20.698 -5.574 -0.234 314 H LYS 45 H LYS 45 -17.193 -7.328 2.316 315 HA LYS 45 HA LYS 45 -16.387 -5.731 4.523 316 HB2 LYS 45 HB2 LYS 45 -15.873 -8.581 3.806 317 HB3 LYS 45 HB3 LYS 45 -15.028 -7.831 5.151 318 HG2 LYS 45 HG2 LYS 45 -17.232 -7.293 6.160 319 HG3 LYS 45 HG3 LYS 45 -18.003 -8.194 4.849 320 HD2 LYS 45 HD2 LYS 45 -16.922 -10.223 5.517 321 HD3 LYS 45 HD3 LYS 45 -15.913 -9.359 6.673 322 HE2 LYS 45 HE2 LYS 45 -17.876 -8.847 7.993 323 HE3 LYS 45 HE3 LYS 45 -18.907 -9.653 6.811 324 HZ1 LYS 45 HZ1 LYS 45 -18.360 -11.077 8.720 325 HZ2 LYS 45 HZ2 LYS 45 -16.729 -10.964 8.336 326 HZ3 LYS 45 HZ3 LYS 45 -17.794 -11.719 7.274 327 H VAL 46 H VAL 46 -14.790 -6.890 1.665 328 HA VAL 46 HA VAL 46 -12.125 -6.357 2.420 329 HB VAL 46 HB VAL 46 -13.350 -6.167 -0.361 330 HG11 VAL 46 HG11 VAL 46 -10.469 -6.499 0.458 331 HG12 VAL 46 HG12 VAL 46 -11.195 -5.057 -0.243 332 HG13 VAL 46 HG13 VAL 46 -11.078 -6.538 -1.201 333 HG21 VAL 46 HG21 VAL 46 -13.708 -8.367 0.626 334 HG22 VAL 46 HG22 VAL 46 -11.991 -8.490 1.010 335 HG23 VAL 46 HG23 VAL 46 -12.518 -8.460 -0.672 336 H ALA 47 H ALA 47 -14.573 -4.362 0.842 337 HA ALA 47 HA ALA 47 -13.056 -2.030 0.535 338 HB1 ALA 47 HB1 ALA 47 -16.031 -2.307 0.985 339 HB2 ALA 47 HB2 ALA 47 -15.215 -2.370 -0.577 340 HB3 ALA 47 HB3 ALA 47 -15.214 -0.874 0.360 341 H GLN 48 H GLN 48 -14.955 -3.266 3.205 342 HA GLN 48 HA GLN 48 -14.668 -0.993 4.852 343 HB2 GLN 48 HB2 GLN 48 -15.420 -3.817 5.504 344 HB3 GLN 48 HB3 GLN 48 -15.229 -2.601 6.757 345 HG2 GLN 48 HG2 GLN 48 -17.129 -2.471 4.435 346 HG3 GLN 48 HG3 GLN 48 -17.545 -2.840 6.108 347 HE21 GLN 48 HE21 GLN 48 -15.669 -0.792 7.198 348 HE22 GLN 48 HE22 GLN 48 -16.424 0.710 6.868 349 H GLN 49 H GLN 49 -12.689 -3.859 4.486 350 HA GLN 49 HA GLN 49 -11.011 -3.567 6.720 351 HB2 GLN 49 HB2 GLN 49 -10.127 -4.425 3.953 352 HB3 GLN 49 HB3 GLN 49 -9.333 -4.814 5.469 353 HG2 GLN 49 HG2 GLN 49 -12.070 -5.759 4.648 354 HG3 GLN 49 HG3 GLN 49 -10.582 -6.693 4.522 355 HE21 GLN 49 HE21 GLN 49 -9.702 -7.558 6.348 356 HE22 GLN 49 HE22 GLN 49 -10.532 -7.626 7.855 357 H LEU 50 H LEU 50 -10.858 -2.209 3.522 358 HA LEU 50 HA LEU 50 -8.514 -0.665 3.731 359 HB2 LEU 50 HB2 LEU 50 -9.587 -1.210 1.620 360 HB3 LEU 50 HB3 LEU 50 -11.000 -0.289 2.071 361 HG LEU 50 HG LEU 50 -9.694 1.788 1.930 362 HD11 LEU 50 HD11 LEU 50 -7.477 -0.016 0.990 363 HD12 LEU 50 HD12 LEU 50 -7.499 0.905 2.495 364 HD13 LEU 50 HD13 LEU 50 -7.466 1.744 0.946 365 HD21 LEU 50 HD21 LEU 50 -9.540 0.019 -0.495 366 HD22 LEU 50 HD22 LEU 50 -9.388 1.773 -0.493 367 HD23 LEU 50 HD23 LEU 50 -10.908 1.020 -0.007 368 H ARG 51 H ARG 51 -11.878 0.079 4.483 369 HA ARG 51 HA ARG 51 -11.394 2.806 5.155 370 HB2 ARG 51 HB2 ARG 51 -13.785 1.046 5.415 371 HB3 ARG 51 HB3 ARG 51 -13.728 2.532 6.344 372 HG2 ARG 51 HG2 ARG 51 -14.949 2.846 4.268 373 HG3 ARG 51 HG3 ARG 51 -13.482 3.818 4.277 374 HD2 ARG 51 HD2 ARG 51 -12.378 2.192 2.871 375 HD3 ARG 51 HD3 ARG 51 -13.795 1.150 2.928 376 HE ARG 51 HE ARG 51 -14.448 3.719 1.974 377 HH11 ARG 51 HH11 ARG 51 -12.916 0.687 1.013 378 HH12 ARG 51 HH12 ARG 51 -13.244 0.880 -0.661 379 HH21 ARG 51 HH21 ARG 51 -14.964 3.931 -0.324 380 HH22 ARG 51 HH22 ARG 51 -14.478 2.715 -1.421 381 H GLU 52 H GLU 52 -10.977 -0.088 6.943 382 HA GLU 52 HA GLU 52 -11.301 1.147 9.513 383 HB2 GLU 52 HB2 GLU 52 -9.846 -1.409 8.802 384 HB3 GLU 52 HB3 GLU 52 -10.324 -0.913 10.414 385 HG2 GLU 52 HG2 GLU 52 -12.165 -1.664 8.147 386 HG3 GLU 52 HG3 GLU 52 -11.791 -2.643 9.559 387 H GLY 53 H GLY 53 -8.944 1.320 7.114 388 HA2 GLY 53 HA2 GLY 53 -6.919 2.450 7.117 389 HA3 GLY 53 HA3 GLY 53 -7.124 2.738 8.840 390 H HIS 54 H HIS 54 -7.481 -0.432 7.723 391 HA HIS 54 HA HIS 54 -4.932 -1.205 8.970 392 HB2 HIS 54 HB2 HIS 54 -7.506 -2.729 8.531 393 HB3 HIS 54 HB3 HIS 54 -6.007 -3.533 8.955 394 HD1 HIS 54 HD1 HIS 54 -6.350 -4.268 11.321 395 HD2 HIS 54 HD2 HIS 54 -7.659 -0.373 10.706 396 HE1 HIS 54 HE1 HIS 54 -7.097 -3.419 13.569 397 H LEU 55 H LEU 55 -5.979 -0.468 6.001 398 HA LEU 55 HA LEU 55 -4.100 -2.157 4.680 399 HB2 LEU 55 HB2 LEU 55 -6.146 -3.589 4.949 400 HB3 LEU 55 HB3 LEU 55 -7.040 -2.409 4.028 401 HG LEU 55 HG LEU 55 -5.674 -2.903 2.053 402 HD11 LEU 55 HD11 LEU 55 -4.385 -4.978 3.833 403 HD12 LEU 55 HD12 LEU 55 -3.594 -3.550 3.159 404 HD13 LEU 55 HD13 LEU 55 -4.149 -4.837 2.092 405 HD21 LEU 55 HD21 LEU 55 -6.918 -5.291 3.406 406 HD22 LEU 55 HD22 LEU 55 -6.522 -5.198 1.693 407 HD23 LEU 55 HD23 LEU 55 -7.734 -4.117 2.377 408 H VAL 56 H VAL 56 -3.854 -1.429 2.404 409 HA VAL 56 HA VAL 56 -5.186 1.092 1.733 410 HB VAL 56 HB VAL 56 -2.187 0.557 1.518 411 HG11 VAL 56 HG11 VAL 56 -3.720 2.989 0.588 412 HG12 VAL 56 HG12 VAL 56 -2.969 1.782 -0.448 413 HG13 VAL 56 HG13 VAL 56 -1.964 2.804 0.585 414 HG21 VAL 56 HG21 VAL 56 -3.700 2.619 3.103 415 HG22 VAL 56 HG22 VAL 56 -1.944 2.504 2.965 416 HG23 VAL 56 HG23 VAL 56 -2.859 1.209 3.740 417 H ALA 57 H ALA 57 -5.418 1.398 -0.539 418 HA ALA 57 HA ALA 57 -4.753 -0.896 -2.206 419 HB1 ALA 57 HB1 ALA 57 -7.095 -1.105 -1.465 420 HB2 ALA 57 HB2 ALA 57 -6.986 -0.788 -3.195 421 HB3 ALA 57 HB3 ALA 57 -7.424 0.511 -2.087 422 H VAL 58 H VAL 58 -4.746 -0.301 -4.479 423 HA VAL 58 HA VAL 58 -4.598 2.561 -4.989 424 HB VAL 58 HB VAL 58 -2.688 2.132 -6.595 425 HG11 VAL 58 HG11 VAL 58 -2.337 3.258 -4.494 426 HG12 VAL 58 HG12 VAL 58 -0.964 2.210 -4.859 427 HG13 VAL 58 HG13 VAL 58 -2.170 1.714 -3.661 428 HG21 VAL 58 HG21 VAL 58 -2.852 -0.292 -6.754 429 HG22 VAL 58 HG22 VAL 58 -2.473 -0.449 -5.039 430 HG23 VAL 58 HG23 VAL 58 -1.258 0.167 -6.156 431 H ARG 59 H ARG 59 -4.542 2.959 -7.405 432 HA ARG 59 HA ARG 59 -6.476 1.125 -8.651 433 HB2 ARG 59 HB2 ARG 59 -7.581 3.121 -7.864 434 HB3 ARG 59 HB3 ARG 59 -6.379 4.134 -8.638 435 HG2 ARG 59 HG2 ARG 59 -7.145 3.371 -10.826 436 HG3 ARG 59 HG3 ARG 59 -8.361 2.360 -10.043 437 HD2 ARG 59 HD2 ARG 59 -9.306 4.472 -10.812 438 HD3 ARG 59 HD3 ARG 59 -9.390 4.334 -9.058 439 HE ARG 59 HE ARG 59 -7.050 5.686 -9.550 440 HH11 ARG 59 HH11 ARG 59 -10.465 6.229 -10.306 441 HH12 ARG 59 HH12 ARG 59 -10.333 7.928 -10.325 442 HH21 ARG 59 HH21 ARG 59 -6.866 8.033 -9.607 443 HH22 ARG 59 HH22 ARG 59 -8.248 8.962 -9.928 444 H ARG 60 H ARG 60 -5.840 0.337 -10.535 445 HA ARG 60 HA ARG 60 -3.862 1.916 -11.993 446 HB2 ARG 60 HB2 ARG 60 -2.658 0.051 -12.740 447 HB3 ARG 60 HB3 ARG 60 -3.015 -0.370 -11.085 448 HG2 ARG 60 HG2 ARG 60 -4.421 -1.446 -13.537 449 HG3 ARG 60 HG3 ARG 60 -3.153 -2.268 -12.645 450 HD2 ARG 60 HD2 ARG 60 -4.645 -2.294 -10.672 451 HD3 ARG 60 HD3 ARG 60 -5.914 -1.570 -11.665 452 HE ARG 60 HE ARG 60 -4.795 -3.939 -12.801 453 HH11 ARG 60 HH11 ARG 60 -7.304 -2.735 -10.645 454 HH12 ARG 60 HH12 ARG 60 -8.216 -4.178 -10.663 455 HH21 ARG 60 HH21 ARG 60 -6.038 -5.900 -12.835 456 HH22 ARG 60 HH22 ARG 60 -7.487 -6.012 -11.929 457 H ALA 61 H ALA 61 -4.611 2.778 -13.638 458 HA ALA 61 HA ALA 61 -5.588 3.243 -15.615 459 HB1 ALA 61 HB1 ALA 61 -6.519 0.360 -15.677 460 HB2 ALA 61 HB2 ALA 61 -5.007 0.959 -16.360 461 HB3 ALA 61 HB3 ALA 61 -6.550 1.487 -17.035 462 H GLY 62 H GLY 62 -7.531 1.291 -13.646 463 HA2 GLY 62 HA2 GLY 62 -9.501 3.243 -13.080 464 HA3 GLY 62 HA3 GLY 62 -10.108 2.160 -14.329 465 H GLY 63 H GLY 63 -8.191 0.059 -12.699 466 HA2 GLY 63 HA2 GLY 63 -10.439 -0.748 -11.017 467 HA3 GLY 63 HA3 GLY 63 -9.221 -1.807 -11.713 468 H VAL 64 H VAL 64 -10.152 -1.381 -8.984 469 HA VAL 64 HA VAL 64 -7.779 -0.268 -7.705 470 HB VAL 64 HB VAL 64 -10.452 -1.127 -6.526 471 HG11 VAL 64 HG11 VAL 64 -8.658 -1.452 -4.896 472 HG12 VAL 64 HG12 VAL 64 -9.690 -0.096 -4.437 473 HG13 VAL 64 HG13 VAL 64 -8.110 0.202 -5.163 474 HG21 VAL 64 HG21 VAL 64 -10.810 1.259 -6.152 475 HG22 VAL 64 HG22 VAL 64 -10.566 0.922 -7.865 476 HG23 VAL 64 HG23 VAL 64 -9.258 1.619 -6.911 477 H VAL 65 H VAL 65 -6.311 -1.447 -6.809 478 HA VAL 65 HA VAL 65 -6.696 -4.304 -6.295 479 HB VAL 65 HB VAL 65 -4.194 -4.477 -7.031 480 HG11 VAL 65 HG11 VAL 65 -4.880 -5.080 -9.300 481 HG12 VAL 65 HG12 VAL 65 -6.412 -4.243 -9.051 482 HG13 VAL 65 HG13 VAL 65 -6.026 -5.675 -8.098 483 HG21 VAL 65 HG21 VAL 65 -3.627 -3.013 -8.923 484 HG22 VAL 65 HG22 VAL 65 -3.862 -2.087 -7.434 485 HG23 VAL 65 HG23 VAL 65 -5.132 -2.123 -8.658 486 H ILE 66 H ILE 66 -5.157 -5.142 -4.892 487 HA ILE 66 HA ILE 66 -4.046 -3.153 -3.047 488 HB ILE 66 HB ILE 66 -5.348 -5.812 -2.341 489 HG12 ILE 66 HG12 ILE 66 -6.320 -2.990 -1.834 490 HG13 ILE 66 HG13 ILE 66 -6.971 -4.070 -3.058 491 HG21 ILE 66 HG21 ILE 66 -5.070 -5.081 -0.010 492 HG22 ILE 66 HG22 ILE 66 -4.230 -3.636 -0.566 493 HG23 ILE 66 HG23 ILE 66 -3.515 -5.229 -0.833 494 HD11 ILE 66 HD11 ILE 66 -7.711 -5.589 -1.265 495 HD12 ILE 66 HD12 ILE 66 -8.416 -3.978 -1.133 496 HD13 ILE 66 HD13 ILE 66 -7.086 -4.442 -0.080 497 HA PRO 67 HA PRO 67 -0.382 -5.517 -4.261 498 HB2 PRO 67 HB2 PRO 67 0.678 -4.221 -1.799 499 HB3 PRO 67 HB3 PRO 67 1.365 -4.265 -3.425 500 HG2 PRO 67 HG2 PRO 67 0.241 -2.045 -2.518 501 HG3 PRO 67 HG3 PRO 67 -0.009 -2.555 -4.196 502 HD2 PRO 67 HD2 PRO 67 -1.861 -2.776 -1.859 503 HD3 PRO 67 HD3 PRO 67 -2.214 -2.372 -3.556 504 H GLN 68 H GLN 68 -0.070 -7.649 -3.731 505 HA GLN 68 HA GLN 68 -1.232 -8.828 -1.493 506 HB2 GLN 68 HB2 GLN 68 -0.921 -9.994 -3.535 507 HB3 GLN 68 HB3 GLN 68 0.816 -9.785 -3.469 508 HG2 GLN 68 HG2 GLN 68 0.992 -11.322 -1.646 509 HG3 GLN 68 HG3 GLN 68 -0.761 -11.375 -1.460 510 HE21 GLN 68 HE21 GLN 68 -1.238 -11.453 -4.386 511 HE22 GLN 68 HE22 GLN 68 -0.826 -13.042 -4.831 512 H VAL 69 H VAL 69 1.783 -7.377 -1.975 513 HA VAL 69 HA VAL 69 3.276 -8.584 0.097 514 HB VAL 69 HB VAL 69 4.796 -6.626 -0.175 515 HG11 VAL 69 HG11 VAL 69 5.416 -7.121 -2.503 516 HG12 VAL 69 HG12 VAL 69 3.863 -7.920 -2.745 517 HG13 VAL 69 HG13 VAL 69 5.036 -8.591 -1.609 518 HG21 VAL 69 HG21 VAL 69 2.681 -5.710 -2.131 519 HG22 VAL 69 HG22 VAL 69 4.292 -5.000 -1.983 520 HG23 VAL 69 HG23 VAL 69 3.158 -4.905 -0.637 521 H PHE 70 H PHE 70 0.601 -6.582 0.356 522 HA PHE 70 HA PHE 70 1.388 -5.334 2.850 523 HB2 PHE 70 HB2 PHE 70 -1.049 -5.225 1.106 524 HB3 PHE 70 HB3 PHE 70 -1.221 -4.804 2.805 525 HD1 PHE 70 HD1 PHE 70 1.494 -4.095 0.332 526 HD2 PHE 70 HD2 PHE 70 -1.449 -2.536 2.972 527 HE1 PHE 70 HE1 PHE 70 2.334 -1.815 -0.074 528 HE2 PHE 70 HE2 PHE 70 -0.611 -0.266 2.584 529 HZ PHE 70 HZ PHE 70 1.267 0.104 1.064 530 H PHE 71 H PHE 71 0.467 -8.291 1.871 531 HA PHE 71 HA PHE 71 -0.665 -8.991 4.472 532 HB2 PHE 71 HB2 PHE 71 -1.067 -10.329 1.778 533 HB3 PHE 71 HB3 PHE 71 -1.628 -10.970 3.311 534 HD1 PHE 71 HD1 PHE 71 -2.118 -8.353 0.785 535 HD2 PHE 71 HD2 PHE 71 -3.600 -10.121 4.360 536 HE1 PHE 71 HE1 PHE 71 -4.250 -7.167 0.485 537 HE2 PHE 71 HE2 PHE 71 -5.735 -8.943 4.061 538 HZ PHE 71 HZ PHE 71 -6.063 -7.464 2.124 539 H THR 72 H THR 72 0.040 -11.057 5.186 540 HA THR 72 HA THR 72 2.793 -11.601 4.482 541 HB THR 72 HB THR 72 2.621 -13.275 6.345 542 HG1 THR 72 HG1 THR 72 0.099 -12.100 6.812 543 HG21 THR 72 HG21 THR 72 2.398 -11.632 8.168 544 HG22 THR 72 HG22 THR 72 1.678 -10.485 7.043 545 HG23 THR 72 HG23 THR 72 3.361 -10.983 6.842 546 H ASN 73 H ASN 73 3.384 -13.904 3.996 547 HA ASN 73 HA ASN 73 1.692 -15.008 2.026 548 HB2 ASN 73 HB2 ASN 73 3.295 -16.913 1.885 549 HB3 ASN 73 HB3 ASN 73 4.113 -15.359 1.838 550 HD21 ASN 73 HD21 ASN 73 5.442 -14.775 3.550 551 HD22 ASN 73 HD22 ASN 73 5.961 -15.886 4.749 552 H SER 74 H SER 74 1.703 -15.292 5.361 553 HA SER 74 HA SER 74 0.319 -17.785 5.548 554 HB2 SER 74 HB2 SER 74 0.563 -15.539 7.554 555 HB3 SER 74 HB3 SER 74 0.139 -17.222 7.890 556 HG SER 74 HG SER 74 2.147 -17.854 7.285 557 H GLY 75 H GLY 75 -0.616 -14.648 4.530 558 HA2 GLY 75 HA2 GLY 75 -2.738 -14.180 3.649 559 HA3 GLY 75 HA3 GLY 75 -3.429 -15.422 4.677 560 H GLN 76 H GLN 76 -1.448 -13.723 6.600 561 HA GLN 76 HA GLN 76 -3.698 -12.322 7.838 562 HB2 GLN 76 HB2 GLN 76 -0.837 -12.540 8.743 563 HB3 GLN 76 HB3 GLN 76 -2.200 -11.987 9.692 564 HG2 GLN 76 HG2 GLN 76 -3.137 -14.225 9.673 565 HG3 GLN 76 HG3 GLN 76 -1.807 -14.782 8.653 566 HE21 GLN 76 HE21 GLN 76 -2.584 -15.636 11.340 567 HE22 GLN 76 HE22 GLN 76 -1.183 -15.397 12.307 568 H VAL 77 H VAL 77 -3.617 -10.075 8.254 569 HA VAL 77 HA VAL 77 -2.022 -8.476 6.512 570 HB VAL 77 HB VAL 77 -3.956 -7.832 8.780 571 HG11 VAL 77 HG11 VAL 77 -2.309 -5.823 7.227 572 HG12 VAL 77 HG12 VAL 77 -2.130 -6.176 8.947 573 HG13 VAL 77 HG13 VAL 77 -3.616 -5.436 8.345 574 HG21 VAL 77 HG21 VAL 77 -3.885 -7.065 5.888 575 HG22 VAL 77 HG22 VAL 77 -5.195 -6.726 7.011 576 HG23 VAL 77 HG23 VAL 77 -4.837 -8.402 6.549 577 H VAL 78 H VAL 78 -0.140 -7.479 6.980 578 HA VAL 78 HA VAL 78 1.537 -8.561 8.971 579 HB VAL 78 HB VAL 78 1.891 -5.884 7.587 580 HG11 VAL 78 HG11 VAL 78 3.920 -7.819 8.680 581 HG12 VAL 78 HG12 VAL 78 3.464 -6.268 9.383 582 HG13 VAL 78 HG13 VAL 78 4.283 -6.320 7.823 583 HG21 VAL 78 HG21 VAL 78 1.379 -7.652 5.945 584 HG22 VAL 78 HG22 VAL 78 2.743 -8.584 6.548 585 HG23 VAL 78 HG23 VAL 78 3.004 -7.016 5.766 586 H LYS 79 H LYS 79 1.750 -8.020 11.056 587 HA LYS 79 HA LYS 79 -0.096 -6.270 12.287 588 HB2 LYS 79 HB2 LYS 79 1.053 -6.626 14.410 589 HB3 LYS 79 HB3 LYS 79 0.793 -8.126 13.531 590 HG2 LYS 79 HG2 LYS 79 3.243 -6.725 13.073 591 HG3 LYS 79 HG3 LYS 79 3.116 -7.450 14.691 592 HD2 LYS 79 HD2 LYS 79 2.826 -8.929 12.026 593 HD3 LYS 79 HD3 LYS 79 4.298 -8.907 12.975 594 HE2 LYS 79 HE2 LYS 79 3.185 -10.996 13.390 595 HE3 LYS 79 HE3 LYS 79 3.045 -10.019 14.840 596 HZ1 LYS 79 HZ1 LYS 79 0.724 -9.590 14.322 597 HZ2 LYS 79 HZ2 LYS 79 0.998 -11.231 14.211 598 HZ3 LYS 79 HZ3 LYS 79 0.865 -10.355 12.817 599 H SER 80 H SER 80 2.941 -5.607 10.981 600 HA SER 80 HA SER 80 3.264 -3.106 12.353 601 HB2 SER 80 HB2 SER 80 4.736 -4.228 9.985 602 HB3 SER 80 HB3 SER 80 5.310 -3.006 11.138 603 HG SER 80 HG SER 80 5.590 -4.534 12.639 604 H LEU 81 H LEU 81 1.346 -4.192 9.771 605 HA LEU 81 HA LEU 81 1.752 -2.156 7.871 606 HB2 LEU 81 HB2 LEU 81 0.627 -4.362 7.419 607 HB3 LEU 81 HB3 LEU 81 -0.795 -3.768 8.230 608 HG LEU 81 HG LEU 81 -0.802 -1.885 6.536 609 HD11 LEU 81 HD11 LEU 81 0.340 -2.348 4.461 610 HD12 LEU 81 HD12 LEU 81 1.041 -3.798 5.171 611 HD13 LEU 81 HD13 LEU 81 1.512 -2.202 5.782 612 HD21 LEU 81 HD21 LEU 81 -1.177 -4.712 5.605 613 HD22 LEU 81 HD22 LEU 81 -1.893 -3.277 4.870 614 HD23 LEU 81 HD23 LEU 81 -2.353 -3.749 6.508 615 HA PRO 82 HA PRO 82 -2.117 0.083 9.765 616 HB2 PRO 82 HB2 PRO 82 -2.173 -0.906 12.558 617 HB3 PRO 82 HB3 PRO 82 -3.519 -0.624 11.451 618 HG2 PRO 82 HG2 PRO 82 -2.769 -3.110 12.071 619 HG3 PRO 82 HG3 PRO 82 -3.275 -2.698 10.420 620 HD2 PRO 82 HD2 PRO 82 -0.529 -3.018 11.541 621 HD3 PRO 82 HD3 PRO 82 -1.197 -3.644 10.023 622 H GLY 83 H GLY 83 0.660 -0.855 11.583 623 HA2 GLY 83 HA2 GLY 83 0.911 1.474 13.194 624 HA3 GLY 83 HA3 GLY 83 2.188 0.313 12.856 625 H LEU 84 H LEU 84 2.416 0.485 10.106 626 HA LEU 84 HA LEU 84 3.819 2.933 9.863 627 HB2 LEU 84 HB2 LEU 84 4.574 2.211 7.756 628 HB3 LEU 84 HB3 LEU 84 4.371 0.731 8.654 629 HG LEU 84 HG LEU 84 2.011 0.783 7.412 630 HD11 LEU 84 HD11 LEU 84 2.381 2.877 6.208 631 HD12 LEU 84 HD12 LEU 84 2.284 1.554 5.065 632 HD13 LEU 84 HD13 LEU 84 3.848 2.231 5.485 633 HD21 LEU 84 HD21 LEU 84 4.610 -0.177 6.210 634 HD22 LEU 84 HD22 LEU 84 3.006 -0.716 5.720 635 HD23 LEU 84 HD23 LEU 84 3.591 -1.062 7.347 636 H LEU 85 H LEU 85 0.724 1.757 8.736 637 HA LEU 85 HA LEU 85 0.081 3.890 7.062 638 HB2 LEU 85 HB2 LEU 85 -1.837 2.246 8.710 639 HB3 LEU 85 HB3 LEU 85 -2.254 3.227 7.323 640 HG LEU 85 HG LEU 85 -0.589 0.724 7.323 641 HD11 LEU 85 HD11 LEU 85 -2.399 -0.191 5.976 642 HD12 LEU 85 HD12 LEU 85 -3.301 1.313 6.187 643 HD13 LEU 85 HD13 LEU 85 -2.938 0.300 7.581 644 HD21 LEU 85 HD21 LEU 85 -0.570 0.954 4.876 645 HD22 LEU 85 HD22 LEU 85 0.301 2.259 5.684 646 HD23 LEU 85 HD23 LEU 85 -1.315 2.546 5.047 647 H THR 86 H THR 86 -0.302 3.487 10.477 648 HA THR 86 HA THR 86 -1.863 5.779 10.959 649 HB THR 86 HB THR 86 0.112 4.425 12.825 650 HG1 THR 86 HG1 THR 86 -1.589 3.071 12.157 651 HG21 THR 86 HG21 THR 86 -1.143 5.509 14.649 652 HG22 THR 86 HG22 THR 86 -2.143 6.347 13.462 653 HG23 THR 86 HG23 THR 86 -0.423 6.711 13.581 654 H ILE 87 H ILE 87 1.679 5.382 10.970 655 HA ILE 87 HA ILE 87 2.080 8.056 11.797 656 HB ILE 87 HB ILE 87 3.700 6.327 12.390 657 HG12 ILE 87 HG12 ILE 87 4.516 8.738 12.144 658 HG13 ILE 87 HG13 ILE 87 5.753 7.492 12.173 659 HG21 ILE 87 HG21 ILE 87 3.581 4.924 10.469 660 HG22 ILE 87 HG22 ILE 87 5.258 5.313 10.859 661 HG23 ILE 87 HG23 ILE 87 4.455 6.119 9.513 662 HD11 ILE 87 HD11 ILE 87 4.701 8.882 9.723 663 HD12 ILE 87 HD12 ILE 87 5.990 7.680 9.758 664 HD13 ILE 87 HD13 ILE 87 6.222 9.245 10.544 665 H LEU 88 H LEU 88 2.258 6.574 8.557 666 HA LEU 88 HA LEU 88 2.935 9.046 7.322 667 HB2 LEU 88 HB2 LEU 88 1.680 6.594 6.138 668 HB3 LEU 88 HB3 LEU 88 1.981 8.032 5.200 669 HG LEU 88 HG LEU 88 3.700 6.631 4.666 670 HD11 LEU 88 HD11 LEU 88 4.529 8.827 5.122 671 HD12 LEU 88 HD12 LEU 88 5.747 7.609 5.487 672 HD13 LEU 88 HD13 LEU 88 4.858 8.385 6.800 673 HD21 LEU 88 HD21 LEU 88 5.068 5.367 6.238 674 HD22 LEU 88 HD22 LEU 88 3.363 4.942 6.346 675 HD23 LEU 88 HD23 LEU 88 4.081 5.986 7.568 676 H HIS 89 H HIS 89 -0.115 7.601 8.134 677 HA HIS 89 HA HIS 89 -1.775 9.379 6.686 678 HB2 HIS 89 HB2 HIS 89 -2.498 7.211 7.778 679 HB3 HIS 89 HB3 HIS 89 -2.419 8.036 9.326 680 HD1 HIS 89 HD1 HIS 89 -4.457 9.518 9.966 681 HD2 HIS 89 HD2 HIS 89 -4.582 8.038 6.077 682 HE1 HIS 89 HE1 HIS 89 -6.780 9.938 9.131 683 H ASP 90 H ASP 90 -0.408 9.402 9.910 684 HA ASP 90 HA ASP 90 -1.560 11.772 10.893 685 HB2 ASP 90 HB2 ASP 90 -0.455 10.051 12.283 686 HB3 ASP 90 HB3 ASP 90 1.090 10.496 11.581 687 H GLY 91 H GLY 91 1.231 11.111 8.929 688 HA2 GLY 91 HA2 GLY 91 2.255 13.805 9.099 689 HA3 GLY 91 HA3 GLY 91 2.895 12.505 8.107 690 H GLY 92 H GLY 92 -0.169 12.342 7.310 691 HA2 GLY 92 HA2 GLY 92 -1.563 13.330 5.755 692 HA3 GLY 92 HA3 GLY 92 -0.474 14.709 5.703 693 H TYR 93 H TYR 93 0.129 11.280 4.990 694 HA TYR 93 HA TYR 93 0.873 12.095 2.264 695 HB2 TYR 93 HB2 TYR 93 1.871 9.767 3.931 696 HB3 TYR 93 HB3 TYR 93 2.276 9.997 2.232 697 HD1 TYR 93 HD1 TYR 93 2.808 11.228 5.646 698 HD2 TYR 93 HD2 TYR 93 3.770 11.779 1.544 699 HE1 TYR 93 HE1 TYR 93 4.627 12.740 6.282 700 HE2 TYR 93 HE2 TYR 93 5.610 13.284 2.177 701 HH TYR 93 HH TYR 93 6.859 13.512 5.194 702 H ARG 94 H ARG 94 0.114 10.940 0.522 703 HA ARG 94 HA ARG 94 -2.440 9.631 1.035 704 HB2 ARG 94 HB2 ARG 94 -2.953 10.015 -1.240 705 HB3 ARG 94 HB3 ARG 94 -2.080 11.450 -0.718 706 HG2 ARG 94 HG2 ARG 94 -0.030 10.278 -1.656 707 HG3 ARG 94 HG3 ARG 94 -1.152 9.219 -2.495 708 HD2 ARG 94 HD2 ARG 94 -0.694 10.934 -4.047 709 HD3 ARG 94 HD3 ARG 94 -2.243 11.403 -3.339 710 HE ARG 94 HE ARG 94 -0.118 12.494 -1.868 711 HH11 ARG 94 HH11 ARG 94 -1.829 12.958 -4.944 712 HH12 ARG 94 HH12 ARG 94 -1.362 14.578 -5.146 713 HH21 ARG 94 HH21 ARG 94 0.530 14.731 -2.130 714 HH22 ARG 94 HH22 ARG 94 0.018 15.642 -3.453 715 H ASP 95 H ASP 95 -2.998 7.768 -0.567 716 HA ASP 95 HA ASP 95 -1.713 5.436 0.226 717 HB2 ASP 95 HB2 ASP 95 -3.078 4.353 -1.542 718 HB3 ASP 95 HB3 ASP 95 -4.016 5.498 -0.590 719 H THR 96 H THR 96 -1.493 7.173 -2.784 720 HA THR 96 HA THR 96 0.194 5.423 -4.106 721 HB THR 96 HB THR 96 -0.157 8.393 -4.592 722 HG1 THR 96 HG1 THR 96 -1.991 6.341 -4.688 723 HG21 THR 96 HG21 THR 96 1.639 7.305 -5.886 724 HG22 THR 96 HG22 THR 96 0.290 7.764 -6.931 725 HG23 THR 96 HG23 THR 96 0.493 6.086 -6.434 726 H GLU 97 H GLU 97 0.844 8.194 -2.037 727 HA GLU 97 HA GLU 97 3.627 8.354 -2.550 728 HB2 GLU 97 HB2 GLU 97 1.954 9.356 -0.266 729 HB3 GLU 97 HB3 GLU 97 3.684 9.655 -0.396 730 HG2 GLU 97 HG2 GLU 97 3.382 10.870 -2.408 731 HG3 GLU 97 HG3 GLU 97 1.676 10.475 -2.486 732 H ILE 98 H ILE 98 1.692 6.530 -0.245 733 HA ILE 98 HA ILE 98 3.784 5.656 1.461 734 HB ILE 98 HB ILE 98 1.464 3.870 0.655 735 HG12 ILE 98 HG12 ILE 98 0.335 5.907 1.268 736 HG13 ILE 98 HG13 ILE 98 0.234 4.783 2.617 737 HG21 ILE 98 HG21 ILE 98 3.157 2.824 2.018 738 HG22 ILE 98 HG22 ILE 98 1.656 2.996 2.927 739 HG23 ILE 98 HG23 ILE 98 3.002 4.096 3.230 740 HD11 ILE 98 HD11 ILE 98 1.940 5.960 3.795 741 HD12 ILE 98 HD12 ILE 98 0.647 7.063 3.341 742 HD13 ILE 98 HD13 ILE 98 2.164 7.069 2.437 743 H MET 99 H MET 99 2.356 4.343 -1.424 744 HA MET 99 HA MET 99 3.945 2.027 -1.687 745 HB2 MET 99 HB2 MET 99 2.577 3.570 -3.886 746 HB3 MET 99 HB3 MET 99 3.103 1.896 -3.943 747 HG2 MET 99 HG2 MET 99 0.937 2.993 -2.171 748 HG3 MET 99 HG3 MET 99 0.693 2.145 -3.693 749 HE1 MET 99 HE1 MET 99 -0.601 -0.367 -1.025 750 HE2 MET 99 HE2 MET 99 -0.964 0.460 -2.540 751 HE3 MET 99 HE3 MET 99 -0.755 1.391 -1.058 752 H ARG 100 H ARG 100 4.446 5.367 -2.578 753 HA ARG 100 HA ARG 100 6.204 5.149 -4.718 754 HB2 ARG 100 HB2 ARG 100 5.196 7.276 -4.011 755 HB3 ARG 100 HB3 ARG 100 6.146 7.246 -2.537 756 HG2 ARG 100 HG2 ARG 100 8.193 7.460 -3.852 757 HG3 ARG 100 HG3 ARG 100 7.234 7.497 -5.333 758 HD2 ARG 100 HD2 ARG 100 6.124 9.538 -4.575 759 HD3 ARG 100 HD3 ARG 100 7.042 9.487 -3.069 760 HE ARG 100 HE ARG 100 8.876 9.437 -5.123 761 HH11 ARG 100 HH11 ARG 100 6.468 11.766 -3.877 762 HH12 ARG 100 HH12 ARG 100 7.292 13.109 -4.473 763 HH21 ARG 100 HH21 ARG 100 10.025 11.342 -5.868 764 HH22 ARG 100 HH22 ARG 100 9.354 12.881 -5.593 765 H TRP 101 H TRP 101 7.213 5.825 -1.372 766 HA TRP 101 HA TRP 101 9.871 5.100 -2.014 767 HB2 TRP 101 HB2 TRP 101 10.267 5.304 0.522 768 HB3 TRP 101 HB3 TRP 101 9.809 6.749 -0.365 769 HD1 TRP 101 HD1 TRP 101 7.591 7.933 0.328 770 HE1 TRP 101 HE1 TRP 101 5.912 7.580 2.230 771 HE3 TRP 101 HE3 TRP 101 9.152 3.346 1.968 772 HZ2 TRP 101 HZ2 TRP 101 5.326 5.630 4.160 773 HZ3 TRP 101 HZ3 TRP 101 7.973 2.316 3.825 774 HH2 TRP 101 HH2 TRP 101 6.099 3.433 4.919 775 H LEU 102 H LEU 102 7.231 3.327 -0.675 776 HA LEU 102 HA LEU 102 8.635 1.181 0.441 777 HB2 LEU 102 HB2 LEU 102 5.916 1.663 -0.511 778 HB3 LEU 102 HB3 LEU 102 6.361 -0.033 -0.353 779 HG LEU 102 HG LEU 102 6.335 2.084 1.808 780 HD11 LEU 102 HD11 LEU 102 4.438 0.860 2.659 781 HD12 LEU 102 HD12 LEU 102 4.572 -0.312 1.345 782 HD13 LEU 102 HD13 LEU 102 4.125 1.359 0.992 783 HD21 LEU 102 HD21 LEU 102 8.055 0.455 2.271 784 HD22 LEU 102 HD22 LEU 102 6.933 -0.865 1.911 785 HD23 LEU 102 HD23 LEU 102 6.665 0.163 3.317 786 H PHE 103 H PHE 103 7.544 1.678 -2.888 787 HA PHE 103 HA PHE 103 8.582 -0.933 -3.576 788 HB2 PHE 103 HB2 PHE 103 6.944 1.050 -5.121 789 HB3 PHE 103 HB3 PHE 103 7.660 -0.368 -5.883 790 HD1 PHE 103 HD1 PHE 103 5.335 0.685 -3.173 791 HD2 PHE 103 HD2 PHE 103 6.625 -2.454 -5.735 792 HE1 PHE 103 HE1 PHE 103 3.413 -0.672 -2.476 793 HE2 PHE 103 HE2 PHE 103 4.701 -3.815 -5.025 794 HZ PHE 103 HZ PHE 103 3.097 -2.921 -3.405 795 H THR 104 H THR 104 9.880 2.038 -3.320 796 HA THR 104 HA THR 104 11.584 1.972 -5.630 797 HB THR 104 HB THR 104 11.785 3.602 -3.068 798 HG1 THR 104 HG1 THR 104 9.901 3.999 -4.437 799 HG21 THR 104 HG21 THR 104 13.946 3.442 -4.236 800 HG22 THR 104 HG22 THR 104 13.284 5.075 -4.342 801 HG23 THR 104 HG23 THR 104 13.175 3.989 -5.726 802 HA PRO 105 HA PRO 105 14.324 -0.996 -3.567 803 HB2 PRO 105 HB2 PRO 105 16.080 -0.509 -5.884 804 HB3 PRO 105 HB3 PRO 105 15.349 -2.024 -5.342 805 HG2 PRO 105 HG2 PRO 105 14.530 -0.781 -7.578 806 HG3 PRO 105 HG3 PRO 105 13.404 -1.663 -6.531 807 HD2 PRO 105 HD2 PRO 105 13.888 1.285 -6.732 808 HD3 PRO 105 HD3 PRO 105 12.361 0.387 -6.569 809 H ASP 106 H ASP 106 15.829 -0.466 -2.093 810 HA ASP 106 HA ASP 106 17.024 2.189 -2.291 811 HB2 ASP 106 HB2 ASP 106 15.540 1.774 -0.375 812 HB3 ASP 106 HB3 ASP 106 16.564 0.390 0.037 813 HA PRO 107 HA PRO 107 20.856 -0.095 -2.965 814 HB2 PRO 107 HB2 PRO 107 22.488 2.119 -2.829 815 HB3 PRO 107 HB3 PRO 107 21.646 1.593 -4.291 816 HG2 PRO 107 HG2 PRO 107 20.901 3.720 -2.333 817 HG3 PRO 107 HG3 PRO 107 20.769 3.726 -4.102 818 HD2 PRO 107 HD2 PRO 107 18.656 3.312 -2.505 819 HD3 PRO 107 HD3 PRO 107 18.800 2.506 -4.079 820 H SER 108 H SER 108 20.095 2.065 -0.350 821 HA SER 108 HA SER 108 22.420 1.599 1.217 822 HB2 SER 108 HB2 SER 108 19.890 2.468 2.476 823 HB3 SER 108 HB3 SER 108 21.499 3.187 2.570 824 HG SER 108 HG SER 108 19.428 3.622 0.793 825 H LEU 109 H LEU 109 19.529 -0.154 0.603 826 HA LEU 109 HA LEU 109 19.608 -1.499 3.179 827 HB2 LEU 109 HB2 LEU 109 17.479 -0.541 2.426 828 HB3 LEU 109 HB3 LEU 109 17.533 -1.555 1.001 829 HG LEU 109 HG LEU 109 17.443 -3.553 2.502 830 HD11 LEU 109 HD11 LEU 109 16.864 -1.497 4.624 831 HD12 LEU 109 HD12 LEU 109 18.278 -2.553 4.545 832 HD13 LEU 109 HD13 LEU 109 16.673 -3.239 4.797 833 HD21 LEU 109 HD21 LEU 109 15.070 -3.349 2.967 834 HD22 LEU 109 HD22 LEU 109 15.475 -2.720 1.369 835 HD23 LEU 109 HD23 LEU 109 15.164 -1.602 2.707 836 H THR 110 H THR 110 20.401 -3.404 3.327 837 HA THR 110 HA THR 110 20.531 -5.224 1.019 838 HB THR 110 HB THR 110 22.674 -4.876 3.129 839 HG1 THR 110 HG1 THR 110 22.265 -3.138 1.565 840 HG21 THR 110 HG21 THR 110 24.042 -6.240 1.590 841 HG22 THR 110 HG22 THR 110 22.677 -6.366 0.482 842 HG23 THR 110 HG23 THR 110 22.588 -7.112 2.077 843 H ILE 111 H ILE 111 19.216 -6.849 1.585 844 HA ILE 111 HA ILE 111 19.251 -7.758 4.362 845 HB ILE 111 HB ILE 111 16.764 -8.084 4.245 846 HG12 ILE 111 HG12 ILE 111 16.985 -5.963 2.090 847 HG13 ILE 111 HG13 ILE 111 16.536 -7.639 1.808 848 HG21 ILE 111 HG21 ILE 111 16.347 -5.844 5.097 849 HG22 ILE 111 HG22 ILE 111 17.908 -5.334 4.410 850 HG23 ILE 111 HG23 ILE 111 17.854 -6.585 5.666 851 HD11 ILE 111 HD11 ILE 111 14.602 -6.174 1.826 852 HD12 ILE 111 HD12 ILE 111 15.000 -5.653 3.462 853 HD13 ILE 111 HD13 ILE 111 14.535 -7.329 3.157 854 H THR 112 H THR 112 18.160 -9.752 4.697 855 HA THR 112 HA THR 112 18.704 -11.549 2.531 856 HB THR 112 HB THR 112 18.482 -13.263 4.350 857 HG1 THR 112 HG1 THR 112 18.565 -11.783 6.489 858 HG21 THR 112 HG21 THR 112 20.154 -10.862 4.982 859 HG22 THR 112 HG22 THR 112 20.644 -12.170 3.904 860 HG23 THR 112 HG23 THR 112 20.449 -12.476 5.643 861 H ARG 113 H ARG 113 17.115 -12.485 1.395 862 HA ARG 113 HA ARG 113 14.513 -11.294 1.709 863 HB2 ARG 113 HB2 ARG 113 15.910 -11.898 -0.493 864 HB3 ARG 113 HB3 ARG 113 15.005 -13.395 -0.357 865 HG2 ARG 113 HG2 ARG 113 13.781 -10.642 -0.504 866 HG3 ARG 113 HG3 ARG 113 13.954 -11.742 -1.864 867 HD2 ARG 113 HD2 ARG 113 12.382 -13.244 -0.967 868 HD3 ARG 113 HD3 ARG 113 12.462 -12.508 0.631 869 HE ARG 113 HE ARG 113 11.613 -10.527 -1.060 870 HH11 ARG 113 HH11 ARG 113 10.362 -13.667 0.056 871 HH12 ARG 113 HH12 ARG 113 8.729 -13.206 -0.156 872 HH21 ARG 113 HH21 ARG 113 9.472 -9.941 -1.293 873 HH22 ARG 113 HH22 ARG 113 8.178 -11.054 -0.967 874 H ASP 114 H ASP 114 12.785 -12.197 2.587 875 HA ASP 114 HA ASP 114 12.796 -14.547 4.078 876 HB2 ASP 114 HB2 ASP 114 11.188 -12.820 4.558 877 HB3 ASP 114 HB3 ASP 114 10.488 -12.971 2.951 878 H GLY 115 H GLY 115 12.774 -16.539 3.511 879 HA2 GLY 115 HA2 GLY 115 11.745 -18.408 2.412 880 HA3 GLY 115 HA3 GLY 115 11.448 -17.348 1.032 881 H SER 116 H SER 116 14.312 -16.306 1.771 882 HA SER 116 HA SER 116 15.729 -18.364 0.304 883 HB2 SER 116 HB2 SER 116 15.910 -15.362 0.013 884 HB3 SER 116 HB3 SER 116 16.844 -16.548 -0.900 885 HG SER 116 HG SER 116 14.141 -16.982 -0.960 886 H ARG 117 H ARG 117 17.976 -18.227 0.704 887 HA ARG 117 HA ARG 117 18.624 -17.418 3.449 888 HB2 ARG 117 HB2 ARG 117 20.510 -18.890 3.286 889 HB3 ARG 117 HB3 ARG 117 19.109 -19.726 2.634 890 HG2 ARG 117 HG2 ARG 117 19.924 -19.047 0.341 891 HG3 ARG 117 HG3 ARG 117 21.413 -18.532 1.129 892 HD2 ARG 117 HD2 ARG 117 21.792 -20.722 0.374 893 HD3 ARG 117 HD3 ARG 117 21.533 -20.798 2.129 894 HE ARG 117 HE ARG 117 19.300 -21.321 0.309 895 HH11 ARG 117 HH11 ARG 117 21.485 -22.564 2.813 896 HH12 ARG 117 HH12 ARG 117 20.673 -24.048 2.967 897 HH21 ARG 117 HH21 ARG 117 18.190 -23.366 0.559 898 HH22 ARG 117 HH22 ARG 117 18.804 -24.523 1.670 899 H ASP 118 H ASP 118 19.106 -16.600 0.226 900 HA ASP 118 HA ASP 118 21.614 -15.327 0.214 901 HB2 ASP 118 HB2 ASP 118 19.242 -14.974 -1.600 902 HB3 ASP 118 HB3 ASP 118 20.837 -14.296 -1.893 903 H ALA 119 H ALA 119 22.181 -13.207 0.115 904 HA ALA 119 HA ALA 119 20.389 -11.330 1.448 905 HB1 ALA 119 HB1 ALA 119 22.426 -9.995 1.822 906 HB2 ALA 119 HB2 ALA 119 23.368 -11.189 0.930 907 HB3 ALA 119 HB3 ALA 119 22.617 -11.628 2.463 908 H VAL 120 H VAL 120 19.603 -9.652 0.356 909 HA VAL 120 HA VAL 120 20.385 -9.357 -2.452 910 HB VAL 120 HB VAL 120 17.768 -8.577 -1.122 911 HG11 VAL 120 HG11 VAL 120 18.542 -8.620 -4.037 912 HG12 VAL 120 HG12 VAL 120 18.299 -7.185 -3.044 913 HG13 VAL 120 HG13 VAL 120 16.938 -8.246 -3.404 914 HG21 VAL 120 HG21 VAL 120 16.765 -10.457 -2.345 915 HG22 VAL 120 HG22 VAL 120 17.986 -11.004 -1.195 916 HG23 VAL 120 HG23 VAL 120 18.365 -10.929 -2.916 917 H SER 121 H SER 121 21.460 -7.583 -2.856 918 HA SER 121 HA SER 121 21.512 -5.345 -1.003 919 HB2 SER 121 HB2 SER 121 22.934 -5.767 -3.643 920 HB3 SER 121 HB3 SER 121 23.363 -4.615 -2.382 921 HG SER 121 HG SER 121 24.139 -7.135 -2.677 922 H ASN 122 H ASN 122 20.443 -3.394 -1.437 923 HA ASN 122 HA ASN 122 19.319 -1.810 -2.465 924 HB2 ASN 122 HB2 ASN 122 21.064 -2.131 -4.316 925 HB3 ASN 122 HB3 ASN 122 19.914 -3.181 -5.115 926 HD21 ASN 122 HD21 ASN 122 21.111 -0.746 -6.073 927 HD22 ASN 122 HD22 ASN 122 19.813 0.337 -6.389 928 H ALA 123 H ALA 123 17.855 -3.317 -1.241 929 HA ALA 123 HA ALA 123 15.794 -4.489 -2.971 930 HB1 ALA 123 HB1 ALA 123 16.716 -5.966 -1.238 931 HB2 ALA 123 HB2 ALA 123 15.007 -5.634 -0.948 932 HB3 ALA 123 HB3 ALA 123 16.238 -4.809 0.002 933 H ARG 124 H ARG 124 13.529 -4.140 -2.196 934 HA ARG 124 HA ARG 124 13.177 -1.301 -1.679 935 HB2 ARG 124 HB2 ARG 124 10.774 -1.732 -2.176 936 HB3 ARG 124 HB3 ARG 124 11.836 -2.211 -3.490 937 HG2 ARG 124 HG2 ARG 124 11.579 -4.514 -2.975 938 HG3 ARG 124 HG3 ARG 124 10.791 -4.144 -1.442 939 HD2 ARG 124 HD2 ARG 124 9.176 -4.873 -3.122 940 HD3 ARG 124 HD3 ARG 124 8.889 -3.219 -2.609 941 HE ARG 124 HE ARG 124 9.944 -2.516 -4.709 942 HH11 ARG 124 HH11 ARG 124 8.988 -5.938 -4.597 943 HH12 ARG 124 HH12 ARG 124 8.380 -5.936 -6.198 944 HH21 ARG 124 HH21 ARG 124 9.046 -2.587 -6.986 945 HH22 ARG 124 HH22 ARG 124 8.363 -4.054 -7.495 946 HA PRO 125 HA PRO 125 12.338 -1.617 2.678 947 HB2 PRO 125 HB2 PRO 125 10.005 0.138 2.055 948 HB3 PRO 125 HB3 PRO 125 11.237 0.323 3.309 949 HG2 PRO 125 HG2 PRO 125 11.356 1.801 1.129 950 HG3 PRO 125 HG3 PRO 125 12.836 1.088 1.794 951 HD2 PRO 125 HD2 PRO 125 11.233 0.250 -0.584 952 HD3 PRO 125 HD3 PRO 125 12.994 0.250 -0.352 953 H VAL 126 H VAL 126 9.659 -2.122 0.427 954 HA VAL 126 HA VAL 126 7.779 -3.271 2.193 955 HB VAL 126 HB VAL 126 8.262 -4.025 -0.711 956 HG11 VAL 126 HG11 VAL 126 5.986 -4.890 -0.694 957 HG12 VAL 126 HG12 VAL 126 5.866 -4.544 1.033 958 HG13 VAL 126 HG13 VAL 126 7.009 -5.755 0.456 959 HG21 VAL 126 HG21 VAL 126 6.404 -2.578 -1.229 960 HG22 VAL 126 HG22 VAL 126 7.676 -1.679 -0.403 961 HG23 VAL 126 HG23 VAL 126 6.219 -2.174 0.476 962 H ASP 127 H ASP 127 10.515 -4.652 0.504 963 HA ASP 127 HA ASP 127 9.813 -7.359 0.916 964 HB2 ASP 127 HB2 ASP 127 11.456 -6.259 -0.798 965 HB3 ASP 127 HB3 ASP 127 12.640 -6.435 0.493 966 H ALA 128 H ALA 128 11.519 -4.995 2.731 967 HA ALA 128 HA ALA 128 12.865 -6.583 4.596 968 HB1 ALA 128 HB1 ALA 128 13.300 -4.187 4.294 969 HB2 ALA 128 HB2 ALA 128 12.997 -4.595 5.982 970 HB3 ALA 128 HB3 ALA 128 11.738 -3.819 5.022 971 H LEU 129 H LEU 129 9.470 -5.571 4.506 972 HA LEU 129 HA LEU 129 8.989 -6.273 7.239 973 HB2 LEU 129 HB2 LEU 129 6.648 -5.948 6.827 974 HB3 LEU 129 HB3 LEU 129 7.524 -4.677 6.016 975 HG LEU 129 HG LEU 129 7.281 -6.254 3.960 976 HD11 LEU 129 HD11 LEU 129 4.975 -7.124 5.666 977 HD12 LEU 129 HD12 LEU 129 6.303 -8.109 5.070 978 HD13 LEU 129 HD13 LEU 129 5.117 -7.453 3.931 979 HD21 LEU 129 HD21 LEU 129 5.016 -4.556 5.021 980 HD22 LEU 129 HD22 LEU 129 5.195 -5.073 3.344 981 HD23 LEU 129 HD23 LEU 129 6.390 -3.998 4.068 982 H HIS 130 H HIS 130 8.861 -8.017 4.222 983 HA HIS 130 HA HIS 130 7.642 -10.378 5.183 984 HB2 HIS 130 HB2 HIS 130 9.630 -9.948 2.930 985 HB3 HIS 130 HB3 HIS 130 8.839 -11.480 3.253 986 HD1 HIS 130 HD1 HIS 130 6.656 -11.849 2.013 987 HD2 HIS 130 HD2 HIS 130 7.800 -7.850 2.124 988 HE1 HIS 130 HE1 HIS 130 5.041 -10.609 0.538 989 H ALA 131 H ALA 131 10.765 -9.053 5.275 990 HA ALA 131 HA ALA 131 12.081 -11.501 6.163 991 HB1 ALA 131 HB1 ALA 131 13.191 -8.709 5.895 992 HB2 ALA 131 HB2 ALA 131 13.262 -9.970 4.662 993 HB3 ALA 131 HB3 ALA 131 14.127 -10.174 6.183 994 H HIS 132 H HIS 132 10.063 -9.618 7.735 995 HA HIS 132 HA HIS 132 9.567 -9.086 9.881 996 HB2 HIS 132 HB2 HIS 132 10.201 -11.503 10.290 997 HB3 HIS 132 HB3 HIS 132 11.844 -10.983 10.629 998 HD1 HIS 132 HD1 HIS 132 12.310 -10.780 13.094 999 HD2 HIS 132 HD2 HIS 132 8.299 -10.154 12.204 1000 HE1 HIS 132 HE1 HIS 132 11.146 -10.421 15.302 1001 H GLN 133 H GLN 133 11.479 -7.602 8.349 1002 HA GLN 133 HA GLN 133 12.917 -6.246 10.483 1003 HB2 GLN 133 HB2 GLN 133 13.502 -6.241 7.513 1004 HB3 GLN 133 HB3 GLN 133 14.386 -5.306 8.711 1005 HG2 GLN 133 HG2 GLN 133 14.930 -7.489 9.842 1006 HG3 GLN 133 HG3 GLN 133 14.271 -8.295 8.421 1007 HE21 GLN 133 HE21 GLN 133 16.184 -9.211 7.855 1008 HE22 GLN 133 HE22 GLN 133 17.525 -8.315 7.239 1009 H ALA 134 H ALA 134 10.197 -6.117 9.830 1010 HA ALA 134 HA ALA 134 9.268 -3.999 8.324 1011 HB1 ALA 134 HB1 ALA 134 7.262 -4.088 9.688 1012 HB2 ALA 134 HB2 ALA 134 8.129 -5.006 10.919 1013 HB3 ALA 134 HB3 ALA 134 7.843 -5.715 9.328 1014 H ARG 135 H ARG 135 10.756 -3.917 11.489 1015 HA ARG 135 HA ARG 135 10.095 -1.346 12.339 1016 HB2 ARG 135 HB2 ARG 135 12.573 -2.989 12.666 1017 HB3 ARG 135 HB3 ARG 135 12.426 -1.393 13.371 1018 HG2 ARG 135 HG2 ARG 135 10.508 -3.653 13.954 1019 HG3 ARG 135 HG3 ARG 135 11.907 -3.261 14.957 1020 HD2 ARG 135 HD2 ARG 135 9.572 -1.446 14.347 1021 HD3 ARG 135 HD3 ARG 135 9.903 -2.249 15.880 1022 HE ARG 135 HE ARG 135 12.163 -0.845 15.334 1023 HH11 ARG 135 HH11 ARG 135 8.772 0.027 15.812 1024 HH12 ARG 135 HH12 ARG 135 9.132 1.588 16.380 1025 HH21 ARG 135 HH21 ARG 135 12.633 1.288 16.092 1026 HH22 ARG 135 HH22 ARG 135 11.367 2.344 16.511 1027 H GLU 136 H GLU 136 12.389 -2.365 9.866 1028 HA GLU 136 HA GLU 136 13.636 0.180 9.596 1029 HB2 GLU 136 HB2 GLU 136 13.539 -2.187 7.747 1030 HB3 GLU 136 HB3 GLU 136 14.543 -0.763 7.477 1031 HG2 GLU 136 HG2 GLU 136 14.733 -2.755 9.717 1032 HG3 GLU 136 HG3 GLU 136 15.873 -2.516 8.395 1033 H VAL 137 H VAL 137 10.801 -1.312 8.332 1034 HA VAL 137 HA VAL 137 10.352 0.467 6.146 1035 HB VAL 137 HB VAL 137 8.299 -1.066 7.779 1036 HG11 VAL 137 HG11 VAL 137 8.134 0.048 4.983 1037 HG12 VAL 137 HG12 VAL 137 7.291 0.657 6.405 1038 HG13 VAL 137 HG13 VAL 137 6.902 -0.941 5.766 1039 HG21 VAL 137 HG21 VAL 137 9.995 -2.576 6.906 1040 HG22 VAL 137 HG22 VAL 137 9.755 -1.928 5.285 1041 HG23 VAL 137 HG23 VAL 137 8.454 -2.816 6.077 1042 H VAL 138 H VAL 138 9.293 0.236 9.459 1043 HA VAL 138 HA VAL 138 7.774 2.594 9.608 1044 HB VAL 138 HB VAL 138 9.325 1.220 11.831 1045 HG11 VAL 138 HG11 VAL 138 7.751 2.292 13.354 1046 HG12 VAL 138 HG12 VAL 138 6.983 3.113 11.989 1047 HG13 VAL 138 HG13 VAL 138 8.655 3.483 12.414 1048 HG21 VAL 138 HG21 VAL 138 7.198 0.105 12.360 1049 HG22 VAL 138 HG22 VAL 138 7.778 -0.315 10.747 1050 HG23 VAL 138 HG23 VAL 138 6.463 0.845 10.937 1051 H ARG 139 H ARG 139 11.170 1.937 10.251 1052 HA ARG 139 HA ARG 139 12.037 4.433 11.133 1053 HB2 ARG 139 HB2 ARG 139 13.348 2.316 11.171 1054 HB3 ARG 139 HB3 ARG 139 13.506 2.423 9.435 1055 HG2 ARG 139 HG2 ARG 139 14.836 4.429 9.641 1056 HG3 ARG 139 HG3 ARG 139 14.632 4.401 11.396 1057 HD2 ARG 139 HD2 ARG 139 15.753 2.287 11.538 1058 HD3 ARG 139 HD3 ARG 139 15.893 2.180 9.793 1059 HE ARG 139 HE ARG 139 17.105 4.497 10.992 1060 HH11 ARG 139 HH11 ARG 139 17.647 1.111 9.909 1061 HH12 ARG 139 HH12 ARG 139 19.339 1.308 9.865 1062 HH21 ARG 139 HH21 ARG 139 19.481 4.664 10.865 1063 HH22 ARG 139 HH22 ARG 139 20.370 3.293 10.390 1064 H ARG 140 H ARG 140 11.851 3.115 7.847 1065 HA ARG 140 HA ARG 140 12.860 5.376 6.485 1066 HB2 ARG 140 HB2 ARG 140 12.606 3.029 5.565 1067 HB3 ARG 140 HB3 ARG 140 10.888 3.343 5.434 1068 HG2 ARG 140 HG2 ARG 140 11.853 3.650 3.273 1069 HG3 ARG 140 HG3 ARG 140 11.416 5.242 3.897 1070 HD2 ARG 140 HD2 ARG 140 13.614 5.268 2.813 1071 HD3 ARG 140 HD3 ARG 140 13.750 5.648 4.529 1072 HE ARG 140 HE ARG 140 14.328 3.175 4.753 1073 HH11 ARG 140 HH11 ARG 140 15.277 5.112 1.935 1074 HH12 ARG 140 HH12 ARG 140 16.588 4.105 1.526 1075 HH21 ARG 140 HH21 ARG 140 16.152 1.821 4.198 1076 HH22 ARG 140 HH22 ARG 140 17.065 2.193 2.808 1077 H ALA 141 H ALA 141 9.624 4.311 7.357 1078 HA ALA 141 HA ALA 141 8.100 6.246 6.069 1079 HB1 ALA 141 HB1 ALA 141 7.127 4.259 7.037 1080 HB2 ALA 141 HB2 ALA 141 6.382 5.700 7.751 1081 HB3 ALA 141 HB3 ALA 141 7.588 4.795 8.653 1082 H GLN 142 H GLN 142 9.450 6.233 9.351 1083 HA GLN 142 HA GLN 142 8.438 8.735 10.133 1084 HB2 GLN 142 HB2 GLN 142 10.924 7.298 11.056 1085 HB3 GLN 142 HB3 GLN 142 10.270 8.731 11.828 1086 HG2 GLN 142 HG2 GLN 142 8.235 7.514 12.396 1087 HG3 GLN 142 HG3 GLN 142 8.863 6.079 11.579 1088 HE21 GLN 142 HE21 GLN 142 8.813 4.861 13.470 1089 HE22 GLN 142 HE22 GLN 142 9.988 5.089 14.714 1090 H ALA 143 H ALA 143 11.445 7.825 8.557 1091 HA ALA 143 HA ALA 143 12.623 10.390 8.561 1092 HB1 ALA 143 HB1 ALA 143 13.887 8.322 8.225 1093 HB2 ALA 143 HB2 ALA 143 14.169 9.501 6.943 1094 HB3 ALA 143 HB3 ALA 143 13.112 8.119 6.651 1095 H MET 144 H MET 144 10.302 8.912 6.463 1096 HA MET 144 HA MET 144 10.600 10.984 4.454 1097 HB2 MET 144 HB2 MET 144 8.491 8.824 4.664 1098 HB3 MET 144 HB3 MET 144 8.708 9.894 3.295 1099 HG2 MET 144 HG2 MET 144 10.618 7.778 4.260 1100 HG3 MET 144 HG3 MET 144 9.630 7.725 2.812 1101 HE1 MET 144 HE1 MET 144 9.957 10.687 1.630 1102 HE2 MET 144 HE2 MET 144 10.060 9.217 0.656 1103 HE3 MET 144 HE3 MET 144 11.325 10.438 0.549 1104 H ALA 145 H ALA 145 8.551 10.248 7.151 1105 HA ALA 145 HA ALA 145 6.603 12.214 6.413 1106 HB1 ALA 145 HB1 ALA 145 5.926 10.184 7.586 1107 HB2 ALA 145 HB2 ALA 145 5.474 11.642 8.472 1108 HB3 ALA 145 HB3 ALA 145 6.868 10.695 8.987 1109 H TYR 146 H TYR 146 8.854 11.921 9.184 1110 HA TYR 146 HA TYR 146 8.711 14.827 9.376 1111 HB2 TYR 146 HB2 TYR 146 8.765 12.840 11.669 1112 HB3 TYR 146 HB3 TYR 146 8.886 14.586 11.849 1113 HD1 TYR 146 HD1 TYR 146 6.909 16.009 11.224 1114 HD2 TYR 146 HD2 TYR 146 6.647 11.766 11.447 1115 HE1 TYR 146 HE1 TYR 146 4.460 16.168 11.328 1116 HE2 TYR 146 HE2 TYR 146 4.193 11.919 11.556 1117 HH TYR 146 HH TYR 146 2.415 13.503 12.098 Start of MODEL 11 1 H MET 1 H MET 1 2.283 -16.872 -8.261 2 HA MET 1 HA MET 1 2.183 -15.376 -10.149 3 HB2 MET 1 HB2 MET 1 -0.425 -16.742 -9.441 4 HB3 MET 1 HB3 MET 1 -0.070 -16.070 -11.017 5 HG2 MET 1 HG2 MET 1 1.496 -18.259 -9.687 6 HG3 MET 1 HG3 MET 1 0.255 -18.491 -10.920 7 HE1 MET 1 HE1 MET 1 3.504 -19.297 -12.903 8 HE2 MET 1 HE2 MET 1 1.892 -19.849 -12.460 9 HE3 MET 1 HE3 MET 1 3.139 -19.700 -11.223 10 HA PRO 2 HA PRO 2 0.065 -11.545 -9.321 11 HB2 PRO 2 HB2 PRO 2 0.402 -10.410 -11.762 12 HB3 PRO 2 HB3 PRO 2 1.710 -10.515 -10.581 13 HG2 PRO 2 HG2 PRO 2 1.212 -12.175 -13.007 14 HG3 PRO 2 HG3 PRO 2 2.749 -11.627 -12.320 15 HD2 PRO 2 HD2 PRO 2 1.694 -14.158 -12.006 16 HD3 PRO 2 HD3 PRO 2 2.886 -13.416 -10.922 17 H GLY 3 H GLY 3 -2.102 -11.963 -9.131 18 HA2 GLY 3 HA2 GLY 3 -3.571 -13.125 -11.299 19 HA3 GLY 3 HA3 GLY 3 -4.204 -12.671 -9.725 20 H ARG 4 H ARG 4 -3.665 -11.746 -12.948 21 HA ARG 4 HA ARG 4 -4.671 -9.092 -12.662 22 HB2 ARG 4 HB2 ARG 4 -3.266 -9.394 -14.525 23 HB3 ARG 4 HB3 ARG 4 -4.090 -10.856 -15.022 24 HG2 ARG 4 HG2 ARG 4 -5.980 -9.608 -15.808 25 HG3 ARG 4 HG3 ARG 4 -5.328 -8.117 -15.123 26 HD2 ARG 4 HD2 ARG 4 -3.844 -9.718 -17.182 27 HD3 ARG 4 HD3 ARG 4 -5.018 -8.476 -17.621 28 HE ARG 4 HE ARG 4 -3.661 -6.889 -16.410 29 HH11 ARG 4 HH11 ARG 4 -1.978 -9.938 -17.189 30 HH12 ARG 4 HH12 ARG 4 -0.453 -9.179 -17.251 31 HH21 ARG 4 HH21 ARG 4 -1.577 -5.929 -16.539 32 HH22 ARG 4 HH22 ARG 4 -0.207 -6.893 -16.940 33 H ALA 5 H ALA 5 -6.714 -8.401 -12.690 34 HA ALA 5 HA ALA 5 -8.794 -10.075 -13.809 35 HB1 ALA 5 HB1 ALA 5 -8.842 -10.554 -11.404 36 HB2 ALA 5 HB2 ALA 5 -10.244 -9.587 -11.860 37 HB3 ALA 5 HB3 ALA 5 -8.874 -8.827 -11.052 38 HA PRO 6 HA PRO 6 -9.525 -5.912 -15.282 39 HB2 PRO 6 HB2 PRO 6 -11.819 -6.427 -16.688 40 HB3 PRO 6 HB3 PRO 6 -10.211 -6.782 -17.323 41 HG2 PRO 6 HG2 PRO 6 -12.223 -8.622 -16.126 42 HG3 PRO 6 HG3 PRO 6 -11.076 -8.909 -17.440 43 HD2 PRO 6 HD2 PRO 6 -10.734 -9.789 -14.860 44 HD3 PRO 6 HD3 PRO 6 -9.402 -9.516 -16.002 45 H GLY 7 H GLY 7 -10.180 -4.636 -13.563 46 HA2 GLY 7 HA2 GLY 7 -12.813 -5.222 -12.480 47 HA3 GLY 7 HA3 GLY 7 -11.467 -4.566 -11.551 48 H SER 8 H SER 8 -13.170 -3.065 -11.108 49 HA SER 8 HA SER 8 -12.825 -0.663 -12.584 50 HB2 SER 8 HB2 SER 8 -14.669 -1.892 -13.853 51 HB3 SER 8 HB3 SER 8 -15.633 -1.820 -12.383 52 HG SER 8 HG SER 8 -15.305 0.018 -14.281 53 H THR 9 H THR 9 -13.991 1.086 -11.352 54 HA THR 9 HA THR 9 -13.714 0.614 -8.551 55 HB THR 9 HB THR 9 -14.809 3.069 -9.969 56 HG1 THR 9 HG1 THR 9 -12.639 2.298 -10.534 57 HG21 THR 9 HG21 THR 9 -13.556 2.722 -7.225 58 HG22 THR 9 HG22 THR 9 -15.275 2.952 -7.534 59 HG23 THR 9 HG23 THR 9 -14.132 4.243 -7.909 60 H LEU 10 H LEU 10 -15.220 -0.201 -7.330 61 HA LEU 10 HA LEU 10 -17.807 -0.880 -8.197 62 HB2 LEU 10 HB2 LEU 10 -16.635 -0.745 -5.452 63 HB3 LEU 10 HB3 LEU 10 -18.166 -1.514 -5.835 64 HG LEU 10 HG LEU 10 -15.427 -2.394 -6.772 65 HD11 LEU 10 HD11 LEU 10 -15.839 -2.852 -4.428 66 HD12 LEU 10 HD12 LEU 10 -15.865 -4.351 -5.363 67 HD13 LEU 10 HD13 LEU 10 -17.378 -3.608 -4.836 68 HD21 LEU 10 HD21 LEU 10 -16.595 -4.355 -7.695 69 HD22 LEU 10 HD22 LEU 10 -17.113 -2.862 -8.481 70 HD23 LEU 10 HD23 LEU 10 -18.144 -3.624 -7.272 71 H ALA 11 H ALA 11 -19.811 -0.198 -7.434 72 HA ALA 11 HA ALA 11 -20.204 2.581 -7.347 73 HB1 ALA 11 HB1 ALA 11 -21.908 1.016 -8.183 74 HB2 ALA 11 HB2 ALA 11 -22.551 2.061 -6.917 75 HB3 ALA 11 HB3 ALA 11 -22.127 0.390 -6.548 76 H ARG 12 H ARG 12 -21.091 3.815 -5.680 77 HA ARG 12 HA ARG 12 -19.554 3.733 -3.372 78 HB2 ARG 12 HB2 ARG 12 -20.897 5.658 -2.593 79 HB3 ARG 12 HB3 ARG 12 -20.285 5.819 -4.228 80 HG2 ARG 12 HG2 ARG 12 -22.497 5.222 -5.103 81 HG3 ARG 12 HG3 ARG 12 -23.096 5.116 -3.448 82 HD2 ARG 12 HD2 ARG 12 -22.448 7.470 -3.108 83 HD3 ARG 12 HD3 ARG 12 -21.977 7.558 -4.807 84 HE ARG 12 HE ARG 12 -24.539 6.616 -4.783 85 HH11 ARG 12 HH11 ARG 12 -22.930 9.578 -3.754 86 HH12 ARG 12 HH12 ARG 12 -24.315 10.556 -3.895 87 HH21 ARG 12 HH21 ARG 12 -26.454 7.926 -4.955 88 HH22 ARG 12 HH22 ARG 12 -26.390 9.570 -4.570 89 H VAL 13 H VAL 13 -19.695 2.023 -2.151 90 HA VAL 13 HA VAL 13 -22.111 1.751 -0.471 91 HB VAL 13 HB VAL 13 -21.529 -0.655 -0.171 92 HG11 VAL 13 HG11 VAL 13 -23.187 -0.081 -1.853 93 HG12 VAL 13 HG12 VAL 13 -22.237 -1.471 -2.385 94 HG13 VAL 13 HG13 VAL 13 -21.915 0.129 -3.057 95 HG21 VAL 13 HG21 VAL 13 -19.459 -0.159 -2.321 96 HG22 VAL 13 HG22 VAL 13 -19.906 -1.742 -1.685 97 HG23 VAL 13 HG23 VAL 13 -19.133 -0.556 -0.635 98 H GLY 14 H GLY 14 -19.633 3.274 -0.387 99 HA2 GLY 14 HA2 GLY 14 -18.471 3.944 1.653 100 HA3 GLY 14 HA3 GLY 14 -18.419 2.234 2.096 101 H SER 15 H SER 15 -17.863 3.503 -1.096 102 HA SER 15 HA SER 15 -15.608 1.937 -1.550 103 HB2 SER 15 HB2 SER 15 -16.612 4.337 -3.074 104 HB3 SER 15 HB3 SER 15 -15.672 2.978 -3.704 105 HG SER 15 HG SER 15 -17.643 2.298 -4.179 106 H ILE 16 H ILE 16 -13.459 2.690 -2.025 107 HA ILE 16 HA ILE 16 -12.712 5.165 -0.643 108 HB ILE 16 HB ILE 16 -11.015 2.639 -0.907 109 HG12 ILE 16 HG12 ILE 16 -11.214 2.586 1.667 110 HG13 ILE 16 HG13 ILE 16 -12.614 3.625 1.448 111 HG21 ILE 16 HG21 ILE 16 -9.668 4.629 -0.816 112 HG22 ILE 16 HG22 ILE 16 -9.485 3.711 0.679 113 HG23 ILE 16 HG23 ILE 16 -10.493 5.157 0.649 114 HD11 ILE 16 HD11 ILE 16 -13.688 1.902 0.108 115 HD12 ILE 16 HD12 ILE 16 -13.253 1.300 1.707 116 HD13 ILE 16 HD13 ILE 16 -12.275 0.864 0.306 117 HA PRO 17 HA PRO 17 -11.099 6.057 -4.760 118 HB2 PRO 17 HB2 PRO 17 -9.302 7.906 -3.278 119 HB3 PRO 17 HB3 PRO 17 -10.397 8.257 -4.620 120 HG2 PRO 17 HG2 PRO 17 -10.977 9.056 -2.141 121 HG3 PRO 17 HG3 PRO 17 -12.243 8.479 -3.239 122 HD2 PRO 17 HD2 PRO 17 -10.930 7.062 -0.954 123 HD3 PRO 17 HD3 PRO 17 -12.630 7.047 -1.472 124 H ALA 18 H ALA 18 -9.399 5.136 -5.777 125 HA ALA 18 HA ALA 18 -7.333 3.957 -4.091 126 HB1 ALA 18 HB1 ALA 18 -7.044 2.355 -5.942 127 HB2 ALA 18 HB2 ALA 18 -8.366 3.153 -6.805 128 HB3 ALA 18 HB3 ALA 18 -8.678 2.330 -5.278 129 H GLY 19 H GLY 19 -5.234 4.274 -4.622 130 HA2 GLY 19 HA2 GLY 19 -4.745 6.696 -6.075 131 HA3 GLY 19 HA3 GLY 19 -3.563 5.738 -5.201 132 H ASP 20 H ASP 20 -2.131 6.030 -6.852 133 HA ASP 20 HA ASP 20 -2.768 4.940 -9.492 134 HB2 ASP 20 HB2 ASP 20 -1.816 7.193 -9.424 135 HB3 ASP 20 HB3 ASP 20 -0.447 6.603 -8.495 136 H ASP 21 H ASP 21 -1.786 3.134 -10.257 137 HA ASP 21 HA ASP 21 -0.698 1.354 -8.416 138 HB2 ASP 21 HB2 ASP 21 -0.180 -0.122 -10.417 139 HB3 ASP 21 HB3 ASP 21 -1.853 0.386 -10.272 140 H VAL 22 H VAL 22 1.072 1.810 -7.416 141 HA VAL 22 HA VAL 22 3.320 3.129 -8.497 142 HB VAL 22 HB VAL 22 3.176 1.422 -5.992 143 HG11 VAL 22 HG11 VAL 22 5.493 1.749 -6.707 144 HG12 VAL 22 HG12 VAL 22 5.161 2.660 -5.238 145 HG13 VAL 22 HG13 VAL 22 5.228 3.491 -6.796 146 HG21 VAL 22 HG21 VAL 22 2.943 3.599 -4.836 147 HG22 VAL 22 HG22 VAL 22 1.595 3.249 -5.922 148 HG23 VAL 22 HG23 VAL 22 2.851 4.383 -6.408 149 H LEU 23 H LEU 23 2.618 -0.261 -7.980 150 HA LEU 23 HA LEU 23 5.143 -1.000 -9.162 151 HB2 LEU 23 HB2 LEU 23 4.261 -3.379 -8.925 152 HB3 LEU 23 HB3 LEU 23 4.602 -2.506 -7.456 153 HG LEU 23 HG LEU 23 2.193 -2.212 -7.044 154 HD11 LEU 23 HD11 LEU 23 0.508 -3.336 -8.400 155 HD12 LEU 23 HD12 LEU 23 1.745 -3.820 -9.559 156 HD13 LEU 23 HD13 LEU 23 1.357 -2.113 -9.346 157 HD21 LEU 23 HD21 LEU 23 1.633 -4.556 -6.661 158 HD22 LEU 23 HD22 LEU 23 3.287 -4.172 -6.183 159 HD23 LEU 23 HD23 LEU 23 2.981 -5.034 -7.690 160 H ASP 24 H ASP 24 4.945 -2.798 -10.896 161 HA ASP 24 HA ASP 24 3.481 -1.599 -13.059 162 HB2 ASP 24 HB2 ASP 24 5.731 -2.504 -13.437 163 HB3 ASP 24 HB3 ASP 24 5.184 -4.103 -12.943 164 HA PRO 25 HA PRO 25 -0.308 -3.855 -12.504 165 HB2 PRO 25 HB2 PRO 25 -0.242 -4.115 -15.473 166 HB3 PRO 25 HB3 PRO 25 -1.550 -3.577 -14.414 167 HG2 PRO 25 HG2 PRO 25 -0.134 -1.797 -15.775 168 HG3 PRO 25 HG3 PRO 25 -0.632 -1.471 -14.107 169 HD2 PRO 25 HD2 PRO 25 2.053 -2.222 -15.166 170 HD3 PRO 25 HD3 PRO 25 1.619 -1.153 -13.815 171 H ASP 26 H ASP 26 2.327 -5.371 -14.299 172 HA ASP 26 HA ASP 26 0.986 -7.959 -14.114 173 HB2 ASP 26 HB2 ASP 26 3.389 -7.046 -15.651 174 HB3 ASP 26 HB3 ASP 26 3.204 -8.752 -15.276 175 H GLU 27 H GLU 27 2.612 -6.219 -12.028 176 HA GLU 27 HA GLU 27 4.339 -8.286 -10.964 177 HB2 GLU 27 HB2 GLU 27 3.607 -5.500 -10.073 178 HB3 GLU 27 HB3 GLU 27 4.552 -6.571 -9.052 179 HG2 GLU 27 HG2 GLU 27 5.326 -5.827 -11.855 180 HG3 GLU 27 HG3 GLU 27 5.878 -4.945 -10.426 181 HA PRO 28 HA PRO 28 1.760 -10.551 -8.163 182 HB2 PRO 28 HB2 PRO 28 3.346 -9.249 -5.976 183 HB3 PRO 28 HB3 PRO 28 2.867 -10.940 -6.153 184 HG2 PRO 28 HG2 PRO 28 5.325 -10.203 -6.785 185 HG3 PRO 28 HG3 PRO 28 4.449 -11.359 -7.806 186 HD2 PRO 28 HD2 PRO 28 5.091 -8.503 -8.306 187 HD3 PRO 28 HD3 PRO 28 4.892 -9.834 -9.459 188 H THR 29 H THR 29 -0.284 -9.754 -8.189 189 HA THR 29 HA THR 29 -0.935 -7.613 -6.342 190 HB THR 29 HB THR 29 -2.665 -7.096 -8.239 191 HG1 THR 29 HG1 THR 29 -0.364 -7.850 -9.743 192 HG21 THR 29 HG21 THR 29 -1.138 -5.318 -9.055 193 HG22 THR 29 HG22 THR 29 0.211 -6.146 -8.280 194 HG23 THR 29 HG23 THR 29 -1.089 -5.468 -7.299 195 H TYR 30 H TYR 30 -2.924 -7.681 -5.441 196 HA TYR 30 HA TYR 30 -4.702 -9.929 -5.934 197 HB2 TYR 30 HB2 TYR 30 -4.065 -8.432 -3.387 198 HB3 TYR 30 HB3 TYR 30 -5.533 -9.376 -3.580 199 HD1 TYR 30 HD1 TYR 30 -4.844 -11.797 -4.761 200 HD2 TYR 30 HD2 TYR 30 -2.538 -9.493 -2.060 201 HE1 TYR 30 HE1 TYR 30 -3.706 -13.821 -4.048 202 HE2 TYR 30 HE2 TYR 30 -1.360 -11.516 -1.323 203 HH TYR 30 HH TYR 30 -1.586 -14.426 -3.038 204 H ASP 31 H ASP 31 -6.972 -9.252 -5.450 205 HA ASP 31 HA ASP 31 -7.454 -6.478 -6.369 206 HB2 ASP 31 HB2 ASP 31 -8.989 -8.952 -7.268 207 HB3 ASP 31 HB3 ASP 31 -9.194 -7.313 -7.850 208 H LEU 32 H LEU 32 -9.700 -5.910 -5.789 209 HA LEU 32 HA LEU 32 -10.297 -6.333 -3.153 210 HB2 LEU 32 HB2 LEU 32 -12.295 -5.672 -5.317 211 HB3 LEU 32 HB3 LEU 32 -12.624 -5.542 -3.605 212 HG LEU 32 HG LEU 32 -10.574 -3.939 -5.132 213 HD11 LEU 32 HD11 LEU 32 -12.853 -3.299 -5.682 214 HD12 LEU 32 HD12 LEU 32 -12.083 -2.055 -4.696 215 HD13 LEU 32 HD13 LEU 32 -13.244 -3.163 -3.968 216 HD21 LEU 32 HD21 LEU 32 -11.439 -3.787 -2.238 217 HD22 LEU 32 HD22 LEU 32 -10.372 -2.643 -3.052 218 HD23 LEU 32 HD23 LEU 32 -9.862 -4.312 -2.832 219 HA PRO 33 HA PRO 33 -13.490 -9.915 -3.978 220 HB2 PRO 33 HB2 PRO 33 -12.992 -11.357 -6.290 221 HB3 PRO 33 HB3 PRO 33 -14.280 -10.165 -6.116 222 HG2 PRO 33 HG2 PRO 33 -11.572 -9.861 -7.343 223 HG3 PRO 33 HG3 PRO 33 -13.129 -9.203 -7.885 224 HD2 PRO 33 HD2 PRO 33 -11.321 -7.687 -6.623 225 HD3 PRO 33 HD3 PRO 33 -13.065 -7.477 -6.353 226 H ARG 34 H ARG 34 -10.192 -10.127 -5.284 227 HA ARG 34 HA ARG 34 -9.773 -12.821 -4.516 228 HB2 ARG 34 HB2 ARG 34 -8.492 -11.302 -6.232 229 HB3 ARG 34 HB3 ARG 34 -7.553 -10.855 -4.814 230 HG2 ARG 34 HG2 ARG 34 -6.391 -12.613 -5.931 231 HG3 ARG 34 HG3 ARG 34 -7.086 -13.272 -4.446 232 HD2 ARG 34 HD2 ARG 34 -8.914 -14.236 -5.662 233 HD3 ARG 34 HD3 ARG 34 -8.391 -13.459 -7.152 234 HE ARG 34 HE ARG 34 -7.024 -15.626 -5.737 235 HH11 ARG 34 HH11 ARG 34 -7.454 -13.714 -8.697 236 HH12 ARG 34 HH12 ARG 34 -6.794 -14.901 -9.721 237 HH21 ARG 34 HH21 ARG 34 -6.083 -17.266 -7.207 238 HH22 ARG 34 HH22 ARG 34 -6.008 -16.927 -8.876 239 H VAL 35 H VAL 35 -9.165 -9.693 -3.008 240 HA VAL 35 HA VAL 35 -7.770 -10.803 -0.795 241 HB VAL 35 HB VAL 35 -9.171 -8.096 -0.983 242 HG11 VAL 35 HG11 VAL 35 -7.157 -9.055 1.054 243 HG12 VAL 35 HG12 VAL 35 -8.868 -8.747 1.351 244 HG13 VAL 35 HG13 VAL 35 -7.797 -7.414 0.926 245 HG21 VAL 35 HG21 VAL 35 -7.387 -8.277 -2.602 246 HG22 VAL 35 HG22 VAL 35 -6.285 -8.869 -1.353 247 HG23 VAL 35 HG23 VAL 35 -6.882 -7.220 -1.280 248 H ALA 36 H ALA 36 -11.130 -10.024 -1.395 249 HA ALA 36 HA ALA 36 -12.153 -10.652 1.140 250 HB1 ALA 36 HB1 ALA 36 -13.455 -11.102 -1.561 251 HB2 ALA 36 HB2 ALA 36 -13.493 -9.598 -0.641 252 HB3 ALA 36 HB3 ALA 36 -14.276 -11.036 0.004 253 H GLU 37 H GLU 37 -11.314 -12.614 -1.606 254 HA GLU 37 HA GLU 37 -12.035 -15.175 -0.718 255 HB2 GLU 37 HB2 GLU 37 -10.031 -14.049 -2.570 256 HB3 GLU 37 HB3 GLU 37 -9.951 -15.752 -2.220 257 HG2 GLU 37 HG2 GLU 37 -12.382 -14.303 -3.275 258 HG3 GLU 37 HG3 GLU 37 -11.207 -15.136 -4.293 259 H LEU 38 H LEU 38 -9.013 -13.373 -0.348 260 HA LEU 38 HA LEU 38 -7.530 -15.381 0.959 261 HB2 LEU 38 HB2 LEU 38 -7.258 -12.398 1.200 262 HB3 LEU 38 HB3 LEU 38 -6.069 -13.566 1.717 263 HG LEU 38 HG LEU 38 -6.912 -13.029 -1.126 264 HD11 LEU 38 HD11 LEU 38 -4.676 -12.096 -1.340 265 HD12 LEU 38 HD12 LEU 38 -4.376 -12.418 0.360 266 HD13 LEU 38 HD13 LEU 38 -5.602 -11.233 -0.108 267 HD21 LEU 38 HD21 LEU 38 -6.269 -15.368 -0.841 268 HD22 LEU 38 HD22 LEU 38 -4.786 -14.872 -0.022 269 HD23 LEU 38 HD23 LEU 38 -5.028 -14.488 -1.725 270 H LEU 39 H LEU 39 -9.333 -12.650 2.219 271 HA LEU 39 HA LEU 39 -8.721 -13.323 4.960 272 HB2 LEU 39 HB2 LEU 39 -10.571 -11.273 3.815 273 HB3 LEU 39 HB3 LEU 39 -10.072 -11.358 5.498 274 HG LEU 39 HG LEU 39 -8.301 -10.732 3.122 275 HD11 LEU 39 HD11 LEU 39 -9.285 -8.991 5.363 276 HD12 LEU 39 HD12 LEU 39 -9.832 -8.935 3.686 277 HD13 LEU 39 HD13 LEU 39 -8.167 -8.510 4.087 278 HD21 LEU 39 HD21 LEU 39 -7.651 -10.773 6.066 279 HD22 LEU 39 HD22 LEU 39 -6.580 -10.231 4.776 280 HD23 LEU 39 HD23 LEU 39 -7.066 -11.920 4.860 281 H GLY 40 H GLY 40 -11.224 -14.114 2.758 282 HA2 GLY 40 HA2 GLY 40 -13.060 -15.476 3.025 283 HA3 GLY 40 HA3 GLY 40 -12.513 -15.796 4.666 284 H VAL 41 H VAL 41 -13.103 -12.637 3.393 285 HA VAL 41 HA VAL 41 -15.507 -12.372 5.082 286 HB VAL 41 HB VAL 41 -14.841 -10.136 5.802 287 HG11 VAL 41 HG11 VAL 41 -12.934 -10.618 7.242 288 HG12 VAL 41 HG12 VAL 41 -12.625 -12.089 6.320 289 HG13 VAL 41 HG13 VAL 41 -14.125 -11.920 7.234 290 HG21 VAL 41 HG21 VAL 41 -12.585 -9.219 5.306 291 HG22 VAL 41 HG22 VAL 41 -13.604 -9.386 3.872 292 HG23 VAL 41 HG23 VAL 41 -12.340 -10.564 4.184 293 HA PRO 42 HA PRO 42 -17.360 -10.446 1.521 294 HB2 PRO 42 HB2 PRO 42 -18.627 -8.267 2.553 295 HB3 PRO 42 HB3 PRO 42 -19.282 -9.906 2.641 296 HG2 PRO 42 HG2 PRO 42 -17.800 -8.352 4.724 297 HG3 PRO 42 HG3 PRO 42 -19.208 -9.411 4.918 298 HD2 PRO 42 HD2 PRO 42 -16.757 -10.235 5.571 299 HD3 PRO 42 HD3 PRO 42 -17.927 -11.341 4.832 300 H VAL 43 H VAL 43 -17.131 -8.748 0.079 301 HA VAL 43 HA VAL 43 -14.668 -7.429 0.021 302 HB VAL 43 HB VAL 43 -17.195 -6.791 -1.499 303 HG11 VAL 43 HG11 VAL 43 -15.595 -4.943 -1.666 304 HG12 VAL 43 HG12 VAL 43 -15.698 -5.786 -3.212 305 HG13 VAL 43 HG13 VAL 43 -14.322 -6.063 -2.145 306 HG21 VAL 43 HG21 VAL 43 -16.509 -9.098 -1.826 307 HG22 VAL 43 HG22 VAL 43 -14.878 -8.576 -2.244 308 HG23 VAL 43 HG23 VAL 43 -16.230 -8.173 -3.303 309 H SER 44 H SER 44 -17.845 -6.333 1.052 310 HA SER 44 HA SER 44 -17.228 -3.622 1.322 311 HB2 SER 44 HB2 SER 44 -19.528 -4.469 1.276 312 HB3 SER 44 HB3 SER 44 -19.292 -5.241 2.846 313 HG SER 44 HG SER 44 -19.054 -3.258 3.760 314 H LYS 45 H LYS 45 -16.681 -6.355 3.514 315 HA LYS 45 HA LYS 45 -15.962 -4.701 5.713 316 HB2 LYS 45 HB2 LYS 45 -16.630 -7.072 6.055 317 HB3 LYS 45 HB3 LYS 45 -15.169 -7.588 5.219 318 HG2 LYS 45 HG2 LYS 45 -13.782 -6.650 6.941 319 HG3 LYS 45 HG3 LYS 45 -15.186 -5.944 7.735 320 HD2 LYS 45 HD2 LYS 45 -16.055 -8.212 8.152 321 HD3 LYS 45 HD3 LYS 45 -14.597 -8.882 7.412 322 HE2 LYS 45 HE2 LYS 45 -14.401 -8.892 9.846 323 HE3 LYS 45 HE3 LYS 45 -13.226 -7.794 9.132 324 HZ1 LYS 45 HZ1 LYS 45 -14.287 -6.822 11.073 325 HZ2 LYS 45 HZ2 LYS 45 -15.808 -7.004 10.385 326 HZ3 LYS 45 HZ3 LYS 45 -14.705 -5.936 9.713 327 H VAL 46 H VAL 46 -14.252 -6.119 3.029 328 HA VAL 46 HA VAL 46 -11.612 -5.326 3.784 329 HB VAL 46 HB VAL 46 -12.758 -5.575 0.978 330 HG11 VAL 46 HG11 VAL 46 -10.660 -4.363 1.042 331 HG12 VAL 46 HG12 VAL 46 -10.434 -5.938 0.275 332 HG13 VAL 46 HG13 VAL 46 -9.903 -5.675 1.943 333 HG21 VAL 46 HG21 VAL 46 -11.373 -7.660 2.664 334 HG22 VAL 46 HG22 VAL 46 -11.822 -7.855 0.970 335 HG23 VAL 46 HG23 VAL 46 -13.075 -7.655 2.196 336 H ALA 47 H ALA 47 -14.164 -3.733 1.998 337 HA ALA 47 HA ALA 47 -12.810 -1.344 1.451 338 HB1 ALA 47 HB1 ALA 47 -15.760 -1.730 1.966 339 HB2 ALA 47 HB2 ALA 47 -14.955 -1.931 0.404 340 HB3 ALA 47 HB3 ALA 47 -15.022 -0.341 1.173 341 H GLN 48 H GLN 48 -14.551 -2.415 4.295 342 HA GLN 48 HA GLN 48 -14.422 0.098 5.610 343 HB2 GLN 48 HB2 GLN 48 -14.758 -2.638 6.860 344 HB3 GLN 48 HB3 GLN 48 -15.026 -1.105 7.673 345 HG2 GLN 48 HG2 GLN 48 -16.643 -2.322 5.446 346 HG3 GLN 48 HG3 GLN 48 -17.140 -2.028 7.108 347 HE21 GLN 48 HE21 GLN 48 -16.708 -0.694 3.987 348 HE22 GLN 48 HE22 GLN 48 -17.446 0.845 4.297 349 H GLN 49 H GLN 49 -12.324 -2.700 5.537 350 HA GLN 49 HA GLN 49 -10.439 -1.904 7.497 351 HB2 GLN 49 HB2 GLN 49 -10.000 -3.493 4.971 352 HB3 GLN 49 HB3 GLN 49 -8.864 -3.392 6.301 353 HG2 GLN 49 HG2 GLN 49 -10.544 -4.343 7.750 354 HG3 GLN 49 HG3 GLN 49 -11.616 -4.545 6.372 355 HE21 GLN 49 HE21 GLN 49 -11.663 -6.739 6.535 356 HE22 GLN 49 HE22 GLN 49 -10.312 -7.744 6.120 357 H LEU 50 H LEU 50 -10.669 -1.425 4.103 358 HA LEU 50 HA LEU 50 -8.338 0.103 3.684 359 HB2 LEU 50 HB2 LEU 50 -10.974 0.073 2.240 360 HB3 LEU 50 HB3 LEU 50 -9.573 0.950 1.622 361 HG LEU 50 HG LEU 50 -9.861 -2.045 1.975 362 HD11 LEU 50 HD11 LEU 50 -9.833 -2.096 -0.469 363 HD12 LEU 50 HD12 LEU 50 -9.783 -0.334 -0.506 364 HD13 LEU 50 HD13 LEU 50 -11.200 -1.162 0.139 365 HD21 LEU 50 HD21 LEU 50 -7.543 -1.326 2.290 366 HD22 LEU 50 HD22 LEU 50 -7.609 -0.445 0.766 367 HD23 LEU 50 HD23 LEU 50 -7.741 -2.203 0.774 368 H ARG 51 H ARG 51 -11.644 1.045 4.506 369 HA ARG 51 HA ARG 51 -11.324 3.831 4.619 370 HB2 ARG 51 HB2 ARG 51 -13.187 1.948 6.046 371 HB3 ARG 51 HB3 ARG 51 -13.244 3.676 6.330 372 HG2 ARG 51 HG2 ARG 51 -13.613 2.375 3.640 373 HG3 ARG 51 HG3 ARG 51 -14.930 2.865 4.716 374 HD2 ARG 51 HD2 ARG 51 -14.027 5.176 4.653 375 HD3 ARG 51 HD3 ARG 51 -12.842 4.642 3.469 376 HE ARG 51 HE ARG 51 -14.716 4.109 2.003 377 HH11 ARG 51 HH11 ARG 51 -15.389 6.300 4.710 378 HH12 ARG 51 HH12 ARG 51 -16.587 7.178 3.895 379 HH21 ARG 51 HH21 ARG 51 -16.323 5.426 0.842 380 HH22 ARG 51 HH22 ARG 51 -17.122 6.688 1.690 381 H GLU 52 H GLU 52 -10.479 1.353 6.917 382 HA GLU 52 HA GLU 52 -10.003 3.231 9.065 383 HB2 GLU 52 HB2 GLU 52 -9.486 0.286 8.813 384 HB3 GLU 52 HB3 GLU 52 -9.113 1.222 10.244 385 HG2 GLU 52 HG2 GLU 52 -11.497 1.778 10.466 386 HG3 GLU 52 HG3 GLU 52 -11.835 0.768 9.055 387 H GLY 53 H GLY 53 -8.258 2.223 6.392 388 HA2 GLY 53 HA2 GLY 53 -6.043 2.546 5.824 389 HA3 GLY 53 HA3 GLY 53 -5.799 3.309 7.395 390 H HIS 54 H HIS 54 -7.234 0.193 7.087 391 HA HIS 54 HA HIS 54 -5.136 -1.053 8.642 392 HB2 HIS 54 HB2 HIS 54 -7.536 -1.571 9.041 393 HB3 HIS 54 HB3 HIS 54 -7.679 -2.164 7.398 394 HD1 HIS 54 HD1 HIS 54 -7.263 -4.695 7.092 395 HD2 HIS 54 HD2 HIS 54 -5.885 -3.222 10.738 396 HE1 HIS 54 HE1 HIS 54 -6.570 -6.679 8.421 397 H LEU 55 H LEU 55 -6.088 -0.624 5.392 398 HA LEU 55 HA LEU 55 -3.779 -1.945 4.371 399 HB2 LEU 55 HB2 LEU 55 -5.536 -3.754 4.589 400 HB3 LEU 55 HB3 LEU 55 -6.565 -2.817 3.534 401 HG LEU 55 HG LEU 55 -4.892 -3.100 1.716 402 HD11 LEU 55 HD11 LEU 55 -3.129 -4.792 1.996 403 HD12 LEU 55 HD12 LEU 55 -3.543 -4.926 3.702 404 HD13 LEU 55 HD13 LEU 55 -2.898 -3.412 3.070 405 HD21 LEU 55 HD21 LEU 55 -5.908 -5.646 2.977 406 HD22 LEU 55 HD22 LEU 55 -5.402 -5.463 1.298 407 HD23 LEU 55 HD23 LEU 55 -6.814 -4.592 1.892 408 H VAL 56 H VAL 56 -3.592 -1.265 2.004 409 HA VAL 56 HA VAL 56 -5.376 0.945 1.326 410 HB VAL 56 HB VAL 56 -3.418 2.151 0.302 411 HG11 VAL 56 HG11 VAL 56 -2.550 3.092 2.405 412 HG12 VAL 56 HG12 VAL 56 -3.272 1.745 3.287 413 HG13 VAL 56 HG13 VAL 56 -4.302 2.895 2.440 414 HG21 VAL 56 HG21 VAL 56 -1.146 1.601 1.082 415 HG22 VAL 56 HG22 VAL 56 -1.856 0.306 0.118 416 HG23 VAL 56 HG23 VAL 56 -1.788 0.161 1.873 417 H ALA 57 H ALA 57 -5.358 1.454 -1.039 418 HA ALA 57 HA ALA 57 -4.572 -0.826 -2.673 419 HB1 ALA 57 HB1 ALA 57 -6.793 -1.059 -3.610 420 HB2 ALA 57 HB2 ALA 57 -7.395 0.214 -2.551 421 HB3 ALA 57 HB3 ALA 57 -6.836 -1.314 -1.864 422 H VAL 58 H VAL 58 -4.660 -0.413 -4.921 423 HA VAL 58 HA VAL 58 -4.903 2.378 -5.740 424 HB VAL 58 HB VAL 58 -2.931 2.036 -7.293 425 HG11 VAL 58 HG11 VAL 58 -1.300 2.573 -5.539 426 HG12 VAL 58 HG12 VAL 58 -2.464 2.031 -4.322 427 HG13 VAL 58 HG13 VAL 58 -2.828 3.430 -5.328 428 HG21 VAL 58 HG21 VAL 58 -2.412 -0.289 -5.427 429 HG22 VAL 58 HG22 VAL 58 -1.255 0.348 -6.597 430 HG23 VAL 58 HG23 VAL 58 -2.752 -0.398 -7.153 431 H ARG 59 H ARG 59 -4.927 2.541 -8.192 432 HA ARG 59 HA ARG 59 -6.676 0.362 -9.121 433 HB2 ARG 59 HB2 ARG 59 -7.886 2.383 -8.587 434 HB3 ARG 59 HB3 ARG 59 -6.810 3.331 -9.595 435 HG2 ARG 59 HG2 ARG 59 -7.713 2.394 -11.565 436 HG3 ARG 59 HG3 ARG 59 -8.563 1.140 -10.660 437 HD2 ARG 59 HD2 ARG 59 -10.075 2.943 -11.391 438 HD3 ARG 59 HD3 ARG 59 -10.004 2.796 -9.641 439 HE ARG 59 HE ARG 59 -8.136 4.713 -10.558 440 HH11 ARG 59 HH11 ARG 59 -11.649 4.316 -9.967 441 HH12 ARG 59 HH12 ARG 59 -11.925 5.980 -9.779 442 HH21 ARG 59 HH21 ARG 59 -8.533 6.954 -10.240 443 HH22 ARG 59 HH22 ARG 59 -10.107 7.523 -9.888 444 H ARG 60 H ARG 60 -6.135 -0.687 -10.806 445 HA ARG 60 HA ARG 60 -4.158 0.440 -12.682 446 HB2 ARG 60 HB2 ARG 60 -3.463 -1.894 -13.211 447 HB3 ARG 60 HB3 ARG 60 -3.195 -1.511 -11.521 448 HG2 ARG 60 HG2 ARG 60 -5.081 -2.819 -10.847 449 HG3 ARG 60 HG3 ARG 60 -5.614 -3.010 -12.513 450 HD2 ARG 60 HD2 ARG 60 -3.627 -4.347 -12.999 451 HD3 ARG 60 HD3 ARG 60 -3.063 -4.129 -11.344 452 HE ARG 60 HE ARG 60 -5.677 -5.194 -11.365 453 HH11 ARG 60 HH11 ARG 60 -2.367 -6.293 -12.146 454 HH12 ARG 60 HH12 ARG 60 -2.592 -7.809 -11.426 455 HH21 ARG 60 HH21 ARG 60 -5.960 -7.380 -10.414 456 HH22 ARG 60 HH22 ARG 60 -4.711 -8.474 -10.509 457 H ALA 61 H ALA 61 -5.105 1.004 -14.486 458 HA ALA 61 HA ALA 61 -6.470 1.182 -16.263 459 HB1 ALA 61 HB1 ALA 61 -6.975 -0.844 -17.506 460 HB2 ALA 61 HB2 ALA 61 -6.668 -1.827 -16.073 461 HB3 ALA 61 HB3 ALA 61 -5.347 -0.937 -16.833 462 H GLY 62 H GLY 62 -7.740 0.752 -13.438 463 HA2 GLY 62 HA2 GLY 62 -10.098 1.640 -13.325 464 HA3 GLY 62 HA3 GLY 62 -10.494 0.276 -14.363 465 H GLY 63 H GLY 63 -8.505 -1.422 -12.883 466 HA2 GLY 63 HA2 GLY 63 -10.444 -2.371 -10.947 467 HA3 GLY 63 HA3 GLY 63 -8.992 -3.201 -11.487 468 H VAL 64 H VAL 64 -10.170 -2.543 -8.812 469 HA VAL 64 HA VAL 64 -8.021 -0.903 -7.712 470 HB VAL 64 HB VAL 64 -10.514 -1.989 -6.352 471 HG11 VAL 64 HG11 VAL 64 -8.724 -1.562 -4.774 472 HG12 VAL 64 HG12 VAL 64 -10.001 -0.359 -4.581 473 HG13 VAL 64 HG13 VAL 64 -8.509 0.062 -5.423 474 HG21 VAL 64 HG21 VAL 64 -9.976 0.786 -7.420 475 HG22 VAL 64 HG22 VAL 64 -11.391 0.305 -6.485 476 HG23 VAL 64 HG23 VAL 64 -11.116 -0.380 -8.086 477 H VAL 65 H VAL 65 -6.364 -1.853 -6.829 478 HA VAL 65 HA VAL 65 -6.505 -4.667 -6.075 479 HB VAL 65 HB VAL 65 -4.294 -4.998 -7.189 480 HG11 VAL 65 HG11 VAL 65 -6.356 -5.787 -8.176 481 HG12 VAL 65 HG12 VAL 65 -5.250 -5.213 -9.428 482 HG13 VAL 65 HG13 VAL 65 -6.611 -4.213 -8.921 483 HG21 VAL 65 HG21 VAL 65 -3.633 -2.639 -7.400 484 HG22 VAL 65 HG22 VAL 65 -4.977 -2.379 -8.514 485 HG23 VAL 65 HG23 VAL 65 -3.650 -3.440 -8.976 486 H ILE 66 H ILE 66 -4.754 -5.401 -4.892 487 HA ILE 66 HA ILE 66 -3.250 -3.392 -3.393 488 HB ILE 66 HB ILE 66 -4.478 -5.913 -2.172 489 HG12 ILE 66 HG12 ILE 66 -5.717 -4.231 -0.648 490 HG13 ILE 66 HG13 ILE 66 -5.320 -3.018 -1.851 491 HG21 ILE 66 HG21 ILE 66 -3.650 -5.072 -0.038 492 HG22 ILE 66 HG22 ILE 66 -2.919 -3.699 -0.866 493 HG23 ILE 66 HG23 ILE 66 -2.344 -5.335 -1.197 494 HD11 ILE 66 HD11 ILE 66 -7.020 -5.472 -2.291 495 HD12 ILE 66 HD12 ILE 66 -6.622 -4.263 -3.511 496 HD13 ILE 66 HD13 ILE 66 -7.595 -3.813 -2.114 497 HA PRO 67 HA PRO 67 0.064 -6.121 -4.983 498 HB2 PRO 67 HB2 PRO 67 1.557 -4.838 -2.778 499 HB3 PRO 67 HB3 PRO 67 1.959 -4.918 -4.496 500 HG2 PRO 67 HG2 PRO 67 1.146 -2.639 -3.411 501 HG3 PRO 67 HG3 PRO 67 0.587 -3.112 -5.026 502 HD2 PRO 67 HD2 PRO 67 -0.850 -3.242 -2.406 503 HD3 PRO 67 HD3 PRO 67 -1.452 -2.779 -4.018 504 H GLN 68 H GLN 68 0.337 -8.194 -4.535 505 HA GLN 68 HA GLN 68 -0.378 -9.534 -2.257 506 HB2 GLN 68 HB2 GLN 68 1.809 -10.146 -4.153 507 HB3 GLN 68 HB3 GLN 68 1.029 -11.351 -3.099 508 HG2 GLN 68 HG2 GLN 68 -1.092 -10.694 -4.283 509 HG3 GLN 68 HG3 GLN 68 -0.070 -9.821 -5.417 510 HE21 GLN 68 HE21 GLN 68 -1.745 -11.778 -6.022 511 HE22 GLN 68 HE22 GLN 68 -0.892 -13.158 -6.636 512 H VAL 69 H VAL 69 2.513 -7.766 -2.808 513 HA VAL 69 HA VAL 69 4.165 -8.994 -0.885 514 HB VAL 69 HB VAL 69 5.579 -6.938 -1.097 515 HG11 VAL 69 HG11 VAL 69 4.603 -8.113 -3.699 516 HG12 VAL 69 HG12 VAL 69 5.857 -8.793 -2.664 517 HG13 VAL 69 HG13 VAL 69 6.120 -7.246 -3.468 518 HG21 VAL 69 HG21 VAL 69 3.390 -6.039 -2.962 519 HG22 VAL 69 HG22 VAL 69 4.942 -5.235 -2.737 520 HG23 VAL 69 HG23 VAL 69 3.787 -5.306 -1.406 521 H PHE 70 H PHE 70 1.459 -7.005 -0.477 522 HA PHE 70 HA PHE 70 2.177 -5.898 2.101 523 HB2 PHE 70 HB2 PHE 70 -0.225 -5.825 0.322 524 HB3 PHE 70 HB3 PHE 70 -0.446 -5.505 2.031 525 HD1 PHE 70 HD1 PHE 70 2.026 -4.488 -0.583 526 HD2 PHE 70 HD2 PHE 70 -0.606 -3.315 2.533 527 HE1 PHE 70 HE1 PHE 70 2.667 -2.144 -0.920 528 HE2 PHE 70 HE2 PHE 70 0.027 -0.973 2.213 529 HZ PHE 70 HZ PHE 70 1.652 -0.373 0.494 530 H PHE 71 H PHE 71 1.392 -8.884 1.011 531 HA PHE 71 HA PHE 71 -0.080 -9.582 3.431 532 HB2 PHE 71 HB2 PHE 71 -0.220 -10.824 0.682 533 HB3 PHE 71 HB3 PHE 71 -0.986 -11.495 2.114 534 HD1 PHE 71 HD1 PHE 71 -1.017 -8.701 -0.277 535 HD2 PHE 71 HD2 PHE 71 -3.028 -10.598 2.947 536 HE1 PHE 71 HE1 PHE 71 -3.012 -7.355 -0.733 537 HE2 PHE 71 HE2 PHE 71 -5.025 -9.246 2.505 538 HZ PHE 71 HZ PHE 71 -5.023 -7.621 0.659 539 H THR 72 H THR 72 0.390 -11.588 4.304 540 HA THR 72 HA THR 72 3.154 -12.268 4.262 541 HB THR 72 HB THR 72 2.433 -14.028 5.888 542 HG1 THR 72 HG1 THR 72 0.081 -13.446 6.576 543 HG21 THR 72 HG21 THR 72 1.362 -11.258 6.470 544 HG22 THR 72 HG22 THR 72 3.040 -11.767 6.671 545 HG23 THR 72 HG23 THR 72 1.778 -12.472 7.678 546 H ASN 73 H ASN 73 3.628 -14.709 4.187 547 HA ASN 73 HA ASN 73 3.204 -15.750 1.633 548 HB2 ASN 73 HB2 ASN 73 4.227 -17.815 2.479 549 HB3 ASN 73 HB3 ASN 73 5.094 -16.412 3.086 550 HD21 ASN 73 HD21 ASN 73 4.998 -19.132 4.126 551 HD22 ASN 73 HD22 ASN 73 4.409 -19.001 5.740 552 H SER 74 H SER 74 1.198 -15.850 4.388 553 HA SER 74 HA SER 74 -0.378 -18.111 3.536 554 HB2 SER 74 HB2 SER 74 0.071 -17.683 5.938 555 HB3 SER 74 HB3 SER 74 -0.778 -16.152 5.817 556 HG SER 74 HG SER 74 -2.285 -18.225 4.908 557 H GLY 75 H GLY 75 -0.213 -14.847 2.655 558 HA2 GLY 75 HA2 GLY 75 -1.566 -13.666 1.250 559 HA3 GLY 75 HA3 GLY 75 -2.750 -14.966 1.323 560 H GLN 76 H GLN 76 -1.472 -13.552 4.220 561 HA GLN 76 HA GLN 76 -4.095 -12.304 4.647 562 HB2 GLN 76 HB2 GLN 76 -2.245 -13.483 6.729 563 HB3 GLN 76 HB3 GLN 76 -3.829 -12.777 7.031 564 HG2 GLN 76 HG2 GLN 76 -3.258 -15.263 5.438 565 HG3 GLN 76 HG3 GLN 76 -3.930 -15.194 7.071 566 HE21 GLN 76 HE21 GLN 76 -5.011 -16.322 4.576 567 HE22 GLN 76 HE22 GLN 76 -6.545 -15.549 4.356 568 H VAL 77 H VAL 77 -4.021 -10.418 6.076 569 HA VAL 77 HA VAL 77 -2.011 -8.618 5.128 570 HB VAL 77 HB VAL 77 -4.102 -8.150 7.291 571 HG11 VAL 77 HG11 VAL 77 -2.319 -6.500 7.387 572 HG12 VAL 77 HG12 VAL 77 -3.809 -5.764 6.798 573 HG13 VAL 77 HG13 VAL 77 -2.517 -6.165 5.666 574 HG21 VAL 77 HG21 VAL 77 -5.144 -8.788 5.182 575 HG22 VAL 77 HG22 VAL 77 -4.230 -7.540 4.337 576 HG23 VAL 77 HG23 VAL 77 -5.443 -7.084 5.535 577 H VAL 78 H VAL 78 -0.148 -8.111 6.045 578 HA VAL 78 HA VAL 78 0.920 -9.463 8.280 579 HB VAL 78 HB VAL 78 1.805 -6.754 7.301 580 HG11 VAL 78 HG11 VAL 78 4.044 -7.452 8.015 581 HG12 VAL 78 HG12 VAL 78 3.365 -8.964 8.614 582 HG13 VAL 78 HG13 VAL 78 2.882 -7.428 9.339 583 HG21 VAL 78 HG21 VAL 78 3.319 -7.842 5.741 584 HG22 VAL 78 HG22 VAL 78 1.636 -8.188 5.352 585 HG23 VAL 78 HG23 VAL 78 2.631 -9.418 6.147 586 H LYS 79 H LYS 79 0.429 -9.130 10.347 587 HA LYS 79 HA LYS 79 -1.378 -7.203 11.229 588 HB2 LYS 79 HB2 LYS 79 -0.881 -7.906 13.503 589 HB3 LYS 79 HB3 LYS 79 -1.100 -9.268 12.410 590 HG2 LYS 79 HG2 LYS 79 1.255 -9.534 12.237 591 HG3 LYS 79 HG3 LYS 79 1.510 -8.142 13.293 592 HD2 LYS 79 HD2 LYS 79 0.260 -9.311 15.094 593 HD3 LYS 79 HD3 LYS 79 0.094 -10.711 14.040 594 HE2 LYS 79 HE2 LYS 79 2.705 -9.573 15.044 595 HE3 LYS 79 HE3 LYS 79 1.877 -10.976 15.707 596 HZ1 LYS 79 HZ1 LYS 79 3.597 -11.685 14.264 597 HZ2 LYS 79 HZ2 LYS 79 3.040 -10.750 12.984 598 HZ3 LYS 79 HZ3 LYS 79 2.136 -12.055 13.527 599 H SER 80 H SER 80 2.010 -6.873 10.897 600 HA SER 80 HA SER 80 2.212 -4.616 12.685 601 HB2 SER 80 HB2 SER 80 4.193 -5.788 10.735 602 HB3 SER 80 HB3 SER 80 4.567 -4.682 12.066 603 HG SER 80 HG SER 80 4.009 -6.226 13.502 604 H LEU 81 H LEU 81 1.295 -5.155 9.464 605 HA LEU 81 HA LEU 81 2.458 -2.927 8.254 606 HB2 LEU 81 HB2 LEU 81 2.024 -4.830 6.964 607 HB3 LEU 81 HB3 LEU 81 0.313 -4.808 7.326 608 HG LEU 81 HG LEU 81 1.505 -2.527 5.792 609 HD11 LEU 81 HD11 LEU 81 1.208 -3.823 3.740 610 HD12 LEU 81 HD12 LEU 81 0.812 -5.252 4.699 611 HD13 LEU 81 HD13 LEU 81 2.429 -4.553 4.780 612 HD21 LEU 81 HD21 LEU 81 -0.868 -2.503 6.467 613 HD22 LEU 81 HD22 LEU 81 -1.112 -4.031 5.623 614 HD23 LEU 81 HD23 LEU 81 -0.682 -2.583 4.713 615 HA PRO 82 HA PRO 82 -2.069 -0.843 8.669 616 HB2 PRO 82 HB2 PRO 82 -2.505 -1.867 11.442 617 HB3 PRO 82 HB3 PRO 82 -3.699 -1.481 10.199 618 HG2 PRO 82 HG2 PRO 82 -3.135 -3.999 10.685 619 HG3 PRO 82 HG3 PRO 82 -3.287 -3.443 9.009 620 HD2 PRO 82 HD2 PRO 82 -0.821 -4.025 10.594 621 HD3 PRO 82 HD3 PRO 82 -1.188 -4.404 8.898 622 H GLY 83 H GLY 83 0.222 -1.495 11.208 623 HA2 GLY 83 HA2 GLY 83 0.052 0.929 12.629 624 HA3 GLY 83 HA3 GLY 83 1.447 -0.146 12.596 625 H LEU 84 H LEU 84 2.069 -0.027 9.860 626 HA LEU 84 HA LEU 84 3.503 2.424 9.859 627 HB2 LEU 84 HB2 LEU 84 4.586 1.724 7.869 628 HB3 LEU 84 HB3 LEU 84 4.345 0.271 8.802 629 HG LEU 84 HG LEU 84 2.195 0.099 7.235 630 HD11 LEU 84 HD11 LEU 84 2.566 2.180 6.022 631 HD12 LEU 84 HD12 LEU 84 2.704 0.815 4.933 632 HD13 LEU 84 HD13 LEU 84 4.155 1.625 5.512 633 HD21 LEU 84 HD21 LEU 84 3.500 -1.376 5.763 634 HD22 LEU 84 HD22 LEU 84 3.926 -1.608 7.458 635 HD23 LEU 84 HD23 LEU 84 4.991 -0.682 6.402 636 H LEU 85 H LEU 85 0.672 1.247 8.195 637 HA LEU 85 HA LEU 85 0.360 3.407 6.426 638 HB2 LEU 85 HB2 LEU 85 -1.746 1.627 7.638 639 HB3 LEU 85 HB3 LEU 85 -2.007 2.713 6.290 640 HG LEU 85 HG LEU 85 -0.147 0.336 6.272 641 HD11 LEU 85 HD11 LEU 85 -1.813 -0.620 4.745 642 HD12 LEU 85 HD12 LEU 85 -2.873 0.754 5.072 643 HD13 LEU 85 HD13 LEU 85 -2.443 -0.356 6.368 644 HD21 LEU 85 HD21 LEU 85 0.623 2.095 4.771 645 HD22 LEU 85 HD22 LEU 85 -0.990 2.219 4.064 646 HD23 LEU 85 HD23 LEU 85 -0.050 0.749 3.850 647 H THR 86 H THR 86 -0.636 2.918 9.694 648 HA THR 86 HA THR 86 -2.326 5.184 9.788 649 HB THR 86 HB THR 86 -1.076 3.657 12.091 650 HG1 THR 86 HG1 THR 86 -2.354 2.294 10.966 651 HG21 THR 86 HG21 THR 86 -2.942 4.592 13.420 652 HG22 THR 86 HG22 THR 86 -3.457 5.543 12.027 653 HG23 THR 86 HG23 THR 86 -1.907 5.877 12.796 654 H ILE 87 H ILE 87 1.139 4.781 10.650 655 HA ILE 87 HA ILE 87 1.285 7.403 11.685 656 HB ILE 87 HB ILE 87 2.957 5.815 12.420 657 HG12 ILE 87 HG12 ILE 87 3.698 8.242 12.227 658 HG13 ILE 87 HG13 ILE 87 4.972 7.045 12.396 659 HG21 ILE 87 HG21 ILE 87 4.729 4.888 11.044 660 HG22 ILE 87 HG22 ILE 87 3.946 5.577 9.623 661 HG23 ILE 87 HG23 ILE 87 3.112 4.356 10.578 662 HD11 ILE 87 HD11 ILE 87 5.465 7.259 9.988 663 HD12 ILE 87 HD12 ILE 87 5.574 8.814 10.814 664 HD13 ILE 87 HD13 ILE 87 4.161 8.433 9.831 665 H LEU 88 H LEU 88 1.912 6.134 8.446 666 HA LEU 88 HA LEU 88 2.659 8.670 7.403 667 HB2 LEU 88 HB2 LEU 88 1.638 6.213 6.076 668 HB3 LEU 88 HB3 LEU 88 1.867 7.683 5.174 669 HG LEU 88 HG LEU 88 3.705 6.410 4.721 670 HD11 LEU 88 HD11 LEU 88 4.617 8.257 6.906 671 HD12 LEU 88 HD12 LEU 88 4.330 8.676 5.222 672 HD13 LEU 88 HD13 LEU 88 5.632 7.564 5.640 673 HD21 LEU 88 HD21 LEU 88 3.389 4.724 6.433 674 HD22 LEU 88 HD22 LEU 88 4.046 5.821 7.639 675 HD23 LEU 88 HD23 LEU 88 5.071 5.223 6.318 676 H HIS 89 H HIS 89 -0.443 7.100 7.780 677 HA HIS 89 HA HIS 89 -1.914 8.924 6.221 678 HB2 HIS 89 HB2 HIS 89 -2.719 6.653 7.062 679 HB3 HIS 89 HB3 HIS 89 -2.959 7.410 8.628 680 HD1 HIS 89 HD1 HIS 89 -5.311 8.273 8.986 681 HD2 HIS 89 HD2 HIS 89 -4.280 8.039 4.965 682 HE1 HIS 89 HE1 HIS 89 -7.382 8.894 7.684 683 H ASP 90 H ASP 90 -0.943 8.870 9.595 684 HA ASP 90 HA ASP 90 -2.303 11.217 10.417 685 HB2 ASP 90 HB2 ASP 90 -1.421 9.632 12.047 686 HB3 ASP 90 HB3 ASP 90 0.215 9.908 11.468 687 H GLY 91 H GLY 91 0.703 10.602 8.813 688 HA2 GLY 91 HA2 GLY 91 1.727 13.283 9.043 689 HA3 GLY 91 HA3 GLY 91 2.383 11.989 8.057 690 H GLY 92 H GLY 92 -0.623 11.850 7.102 691 HA2 GLY 92 HA2 GLY 92 -1.979 13.014 5.593 692 HA3 GLY 92 HA3 GLY 92 -0.732 14.242 5.451 693 H TYR 93 H TYR 93 0.124 10.902 5.095 694 HA TYR 93 HA TYR 93 0.651 11.421 2.263 695 HB2 TYR 93 HB2 TYR 93 1.764 9.409 4.206 696 HB3 TYR 93 HB3 TYR 93 2.051 9.291 2.474 697 HD1 TYR 93 HD1 TYR 93 2.601 11.450 5.462 698 HD2 TYR 93 HD2 TYR 93 3.758 10.556 1.469 699 HE1 TYR 93 HE1 TYR 93 4.536 12.943 5.693 700 HE2 TYR 93 HE2 TYR 93 5.698 12.035 1.687 701 HH TYR 93 HH TYR 93 6.834 13.203 4.623 702 H ARG 94 H ARG 94 -0.357 10.315 0.689 703 HA ARG 94 HA ARG 94 -2.495 8.566 1.536 704 HB2 ARG 94 HB2 ARG 94 -3.495 8.733 -0.608 705 HB3 ARG 94 HB3 ARG 94 -2.948 10.344 -0.185 706 HG2 ARG 94 HG2 ARG 94 -1.213 10.283 -1.766 707 HG3 ARG 94 HG3 ARG 94 -1.340 8.528 -1.965 708 HD2 ARG 94 HD2 ARG 94 -3.385 10.595 -2.780 709 HD3 ARG 94 HD3 ARG 94 -2.357 9.649 -3.864 710 HE ARG 94 HE ARG 94 -3.556 7.635 -2.968 711 HH11 ARG 94 HH11 ARG 94 -5.194 10.795 -3.100 712 HH12 ARG 94 HH12 ARG 94 -6.742 10.135 -2.888 713 HH21 ARG 94 HH21 ARG 94 -5.661 6.757 -2.698 714 HH22 ARG 94 HH22 ARG 94 -7.026 7.785 -2.672 715 H ASP 95 H ASP 95 -2.981 6.765 -0.104 716 HA ASP 95 HA ASP 95 -1.382 4.603 0.499 717 HB2 ASP 95 HB2 ASP 95 -2.613 3.489 -1.466 718 HB3 ASP 95 HB3 ASP 95 -3.578 4.157 -0.157 719 H THR 96 H THR 96 -1.431 6.313 -2.560 720 HA THR 96 HA THR 96 0.493 4.835 -3.916 721 HB THR 96 HB THR 96 -0.074 7.786 -4.276 722 HG1 THR 96 HG1 THR 96 -1.936 6.043 -4.248 723 HG21 THR 96 HG21 THR 96 0.467 7.319 -6.617 724 HG22 THR 96 HG22 THR 96 0.746 5.620 -6.222 725 HG23 THR 96 HG23 THR 96 1.810 6.857 -5.565 726 H GLU 97 H GLU 97 0.793 7.630 -1.805 727 HA GLU 97 HA GLU 97 3.507 8.225 -2.310 728 HB2 GLU 97 HB2 GLU 97 1.870 8.830 0.152 729 HB3 GLU 97 HB3 GLU 97 3.377 9.603 -0.325 730 HG2 GLU 97 HG2 GLU 97 0.796 9.722 -1.850 731 HG3 GLU 97 HG3 GLU 97 1.426 11.000 -0.808 732 H ILE 98 H ILE 98 1.843 6.188 0.033 733 HA ILE 98 HA ILE 98 4.015 5.615 1.764 734 HB ILE 98 HB ILE 98 2.062 3.435 1.057 735 HG12 ILE 98 HG12 ILE 98 0.533 5.290 1.291 736 HG13 ILE 98 HG13 ILE 98 0.461 4.294 2.737 737 HG21 ILE 98 HG21 ILE 98 3.266 4.303 3.668 738 HG22 ILE 98 HG22 ILE 98 3.802 2.966 2.655 739 HG23 ILE 98 HG23 ILE 98 2.217 2.903 3.427 740 HD11 ILE 98 HD11 ILE 98 1.796 5.876 3.933 741 HD12 ILE 98 HD12 ILE 98 0.372 6.660 3.256 742 HD13 ILE 98 HD13 ILE 98 1.947 6.883 2.491 743 H MET 99 H MET 99 2.743 4.064 -1.099 744 HA MET 99 HA MET 99 4.671 2.012 -1.062 745 HB2 MET 99 HB2 MET 99 2.583 2.748 -3.038 746 HB3 MET 99 HB3 MET 99 3.687 1.390 -3.288 747 HG2 MET 99 HG2 MET 99 2.952 0.510 -1.095 748 HG3 MET 99 HG3 MET 99 1.780 1.827 -1.046 749 HE1 MET 99 HE1 MET 99 0.764 2.062 -3.977 750 HE2 MET 99 HE2 MET 99 -0.289 2.024 -2.560 751 HE3 MET 99 HE3 MET 99 -0.621 0.973 -3.937 752 H ARG 100 H ARG 100 4.734 5.153 -2.251 753 HA ARG 100 HA ARG 100 6.412 4.900 -4.461 754 HB2 ARG 100 HB2 ARG 100 5.462 7.072 -3.846 755 HB3 ARG 100 HB3 ARG 100 6.426 7.099 -2.373 756 HG2 ARG 100 HG2 ARG 100 8.473 7.066 -3.768 757 HG3 ARG 100 HG3 ARG 100 7.451 7.188 -5.196 758 HD2 ARG 100 HD2 ARG 100 6.604 9.321 -4.420 759 HD3 ARG 100 HD3 ARG 100 7.585 9.189 -2.957 760 HE ARG 100 HE ARG 100 9.116 8.916 -5.347 761 HH11 ARG 100 HH11 ARG 100 7.714 11.410 -3.240 762 HH12 ARG 100 HH12 ARG 100 8.926 12.557 -3.580 763 HH21 ARG 100 HH21 ARG 100 10.749 10.482 -5.775 764 HH22 ARG 100 HH22 ARG 100 10.695 12.030 -5.054 765 H TRP 101 H TRP 101 7.483 5.723 -1.172 766 HA TRP 101 HA TRP 101 10.155 5.002 -1.754 767 HB2 TRP 101 HB2 TRP 101 10.477 5.269 0.788 768 HB3 TRP 101 HB3 TRP 101 10.022 6.685 -0.145 769 HD1 TRP 101 HD1 TRP 101 7.729 7.825 0.418 770 HE1 TRP 101 HE1 TRP 101 6.009 7.504 2.296 771 HE3 TRP 101 HE3 TRP 101 9.376 3.368 2.332 772 HZ2 TRP 101 HZ2 TRP 101 5.438 5.643 4.300 773 HZ3 TRP 101 HZ3 TRP 101 8.185 2.401 4.198 774 HH2 TRP 101 HH2 TRP 101 6.252 3.511 5.189 775 H LEU 102 H LEU 102 7.511 3.263 -0.364 776 HA LEU 102 HA LEU 102 8.878 1.133 0.828 777 HB2 LEU 102 HB2 LEU 102 6.243 1.681 -0.184 778 HB3 LEU 102 HB3 LEU 102 6.570 -0.045 -0.037 779 HG LEU 102 HG LEU 102 6.506 2.098 2.107 780 HD11 LEU 102 HD11 LEU 102 4.724 -0.261 1.553 781 HD12 LEU 102 HD12 LEU 102 4.347 1.441 1.256 782 HD13 LEU 102 HD13 LEU 102 4.592 0.866 2.910 783 HD21 LEU 102 HD21 LEU 102 7.246 -0.811 2.246 784 HD22 LEU 102 HD22 LEU 102 6.647 0.106 3.648 785 HD23 LEU 102 HD23 LEU 102 8.103 0.625 2.843 786 H PHE 103 H PHE 103 7.820 1.507 -2.560 787 HA PHE 103 HA PHE 103 8.834 -1.135 -3.177 788 HB2 PHE 103 HB2 PHE 103 7.315 0.894 -4.772 789 HB3 PHE 103 HB3 PHE 103 8.104 -0.457 -5.573 790 HD1 PHE 103 HD1 PHE 103 5.683 0.314 -2.844 791 HD2 PHE 103 HD2 PHE 103 7.038 -2.475 -5.738 792 HE1 PHE 103 HE1 PHE 103 3.762 -1.123 -2.351 793 HE2 PHE 103 HE2 PHE 103 5.128 -3.927 -5.248 794 HZ PHE 103 HZ PHE 103 3.477 -3.251 -3.550 795 H THR 104 H THR 104 10.140 1.863 -2.992 796 HA THR 104 HA THR 104 12.092 1.447 -5.080 797 HB THR 104 HB THR 104 11.925 3.605 -2.951 798 HG1 THR 104 HG1 THR 104 10.210 4.023 -4.171 799 HG21 THR 104 HG21 THR 104 13.451 3.473 -5.560 800 HG22 THR 104 HG22 THR 104 14.164 3.352 -3.953 801 HG23 THR 104 HG23 THR 104 13.409 4.860 -4.470 802 HA PRO 105 HA PRO 105 14.673 -0.897 -2.155 803 HB2 PRO 105 HB2 PRO 105 16.746 -0.113 -4.158 804 HB3 PRO 105 HB3 PRO 105 16.397 -1.710 -3.488 805 HG2 PRO 105 HG2 PRO 105 15.667 -1.108 -5.978 806 HG3 PRO 105 HG3 PRO 105 14.617 -2.077 -4.928 807 HD2 PRO 105 HD2 PRO 105 14.379 0.798 -5.703 808 HD3 PRO 105 HD3 PRO 105 13.109 -0.422 -5.457 809 H ASP 106 H ASP 106 15.646 -0.019 -0.450 810 HA ASP 106 HA ASP 106 16.162 2.832 -0.535 811 HB2 ASP 106 HB2 ASP 106 14.789 1.739 1.271 812 HB3 ASP 106 HB3 ASP 106 16.270 0.976 1.826 813 HA PRO 107 HA PRO 107 20.497 1.981 -1.143 814 HB2 PRO 107 HB2 PRO 107 21.373 4.531 -0.668 815 HB3 PRO 107 HB3 PRO 107 20.687 3.991 -2.201 816 HG2 PRO 107 HG2 PRO 107 19.367 5.459 0.045 817 HG3 PRO 107 HG3 PRO 107 19.232 5.737 -1.701 818 HD2 PRO 107 HD2 PRO 107 17.345 4.443 -0.333 819 HD3 PRO 107 HD3 PRO 107 17.761 3.970 -1.996 820 H SER 108 H SER 108 19.076 3.112 1.823 821 HA SER 108 HA SER 108 21.639 2.698 3.172 822 HB2 SER 108 HB2 SER 108 19.191 4.180 4.128 823 HB3 SER 108 HB3 SER 108 20.733 4.042 4.974 824 HG SER 108 HG SER 108 21.408 4.930 2.680 825 H LEU 109 H LEU 109 19.098 0.918 2.364 826 HA LEU 109 HA LEU 109 18.667 -0.109 5.058 827 HB2 LEU 109 HB2 LEU 109 16.674 0.525 3.769 828 HB3 LEU 109 HB3 LEU 109 17.100 -0.689 2.567 829 HG LEU 109 HG LEU 109 16.855 -2.424 4.323 830 HD11 LEU 109 HD11 LEU 109 15.640 -1.847 6.373 831 HD12 LEU 109 HD12 LEU 109 15.765 -0.137 5.956 832 HD13 LEU 109 HD13 LEU 109 17.221 -1.073 6.294 833 HD21 LEU 109 HD21 LEU 109 14.419 -2.387 4.340 834 HD22 LEU 109 HD22 LEU 109 15.069 -1.977 2.753 835 HD23 LEU 109 HD23 LEU 109 14.440 -0.703 3.807 836 H THR 110 H THR 110 19.536 -1.894 5.646 837 HA THR 110 HA THR 110 20.245 -3.901 3.660 838 HB THR 110 HB THR 110 21.777 -3.294 6.218 839 HG1 THR 110 HG1 THR 110 22.289 -1.651 4.863 840 HG21 THR 110 HG21 THR 110 22.409 -5.095 3.866 841 HG22 THR 110 HG22 THR 110 21.904 -5.628 5.466 842 HG23 THR 110 HG23 THR 110 23.462 -4.827 5.253 843 H ILE 111 H ILE 111 19.054 -5.640 4.051 844 HA ILE 111 HA ILE 111 18.092 -6.139 6.781 845 HB ILE 111 HB ILE 111 15.915 -6.841 5.778 846 HG12 ILE 111 HG12 ILE 111 16.852 -5.120 3.466 847 HG13 ILE 111 HG13 ILE 111 16.668 -6.866 3.420 848 HG21 ILE 111 HG21 ILE 111 14.983 -4.573 5.878 849 HG22 ILE 111 HG22 ILE 111 16.647 -3.944 5.852 850 HG23 ILE 111 HG23 ILE 111 16.115 -4.995 7.169 851 HD11 ILE 111 HD11 ILE 111 14.238 -6.542 3.856 852 HD12 ILE 111 HD12 ILE 111 14.810 -5.841 2.337 853 HD13 ILE 111 HD13 ILE 111 14.525 -4.800 3.721 854 H THR 112 H THR 112 17.142 -8.238 7.008 855 HA THR 112 HA THR 112 18.646 -10.222 5.516 856 HB THR 112 HB THR 112 17.959 -11.699 7.371 857 HG1 THR 112 HG1 THR 112 15.953 -9.875 7.562 858 HG21 THR 112 HG21 THR 112 18.688 -8.951 8.330 859 HG22 THR 112 HG22 THR 112 19.839 -10.193 7.835 860 HG23 THR 112 HG23 THR 112 18.856 -10.420 9.299 861 H ARG 113 H ARG 113 17.543 -11.333 3.906 862 HA ARG 113 HA ARG 113 14.646 -10.994 3.976 863 HB2 ARG 113 HB2 ARG 113 14.534 -10.186 1.709 864 HB3 ARG 113 HB3 ARG 113 15.507 -9.116 2.708 865 HG2 ARG 113 HG2 ARG 113 17.527 -10.077 1.754 866 HG3 ARG 113 HG3 ARG 113 16.543 -11.157 0.764 867 HD2 ARG 113 HD2 ARG 113 16.537 -8.150 0.674 868 HD3 ARG 113 HD3 ARG 113 17.271 -9.221 -0.521 869 HE ARG 113 HE ARG 113 14.390 -9.133 0.057 870 HH11 ARG 113 HH11 ARG 113 17.052 -9.314 -2.330 871 HH12 ARG 113 HH12 ARG 113 15.998 -9.317 -3.658 872 HH21 ARG 113 HH21 ARG 113 13.020 -9.136 -1.784 873 HH22 ARG 113 HH22 ARG 113 13.669 -9.203 -3.371 874 H ASP 114 H ASP 114 13.623 -11.990 2.103 875 HA ASP 114 HA ASP 114 12.778 -13.923 1.345 876 HB2 ASP 114 HB2 ASP 114 14.423 -13.196 -0.463 877 HB3 ASP 114 HB3 ASP 114 15.529 -14.407 0.180 878 H GLY 115 H GLY 115 12.580 -14.644 3.477 879 HA2 GLY 115 HA2 GLY 115 12.548 -16.618 4.767 880 HA3 GLY 115 HA3 GLY 115 14.004 -17.156 3.928 881 H SER 116 H SER 116 14.802 -14.204 4.408 882 HA SER 116 HA SER 116 16.079 -12.943 5.754 883 HB2 SER 116 HB2 SER 116 14.921 -14.555 8.030 884 HB3 SER 116 HB3 SER 116 15.743 -12.990 8.141 885 HG SER 116 HG SER 116 14.013 -11.994 7.363 886 H ARG 117 H ARG 117 16.974 -15.446 4.665 887 HA ARG 117 HA ARG 117 18.641 -16.898 6.413 888 HB2 ARG 117 HB2 ARG 117 19.607 -17.873 4.404 889 HB3 ARG 117 HB3 ARG 117 17.853 -17.794 4.320 890 HG2 ARG 117 HG2 ARG 117 18.004 -15.814 2.897 891 HG3 ARG 117 HG3 ARG 117 19.762 -15.902 2.971 892 HD2 ARG 117 HD2 ARG 117 19.664 -18.129 1.963 893 HD3 ARG 117 HD3 ARG 117 17.908 -17.980 1.842 894 HE ARG 117 HE ARG 117 19.910 -16.465 0.343 895 HH11 ARG 117 HH11 ARG 117 16.507 -17.164 0.926 896 HH12 ARG 117 HH12 ARG 117 15.954 -16.658 -0.584 897 HH21 ARG 117 HH21 ARG 117 19.181 -15.775 -1.806 898 HH22 ARG 117 HH22 ARG 117 17.530 -15.915 -2.210 899 H ASP 118 H ASP 118 19.170 -13.943 4.695 900 HA ASP 118 HA ASP 118 21.637 -13.456 6.014 901 HB2 ASP 118 HB2 ASP 118 22.504 -14.945 4.214 902 HB3 ASP 118 HB3 ASP 118 21.779 -13.900 3.002 903 H ALA 119 H ALA 119 22.553 -11.365 5.258 904 HA ALA 119 HA ALA 119 20.360 -9.492 4.946 905 HB1 ALA 119 HB1 ALA 119 21.953 -7.821 5.679 906 HB2 ALA 119 HB2 ALA 119 23.255 -9.010 5.621 907 HB3 ALA 119 HB3 ALA 119 21.947 -9.191 6.790 908 H VAL 120 H VAL 120 20.122 -8.180 3.325 909 HA VAL 120 HA VAL 120 22.058 -8.187 1.122 910 HB VAL 120 HB VAL 120 19.017 -8.153 0.915 911 HG11 VAL 120 HG11 VAL 120 21.092 -8.071 -1.267 912 HG12 VAL 120 HG12 VAL 120 20.027 -6.748 -0.799 913 HG13 VAL 120 HG13 VAL 120 19.353 -8.211 -1.520 914 HG21 VAL 120 HG21 VAL 120 19.219 -10.296 -0.220 915 HG22 VAL 120 HG22 VAL 120 19.914 -10.386 1.396 916 HG23 VAL 120 HG23 VAL 120 20.967 -10.258 -0.018 917 H SER 121 H SER 121 22.615 -6.181 0.483 918 HA SER 121 HA SER 121 21.508 -3.909 1.877 919 HB2 SER 121 HB2 SER 121 23.423 -2.794 0.613 920 HB3 SER 121 HB3 SER 121 23.884 -4.003 1.811 921 HG SER 121 HG SER 121 24.099 -4.054 -0.950 922 H ASN 122 H ASN 122 20.562 -2.192 0.923 923 HA ASN 122 HA ASN 122 19.252 -1.064 -0.389 924 HB2 ASN 122 HB2 ASN 122 20.910 -2.234 -2.639 925 HB3 ASN 122 HB3 ASN 122 19.681 -0.991 -2.840 926 HD21 ASN 122 HD21 ASN 122 21.163 0.503 -3.627 927 HD22 ASN 122 HD22 ASN 122 22.339 1.260 -2.621 928 H ALA 123 H ALA 123 17.760 -2.529 0.508 929 HA ALA 123 HA ALA 123 16.387 -3.998 -1.627 930 HB1 ALA 123 HB1 ALA 123 15.493 -5.513 0.061 931 HB2 ALA 123 HB2 ALA 123 16.355 -4.623 1.317 932 HB3 ALA 123 HB3 ALA 123 17.258 -5.506 0.085 933 H ARG 124 H ARG 124 14.013 -4.287 -1.090 934 HA ARG 124 HA ARG 124 12.850 -1.654 -0.938 935 HB2 ARG 124 HB2 ARG 124 11.516 -4.357 -1.064 936 HB3 ARG 124 HB3 ARG 124 10.741 -2.807 -1.328 937 HG2 ARG 124 HG2 ARG 124 11.945 -2.469 -3.331 938 HG3 ARG 124 HG3 ARG 124 12.959 -3.889 -3.001 939 HD2 ARG 124 HD2 ARG 124 9.985 -3.904 -3.519 940 HD3 ARG 124 HD3 ARG 124 11.231 -4.426 -4.655 941 HE ARG 124 HE ARG 124 11.682 -5.909 -2.412 942 HH11 ARG 124 HH11 ARG 124 9.010 -5.562 -4.687 943 HH12 ARG 124 HH12 ARG 124 8.320 -7.077 -4.373 944 HH21 ARG 124 HH21 ARG 124 10.726 -8.039 -1.914 945 HH22 ARG 124 HH22 ARG 124 9.307 -8.499 -2.693 946 HA PRO 125 HA PRO 125 11.920 -1.850 3.494 947 HB2 PRO 125 HB2 PRO 125 9.762 -0.071 2.485 948 HB3 PRO 125 HB3 PRO 125 10.792 0.165 3.913 949 HG2 PRO 125 HG2 PRO 125 11.261 1.567 1.736 950 HG3 PRO 125 HG3 PRO 125 12.626 0.811 2.581 951 HD2 PRO 125 HD2 PRO 125 11.242 -0.050 0.072 952 HD3 PRO 125 HD3 PRO 125 12.974 -0.074 0.474 953 H VAL 126 H VAL 126 9.573 -2.280 0.849 954 HA VAL 126 HA VAL 126 7.520 -3.506 2.401 955 HB VAL 126 HB VAL 126 8.134 -4.083 -0.524 956 HG11 VAL 126 HG11 VAL 126 5.601 -4.436 1.066 957 HG12 VAL 126 HG12 VAL 126 6.667 -5.721 0.509 958 HG13 VAL 126 HG13 VAL 126 5.788 -4.736 -0.662 959 HG21 VAL 126 HG21 VAL 126 6.232 -2.095 0.662 960 HG22 VAL 126 HG22 VAL 126 6.422 -2.454 -1.054 961 HG23 VAL 126 HG23 VAL 126 7.753 -1.720 -0.157 962 H ASP 127 H ASP 127 10.446 -4.706 0.912 963 HA ASP 127 HA ASP 127 9.835 -7.463 1.212 964 HB2 ASP 127 HB2 ASP 127 11.583 -6.277 -0.298 965 HB3 ASP 127 HB3 ASP 127 12.612 -6.296 1.129 966 H ALA 128 H ALA 128 11.271 -4.983 3.149 967 HA ALA 128 HA ALA 128 12.360 -6.556 5.239 968 HB1 ALA 128 HB1 ALA 128 12.601 -4.494 6.461 969 HB2 ALA 128 HB2 ALA 128 11.457 -3.695 5.391 970 HB3 ALA 128 HB3 ALA 128 13.019 -4.200 4.770 971 H LEU 129 H LEU 129 9.166 -5.134 4.760 972 HA LEU 129 HA LEU 129 8.405 -5.581 7.468 973 HB2 LEU 129 HB2 LEU 129 6.127 -4.992 6.833 974 HB3 LEU 129 HB3 LEU 129 7.275 -3.835 6.217 975 HG LEU 129 HG LEU 129 7.082 -5.248 4.042 976 HD11 LEU 129 HD11 LEU 129 5.745 -7.000 4.970 977 HD12 LEU 129 HD12 LEU 129 4.852 -6.185 3.675 978 HD13 LEU 129 HD13 LEU 129 4.460 -5.864 5.373 979 HD21 LEU 129 HD21 LEU 129 5.261 -3.768 3.280 980 HD22 LEU 129 HD22 LEU 129 6.463 -2.896 4.231 981 HD23 LEU 129 HD23 LEU 129 4.921 -3.346 4.956 982 H HIS 130 H HIS 130 8.103 -7.520 4.583 983 HA HIS 130 HA HIS 130 6.605 -9.545 5.963 984 HB2 HIS 130 HB2 HIS 130 6.473 -9.188 3.459 985 HB3 HIS 130 HB3 HIS 130 8.108 -9.820 3.332 986 HD1 HIS 130 HD1 HIS 130 7.730 -12.080 2.176 987 HD2 HIS 130 HD2 HIS 130 5.125 -11.436 5.353 988 HE1 HIS 130 HE1 HIS 130 6.449 -14.221 2.480 989 H ALA 131 H ALA 131 9.788 -8.590 5.770 990 HA ALA 131 HA ALA 131 10.955 -11.140 6.594 991 HB1 ALA 131 HB1 ALA 131 13.090 -9.934 6.672 992 HB2 ALA 131 HB2 ALA 131 12.258 -8.411 6.470 993 HB3 ALA 131 HB3 ALA 131 12.265 -9.584 5.152 994 H HIS 132 H HIS 132 9.064 -9.063 8.071 995 HA HIS 132 HA HIS 132 8.501 -8.481 10.176 996 HB2 HIS 132 HB2 HIS 132 10.400 -10.728 10.919 997 HB3 HIS 132 HB3 HIS 132 9.386 -9.885 12.088 998 HD1 HIS 132 HD1 HIS 132 9.370 -12.946 10.378 999 HD2 HIS 132 HD2 HIS 132 6.534 -9.967 10.949 1000 HE1 HIS 132 HE1 HIS 132 7.125 -14.036 10.008 1001 H GLN 133 H GLN 133 10.660 -7.231 8.828 1002 HA GLN 133 HA GLN 133 12.188 -6.144 11.026 1003 HB2 GLN 133 HB2 GLN 133 12.743 -6.310 8.096 1004 HB3 GLN 133 HB3 GLN 133 13.604 -5.161 9.119 1005 HG2 GLN 133 HG2 GLN 133 14.283 -7.033 10.571 1006 HG3 GLN 133 HG3 GLN 133 13.528 -8.141 9.424 1007 HE21 GLN 133 HE21 GLN 133 15.963 -5.781 9.855 1008 HE22 GLN 133 HE22 GLN 133 17.036 -6.310 8.612 1009 H ALA 134 H ALA 134 9.531 -5.577 10.448 1010 HA ALA 134 HA ALA 134 8.935 -3.326 9.014 1011 HB1 ALA 134 HB1 ALA 134 6.924 -3.137 10.334 1012 HB2 ALA 134 HB2 ALA 134 7.615 -4.193 11.570 1013 HB3 ALA 134 HB3 ALA 134 7.266 -4.826 9.963 1014 H ARG 135 H ARG 135 10.512 -3.391 12.182 1015 HA ARG 135 HA ARG 135 9.923 -0.712 12.863 1016 HB2 ARG 135 HB2 ARG 135 12.267 -2.409 13.660 1017 HB3 ARG 135 HB3 ARG 135 12.104 -0.749 14.192 1018 HG2 ARG 135 HG2 ARG 135 11.275 -2.017 15.973 1019 HG3 ARG 135 HG3 ARG 135 9.843 -1.429 15.148 1020 HD2 ARG 135 HD2 ARG 135 9.526 -3.749 15.719 1021 HD3 ARG 135 HD3 ARG 135 9.696 -3.602 13.974 1022 HE ARG 135 HE ARG 135 11.907 -4.440 14.148 1023 HH11 ARG 135 HH11 ARG 135 10.051 -4.720 17.163 1024 HH12 ARG 135 HH12 ARG 135 10.973 -6.033 17.736 1025 HH21 ARG 135 HH21 ARG 135 13.145 -6.257 14.970 1026 HH22 ARG 135 HH22 ARG 135 12.719 -6.916 16.484 1027 H GLU 136 H GLU 136 12.525 -2.042 10.895 1028 HA GLU 136 HA GLU 136 13.867 0.384 10.479 1029 HB2 GLU 136 HB2 GLU 136 13.700 -2.130 8.843 1030 HB3 GLU 136 HB3 GLU 136 14.650 -0.755 8.294 1031 HG2 GLU 136 HG2 GLU 136 16.200 -2.189 9.284 1032 HG3 GLU 136 HG3 GLU 136 15.893 -0.983 10.520 1033 H VAL 137 H VAL 137 11.086 -1.033 9.039 1034 HA VAL 137 HA VAL 137 10.837 0.751 6.822 1035 HB VAL 137 HB VAL 137 8.676 -0.869 8.192 1036 HG11 VAL 137 HG11 VAL 137 8.795 0.253 5.395 1037 HG12 VAL 137 HG12 VAL 137 7.768 0.824 6.709 1038 HG13 VAL 137 HG13 VAL 137 7.519 -0.785 6.030 1039 HG21 VAL 137 HG21 VAL 137 10.470 -1.652 5.903 1040 HG22 VAL 137 HG22 VAL 137 9.109 -2.598 6.504 1041 HG23 VAL 137 HG23 VAL 137 10.508 -2.313 7.536 1042 H VAL 138 H VAL 138 9.323 0.497 10.011 1043 HA VAL 138 HA VAL 138 7.674 2.738 9.827 1044 HB VAL 138 HB VAL 138 8.873 1.516 12.332 1045 HG11 VAL 138 HG11 VAL 138 6.982 2.581 13.517 1046 HG12 VAL 138 HG12 VAL 138 6.507 3.377 12.017 1047 HG13 VAL 138 HG13 VAL 138 8.051 3.770 12.776 1048 HG21 VAL 138 HG21 VAL 138 6.201 1.061 10.998 1049 HG22 VAL 138 HG22 VAL 138 6.706 0.360 12.535 1050 HG23 VAL 138 HG23 VAL 138 7.545 -0.080 11.050 1051 H ARG 139 H ARG 139 10.976 2.447 11.100 1052 HA ARG 139 HA ARG 139 11.058 5.148 11.825 1053 HB2 ARG 139 HB2 ARG 139 13.453 4.936 12.170 1054 HB3 ARG 139 HB3 ARG 139 12.580 3.546 12.788 1055 HG2 ARG 139 HG2 ARG 139 13.284 2.255 10.872 1056 HG3 ARG 139 HG3 ARG 139 14.205 3.647 10.277 1057 HD2 ARG 139 HD2 ARG 139 15.465 3.707 12.361 1058 HD3 ARG 139 HD3 ARG 139 14.566 2.320 12.952 1059 HE ARG 139 HE ARG 139 16.282 2.211 10.586 1060 HH11 ARG 139 HH11 ARG 139 15.086 0.766 13.591 1061 HH12 ARG 139 HH12 ARG 139 16.255 -0.453 13.666 1062 HH21 ARG 139 HH21 ARG 139 17.983 0.529 10.730 1063 HH22 ARG 139 HH22 ARG 139 17.964 -0.562 12.038 1064 H ARG 140 H ARG 140 11.917 3.623 8.774 1065 HA ARG 140 HA ARG 140 12.840 6.000 7.543 1066 HB2 ARG 140 HB2 ARG 140 11.839 3.391 6.552 1067 HB3 ARG 140 HB3 ARG 140 11.746 4.735 5.430 1068 HG2 ARG 140 HG2 ARG 140 14.239 3.708 6.777 1069 HG3 ARG 140 HG3 ARG 140 13.781 3.454 5.092 1070 HD2 ARG 140 HD2 ARG 140 13.681 6.077 5.020 1071 HD3 ARG 140 HD3 ARG 140 14.711 5.961 6.446 1072 HE ARG 140 HE ARG 140 15.530 4.428 4.132 1073 HH11 ARG 140 HH11 ARG 140 16.004 7.462 5.920 1074 HH12 ARG 140 HH12 ARG 140 17.442 7.844 5.088 1075 HH21 ARG 140 HH21 ARG 140 17.428 4.941 3.075 1076 HH22 ARG 140 HH22 ARG 140 18.300 6.381 3.409 1077 H ALA 141 H ALA 141 9.658 4.605 7.918 1078 HA ALA 141 HA ALA 141 8.169 6.393 6.384 1079 HB1 ALA 141 HB1 ALA 141 6.294 5.698 7.828 1080 HB2 ALA 141 HB2 ALA 141 7.447 4.866 8.874 1081 HB3 ALA 141 HB3 ALA 141 7.231 4.345 7.195 1082 H GLN 142 H GLN 142 9.004 6.417 9.813 1083 HA GLN 142 HA GLN 142 7.753 8.808 10.539 1084 HB2 GLN 142 HB2 GLN 142 10.165 7.420 11.688 1085 HB3 GLN 142 HB3 GLN 142 9.402 8.815 12.435 1086 HG2 GLN 142 HG2 GLN 142 7.341 7.572 12.709 1087 HG3 GLN 142 HG3 GLN 142 8.048 6.188 11.879 1088 HE21 GLN 142 HE21 GLN 142 6.955 6.417 14.570 1089 HE22 GLN 142 HE22 GLN 142 8.242 5.946 15.627 1090 H ALA 143 H ALA 143 11.059 8.189 9.453 1091 HA ALA 143 HA ALA 143 11.917 10.875 9.601 1092 HB1 ALA 143 HB1 ALA 143 13.467 8.982 9.549 1093 HB2 ALA 143 HB2 ALA 143 13.830 10.150 8.275 1094 HB3 ALA 143 HB3 ALA 143 13.000 8.645 7.884 1095 H MET 144 H MET 144 10.044 9.201 7.298 1096 HA MET 144 HA MET 144 10.451 11.090 5.141 1097 HB2 MET 144 HB2 MET 144 9.937 8.734 4.643 1098 HB3 MET 144 HB3 MET 144 8.413 8.879 5.496 1099 HG2 MET 144 HG2 MET 144 8.021 8.947 3.125 1100 HG3 MET 144 HG3 MET 144 7.645 10.515 3.829 1101 HE1 MET 144 HE1 MET 144 10.148 8.435 1.643 1102 HE2 MET 144 HE2 MET 144 11.205 8.977 2.946 1103 HE3 MET 144 HE3 MET 144 11.424 9.610 1.315 1104 H ALA 145 H ALA 145 8.012 10.399 7.578 1105 HA ALA 145 HA ALA 145 6.245 12.422 6.572 1106 HB1 ALA 145 HB1 ALA 145 4.765 11.789 8.389 1107 HB2 ALA 145 HB2 ALA 145 6.046 10.813 9.110 1108 HB3 ALA 145 HB3 ALA 145 5.362 10.359 7.547 1109 H TYR 146 H TYR 146 8.191 12.054 9.541 1110 HA TYR 146 HA TYR 146 7.804 14.912 9.984 1111 HB2 TYR 146 HB2 TYR 146 7.952 12.690 12.037 1112 HB3 TYR 146 HB3 TYR 146 7.995 14.406 12.428 1113 HD1 TYR 146 HD1 TYR 146 6.012 15.798 12.069 1114 HD2 TYR 146 HD2 TYR 146 5.873 11.596 11.455 1115 HE1 TYR 146 HE1 TYR 146 3.558 15.882 12.103 1116 HE2 TYR 146 HE2 TYR 146 3.406 11.670 11.483 1117 HH TYR 146 HH TYR 146 1.584 13.055 12.233 Start of MODEL 12 1 H MET 1 H MET 1 -22.832 13.939 45.441 2 HA MET 1 HA MET 1 -20.616 14.824 45.028 3 HB2 MET 1 HB2 MET 1 -21.540 12.692 43.088 4 HB3 MET 1 HB3 MET 1 -19.857 13.096 43.357 5 HG2 MET 1 HG2 MET 1 -20.098 12.401 45.705 6 HG3 MET 1 HG3 MET 1 -21.771 11.948 45.378 7 HE1 MET 1 HE1 MET 1 -21.177 9.560 46.390 8 HE2 MET 1 HE2 MET 1 -19.492 10.022 46.621 9 HE3 MET 1 HE3 MET 1 -19.888 8.523 45.777 10 HA PRO 2 HA PRO 2 -20.354 17.552 41.515 11 HB2 PRO 2 HB2 PRO 2 -17.582 17.562 41.317 12 HB3 PRO 2 HB3 PRO 2 -18.511 18.646 42.349 13 HG2 PRO 2 HG2 PRO 2 -16.989 16.202 43.058 14 HG3 PRO 2 HG3 PRO 2 -17.302 17.656 44.019 15 HD2 PRO 2 HD2 PRO 2 -18.576 15.260 44.383 16 HD3 PRO 2 HD3 PRO 2 -19.267 16.827 44.832 17 H GLY 3 H GLY 3 -20.769 16.796 39.548 18 HA2 GLY 3 HA2 GLY 3 -19.841 14.180 38.812 19 HA3 GLY 3 HA3 GLY 3 -20.988 15.181 37.934 20 H ARG 4 H ARG 4 -17.787 14.182 38.237 21 HA ARG 4 HA ARG 4 -16.634 16.178 36.524 22 HB2 ARG 4 HB2 ARG 4 -15.616 13.442 37.317 23 HB3 ARG 4 HB3 ARG 4 -14.717 14.526 36.278 24 HG2 ARG 4 HG2 ARG 4 -13.760 14.711 38.434 25 HG3 ARG 4 HG3 ARG 4 -14.726 16.168 38.216 26 HD2 ARG 4 HD2 ARG 4 -16.526 15.156 39.528 27 HD3 ARG 4 HD3 ARG 4 -15.555 13.700 39.735 28 HE ARG 4 HE ARG 4 -14.257 16.095 40.609 29 HH11 ARG 4 HH11 ARG 4 -16.519 13.544 41.608 30 HH12 ARG 4 HH12 ARG 4 -16.198 13.702 43.256 31 HH21 ARG 4 HH21 ARG 4 -13.814 16.313 42.923 32 HH22 ARG 4 HH22 ARG 4 -14.645 15.306 44.006 33 H ALA 5 H ALA 5 -16.196 15.991 34.323 34 HA ALA 5 HA ALA 5 -17.899 14.047 32.990 35 HB1 ALA 5 HB1 ALA 5 -18.254 16.416 32.459 36 HB2 ALA 5 HB2 ALA 5 -17.722 15.499 31.048 37 HB3 ALA 5 HB3 ALA 5 -16.583 16.534 31.905 38 HA PRO 6 HA PRO 6 -13.960 12.077 31.831 39 HB2 PRO 6 HB2 PRO 6 -15.588 9.744 31.219 40 HB3 PRO 6 HB3 PRO 6 -14.379 9.917 32.489 41 HG2 PRO 6 HG2 PRO 6 -17.030 9.662 33.004 42 HG3 PRO 6 HG3 PRO 6 -15.921 10.557 34.058 43 HD2 PRO 6 HD2 PRO 6 -17.816 11.616 31.985 44 HD3 PRO 6 HD3 PRO 6 -17.479 12.210 33.631 45 H GLY 7 H GLY 7 -13.605 10.641 29.682 46 HA2 GLY 7 HA2 GLY 7 -15.458 11.311 27.620 47 HA3 GLY 7 HA3 GLY 7 -13.941 12.195 27.541 48 H SER 8 H SER 8 -15.343 9.964 26.040 49 HA SER 8 HA SER 8 -13.076 8.119 25.879 50 HB2 SER 8 HB2 SER 8 -15.831 7.963 24.604 51 HB3 SER 8 HB3 SER 8 -14.611 6.691 24.591 52 HG SER 8 HG SER 8 -14.791 7.136 27.048 53 H THR 9 H THR 9 -11.547 8.877 24.522 54 HA THR 9 HA THR 9 -12.246 10.623 22.320 55 HB THR 9 HB THR 9 -9.502 9.636 23.169 56 HG1 THR 9 HG1 THR 9 -10.100 10.721 24.891 57 HG21 THR 9 HG21 THR 9 -9.661 10.658 20.898 58 HG22 THR 9 HG22 THR 9 -8.698 11.644 22.004 59 HG23 THR 9 HG23 THR 9 -10.358 12.101 21.625 60 H LEU 10 H LEU 10 -12.078 10.056 20.196 61 HA LEU 10 HA LEU 10 -11.764 7.222 19.604 62 HB2 LEU 10 HB2 LEU 10 -12.680 9.511 17.910 63 HB3 LEU 10 HB3 LEU 10 -12.634 7.837 17.383 64 HG LEU 10 HG LEU 10 -14.422 9.019 19.517 65 HD11 LEU 10 HD11 LEU 10 -16.206 8.422 17.968 66 HD12 LEU 10 HD12 LEU 10 -14.995 7.838 16.820 67 HD13 LEU 10 HD13 LEU 10 -15.057 9.549 17.240 68 HD21 LEU 10 HD21 LEU 10 -15.446 6.789 19.630 69 HD22 LEU 10 HD22 LEU 10 -13.761 6.749 20.151 70 HD23 LEU 10 HD23 LEU 10 -14.206 6.166 18.546 71 H ALA 11 H ALA 11 -10.405 6.469 18.027 72 HA ALA 11 HA ALA 11 -8.029 8.099 17.560 73 HB1 ALA 11 HB1 ALA 11 -7.686 5.848 18.468 74 HB2 ALA 11 HB2 ALA 11 -6.985 5.983 16.856 75 HB3 ALA 11 HB3 ALA 11 -8.523 5.152 17.083 76 H ARG 12 H ARG 12 -8.255 9.342 15.833 77 HA ARG 12 HA ARG 12 -9.966 8.562 13.689 78 HB2 ARG 12 HB2 ARG 12 -8.355 11.047 14.165 79 HB3 ARG 12 HB3 ARG 12 -9.145 10.750 12.623 80 HG2 ARG 12 HG2 ARG 12 -11.303 10.647 13.708 81 HG3 ARG 12 HG3 ARG 12 -10.550 10.842 15.290 82 HD2 ARG 12 HD2 ARG 12 -11.551 12.934 14.386 83 HD3 ARG 12 HD3 ARG 12 -9.832 13.066 14.735 84 HE ARG 12 HE ARG 12 -9.582 12.594 12.242 85 HH11 ARG 12 HH11 ARG 12 -12.344 14.417 13.549 86 HH12 ARG 12 HH12 ARG 12 -12.492 15.409 12.183 87 HH21 ARG 12 HH21 ARG 12 -9.805 13.940 10.395 88 HH22 ARG 12 HH22 ARG 12 -11.014 15.136 10.330 89 H VAL 13 H VAL 13 -9.027 6.736 12.991 90 HA VAL 13 HA VAL 13 -6.904 7.165 11.014 91 HB VAL 13 HB VAL 13 -7.544 4.543 12.444 92 HG11 VAL 13 HG11 VAL 13 -5.266 5.255 10.601 93 HG12 VAL 13 HG12 VAL 13 -6.669 4.265 10.204 94 HG13 VAL 13 HG13 VAL 13 -5.504 3.699 11.405 95 HG21 VAL 13 HG21 VAL 13 -6.501 6.074 14.041 96 HG22 VAL 13 HG22 VAL 13 -5.183 6.371 12.908 97 HG23 VAL 13 HG23 VAL 13 -5.389 4.769 13.615 98 H GLY 14 H GLY 14 -7.822 6.994 9.036 99 HA2 GLY 14 HA2 GLY 14 -10.266 5.395 8.852 100 HA3 GLY 14 HA3 GLY 14 -10.253 7.060 8.302 101 H SER 15 H SER 15 -10.782 6.515 6.272 102 HA SER 15 HA SER 15 -9.372 4.528 4.781 103 HB2 SER 15 HB2 SER 15 -11.547 6.454 3.987 104 HB3 SER 15 HB3 SER 15 -11.008 5.040 3.066 105 HG SER 15 HG SER 15 -11.384 3.973 5.153 106 H ILE 16 H ILE 16 -7.634 4.880 3.581 107 HA ILE 16 HA ILE 16 -7.079 7.577 2.650 108 HB ILE 16 HB ILE 16 -5.357 5.051 2.514 109 HG12 ILE 16 HG12 ILE 16 -3.753 6.423 3.965 110 HG13 ILE 16 HG13 ILE 16 -5.078 7.544 4.217 111 HG21 ILE 16 HG21 ILE 16 -4.955 6.426 0.569 112 HG22 ILE 16 HG22 ILE 16 -3.557 6.462 1.644 113 HG23 ILE 16 HG23 ILE 16 -4.667 7.832 1.591 114 HD11 ILE 16 HD11 ILE 16 -4.816 6.030 6.097 115 HD12 ILE 16 HD12 ILE 16 -5.029 4.640 5.029 116 HD13 ILE 16 HD13 ILE 16 -6.364 5.762 5.295 117 HA PRO 17 HA PRO 17 -9.109 6.065 -1.080 118 HB2 PRO 17 HB2 PRO 17 -8.324 8.603 -2.309 119 HB3 PRO 17 HB3 PRO 17 -9.945 7.993 -1.962 120 HG2 PRO 17 HG2 PRO 17 -8.891 10.050 -0.581 121 HG3 PRO 17 HG3 PRO 17 -9.968 8.861 0.175 122 HD2 PRO 17 HD2 PRO 17 -6.978 9.044 0.289 123 HD3 PRO 17 HD3 PRO 17 -8.159 8.723 1.585 124 H ALA 18 H ALA 18 -8.514 5.318 -3.085 125 HA ALA 18 HA ALA 18 -5.684 4.884 -3.464 126 HB1 ALA 18 HB1 ALA 18 -7.250 3.028 -3.722 127 HB2 ALA 18 HB2 ALA 18 -6.413 3.347 -5.242 128 HB3 ALA 18 HB3 ALA 18 -8.072 3.888 -5.022 129 H GLY 19 H GLY 19 -4.449 5.829 -4.935 130 HA2 GLY 19 HA2 GLY 19 -5.761 7.613 -6.883 131 HA3 GLY 19 HA3 GLY 19 -4.250 8.003 -6.070 132 H ASP 20 H ASP 20 -2.319 6.869 -6.682 133 HA ASP 20 HA ASP 20 -2.573 5.612 -9.319 134 HB2 ASP 20 HB2 ASP 20 -1.686 7.866 -9.582 135 HB3 ASP 20 HB3 ASP 20 -0.435 7.534 -8.388 136 H ASP 21 H ASP 21 -1.735 3.701 -9.498 137 HA ASP 21 HA ASP 21 -0.357 2.502 -7.278 138 HB2 ASP 21 HB2 ASP 21 -2.023 1.157 -8.368 139 HB3 ASP 21 HB3 ASP 21 -1.262 1.395 -9.937 140 H VAL 22 H VAL 22 1.638 1.643 -7.276 141 HA VAL 22 HA VAL 22 3.539 2.884 -9.157 142 HB VAL 22 HB VAL 22 3.961 2.068 -6.253 143 HG11 VAL 22 HG11 VAL 22 5.842 3.539 -8.092 144 HG12 VAL 22 HG12 VAL 22 6.039 1.894 -7.492 145 HG13 VAL 22 HG13 VAL 22 6.091 3.255 -6.366 146 HG21 VAL 22 HG21 VAL 22 3.664 4.814 -7.469 147 HG22 VAL 22 HG22 VAL 22 4.073 4.487 -5.786 148 HG23 VAL 22 HG23 VAL 22 2.500 4.004 -6.425 149 H LEU 23 H LEU 23 2.162 -0.037 -8.254 150 HA LEU 23 HA LEU 23 4.285 -1.870 -8.273 151 HB2 LEU 23 HB2 LEU 23 1.364 -2.084 -8.812 152 HB3 LEU 23 HB3 LEU 23 2.426 -3.465 -8.938 153 HG LEU 23 HG LEU 23 2.242 -1.864 -6.394 154 HD11 LEU 23 HD11 LEU 23 0.607 -4.214 -7.314 155 HD12 LEU 23 HD12 LEU 23 -0.019 -2.595 -6.993 156 HD13 LEU 23 HD13 LEU 23 0.618 -3.584 -5.671 157 HD21 LEU 23 HD21 LEU 23 3.017 -3.952 -5.449 158 HD22 LEU 23 HD22 LEU 23 4.126 -3.405 -6.701 159 HD23 LEU 23 HD23 LEU 23 2.987 -4.708 -7.043 160 H ASP 24 H ASP 24 4.761 -3.433 -9.780 161 HA ASP 24 HA ASP 24 4.737 -2.649 -12.548 162 HB2 ASP 24 HB2 ASP 24 6.723 -3.809 -11.797 163 HB3 ASP 24 HB3 ASP 24 5.806 -5.104 -11.067 164 HA PRO 25 HA PRO 25 0.696 -4.194 -13.411 165 HB2 PRO 25 HB2 PRO 25 1.971 -5.391 -15.819 166 HB3 PRO 25 HB3 PRO 25 0.490 -4.428 -15.699 167 HG2 PRO 25 HG2 PRO 25 2.704 -3.286 -16.568 168 HG3 PRO 25 HG3 PRO 25 1.666 -2.429 -15.413 169 HD2 PRO 25 HD2 PRO 25 4.274 -3.808 -14.945 170 HD3 PRO 25 HD3 PRO 25 3.620 -2.326 -14.218 171 H ASP 26 H ASP 26 3.335 -6.567 -13.579 172 HA ASP 26 HA ASP 26 1.330 -8.544 -12.849 173 HB2 ASP 26 HB2 ASP 26 3.480 -8.795 -14.856 174 HB3 ASP 26 HB3 ASP 26 3.139 -10.206 -13.858 175 H GLU 27 H GLU 27 3.095 -6.834 -11.239 176 HA GLU 27 HA GLU 27 4.834 -8.635 -9.820 177 HB2 GLU 27 HB2 GLU 27 4.790 -6.000 -9.815 178 HB3 GLU 27 HB3 GLU 27 3.470 -6.179 -8.692 179 HG2 GLU 27 HG2 GLU 27 5.437 -5.778 -7.430 180 HG3 GLU 27 HG3 GLU 27 4.996 -7.468 -7.194 181 HA PRO 28 HA PRO 28 1.731 -11.092 -7.600 182 HB2 PRO 28 HB2 PRO 28 2.881 -10.411 -5.031 183 HB3 PRO 28 HB3 PRO 28 2.971 -11.948 -5.893 184 HG2 PRO 28 HG2 PRO 28 4.914 -9.739 -5.767 185 HG3 PRO 28 HG3 PRO 28 5.176 -11.438 -6.182 186 HD2 PRO 28 HD2 PRO 28 5.315 -9.490 -8.015 187 HD3 PRO 28 HD3 PRO 28 4.663 -11.092 -8.420 188 H THR 29 H THR 29 -0.209 -10.143 -7.620 189 HA THR 29 HA THR 29 -0.676 -7.872 -5.852 190 HB THR 29 HB THR 29 -2.390 -7.375 -7.837 191 HG1 THR 29 HG1 THR 29 -0.080 -8.454 -9.084 192 HG21 THR 29 HG21 THR 29 0.524 -6.577 -7.799 193 HG22 THR 29 HG22 THR 29 -0.778 -5.793 -6.904 194 HG23 THR 29 HG23 THR 29 -0.760 -5.732 -8.668 195 H TYR 30 H TYR 30 -2.981 -7.491 -5.417 196 HA TYR 30 HA TYR 30 -4.701 -9.754 -5.773 197 HB2 TYR 30 HB2 TYR 30 -4.273 -8.133 -3.252 198 HB3 TYR 30 HB3 TYR 30 -5.743 -9.048 -3.571 199 HD1 TYR 30 HD1 TYR 30 -4.965 -11.538 -4.573 200 HD2 TYR 30 HD2 TYR 30 -2.985 -9.173 -1.671 201 HE1 TYR 30 HE1 TYR 30 -3.926 -13.555 -3.675 202 HE2 TYR 30 HE2 TYR 30 -1.934 -11.170 -0.739 203 HH TYR 30 HH TYR 30 -2.177 -13.550 -0.706 204 H ASP 31 H ASP 31 -6.871 -9.014 -5.590 205 HA ASP 31 HA ASP 31 -7.342 -6.280 -6.496 206 HB2 ASP 31 HB2 ASP 31 -8.510 -8.814 -7.750 207 HB3 ASP 31 HB3 ASP 31 -8.840 -7.169 -8.256 208 H LEU 32 H LEU 32 -9.765 -5.922 -6.140 209 HA LEU 32 HA LEU 32 -10.268 -6.446 -3.486 210 HB2 LEU 32 HB2 LEU 32 -12.281 -5.643 -5.582 211 HB3 LEU 32 HB3 LEU 32 -12.582 -5.598 -3.859 212 HG LEU 32 HG LEU 32 -10.517 -3.957 -5.335 213 HD11 LEU 32 HD11 LEU 32 -11.937 -2.065 -4.726 214 HD12 LEU 32 HD12 LEU 32 -13.126 -3.183 -4.054 215 HD13 LEU 32 HD13 LEU 32 -12.765 -3.210 -5.780 216 HD21 LEU 32 HD21 LEU 32 -9.731 -4.478 -3.090 217 HD22 LEU 32 HD22 LEU 32 -11.280 -3.966 -2.412 218 HD23 LEU 32 HD23 LEU 32 -10.228 -2.791 -3.190 219 HA PRO 33 HA PRO 33 -13.429 -10.003 -4.346 220 HB2 PRO 33 HB2 PRO 33 -13.081 -11.330 -6.741 221 HB3 PRO 33 HB3 PRO 33 -14.319 -10.104 -6.463 222 HG2 PRO 33 HG2 PRO 33 -11.641 -9.835 -7.760 223 HG3 PRO 33 HG3 PRO 33 -13.191 -9.130 -8.253 224 HD2 PRO 33 HD2 PRO 33 -11.329 -7.682 -6.985 225 HD3 PRO 33 HD3 PRO 33 -13.061 -7.448 -6.662 226 H ARG 34 H ARG 34 -10.206 -10.083 -5.738 227 HA ARG 34 HA ARG 34 -9.590 -12.804 -5.211 228 HB2 ARG 34 HB2 ARG 34 -8.493 -11.141 -6.833 229 HB3 ARG 34 HB3 ARG 34 -7.731 -10.501 -5.390 230 HG2 ARG 34 HG2 ARG 34 -6.180 -11.919 -6.522 231 HG3 ARG 34 HG3 ARG 34 -6.680 -12.688 -5.011 232 HD2 ARG 34 HD2 ARG 34 -8.005 -14.247 -6.092 233 HD3 ARG 34 HD3 ARG 34 -8.096 -13.274 -7.563 234 HE ARG 34 HE ARG 34 -5.435 -13.917 -7.136 235 HH11 ARG 34 HH11 ARG 34 -8.405 -15.727 -7.794 236 HH12 ARG 34 HH12 ARG 34 -7.627 -16.873 -8.800 237 HH21 ARG 34 HH21 ARG 34 -4.391 -15.490 -8.506 238 HH22 ARG 34 HH22 ARG 34 -5.333 -16.736 -9.209 239 H VAL 35 H VAL 35 -9.210 -9.757 -3.435 240 HA VAL 35 HA VAL 35 -7.673 -10.860 -1.309 241 HB VAL 35 HB VAL 35 -9.461 -8.391 -1.213 242 HG11 VAL 35 HG11 VAL 35 -8.068 -7.663 0.676 243 HG12 VAL 35 HG12 VAL 35 -7.193 -9.194 0.612 244 HG13 VAL 35 HG13 VAL 35 -8.907 -9.175 1.021 245 HG21 VAL 35 HG21 VAL 35 -7.479 -7.080 -1.638 246 HG22 VAL 35 HG22 VAL 35 -7.736 -8.233 -2.941 247 HG23 VAL 35 HG23 VAL 35 -6.498 -8.540 -1.712 248 H ALA 36 H ALA 36 -11.053 -10.326 -1.864 249 HA ALA 36 HA ALA 36 -12.091 -11.178 0.578 250 HB1 ALA 36 HB1 ALA 36 -13.257 -11.478 -2.197 251 HB2 ALA 36 HB2 ALA 36 -13.426 -10.067 -1.155 252 HB3 ALA 36 HB3 ALA 36 -14.153 -11.605 -0.683 253 H GLU 37 H GLU 37 -11.110 -12.886 -2.283 254 HA GLU 37 HA GLU 37 -11.894 -15.517 -1.663 255 HB2 GLU 37 HB2 GLU 37 -11.117 -14.455 -3.857 256 HB3 GLU 37 HB3 GLU 37 -9.521 -14.606 -3.224 257 HG2 GLU 37 HG2 GLU 37 -9.660 -17.007 -3.097 258 HG3 GLU 37 HG3 GLU 37 -11.325 -16.952 -3.680 259 H LEU 38 H LEU 38 -8.845 -13.769 -1.253 260 HA LEU 38 HA LEU 38 -7.250 -15.817 -0.248 261 HB2 LEU 38 HB2 LEU 38 -6.347 -13.711 -1.060 262 HB3 LEU 38 HB3 LEU 38 -7.102 -12.851 0.270 263 HG LEU 38 HG LEU 38 -5.680 -14.249 1.815 264 HD11 LEU 38 HD11 LEU 38 -5.064 -16.009 0.278 265 HD12 LEU 38 HD12 LEU 38 -3.624 -15.199 0.902 266 HD13 LEU 38 HD13 LEU 38 -4.194 -14.851 -0.726 267 HD21 LEU 38 HD21 LEU 38 -3.693 -12.829 1.520 268 HD22 LEU 38 HD22 LEU 38 -5.192 -11.906 1.396 269 HD23 LEU 38 HD23 LEU 38 -4.300 -12.339 -0.061 270 H LEU 39 H LEU 39 -9.115 -13.378 1.475 271 HA LEU 39 HA LEU 39 -8.323 -14.517 4.028 272 HB2 LEU 39 HB2 LEU 39 -10.135 -12.183 3.465 273 HB3 LEU 39 HB3 LEU 39 -9.457 -12.614 5.021 274 HG LEU 39 HG LEU 39 -7.922 -11.611 2.620 275 HD11 LEU 39 HD11 LEU 39 -7.525 -9.624 3.991 276 HD12 LEU 39 HD12 LEU 39 -8.557 -10.296 5.252 277 HD13 LEU 39 HD13 LEU 39 -9.241 -9.881 3.680 278 HD21 LEU 39 HD21 LEU 39 -5.983 -11.528 4.119 279 HD22 LEU 39 HD22 LEU 39 -6.570 -13.179 3.922 280 HD23 LEU 39 HD23 LEU 39 -6.938 -12.278 5.396 281 H GLY 40 H GLY 40 -10.950 -14.791 1.846 282 HA2 GLY 40 HA2 GLY 40 -12.772 -16.211 1.973 283 HA3 GLY 40 HA3 GLY 40 -12.327 -16.588 3.637 284 H VAL 41 H VAL 41 -12.499 -13.334 2.788 285 HA VAL 41 HA VAL 41 -14.890 -12.994 4.479 286 HB VAL 41 HB VAL 41 -14.107 -10.738 4.969 287 HG11 VAL 41 HG11 VAL 41 -12.028 -11.165 6.171 288 HG12 VAL 41 HG12 VAL 41 -11.874 -12.706 5.321 289 HG13 VAL 41 HG13 VAL 41 -13.227 -12.434 6.415 290 HG21 VAL 41 HG21 VAL 41 -13.120 -10.104 2.864 291 HG22 VAL 41 HG22 VAL 41 -11.837 -11.299 3.055 292 HG23 VAL 41 HG23 VAL 41 -11.910 -9.906 4.132 293 HA PRO 42 HA PRO 42 -16.764 -11.161 0.876 294 HB2 PRO 42 HB2 PRO 42 -18.384 -9.269 1.922 295 HB3 PRO 42 HB3 PRO 42 -18.748 -10.995 2.055 296 HG2 PRO 42 HG2 PRO 42 -17.537 -9.154 4.081 297 HG3 PRO 42 HG3 PRO 42 -18.756 -10.421 4.316 298 HD2 PRO 42 HD2 PRO 42 -16.131 -10.761 4.905 299 HD3 PRO 42 HD3 PRO 42 -17.183 -12.090 4.391 300 H VAL 43 H VAL 43 -16.809 -9.214 -0.386 301 HA VAL 43 HA VAL 43 -14.454 -7.683 -0.323 302 HB VAL 43 HB VAL 43 -17.045 -7.029 -1.758 303 HG11 VAL 43 HG11 VAL 43 -15.611 -5.758 -3.335 304 HG12 VAL 43 HG12 VAL 43 -14.213 -6.100 -2.313 305 HG13 VAL 43 HG13 VAL 43 -15.528 -5.106 -1.697 306 HG21 VAL 43 HG21 VAL 43 -14.651 -8.596 -2.721 307 HG22 VAL 43 HG22 VAL 43 -16.040 -8.152 -3.712 308 HG23 VAL 43 HG23 VAL 43 -16.239 -9.258 -2.352 309 H SER 44 H SER 44 -17.602 -7.141 0.974 310 HA SER 44 HA SER 44 -17.469 -4.472 1.616 311 HB2 SER 44 HB2 SER 44 -19.102 -5.262 3.394 312 HB3 SER 44 HB3 SER 44 -19.483 -5.583 1.683 313 HG SER 44 HG SER 44 -19.703 -7.388 3.220 314 H LYS 45 H LYS 45 -16.209 -7.334 3.377 315 HA LYS 45 HA LYS 45 -15.371 -5.743 5.577 316 HB2 LYS 45 HB2 LYS 45 -15.693 -8.110 6.037 317 HB3 LYS 45 HB3 LYS 45 -14.475 -8.537 4.835 318 HG2 LYS 45 HG2 LYS 45 -12.711 -7.779 6.143 319 HG3 LYS 45 HG3 LYS 45 -13.758 -6.788 7.146 320 HD2 LYS 45 HD2 LYS 45 -13.816 -9.798 7.134 321 HD3 LYS 45 HD3 LYS 45 -12.835 -8.847 8.251 322 HE2 LYS 45 HE2 LYS 45 -15.849 -8.771 8.000 323 HE3 LYS 45 HE3 LYS 45 -14.924 -9.496 9.307 324 HZ1 LYS 45 HZ1 LYS 45 -14.025 -7.208 9.751 325 HZ2 LYS 45 HZ2 LYS 45 -15.679 -7.405 10.021 326 HZ3 LYS 45 HZ3 LYS 45 -15.182 -6.624 8.645 327 H VAL 46 H VAL 46 -13.929 -6.684 2.594 328 HA VAL 46 HA VAL 46 -11.301 -5.677 3.118 329 HB VAL 46 HB VAL 46 -12.795 -5.639 0.465 330 HG11 VAL 46 HG11 VAL 46 -10.566 -5.617 -0.555 331 HG12 VAL 46 HG12 VAL 46 -9.843 -5.552 1.057 332 HG13 VAL 46 HG13 VAL 46 -10.835 -4.211 0.484 333 HG21 VAL 46 HG21 VAL 46 -12.728 -7.906 1.374 334 HG22 VAL 46 HG22 VAL 46 -10.983 -7.774 1.598 335 HG23 VAL 46 HG23 VAL 46 -11.666 -7.768 -0.027 336 H ALA 47 H ALA 47 -14.217 -4.150 1.929 337 HA ALA 47 HA ALA 47 -13.192 -1.550 1.749 338 HB1 ALA 47 HB1 ALA 47 -15.353 -2.210 0.778 339 HB2 ALA 47 HB2 ALA 47 -15.535 -0.807 1.836 340 HB3 ALA 47 HB3 ALA 47 -16.017 -2.407 2.398 341 H GLN 48 H GLN 48 -14.454 -3.361 4.476 342 HA GLN 48 HA GLN 48 -14.572 -1.232 6.366 343 HB2 GLN 48 HB2 GLN 48 -14.099 -4.160 6.901 344 HB3 GLN 48 HB3 GLN 48 -14.450 -2.958 8.126 345 HG2 GLN 48 HG2 GLN 48 -16.631 -2.578 7.083 346 HG3 GLN 48 HG3 GLN 48 -16.266 -3.840 5.909 347 HE21 GLN 48 HE21 GLN 48 -17.077 -3.153 9.181 348 HE22 GLN 48 HE22 GLN 48 -17.368 -4.783 9.667 349 H GLN 49 H GLN 49 -12.022 -3.421 5.398 350 HA GLN 49 HA GLN 49 -10.114 -2.762 7.370 351 HB2 GLN 49 HB2 GLN 49 -9.511 -3.421 4.472 352 HB3 GLN 49 HB3 GLN 49 -8.420 -3.606 5.833 353 HG2 GLN 49 HG2 GLN 49 -10.954 -5.181 5.391 354 HG3 GLN 49 HG3 GLN 49 -9.329 -5.742 5.028 355 HE21 GLN 49 HE21 GLN 49 -9.600 -7.502 6.392 356 HE22 GLN 49 HE22 GLN 49 -9.593 -7.352 8.113 357 H LEU 50 H LEU 50 -10.759 -1.461 4.192 358 HA LEU 50 HA LEU 50 -8.930 0.662 4.194 359 HB2 LEU 50 HB2 LEU 50 -11.353 -0.111 2.709 360 HB3 LEU 50 HB3 LEU 50 -10.925 1.592 2.595 361 HG LEU 50 HG LEU 50 -10.138 0.295 0.678 362 HD11 LEU 50 HD11 LEU 50 -8.861 2.221 1.305 363 HD12 LEU 50 HD12 LEU 50 -7.790 0.961 0.694 364 HD13 LEU 50 HD13 LEU 50 -7.899 1.265 2.428 365 HD21 LEU 50 HD21 LEU 50 -8.370 -1.391 0.907 366 HD22 LEU 50 HD22 LEU 50 -9.840 -1.891 1.745 367 HD23 LEU 50 HD23 LEU 50 -8.471 -1.260 2.661 368 H ARG 51 H ARG 51 -12.238 0.408 5.346 369 HA ARG 51 HA ARG 51 -12.633 3.130 5.993 370 HB2 ARG 51 HB2 ARG 51 -13.972 0.655 7.065 371 HB3 ARG 51 HB3 ARG 51 -14.469 2.284 7.489 372 HG2 ARG 51 HG2 ARG 51 -14.434 1.183 4.682 373 HG3 ARG 51 HG3 ARG 51 -15.859 1.259 5.718 374 HD2 ARG 51 HD2 ARG 51 -14.215 3.639 4.820 375 HD3 ARG 51 HD3 ARG 51 -15.747 3.133 4.121 376 HE ARG 51 HE ARG 51 -16.782 3.563 6.250 377 HH11 ARG 51 HH11 ARG 51 -13.585 5.106 5.741 378 HH12 ARG 51 HH12 ARG 51 -13.895 6.370 6.817 379 HH21 ARG 51 HH21 ARG 51 -17.179 5.359 7.729 380 HH22 ARG 51 HH22 ARG 51 -15.951 6.511 7.971 381 H GLU 52 H GLU 52 -11.000 0.602 7.738 382 HA GLU 52 HA GLU 52 -10.949 2.319 10.106 383 HB2 GLU 52 HB2 GLU 52 -10.340 -0.608 9.772 384 HB3 GLU 52 HB3 GLU 52 -10.121 0.278 11.279 385 HG2 GLU 52 HG2 GLU 52 -12.478 0.826 11.315 386 HG3 GLU 52 HG3 GLU 52 -12.715 -0.025 9.794 387 H GLY 53 H GLY 53 -9.123 1.896 7.466 388 HA2 GLY 53 HA2 GLY 53 -6.946 2.449 6.957 389 HA3 GLY 53 HA3 GLY 53 -6.795 3.079 8.594 390 H HIS 54 H HIS 54 -7.696 -0.146 7.691 391 HA HIS 54 HA HIS 54 -5.462 -1.206 9.255 392 HB2 HIS 54 HB2 HIS 54 -7.819 -1.952 9.684 393 HB3 HIS 54 HB3 HIS 54 -7.844 -2.652 8.072 394 HD1 HIS 54 HD1 HIS 54 -6.994 -5.055 7.896 395 HD2 HIS 54 HD2 HIS 54 -5.913 -3.200 11.444 396 HE1 HIS 54 HE1 HIS 54 -5.973 -6.849 9.334 397 H LEU 55 H LEU 55 -6.502 -0.714 6.043 398 HA LEU 55 HA LEU 55 -4.184 -1.954 4.944 399 HB2 LEU 55 HB2 LEU 55 -5.781 -3.867 5.252 400 HB3 LEU 55 HB3 LEU 55 -6.938 -3.011 4.270 401 HG LEU 55 HG LEU 55 -5.480 -3.249 2.310 402 HD11 LEU 55 HD11 LEU 55 -3.499 -4.679 2.429 403 HD12 LEU 55 HD12 LEU 55 -3.680 -4.794 4.180 404 HD13 LEU 55 HD13 LEU 55 -3.312 -3.241 3.431 405 HD21 LEU 55 HD21 LEU 55 -5.993 -5.818 3.799 406 HD22 LEU 55 HD22 LEU 55 -5.700 -5.677 2.067 407 HD23 LEU 55 HD23 LEU 55 -7.144 -4.956 2.777 408 H VAL 56 H VAL 56 -3.971 -1.252 2.686 409 HA VAL 56 HA VAL 56 -5.929 0.733 1.874 410 HB VAL 56 HB VAL 56 -4.053 2.126 0.913 411 HG11 VAL 56 HG11 VAL 56 -5.223 2.823 2.920 412 HG12 VAL 56 HG12 VAL 56 -3.510 3.241 3.023 413 HG13 VAL 56 HG13 VAL 56 -4.131 1.845 3.903 414 HG21 VAL 56 HG21 VAL 56 -1.815 1.890 1.910 415 HG22 VAL 56 HG22 VAL 56 -2.269 0.464 0.971 416 HG23 VAL 56 HG23 VAL 56 -2.350 0.425 2.732 417 H ALA 57 H ALA 57 -5.720 1.309 -0.433 418 HA ALA 57 HA ALA 57 -4.807 -0.944 -2.030 419 HB1 ALA 57 HB1 ALA 57 -7.192 -1.273 -1.575 420 HB2 ALA 57 HB2 ALA 57 -6.916 -0.873 -3.270 421 HB3 ALA 57 HB3 ALA 57 -7.531 0.355 -2.162 422 H VAL 58 H VAL 58 -4.653 -0.343 -4.268 423 HA VAL 58 HA VAL 58 -4.442 2.512 -4.788 424 HB VAL 58 HB VAL 58 -2.395 1.998 -6.228 425 HG11 VAL 58 HG11 VAL 58 -2.284 3.197 -4.092 426 HG12 VAL 58 HG12 VAL 58 -0.859 2.220 -4.391 427 HG13 VAL 58 HG13 VAL 58 -2.086 1.657 -3.247 428 HG21 VAL 58 HG21 VAL 58 -2.595 -0.431 -6.278 429 HG22 VAL 58 HG22 VAL 58 -2.372 -0.501 -4.528 430 HG23 VAL 58 HG23 VAL 58 -1.053 0.043 -5.566 431 H ARG 59 H ARG 59 -4.183 2.855 -7.227 432 HA ARG 59 HA ARG 59 -6.120 1.042 -8.487 433 HB2 ARG 59 HB2 ARG 59 -7.055 3.229 -8.002 434 HB3 ARG 59 HB3 ARG 59 -5.738 4.005 -8.860 435 HG2 ARG 59 HG2 ARG 59 -6.515 2.953 -10.948 436 HG3 ARG 59 HG3 ARG 59 -7.869 2.249 -10.064 437 HD2 ARG 59 HD2 ARG 59 -8.510 4.305 -11.228 438 HD3 ARG 59 HD3 ARG 59 -8.681 4.458 -9.479 439 HE ARG 59 HE ARG 59 -6.149 5.378 -10.115 440 HH11 ARG 59 HH11 ARG 59 -9.449 6.353 -11.003 441 HH12 ARG 59 HH12 ARG 59 -9.079 8.006 -11.014 442 HH21 ARG 59 HH21 ARG 59 -5.669 7.645 -10.188 443 HH22 ARG 59 HH22 ARG 59 -6.893 8.751 -10.597 444 H ARG 60 H ARG 60 -5.255 -0.151 -10.020 445 HA ARG 60 HA ARG 60 -3.197 1.008 -11.805 446 HB2 ARG 60 HB2 ARG 60 -2.214 -1.191 -12.137 447 HB3 ARG 60 HB3 ARG 60 -2.308 -0.934 -10.400 448 HG2 ARG 60 HG2 ARG 60 -4.238 -2.364 -10.238 449 HG3 ARG 60 HG3 ARG 60 -4.349 -2.475 -11.980 450 HD2 ARG 60 HD2 ARG 60 -2.230 -3.706 -12.042 451 HD3 ARG 60 HD3 ARG 60 -2.113 -3.593 -10.280 452 HE ARG 60 HE ARG 60 -4.605 -4.641 -10.932 453 HH11 ARG 60 HH11 ARG 60 -1.277 -5.776 -11.348 454 HH12 ARG 60 HH12 ARG 60 -1.632 -7.375 -10.878 455 HH21 ARG 60 HH21 ARG 60 -5.102 -6.869 -10.298 456 HH22 ARG 60 HH22 ARG 60 -3.874 -8.012 -10.343 457 H ALA 61 H ALA 61 -3.718 0.941 -13.924 458 HA ALA 61 HA ALA 61 -4.872 0.679 -15.855 459 HB1 ALA 61 HB1 ALA 61 -5.278 -1.626 -16.525 460 HB2 ALA 61 HB2 ALA 61 -5.144 -2.148 -14.844 461 HB3 ALA 61 HB3 ALA 61 -3.739 -1.481 -15.673 462 H GLY 62 H GLY 62 -6.536 1.552 -13.632 463 HA2 GLY 62 HA2 GLY 62 -8.771 2.198 -13.518 464 HA3 GLY 62 HA3 GLY 62 -9.121 1.121 -14.860 465 H GLY 63 H GLY 63 -7.440 -0.193 -12.135 466 HA2 GLY 63 HA2 GLY 63 -9.948 -1.261 -11.015 467 HA3 GLY 63 HA3 GLY 63 -8.580 -2.308 -11.371 468 H VAL 64 H VAL 64 -9.872 -1.820 -8.832 469 HA VAL 64 HA VAL 64 -7.815 -0.335 -7.378 470 HB VAL 64 HB VAL 64 -10.430 -1.514 -6.368 471 HG11 VAL 64 HG11 VAL 64 -8.521 0.431 -5.071 472 HG12 VAL 64 HG12 VAL 64 -8.772 -1.253 -4.605 473 HG13 VAL 64 HG13 VAL 64 -10.072 -0.078 -4.402 474 HG21 VAL 64 HG21 VAL 64 -9.787 1.339 -7.117 475 HG22 VAL 64 HG22 VAL 64 -11.273 0.803 -6.338 476 HG23 VAL 64 HG23 VAL 64 -10.886 0.256 -7.969 477 H VAL 65 H VAL 65 -6.256 -1.437 -6.445 478 HA VAL 65 HA VAL 65 -6.537 -4.333 -6.004 479 HB VAL 65 HB VAL 65 -4.292 -4.619 -7.006 480 HG11 VAL 65 HG11 VAL 65 -6.323 -5.129 -8.276 481 HG12 VAL 65 HG12 VAL 65 -5.037 -4.537 -9.316 482 HG13 VAL 65 HG13 VAL 65 -6.368 -3.466 -8.864 483 HG21 VAL 65 HG21 VAL 65 -3.379 -2.895 -8.448 484 HG22 VAL 65 HG22 VAL 65 -3.569 -2.262 -6.808 485 HG23 VAL 65 HG23 VAL 65 -4.740 -1.839 -8.071 486 H ILE 66 H ILE 66 -4.802 -5.176 -4.824 487 HA ILE 66 HA ILE 66 -3.490 -3.288 -3.027 488 HB ILE 66 HB ILE 66 -4.912 -5.858 -2.189 489 HG12 ILE 66 HG12 ILE 66 -5.537 -2.968 -1.526 490 HG13 ILE 66 HG13 ILE 66 -6.470 -3.998 -2.599 491 HG21 ILE 66 HG21 ILE 66 -2.857 -5.523 -0.935 492 HG22 ILE 66 HG22 ILE 66 -4.260 -5.276 0.107 493 HG23 ILE 66 HG23 ILE 66 -3.359 -3.885 -0.505 494 HD11 ILE 66 HD11 ILE 66 -6.116 -4.345 0.364 495 HD12 ILE 66 HD12 ILE 66 -7.043 -5.426 -0.677 496 HD13 ILE 66 HD13 ILE 66 -7.559 -3.754 -0.458 497 HA PRO 67 HA PRO 67 -0.096 -5.817 -4.519 498 HB2 PRO 67 HB2 PRO 67 1.290 -5.039 -2.035 499 HB3 PRO 67 HB3 PRO 67 1.766 -4.760 -3.710 500 HG2 PRO 67 HG2 PRO 67 0.875 -2.792 -2.083 501 HG3 PRO 67 HG3 PRO 67 0.622 -2.761 -3.830 502 HD2 PRO 67 HD2 PRO 67 -1.293 -3.360 -1.644 503 HD3 PRO 67 HD3 PRO 67 -1.575 -2.644 -3.243 504 H GLN 68 H GLN 68 0.310 -8.032 -4.193 505 HA GLN 68 HA GLN 68 -0.811 -9.364 -1.964 506 HB2 GLN 68 HB2 GLN 68 -0.646 -10.431 -4.076 507 HB3 GLN 68 HB3 GLN 68 1.083 -10.175 -4.147 508 HG2 GLN 68 HG2 GLN 68 1.442 -11.786 -2.404 509 HG3 GLN 68 HG3 GLN 68 -0.298 -11.958 -2.163 510 HE21 GLN 68 HE21 GLN 68 -0.908 -11.822 -5.035 511 HE22 GLN 68 HE22 GLN 68 -0.392 -13.339 -5.642 512 H VAL 69 H VAL 69 2.241 -8.115 -2.800 513 HA VAL 69 HA VAL 69 3.814 -9.273 -0.773 514 HB VAL 69 HB VAL 69 5.417 -7.393 -1.322 515 HG11 VAL 69 HG11 VAL 69 5.457 -9.515 -2.561 516 HG12 VAL 69 HG12 VAL 69 5.814 -8.138 -3.620 517 HG13 VAL 69 HG13 VAL 69 4.218 -8.880 -3.653 518 HG21 VAL 69 HG21 VAL 69 3.668 -5.744 -1.873 519 HG22 VAL 69 HG22 VAL 69 3.288 -6.660 -3.325 520 HG23 VAL 69 HG23 VAL 69 4.878 -5.905 -3.151 521 H PHE 70 H PHE 70 1.283 -7.150 -0.455 522 HA PHE 70 HA PHE 70 2.323 -5.550 1.729 523 HB2 PHE 70 HB2 PHE 70 0.143 -5.379 -0.092 524 HB3 PHE 70 HB3 PHE 70 -0.534 -5.495 1.524 525 HD1 PHE 70 HD1 PHE 70 2.394 -3.793 0.005 526 HD2 PHE 70 HD2 PHE 70 -1.110 -3.454 2.372 527 HE1 PHE 70 HE1 PHE 70 2.864 -1.428 0.335 528 HE2 PHE 70 HE2 PHE 70 -0.655 -1.064 2.720 529 HZ PHE 70 HZ PHE 70 1.326 -0.040 1.712 530 H PHE 71 H PHE 71 1.126 -8.594 1.217 531 HA PHE 71 HA PHE 71 0.092 -8.869 3.929 532 HB2 PHE 71 HB2 PHE 71 -0.257 -10.573 1.467 533 HB3 PHE 71 HB3 PHE 71 -0.779 -11.073 3.069 534 HD1 PHE 71 HD1 PHE 71 -1.335 -8.646 0.347 535 HD2 PHE 71 HD2 PHE 71 -2.809 -10.288 3.980 536 HE1 PHE 71 HE1 PHE 71 -3.507 -7.558 -0.047 537 HE2 PHE 71 HE2 PHE 71 -4.985 -9.207 3.592 538 HZ PHE 71 HZ PHE 71 -5.334 -7.840 1.579 539 H THR 72 H THR 72 0.769 -10.871 4.975 540 HA THR 72 HA THR 72 3.612 -11.229 4.773 541 HB THR 72 HB THR 72 3.286 -12.877 6.608 542 HG1 THR 72 HG1 THR 72 0.555 -12.161 6.389 543 HG21 THR 72 HG21 THR 72 2.420 -11.315 8.280 544 HG22 THR 72 HG22 THR 72 1.714 -10.325 6.998 545 HG23 THR 72 HG23 THR 72 3.464 -10.483 7.122 546 H ASN 73 H ASN 73 4.608 -13.374 4.461 547 HA ASN 73 HA ASN 73 3.756 -14.665 2.142 548 HB2 ASN 73 HB2 ASN 73 5.459 -16.407 2.635 549 HB3 ASN 73 HB3 ASN 73 6.086 -14.776 2.780 550 HD21 ASN 73 HD21 ASN 73 7.768 -15.455 4.029 551 HD22 ASN 73 HD22 ASN 73 7.598 -15.945 5.689 552 H SER 74 H SER 74 2.641 -15.069 5.283 553 HA SER 74 HA SER 74 1.638 -17.741 4.804 554 HB2 SER 74 HB2 SER 74 1.500 -16.013 7.276 555 HB3 SER 74 HB3 SER 74 1.034 -17.714 7.171 556 HG SER 74 HG SER 74 3.646 -16.825 6.452 557 H GLY 75 H GLY 75 0.579 -14.676 4.030 558 HA2 GLY 75 HA2 GLY 75 -1.435 -14.264 2.958 559 HA3 GLY 75 HA3 GLY 75 -2.122 -15.682 3.719 560 H GLN 76 H GLN 76 -0.615 -13.874 6.065 561 HA GLN 76 HA GLN 76 -3.208 -12.827 6.970 562 HB2 GLN 76 HB2 GLN 76 -1.727 -14.164 8.534 563 HB3 GLN 76 HB3 GLN 76 -0.550 -12.860 8.444 564 HG2 GLN 76 HG2 GLN 76 -2.360 -11.330 9.298 565 HG3 GLN 76 HG3 GLN 76 -3.316 -12.771 9.614 566 HE21 GLN 76 HE21 GLN 76 -2.332 -10.766 11.398 567 HE22 GLN 76 HE22 GLN 76 -1.381 -11.570 12.597 568 H VAL 77 H VAL 77 -3.347 -10.562 7.700 569 HA VAL 77 HA VAL 77 -1.885 -8.735 6.047 570 HB VAL 77 HB VAL 77 -3.731 -8.182 8.417 571 HG11 VAL 77 HG11 VAL 77 -3.983 -5.940 7.481 572 HG12 VAL 77 HG12 VAL 77 -2.834 -6.341 6.205 573 HG13 VAL 77 HG13 VAL 77 -2.295 -6.274 7.884 574 HG21 VAL 77 HG21 VAL 77 -5.467 -7.726 6.758 575 HG22 VAL 77 HG22 VAL 77 -4.909 -9.399 6.656 576 HG23 VAL 77 HG23 VAL 77 -4.365 -8.201 5.473 577 H VAL 78 H VAL 78 -0.173 -7.467 6.686 578 HA VAL 78 HA VAL 78 1.463 -8.329 8.802 579 HB VAL 78 HB VAL 78 1.510 -5.729 7.243 580 HG11 VAL 78 HG11 VAL 78 3.688 -6.935 8.941 581 HG12 VAL 78 HG12 VAL 78 2.775 -5.475 9.304 582 HG13 VAL 78 HG13 VAL 78 3.852 -5.515 7.911 583 HG21 VAL 78 HG21 VAL 78 3.017 -8.294 6.827 584 HG22 VAL 78 HG22 VAL 78 3.294 -6.789 5.952 585 HG23 VAL 78 HG23 VAL 78 1.748 -7.625 5.798 586 H LYS 79 H LYS 79 1.572 -7.695 10.862 587 HA LYS 79 HA LYS 79 -0.660 -6.478 12.028 588 HB2 LYS 79 HB2 LYS 79 0.540 -8.132 13.273 589 HB3 LYS 79 HB3 LYS 79 2.022 -7.194 13.207 590 HG2 LYS 79 HG2 LYS 79 0.959 -7.106 15.410 591 HG3 LYS 79 HG3 LYS 79 1.064 -5.511 14.656 592 HD2 LYS 79 HD2 LYS 79 -1.296 -5.758 13.940 593 HD3 LYS 79 HD3 LYS 79 -1.378 -7.284 14.827 594 HE2 LYS 79 HE2 LYS 79 -0.848 -6.118 16.887 595 HE3 LYS 79 HE3 LYS 79 -0.705 -4.599 16.009 596 HZ1 LYS 79 HZ1 LYS 79 -2.845 -4.829 17.115 597 HZ2 LYS 79 HZ2 LYS 79 -3.180 -6.215 16.218 598 HZ3 LYS 79 HZ3 LYS 79 -3.032 -4.729 15.443 599 H SER 80 H SER 80 2.554 -5.177 11.420 600 HA SER 80 HA SER 80 1.742 -2.689 12.639 601 HB2 SER 80 HB2 SER 80 4.040 -3.598 12.999 602 HB3 SER 80 HB3 SER 80 4.375 -3.345 11.285 603 HG SER 80 HG SER 80 3.998 -1.155 11.591 604 H LEU 81 H LEU 81 0.778 -3.874 9.889 605 HA LEU 81 HA LEU 81 1.486 -1.930 7.973 606 HB2 LEU 81 HB2 LEU 81 0.515 -4.247 7.568 607 HB3 LEU 81 HB3 LEU 81 -1.031 -3.599 8.007 608 HG LEU 81 HG LEU 81 0.533 -2.536 5.650 609 HD11 LEU 81 HD11 LEU 81 -0.851 -4.016 4.281 610 HD12 LEU 81 HD12 LEU 81 -1.534 -4.727 5.741 611 HD13 LEU 81 HD13 LEU 81 0.179 -4.935 5.377 612 HD21 LEU 81 HD21 LEU 81 -2.406 -2.531 6.312 613 HD22 LEU 81 HD22 LEU 81 -1.660 -1.795 4.897 614 HD23 LEU 81 HD23 LEU 81 -1.330 -1.147 6.509 615 HA PRO 82 HA PRO 82 -2.734 0.293 9.349 616 HB2 PRO 82 HB2 PRO 82 -3.230 -0.269 12.053 617 HB3 PRO 82 HB3 PRO 82 -4.199 -0.846 10.703 618 HG2 PRO 82 HG2 PRO 82 -2.051 -2.235 12.232 619 HG3 PRO 82 HG3 PRO 82 -3.536 -2.898 11.533 620 HD2 PRO 82 HD2 PRO 82 -1.173 -3.315 10.374 621 HD3 PRO 82 HD3 PRO 82 -2.632 -3.017 9.404 622 H GLY 83 H GLY 83 -0.182 -0.645 11.514 623 HA2 GLY 83 HA2 GLY 83 0.078 1.712 13.047 624 HA3 GLY 83 HA3 GLY 83 1.347 0.524 12.784 625 H LEU 84 H LEU 84 1.734 0.707 10.047 626 HA LEU 84 HA LEU 84 3.215 3.124 9.907 627 HB2 LEU 84 HB2 LEU 84 4.009 2.438 7.760 628 HB3 LEU 84 HB3 LEU 84 3.874 0.984 8.710 629 HG LEU 84 HG LEU 84 1.533 0.849 7.481 630 HD11 LEU 84 HD11 LEU 84 3.234 2.365 5.486 631 HD12 LEU 84 HD12 LEU 84 1.750 2.937 6.233 632 HD13 LEU 84 HD13 LEU 84 1.702 1.577 5.121 633 HD21 LEU 84 HD21 LEU 84 4.155 0.043 6.212 634 HD22 LEU 84 HD22 LEU 84 2.579 -0.639 5.824 635 HD23 LEU 84 HD23 LEU 84 3.270 -0.876 7.429 636 H LEU 85 H LEU 85 0.164 2.055 8.583 637 HA LEU 85 HA LEU 85 -0.369 4.291 6.987 638 HB2 LEU 85 HB2 LEU 85 -2.329 2.559 8.487 639 HB3 LEU 85 HB3 LEU 85 -2.757 3.698 7.233 640 HG LEU 85 HG LEU 85 -1.078 1.221 6.873 641 HD11 LEU 85 HD11 LEU 85 -3.397 0.708 7.257 642 HD12 LEU 85 HD12 LEU 85 -2.994 0.433 5.559 643 HD13 LEU 85 HD13 LEU 85 -3.890 1.879 6.039 644 HD21 LEU 85 HD21 LEU 85 -2.034 3.257 4.861 645 HD22 LEU 85 HD22 LEU 85 -1.248 1.726 4.472 646 HD23 LEU 85 HD23 LEU 85 -0.362 2.969 5.349 647 H THR 86 H THR 86 -0.798 3.741 10.368 648 HA THR 86 HA THR 86 -2.363 6.009 10.967 649 HB THR 86 HB THR 86 -0.319 4.707 12.807 650 HG1 THR 86 HG1 THR 86 -2.154 3.405 11.789 651 HG21 THR 86 HG21 THR 86 -1.719 5.602 14.613 652 HG22 THR 86 HG22 THR 86 -2.806 6.322 13.426 653 HG23 THR 86 HG23 THR 86 -1.155 6.910 13.578 654 H ILE 87 H ILE 87 1.194 5.617 11.053 655 HA ILE 87 HA ILE 87 1.619 8.300 11.747 656 HB ILE 87 HB ILE 87 3.328 6.813 12.416 657 HG12 ILE 87 HG12 ILE 87 4.168 9.069 11.520 658 HG13 ILE 87 HG13 ILE 87 5.368 7.821 11.814 659 HG21 ILE 87 HG21 ILE 87 3.664 5.869 9.616 660 HG22 ILE 87 HG22 ILE 87 3.062 4.981 11.011 661 HG23 ILE 87 HG23 ILE 87 4.757 5.473 10.939 662 HD11 ILE 87 HD11 ILE 87 5.835 9.064 9.756 663 HD12 ILE 87 HD12 ILE 87 4.256 8.622 9.116 664 HD13 ILE 87 HD13 ILE 87 5.483 7.385 9.379 665 H LEU 88 H LEU 88 1.692 6.723 8.575 666 HA LEU 88 HA LEU 88 2.421 9.139 7.280 667 HB2 LEU 88 HB2 LEU 88 1.218 6.642 6.172 668 HB3 LEU 88 HB3 LEU 88 1.469 8.051 5.178 669 HG LEU 88 HG LEU 88 3.266 6.730 4.698 670 HD11 LEU 88 HD11 LEU 88 4.324 8.551 6.816 671 HD12 LEU 88 HD12 LEU 88 4.015 8.944 5.125 672 HD13 LEU 88 HD13 LEU 88 5.263 7.772 5.545 673 HD21 LEU 88 HD21 LEU 88 3.775 6.162 7.592 674 HD22 LEU 88 HD22 LEU 88 4.592 5.462 6.198 675 HD23 LEU 88 HD23 LEU 88 2.891 5.094 6.502 676 H HIS 89 H HIS 89 -0.735 7.778 7.998 677 HA HIS 89 HA HIS 89 -2.180 9.673 6.487 678 HB2 HIS 89 HB2 HIS 89 -3.201 7.577 7.281 679 HB3 HIS 89 HB3 HIS 89 -3.014 8.096 8.944 680 HD1 HIS 89 HD1 HIS 89 -4.982 9.285 9.932 681 HD2 HIS 89 HD2 HIS 89 -5.084 9.240 5.782 682 HE1 HIS 89 HE1 HIS 89 -7.211 10.257 9.280 683 H ASP 90 H ASP 90 -0.893 9.660 9.731 684 HA ASP 90 HA ASP 90 -2.069 12.138 10.505 685 HB2 ASP 90 HB2 ASP 90 -1.351 10.510 12.188 686 HB3 ASP 90 HB3 ASP 90 0.307 10.640 11.635 687 H GLY 91 H GLY 91 0.887 11.213 8.878 688 HA2 GLY 91 HA2 GLY 91 2.049 13.866 8.943 689 HA3 GLY 91 HA3 GLY 91 2.645 12.480 8.058 690 H GLY 92 H GLY 92 -0.336 12.369 7.130 691 HA2 GLY 92 HA2 GLY 92 -1.677 13.303 5.487 692 HA3 GLY 92 HA3 GLY 92 -0.551 14.642 5.370 693 H TYR 93 H TYR 93 0.169 11.203 4.998 694 HA TYR 93 HA TYR 93 0.910 11.764 2.222 695 HB2 TYR 93 HB2 TYR 93 1.995 9.743 4.172 696 HB3 TYR 93 HB3 TYR 93 2.279 9.609 2.443 697 HD1 TYR 93 HD1 TYR 93 3.619 11.333 1.287 698 HD2 TYR 93 HD2 TYR 93 3.205 11.306 5.517 699 HE1 TYR 93 HE1 TYR 93 5.578 12.793 1.469 700 HE2 TYR 93 HE2 TYR 93 5.154 12.781 5.721 701 HH TYR 93 HH TYR 93 7.308 13.227 4.188 702 H ARG 94 H ARG 94 -0.163 10.868 0.680 703 HA ARG 94 HA ARG 94 -2.300 9.042 1.325 704 HB2 ARG 94 HB2 ARG 94 -3.181 9.397 -0.865 705 HB3 ARG 94 HB3 ARG 94 -2.715 10.953 -0.202 706 HG2 ARG 94 HG2 ARG 94 -0.793 11.054 -1.606 707 HG3 ARG 94 HG3 ARG 94 -1.026 9.380 -2.134 708 HD2 ARG 94 HD2 ARG 94 -2.865 11.707 -2.643 709 HD3 ARG 94 HD3 ARG 94 -1.849 10.895 -3.842 710 HE ARG 94 HE ARG 94 -3.329 8.847 -3.001 711 HH11 ARG 94 HH11 ARG 94 -4.332 12.108 -4.012 712 HH12 ARG 94 HH12 ARG 94 -5.936 11.633 -4.287 713 HH21 ARG 94 HH21 ARG 94 -5.469 8.246 -3.341 714 HH22 ARG 94 HH22 ARG 94 -6.605 9.395 -3.925 715 H ASP 95 H ASP 95 -2.760 7.380 -0.523 716 HA ASP 95 HA ASP 95 -1.250 5.128 -0.043 717 HB2 ASP 95 HB2 ASP 95 -2.575 4.122 -1.835 718 HB3 ASP 95 HB3 ASP 95 -3.593 5.205 -0.888 719 H THR 96 H THR 96 -1.204 7.244 -2.834 720 HA THR 96 HA THR 96 0.595 5.873 -4.444 721 HB THR 96 HB THR 96 0.122 8.852 -4.314 722 HG1 THR 96 HG1 THR 96 -1.557 6.815 -4.818 723 HG21 THR 96 HG21 THR 96 2.029 8.102 -5.712 724 HG22 THR 96 HG22 THR 96 0.722 8.790 -6.692 725 HG23 THR 96 HG23 THR 96 0.935 7.039 -6.586 726 H GLU 97 H GLU 97 1.086 8.299 -1.957 727 HA GLU 97 HA GLU 97 3.852 8.758 -2.336 728 HB2 GLU 97 HB2 GLU 97 2.181 8.988 0.175 729 HB3 GLU 97 HB3 GLU 97 3.770 9.689 -0.069 730 HG2 GLU 97 HG2 GLU 97 1.310 10.420 -1.637 731 HG3 GLU 97 HG3 GLU 97 1.922 11.315 -0.246 732 H ILE 98 H ILE 98 1.920 6.596 -0.316 733 HA ILE 98 HA ILE 98 3.955 5.566 1.336 734 HB ILE 98 HB ILE 98 1.602 3.890 0.424 735 HG12 ILE 98 HG12 ILE 98 0.585 6.025 1.018 736 HG13 ILE 98 HG13 ILE 98 0.269 4.830 2.267 737 HG21 ILE 98 HG21 ILE 98 3.244 2.821 1.859 738 HG22 ILE 98 HG22 ILE 98 1.690 2.979 2.676 739 HG23 ILE 98 HG23 ILE 98 3.011 4.075 3.075 740 HD11 ILE 98 HD11 ILE 98 0.772 7.025 3.164 741 HD12 ILE 98 HD12 ILE 98 2.372 6.954 2.421 742 HD13 ILE 98 HD13 ILE 98 1.917 5.784 3.670 743 H MET 99 H MET 99 2.537 4.379 -1.678 744 HA MET 99 HA MET 99 4.075 2.008 -1.804 745 HB2 MET 99 HB2 MET 99 2.656 3.432 -4.049 746 HB3 MET 99 HB3 MET 99 3.273 1.792 -4.099 747 HG2 MET 99 HG2 MET 99 1.051 2.821 -2.354 748 HG3 MET 99 HG3 MET 99 0.912 1.809 -3.793 749 HE1 MET 99 HE1 MET 99 -0.622 0.139 -2.444 750 HE2 MET 99 HE2 MET 99 -0.462 1.163 -1.016 751 HE3 MET 99 HE3 MET 99 -0.159 -0.570 -0.899 752 H ARG 100 H ARG 100 4.689 5.289 -2.836 753 HA ARG 100 HA ARG 100 6.555 4.792 -4.831 754 HB2 ARG 100 HB2 ARG 100 5.599 6.952 -4.535 755 HB3 ARG 100 HB3 ARG 100 6.240 7.069 -2.907 756 HG2 ARG 100 HG2 ARG 100 8.459 7.285 -3.722 757 HG3 ARG 100 HG3 ARG 100 7.952 6.948 -5.382 758 HD2 ARG 100 HD2 ARG 100 6.994 9.209 -3.690 759 HD3 ARG 100 HD3 ARG 100 8.265 9.367 -4.910 760 HE ARG 100 HE ARG 100 6.544 8.608 -6.537 761 HH11 ARG 100 HH11 ARG 100 5.515 10.132 -3.542 762 HH12 ARG 100 HH12 ARG 100 4.077 10.780 -4.133 763 HH21 ARG 100 HH21 ARG 100 4.555 9.522 -7.457 764 HH22 ARG 100 HH22 ARG 100 3.522 10.447 -6.479 765 H TRP 101 H TRP 101 7.291 5.729 -1.470 766 HA TRP 101 HA TRP 101 9.978 4.915 -1.828 767 HB2 TRP 101 HB2 TRP 101 10.135 5.241 0.737 768 HB3 TRP 101 HB3 TRP 101 9.850 6.643 -0.279 769 HD1 TRP 101 HD1 TRP 101 7.673 7.977 0.089 770 HE1 TRP 101 HE1 TRP 101 5.766 7.847 1.766 771 HE3 TRP 101 HE3 TRP 101 8.723 3.414 2.159 772 HZ2 TRP 101 HZ2 TRP 101 4.818 6.060 3.725 773 HZ3 TRP 101 HZ3 TRP 101 7.261 2.578 3.918 774 HH2 TRP 101 HH2 TRP 101 5.346 3.869 4.698 775 H LEU 102 H LEU 102 7.180 3.315 -0.638 776 HA LEU 102 HA LEU 102 8.371 1.166 0.665 777 HB2 LEU 102 HB2 LEU 102 5.808 1.736 -0.592 778 HB3 LEU 102 HB3 LEU 102 6.163 0.034 -0.391 779 HG LEU 102 HG LEU 102 5.921 2.144 1.757 780 HD11 LEU 102 HD11 LEU 102 3.842 1.308 0.703 781 HD12 LEU 102 HD12 LEU 102 4.001 0.890 2.413 782 HD13 LEU 102 HD13 LEU 102 4.323 -0.328 1.176 783 HD21 LEU 102 HD21 LEU 102 6.702 -0.744 1.874 784 HD22 LEU 102 HD22 LEU 102 6.123 0.175 3.277 785 HD23 LEU 102 HD23 LEU 102 7.596 0.669 2.466 786 H PHE 103 H PHE 103 7.661 1.619 -2.766 787 HA PHE 103 HA PHE 103 8.746 -1.014 -3.225 788 HB2 PHE 103 HB2 PHE 103 7.090 0.796 -4.933 789 HB3 PHE 103 HB3 PHE 103 7.944 -0.581 -5.630 790 HD1 PHE 103 HD1 PHE 103 5.212 0.447 -3.391 791 HD2 PHE 103 HD2 PHE 103 7.349 -2.825 -5.066 792 HE1 PHE 103 HE1 PHE 103 3.424 -1.089 -2.677 793 HE2 PHE 103 HE2 PHE 103 5.591 -4.354 -4.356 794 HZ PHE 103 HZ PHE 103 3.627 -3.514 -3.164 795 H THR 104 H THR 104 10.004 1.929 -2.987 796 HA THR 104 HA THR 104 11.966 1.548 -5.073 797 HB THR 104 HB THR 104 11.776 3.660 -2.899 798 HG1 THR 104 HG1 THR 104 10.120 3.952 -4.315 799 HG21 THR 104 HG21 THR 104 14.081 3.358 -3.719 800 HG22 THR 104 HG22 THR 104 13.415 4.895 -4.264 801 HG23 THR 104 HG23 THR 104 13.515 3.534 -5.380 802 HA PRO 105 HA PRO 105 14.296 -1.232 -2.341 803 HB2 PRO 105 HB2 PRO 105 16.354 -0.445 -4.355 804 HB3 PRO 105 HB3 PRO 105 15.957 -2.052 -3.734 805 HG2 PRO 105 HG2 PRO 105 15.119 -1.377 -6.128 806 HG3 PRO 105 HG3 PRO 105 14.004 -2.193 -5.015 807 HD2 PRO 105 HD2 PRO 105 14.146 0.706 -5.749 808 HD3 PRO 105 HD3 PRO 105 12.726 -0.336 -5.521 809 H ASP 106 H ASP 106 15.363 -0.716 -0.571 810 HA ASP 106 HA ASP 106 16.245 2.033 -0.282 811 HB2 ASP 106 HB2 ASP 106 14.715 0.947 1.384 812 HB3 ASP 106 HB3 ASP 106 16.063 -0.109 1.813 813 HA PRO 107 HA PRO 107 20.527 0.847 -0.830 814 HB2 PRO 107 HB2 PRO 107 21.601 3.158 0.221 815 HB3 PRO 107 HB3 PRO 107 21.043 2.983 -1.448 816 HG2 PRO 107 HG2 PRO 107 19.644 4.176 0.907 817 HG3 PRO 107 HG3 PRO 107 19.694 4.738 -0.775 818 HD2 PRO 107 HD2 PRO 107 17.570 3.447 0.212 819 HD3 PRO 107 HD3 PRO 107 18.098 3.209 -1.466 820 H SER 108 H SER 108 19.154 1.822 2.273 821 HA SER 108 HA SER 108 21.551 0.892 3.626 822 HB2 SER 108 HB2 SER 108 19.153 2.412 4.652 823 HB3 SER 108 HB3 SER 108 20.617 2.038 5.566 824 HG SER 108 HG SER 108 21.338 3.178 3.293 825 H LEU 109 H LEU 109 18.923 -0.543 2.432 826 HA LEU 109 HA LEU 109 18.340 -1.981 4.893 827 HB2 LEU 109 HB2 LEU 109 16.453 -1.035 3.656 828 HB3 LEU 109 HB3 LEU 109 16.843 -2.081 2.295 829 HG LEU 109 HG LEU 109 16.472 -4.035 3.815 830 HD11 LEU 109 HD11 LEU 109 16.778 -2.950 5.955 831 HD12 LEU 109 HD12 LEU 109 15.168 -3.661 5.859 832 HD13 LEU 109 HD13 LEU 109 15.375 -1.922 5.658 833 HD21 LEU 109 HD21 LEU 109 14.810 -3.305 2.222 834 HD22 LEU 109 HD22 LEU 109 14.152 -2.168 3.408 835 HD23 LEU 109 HD23 LEU 109 14.069 -3.914 3.708 836 H THR 110 H THR 110 19.218 -3.766 5.242 837 HA THR 110 HA THR 110 19.835 -5.693 3.106 838 HB THR 110 HB THR 110 21.533 -5.268 5.588 839 HG1 THR 110 HG1 THR 110 21.411 -3.744 3.332 840 HG21 THR 110 HG21 THR 110 21.721 -7.444 4.448 841 HG22 THR 110 HG22 THR 110 23.211 -6.519 4.276 842 HG23 THR 110 HG23 THR 110 22.078 -6.626 2.929 843 H ILE 111 H ILE 111 18.410 -7.327 3.566 844 HA ILE 111 HA ILE 111 17.951 -7.905 6.405 845 HB ILE 111 HB ILE 111 15.563 -8.427 5.795 846 HG12 ILE 111 HG12 ILE 111 16.144 -6.452 3.572 847 HG13 ILE 111 HG13 ILE 111 15.875 -8.173 3.342 848 HG21 ILE 111 HG21 ILE 111 14.866 -6.171 6.361 849 HG22 ILE 111 HG22 ILE 111 16.517 -5.610 6.006 850 HG23 ILE 111 HG23 ILE 111 16.237 -6.786 7.306 851 HD11 ILE 111 HD11 ILE 111 13.890 -6.212 4.451 852 HD12 ILE 111 HD12 ILE 111 13.614 -7.933 4.196 853 HD13 ILE 111 HD13 ILE 111 13.898 -6.874 2.814 854 H THR 112 H THR 112 16.930 -9.839 6.841 855 HA THR 112 HA THR 112 17.666 -11.965 5.060 856 HB THR 112 HB THR 112 17.036 -13.365 7.058 857 HG1 THR 112 HG1 THR 112 16.870 -11.013 8.571 858 HG21 THR 112 HG21 THR 112 18.823 -12.510 8.522 859 HG22 THR 112 HG22 THR 112 18.739 -10.984 7.638 860 HG23 THR 112 HG23 THR 112 19.306 -12.445 6.813 861 H ARG 113 H ARG 113 16.158 -12.949 3.810 862 HA ARG 113 HA ARG 113 13.537 -11.661 3.827 863 HB2 ARG 113 HB2 ARG 113 15.033 -11.834 1.765 864 HB3 ARG 113 HB3 ARG 113 14.576 -13.529 1.722 865 HG2 ARG 113 HG2 ARG 113 12.214 -12.860 1.586 866 HG3 ARG 113 HG3 ARG 113 12.722 -11.171 1.533 867 HD2 ARG 113 HD2 ARG 113 14.130 -11.823 -0.473 868 HD3 ARG 113 HD3 ARG 113 13.221 -13.339 -0.466 869 HE ARG 113 HE ARG 113 11.828 -10.779 -0.528 870 HH11 ARG 113 HH11 ARG 113 12.659 -13.773 -2.202 871 HH12 ARG 113 HH12 ARG 113 11.477 -13.590 -3.425 872 HH21 ARG 113 HH21 ARG 113 10.306 -10.512 -2.167 873 HH22 ARG 113 HH22 ARG 113 10.083 -11.660 -3.424 874 H ASP 114 H ASP 114 11.702 -12.690 4.206 875 HA ASP 114 HA ASP 114 10.204 -14.209 4.967 876 HB2 ASP 114 HB2 ASP 114 11.716 -15.909 3.003 877 HB3 ASP 114 HB3 ASP 114 10.287 -16.490 3.845 878 H GLY 115 H GLY 115 12.678 -14.005 6.501 879 HA2 GLY 115 HA2 GLY 115 13.354 -14.935 8.506 880 HA3 GLY 115 HA3 GLY 115 12.128 -16.174 8.282 881 H SER 116 H SER 116 14.282 -15.848 5.609 882 HA SER 116 HA SER 116 15.452 -18.355 6.215 883 HB2 SER 116 HB2 SER 116 14.702 -17.853 3.917 884 HB3 SER 116 HB3 SER 116 15.754 -16.445 3.865 885 HG SER 116 HG SER 116 16.501 -18.480 2.851 886 H ARG 117 H ARG 117 17.769 -18.381 5.719 887 HA ARG 117 HA ARG 117 19.087 -16.442 7.443 888 HB2 ARG 117 HB2 ARG 117 21.027 -17.838 7.525 889 HB3 ARG 117 HB3 ARG 117 19.637 -18.872 7.722 890 HG2 ARG 117 HG2 ARG 117 21.135 -18.539 5.129 891 HG3 ARG 117 HG3 ARG 117 21.489 -19.793 6.309 892 HD2 ARG 117 HD2 ARG 117 19.175 -20.630 6.015 893 HD3 ARG 117 HD3 ARG 117 18.929 -19.402 4.765 894 HE ARG 117 HE ARG 117 21.141 -20.726 3.945 895 HH11 ARG 117 HH11 ARG 117 17.865 -21.761 4.791 896 HH12 ARG 117 HH12 ARG 117 17.871 -23.126 3.774 897 HH21 ARG 117 HH21 ARG 117 21.167 -22.621 2.541 898 HH22 ARG 117 HH22 ARG 117 19.794 -23.618 2.471 899 H ASP 118 H ASP 118 18.432 -16.765 4.233 900 HA ASP 118 HA ASP 118 20.800 -15.658 3.088 901 HB2 ASP 118 HB2 ASP 118 19.243 -16.981 1.762 902 HB3 ASP 118 HB3 ASP 118 17.994 -15.749 2.010 903 H ALA 119 H ALA 119 21.270 -13.675 2.631 904 HA ALA 119 HA ALA 119 19.586 -11.569 3.815 905 HB1 ALA 119 HB1 ALA 119 21.766 -11.839 4.900 906 HB2 ALA 119 HB2 ALA 119 21.615 -10.264 4.123 907 HB3 ALA 119 HB3 ALA 119 22.569 -11.535 3.359 908 H VAL 120 H VAL 120 18.783 -10.118 2.519 909 HA VAL 120 HA VAL 120 19.738 -9.970 -0.250 910 HB VAL 120 HB VAL 120 17.044 -9.140 0.875 911 HG11 VAL 120 HG11 VAL 120 17.980 -9.389 -1.982 912 HG12 VAL 120 HG12 VAL 120 17.681 -7.886 -1.113 913 HG13 VAL 120 HG13 VAL 120 16.343 -8.982 -1.470 914 HG21 VAL 120 HG21 VAL 120 16.124 -11.111 -0.252 915 HG22 VAL 120 HG22 VAL 120 17.296 -11.562 0.984 916 HG23 VAL 120 HG23 VAL 120 17.747 -11.604 -0.723 917 H SER 121 H SER 121 20.888 -8.222 -0.633 918 HA SER 121 HA SER 121 20.735 -5.912 1.108 919 HB2 SER 121 HB2 SER 121 22.533 -6.486 -1.254 920 HB3 SER 121 HB3 SER 121 22.752 -5.214 -0.044 921 HG SER 121 HG SER 121 23.227 -7.931 0.096 922 H ASN 122 H ASN 122 19.844 -3.971 0.516 923 HA ASN 122 HA ASN 122 18.807 -2.389 -0.598 924 HB2 ASN 122 HB2 ASN 122 20.821 -2.423 -2.085 925 HB3 ASN 122 HB3 ASN 122 20.024 -3.602 -3.113 926 HD21 ASN 122 HD21 ASN 122 20.020 -0.329 -2.021 927 HD22 ASN 122 HD22 ASN 122 19.105 0.352 -3.304 928 H ALA 123 H ALA 123 17.170 -3.939 0.252 929 HA ALA 123 HA ALA 123 15.485 -5.031 -1.868 930 HB1 ALA 123 HB1 ALA 123 14.250 -6.113 -0.033 931 HB2 ALA 123 HB2 ALA 123 15.302 -5.322 1.140 932 HB3 ALA 123 HB3 ALA 123 15.966 -6.513 0.026 933 H ARG 124 H ARG 124 13.148 -4.542 -1.677 934 HA ARG 124 HA ARG 124 12.840 -1.711 -1.128 935 HB2 ARG 124 HB2 ARG 124 10.972 -1.759 -2.540 936 HB3 ARG 124 HB3 ARG 124 11.946 -3.036 -3.236 937 HG2 ARG 124 HG2 ARG 124 10.576 -4.626 -1.788 938 HG3 ARG 124 HG3 ARG 124 9.485 -3.265 -1.541 939 HD2 ARG 124 HD2 ARG 124 8.513 -4.314 -3.355 940 HD3 ARG 124 HD3 ARG 124 9.541 -3.123 -4.152 941 HE ARG 124 HE ARG 124 11.057 -5.397 -3.827 942 HH11 ARG 124 HH11 ARG 124 8.375 -4.309 -5.878 943 HH12 ARG 124 HH12 ARG 124 8.398 -5.674 -6.894 944 HH21 ARG 124 HH21 ARG 124 11.090 -7.272 -5.216 945 HH22 ARG 124 HH22 ARG 124 9.973 -7.412 -6.481 946 HA PRO 125 HA PRO 125 11.266 -2.181 2.978 947 HB2 PRO 125 HB2 PRO 125 9.258 -0.204 2.018 948 HB3 PRO 125 HB3 PRO 125 10.185 -0.196 3.529 949 HG2 PRO 125 HG2 PRO 125 10.926 1.375 1.548 950 HG3 PRO 125 HG3 PRO 125 12.153 0.460 2.440 951 HD2 PRO 125 HD2 PRO 125 11.040 -0.031 -0.286 952 HD3 PRO 125 HD3 PRO 125 12.686 -0.285 0.337 953 H VAL 126 H VAL 126 8.907 -2.359 0.316 954 HA VAL 126 HA VAL 126 6.820 -3.486 1.906 955 HB VAL 126 HB VAL 126 7.227 -4.021 -1.048 956 HG11 VAL 126 HG11 VAL 126 5.595 -5.473 0.020 957 HG12 VAL 126 HG12 VAL 126 4.802 -4.303 -1.046 958 HG13 VAL 126 HG13 VAL 126 4.777 -4.066 0.699 959 HG21 VAL 126 HG21 VAL 126 5.762 -2.162 -1.433 960 HG22 VAL 126 HG22 VAL 126 7.224 -1.670 -0.580 961 HG23 VAL 126 HG23 VAL 126 5.702 -1.851 0.306 962 H ASP 127 H ASP 127 9.538 -4.865 0.226 963 HA ASP 127 HA ASP 127 8.654 -7.575 0.409 964 HB2 ASP 127 HB2 ASP 127 10.413 -6.547 -1.181 965 HB3 ASP 127 HB3 ASP 127 11.527 -6.691 0.181 966 H ALA 128 H ALA 128 10.430 -5.339 2.295 967 HA ALA 128 HA ALA 128 11.473 -7.022 4.289 968 HB1 ALA 128 HB1 ALA 128 11.755 -4.995 5.609 969 HB2 ALA 128 HB2 ALA 128 10.640 -4.142 4.547 970 HB3 ALA 128 HB3 ALA 128 12.193 -4.697 3.926 971 H LEU 129 H LEU 129 8.389 -5.226 4.134 972 HA LEU 129 HA LEU 129 7.560 -6.163 6.702 973 HB2 LEU 129 HB2 LEU 129 5.351 -5.230 6.175 974 HB3 LEU 129 HB3 LEU 129 6.622 -4.080 5.869 975 HG LEU 129 HG LEU 129 6.403 -5.055 3.445 976 HD11 LEU 129 HD11 LEU 129 3.611 -5.387 4.503 977 HD12 LEU 129 HD12 LEU 129 4.738 -6.675 4.087 978 HD13 LEU 129 HD13 LEU 129 4.141 -5.587 2.820 979 HD21 LEU 129 HD21 LEU 129 4.566 -2.980 4.651 980 HD22 LEU 129 HD22 LEU 129 4.846 -3.178 2.922 981 HD23 LEU 129 HD23 LEU 129 6.174 -2.710 3.982 982 H HIS 130 H HIS 130 7.144 -7.362 3.466 983 HA HIS 130 HA HIS 130 5.357 -9.477 3.974 984 HB2 HIS 130 HB2 HIS 130 6.016 -8.691 1.706 985 HB3 HIS 130 HB3 HIS 130 7.650 -9.267 1.989 986 HD1 HIS 130 HD1 HIS 130 8.006 -11.925 1.854 987 HD2 HIS 130 HD2 HIS 130 4.176 -10.586 0.935 988 HE1 HIS 130 HE1 HIS 130 6.847 -13.836 0.749 989 H ALA 131 H ALA 131 8.730 -9.002 4.358 990 HA ALA 131 HA ALA 131 9.304 -11.757 5.143 991 HB1 ALA 131 HB1 ALA 131 11.638 -11.044 5.259 992 HB2 ALA 131 HB2 ALA 131 11.140 -9.369 5.019 993 HB3 ALA 131 HB3 ALA 131 10.902 -10.545 3.732 994 H HIS 132 H HIS 132 7.819 -9.493 6.731 995 HA HIS 132 HA HIS 132 7.296 -9.083 8.896 996 HB2 HIS 132 HB2 HIS 132 9.036 -11.502 9.469 997 HB3 HIS 132 HB3 HIS 132 8.024 -10.707 10.668 998 HD1 HIS 132 HD1 HIS 132 5.541 -11.387 10.707 999 HD2 HIS 132 HD2 HIS 132 7.587 -12.799 7.374 1000 HE1 HIS 132 HE1 HIS 132 3.946 -12.887 9.481 1001 H GLN 133 H GLN 133 9.546 -7.842 7.659 1002 HA GLN 133 HA GLN 133 11.182 -7.031 9.964 1003 HB2 GLN 133 HB2 GLN 133 11.557 -6.444 7.014 1004 HB3 GLN 133 HB3 GLN 133 12.725 -6.133 8.292 1005 HG2 GLN 133 HG2 GLN 133 11.769 -8.868 7.466 1006 HG3 GLN 133 HG3 GLN 133 13.239 -8.105 6.876 1007 HE21 GLN 133 HE21 GLN 133 14.368 -9.879 7.686 1008 HE22 GLN 133 HE22 GLN 133 14.733 -10.031 9.359 1009 H ALA 134 H ALA 134 8.400 -6.337 9.424 1010 HA ALA 134 HA ALA 134 7.897 -3.970 8.082 1011 HB1 ALA 134 HB1 ALA 134 6.171 -5.535 8.833 1012 HB2 ALA 134 HB2 ALA 134 5.819 -3.864 9.284 1013 HB3 ALA 134 HB3 ALA 134 6.424 -4.991 10.491 1014 H ARG 135 H ARG 135 9.107 -4.349 11.360 1015 HA ARG 135 HA ARG 135 8.616 -1.739 12.298 1016 HB2 ARG 135 HB2 ARG 135 10.902 -3.590 12.937 1017 HB3 ARG 135 HB3 ARG 135 10.610 -2.082 13.784 1018 HG2 ARG 135 HG2 ARG 135 8.730 -4.441 13.686 1019 HG3 ARG 135 HG3 ARG 135 9.769 -3.998 15.040 1020 HD2 ARG 135 HD2 ARG 135 8.569 -1.864 15.242 1021 HD3 ARG 135 HD3 ARG 135 7.523 -2.331 13.902 1022 HE ARG 135 HE ARG 135 7.500 -4.306 15.888 1023 HH11 ARG 135 HH11 ARG 135 6.266 -1.061 15.271 1024 HH12 ARG 135 HH12 ARG 135 4.897 -1.222 16.270 1025 HH21 ARG 135 HH21 ARG 135 5.593 -4.530 17.296 1026 HH22 ARG 135 HH22 ARG 135 4.528 -3.229 17.476 1027 H GLU 136 H GLU 136 11.210 -2.979 10.312 1028 HA GLU 136 HA GLU 136 12.838 -0.655 10.350 1029 HB2 GLU 136 HB2 GLU 136 12.612 -2.800 8.238 1030 HB3 GLU 136 HB3 GLU 136 13.958 -1.687 8.446 1031 HG2 GLU 136 HG2 GLU 136 13.109 -3.840 10.373 1032 HG3 GLU 136 HG3 GLU 136 14.488 -3.908 9.282 1033 H VAL 137 H VAL 137 10.110 -1.713 8.567 1034 HA VAL 137 HA VAL 137 10.244 0.104 6.375 1035 HB VAL 137 HB VAL 137 7.860 -1.374 7.504 1036 HG11 VAL 137 HG11 VAL 137 6.906 -1.158 5.271 1037 HG12 VAL 137 HG12 VAL 137 8.305 -0.213 4.759 1038 HG13 VAL 137 HG13 VAL 137 7.217 0.420 5.993 1039 HG21 VAL 137 HG21 VAL 137 8.364 -3.068 5.781 1040 HG22 VAL 137 HG22 VAL 137 9.642 -2.917 6.990 1041 HG23 VAL 137 HG23 VAL 137 9.838 -2.190 5.397 1042 H VAL 138 H VAL 138 8.454 -0.008 9.405 1043 HA VAL 138 HA VAL 138 6.993 2.385 9.134 1044 HB VAL 138 HB VAL 138 8.108 1.196 11.657 1045 HG11 VAL 138 HG11 VAL 138 6.111 2.276 12.721 1046 HG12 VAL 138 HG12 VAL 138 5.729 3.022 11.167 1047 HG13 VAL 138 HG13 VAL 138 7.224 3.443 12.004 1048 HG21 VAL 138 HG21 VAL 138 5.948 0.013 11.873 1049 HG22 VAL 138 HG22 VAL 138 6.852 -0.489 10.446 1050 HG23 VAL 138 HG23 VAL 138 5.483 0.610 10.280 1051 H ARG 139 H ARG 139 10.111 1.688 10.534 1052 HA ARG 139 HA ARG 139 10.835 4.235 11.398 1053 HB2 ARG 139 HB2 ARG 139 12.271 1.814 10.530 1054 HB3 ARG 139 HB3 ARG 139 13.213 3.251 10.994 1055 HG2 ARG 139 HG2 ARG 139 12.177 3.131 13.201 1056 HG3 ARG 139 HG3 ARG 139 11.209 1.748 12.684 1057 HD2 ARG 139 HD2 ARG 139 13.186 1.118 14.006 1058 HD3 ARG 139 HD3 ARG 139 13.199 0.423 12.383 1059 HE ARG 139 HE ARG 139 14.687 2.463 11.885 1060 HH11 ARG 139 HH11 ARG 139 14.766 0.534 14.834 1061 HH12 ARG 139 HH12 ARG 139 16.374 0.949 15.226 1062 HH21 ARG 139 HH21 ARG 139 16.845 2.938 12.329 1063 HH22 ARG 139 HH22 ARG 139 17.635 2.364 13.724 1064 H ARG 140 H ARG 140 11.203 2.697 8.257 1065 HA ARG 140 HA ARG 140 12.727 4.729 6.977 1066 HB2 ARG 140 HB2 ARG 140 11.991 2.207 6.353 1067 HB3 ARG 140 HB3 ARG 140 10.776 3.072 5.439 1068 HG2 ARG 140 HG2 ARG 140 13.760 3.374 5.124 1069 HG3 ARG 140 HG3 ARG 140 12.723 2.398 4.100 1070 HD2 ARG 140 HD2 ARG 140 11.509 4.495 3.472 1071 HD3 ARG 140 HD3 ARG 140 12.724 5.400 4.387 1072 HE ARG 140 HE ARG 140 14.172 3.792 2.738 1073 HH11 ARG 140 HH11 ARG 140 11.976 6.518 2.258 1074 HH12 ARG 140 HH12 ARG 140 12.422 6.724 0.608 1075 HH21 ARG 140 HH21 ARG 140 14.782 4.138 0.587 1076 HH22 ARG 140 HH22 ARG 140 14.032 5.362 -0.364 1077 H ALA 141 H ALA 141 9.290 4.085 7.365 1078 HA ALA 141 HA ALA 141 8.193 6.143 5.767 1079 HB1 ALA 141 HB1 ALA 141 7.135 4.758 8.213 1080 HB2 ALA 141 HB2 ALA 141 6.834 4.316 6.518 1081 HB3 ALA 141 HB3 ALA 141 6.223 5.844 7.179 1082 H GLN 142 H GLN 142 9.064 6.037 9.178 1083 HA GLN 142 HA GLN 142 8.175 8.587 9.903 1084 HB2 GLN 142 HB2 GLN 142 10.598 7.139 10.974 1085 HB3 GLN 142 HB3 GLN 142 9.780 8.486 11.746 1086 HG2 GLN 142 HG2 GLN 142 7.767 7.095 11.995 1087 HG3 GLN 142 HG3 GLN 142 8.633 5.743 11.266 1088 HE21 GLN 142 HE21 GLN 142 8.476 4.471 13.129 1089 HE22 GLN 142 HE22 GLN 142 9.425 4.822 14.529 1090 H ALA 143 H ALA 143 11.238 7.534 8.531 1091 HA ALA 143 HA ALA 143 12.593 9.988 8.667 1092 HB1 ALA 143 HB1 ALA 143 13.729 7.852 8.283 1093 HB2 ALA 143 HB2 ALA 143 14.143 9.033 7.041 1094 HB3 ALA 143 HB3 ALA 143 12.991 7.745 6.687 1095 H MET 144 H MET 144 10.453 8.657 6.220 1096 HA MET 144 HA MET 144 10.833 10.810 4.363 1097 HB2 MET 144 HB2 MET 144 10.122 8.638 3.534 1098 HB3 MET 144 HB3 MET 144 8.701 8.673 4.562 1099 HG2 MET 144 HG2 MET 144 8.124 9.107 2.234 1100 HG3 MET 144 HG3 MET 144 7.761 10.493 3.251 1101 HE1 MET 144 HE1 MET 144 10.217 8.984 0.576 1102 HE2 MET 144 HE2 MET 144 11.328 9.414 1.875 1103 HE3 MET 144 HE3 MET 144 11.366 10.302 0.349 1104 H ALA 145 H ALA 145 8.769 10.277 7.086 1105 HA ALA 145 HA ALA 145 6.990 12.392 6.306 1106 HB1 ALA 145 HB1 ALA 145 5.760 11.950 8.355 1107 HB2 ALA 145 HB2 ALA 145 7.060 10.906 8.932 1108 HB3 ALA 145 HB3 ALA 145 6.109 10.437 7.522 1109 H TYR 146 H TYR 146 9.491 11.958 8.789 1110 HA TYR 146 HA TYR 146 9.547 14.869 9.078 1111 HB2 TYR 146 HB2 TYR 146 9.781 12.857 11.340 1112 HB3 TYR 146 HB3 TYR 146 9.974 14.602 11.497 1113 HD1 TYR 146 HD1 TYR 146 8.007 16.085 11.289 1114 HD2 TYR 146 HD2 TYR 146 7.627 11.857 11.168 1115 HE1 TYR 146 HE1 TYR 146 5.577 16.293 11.623 1116 HE2 TYR 146 HE2 TYR 146 5.223 12.049 11.498 1117 HH TYR 146 HH TYR 146 3.588 13.487 12.203 Start of MODEL 13 1 H MET 1 H MET 1 -14.545 11.406 -1.317 2 HA MET 1 HA MET 1 -15.906 9.640 -0.345 3 HB2 MET 1 HB2 MET 1 -14.116 8.513 0.839 4 HB3 MET 1 HB3 MET 1 -13.359 9.503 -0.385 5 HG2 MET 1 HG2 MET 1 -13.598 10.250 2.528 6 HG3 MET 1 HG3 MET 1 -12.181 9.505 1.798 7 HE1 MET 1 HE1 MET 1 -11.997 11.022 -1.020 8 HE2 MET 1 HE2 MET 1 -10.634 10.679 0.048 9 HE3 MET 1 HE3 MET 1 -10.889 12.314 -0.568 10 HA PRO 2 HA PRO 2 -17.996 10.462 3.563 11 HB2 PRO 2 HB2 PRO 2 -18.144 7.989 4.678 12 HB3 PRO 2 HB3 PRO 2 -19.103 8.442 3.269 13 HG2 PRO 2 HG2 PRO 2 -16.513 6.933 3.386 14 HG3 PRO 2 HG3 PRO 2 -17.985 6.544 2.475 15 HD2 PRO 2 HD2 PRO 2 -15.893 7.713 1.295 16 HD3 PRO 2 HD3 PRO 2 -17.556 8.138 0.852 17 H GLY 3 H GLY 3 -15.436 11.257 3.799 18 HA2 GLY 3 HA2 GLY 3 -14.687 10.374 6.475 19 HA3 GLY 3 HA3 GLY 3 -13.455 10.429 5.215 20 H ARG 4 H ARG 4 -15.422 12.209 7.344 21 HA ARG 4 HA ARG 4 -14.940 14.814 6.437 22 HB2 ARG 4 HB2 ARG 4 -15.756 15.602 8.519 23 HB3 ARG 4 HB3 ARG 4 -16.608 14.098 8.260 24 HG2 ARG 4 HG2 ARG 4 -14.269 14.530 10.129 25 HG3 ARG 4 HG3 ARG 4 -15.958 14.362 10.593 26 HD2 ARG 4 HD2 ARG 4 -14.285 12.257 9.237 27 HD3 ARG 4 HD3 ARG 4 -14.621 12.320 10.966 28 HE ARG 4 HE ARG 4 -17.081 12.264 9.883 29 HH11 ARG 4 HH11 ARG 4 -14.241 10.230 9.244 30 HH12 ARG 4 HH12 ARG 4 -15.147 8.821 9.017 31 HH21 ARG 4 HH21 ARG 4 -18.300 10.300 9.584 32 HH22 ARG 4 HH22 ARG 4 -17.480 8.847 9.211 33 H ALA 5 H ALA 5 -13.386 16.335 6.964 34 HA ALA 5 HA ALA 5 -10.778 15.841 6.852 35 HB1 ALA 5 HB1 ALA 5 -10.340 18.024 7.858 36 HB2 ALA 5 HB2 ALA 5 -11.963 18.041 8.543 37 HB3 ALA 5 HB3 ALA 5 -11.744 18.098 6.796 38 HA PRO 6 HA PRO 6 -9.952 13.383 10.402 39 HB2 PRO 6 HB2 PRO 6 -7.216 13.334 10.135 40 HB3 PRO 6 HB3 PRO 6 -8.327 12.272 9.271 41 HG2 PRO 6 HG2 PRO 6 -6.990 14.770 8.353 42 HG3 PRO 6 HG3 PRO 6 -7.309 13.275 7.455 43 HD2 PRO 6 HD2 PRO 6 -8.792 15.495 7.138 44 HD3 PRO 6 HD3 PRO 6 -9.495 13.868 7.006 45 H GLY 7 H GLY 7 -10.210 14.213 12.284 46 HA2 GLY 7 HA2 GLY 7 -8.311 16.194 13.263 47 HA3 GLY 7 HA3 GLY 7 -10.004 16.117 13.771 48 H SER 8 H SER 8 -6.970 15.213 14.608 49 HA SER 8 HA SER 8 -8.013 13.274 16.508 50 HB2 SER 8 HB2 SER 8 -5.673 12.714 14.677 51 HB3 SER 8 HB3 SER 8 -6.234 11.659 15.976 52 HG SER 8 HG SER 8 -8.264 12.336 14.352 53 H THR 9 H THR 9 -6.958 13.428 18.467 54 HA THR 9 HA THR 9 -4.673 15.218 18.474 55 HB THR 9 HB THR 9 -6.600 15.916 19.941 56 HG1 THR 9 HG1 THR 9 -4.606 16.662 20.536 57 HG21 THR 9 HG21 THR 9 -5.868 13.500 21.596 58 HG22 THR 9 HG22 THR 9 -7.336 13.663 20.628 59 HG23 THR 9 HG23 THR 9 -7.062 14.726 22.008 60 H LEU 10 H LEU 10 -5.525 12.138 18.668 61 HA LEU 10 HA LEU 10 -3.007 11.148 19.748 62 HB2 LEU 10 HB2 LEU 10 -5.534 9.878 18.696 63 HB3 LEU 10 HB3 LEU 10 -4.097 8.930 18.972 64 HG LEU 10 HG LEU 10 -5.676 8.641 20.704 65 HD11 LEU 10 HD11 LEU 10 -3.300 10.229 21.681 66 HD12 LEU 10 HD12 LEU 10 -3.340 8.501 21.341 67 HD13 LEU 10 HD13 LEU 10 -4.280 9.159 22.681 68 HD21 LEU 10 HD21 LEU 10 -6.899 10.716 20.665 69 HD22 LEU 10 HD22 LEU 10 -5.476 11.584 21.237 70 HD23 LEU 10 HD23 LEU 10 -6.292 10.429 22.295 71 H ALA 11 H ALA 11 -2.698 9.010 17.843 72 HA ALA 11 HA ALA 11 -1.492 10.391 15.687 73 HB1 ALA 11 HB1 ALA 11 -0.695 8.179 16.427 74 HB2 ALA 11 HB2 ALA 11 -1.119 8.173 14.715 75 HB3 ALA 11 HB3 ALA 11 -2.214 7.456 15.890 76 H ARG 12 H ARG 12 -2.352 11.086 13.852 77 HA ARG 12 HA ARG 12 -5.137 10.905 13.504 78 HB2 ARG 12 HB2 ARG 12 -4.140 12.985 13.084 79 HB3 ARG 12 HB3 ARG 12 -2.882 12.294 12.089 80 HG2 ARG 12 HG2 ARG 12 -4.448 11.803 10.379 81 HG3 ARG 12 HG3 ARG 12 -5.789 12.351 11.394 82 HD2 ARG 12 HD2 ARG 12 -5.158 14.086 9.766 83 HD3 ARG 12 HD3 ARG 12 -4.854 14.586 11.432 84 HE ARG 12 HE ARG 12 -2.483 13.905 10.954 85 HH11 ARG 12 HH11 ARG 12 -4.613 15.171 8.377 86 HH12 ARG 12 HH12 ARG 12 -3.348 15.872 7.504 87 HH21 ARG 12 HH21 ARG 12 -0.786 14.901 9.742 88 HH22 ARG 12 HH22 ARG 12 -1.104 15.750 8.299 89 H VAL 13 H VAL 13 -6.194 9.532 12.294 90 HA VAL 13 HA VAL 13 -4.669 7.793 10.595 91 HB VAL 13 HB VAL 13 -6.528 6.184 10.951 92 HG11 VAL 13 HG11 VAL 13 -5.984 5.661 13.330 93 HG12 VAL 13 HG12 VAL 13 -5.177 7.239 13.435 94 HG13 VAL 13 HG13 VAL 13 -4.565 6.013 12.342 95 HG21 VAL 13 HG21 VAL 13 -8.318 7.813 11.451 96 HG22 VAL 13 HG22 VAL 13 -7.521 8.209 12.972 97 HG23 VAL 13 HG23 VAL 13 -8.187 6.595 12.721 98 H GLY 14 H GLY 14 -5.993 7.077 8.778 99 HA2 GLY 14 HA2 GLY 14 -7.724 9.171 7.789 100 HA3 GLY 14 HA3 GLY 14 -6.236 8.839 6.924 101 H SER 15 H SER 15 -8.906 8.649 6.187 102 HA SER 15 HA SER 15 -9.155 5.840 5.373 103 HB2 SER 15 HB2 SER 15 -11.170 7.035 6.382 104 HB3 SER 15 HB3 SER 15 -11.127 8.137 5.007 105 HG SER 15 HG SER 15 -11.667 5.385 5.083 106 H ILE 16 H ILE 16 -8.069 5.509 3.468 107 HA ILE 16 HA ILE 16 -7.768 7.833 1.720 108 HB ILE 16 HB ILE 16 -5.851 5.501 2.016 109 HG12 ILE 16 HG12 ILE 16 -5.840 6.920 4.026 110 HG13 ILE 16 HG13 ILE 16 -4.335 7.072 3.130 111 HG21 ILE 16 HG21 ILE 16 -5.790 6.471 -0.213 112 HG22 ILE 16 HG22 ILE 16 -4.315 6.870 0.670 113 HG23 ILE 16 HG23 ILE 16 -5.582 8.080 0.479 114 HD11 ILE 16 HD11 ILE 16 -5.134 9.210 2.211 115 HD12 ILE 16 HD12 ILE 16 -5.064 9.218 3.974 116 HD13 ILE 16 HD13 ILE 16 -6.615 9.042 3.157 117 HA PRO 17 HA PRO 17 -9.858 5.227 -1.302 118 HB2 PRO 17 HB2 PRO 17 -9.888 7.098 -3.271 119 HB3 PRO 17 HB3 PRO 17 -11.012 7.169 -1.908 120 HG2 PRO 17 HG2 PRO 17 -8.484 8.675 -2.378 121 HG3 PRO 17 HG3 PRO 17 -10.024 9.248 -1.720 122 HD2 PRO 17 HD2 PRO 17 -7.865 8.623 -0.183 123 HD3 PRO 17 HD3 PRO 17 -9.539 8.503 0.393 124 H ALA 18 H ALA 18 -9.229 4.590 -3.642 125 HA ALA 18 HA ALA 18 -6.387 3.994 -3.563 126 HB1 ALA 18 HB1 ALA 18 -6.836 2.519 -5.415 127 HB2 ALA 18 HB2 ALA 18 -8.476 3.157 -5.572 128 HB3 ALA 18 HB3 ALA 18 -8.011 2.242 -4.131 129 H GLY 19 H GLY 19 -4.860 5.115 -4.639 130 HA2 GLY 19 HA2 GLY 19 -5.834 7.015 -6.632 131 HA3 GLY 19 HA3 GLY 19 -4.419 7.228 -5.619 132 H ASP 20 H ASP 20 -2.499 6.806 -6.503 133 HA ASP 20 HA ASP 20 -2.583 5.849 -9.249 134 HB2 ASP 20 HB2 ASP 20 -1.634 8.060 -8.918 135 HB3 ASP 20 HB3 ASP 20 -0.472 7.416 -7.771 136 H ASP 21 H ASP 21 -1.762 4.067 -9.875 137 HA ASP 21 HA ASP 21 -0.744 2.075 -8.158 138 HB2 ASP 21 HB2 ASP 21 -1.922 1.338 -10.032 139 HB3 ASP 21 HB3 ASP 21 -1.015 2.371 -11.129 140 H VAL 22 H VAL 22 1.197 1.850 -7.397 141 HA VAL 22 HA VAL 22 3.356 3.435 -8.548 142 HB VAL 22 HB VAL 22 3.222 2.042 -5.866 143 HG11 VAL 22 HG11 VAL 22 5.251 4.027 -6.903 144 HG12 VAL 22 HG12 VAL 22 5.529 2.306 -6.641 145 HG13 VAL 22 HG13 VAL 22 5.183 3.359 -5.269 146 HG21 VAL 22 HG21 VAL 22 2.972 4.339 -4.981 147 HG22 VAL 22 HG22 VAL 22 1.623 3.839 -6.007 148 HG23 VAL 22 HG23 VAL 22 2.860 4.925 -6.638 149 H LEU 23 H LEU 23 2.503 0.072 -8.045 150 HA LEU 23 HA LEU 23 5.235 -0.671 -8.476 151 HB2 LEU 23 HB2 LEU 23 4.412 -3.074 -8.235 152 HB3 LEU 23 HB3 LEU 23 4.426 -2.053 -6.823 153 HG LEU 23 HG LEU 23 1.992 -1.853 -6.904 154 HD11 LEU 23 HD11 LEU 23 1.657 -2.009 -9.340 155 HD12 LEU 23 HD12 LEU 23 0.673 -3.193 -8.480 156 HD13 LEU 23 HD13 LEU 23 2.152 -3.698 -9.294 157 HD21 LEU 23 HD21 LEU 23 2.951 -4.690 -7.140 158 HD22 LEU 23 HD22 LEU 23 1.422 -4.171 -6.428 159 HD23 LEU 23 HD23 LEU 23 2.949 -3.690 -5.688 160 H ASP 24 H ASP 24 5.875 -2.349 -9.899 161 HA ASP 24 HA ASP 24 5.436 -1.675 -12.564 162 HB2 ASP 24 HB2 ASP 24 7.511 -2.643 -11.956 163 HB3 ASP 24 HB3 ASP 24 6.763 -4.031 -11.202 164 HA PRO 25 HA PRO 25 1.694 -3.606 -13.893 165 HB2 PRO 25 HB2 PRO 25 3.315 -4.705 -16.131 166 HB3 PRO 25 HB3 PRO 25 1.761 -3.862 -16.170 167 HG2 PRO 25 HG2 PRO 25 4.004 -2.599 -16.813 168 HG3 PRO 25 HG3 PRO 25 2.736 -1.782 -15.884 169 HD2 PRO 25 HD2 PRO 25 5.365 -2.840 -14.976 170 HD3 PRO 25 HD3 PRO 25 4.437 -1.449 -14.384 171 H ASP 26 H ASP 26 4.538 -5.823 -13.926 172 HA ASP 26 HA ASP 26 2.558 -7.904 -13.683 173 HB2 ASP 26 HB2 ASP 26 4.286 -9.539 -14.244 174 HB3 ASP 26 HB3 ASP 26 3.917 -8.432 -15.553 175 H GLU 27 H GLU 27 3.862 -6.153 -11.517 176 HA GLU 27 HA GLU 27 4.907 -8.054 -9.672 177 HB2 GLU 27 HB2 GLU 27 3.633 -5.340 -9.278 178 HB3 GLU 27 HB3 GLU 27 4.214 -6.318 -7.937 179 HG2 GLU 27 HG2 GLU 27 5.892 -5.419 -10.238 180 HG3 GLU 27 HG3 GLU 27 5.804 -4.559 -8.694 181 HA PRO 28 HA PRO 28 1.299 -10.289 -8.595 182 HB2 PRO 28 HB2 PRO 28 1.768 -10.765 -5.917 183 HB3 PRO 28 HB3 PRO 28 2.536 -11.650 -7.232 184 HG2 PRO 28 HG2 PRO 28 3.591 -9.328 -5.667 185 HG3 PRO 28 HG3 PRO 28 4.420 -10.824 -6.135 186 HD2 PRO 28 HD2 PRO 28 4.818 -8.561 -7.487 187 HD3 PRO 28 HD3 PRO 28 4.708 -10.118 -8.335 188 H THR 29 H THR 29 -0.730 -9.663 -8.194 189 HA THR 29 HA THR 29 -1.216 -7.522 -6.269 190 HB THR 29 HB THR 29 -2.991 -6.724 -7.922 191 HG1 THR 29 HG1 THR 29 -2.984 -8.488 -9.261 192 HG21 THR 29 HG21 THR 29 -1.389 -5.377 -9.232 193 HG22 THR 29 HG22 THR 29 -0.086 -6.458 -8.739 194 HG23 THR 29 HG23 THR 29 -0.906 -5.465 -7.537 195 H TYR 30 H TYR 30 -3.506 -7.365 -5.689 196 HA TYR 30 HA TYR 30 -5.136 -9.748 -6.018 197 HB2 TYR 30 HB2 TYR 30 -4.487 -8.294 -3.458 198 HB3 TYR 30 HB3 TYR 30 -5.993 -9.171 -3.680 199 HD1 TYR 30 HD1 TYR 30 -5.259 -11.602 -4.980 200 HD2 TYR 30 HD2 TYR 30 -3.160 -9.448 -2.000 201 HE1 TYR 30 HE1 TYR 30 -4.210 -13.682 -4.243 202 HE2 TYR 30 HE2 TYR 30 -2.088 -11.509 -1.247 203 HH TYR 30 HH TYR 30 -2.152 -14.345 -3.088 204 H ASP 31 H ASP 31 -7.337 -9.263 -5.668 205 HA ASP 31 HA ASP 31 -8.084 -6.482 -6.078 206 HB2 ASP 31 HB2 ASP 31 -9.714 -7.255 -7.823 207 HB3 ASP 31 HB3 ASP 31 -8.043 -7.488 -8.319 208 H LEU 32 H LEU 32 -10.475 -6.276 -5.599 209 HA LEU 32 HA LEU 32 -10.819 -7.072 -3.008 210 HB2 LEU 32 HB2 LEU 32 -12.980 -6.180 -4.906 211 HB3 LEU 32 HB3 LEU 32 -13.208 -6.362 -3.183 212 HG LEU 32 HG LEU 32 -11.368 -4.393 -4.550 213 HD11 LEU 32 HD11 LEU 32 -12.867 -2.712 -3.636 214 HD12 LEU 32 HD12 LEU 32 -13.884 -3.978 -2.956 215 HD13 LEU 32 HD13 LEU 32 -13.733 -3.818 -4.704 216 HD21 LEU 32 HD21 LEU 32 -10.356 -5.120 -2.455 217 HD22 LEU 32 HD22 LEU 32 -11.880 -4.841 -1.604 218 HD23 LEU 32 HD23 LEU 32 -10.991 -3.485 -2.290 219 HA PRO 33 HA PRO 33 -13.858 -10.652 -4.011 220 HB2 PRO 33 HB2 PRO 33 -13.380 -11.827 -6.514 221 HB3 PRO 33 HB3 PRO 33 -14.796 -10.880 -6.066 222 HG2 PRO 33 HG2 PRO 33 -12.403 -10.083 -7.616 223 HG3 PRO 33 HG3 PRO 33 -14.064 -9.479 -7.719 224 HD2 PRO 33 HD2 PRO 33 -12.017 -8.100 -6.564 225 HD3 PRO 33 HD3 PRO 33 -13.716 -7.913 -6.090 226 H ARG 34 H ARG 34 -10.614 -10.622 -5.544 227 HA ARG 34 HA ARG 34 -9.986 -13.302 -4.919 228 HB2 ARG 34 HB2 ARG 34 -8.914 -11.752 -6.631 229 HB3 ARG 34 HB3 ARG 34 -8.090 -10.998 -5.286 230 HG2 ARG 34 HG2 ARG 34 -6.623 -12.548 -6.380 231 HG3 ARG 34 HG3 ARG 34 -7.014 -13.148 -4.769 232 HD2 ARG 34 HD2 ARG 34 -8.468 -14.771 -5.600 233 HD3 ARG 34 HD3 ARG 34 -8.580 -13.976 -7.170 234 HE ARG 34 HE ARG 34 -5.946 -14.613 -6.882 235 HH11 ARG 34 HH11 ARG 34 -8.818 -16.664 -6.529 236 HH12 ARG 34 HH12 ARG 34 -8.161 -17.937 -7.451 237 HH21 ARG 34 HH21 ARG 34 -5.063 -16.434 -8.122 238 HH22 ARG 34 HH22 ARG 34 -6.029 -17.842 -8.295 239 H VAL 35 H VAL 35 -9.527 -10.214 -3.300 240 HA VAL 35 HA VAL 35 -7.997 -11.250 -1.153 241 HB VAL 35 HB VAL 35 -9.647 -8.692 -1.204 242 HG11 VAL 35 HG11 VAL 35 -7.423 -9.499 0.671 243 HG12 VAL 35 HG12 VAL 35 -9.135 -9.388 1.080 244 HG13 VAL 35 HG13 VAL 35 -8.237 -7.934 0.645 245 HG21 VAL 35 HG21 VAL 35 -6.717 -9.120 -1.705 246 HG22 VAL 35 HG22 VAL 35 -7.544 -7.566 -1.661 247 HG23 VAL 35 HG23 VAL 35 -7.938 -8.734 -2.925 248 H ALA 36 H ALA 36 -11.400 -10.661 -1.623 249 HA ALA 36 HA ALA 36 -12.322 -11.246 0.958 250 HB1 ALA 36 HB1 ALA 36 -13.681 -11.810 -1.688 251 HB2 ALA 36 HB2 ALA 36 -13.752 -10.289 -0.799 252 HB3 ALA 36 HB3 ALA 36 -14.470 -11.748 -0.111 253 H GLU 37 H GLU 37 -11.560 -13.206 -1.752 254 HA GLU 37 HA GLU 37 -12.325 -15.753 -0.825 255 HB2 GLU 37 HB2 GLU 37 -11.764 -14.890 -3.160 256 HB3 GLU 37 HB3 GLU 37 -10.120 -14.990 -2.664 257 HG2 GLU 37 HG2 GLU 37 -10.198 -17.347 -2.336 258 HG3 GLU 37 HG3 GLU 37 -11.925 -17.374 -2.692 259 H LEU 38 H LEU 38 -9.263 -13.954 -0.837 260 HA LEU 38 HA LEU 38 -7.611 -15.970 0.197 261 HB2 LEU 38 HB2 LEU 38 -6.813 -14.002 -1.041 262 HB3 LEU 38 HB3 LEU 38 -7.266 -12.977 0.306 263 HG LEU 38 HG LEU 38 -5.644 -14.315 1.701 264 HD11 LEU 38 HD11 LEU 38 -4.710 -15.244 -1.005 265 HD12 LEU 38 HD12 LEU 38 -5.406 -16.254 0.265 266 HD13 LEU 38 HD13 LEU 38 -3.844 -15.474 0.511 267 HD21 LEU 38 HD21 LEU 38 -5.162 -12.053 0.927 268 HD22 LEU 38 HD22 LEU 38 -4.552 -12.698 -0.596 269 HD23 LEU 38 HD23 LEU 38 -3.704 -13.049 0.904 270 H LEU 39 H LEU 39 -9.282 -13.262 1.768 271 HA LEU 39 HA LEU 39 -8.208 -14.004 4.351 272 HB2 LEU 39 HB2 LEU 39 -10.227 -11.925 3.572 273 HB3 LEU 39 HB3 LEU 39 -9.605 -12.133 5.200 274 HG LEU 39 HG LEU 39 -8.016 -11.288 2.768 275 HD11 LEU 39 HD11 LEU 39 -7.867 -9.133 3.908 276 HD12 LEU 39 HD12 LEU 39 -8.904 -9.744 5.197 277 HD13 LEU 39 HD13 LEU 39 -9.541 -9.567 3.561 278 HD21 LEU 39 HD21 LEU 39 -7.173 -11.561 5.659 279 HD22 LEU 39 HD22 LEU 39 -6.200 -10.866 4.363 280 HD23 LEU 39 HD23 LEU 39 -6.630 -12.571 4.316 281 H GLY 40 H GLY 40 -10.999 -14.798 2.528 282 HA2 GLY 40 HA2 GLY 40 -12.610 -16.375 3.041 283 HA3 GLY 40 HA3 GLY 40 -11.937 -16.495 4.662 284 H VAL 41 H VAL 41 -12.722 -13.389 3.419 285 HA VAL 41 HA VAL 41 -15.198 -13.325 4.980 286 HB VAL 41 HB VAL 41 -14.668 -11.039 5.794 287 HG11 VAL 41 HG11 VAL 41 -14.171 -12.886 7.268 288 HG12 VAL 41 HG12 VAL 41 -12.980 -11.600 7.474 289 HG13 VAL 41 HG13 VAL 41 -12.566 -13.051 6.559 290 HG21 VAL 41 HG21 VAL 41 -11.925 -11.489 4.613 291 HG22 VAL 41 HG22 VAL 41 -12.396 -10.120 5.618 292 HG23 VAL 41 HG23 VAL 41 -13.120 -10.336 4.024 293 HA PRO 42 HA PRO 42 -16.896 -11.551 1.346 294 HB2 PRO 42 HB2 PRO 42 -18.690 -9.747 2.370 295 HB3 PRO 42 HB3 PRO 42 -18.973 -11.488 2.309 296 HG2 PRO 42 HG2 PRO 42 -18.013 -9.806 4.588 297 HG3 PRO 42 HG3 PRO 42 -19.197 -11.129 4.588 298 HD2 PRO 42 HD2 PRO 42 -16.681 -11.497 5.418 299 HD3 PRO 42 HD3 PRO 42 -17.566 -12.760 4.538 300 H VAL 43 H VAL 43 -17.158 -9.600 0.129 301 HA VAL 43 HA VAL 43 -14.915 -7.939 0.089 302 HB VAL 43 HB VAL 43 -17.609 -7.431 -1.223 303 HG11 VAL 43 HG11 VAL 43 -16.351 -6.084 -2.856 304 HG12 VAL 43 HG12 VAL 43 -14.887 -6.312 -1.898 305 HG13 VAL 43 HG13 VAL 43 -16.246 -5.416 -1.225 306 HG21 VAL 43 HG21 VAL 43 -15.165 -8.838 -2.297 307 HG22 VAL 43 HG22 VAL 43 -16.632 -8.485 -3.212 308 HG23 VAL 43 HG23 VAL 43 -16.693 -9.598 -1.849 309 H SER 44 H SER 44 -17.984 -7.501 1.620 310 HA SER 44 HA SER 44 -17.959 -4.785 2.117 311 HB2 SER 44 HB2 SER 44 -19.481 -5.550 4.016 312 HB3 SER 44 HB3 SER 44 -19.895 -6.035 2.355 313 HG SER 44 HG SER 44 -19.995 -7.777 3.916 314 H LYS 45 H LYS 45 -16.676 -7.488 4.041 315 HA LYS 45 HA LYS 45 -15.731 -5.805 6.129 316 HB2 LYS 45 HB2 LYS 45 -15.158 -8.680 5.482 317 HB3 LYS 45 HB3 LYS 45 -14.304 -7.851 6.771 318 HG2 LYS 45 HG2 LYS 45 -16.490 -7.353 7.834 319 HG3 LYS 45 HG3 LYS 45 -17.274 -8.313 6.575 320 HD2 LYS 45 HD2 LYS 45 -16.138 -10.295 7.274 321 HD3 LYS 45 HD3 LYS 45 -15.112 -9.385 8.383 322 HE2 LYS 45 HE2 LYS 45 -16.864 -10.561 9.595 323 HE3 LYS 45 HE3 LYS 45 -17.089 -8.822 9.725 324 HZ1 LYS 45 HZ1 LYS 45 -19.155 -10.017 9.314 325 HZ2 LYS 45 HZ2 LYS 45 -18.559 -10.602 7.860 326 HZ3 LYS 45 HZ3 LYS 45 -18.842 -8.952 8.059 327 H VAL 46 H VAL 46 -14.268 -7.089 3.244 328 HA VAL 46 HA VAL 46 -11.584 -6.237 3.725 329 HB VAL 46 HB VAL 46 -13.021 -6.475 1.060 330 HG11 VAL 46 HG11 VAL 46 -10.772 -6.777 0.108 331 HG12 VAL 46 HG12 VAL 46 -10.074 -6.512 1.709 332 HG13 VAL 46 HG13 VAL 46 -10.958 -5.214 0.909 333 HG21 VAL 46 HG21 VAL 46 -11.411 -8.551 2.552 334 HG22 VAL 46 HG22 VAL 46 -12.035 -8.724 0.912 335 HG23 VAL 46 HG23 VAL 46 -13.152 -8.579 2.268 336 H ALA 47 H ALA 47 -14.277 -4.680 2.069 337 HA ALA 47 HA ALA 47 -12.971 -2.304 1.423 338 HB1 ALA 47 HB1 ALA 47 -15.899 -2.691 2.060 339 HB2 ALA 47 HB2 ALA 47 -15.148 -2.948 0.487 340 HB3 ALA 47 HB3 ALA 47 -15.201 -1.329 1.186 341 H GLN 48 H GLN 48 -14.657 -3.283 4.333 342 HA GLN 48 HA GLN 48 -14.592 -0.803 5.653 343 HB2 GLN 48 HB2 GLN 48 -14.734 -3.600 6.743 344 HB3 GLN 48 HB3 GLN 48 -14.794 -2.177 7.774 345 HG2 GLN 48 HG2 GLN 48 -16.724 -2.813 5.556 346 HG3 GLN 48 HG3 GLN 48 -17.024 -3.060 7.277 347 HE21 GLN 48 HE21 GLN 48 -17.345 -1.284 8.589 348 HE22 GLN 48 HE22 GLN 48 -17.717 0.278 7.945 349 H GLN 49 H GLN 49 -12.181 -3.350 5.460 350 HA GLN 49 HA GLN 49 -10.438 -2.396 7.488 351 HB2 GLN 49 HB2 GLN 49 -9.726 -3.866 4.941 352 HB3 GLN 49 HB3 GLN 49 -8.682 -3.684 6.339 353 HG2 GLN 49 HG2 GLN 49 -10.277 -4.936 7.665 354 HG3 GLN 49 HG3 GLN 49 -11.283 -5.179 6.243 355 HE21 GLN 49 HE21 GLN 49 -9.953 -7.163 7.902 356 HE22 GLN 49 HE22 GLN 49 -8.918 -8.059 6.854 357 H LEU 50 H LEU 50 -10.496 -2.012 4.057 358 HA LEU 50 HA LEU 50 -8.388 -0.169 3.839 359 HB2 LEU 50 HB2 LEU 50 -10.598 -1.004 2.057 360 HB3 LEU 50 HB3 LEU 50 -9.689 0.436 1.591 361 HG LEU 50 HG LEU 50 -7.627 -1.050 1.698 362 HD11 LEU 50 HD11 LEU 50 -9.645 -3.281 1.729 363 HD12 LEU 50 HD12 LEU 50 -8.570 -2.836 3.052 364 HD13 LEU 50 HD13 LEU 50 -7.891 -3.421 1.534 365 HD21 LEU 50 HD21 LEU 50 -8.619 -0.378 -0.395 366 HD22 LEU 50 HD22 LEU 50 -9.759 -1.725 -0.309 367 HD23 LEU 50 HD23 LEU 50 -8.025 -2.033 -0.480 368 H ARG 51 H ARG 51 -11.855 0.365 4.165 369 HA ARG 51 HA ARG 51 -11.772 3.167 3.981 370 HB2 ARG 51 HB2 ARG 51 -13.758 1.321 5.299 371 HB3 ARG 51 HB3 ARG 51 -13.975 3.065 5.279 372 HG2 ARG 51 HG2 ARG 51 -14.123 3.095 2.902 373 HG3 ARG 51 HG3 ARG 51 -13.633 1.406 2.795 374 HD2 ARG 51 HD2 ARG 51 -16.046 1.637 2.452 375 HD3 ARG 51 HD3 ARG 51 -15.688 0.728 3.906 376 HE ARG 51 HE ARG 51 -16.117 2.887 5.115 377 HH11 ARG 51 HH11 ARG 51 -17.628 2.411 1.952 378 HH12 ARG 51 HH12 ARG 51 -19.125 3.077 2.382 379 HH21 ARG 51 HH21 ARG 51 -18.135 3.851 5.715 380 HH22 ARG 51 HH22 ARG 51 -19.428 3.953 4.620 381 H GLU 52 H GLU 52 -10.984 1.052 6.656 382 HA GLU 52 HA GLU 52 -10.898 3.299 8.491 383 HB2 GLU 52 HB2 GLU 52 -10.392 0.357 8.855 384 HB3 GLU 52 HB3 GLU 52 -10.182 1.544 10.132 385 HG2 GLU 52 HG2 GLU 52 -12.729 0.978 8.665 386 HG3 GLU 52 HG3 GLU 52 -12.316 0.396 10.276 387 H GLY 53 H GLY 53 -8.956 2.206 6.150 388 HA2 GLY 53 HA2 GLY 53 -6.801 2.681 5.620 389 HA3 GLY 53 HA3 GLY 53 -6.700 3.627 7.093 390 H HIS 54 H HIS 54 -7.517 0.226 6.884 391 HA HIS 54 HA HIS 54 -5.126 -0.434 8.446 392 HB2 HIS 54 HB2 HIS 54 -7.575 -2.066 7.720 393 HB3 HIS 54 HB3 HIS 54 -6.175 -2.767 8.511 394 HD1 HIS 54 HD1 HIS 54 -7.099 -3.270 10.848 395 HD2 HIS 54 HD2 HIS 54 -8.004 0.566 9.520 396 HE1 HIS 54 HE1 HIS 54 -8.212 -2.111 12.767 397 H LEU 55 H LEU 55 -6.223 -0.348 5.294 398 HA LEU 55 HA LEU 55 -3.929 -1.706 4.261 399 HB2 LEU 55 HB2 LEU 55 -6.137 -3.249 4.782 400 HB3 LEU 55 HB3 LEU 55 -6.531 -2.642 3.194 401 HG LEU 55 HG LEU 55 -4.088 -4.228 3.896 402 HD11 LEU 55 HD11 LEU 55 -6.610 -5.047 2.464 403 HD12 LEU 55 HD12 LEU 55 -6.088 -5.579 4.065 404 HD13 LEU 55 HD13 LEU 55 -5.167 -6.043 2.633 405 HD21 LEU 55 HD21 LEU 55 -3.582 -2.871 2.012 406 HD22 LEU 55 HD22 LEU 55 -5.119 -3.287 1.233 407 HD23 LEU 55 HD23 LEU 55 -3.870 -4.511 1.455 408 H VAL 56 H VAL 56 -3.797 -1.068 1.969 409 HA VAL 56 HA VAL 56 -5.721 0.940 1.118 410 HB VAL 56 HB VAL 56 -3.855 2.368 0.191 411 HG11 VAL 56 HG11 VAL 56 -4.983 3.045 2.237 412 HG12 VAL 56 HG12 VAL 56 -3.270 3.457 2.318 413 HG13 VAL 56 HG13 VAL 56 -3.881 2.051 3.191 414 HG21 VAL 56 HG21 VAL 56 -2.067 0.709 0.200 415 HG22 VAL 56 HG22 VAL 56 -2.119 0.650 1.961 416 HG23 VAL 56 HG23 VAL 56 -1.599 2.124 1.147 417 H ALA 57 H ALA 57 -5.452 1.467 -1.253 418 HA ALA 57 HA ALA 57 -4.534 -0.826 -2.792 419 HB1 ALA 57 HB1 ALA 57 -7.342 0.274 -2.900 420 HB2 ALA 57 HB2 ALA 57 -6.885 -1.270 -2.190 421 HB3 ALA 57 HB3 ALA 57 -6.683 -1.001 -3.925 422 H VAL 58 H VAL 58 -4.634 -0.306 -5.148 423 HA VAL 58 HA VAL 58 -4.599 2.577 -5.636 424 HB VAL 58 HB VAL 58 -2.758 2.210 -7.318 425 HG11 VAL 58 HG11 VAL 58 -2.128 1.613 -4.442 426 HG12 VAL 58 HG12 VAL 58 -2.383 3.203 -5.141 427 HG13 VAL 58 HG13 VAL 58 -0.978 2.237 -5.635 428 HG21 VAL 58 HG21 VAL 58 -2.478 -0.442 -5.884 429 HG22 VAL 58 HG22 VAL 58 -1.330 0.215 -7.048 430 HG23 VAL 58 HG23 VAL 58 -2.958 -0.225 -7.566 431 H ARG 59 H ARG 59 -4.866 3.129 -7.958 432 HA ARG 59 HA ARG 59 -6.725 1.209 -9.135 433 HB2 ARG 59 HB2 ARG 59 -7.869 3.171 -8.304 434 HB3 ARG 59 HB3 ARG 59 -6.776 4.222 -9.191 435 HG2 ARG 59 HG2 ARG 59 -7.649 3.401 -11.292 436 HG3 ARG 59 HG3 ARG 59 -8.704 2.272 -10.435 437 HD2 ARG 59 HD2 ARG 59 -9.863 4.125 -9.395 438 HD3 ARG 59 HD3 ARG 59 -8.775 5.266 -10.179 439 HE ARG 59 HE ARG 59 -9.674 4.295 -12.314 440 HH11 ARG 59 HH11 ARG 59 -11.624 4.501 -9.379 441 HH12 ARG 59 HH12 ARG 59 -13.111 4.686 -10.198 442 HH21 ARG 59 HH21 ARG 59 -11.702 4.574 -13.445 443 HH22 ARG 59 HH22 ARG 59 -13.143 4.777 -12.563 444 H ARG 60 H ARG 60 -6.189 0.414 -10.958 445 HA ARG 60 HA ARG 60 -4.617 1.870 -12.913 446 HB2 ARG 60 HB2 ARG 60 -3.255 -0.299 -13.231 447 HB3 ARG 60 HB3 ARG 60 -2.827 0.741 -11.880 448 HG2 ARG 60 HG2 ARG 60 -4.186 -0.709 -10.396 449 HG3 ARG 60 HG3 ARG 60 -4.473 -1.778 -11.764 450 HD2 ARG 60 HD2 ARG 60 -1.710 -1.053 -10.864 451 HD3 ARG 60 HD3 ARG 60 -2.594 -2.381 -10.131 452 HE ARG 60 HE ARG 60 -2.771 -2.944 -12.716 453 HH11 ARG 60 HH11 ARG 60 0.081 -1.854 -10.935 454 HH12 ARG 60 HH12 ARG 60 1.140 -3.013 -11.573 455 HH21 ARG 60 HH21 ARG 60 -1.388 -4.566 -13.592 456 HH22 ARG 60 HH22 ARG 60 0.243 -4.701 -13.155 457 H ALA 61 H ALA 61 -5.272 1.452 -14.929 458 HA ALA 61 HA ALA 61 -6.522 0.737 -16.661 459 HB1 ALA 61 HB1 ALA 61 -6.499 -1.926 -15.222 460 HB2 ALA 61 HB2 ALA 61 -5.274 -1.361 -16.357 461 HB3 ALA 61 HB3 ALA 61 -6.920 -1.662 -16.914 462 H GLY 62 H GLY 62 -7.785 1.781 -14.215 463 HA2 GLY 62 HA2 GLY 62 -9.980 2.390 -13.734 464 HA3 GLY 62 HA3 GLY 62 -10.525 1.248 -14.959 465 H GLY 63 H GLY 63 -8.399 -0.299 -12.923 466 HA2 GLY 63 HA2 GLY 63 -10.623 -1.354 -11.322 467 HA3 GLY 63 HA3 GLY 63 -9.234 -2.290 -11.865 468 H VAL 64 H VAL 64 -10.372 -1.579 -9.204 469 HA VAL 64 HA VAL 64 -8.049 -0.289 -8.007 470 HB VAL 64 HB VAL 64 -10.721 -1.134 -6.814 471 HG11 VAL 64 HG11 VAL 64 -8.438 0.351 -5.510 472 HG12 VAL 64 HG12 VAL 64 -8.961 -1.292 -5.135 473 HG13 VAL 64 HG13 VAL 64 -10.030 0.071 -4.799 474 HG21 VAL 64 HG21 VAL 64 -9.596 1.605 -7.396 475 HG22 VAL 64 HG22 VAL 64 -11.144 1.270 -6.623 476 HG23 VAL 64 HG23 VAL 64 -10.876 0.798 -8.301 477 H VAL 65 H VAL 65 -6.487 -1.508 -7.263 478 HA VAL 65 HA VAL 65 -7.035 -4.255 -6.408 479 HB VAL 65 HB VAL 65 -4.905 -4.972 -7.511 480 HG11 VAL 65 HG11 VAL 65 -7.075 -5.557 -8.497 481 HG12 VAL 65 HG12 VAL 65 -5.887 -5.254 -9.762 482 HG13 VAL 65 HG13 VAL 65 -7.097 -4.030 -9.377 483 HG21 VAL 65 HG21 VAL 65 -5.232 -2.397 -9.017 484 HG22 VAL 65 HG22 VAL 65 -4.070 -3.667 -9.395 485 HG23 VAL 65 HG23 VAL 65 -3.935 -2.769 -7.875 486 H ILE 66 H ILE 66 -5.363 -5.147 -5.178 487 HA ILE 66 HA ILE 66 -3.934 -3.131 -3.582 488 HB ILE 66 HB ILE 66 -5.024 -5.841 -2.754 489 HG12 ILE 66 HG12 ILE 66 -5.927 -3.069 -1.949 490 HG13 ILE 66 HG13 ILE 66 -6.788 -4.126 -3.059 491 HG21 ILE 66 HG21 ILE 66 -2.960 -5.297 -1.589 492 HG22 ILE 66 HG22 ILE 66 -4.341 -5.229 -0.493 493 HG23 ILE 66 HG23 ILE 66 -3.630 -3.736 -1.106 494 HD11 ILE 66 HD11 ILE 66 -7.119 -5.731 -1.230 495 HD12 ILE 66 HD12 ILE 66 -7.813 -4.153 -0.865 496 HD13 ILE 66 HD13 ILE 66 -6.283 -4.635 -0.133 497 HA PRO 67 HA PRO 67 -0.289 -5.410 -5.050 498 HB2 PRO 67 HB2 PRO 67 0.839 -4.265 -2.540 499 HB3 PRO 67 HB3 PRO 67 1.490 -4.212 -4.184 500 HG2 PRO 67 HG2 PRO 67 0.404 -2.043 -3.128 501 HG3 PRO 67 HG3 PRO 67 0.086 -2.468 -4.820 502 HD2 PRO 67 HD2 PRO 67 -1.668 -2.827 -2.421 503 HD3 PRO 67 HD3 PRO 67 -2.090 -2.304 -4.070 504 H GLN 68 H GLN 68 0.006 -7.550 -4.652 505 HA GLN 68 HA GLN 68 -1.151 -8.887 -2.512 506 HB2 GLN 68 HB2 GLN 68 -0.864 -9.912 -4.607 507 HB3 GLN 68 HB3 GLN 68 0.860 -9.626 -4.585 508 HG2 GLN 68 HG2 GLN 68 1.216 -11.332 -2.994 509 HG3 GLN 68 HG3 GLN 68 -0.507 -11.458 -2.644 510 HE21 GLN 68 HE21 GLN 68 -1.348 -11.306 -5.462 511 HE22 GLN 68 HE22 GLN 68 -0.905 -12.812 -6.114 512 H VAL 69 H VAL 69 1.928 -7.456 -2.823 513 HA VAL 69 HA VAL 69 3.300 -8.907 -0.817 514 HB VAL 69 HB VAL 69 4.946 -7.057 -0.897 515 HG11 VAL 69 HG11 VAL 69 4.005 -8.051 -3.590 516 HG12 VAL 69 HG12 VAL 69 5.105 -8.896 -2.499 517 HG13 VAL 69 HG13 VAL 69 5.599 -7.377 -3.250 518 HG21 VAL 69 HG21 VAL 69 4.610 -5.235 -2.535 519 HG22 VAL 69 HG22 VAL 69 3.412 -5.208 -1.237 520 HG23 VAL 69 HG23 VAL 69 2.973 -5.831 -2.826 521 H PHE 70 H PHE 70 0.719 -6.833 -0.459 522 HA PHE 70 HA PHE 70 1.509 -5.715 2.095 523 HB2 PHE 70 HB2 PHE 70 -0.922 -5.498 0.346 524 HB3 PHE 70 HB3 PHE 70 -1.077 -5.116 2.054 525 HD1 PHE 70 HD1 PHE 70 1.514 -4.366 -0.559 526 HD2 PHE 70 HD2 PHE 70 -1.136 -2.867 2.405 527 HE1 PHE 70 HE1 PHE 70 2.349 -2.085 -0.955 528 HE2 PHE 70 HE2 PHE 70 -0.301 -0.609 2.041 529 HZ PHE 70 HZ PHE 70 1.423 -0.191 0.361 530 H PHE 71 H PHE 71 0.670 -8.646 1.059 531 HA PHE 71 HA PHE 71 -0.691 -9.385 3.550 532 HB2 PHE 71 HB2 PHE 71 -0.923 -10.685 0.824 533 HB3 PHE 71 HB3 PHE 71 -1.657 -11.284 2.302 534 HD1 PHE 71 HD1 PHE 71 -1.745 -8.666 -0.251 535 HD2 PHE 71 HD2 PHE 71 -3.657 -10.310 3.168 536 HE1 PHE 71 HE1 PHE 71 -3.745 -7.349 -0.750 537 HE2 PHE 71 HE2 PHE 71 -5.671 -8.986 2.679 538 HZ PHE 71 HZ PHE 71 -5.717 -7.500 0.718 539 H THR 72 H THR 72 -0.195 -11.589 4.171 540 HA THR 72 HA THR 72 2.626 -12.184 3.737 541 HB THR 72 HB THR 72 2.311 -13.777 5.634 542 HG1 THR 72 HG1 THR 72 -0.244 -12.615 5.893 543 HG21 THR 72 HG21 THR 72 2.984 -11.459 6.144 544 HG22 THR 72 HG22 THR 72 1.934 -12.103 7.405 545 HG23 THR 72 HG23 THR 72 1.288 -10.986 6.207 546 H ASN 73 H ASN 73 3.199 -14.463 3.355 547 HA ASN 73 HA ASN 73 1.717 -15.659 1.257 548 HB2 ASN 73 HB2 ASN 73 3.262 -17.549 1.375 549 HB3 ASN 73 HB3 ASN 73 4.163 -16.049 1.513 550 HD21 ASN 73 HD21 ASN 73 4.683 -18.847 2.378 551 HD22 ASN 73 HD22 ASN 73 5.097 -18.753 4.042 552 H SER 74 H SER 74 1.346 -15.772 4.599 553 HA SER 74 HA SER 74 0.106 -18.332 4.847 554 HB2 SER 74 HB2 SER 74 -0.016 -15.974 6.720 555 HB3 SER 74 HB3 SER 74 -0.177 -17.688 7.123 556 HG SER 74 HG SER 74 2.049 -17.796 6.132 557 H GLY 75 H GLY 75 -0.891 -15.341 3.553 558 HA2 GLY 75 HA2 GLY 75 -2.961 -14.918 2.583 559 HA3 GLY 75 HA3 GLY 75 -3.653 -16.231 3.525 560 H GLN 76 H GLN 76 -1.749 -14.136 5.336 561 HA GLN 76 HA GLN 76 -4.168 -12.879 6.465 562 HB2 GLN 76 HB2 GLN 76 -1.456 -13.262 7.747 563 HB3 GLN 76 HB3 GLN 76 -2.868 -12.563 8.511 564 HG2 GLN 76 HG2 GLN 76 -4.002 -14.738 8.300 565 HG3 GLN 76 HG3 GLN 76 -2.513 -15.424 7.641 566 HE21 GLN 76 HE21 GLN 76 -4.092 -14.197 10.437 567 HE22 GLN 76 HE22 GLN 76 -2.923 -14.702 11.603 568 H VAL 77 H VAL 77 -4.047 -10.656 6.988 569 HA VAL 77 HA VAL 77 -2.356 -9.038 5.357 570 HB VAL 77 HB VAL 77 -4.296 -8.415 7.627 571 HG11 VAL 77 HG11 VAL 77 -2.496 -6.730 7.704 572 HG12 VAL 77 HG12 VAL 77 -4.020 -6.034 7.154 573 HG13 VAL 77 HG13 VAL 77 -2.746 -6.413 5.987 574 HG21 VAL 77 HG21 VAL 77 -5.585 -7.362 5.868 575 HG22 VAL 77 HG22 VAL 77 -5.243 -9.054 5.464 576 HG23 VAL 77 HG23 VAL 77 -4.307 -7.746 4.718 577 H VAL 78 H VAL 78 -0.460 -7.973 5.969 578 HA VAL 78 HA VAL 78 1.062 -9.058 8.105 579 HB VAL 78 HB VAL 78 1.478 -6.392 6.714 580 HG11 VAL 78 HG11 VAL 78 2.835 -6.642 8.701 581 HG12 VAL 78 HG12 VAL 78 3.851 -6.711 7.262 582 HG13 VAL 78 HG13 VAL 78 3.435 -8.194 8.121 583 HG21 VAL 78 HG21 VAL 78 1.305 -8.136 5.030 584 HG22 VAL 78 HG22 VAL 78 2.508 -9.105 5.885 585 HG23 VAL 78 HG23 VAL 78 2.968 -7.566 5.153 586 H LYS 79 H LYS 79 1.081 -8.500 10.207 587 HA LYS 79 HA LYS 79 -0.935 -6.819 11.220 588 HB2 LYS 79 HB2 LYS 79 0.159 -7.084 13.437 589 HB3 LYS 79 HB3 LYS 79 -0.170 -8.593 12.587 590 HG2 LYS 79 HG2 LYS 79 2.026 -8.846 11.964 591 HG3 LYS 79 HG3 LYS 79 2.444 -7.206 12.474 592 HD2 LYS 79 HD2 LYS 79 2.068 -7.801 14.801 593 HD3 LYS 79 HD3 LYS 79 1.517 -9.409 14.328 594 HE2 LYS 79 HE2 LYS 79 4.274 -8.361 13.745 595 HE3 LYS 79 HE3 LYS 79 3.880 -9.282 15.193 596 HZ1 LYS 79 HZ1 LYS 79 3.212 -11.120 13.823 597 HZ2 LYS 79 HZ2 LYS 79 4.779 -10.684 13.427 598 HZ3 LYS 79 HZ3 LYS 79 3.505 -10.276 12.406 599 H SER 80 H SER 80 2.339 -6.172 10.395 600 HA SER 80 HA SER 80 2.594 -3.691 11.760 601 HB2 SER 80 HB2 SER 80 4.158 -4.694 9.394 602 HB3 SER 80 HB3 SER 80 4.712 -3.632 10.698 603 HG SER 80 HG SER 80 4.692 -5.315 12.098 604 H LEU 81 H LEU 81 0.746 -4.592 9.089 605 HA LEU 81 HA LEU 81 1.363 -2.609 7.197 606 HB2 LEU 81 HB2 LEU 81 0.065 -4.823 6.927 607 HB3 LEU 81 HB3 LEU 81 -1.329 -3.898 7.427 608 HG LEU 81 HG LEU 81 -0.762 -2.322 5.505 609 HD11 LEU 81 HD11 LEU 81 1.520 -3.203 5.146 610 HD12 LEU 81 HD12 LEU 81 0.502 -3.345 3.703 611 HD13 LEU 81 HD13 LEU 81 0.790 -4.757 4.711 612 HD21 LEU 81 HD21 LEU 81 -2.633 -3.929 5.579 613 HD22 LEU 81 HD22 LEU 81 -1.572 -5.146 4.880 614 HD23 LEU 81 HD23 LEU 81 -1.994 -3.700 3.954 615 HA PRO 82 HA PRO 82 -2.477 -0.097 8.843 616 HB2 PRO 82 HB2 PRO 82 -3.208 -0.622 11.459 617 HB3 PRO 82 HB3 PRO 82 -4.067 -1.249 10.052 618 HG2 PRO 82 HG2 PRO 82 -2.012 -2.570 11.768 619 HG3 PRO 82 HG3 PRO 82 -3.500 -3.253 11.087 620 HD2 PRO 82 HD2 PRO 82 -1.116 -3.771 10.008 621 HD3 PRO 82 HD3 PRO 82 -2.558 -3.526 8.996 622 H GLY 83 H GLY 83 0.014 -1.269 10.967 623 HA2 GLY 83 HA2 GLY 83 0.317 1.003 12.629 624 HA3 GLY 83 HA3 GLY 83 1.527 -0.244 12.356 625 H LEU 84 H LEU 84 1.990 0.019 9.656 626 HA LEU 84 HA LEU 84 3.660 2.299 9.654 627 HB2 LEU 84 HB2 LEU 84 4.406 1.633 7.469 628 HB3 LEU 84 HB3 LEU 84 4.205 0.187 8.422 629 HG LEU 84 HG LEU 84 1.843 0.176 7.160 630 HD11 LEU 84 HD11 LEU 84 2.080 0.865 4.833 631 HD12 LEU 84 HD12 LEU 84 3.638 1.588 5.211 632 HD13 LEU 84 HD13 LEU 84 2.172 2.226 5.944 633 HD21 LEU 84 HD21 LEU 84 4.441 -0.784 5.965 634 HD22 LEU 84 HD22 LEU 84 2.832 -1.358 5.528 635 HD23 LEU 84 HD23 LEU 84 3.461 -1.649 7.151 636 H LEU 85 H LEU 85 0.578 1.556 8.181 637 HA LEU 85 HA LEU 85 0.339 3.900 6.683 638 HB2 LEU 85 HB2 LEU 85 -1.798 2.171 7.921 639 HB3 LEU 85 HB3 LEU 85 -2.118 3.461 6.780 640 HG LEU 85 HG LEU 85 -0.479 0.997 6.170 641 HD11 LEU 85 HD11 LEU 85 -3.303 1.718 5.420 642 HD12 LEU 85 HD12 LEU 85 -2.809 0.443 6.533 643 HD13 LEU 85 HD13 LEU 85 -2.406 0.323 4.819 644 HD21 LEU 85 HD21 LEU 85 -0.686 1.747 3.841 645 HD22 LEU 85 HD22 LEU 85 0.176 2.929 4.822 646 HD23 LEU 85 HD23 LEU 85 -1.507 3.206 4.386 647 H THR 86 H THR 86 -0.372 3.191 9.995 648 HA THR 86 HA THR 86 -1.876 5.473 10.659 649 HB THR 86 HB THR 86 0.021 3.942 12.483 650 HG1 THR 86 HG1 THR 86 -1.888 2.873 11.376 651 HG21 THR 86 HG21 THR 86 -1.371 4.813 14.326 652 HG22 THR 86 HG22 THR 86 -2.289 5.774 13.166 653 HG23 THR 86 HG23 THR 86 -0.581 6.116 13.440 654 H ILE 87 H ILE 87 1.693 5.062 10.788 655 HA ILE 87 HA ILE 87 2.012 7.676 11.794 656 HB ILE 87 HB ILE 87 3.707 6.055 12.355 657 HG12 ILE 87 HG12 ILE 87 4.479 8.466 12.044 658 HG13 ILE 87 HG13 ILE 87 5.733 7.242 12.100 659 HG21 ILE 87 HG21 ILE 87 4.364 5.744 9.473 660 HG22 ILE 87 HG22 ILE 87 3.635 4.551 10.545 661 HG23 ILE 87 HG23 ILE 87 5.302 5.077 10.803 662 HD11 ILE 87 HD11 ILE 87 4.666 8.567 9.614 663 HD12 ILE 87 HD12 ILE 87 5.962 7.372 9.663 664 HD13 ILE 87 HD13 ILE 87 6.192 8.959 10.410 665 H LEU 88 H LEU 88 2.168 6.398 8.524 666 HA LEU 88 HA LEU 88 2.968 8.878 7.403 667 HB2 LEU 88 HB2 LEU 88 1.733 6.461 6.182 668 HB3 LEU 88 HB3 LEU 88 1.958 7.908 5.241 669 HG LEU 88 HG LEU 88 3.711 6.528 4.702 670 HD11 LEU 88 HD11 LEU 88 5.729 7.674 5.417 671 HD12 LEU 88 HD12 LEU 88 4.851 8.423 6.738 672 HD13 LEU 88 HD13 LEU 88 4.430 8.818 5.071 673 HD21 LEU 88 HD21 LEU 88 5.210 5.447 6.307 674 HD22 LEU 88 HD22 LEU 88 3.537 4.913 6.485 675 HD23 LEU 88 HD23 LEU 88 4.212 6.089 7.614 676 H HIS 89 H HIS 89 -0.184 7.498 7.998 677 HA HIS 89 HA HIS 89 -1.611 9.525 6.626 678 HB2 HIS 89 HB2 HIS 89 -2.476 7.628 8.813 679 HB3 HIS 89 HB3 HIS 89 -3.601 8.719 8.029 680 HD1 HIS 89 HD1 HIS 89 -4.016 5.639 7.826 681 HD2 HIS 89 HD2 HIS 89 -1.928 7.901 5.029 682 HE1 HIS 89 HE1 HIS 89 -4.048 4.323 5.686 683 H ASP 90 H ASP 90 -0.393 9.214 9.867 684 HA ASP 90 HA ASP 90 -1.597 11.531 10.909 685 HB2 ASP 90 HB2 ASP 90 -0.644 9.791 12.357 686 HB3 ASP 90 HB3 ASP 90 0.962 10.128 11.733 687 H GLY 91 H GLY 91 1.140 10.998 8.889 688 HA2 GLY 91 HA2 GLY 91 2.156 13.705 9.199 689 HA3 GLY 91 HA3 GLY 91 2.840 12.444 8.181 690 H GLY 92 H GLY 92 -0.326 12.322 7.507 691 HA2 GLY 92 HA2 GLY 92 -1.754 13.370 6.009 692 HA3 GLY 92 HA3 GLY 92 -0.569 14.653 5.824 693 H TYR 93 H TYR 93 0.140 11.262 5.370 694 HA TYR 93 HA TYR 93 0.872 11.791 2.612 695 HB2 TYR 93 HB2 TYR 93 1.465 9.672 4.598 696 HB3 TYR 93 HB3 TYR 93 1.547 9.237 2.895 697 HD1 TYR 93 HD1 TYR 93 2.777 11.982 5.177 698 HD2 TYR 93 HD2 TYR 93 3.560 9.397 1.900 699 HE1 TYR 93 HE1 TYR 93 5.068 12.904 4.987 700 HE2 TYR 93 HE2 TYR 93 5.812 10.291 1.697 701 HH TYR 93 HH TYR 93 7.248 12.384 4.024 702 H ARG 94 H ARG 94 0.248 10.381 0.923 703 HA ARG 94 HA ARG 94 -2.398 9.150 1.335 704 HB2 ARG 94 HB2 ARG 94 -2.883 9.472 -1.032 705 HB3 ARG 94 HB3 ARG 94 -2.426 11.008 -0.316 706 HG2 ARG 94 HG2 ARG 94 -0.242 10.868 -1.285 707 HG3 ARG 94 HG3 ARG 94 -0.572 9.246 -1.898 708 HD2 ARG 94 HD2 ARG 94 -1.976 11.790 -2.719 709 HD3 ARG 94 HD3 ARG 94 -0.749 10.941 -3.659 710 HE ARG 94 HE ARG 94 -3.091 9.389 -2.956 711 HH11 ARG 94 HH11 ARG 94 -1.413 11.216 -5.547 712 HH12 ARG 94 HH12 ARG 94 -2.584 10.788 -6.715 713 HH21 ARG 94 HH21 ARG 94 -4.635 8.881 -4.605 714 HH22 ARG 94 HH22 ARG 94 -4.405 9.470 -6.196 715 H ASP 95 H ASP 95 -2.799 7.410 -0.409 716 HA ASP 95 HA ASP 95 -1.478 5.083 0.307 717 HB2 ASP 95 HB2 ASP 95 -2.753 4.096 -1.579 718 HB3 ASP 95 HB3 ASP 95 -3.753 5.162 -0.600 719 H THR 96 H THR 96 -1.177 6.984 -2.624 720 HA THR 96 HA THR 96 0.546 5.366 -4.054 721 HB THR 96 HB THR 96 0.229 8.369 -4.128 722 HG1 THR 96 HG1 THR 96 -1.522 6.351 -4.659 723 HG21 THR 96 HG21 THR 96 2.149 7.450 -5.435 724 HG22 THR 96 HG22 THR 96 0.912 8.179 -6.466 725 HG23 THR 96 HG23 THR 96 1.016 6.425 -6.310 726 H GLU 97 H GLU 97 1.141 7.940 -1.744 727 HA GLU 97 HA GLU 97 3.925 8.160 -2.211 728 HB2 GLU 97 HB2 GLU 97 2.330 8.968 0.193 729 HB3 GLU 97 HB3 GLU 97 3.969 9.487 -0.200 730 HG2 GLU 97 HG2 GLU 97 3.124 10.512 -2.246 731 HG3 GLU 97 HG3 GLU 97 1.494 10.042 -1.782 732 H ILE 98 H ILE 98 1.946 6.265 -0.030 733 HA ILE 98 HA ILE 98 3.955 5.417 1.764 734 HB ILE 98 HB ILE 98 1.737 3.582 0.852 735 HG12 ILE 98 HG12 ILE 98 0.546 5.661 1.262 736 HG13 ILE 98 HG13 ILE 98 0.272 4.545 2.595 737 HG21 ILE 98 HG21 ILE 98 3.043 4.007 3.520 738 HG22 ILE 98 HG22 ILE 98 3.361 2.688 2.396 739 HG23 ILE 98 HG23 ILE 98 1.781 2.829 3.173 740 HD11 ILE 98 HD11 ILE 98 1.832 5.750 3.961 741 HD12 ILE 98 HD12 ILE 98 0.574 6.821 3.356 742 HD13 ILE 98 HD13 ILE 98 2.181 6.857 2.629 743 H MET 99 H MET 99 2.671 4.081 -1.213 744 HA MET 99 HA MET 99 4.376 1.814 -1.215 745 HB2 MET 99 HB2 MET 99 2.742 2.962 -3.466 746 HB3 MET 99 HB3 MET 99 3.480 1.366 -3.438 747 HG2 MET 99 HG2 MET 99 2.078 0.809 -1.487 748 HG3 MET 99 HG3 MET 99 1.293 2.377 -1.644 749 HE1 MET 99 HE1 MET 99 -0.441 -0.125 -1.513 750 HE2 MET 99 HE2 MET 99 -1.542 0.088 -2.875 751 HE3 MET 99 HE3 MET 99 -1.103 1.470 -1.869 752 H ARG 100 H ARG 100 4.746 5.064 -2.259 753 HA ARG 100 HA ARG 100 6.435 4.803 -4.475 754 HB2 ARG 100 HB2 ARG 100 5.304 6.885 -3.616 755 HB3 ARG 100 HB3 ARG 100 6.539 6.967 -2.378 756 HG2 ARG 100 HG2 ARG 100 8.247 7.195 -4.120 757 HG3 ARG 100 HG3 ARG 100 6.981 7.149 -5.348 758 HD2 ARG 100 HD2 ARG 100 5.915 9.104 -4.247 759 HD3 ARG 100 HD3 ARG 100 7.300 9.210 -3.173 760 HE ARG 100 HE ARG 100 8.401 9.268 -5.634 761 HH11 ARG 100 HH11 ARG 100 6.060 11.250 -3.861 762 HH12 ARG 100 HH12 ARG 100 6.160 12.585 -4.902 763 HH21 ARG 100 HH21 ARG 100 8.578 11.188 -7.091 764 HH22 ARG 100 HH22 ARG 100 7.573 12.524 -6.759 765 H TRP 101 H TRP 101 7.464 5.596 -1.152 766 HA TRP 101 HA TRP 101 10.091 4.759 -1.741 767 HB2 TRP 101 HB2 TRP 101 10.454 5.003 0.814 768 HB3 TRP 101 HB3 TRP 101 10.124 6.435 -0.141 769 HD1 TRP 101 HD1 TRP 101 8.026 7.825 0.461 770 HE1 TRP 101 HE1 TRP 101 6.243 7.664 2.292 771 HE3 TRP 101 HE3 TRP 101 9.097 3.155 2.262 772 HZ2 TRP 101 HZ2 TRP 101 5.418 5.825 4.226 773 HZ3 TRP 101 HZ3 TRP 101 7.758 2.276 4.080 774 HH2 TRP 101 HH2 TRP 101 5.948 3.583 5.066 775 H LEU 102 H LEU 102 7.374 3.077 -0.399 776 HA LEU 102 HA LEU 102 8.683 0.929 0.818 777 HB2 LEU 102 HB2 LEU 102 6.037 1.354 -0.343 778 HB3 LEU 102 HB3 LEU 102 6.484 -0.324 -0.060 779 HG LEU 102 HG LEU 102 6.262 1.899 1.980 780 HD11 LEU 102 HD11 LEU 102 4.343 0.639 2.764 781 HD12 LEU 102 HD12 LEU 102 4.553 -0.527 1.452 782 HD13 LEU 102 HD13 LEU 102 4.122 1.151 1.092 783 HD21 LEU 102 HD21 LEU 102 7.917 0.412 2.727 784 HD22 LEU 102 HD22 LEU 102 6.974 -1.004 2.221 785 HD23 LEU 102 HD23 LEU 102 6.428 -0.010 3.575 786 H PHE 103 H PHE 103 7.809 1.323 -2.587 787 HA PHE 103 HA PHE 103 8.773 -1.356 -3.098 788 HB2 PHE 103 HB2 PHE 103 7.391 0.654 -4.837 789 HB3 PHE 103 HB3 PHE 103 8.103 -0.812 -5.502 790 HD1 PHE 103 HD1 PHE 103 5.630 0.382 -2.978 791 HD2 PHE 103 HD2 PHE 103 6.946 -2.810 -5.460 792 HE1 PHE 103 HE1 PHE 103 3.588 -0.870 -2.446 793 HE2 PHE 103 HE2 PHE 103 4.907 -4.065 -4.918 794 HZ PHE 103 HZ PHE 103 3.228 -3.093 -3.416 795 H THR 104 H THR 104 10.066 1.710 -3.127 796 HA THR 104 HA THR 104 12.031 1.098 -5.153 797 HB THR 104 HB THR 104 11.784 3.522 -3.349 798 HG1 THR 104 HG1 THR 104 10.022 3.669 -4.564 799 HG21 THR 104 HG21 THR 104 14.025 3.239 -4.374 800 HG22 THR 104 HG22 THR 104 13.179 4.628 -5.059 801 HG23 THR 104 HG23 THR 104 13.273 3.115 -5.963 802 HA PRO 105 HA PRO 105 14.715 -0.902 -2.057 803 HB2 PRO 105 HB2 PRO 105 16.659 -0.400 -4.260 804 HB3 PRO 105 HB3 PRO 105 16.357 -1.889 -3.355 805 HG2 PRO 105 HG2 PRO 105 15.463 -1.643 -5.829 806 HG3 PRO 105 HG3 PRO 105 14.452 -2.401 -4.583 807 HD2 PRO 105 HD2 PRO 105 14.265 0.343 -5.762 808 HD3 PRO 105 HD3 PRO 105 12.973 -0.785 -5.292 809 H ASP 106 H ASP 106 15.801 0.087 -0.497 810 HA ASP 106 HA ASP 106 16.660 2.841 -0.965 811 HB2 ASP 106 HB2 ASP 106 15.115 2.340 0.947 812 HB3 ASP 106 HB3 ASP 106 16.398 1.390 1.670 813 HA PRO 107 HA PRO 107 20.873 1.478 -1.315 814 HB2 PRO 107 HB2 PRO 107 22.036 3.908 -0.724 815 HB3 PRO 107 HB3 PRO 107 21.446 3.436 -2.317 816 HG2 PRO 107 HG2 PRO 107 20.131 5.105 -0.218 817 HG3 PRO 107 HG3 PRO 107 20.146 5.325 -1.977 818 HD2 PRO 107 HD2 PRO 107 18.022 4.329 -0.703 819 HD3 PRO 107 HD3 PRO 107 18.495 3.725 -2.306 820 H SER 108 H SER 108 19.616 2.891 1.611 821 HA SER 108 HA SER 108 22.059 2.041 2.974 822 HB2 SER 108 HB2 SER 108 21.277 3.663 4.791 823 HB3 SER 108 HB3 SER 108 21.895 4.354 3.292 824 HG SER 108 HG SER 108 19.202 3.968 3.096 825 H LEU 109 H LEU 109 19.231 0.795 2.319 826 HA LEU 109 HA LEU 109 18.652 -0.081 5.032 827 HB2 LEU 109 HB2 LEU 109 16.811 0.865 3.747 828 HB3 LEU 109 HB3 LEU 109 17.085 -0.320 2.482 829 HG LEU 109 HG LEU 109 16.342 -2.107 3.949 830 HD11 LEU 109 HD11 LEU 109 15.902 0.061 5.985 831 HD12 LEU 109 HD12 LEU 109 17.128 -1.211 6.059 832 HD13 LEU 109 HD13 LEU 109 15.416 -1.630 6.132 833 HD21 LEU 109 HD21 LEU 109 14.482 0.250 3.904 834 HD22 LEU 109 HD22 LEU 109 14.012 -1.426 4.189 835 HD23 LEU 109 HD23 LEU 109 14.687 -0.954 2.627 836 H THR 110 H THR 110 19.045 -2.096 5.641 837 HA THR 110 HA THR 110 19.903 -4.034 3.617 838 HB THR 110 HB THR 110 20.834 -3.874 6.498 839 HG1 THR 110 HG1 THR 110 21.421 -2.367 4.379 840 HG21 THR 110 HG21 THR 110 21.899 -5.334 4.067 841 HG22 THR 110 HG22 THR 110 21.042 -6.071 5.420 842 HG23 THR 110 HG23 THR 110 22.636 -5.341 5.669 843 H ILE 111 H ILE 111 18.656 -5.800 3.521 844 HA ILE 111 HA ILE 111 16.818 -6.433 5.747 845 HB ILE 111 HB ILE 111 16.200 -6.398 2.788 846 HG12 ILE 111 HG12 ILE 111 15.195 -4.562 4.979 847 HG13 ILE 111 HG13 ILE 111 16.309 -4.147 3.686 848 HG21 ILE 111 HG21 ILE 111 14.335 -7.029 5.070 849 HG22 ILE 111 HG22 ILE 111 15.061 -8.189 3.972 850 HG23 ILE 111 HG23 ILE 111 13.923 -6.975 3.341 851 HD11 ILE 111 HD11 ILE 111 13.444 -4.974 3.307 852 HD12 ILE 111 HD12 ILE 111 14.556 -4.481 2.037 853 HD13 ILE 111 HD13 ILE 111 14.052 -3.322 3.261 854 H THR 112 H THR 112 16.286 -8.643 5.798 855 HA THR 112 HA THR 112 17.684 -10.374 3.909 856 HB THR 112 HB THR 112 16.906 -11.027 6.724 857 HG1 THR 112 HG1 THR 112 18.676 -9.669 6.855 858 HG21 THR 112 HG21 THR 112 16.891 -12.832 5.207 859 HG22 THR 112 HG22 THR 112 18.237 -13.067 6.345 860 HG23 THR 112 HG23 THR 112 18.537 -12.475 4.687 861 H ARG 113 H ARG 113 16.303 -11.607 2.821 862 HA ARG 113 HA ARG 113 13.551 -11.908 3.788 863 HB2 ARG 113 HB2 ARG 113 13.327 -10.155 2.201 864 HB3 ARG 113 HB3 ARG 113 14.378 -10.964 1.045 865 HG2 ARG 113 HG2 ARG 113 12.680 -12.755 0.809 866 HG3 ARG 113 HG3 ARG 113 11.613 -11.846 1.875 867 HD2 ARG 113 HD2 ARG 113 11.413 -10.100 0.326 868 HD3 ARG 113 HD3 ARG 113 12.754 -10.714 -0.650 869 HE ARG 113 HE ARG 113 10.792 -12.692 -0.517 870 HH11 ARG 113 HH11 ARG 113 10.984 -9.421 -1.798 871 HH12 ARG 113 HH12 ARG 113 10.135 -9.782 -3.234 872 HH21 ARG 113 HH21 ARG 113 9.585 -13.173 -2.447 873 HH22 ARG 113 HH22 ARG 113 9.312 -11.957 -3.614 874 H ASP 114 H ASP 114 12.698 -13.793 3.547 875 HA ASP 114 HA ASP 114 12.416 -15.986 3.256 876 HB2 ASP 114 HB2 ASP 114 11.602 -15.244 1.110 877 HB3 ASP 114 HB3 ASP 114 13.224 -15.314 0.430 878 H GLY 115 H GLY 115 13.941 -16.832 4.619 879 HA2 GLY 115 HA2 GLY 115 15.452 -18.491 4.902 880 HA3 GLY 115 HA3 GLY 115 15.940 -18.326 3.215 881 H SER 116 H SER 116 17.085 -18.080 6.052 882 HA SER 116 HA SER 116 18.457 -15.603 5.966 883 HB2 SER 116 HB2 SER 116 19.275 -18.117 7.418 884 HB3 SER 116 HB3 SER 116 19.749 -16.457 7.789 885 HG SER 116 HG SER 116 17.662 -17.782 8.681 886 H ARG 117 H ARG 117 19.132 -15.602 3.833 887 HA ARG 117 HA ARG 117 21.097 -17.475 2.800 888 HB2 ARG 117 HB2 ARG 117 20.497 -14.728 1.684 889 HB3 ARG 117 HB3 ARG 117 21.086 -16.140 0.823 890 HG2 ARG 117 HG2 ARG 117 18.311 -15.783 1.948 891 HG3 ARG 117 HG3 ARG 117 18.772 -15.635 0.256 892 HD2 ARG 117 HD2 ARG 117 19.373 -17.980 0.189 893 HD3 ARG 117 HD3 ARG 117 19.072 -18.107 1.927 894 HE ARG 117 HE ARG 117 16.736 -17.174 0.868 895 HH11 ARG 117 HH11 ARG 117 18.690 -20.074 0.320 896 HH12 ARG 117 HH12 ARG 117 17.348 -21.091 0.065 897 HH21 ARG 117 HH21 ARG 117 14.870 -18.562 0.451 898 HH22 ARG 117 HH22 ARG 117 15.153 -20.207 0.139 899 H ASP 118 H ASP 118 20.909 -14.120 3.734 900 HA ASP 118 HA ASP 118 23.122 -13.720 5.220 901 HB2 ASP 118 HB2 ASP 118 24.276 -14.260 2.907 902 HB3 ASP 118 HB3 ASP 118 23.605 -12.727 2.379 903 H ALA 119 H ALA 119 23.504 -11.077 4.745 904 HA ALA 119 HA ALA 119 20.783 -10.040 4.764 905 HB1 ALA 119 HB1 ALA 119 22.250 -9.369 6.613 906 HB2 ALA 119 HB2 ALA 119 21.829 -7.975 5.621 907 HB3 ALA 119 HB3 ALA 119 23.417 -8.718 5.465 908 H VAL 120 H VAL 120 20.066 -8.579 3.231 909 HA VAL 120 HA VAL 120 21.797 -8.270 0.889 910 HB VAL 120 HB VAL 120 18.765 -8.214 1.029 911 HG11 VAL 120 HG11 VAL 120 19.626 -6.861 -0.794 912 HG12 VAL 120 HG12 VAL 120 18.847 -8.312 -1.423 913 HG13 VAL 120 HG13 VAL 120 20.606 -8.212 -1.359 914 HG21 VAL 120 HG21 VAL 120 20.592 -10.403 0.037 915 HG22 VAL 120 HG22 VAL 120 18.835 -10.389 -0.122 916 HG23 VAL 120 HG23 VAL 120 19.578 -10.462 1.476 917 H SER 121 H SER 121 22.521 -6.294 0.652 918 HA SER 121 HA SER 121 21.235 -4.037 1.952 919 HB2 SER 121 HB2 SER 121 23.703 -4.117 0.199 920 HB3 SER 121 HB3 SER 121 23.233 -2.843 1.328 921 HG SER 121 HG SER 121 24.433 -5.277 1.764 922 H ASN 122 H ASN 122 20.238 -2.426 0.950 923 HA ASN 122 HA ASN 122 19.082 -1.302 -0.543 924 HB2 ASN 122 HB2 ASN 122 21.180 -0.981 -1.797 925 HB3 ASN 122 HB3 ASN 122 20.950 -2.518 -2.612 926 HD21 ASN 122 HD21 ASN 122 19.603 -2.604 -4.368 927 HD22 ASN 122 HD22 ASN 122 18.872 -1.214 -5.084 928 H ALA 123 H ALA 123 17.523 -2.837 0.310 929 HA ALA 123 HA ALA 123 16.223 -4.159 -1.960 930 HB1 ALA 123 HB1 ALA 123 16.902 -5.849 -0.347 931 HB2 ALA 123 HB2 ALA 123 15.147 -5.656 -0.248 932 HB3 ALA 123 HB3 ALA 123 16.195 -4.923 0.969 933 H ARG 124 H ARG 124 13.687 -4.282 -1.310 934 HA ARG 124 HA ARG 124 13.076 -1.491 -0.784 935 HB2 ARG 124 HB2 ARG 124 10.809 -1.984 -1.680 936 HB3 ARG 124 HB3 ARG 124 12.083 -2.315 -2.839 937 HG2 ARG 124 HG2 ARG 124 11.865 -4.637 -2.553 938 HG3 ARG 124 HG3 ARG 124 10.847 -4.448 -1.130 939 HD2 ARG 124 HD2 ARG 124 9.538 -5.095 -3.101 940 HD3 ARG 124 HD3 ARG 124 9.070 -3.514 -2.500 941 HE ARG 124 HE ARG 124 10.651 -2.725 -4.378 942 HH11 ARG 124 HH11 ARG 124 8.696 -5.686 -4.621 943 HH12 ARG 124 HH12 ARG 124 8.254 -5.445 -6.250 944 HH21 ARG 124 HH21 ARG 124 10.047 -2.373 -6.629 945 HH22 ARG 124 HH22 ARG 124 9.087 -3.522 -7.415 946 HA PRO 125 HA PRO 125 11.860 -2.083 3.404 947 HB2 PRO 125 HB2 PRO 125 9.608 -0.324 2.592 948 HB3 PRO 125 HB3 PRO 125 10.659 -0.193 4.018 949 HG2 PRO 125 HG2 PRO 125 11.046 1.407 1.954 950 HG3 PRO 125 HG3 PRO 125 12.437 0.652 2.754 951 HD2 PRO 125 HD2 PRO 125 11.163 -0.016 0.141 952 HD3 PRO 125 HD3 PRO 125 12.874 -0.075 0.624 953 H VAL 126 H VAL 126 9.544 -2.661 0.843 954 HA VAL 126 HA VAL 126 7.437 -3.770 2.348 955 HB VAL 126 HB VAL 126 8.323 -4.555 -0.449 956 HG11 VAL 126 HG11 VAL 126 6.034 -5.352 -0.743 957 HG12 VAL 126 HG12 VAL 126 5.691 -5.005 0.953 958 HG13 VAL 126 HG13 VAL 126 6.872 -6.249 0.526 959 HG21 VAL 126 HG21 VAL 126 7.792 -2.201 -0.271 960 HG22 VAL 126 HG22 VAL 126 6.233 -2.589 0.461 961 HG23 VAL 126 HG23 VAL 126 6.562 -3.050 -1.212 962 H ASP 127 H ASP 127 10.431 -5.175 1.136 963 HA ASP 127 HA ASP 127 9.834 -7.879 1.687 964 HB2 ASP 127 HB2 ASP 127 12.548 -6.520 1.623 965 HB3 ASP 127 HB3 ASP 127 12.286 -8.257 1.605 966 H ALA 128 H ALA 128 11.149 -5.285 3.545 967 HA ALA 128 HA ALA 128 12.021 -6.813 5.767 968 HB1 ALA 128 HB1 ALA 128 12.951 -4.606 5.310 969 HB2 ALA 128 HB2 ALA 128 12.255 -4.672 6.931 970 HB3 ALA 128 HB3 ALA 128 11.379 -3.877 5.626 971 H LEU 129 H LEU 129 9.008 -5.086 5.082 972 HA LEU 129 HA LEU 129 8.011 -5.421 7.730 973 HB2 LEU 129 HB2 LEU 129 5.848 -4.665 6.899 974 HB3 LEU 129 HB3 LEU 129 7.130 -3.625 6.338 975 HG LEU 129 HG LEU 129 6.974 -5.159 4.218 976 HD11 LEU 129 HD11 LEU 129 5.367 -6.677 5.124 977 HD12 LEU 129 HD12 LEU 129 4.685 -5.847 3.713 978 HD13 LEU 129 HD13 LEU 129 4.202 -5.373 5.351 979 HD21 LEU 129 HD21 LEU 129 5.395 -3.526 3.229 980 HD22 LEU 129 HD22 LEU 129 6.645 -2.754 4.206 981 HD23 LEU 129 HD23 LEU 129 5.016 -2.951 4.852 982 H HIS 130 H HIS 130 7.777 -7.397 4.869 983 HA HIS 130 HA HIS 130 5.932 -9.255 6.039 984 HB2 HIS 130 HB2 HIS 130 6.159 -8.981 3.567 985 HB3 HIS 130 HB3 HIS 130 7.796 -9.610 3.657 986 HD1 HIS 130 HD1 HIS 130 7.968 -12.135 3.164 987 HD2 HIS 130 HD2 HIS 130 4.193 -10.988 4.499 988 HE1 HIS 130 HE1 HIS 130 6.550 -14.194 3.086 989 H ALA 131 H ALA 131 9.245 -8.685 6.222 990 HA ALA 131 HA ALA 131 9.864 -11.409 7.126 991 HB1 ALA 131 HB1 ALA 131 11.343 -10.366 5.472 992 HB2 ALA 131 HB2 ALA 131 12.194 -10.811 6.952 993 HB3 ALA 131 HB3 ALA 131 11.765 -9.126 6.653 994 H HIS 132 H HIS 132 8.652 -8.862 8.635 995 HA HIS 132 HA HIS 132 8.493 -8.112 10.777 996 HB2 HIS 132 HB2 HIS 132 8.331 -10.551 11.377 997 HB3 HIS 132 HB3 HIS 132 10.077 -10.617 11.535 998 HD1 HIS 132 HD1 HIS 132 10.908 -10.326 13.882 999 HD2 HIS 132 HD2 HIS 132 7.151 -8.645 13.344 1000 HE1 HIS 132 HE1 HIS 132 10.179 -9.496 16.151 1001 H GLN 133 H GLN 133 10.403 -7.166 9.132 1002 HA GLN 133 HA GLN 133 12.438 -6.217 11.004 1003 HB2 GLN 133 HB2 GLN 133 12.589 -6.544 7.983 1004 HB3 GLN 133 HB3 GLN 133 13.869 -5.847 8.979 1005 HG2 GLN 133 HG2 GLN 133 14.222 -7.926 10.106 1006 HG3 GLN 133 HG3 GLN 133 12.795 -8.630 9.357 1007 HE21 GLN 133 HE21 GLN 133 13.924 -10.325 8.551 1008 HE22 GLN 133 HE22 GLN 133 14.958 -10.194 7.189 1009 H ALA 134 H ALA 134 9.756 -5.550 10.564 1010 HA ALA 134 HA ALA 134 9.111 -3.390 8.967 1011 HB1 ALA 134 HB1 ALA 134 7.933 -4.104 11.640 1012 HB2 ALA 134 HB2 ALA 134 7.479 -4.817 10.091 1013 HB3 ALA 134 HB3 ALA 134 7.179 -3.107 10.396 1014 H ARG 135 H ARG 135 10.780 -3.439 12.014 1015 HA ARG 135 HA ARG 135 10.428 -0.844 12.934 1016 HB2 ARG 135 HB2 ARG 135 12.896 -2.555 13.030 1017 HB3 ARG 135 HB3 ARG 135 12.700 -1.063 13.932 1018 HG2 ARG 135 HG2 ARG 135 10.865 -1.997 15.168 1019 HG3 ARG 135 HG3 ARG 135 10.920 -3.465 14.189 1020 HD2 ARG 135 HD2 ARG 135 12.008 -3.837 16.287 1021 HD3 ARG 135 HD3 ARG 135 13.175 -3.878 14.959 1022 HE ARG 135 HE ARG 135 12.816 -1.455 16.572 1023 HH11 ARG 135 HH11 ARG 135 14.989 -3.905 15.226 1024 HH12 ARG 135 HH12 ARG 135 16.383 -3.294 15.968 1025 HH21 ARG 135 HH21 ARG 135 14.747 -0.597 17.603 1026 HH22 ARG 135 HH22 ARG 135 16.251 -1.376 17.355 1027 H GLU 136 H GLU 136 12.677 -2.077 10.500 1028 HA GLU 136 HA GLU 136 14.047 0.375 10.066 1029 HB2 GLU 136 HB2 GLU 136 13.821 -2.138 8.418 1030 HB3 GLU 136 HB3 GLU 136 14.884 -0.788 8.032 1031 HG2 GLU 136 HG2 GLU 136 15.002 -2.315 10.617 1032 HG3 GLU 136 HG3 GLU 136 15.989 -2.696 9.208 1033 H VAL 137 H VAL 137 11.169 -1.048 8.851 1034 HA VAL 137 HA VAL 137 10.847 0.593 6.515 1035 HB VAL 137 HB VAL 137 8.710 -0.860 8.106 1036 HG11 VAL 137 HG11 VAL 137 8.715 0.062 5.236 1037 HG12 VAL 137 HG12 VAL 137 7.786 0.769 6.560 1038 HG13 VAL 137 HG13 VAL 137 7.438 -0.874 6.014 1039 HG21 VAL 137 HG21 VAL 137 10.331 -1.847 5.777 1040 HG22 VAL 137 HG22 VAL 137 8.995 -2.710 6.534 1041 HG23 VAL 137 HG23 VAL 137 10.472 -2.392 7.447 1042 H VAL 138 H VAL 138 9.478 0.508 9.757 1043 HA VAL 138 HA VAL 138 7.995 2.865 9.644 1044 HB VAL 138 HB VAL 138 9.318 1.622 12.087 1045 HG11 VAL 138 HG11 VAL 138 8.662 3.912 12.526 1046 HG12 VAL 138 HG12 VAL 138 7.565 2.808 13.367 1047 HG13 VAL 138 HG13 VAL 138 7.049 3.604 11.882 1048 HG21 VAL 138 HG21 VAL 138 6.534 1.259 10.975 1049 HG22 VAL 138 HG22 VAL 138 7.129 0.578 12.489 1050 HG23 VAL 138 HG23 VAL 138 7.823 0.058 10.955 1051 H ARG 139 H ARG 139 11.319 2.260 10.552 1052 HA ARG 139 HA ARG 139 12.118 4.787 11.321 1053 HB2 ARG 139 HB2 ARG 139 13.465 2.825 11.633 1054 HB3 ARG 139 HB3 ARG 139 13.585 2.581 9.905 1055 HG2 ARG 139 HG2 ARG 139 14.975 4.531 9.694 1056 HG3 ARG 139 HG3 ARG 139 14.793 4.894 11.412 1057 HD2 ARG 139 HD2 ARG 139 15.816 2.759 11.975 1058 HD3 ARG 139 HD3 ARG 139 15.969 2.370 10.266 1059 HE ARG 139 HE ARG 139 17.231 4.812 10.993 1060 HH11 ARG 139 HH11 ARG 139 17.618 1.281 10.907 1061 HH12 ARG 139 HH12 ARG 139 19.312 1.323 10.830 1062 HH21 ARG 139 HH21 ARG 139 19.591 4.868 10.921 1063 HH22 ARG 139 HH22 ARG 139 20.462 3.431 10.793 1064 H ARG 140 H ARG 140 12.128 3.375 8.013 1065 HA ARG 140 HA ARG 140 13.068 5.743 6.782 1066 HB2 ARG 140 HB2 ARG 140 13.228 3.629 5.553 1067 HB3 ARG 140 HB3 ARG 140 11.481 3.452 5.562 1068 HG2 ARG 140 HG2 ARG 140 12.293 4.165 3.360 1069 HG3 ARG 140 HG3 ARG 140 11.253 5.385 4.085 1070 HD2 ARG 140 HD2 ARG 140 13.121 6.497 3.064 1071 HD3 ARG 140 HD3 ARG 140 13.311 6.621 4.805 1072 HE ARG 140 HE ARG 140 14.863 4.892 2.990 1073 HH11 ARG 140 HH11 ARG 140 14.575 6.464 6.164 1074 HH12 ARG 140 HH12 ARG 140 16.161 6.079 6.628 1075 HH21 ARG 140 HH21 ARG 140 17.031 4.453 3.608 1076 HH22 ARG 140 HH22 ARG 140 17.593 4.883 5.154 1077 H ALA 141 H ALA 141 9.865 4.539 7.492 1078 HA ALA 141 HA ALA 141 8.353 6.467 6.193 1079 HB1 ALA 141 HB1 ALA 141 7.760 5.016 8.769 1080 HB2 ALA 141 HB2 ALA 141 7.362 4.465 7.140 1081 HB3 ALA 141 HB3 ALA 141 6.580 5.900 7.812 1082 H GLN 142 H GLN 142 9.655 6.406 9.496 1083 HA GLN 142 HA GLN 142 8.728 8.839 10.509 1084 HB2 GLN 142 HB2 GLN 142 11.404 7.525 11.031 1085 HB3 GLN 142 HB3 GLN 142 10.726 8.831 11.980 1086 HG2 GLN 142 HG2 GLN 142 9.588 6.058 11.715 1087 HG3 GLN 142 HG3 GLN 142 10.512 6.678 13.079 1088 HE21 GLN 142 HE21 GLN 142 7.884 5.594 13.060 1089 HE22 GLN 142 HE22 GLN 142 6.826 6.809 13.677 1090 H ALA 143 H ALA 143 11.672 8.094 8.740 1091 HA ALA 143 HA ALA 143 12.819 10.649 8.755 1092 HB1 ALA 143 HB1 ALA 143 14.068 8.622 8.214 1093 HB2 ALA 143 HB2 ALA 143 14.226 9.827 6.930 1094 HB3 ALA 143 HB3 ALA 143 13.146 8.449 6.721 1095 H MET 144 H MET 144 10.518 9.164 6.573 1096 HA MET 144 HA MET 144 10.673 11.314 4.672 1097 HB2 MET 144 HB2 MET 144 8.577 9.143 4.871 1098 HB3 MET 144 HB3 MET 144 8.812 10.226 3.514 1099 HG2 MET 144 HG2 MET 144 10.692 8.081 4.473 1100 HG3 MET 144 HG3 MET 144 9.724 8.063 3.007 1101 HE1 MET 144 HE1 MET 144 10.117 11.056 1.894 1102 HE2 MET 144 HE2 MET 144 10.206 9.599 0.900 1103 HE3 MET 144 HE3 MET 144 11.495 10.800 0.825 1104 H ALA 145 H ALA 145 8.542 10.459 7.326 1105 HA ALA 145 HA ALA 145 6.633 12.479 6.589 1106 HB1 ALA 145 HB1 ALA 145 6.744 10.814 9.091 1107 HB2 ALA 145 HB2 ALA 145 5.902 10.376 7.604 1108 HB3 ALA 145 HB3 ALA 145 5.379 11.781 8.536 1109 H TYR 146 H TYR 146 9.120 12.162 9.118 1110 HA TYR 146 HA TYR 146 8.448 14.911 9.873 1111 HB2 TYR 146 HB2 TYR 146 9.839 12.830 11.572 1112 HB3 TYR 146 HB3 TYR 146 9.326 14.432 12.081 1113 HD1 TYR 146 HD1 TYR 146 6.797 14.908 12.116 1114 HD2 TYR 146 HD2 TYR 146 8.428 10.998 11.761 1115 HE1 TYR 146 HE1 TYR 146 4.661 13.950 12.882 1116 HE2 TYR 146 HE2 TYR 146 6.307 10.033 12.514 1117 HH TYR 146 HH TYR 146 3.410 11.792 12.776 Start of MODEL 14 1 H MET 1 H MET 1 -3.423 24.969 30.651 2 HA MET 1 HA MET 1 -1.215 24.357 30.306 3 HB2 MET 1 HB2 MET 1 -1.871 22.008 32.089 4 HB3 MET 1 HB3 MET 1 -0.446 22.062 31.067 5 HG2 MET 1 HG2 MET 1 0.349 24.024 32.267 6 HG3 MET 1 HG3 MET 1 -1.097 24.002 33.269 7 HE1 MET 1 HE1 MET 1 1.872 24.075 34.380 8 HE2 MET 1 HE2 MET 1 1.769 22.922 35.706 9 HE3 MET 1 HE3 MET 1 0.455 24.065 35.428 10 HA PRO 2 HA PRO 2 -3.253 22.294 26.932 11 HB2 PRO 2 HB2 PRO 2 -1.372 22.696 25.062 12 HB3 PRO 2 HB3 PRO 2 -2.367 24.024 25.671 13 HG2 PRO 2 HG2 PRO 2 0.436 23.279 26.406 14 HG3 PRO 2 HG3 PRO 2 -0.248 24.886 26.094 15 HD2 PRO 2 HD2 PRO 2 0.143 23.863 28.603 16 HD3 PRO 2 HD3 PRO 2 -1.096 25.072 28.214 17 H GLY 3 H GLY 3 -3.160 20.287 26.005 18 HA2 GLY 3 HA2 GLY 3 -0.801 18.638 26.650 19 HA3 GLY 3 HA3 GLY 3 -2.449 18.015 26.549 20 H ARG 4 H ARG 4 -3.282 17.476 24.647 21 HA ARG 4 HA ARG 4 -1.580 17.310 22.350 22 HB2 ARG 4 HB2 ARG 4 -3.360 15.617 22.782 23 HB3 ARG 4 HB3 ARG 4 -4.576 16.870 22.592 24 HG2 ARG 4 HG2 ARG 4 -3.953 17.150 20.256 25 HG3 ARG 4 HG3 ARG 4 -2.683 15.943 20.434 26 HD2 ARG 4 HD2 ARG 4 -4.647 14.961 19.374 27 HD3 ARG 4 HD3 ARG 4 -4.376 14.242 20.959 28 HE ARG 4 HE ARG 4 -6.139 16.306 21.363 29 HH11 ARG 4 HH11 ARG 4 -6.171 13.377 19.332 30 HH12 ARG 4 HH12 ARG 4 -7.828 13.090 19.509 31 HH21 ARG 4 HH21 ARG 4 -8.450 15.948 21.567 32 HH22 ARG 4 HH22 ARG 4 -9.172 14.620 20.761 33 H ALA 5 H ALA 5 -1.460 18.768 20.710 34 HA ALA 5 HA ALA 5 -2.696 21.296 21.131 35 HB1 ALA 5 HB1 ALA 5 -1.456 22.022 19.181 36 HB2 ALA 5 HB2 ALA 5 -1.037 20.352 18.807 37 HB3 ALA 5 HB3 ALA 5 -0.417 21.111 20.278 38 HA PRO 6 HA PRO 6 -6.141 20.250 18.448 39 HB2 PRO 6 HB2 PRO 6 -7.762 22.212 19.246 40 HB3 PRO 6 HB3 PRO 6 -7.389 20.870 20.336 41 HG2 PRO 6 HG2 PRO 6 -6.298 23.650 20.308 42 HG3 PRO 6 HG3 PRO 6 -6.738 22.637 21.693 43 HD2 PRO 6 HD2 PRO 6 -4.158 22.988 20.712 44 HD3 PRO 6 HD3 PRO 6 -4.695 21.657 21.755 45 H GLY 7 H GLY 7 -3.791 21.767 17.644 46 HA2 GLY 7 HA2 GLY 7 -4.834 24.083 16.200 47 HA3 GLY 7 HA3 GLY 7 -3.141 23.663 16.413 48 H SER 8 H SER 8 -4.755 20.901 15.605 49 HA SER 8 HA SER 8 -4.195 21.317 12.781 50 HB2 SER 8 HB2 SER 8 -3.760 18.827 12.769 51 HB3 SER 8 HB3 SER 8 -2.586 19.771 13.687 52 HG SER 8 HG SER 8 -3.106 18.690 15.363 53 H THR 9 H THR 9 -5.629 20.070 11.352 54 HA THR 9 HA THR 9 -8.330 20.211 12.240 55 HB THR 9 HB THR 9 -7.224 19.003 9.695 56 HG1 THR 9 HG1 THR 9 -7.148 20.959 8.851 57 HG21 THR 9 HG21 THR 9 -9.884 20.273 10.338 58 HG22 THR 9 HG22 THR 9 -9.595 18.542 10.154 59 HG23 THR 9 HG23 THR 9 -9.407 19.624 8.771 60 H LEU 10 H LEU 10 -9.471 18.535 13.108 61 HA LEU 10 HA LEU 10 -8.221 16.005 13.474 62 HB2 LEU 10 HB2 LEU 10 -11.073 16.859 13.905 63 HB3 LEU 10 HB3 LEU 10 -10.429 15.299 14.377 64 HG LEU 10 HG LEU 10 -9.678 17.988 15.528 65 HD11 LEU 10 HD11 LEU 10 -11.818 17.182 16.263 66 HD12 LEU 10 HD12 LEU 10 -10.642 17.022 17.579 67 HD13 LEU 10 HD13 LEU 10 -11.119 15.607 16.633 68 HD21 LEU 10 HD21 LEU 10 -7.700 16.546 15.466 69 HD22 LEU 10 HD22 LEU 10 -8.622 15.239 16.219 70 HD23 LEU 10 HD23 LEU 10 -8.294 16.719 17.115 71 H ALA 11 H ALA 11 -8.891 14.027 12.532 72 HA ALA 11 HA ALA 11 -10.135 14.500 9.915 73 HB1 ALA 11 HB1 ALA 11 -7.868 12.603 10.435 74 HB2 ALA 11 HB2 ALA 11 -7.718 14.208 9.713 75 HB3 ALA 11 HB3 ALA 11 -8.623 12.944 8.878 76 H ARG 12 H ARG 12 -11.874 13.488 9.582 77 HA ARG 12 HA ARG 12 -12.286 10.808 10.670 78 HB2 ARG 12 HB2 ARG 12 -14.682 11.117 10.110 79 HB3 ARG 12 HB3 ARG 12 -14.141 12.447 11.115 80 HG2 ARG 12 HG2 ARG 12 -13.954 13.865 9.099 81 HG3 ARG 12 HG3 ARG 12 -14.525 12.514 8.129 82 HD2 ARG 12 HD2 ARG 12 -16.628 12.520 9.363 83 HD3 ARG 12 HD3 ARG 12 -16.045 13.874 10.332 84 HE ARG 12 HE ARG 12 -15.919 14.390 7.542 85 HH11 ARG 12 HH11 ARG 12 -18.045 14.507 10.371 86 HH12 ARG 12 HH12 ARG 12 -19.155 15.583 9.680 87 HH21 ARG 12 HH21 ARG 12 -17.523 15.943 6.572 88 HH22 ARG 12 HH22 ARG 12 -18.853 16.382 7.519 89 H VAL 13 H VAL 13 -11.973 9.178 9.217 90 HA VAL 13 HA VAL 13 -12.247 9.728 6.426 91 HB VAL 13 HB VAL 13 -10.081 10.737 6.810 92 HG11 VAL 13 HG11 VAL 13 -9.382 9.642 8.798 93 HG12 VAL 13 HG12 VAL 13 -8.127 9.456 7.568 94 HG13 VAL 13 HG13 VAL 13 -9.198 8.106 7.954 95 HG21 VAL 13 HG21 VAL 13 -10.362 9.628 4.667 96 HG22 VAL 13 HG22 VAL 13 -9.797 8.103 5.352 97 HG23 VAL 13 HG23 VAL 13 -8.690 9.468 5.208 98 H GLY 14 H GLY 14 -12.664 8.018 5.304 99 HA2 GLY 14 HA2 GLY 14 -12.535 5.425 6.613 100 HA3 GLY 14 HA3 GLY 14 -13.500 5.823 5.187 101 H SER 15 H SER 15 -12.746 4.868 3.432 102 HA SER 15 HA SER 15 -10.003 4.055 3.361 103 HB2 SER 15 HB2 SER 15 -10.665 3.017 1.171 104 HB3 SER 15 HB3 SER 15 -11.640 2.483 2.538 105 HG SER 15 HG SER 15 -13.332 3.633 1.819 106 H ILE 16 H ILE 16 -8.457 4.819 2.016 107 HA ILE 16 HA ILE 16 -8.835 7.497 1.051 108 HB ILE 16 HB ILE 16 -6.381 5.683 1.143 109 HG12 ILE 16 HG12 ILE 16 -5.486 7.443 2.745 110 HG13 ILE 16 HG13 ILE 16 -7.093 8.149 2.761 111 HG21 ILE 16 HG21 ILE 16 -6.462 8.539 0.196 112 HG22 ILE 16 HG22 ILE 16 -6.170 7.112 -0.797 113 HG23 ILE 16 HG23 ILE 16 -5.003 7.577 0.441 114 HD11 ILE 16 HD11 ILE 16 -6.367 5.380 3.702 115 HD12 ILE 16 HD12 ILE 16 -7.979 6.094 3.748 116 HD13 ILE 16 HD13 ILE 16 -6.684 6.780 4.729 117 HA PRO 17 HA PRO 17 -9.889 6.077 -3.064 118 HB2 PRO 17 HB2 PRO 17 -9.111 8.372 -4.404 119 HB3 PRO 17 HB3 PRO 17 -10.681 8.169 -3.620 120 HG2 PRO 17 HG2 PRO 17 -8.225 9.542 -2.607 121 HG3 PRO 17 HG3 PRO 17 -9.921 10.030 -2.461 122 HD2 PRO 17 HD2 PRO 17 -8.616 8.914 -0.423 123 HD3 PRO 17 HD3 PRO 17 -10.329 8.550 -0.721 124 H ALA 18 H ALA 18 -8.765 5.193 -4.741 125 HA ALA 18 HA ALA 18 -5.945 4.875 -4.285 126 HB1 ALA 18 HB1 ALA 18 -7.331 2.947 -4.778 127 HB2 ALA 18 HB2 ALA 18 -6.132 3.178 -6.052 128 HB3 ALA 18 HB3 ALA 18 -7.805 3.659 -6.317 129 H GLY 19 H GLY 19 -4.442 5.987 -5.279 130 HA2 GLY 19 HA2 GLY 19 -5.208 7.746 -7.482 131 HA3 GLY 19 HA3 GLY 19 -3.734 7.855 -6.523 132 H ASP 20 H ASP 20 -2.039 6.376 -6.946 133 HA ASP 20 HA ASP 20 -2.253 4.889 -9.441 134 HB2 ASP 20 HB2 ASP 20 -0.180 7.009 -8.856 135 HB3 ASP 20 HB3 ASP 20 0.111 5.718 -10.009 136 H ASP 21 H ASP 21 -0.816 3.184 -9.631 137 HA ASP 21 HA ASP 21 0.088 2.119 -7.107 138 HB2 ASP 21 HB2 ASP 21 0.438 0.073 -8.360 139 HB3 ASP 21 HB3 ASP 21 -1.129 0.744 -8.810 140 H VAL 22 H VAL 22 2.324 1.197 -6.998 141 HA VAL 22 HA VAL 22 4.217 2.813 -8.565 142 HB VAL 22 HB VAL 22 4.594 1.929 -5.670 143 HG11 VAL 22 HG11 VAL 22 6.500 3.429 -5.653 144 HG12 VAL 22 HG12 VAL 22 6.137 3.910 -7.321 145 HG13 VAL 22 HG13 VAL 22 6.625 2.249 -6.970 146 HG21 VAL 22 HG21 VAL 22 2.783 3.577 -5.855 147 HG22 VAL 22 HG22 VAL 22 3.865 4.666 -6.718 148 HG23 VAL 22 HG23 VAL 22 4.188 4.254 -5.034 149 H LEU 23 H LEU 23 3.080 0.033 -8.668 150 HA LEU 23 HA LEU 23 5.629 -1.373 -8.826 151 HB2 LEU 23 HB2 LEU 23 4.205 -3.541 -8.725 152 HB3 LEU 23 HB3 LEU 23 4.547 -2.683 -7.249 153 HG LEU 23 HG LEU 23 2.250 -1.835 -7.186 154 HD11 LEU 23 HD11 LEU 23 1.808 -3.498 -9.682 155 HD12 LEU 23 HD12 LEU 23 1.771 -1.739 -9.613 156 HD13 LEU 23 HD13 LEU 23 0.548 -2.681 -8.756 157 HD21 LEU 23 HD21 LEU 23 1.114 -3.965 -6.799 158 HD22 LEU 23 HD22 LEU 23 2.729 -3.913 -6.097 159 HD23 LEU 23 HD23 LEU 23 2.445 -4.806 -7.590 160 H ASP 24 H ASP 24 5.054 -3.477 -10.410 161 HA ASP 24 HA ASP 24 4.338 -2.147 -12.908 162 HB2 ASP 24 HB2 ASP 24 6.537 -3.361 -12.817 163 HB3 ASP 24 HB3 ASP 24 5.667 -4.842 -12.430 164 HA PRO 25 HA PRO 25 0.351 -4.010 -12.519 165 HB2 PRO 25 HB2 PRO 25 0.520 -4.519 -15.438 166 HB3 PRO 25 HB3 PRO 25 -0.758 -3.722 -14.514 167 HG2 PRO 25 HG2 PRO 25 0.930 -2.255 -15.940 168 HG3 PRO 25 HG3 PRO 25 0.442 -1.731 -14.316 169 HD2 PRO 25 HD2 PRO 25 2.994 -3.006 -15.215 170 HD3 PRO 25 HD3 PRO 25 2.742 -1.697 -14.052 171 H ASP 26 H ASP 26 2.930 -5.807 -14.045 172 HA ASP 26 HA ASP 26 1.463 -8.286 -14.119 173 HB2 ASP 26 HB2 ASP 26 3.178 -7.996 -15.786 174 HB3 ASP 26 HB3 ASP 26 4.400 -7.707 -14.553 175 H GLU 27 H GLU 27 3.095 -6.596 -11.660 176 HA GLU 27 HA GLU 27 4.120 -8.755 -10.180 177 HB2 GLU 27 HB2 GLU 27 3.095 -6.081 -9.221 178 HB3 GLU 27 HB3 GLU 27 3.971 -7.222 -8.212 179 HG2 GLU 27 HG2 GLU 27 4.997 -5.753 -10.626 180 HG3 GLU 27 HG3 GLU 27 5.473 -5.507 -8.948 181 HA PRO 28 HA PRO 28 0.554 -10.894 -8.759 182 HB2 PRO 28 HB2 PRO 28 1.435 -11.512 -6.184 183 HB3 PRO 28 HB3 PRO 28 1.791 -12.453 -7.631 184 HG2 PRO 28 HG2 PRO 28 3.472 -10.390 -6.270 185 HG3 PRO 28 HG3 PRO 28 3.956 -11.930 -7.011 186 HD2 PRO 28 HD2 PRO 28 4.362 -9.615 -8.264 187 HD3 PRO 28 HD3 PRO 28 3.858 -11.062 -9.163 188 H THR 29 H THR 29 -1.231 -9.869 -8.272 189 HA THR 29 HA THR 29 -1.249 -8.125 -5.977 190 HB THR 29 HB THR 29 -2.930 -6.844 -7.640 191 HG1 THR 29 HG1 THR 29 -0.741 -7.774 -9.231 192 HG21 THR 29 HG21 THR 29 0.031 -6.374 -7.288 193 HG22 THR 29 HG22 THR 29 -1.288 -5.697 -6.333 194 HG23 THR 29 HG23 THR 29 -1.066 -5.196 -8.007 195 H TYR 30 H TYR 30 -3.388 -7.626 -5.281 196 HA TYR 30 HA TYR 30 -5.253 -9.801 -5.694 197 HB2 TYR 30 HB2 TYR 30 -4.651 -8.107 -3.275 198 HB3 TYR 30 HB3 TYR 30 -6.097 -9.100 -3.411 199 HD1 TYR 30 HD1 TYR 30 -5.698 -11.547 -4.021 200 HD2 TYR 30 HD2 TYR 30 -2.724 -9.054 -2.339 201 HE1 TYR 30 HE1 TYR 30 -4.516 -13.522 -3.266 202 HE2 TYR 30 HE2 TYR 30 -1.503 -11.041 -1.547 203 HH TYR 30 HH TYR 30 -1.902 -13.401 -1.036 204 H ASP 31 H ASP 31 -7.453 -9.113 -5.410 205 HA ASP 31 HA ASP 31 -8.090 -6.368 -6.249 206 HB2 ASP 31 HB2 ASP 31 -9.182 -8.958 -7.431 207 HB3 ASP 31 HB3 ASP 31 -9.831 -7.368 -7.753 208 H LEU 32 H LEU 32 -10.586 -6.189 -5.932 209 HA LEU 32 HA LEU 32 -11.073 -6.734 -3.260 210 HB2 LEU 32 HB2 LEU 32 -13.002 -5.906 -5.401 211 HB3 LEU 32 HB3 LEU 32 -13.492 -6.128 -3.737 212 HG LEU 32 HG LEU 32 -13.183 -3.851 -4.021 213 HD11 LEU 32 HD11 LEU 32 -12.320 -4.639 -1.938 214 HD12 LEU 32 HD12 LEU 32 -11.430 -3.228 -2.493 215 HD13 LEU 32 HD13 LEU 32 -10.710 -4.825 -2.642 216 HD21 LEU 32 HD21 LEU 32 -11.128 -2.774 -4.869 217 HD22 LEU 32 HD22 LEU 32 -11.904 -3.783 -6.088 218 HD23 LEU 32 HD23 LEU 32 -10.470 -4.366 -5.243 219 HA PRO 33 HA PRO 33 -14.016 -10.438 -4.435 220 HB2 PRO 33 HB2 PRO 33 -13.355 -11.624 -6.860 221 HB3 PRO 33 HB3 PRO 33 -14.745 -10.568 -6.604 222 HG2 PRO 33 HG2 PRO 33 -12.069 -9.938 -7.750 223 HG3 PRO 33 HG3 PRO 33 -13.667 -9.344 -8.239 224 HD2 PRO 33 HD2 PRO 33 -11.962 -7.852 -6.808 225 HD3 PRO 33 HD3 PRO 33 -13.719 -7.765 -6.550 226 H ARG 34 H ARG 34 -10.697 -10.317 -5.648 227 HA ARG 34 HA ARG 34 -9.962 -12.973 -5.091 228 HB2 ARG 34 HB2 ARG 34 -8.811 -11.169 -6.537 229 HB3 ARG 34 HB3 ARG 34 -8.209 -10.610 -4.981 230 HG2 ARG 34 HG2 ARG 34 -6.523 -11.931 -6.067 231 HG3 ARG 34 HG3 ARG 34 -7.125 -12.741 -4.615 232 HD2 ARG 34 HD2 ARG 34 -8.415 -14.244 -5.868 233 HD3 ARG 34 HD3 ARG 34 -8.172 -13.307 -7.347 234 HE ARG 34 HE ARG 34 -5.686 -13.902 -6.759 235 HH11 ARG 34 HH11 ARG 34 -8.490 -16.060 -6.610 236 HH12 ARG 34 HH12 ARG 34 -7.612 -17.456 -6.950 237 HH21 ARG 34 HH21 ARG 34 -4.470 -15.823 -7.231 238 HH22 ARG 34 HH22 ARG 34 -5.251 -17.325 -7.319 239 H VAL 35 H VAL 35 -9.725 -9.958 -3.200 240 HA VAL 35 HA VAL 35 -8.344 -11.194 -1.055 241 HB VAL 35 HB VAL 35 -9.974 -8.615 -1.000 242 HG11 VAL 35 HG11 VAL 35 -9.666 -9.491 1.254 243 HG12 VAL 35 HG12 VAL 35 -8.694 -8.041 1.018 244 HG13 VAL 35 HG13 VAL 35 -7.931 -9.631 0.979 245 HG21 VAL 35 HG21 VAL 35 -7.007 -9.036 -1.319 246 HG22 VAL 35 HG22 VAL 35 -7.812 -7.474 -1.164 247 HG23 VAL 35 HG23 VAL 35 -8.129 -8.493 -2.570 248 H ALA 36 H ALA 36 -11.691 -10.596 -1.769 249 HA ALA 36 HA ALA 36 -12.820 -11.492 0.634 250 HB1 ALA 36 HB1 ALA 36 -14.856 -11.838 -0.665 251 HB2 ALA 36 HB2 ALA 36 -13.944 -11.706 -2.170 252 HB3 ALA 36 HB3 ALA 36 -14.101 -10.307 -1.105 253 H GLU 37 H GLU 37 -11.735 -13.146 -2.248 254 HA GLU 37 HA GLU 37 -12.627 -15.775 -1.720 255 HB2 GLU 37 HB2 GLU 37 -11.658 -14.688 -3.865 256 HB3 GLU 37 HB3 GLU 37 -10.112 -14.981 -3.137 257 HG2 GLU 37 HG2 GLU 37 -10.712 -17.413 -2.951 258 HG3 GLU 37 HG3 GLU 37 -12.088 -17.065 -3.997 259 H LEU 38 H LEU 38 -9.578 -14.067 -1.171 260 HA LEU 38 HA LEU 38 -8.080 -16.213 -0.156 261 HB2 LEU 38 HB2 LEU 38 -7.085 -14.238 -1.168 262 HB3 LEU 38 HB3 LEU 38 -7.688 -13.247 0.142 263 HG LEU 38 HG LEU 38 -6.234 -14.542 1.704 264 HD11 LEU 38 HD11 LEU 38 -4.392 -15.858 0.765 265 HD12 LEU 38 HD12 LEU 38 -5.107 -15.698 -0.840 266 HD13 LEU 38 HD13 LEU 38 -5.965 -16.575 0.425 267 HD21 LEU 38 HD21 LEU 38 -4.160 -13.430 1.030 268 HD22 LEU 38 HD22 LEU 38 -5.557 -12.366 0.858 269 HD23 LEU 38 HD23 LEU 38 -4.847 -13.124 -0.566 270 H LEU 39 H LEU 39 -9.656 -13.507 1.521 271 HA LEU 39 HA LEU 39 -8.860 -14.612 4.072 272 HB2 LEU 39 HB2 LEU 39 -10.603 -12.254 3.417 273 HB3 LEU 39 HB3 LEU 39 -10.075 -12.684 5.030 274 HG LEU 39 HG LEU 39 -8.311 -11.769 2.754 275 HD11 LEU 39 HD11 LEU 39 -7.992 -9.773 4.123 276 HD12 LEU 39 HD12 LEU 39 -9.136 -10.400 5.306 277 HD13 LEU 39 HD13 LEU 39 -9.686 -9.989 3.678 278 HD21 LEU 39 HD21 LEU 39 -7.623 -12.433 5.618 279 HD22 LEU 39 HD22 LEU 39 -6.529 -11.706 4.440 280 HD23 LEU 39 HD23 LEU 39 -7.130 -13.339 4.186 281 H GLY 40 H GLY 40 -11.516 -14.927 1.979 282 HA2 GLY 40 HA2 GLY 40 -13.367 -16.281 2.180 283 HA3 GLY 40 HA3 GLY 40 -12.812 -16.728 3.795 284 H VAL 41 H VAL 41 -13.214 -13.487 2.735 285 HA VAL 41 HA VAL 41 -15.495 -13.166 4.571 286 HB VAL 41 HB VAL 41 -14.682 -10.954 5.218 287 HG11 VAL 41 HG11 VAL 41 -12.686 -11.528 6.494 288 HG12 VAL 41 HG12 VAL 41 -12.525 -13.016 5.560 289 HG13 VAL 41 HG13 VAL 41 -13.931 -12.774 6.594 290 HG21 VAL 41 HG21 VAL 41 -12.374 -11.492 3.348 291 HG22 VAL 41 HG22 VAL 41 -12.415 -10.164 4.519 292 HG23 VAL 41 HG23 VAL 41 -13.593 -10.231 3.214 293 HA PRO 42 HA PRO 42 -17.498 -11.105 1.174 294 HB2 PRO 42 HB2 PRO 42 -18.933 -9.182 2.491 295 HB3 PRO 42 HB3 PRO 42 -19.422 -10.878 2.455 296 HG2 PRO 42 HG2 PRO 42 -17.981 -9.346 4.573 297 HG3 PRO 42 HG3 PRO 42 -19.271 -10.552 4.741 298 HD2 PRO 42 HD2 PRO 42 -16.688 -11.153 5.189 299 HD3 PRO 42 HD3 PRO 42 -17.828 -12.321 4.506 300 H VAL 43 H VAL 43 -17.618 -9.041 0.084 301 HA VAL 43 HA VAL 43 -15.223 -7.594 0.046 302 HB VAL 43 HB VAL 43 -17.911 -6.775 -1.121 303 HG11 VAL 43 HG11 VAL 43 -16.602 -5.423 -2.709 304 HG12 VAL 43 HG12 VAL 43 -15.124 -5.863 -1.853 305 HG13 VAL 43 HG13 VAL 43 -16.351 -4.894 -1.045 306 HG21 VAL 43 HG21 VAL 43 -17.072 -7.775 -3.210 307 HG22 VAL 43 HG22 VAL 43 -17.231 -8.967 -1.919 308 HG23 VAL 43 HG23 VAL 43 -15.640 -8.338 -2.351 309 H SER 44 H SER 44 -18.238 -7.040 1.681 310 HA SER 44 HA SER 44 -17.937 -4.414 2.510 311 HB2 SER 44 HB2 SER 44 -20.014 -5.740 2.827 312 HB3 SER 44 HB3 SER 44 -19.202 -6.697 4.064 313 HG SER 44 HG SER 44 -20.542 -4.508 4.384 314 H LYS 45 H LYS 45 -16.650 -7.411 4.015 315 HA LYS 45 HA LYS 45 -15.459 -6.001 6.173 316 HB2 LYS 45 HB2 LYS 45 -15.174 -8.815 5.191 317 HB3 LYS 45 HB3 LYS 45 -14.050 -8.189 6.388 318 HG2 LYS 45 HG2 LYS 45 -15.967 -7.655 7.856 319 HG3 LYS 45 HG3 LYS 45 -17.041 -8.385 6.660 320 HD2 LYS 45 HD2 LYS 45 -16.049 -10.547 6.979 321 HD3 LYS 45 HD3 LYS 45 -14.746 -9.859 7.944 322 HE2 LYS 45 HE2 LYS 45 -16.437 -11.007 9.319 323 HE3 LYS 45 HE3 LYS 45 -16.299 -9.299 9.715 324 HZ1 LYS 45 HZ1 LYS 45 -18.597 -9.981 9.627 325 HZ2 LYS 45 HZ2 LYS 45 -18.436 -10.547 8.055 326 HZ3 LYS 45 HZ3 LYS 45 -18.316 -8.895 8.392 327 H VAL 46 H VAL 46 -14.360 -6.901 3.011 328 HA VAL 46 HA VAL 46 -11.611 -6.141 3.372 329 HB VAL 46 HB VAL 46 -13.264 -5.921 0.831 330 HG11 VAL 46 HG11 VAL 46 -11.102 -6.124 -0.330 331 HG12 VAL 46 HG12 VAL 46 -10.285 -6.145 1.237 332 HG13 VAL 46 HG13 VAL 46 -11.170 -4.709 0.726 333 HG21 VAL 46 HG21 VAL 46 -13.388 -8.201 1.692 334 HG22 VAL 46 HG22 VAL 46 -11.632 -8.262 1.822 335 HG23 VAL 46 HG23 VAL 46 -12.389 -8.150 0.236 336 H ALA 47 H ALA 47 -14.428 -4.360 2.316 337 HA ALA 47 HA ALA 47 -13.192 -1.867 2.044 338 HB1 ALA 47 HB1 ALA 47 -15.438 -2.376 1.181 339 HB2 ALA 47 HB2 ALA 47 -15.428 -0.918 2.175 340 HB3 ALA 47 HB3 ALA 47 -16.048 -2.434 2.835 341 H GLN 48 H GLN 48 -14.499 -3.503 4.844 342 HA GLN 48 HA GLN 48 -14.428 -1.381 6.670 343 HB2 GLN 48 HB2 GLN 48 -14.097 -4.325 7.160 344 HB3 GLN 48 HB3 GLN 48 -14.235 -3.128 8.436 345 HG2 GLN 48 HG2 GLN 48 -16.440 -2.487 7.532 346 HG3 GLN 48 HG3 GLN 48 -16.291 -3.789 6.351 347 HE21 GLN 48 HE21 GLN 48 -18.217 -3.392 8.414 348 HE22 GLN 48 HE22 GLN 48 -18.171 -4.797 9.430 349 H GLN 49 H GLN 49 -11.990 -3.788 5.828 350 HA GLN 49 HA GLN 49 -9.949 -3.054 7.619 351 HB2 GLN 49 HB2 GLN 49 -9.659 -4.056 4.775 352 HB3 GLN 49 HB3 GLN 49 -8.401 -4.075 5.994 353 HG2 GLN 49 HG2 GLN 49 -10.988 -5.589 6.235 354 HG3 GLN 49 HG3 GLN 49 -9.512 -6.263 5.554 355 HE21 GLN 49 HE21 GLN 49 -9.444 -7.831 7.107 356 HE22 GLN 49 HE22 GLN 49 -8.954 -7.518 8.730 357 H LEU 50 H LEU 50 -10.658 -2.065 4.344 358 HA LEU 50 HA LEU 50 -8.510 -0.331 3.907 359 HB2 LEU 50 HB2 LEU 50 -11.237 -0.548 2.687 360 HB3 LEU 50 HB3 LEU 50 -9.986 0.510 2.026 361 HG LEU 50 HG LEU 50 -9.948 -2.515 2.210 362 HD11 LEU 50 HD11 LEU 50 -10.241 -0.683 -0.165 363 HD12 LEU 50 HD12 LEU 50 -11.509 -1.682 0.546 364 HD13 LEU 50 HD13 LEU 50 -10.114 -2.440 -0.222 365 HD21 LEU 50 HD21 LEU 50 -7.917 -2.387 0.843 366 HD22 LEU 50 HD22 LEU 50 -7.686 -1.601 2.402 367 HD23 LEU 50 HD23 LEU 50 -7.951 -0.630 0.954 368 H ARG 51 H ARG 51 -11.803 0.262 5.066 369 HA ARG 51 HA ARG 51 -11.522 3.077 5.059 370 HB2 ARG 51 HB2 ARG 51 -13.670 3.211 6.033 371 HB3 ARG 51 HB3 ARG 51 -13.661 1.850 4.908 372 HG2 ARG 51 HG2 ARG 51 -13.430 0.316 6.777 373 HG3 ARG 51 HG3 ARG 51 -13.471 1.678 7.893 374 HD2 ARG 51 HD2 ARG 51 -15.696 2.279 7.096 375 HD3 ARG 51 HD3 ARG 51 -15.670 0.914 5.982 376 HE ARG 51 HE ARG 51 -15.189 0.008 8.595 377 HH11 ARG 51 HH11 ARG 51 -17.852 1.307 6.628 378 HH12 ARG 51 HH12 ARG 51 -19.064 0.503 7.500 379 HH21 ARG 51 HH21 ARG 51 -16.844 -1.068 9.790 380 HH22 ARG 51 HH22 ARG 51 -18.485 -0.877 9.374 381 H GLU 52 H GLU 52 -10.554 0.719 7.368 382 HA GLU 52 HA GLU 52 -10.329 2.892 9.314 383 HB2 GLU 52 HB2 GLU 52 -10.155 -0.077 9.793 384 HB3 GLU 52 HB3 GLU 52 -9.875 1.140 11.028 385 HG2 GLU 52 HG2 GLU 52 -12.199 1.990 10.551 386 HG3 GLU 52 HG3 GLU 52 -12.428 0.544 9.571 387 H GLY 53 H GLY 53 -8.601 1.802 6.966 388 HA2 GLY 53 HA2 GLY 53 -6.411 2.138 6.416 389 HA3 GLY 53 HA3 GLY 53 -6.200 2.911 7.978 390 H HIS 54 H HIS 54 -7.327 -0.372 7.457 391 HA HIS 54 HA HIS 54 -4.990 -1.323 8.910 392 HB2 HIS 54 HB2 HIS 54 -7.570 -2.731 8.157 393 HB3 HIS 54 HB3 HIS 54 -6.236 -3.517 8.986 394 HD1 HIS 54 HD1 HIS 54 -9.392 -2.493 9.923 395 HD2 HIS 54 HD2 HIS 54 -5.614 -1.491 11.350 396 HE1 HIS 54 HE1 HIS 54 -9.718 -1.672 12.270 397 H LEU 55 H LEU 55 -6.134 -0.942 5.809 398 HA LEU 55 HA LEU 55 -3.913 -2.264 4.613 399 HB2 LEU 55 HB2 LEU 55 -5.605 -4.107 4.897 400 HB3 LEU 55 HB3 LEU 55 -6.756 -3.143 3.996 401 HG LEU 55 HG LEU 55 -5.260 -3.313 2.010 402 HD11 LEU 55 HD11 LEU 55 -3.735 -5.244 3.745 403 HD12 LEU 55 HD12 LEU 55 -3.151 -3.685 3.165 404 HD13 LEU 55 HD13 LEU 55 -3.478 -4.985 2.021 405 HD21 LEU 55 HD21 LEU 55 -6.149 -5.923 3.235 406 HD22 LEU 55 HD22 LEU 55 -5.806 -5.661 1.525 407 HD23 LEU 55 HD23 LEU 55 -7.156 -4.824 2.292 408 H VAL 56 H VAL 56 -3.752 -1.397 2.363 409 HA VAL 56 HA VAL 56 -5.793 0.572 1.755 410 HB VAL 56 HB VAL 56 -3.872 1.728 2.825 411 HG11 VAL 56 HG11 VAL 56 -1.744 1.995 1.619 412 HG12 VAL 56 HG12 VAL 56 -2.279 0.782 0.456 413 HG13 VAL 56 HG13 VAL 56 -2.049 0.339 2.148 414 HG21 VAL 56 HG21 VAL 56 -3.580 3.506 1.126 415 HG22 VAL 56 HG22 VAL 56 -5.257 2.987 1.299 416 HG23 VAL 56 HG23 VAL 56 -4.299 2.434 -0.074 417 H ALA 57 H ALA 57 -5.910 1.083 -0.496 418 HA ALA 57 HA ALA 57 -4.829 -1.039 -2.196 419 HB1 ALA 57 HB1 ALA 57 -7.590 0.184 -2.305 420 HB2 ALA 57 HB2 ALA 57 -7.202 -1.428 -1.715 421 HB3 ALA 57 HB3 ALA 57 -6.950 -1.028 -3.415 422 H VAL 58 H VAL 58 -4.601 -0.436 -4.400 423 HA VAL 58 HA VAL 58 -4.463 2.420 -4.913 424 HB VAL 58 HB VAL 58 -2.335 2.032 -6.242 425 HG11 VAL 58 HG11 VAL 58 -2.246 1.788 -3.246 426 HG12 VAL 58 HG12 VAL 58 -2.346 3.282 -4.176 427 HG13 VAL 58 HG13 VAL 58 -0.895 2.282 -4.262 428 HG21 VAL 58 HG21 VAL 58 -2.235 -0.466 -4.543 429 HG22 VAL 58 HG22 VAL 58 -0.900 0.163 -5.511 430 HG23 VAL 58 HG23 VAL 58 -2.374 -0.405 -6.298 431 H ARG 59 H ARG 59 -3.935 2.784 -7.257 432 HA ARG 59 HA ARG 59 -5.842 1.137 -8.751 433 HB2 ARG 59 HB2 ARG 59 -6.649 3.354 -8.588 434 HB3 ARG 59 HB3 ARG 59 -5.054 4.034 -8.863 435 HG2 ARG 59 HG2 ARG 59 -5.184 3.148 -11.205 436 HG3 ARG 59 HG3 ARG 59 -6.869 2.730 -10.880 437 HD2 ARG 59 HD2 ARG 59 -7.526 4.935 -10.738 438 HD3 ARG 59 HD3 ARG 59 -5.916 5.493 -10.284 439 HE ARG 59 HE ARG 59 -6.946 5.013 -12.946 440 HH11 ARG 59 HH11 ARG 59 -4.134 5.682 -10.912 441 HH12 ARG 59 HH12 ARG 59 -3.126 6.272 -12.128 442 HH21 ARG 59 HH21 ARG 59 -5.584 5.862 -14.731 443 HH22 ARG 59 HH22 ARG 59 -4.010 6.415 -14.378 444 H ARG 60 H ARG 60 -5.044 -0.051 -10.211 445 HA ARG 60 HA ARG 60 -2.363 0.365 -11.424 446 HB2 ARG 60 HB2 ARG 60 -2.486 -1.639 -10.025 447 HB3 ARG 60 HB3 ARG 60 -3.999 -2.099 -10.784 448 HG2 ARG 60 HG2 ARG 60 -2.757 -2.232 -12.916 449 HG3 ARG 60 HG3 ARG 60 -1.240 -2.140 -11.992 450 HD2 ARG 60 HD2 ARG 60 -1.672 -4.486 -12.299 451 HD3 ARG 60 HD3 ARG 60 -2.186 -4.137 -10.645 452 HE ARG 60 HE ARG 60 -4.268 -3.882 -12.602 453 HH11 ARG 60 HH11 ARG 60 -2.661 -6.336 -10.498 454 HH12 ARG 60 HH12 ARG 60 -3.975 -7.367 -10.535 455 HH21 ARG 60 HH21 ARG 60 -6.075 -5.400 -12.567 456 HH22 ARG 60 HH22 ARG 60 -5.935 -6.852 -11.701 457 H ALA 61 H ALA 61 -2.609 1.151 -13.329 458 HA ALA 61 HA ALA 61 -3.236 1.560 -15.441 459 HB1 ALA 61 HB1 ALA 61 -2.881 -0.877 -15.695 460 HB2 ALA 61 HB2 ALA 61 -4.097 -0.247 -16.801 461 HB3 ALA 61 HB3 ALA 61 -4.592 -1.136 -15.359 462 H GLY 62 H GLY 62 -5.827 0.120 -13.789 463 HA2 GLY 62 HA2 GLY 62 -7.605 2.318 -13.856 464 HA3 GLY 62 HA3 GLY 62 -8.020 1.241 -15.184 465 H GLY 63 H GLY 63 -6.713 -0.421 -12.400 466 HA2 GLY 63 HA2 GLY 63 -9.437 -0.928 -11.450 467 HA3 GLY 63 HA3 GLY 63 -8.269 -2.226 -11.698 468 H VAL 64 H VAL 64 -9.551 -1.551 -9.232 469 HA VAL 64 HA VAL 64 -7.418 -0.284 -7.683 470 HB VAL 64 HB VAL 64 -10.186 -1.195 -6.809 471 HG11 VAL 64 HG11 VAL 64 -9.800 0.193 -4.818 472 HG12 VAL 64 HG12 VAL 64 -8.164 0.532 -5.387 473 HG13 VAL 64 HG13 VAL 64 -8.623 -1.113 -4.955 474 HG21 VAL 64 HG21 VAL 64 -10.355 0.615 -8.430 475 HG22 VAL 64 HG22 VAL 64 -9.217 1.584 -7.491 476 HG23 VAL 64 HG23 VAL 64 -10.797 1.189 -6.821 477 H VAL 65 H VAL 65 -6.014 -1.525 -6.690 478 HA VAL 65 HA VAL 65 -6.646 -4.321 -6.141 479 HB VAL 65 HB VAL 65 -4.396 -4.954 -7.040 480 HG11 VAL 65 HG11 VAL 65 -5.104 -5.003 -9.400 481 HG12 VAL 65 HG12 VAL 65 -6.361 -3.822 -9.036 482 HG13 VAL 65 HG13 VAL 65 -6.428 -5.431 -8.315 483 HG21 VAL 65 HG21 VAL 65 -3.382 -2.732 -7.082 484 HG22 VAL 65 HG22 VAL 65 -4.535 -2.230 -8.319 485 HG23 VAL 65 HG23 VAL 65 -3.337 -3.469 -8.689 486 H ILE 66 H ILE 66 -5.007 -5.343 -4.853 487 HA ILE 66 HA ILE 66 -3.561 -3.501 -3.082 488 HB ILE 66 HB ILE 66 -4.863 -6.134 -2.243 489 HG12 ILE 66 HG12 ILE 66 -6.228 -4.609 -0.656 490 HG13 ILE 66 HG13 ILE 66 -5.747 -3.286 -1.701 491 HG21 ILE 66 HG21 ILE 66 -4.229 -5.508 0.040 492 HG22 ILE 66 HG22 ILE 66 -3.388 -4.094 -0.601 493 HG23 ILE 66 HG23 ILE 66 -2.838 -5.714 -1.026 494 HD11 ILE 66 HD11 ILE 66 -6.894 -4.378 -3.578 495 HD12 ILE 66 HD12 ILE 66 -7.987 -4.067 -2.231 496 HD13 ILE 66 HD13 ILE 66 -7.375 -5.694 -2.510 497 HA PRO 67 HA PRO 67 -0.196 -6.023 -4.775 498 HB2 PRO 67 HB2 PRO 67 1.335 -4.910 -2.516 499 HB3 PRO 67 HB3 PRO 67 1.666 -4.828 -4.250 500 HG2 PRO 67 HG2 PRO 67 0.826 -2.673 -2.923 501 HG3 PRO 67 HG3 PRO 67 0.253 -3.017 -4.567 502 HD2 PRO 67 HD2 PRO 67 -1.133 -3.455 -1.948 503 HD3 PRO 67 HD3 PRO 67 -1.769 -2.824 -3.486 504 H GLN 68 H GLN 68 0.592 -8.010 -4.430 505 HA GLN 68 HA GLN 68 -0.116 -9.842 -2.506 506 HB2 GLN 68 HB2 GLN 68 1.029 -10.475 -4.520 507 HB3 GLN 68 HB3 GLN 68 2.468 -9.599 -4.047 508 HG2 GLN 68 HG2 GLN 68 2.881 -11.940 -3.767 509 HG3 GLN 68 HG3 GLN 68 2.770 -11.211 -2.170 510 HE21 GLN 68 HE21 GLN 68 0.036 -11.986 -4.233 511 HE22 GLN 68 HE22 GLN 68 -0.578 -13.228 -3.221 512 H VAL 69 H VAL 69 2.604 -7.705 -2.498 513 HA VAL 69 HA VAL 69 3.935 -8.707 -0.254 514 HB VAL 69 HB VAL 69 5.226 -6.539 -0.366 515 HG11 VAL 69 HG11 VAL 69 6.228 -7.060 -2.539 516 HG12 VAL 69 HG12 VAL 69 4.834 -8.055 -2.945 517 HG13 VAL 69 HG13 VAL 69 5.904 -8.532 -1.621 518 HG21 VAL 69 HG21 VAL 69 3.406 -6.048 -2.721 519 HG22 VAL 69 HG22 VAL 69 4.789 -5.059 -2.254 520 HG23 VAL 69 HG23 VAL 69 3.364 -5.161 -1.207 521 H PHE 70 H PHE 70 1.045 -6.969 -0.279 522 HA PHE 70 HA PHE 70 1.508 -5.723 2.296 523 HB2 PHE 70 HB2 PHE 70 -0.666 -5.591 0.259 524 HB3 PHE 70 HB3 PHE 70 -1.106 -5.282 1.936 525 HD1 PHE 70 HD1 PHE 70 1.651 -4.309 -0.403 526 HD2 PHE 70 HD2 PHE 70 -1.155 -3.094 2.542 527 HE1 PHE 70 HE1 PHE 70 2.465 -1.989 -0.576 528 HE2 PHE 70 HE2 PHE 70 -0.344 -0.791 2.387 529 HZ PHE 70 HZ PHE 70 1.446 -0.224 0.839 530 H PHE 71 H PHE 71 0.854 -8.687 1.209 531 HA PHE 71 HA PHE 71 -0.534 -9.441 3.673 532 HB2 PHE 71 HB2 PHE 71 -0.625 -10.721 0.931 533 HB3 PHE 71 HB3 PHE 71 -1.190 -11.526 2.385 534 HD1 PHE 71 HD1 PHE 71 -1.786 -8.650 0.138 535 HD2 PHE 71 HD2 PHE 71 -3.319 -11.075 3.275 536 HE1 PHE 71 HE1 PHE 71 -4.012 -7.645 -0.169 537 HE2 PHE 71 HE2 PHE 71 -5.542 -10.078 2.971 538 HZ PHE 71 HZ PHE 71 -5.892 -8.361 1.250 539 H THR 72 H THR 72 0.174 -11.458 4.550 540 HA THR 72 HA THR 72 3.005 -11.883 4.229 541 HB THR 72 HB THR 72 2.657 -13.502 6.084 542 HG1 THR 72 HG1 THR 72 0.441 -13.183 7.078 543 HG21 THR 72 HG21 THR 72 2.108 -11.835 7.814 544 HG22 THR 72 HG22 THR 72 1.449 -10.771 6.567 545 HG23 THR 72 HG23 THR 72 3.171 -11.153 6.586 546 H ASN 73 H ASN 73 3.608 -14.376 4.279 547 HA ASN 73 HA ASN 73 2.772 -15.541 1.842 548 HB2 ASN 73 HB2 ASN 73 4.971 -16.007 2.914 549 HB3 ASN 73 HB3 ASN 73 4.144 -16.878 4.191 550 HD21 ASN 73 HD21 ASN 73 3.288 -17.127 0.717 551 HD22 ASN 73 HD22 ASN 73 3.793 -18.756 0.590 552 H SER 74 H SER 74 1.455 -15.698 5.021 553 HA SER 74 HA SER 74 -0.080 -18.084 4.601 554 HB2 SER 74 HB2 SER 74 0.662 -17.371 6.863 555 HB3 SER 74 HB3 SER 74 -0.357 -15.940 6.729 556 HG SER 74 HG SER 74 -2.166 -17.284 6.681 557 H GLY 75 H GLY 75 -0.363 -14.927 3.471 558 HA2 GLY 75 HA2 GLY 75 -2.041 -14.022 2.168 559 HA3 GLY 75 HA3 GLY 75 -3.042 -15.420 2.537 560 H GLN 76 H GLN 76 -1.499 -13.541 4.991 561 HA GLN 76 HA GLN 76 -4.135 -12.484 5.764 562 HB2 GLN 76 HB2 GLN 76 -2.633 -14.279 7.174 563 HB3 GLN 76 HB3 GLN 76 -2.000 -12.771 7.803 564 HG2 GLN 76 HG2 GLN 76 -4.908 -13.583 7.838 565 HG3 GLN 76 HG3 GLN 76 -3.795 -13.709 9.189 566 HE21 GLN 76 HE21 GLN 76 -3.197 -11.881 10.252 567 HE22 GLN 76 HE22 GLN 76 -4.005 -10.367 10.063 568 H VAL 77 H VAL 77 -4.070 -10.335 6.659 569 HA VAL 77 HA VAL 77 -2.186 -8.614 5.367 570 HB VAL 77 HB VAL 77 -4.219 -7.942 7.526 571 HG11 VAL 77 HG11 VAL 77 -2.558 -6.202 7.279 572 HG12 VAL 77 HG12 VAL 77 -4.105 -5.649 6.636 573 HG13 VAL 77 HG13 VAL 77 -2.823 -6.165 5.536 574 HG21 VAL 77 HG21 VAL 77 -5.704 -7.244 5.698 575 HG22 VAL 77 HG22 VAL 77 -5.333 -8.966 5.614 576 HG23 VAL 77 HG23 VAL 77 -4.529 -7.837 4.525 577 H VAL 78 H VAL 78 -0.374 -7.786 6.184 578 HA VAL 78 HA VAL 78 0.914 -8.865 8.424 579 HB VAL 78 HB VAL 78 1.449 -6.169 7.181 580 HG11 VAL 78 HG11 VAL 78 3.781 -6.506 7.900 581 HG12 VAL 78 HG12 VAL 78 3.304 -8.013 8.681 582 HG13 VAL 78 HG13 VAL 78 2.655 -6.478 9.259 583 HG21 VAL 78 HG21 VAL 78 2.556 -8.840 6.330 584 HG22 VAL 78 HG22 VAL 78 3.063 -7.264 5.718 585 HG23 VAL 78 HG23 VAL 78 1.419 -7.831 5.424 586 H LYS 79 H LYS 79 0.735 -8.419 10.514 587 HA LYS 79 HA LYS 79 -1.319 -6.813 11.548 588 HB2 LYS 79 HB2 LYS 79 -0.553 -8.757 12.740 589 HB3 LYS 79 HB3 LYS 79 1.059 -8.075 12.905 590 HG2 LYS 79 HG2 LYS 79 0.274 -6.385 14.355 591 HG3 LYS 79 HG3 LYS 79 -1.412 -6.880 14.129 592 HD2 LYS 79 HD2 LYS 79 -0.827 -9.081 15.132 593 HD3 LYS 79 HD3 LYS 79 0.801 -8.469 15.441 594 HE2 LYS 79 HE2 LYS 79 -0.616 -8.311 17.435 595 HE3 LYS 79 HE3 LYS 79 -0.118 -6.717 16.866 596 HZ1 LYS 79 HZ1 LYS 79 -2.456 -6.790 17.487 597 HZ2 LYS 79 HZ2 LYS 79 -2.768 -7.976 16.349 598 HZ3 LYS 79 HZ3 LYS 79 -2.311 -6.447 15.849 599 H SER 80 H SER 80 2.069 -6.171 11.133 600 HA SER 80 HA SER 80 1.932 -3.740 12.685 601 HB2 SER 80 HB2 SER 80 3.878 -5.128 12.858 602 HB3 SER 80 HB3 SER 80 4.197 -5.006 11.132 603 HG SER 80 HG SER 80 4.116 -2.570 11.802 604 H LEU 81 H LEU 81 1.033 -4.500 9.620 605 HA LEU 81 HA LEU 81 2.127 -2.368 8.175 606 HB2 LEU 81 HB2 LEU 81 1.515 -4.336 7.082 607 HB3 LEU 81 HB3 LEU 81 -0.170 -4.226 7.551 608 HG LEU 81 HG LEU 81 1.182 -2.287 5.657 609 HD11 LEU 81 HD11 LEU 81 0.310 -3.693 3.872 610 HD12 LEU 81 HD12 LEU 81 -0.282 -4.853 5.058 611 HD13 LEU 81 HD13 LEU 81 1.452 -4.590 4.868 612 HD21 LEU 81 HD21 LEU 81 -1.104 -1.929 4.853 613 HD22 LEU 81 HD22 LEU 81 -1.007 -1.596 6.583 614 HD23 LEU 81 HD23 LEU 81 -1.711 -3.112 6.009 615 HA PRO 82 HA PRO 82 -2.279 -0.152 8.999 616 HB2 PRO 82 HB2 PRO 82 -2.496 -1.187 11.793 617 HB3 PRO 82 HB3 PRO 82 -3.776 -0.743 10.661 618 HG2 PRO 82 HG2 PRO 82 -3.220 -3.298 11.129 619 HG3 PRO 82 HG3 PRO 82 -3.626 -2.750 9.496 620 HD2 PRO 82 HD2 PRO 82 -0.981 -3.487 10.645 621 HD3 PRO 82 HD3 PRO 82 -1.606 -3.704 8.994 622 H GLY 83 H GLY 83 0.176 -0.981 11.333 623 HA2 GLY 83 HA2 GLY 83 0.272 1.401 12.823 624 HA3 GLY 83 HA3 GLY 83 1.593 0.252 12.652 625 H LEU 84 H LEU 84 1.991 0.438 9.850 626 HA LEU 84 HA LEU 84 3.521 2.837 9.787 627 HB2 LEU 84 HB2 LEU 84 4.333 2.193 7.632 628 HB3 LEU 84 HB3 LEU 84 4.203 0.728 8.567 629 HG LEU 84 HG LEU 84 1.870 0.586 7.307 630 HD11 LEU 84 HD11 LEU 84 2.062 2.686 6.102 631 HD12 LEU 84 HD12 LEU 84 2.044 1.344 4.972 632 HD13 LEU 84 HD13 LEU 84 3.562 2.149 5.352 633 HD21 LEU 84 HD21 LEU 84 4.520 -0.176 6.072 634 HD22 LEU 84 HD22 LEU 84 2.957 -0.856 5.633 635 HD23 LEU 84 HD23 LEU 84 3.613 -1.123 7.250 636 H LEU 85 H LEU 85 0.492 1.818 8.392 637 HA LEU 85 HA LEU 85 0.056 4.099 6.821 638 HB2 LEU 85 HB2 LEU 85 -1.951 2.262 8.130 639 HB3 LEU 85 HB3 LEU 85 -2.369 3.496 6.961 640 HG LEU 85 HG LEU 85 -0.606 1.097 6.408 641 HD11 LEU 85 HD11 LEU 85 -2.937 0.482 6.764 642 HD12 LEU 85 HD12 LEU 85 -2.479 0.301 5.072 643 HD13 LEU 85 HD13 LEU 85 -3.445 1.688 5.580 644 HD21 LEU 85 HD21 LEU 85 -0.810 1.779 4.064 645 HD22 LEU 85 HD22 LEU 85 -0.012 3.027 5.020 646 HD23 LEU 85 HD23 LEU 85 -1.701 3.221 4.557 647 H THR 86 H THR 86 -0.630 3.411 10.135 648 HA THR 86 HA THR 86 -2.172 5.675 10.752 649 HB THR 86 HB THR 86 -0.281 4.140 12.563 650 HG1 THR 86 HG1 THR 86 -2.186 3.077 11.500 651 HG21 THR 86 HG21 THR 86 -0.819 6.342 13.539 652 HG22 THR 86 HG22 THR 86 -1.610 5.044 14.436 653 HG23 THR 86 HG23 THR 86 -2.535 6.033 13.302 654 H ILE 87 H ILE 87 1.384 5.312 10.940 655 HA ILE 87 HA ILE 87 1.700 7.985 11.779 656 HB ILE 87 HB ILE 87 3.393 6.447 12.463 657 HG12 ILE 87 HG12 ILE 87 4.131 8.818 11.861 658 HG13 ILE 87 HG13 ILE 87 5.391 7.624 12.127 659 HG21 ILE 87 HG21 ILE 87 3.983 5.848 9.602 660 HG22 ILE 87 HG22 ILE 87 3.339 4.762 10.832 661 HG23 ILE 87 HG23 ILE 87 4.999 5.353 10.951 662 HD11 ILE 87 HD11 ILE 87 4.413 8.642 9.456 663 HD12 ILE 87 HD12 ILE 87 5.673 7.429 9.685 664 HD13 ILE 87 HD13 ILE 87 5.931 9.082 10.247 665 H LEU 88 H LEU 88 1.912 6.498 8.594 666 HA LEU 88 HA LEU 88 2.709 8.893 7.305 667 HB2 LEU 88 HB2 LEU 88 1.521 6.359 6.303 668 HB3 LEU 88 HB3 LEU 88 1.608 7.733 5.236 669 HG LEU 88 HG LEU 88 3.426 6.328 4.758 670 HD11 LEU 88 HD11 LEU 88 5.370 7.731 5.141 671 HD12 LEU 88 HD12 LEU 88 4.493 8.624 6.375 672 HD13 LEU 88 HD13 LEU 88 3.957 8.689 4.693 673 HD21 LEU 88 HD21 LEU 88 3.477 5.068 6.851 674 HD22 LEU 88 HD22 LEU 88 4.229 6.446 7.646 675 HD23 LEU 88 HD23 LEU 88 5.081 5.593 6.350 676 H HIS 89 H HIS 89 -0.454 7.573 7.994 677 HA HIS 89 HA HIS 89 -1.871 9.532 6.560 678 HB2 HIS 89 HB2 HIS 89 -2.727 7.786 8.875 679 HB3 HIS 89 HB3 HIS 89 -3.837 8.884 8.076 680 HD1 HIS 89 HD1 HIS 89 -4.435 5.850 8.028 681 HD2 HIS 89 HD2 HIS 89 -2.284 7.827 5.068 682 HE1 HIS 89 HE1 HIS 89 -4.602 4.430 5.966 683 H ASP 90 H ASP 90 -0.512 9.471 9.747 684 HA ASP 90 HA ASP 90 -1.702 11.871 10.699 685 HB2 ASP 90 HB2 ASP 90 -0.591 10.249 12.201 686 HB3 ASP 90 HB3 ASP 90 0.957 10.637 11.460 687 H GLY 91 H GLY 91 1.035 11.158 8.689 688 HA2 GLY 91 HA2 GLY 91 2.038 13.879 8.720 689 HA3 GLY 91 HA3 GLY 91 2.683 12.529 7.793 690 H GLY 92 H GLY 92 -0.390 12.267 7.033 691 HA2 GLY 92 HA2 GLY 92 -1.869 13.276 5.529 692 HA3 GLY 92 HA3 GLY 92 -0.687 14.541 5.244 693 H TYR 93 H TYR 93 -0.008 11.112 5.016 694 HA TYR 93 HA TYR 93 0.653 11.527 2.209 695 HB2 TYR 93 HB2 TYR 93 1.533 9.480 4.227 696 HB3 TYR 93 HB3 TYR 93 1.826 9.261 2.506 697 HD1 TYR 93 HD1 TYR 93 2.307 11.891 5.142 698 HD2 TYR 93 HD2 TYR 93 3.867 9.931 1.715 699 HE1 TYR 93 HE1 TYR 93 4.356 13.231 5.308 700 HE2 TYR 93 HE2 TYR 93 5.898 11.266 1.860 701 HH TYR 93 HH TYR 93 6.660 13.305 2.768 702 H ARG 94 H ARG 94 -0.420 10.634 0.635 703 HA ARG 94 HA ARG 94 -2.712 8.977 1.240 704 HB2 ARG 94 HB2 ARG 94 -3.491 9.333 -1.007 705 HB3 ARG 94 HB3 ARG 94 -2.981 10.879 -0.359 706 HG2 ARG 94 HG2 ARG 94 -0.992 10.844 -1.676 707 HG3 ARG 94 HG3 ARG 94 -1.298 9.181 -2.192 708 HD2 ARG 94 HD2 ARG 94 -2.999 11.589 -2.809 709 HD3 ARG 94 HD3 ARG 94 -1.932 10.761 -3.948 710 HE ARG 94 HE ARG 94 -3.674 8.812 -3.037 711 HH11 ARG 94 HH11 ARG 94 -4.067 11.898 -4.766 712 HH12 ARG 94 HH12 ARG 94 -5.529 11.428 -5.489 713 HH21 ARG 94 HH21 ARG 94 -5.623 8.219 -3.963 714 HH22 ARG 94 HH22 ARG 94 -6.426 9.258 -5.049 715 H ASP 95 H ASP 95 -3.175 7.298 -0.622 716 HA ASP 95 HA ASP 95 -1.806 4.987 -0.009 717 HB2 ASP 95 HB2 ASP 95 -3.050 4.071 -1.958 718 HB3 ASP 95 HB3 ASP 95 -4.070 5.089 -0.941 719 H THR 96 H THR 96 -1.518 6.999 -2.902 720 HA THR 96 HA THR 96 0.349 5.442 -4.255 721 HB THR 96 HB THR 96 -0.131 8.419 -4.453 722 HG1 THR 96 HG1 THR 96 -1.844 6.406 -4.839 723 HG21 THR 96 HG21 THR 96 0.609 8.150 -6.777 724 HG22 THR 96 HG22 THR 96 0.849 6.418 -6.509 725 HG23 THR 96 HG23 THR 96 1.861 7.581 -5.666 726 H GLU 97 H GLU 97 0.625 8.077 -2.000 727 HA GLU 97 HA GLU 97 3.372 8.656 -2.248 728 HB2 GLU 97 HB2 GLU 97 1.477 9.062 0.060 729 HB3 GLU 97 HB3 GLU 97 3.132 9.656 0.001 730 HG2 GLU 97 HG2 GLU 97 1.063 10.382 -2.026 731 HG3 GLU 97 HG3 GLU 97 1.350 11.315 -0.554 732 H ILE 98 H ILE 98 1.553 6.482 -0.155 733 HA ILE 98 HA ILE 98 3.609 5.745 1.634 734 HB ILE 98 HB ILE 98 1.492 3.803 0.679 735 HG12 ILE 98 HG12 ILE 98 0.206 5.797 1.194 736 HG13 ILE 98 HG13 ILE 98 0.015 4.615 2.484 737 HG21 ILE 98 HG21 ILE 98 3.170 2.911 2.166 738 HG22 ILE 98 HG22 ILE 98 1.596 2.942 2.952 739 HG23 ILE 98 HG23 ILE 98 2.808 4.156 3.360 740 HD11 ILE 98 HD11 ILE 98 0.218 6.886 3.315 741 HD12 ILE 98 HD12 ILE 98 1.820 7.005 2.588 742 HD13 ILE 98 HD13 ILE 98 1.523 5.842 3.881 743 H MET 99 H MET 99 2.440 4.319 -1.373 744 HA MET 99 HA MET 99 4.331 2.225 -1.275 745 HB2 MET 99 HB2 MET 99 2.520 3.058 -3.511 746 HB3 MET 99 HB3 MET 99 3.463 1.572 -3.472 747 HG2 MET 99 HG2 MET 99 2.299 1.037 -1.318 748 HG3 MET 99 HG3 MET 99 1.245 2.403 -1.663 749 HE1 MET 99 HE1 MET 99 -0.852 1.013 -1.517 750 HE2 MET 99 HE2 MET 99 0.077 -0.425 -1.105 751 HE3 MET 99 HE3 MET 99 -1.157 -0.514 -2.365 752 H ARG 100 H ARG 100 4.570 5.419 -2.416 753 HA ARG 100 HA ARG 100 6.342 5.131 -4.572 754 HB2 ARG 100 HB2 ARG 100 6.189 7.350 -2.527 755 HB3 ARG 100 HB3 ARG 100 7.240 7.419 -3.933 756 HG2 ARG 100 HG2 ARG 100 5.323 7.325 -5.409 757 HG3 ARG 100 HG3 ARG 100 4.244 7.126 -4.029 758 HD2 ARG 100 HD2 ARG 100 4.174 9.430 -4.773 759 HD3 ARG 100 HD3 ARG 100 4.957 9.334 -3.197 760 HE ARG 100 HE ARG 100 6.905 9.243 -5.211 761 HH11 ARG 100 HH11 ARG 100 4.617 11.580 -3.785 762 HH12 ARG 100 HH12 ARG 100 5.633 12.919 -4.104 763 HH21 ARG 100 HH21 ARG 100 8.203 11.073 -5.656 764 HH22 ARG 100 HH22 ARG 100 7.691 12.645 -5.193 765 H TRP 101 H TRP 101 7.341 5.910 -1.264 766 HA TRP 101 HA TRP 101 10.016 5.189 -1.815 767 HB2 TRP 101 HB2 TRP 101 10.289 5.403 0.740 768 HB3 TRP 101 HB3 TRP 101 9.846 6.836 -0.169 769 HD1 TRP 101 HD1 TRP 101 7.473 7.910 0.315 770 HE1 TRP 101 HE1 TRP 101 5.734 7.540 2.159 771 HE3 TRP 101 HE3 TRP 101 9.263 3.535 2.269 772 HZ2 TRP 101 HZ2 TRP 101 5.192 5.655 4.172 773 HZ3 TRP 101 HZ3 TRP 101 8.074 2.524 4.135 774 HH2 TRP 101 HH2 TRP 101 6.083 3.562 5.086 775 H LEU 102 H LEU 102 7.324 3.443 -0.562 776 HA LEU 102 HA LEU 102 8.691 1.252 0.562 777 HB2 LEU 102 HB2 LEU 102 5.984 1.908 -0.183 778 HB3 LEU 102 HB3 LEU 102 6.280 0.175 -0.174 779 HG LEU 102 HG LEU 102 6.498 2.170 2.096 780 HD11 LEU 102 HD11 LEU 102 4.661 0.957 3.035 781 HD12 LEU 102 HD12 LEU 102 4.700 -0.205 1.709 782 HD13 LEU 102 HD13 LEU 102 4.241 1.468 1.394 783 HD21 LEU 102 HD21 LEU 102 8.241 0.562 2.442 784 HD22 LEU 102 HD22 LEU 102 7.148 -0.775 2.041 785 HD23 LEU 102 HD23 LEU 102 6.889 0.167 3.499 786 H PHE 103 H PHE 103 7.527 1.755 -2.759 787 HA PHE 103 HA PHE 103 8.263 -0.971 -3.354 788 HB2 PHE 103 HB2 PHE 103 6.691 1.062 -4.810 789 HB3 PHE 103 HB3 PHE 103 7.436 -0.248 -5.716 790 HD1 PHE 103 HD1 PHE 103 5.166 0.461 -2.876 791 HD2 PHE 103 HD2 PHE 103 6.481 -2.325 -5.791 792 HE1 PHE 103 HE1 PHE 103 3.289 -1.005 -2.313 793 HE2 PHE 103 HE2 PHE 103 4.618 -3.806 -5.238 794 HZ PHE 103 HZ PHE 103 3.008 -3.160 -3.531 795 H THR 104 H THR 104 9.822 1.937 -3.473 796 HA THR 104 HA THR 104 11.333 1.471 -5.841 797 HB THR 104 HB THR 104 11.861 3.332 -3.495 798 HG1 THR 104 HG1 THR 104 9.953 3.967 -4.529 799 HG21 THR 104 HG21 THR 104 13.019 3.334 -6.296 800 HG22 THR 104 HG22 THR 104 13.892 2.902 -4.827 801 HG23 THR 104 HG23 THR 104 13.318 4.553 -5.059 802 HA PRO 105 HA PRO 105 13.890 -1.674 -3.764 803 HB2 PRO 105 HB2 PRO 105 15.397 -1.544 -6.306 804 HB3 PRO 105 HB3 PRO 105 14.633 -2.938 -5.533 805 HG2 PRO 105 HG2 PRO 105 13.589 -1.851 -7.739 806 HG3 PRO 105 HG3 PRO 105 12.553 -2.468 -6.439 807 HD2 PRO 105 HD2 PRO 105 13.333 0.358 -7.061 808 HD3 PRO 105 HD3 PRO 105 11.746 -0.316 -6.613 809 H ASP 106 H ASP 106 15.625 -1.333 -2.543 810 HA ASP 106 HA ASP 106 17.323 0.945 -3.261 811 HB2 ASP 106 HB2 ASP 106 15.960 1.507 -1.351 812 HB3 ASP 106 HB3 ASP 106 16.445 0.011 -0.554 813 HA PRO 107 HA PRO 107 20.544 -2.203 -3.361 814 HB2 PRO 107 HB2 PRO 107 22.237 0.216 -3.503 815 HB3 PRO 107 HB3 PRO 107 22.176 -1.174 -4.592 816 HG2 PRO 107 HG2 PRO 107 21.174 1.199 -5.289 817 HG3 PRO 107 HG3 PRO 107 20.396 -0.319 -5.789 818 HD2 PRO 107 HD2 PRO 107 19.616 1.620 -3.660 819 HD3 PRO 107 HD3 PRO 107 18.603 0.675 -4.775 820 H SER 108 H SER 108 20.282 0.577 -1.322 821 HA SER 108 HA SER 108 22.468 -0.079 0.421 822 HB2 SER 108 HB2 SER 108 20.185 1.735 1.123 823 HB3 SER 108 HB3 SER 108 21.897 1.893 1.529 824 HG SER 108 HG SER 108 20.506 2.541 -0.762 825 H LEU 109 H LEU 109 19.349 -1.303 -0.016 826 HA LEU 109 HA LEU 109 19.130 -2.079 2.777 827 HB2 LEU 109 HB2 LEU 109 17.309 -0.709 1.912 828 HB3 LEU 109 HB3 LEU 109 17.025 -1.874 0.638 829 HG LEU 109 HG LEU 109 16.265 -3.513 2.273 830 HD11 LEU 109 HD11 LEU 109 17.676 -2.867 4.142 831 HD12 LEU 109 HD12 LEU 109 15.975 -2.893 4.613 832 HD13 LEU 109 HD13 LEU 109 16.784 -1.351 4.309 833 HD21 LEU 109 HD21 LEU 109 15.006 -0.807 2.581 834 HD22 LEU 109 HD22 LEU 109 14.254 -2.344 3.014 835 HD23 LEU 109 HD23 LEU 109 14.654 -2.000 1.326 836 H THR 110 H THR 110 19.279 -4.105 3.269 837 HA THR 110 HA THR 110 19.239 -6.154 1.177 838 HB THR 110 HB THR 110 20.948 -6.053 3.686 839 HG1 THR 110 HG1 THR 110 21.721 -4.682 2.143 840 HG21 THR 110 HG21 THR 110 20.321 -8.353 3.071 841 HG22 THR 110 HG22 THR 110 22.039 -8.065 2.779 842 HG23 THR 110 HG23 THR 110 20.903 -8.065 1.428 843 H ILE 111 H ILE 111 17.809 -7.716 1.476 844 HA ILE 111 HA ILE 111 16.424 -7.874 4.060 845 HB ILE 111 HB ILE 111 15.125 -7.707 1.323 846 HG12 ILE 111 HG12 ILE 111 15.197 -5.700 3.586 847 HG13 ILE 111 HG13 ILE 111 15.941 -5.550 2.005 848 HG21 ILE 111 HG21 ILE 111 13.844 -7.892 4.028 849 HG22 ILE 111 HG22 ILE 111 13.889 -9.150 2.777 850 HG23 ILE 111 HG23 ILE 111 13.025 -7.620 2.476 851 HD11 ILE 111 HD11 ILE 111 12.989 -5.664 2.544 852 HD12 ILE 111 HD12 ILE 111 13.739 -5.473 0.963 853 HD13 ILE 111 HD13 ILE 111 13.917 -4.212 2.178 854 H THR 112 H THR 112 15.287 -9.898 4.350 855 HA THR 112 HA THR 112 16.005 -12.116 2.599 856 HB THR 112 HB THR 112 16.296 -13.449 4.775 857 HG1 THR 112 HG1 THR 112 16.770 -12.282 6.596 858 HG21 THR 112 HG21 THR 112 18.182 -12.855 3.375 859 HG22 THR 112 HG22 THR 112 18.636 -12.710 5.078 860 HG23 THR 112 HG23 THR 112 18.248 -11.261 4.131 861 H ARG 113 H ARG 113 14.268 -13.544 2.330 862 HA ARG 113 HA ARG 113 11.842 -12.904 3.870 863 HB2 ARG 113 HB2 ARG 113 12.112 -14.091 1.114 864 HB3 ARG 113 HB3 ARG 113 10.630 -14.204 2.034 865 HG2 ARG 113 HG2 ARG 113 10.597 -11.689 2.096 866 HG3 ARG 113 HG3 ARG 113 11.945 -11.726 0.944 867 HD2 ARG 113 HD2 ARG 113 10.607 -13.032 -0.616 868 HD3 ARG 113 HD3 ARG 113 9.282 -13.081 0.535 869 HE ARG 113 HE ARG 113 10.142 -10.442 -0.367 870 HH11 ARG 113 HH11 ARG 113 7.741 -13.043 -0.645 871 HH12 ARG 113 HH12 ARG 113 6.671 -12.091 -1.580 872 HH21 ARG 113 HH21 ARG 113 8.715 -9.225 -1.545 873 HH22 ARG 113 HH22 ARG 113 7.216 -9.853 -2.118 874 H ASP 114 H ASP 114 10.380 -14.753 4.211 875 HA ASP 114 HA ASP 114 11.770 -16.888 5.483 876 HB2 ASP 114 HB2 ASP 114 8.814 -16.465 4.929 877 HB3 ASP 114 HB3 ASP 114 9.448 -17.815 5.855 878 H GLY 115 H GLY 115 12.780 -18.326 4.307 879 HA2 GLY 115 HA2 GLY 115 12.330 -20.365 2.957 880 HA3 GLY 115 HA3 GLY 115 11.484 -19.292 1.841 881 H SER 116 H SER 116 13.625 -17.233 2.600 882 HA SER 116 HA SER 116 15.841 -18.333 1.052 883 HB2 SER 116 HB2 SER 116 14.616 -15.574 0.687 884 HB3 SER 116 HB3 SER 116 16.044 -16.184 -0.153 885 HG SER 116 HG SER 116 14.418 -17.986 -0.690 886 H ARG 117 H ARG 117 17.101 -18.601 2.848 887 HA ARG 117 HA ARG 117 17.269 -16.554 4.831 888 HB2 ARG 117 HB2 ARG 117 18.844 -18.003 6.029 889 HB3 ARG 117 HB3 ARG 117 17.431 -18.899 5.532 890 HG2 ARG 117 HG2 ARG 117 19.265 -20.357 5.222 891 HG3 ARG 117 HG3 ARG 117 18.843 -19.795 3.609 892 HD2 ARG 117 HD2 ARG 117 20.675 -18.181 3.685 893 HD3 ARG 117 HD3 ARG 117 21.073 -18.683 5.324 894 HE ARG 117 HE ARG 117 21.370 -20.978 4.067 895 HH11 ARG 117 HH11 ARG 117 22.404 -17.775 2.963 896 HH12 ARG 117 HH12 ARG 117 23.765 -18.377 2.121 897 HH21 ARG 117 HH21 ARG 117 23.244 -21.752 2.970 898 HH22 ARG 117 HH22 ARG 117 24.270 -20.671 2.142 899 H ASP 118 H ASP 118 18.830 -17.081 1.921 900 HA ASP 118 HA ASP 118 21.304 -15.832 2.587 901 HB2 ASP 118 HB2 ASP 118 21.079 -17.368 0.666 902 HB3 ASP 118 HB3 ASP 118 20.043 -16.175 -0.132 903 H ALA 119 H ALA 119 21.924 -13.800 2.221 904 HA ALA 119 HA ALA 119 19.822 -11.872 2.638 905 HB1 ALA 119 HB1 ALA 119 22.800 -11.452 2.445 906 HB2 ALA 119 HB2 ALA 119 21.900 -11.776 3.925 907 HB3 ALA 119 HB3 ALA 119 21.618 -10.283 3.031 908 H VAL 120 H VAL 120 18.858 -10.707 1.118 909 HA VAL 120 HA VAL 120 20.137 -10.617 -1.504 910 HB VAL 120 HB VAL 120 17.240 -10.127 -0.759 911 HG11 VAL 120 HG11 VAL 120 18.520 -10.382 -3.479 912 HG12 VAL 120 HG12 VAL 120 17.920 -8.894 -2.752 913 HG13 VAL 120 HG13 VAL 120 16.794 -10.188 -3.160 914 HG21 VAL 120 HG21 VAL 120 16.777 -12.283 -1.848 915 HG22 VAL 120 HG22 VAL 120 17.826 -12.469 -0.443 916 HG23 VAL 120 HG23 VAL 120 18.506 -12.539 -2.069 917 H SER 121 H SER 121 21.080 -8.752 -1.945 918 HA SER 121 HA SER 121 20.282 -6.348 -0.525 919 HB2 SER 121 HB2 SER 121 22.589 -6.883 -2.420 920 HB3 SER 121 HB3 SER 121 22.321 -5.378 -1.533 921 HG SER 121 HG SER 121 22.468 -6.556 0.393 922 H ASN 122 H ASN 122 19.469 -4.581 -1.491 923 HA ASN 122 HA ASN 122 18.339 -3.344 -2.892 924 HB2 ASN 122 HB2 ASN 122 20.077 -3.625 -4.653 925 HB3 ASN 122 HB3 ASN 122 19.329 -5.127 -5.154 926 HD21 ASN 122 HD21 ASN 122 17.479 -5.063 -6.401 927 HD22 ASN 122 HD22 ASN 122 16.867 -3.634 -7.141 928 H ALA 123 H ALA 123 16.713 -4.383 -1.530 929 HA ALA 123 HA ALA 123 14.768 -5.543 -3.356 930 HB1 ALA 123 HB1 ALA 123 15.315 -7.171 -1.649 931 HB2 ALA 123 HB2 ALA 123 13.721 -6.501 -1.275 932 HB3 ALA 123 HB3 ALA 123 15.149 -5.958 -0.390 933 H ARG 124 H ARG 124 12.487 -4.906 -2.375 934 HA ARG 124 HA ARG 124 12.688 -2.026 -2.052 935 HB2 ARG 124 HB2 ARG 124 10.448 -1.886 -2.836 936 HB3 ARG 124 HB3 ARG 124 11.175 -3.139 -3.822 937 HG2 ARG 124 HG2 ARG 124 10.127 -4.822 -2.285 938 HG3 ARG 124 HG3 ARG 124 9.267 -3.483 -1.524 939 HD2 ARG 124 HD2 ARG 124 7.737 -4.263 -3.085 940 HD3 ARG 124 HD3 ARG 124 8.494 -2.915 -3.924 941 HE ARG 124 HE ARG 124 9.115 -5.743 -4.337 942 HH11 ARG 124 HH11 ARG 124 9.262 -2.418 -5.644 943 HH12 ARG 124 HH12 ARG 124 9.356 -2.926 -7.251 944 HH21 ARG 124 HH21 ARG 124 9.253 -6.411 -6.593 945 HH22 ARG 124 HH22 ARG 124 9.365 -5.236 -7.811 946 HA PRO 125 HA PRO 125 12.089 -2.112 2.315 947 HB2 PRO 125 HB2 PRO 125 9.985 -0.062 1.772 948 HB3 PRO 125 HB3 PRO 125 11.278 -0.046 2.982 949 HG2 PRO 125 HG2 PRO 125 11.538 1.367 0.767 950 HG3 PRO 125 HG3 PRO 125 12.919 0.443 1.391 951 HD2 PRO 125 HD2 PRO 125 11.140 -0.144 -0.931 952 HD3 PRO 125 HD3 PRO 125 12.876 -0.455 -0.721 953 H VAL 126 H VAL 126 9.207 -2.447 0.285 954 HA VAL 126 HA VAL 126 7.435 -3.223 2.370 955 HB VAL 126 HB VAL 126 7.242 -4.365 -0.427 956 HG11 VAL 126 HG11 VAL 126 4.856 -4.398 0.060 957 HG12 VAL 126 HG12 VAL 126 5.167 -3.683 1.638 958 HG13 VAL 126 HG13 VAL 126 5.778 -5.299 1.271 959 HG21 VAL 126 HG21 VAL 126 7.494 -1.914 -0.581 960 HG22 VAL 126 HG22 VAL 126 6.127 -1.739 0.518 961 HG23 VAL 126 HG23 VAL 126 5.892 -2.465 -1.077 962 H ASP 127 H ASP 127 9.877 -4.981 0.564 963 HA ASP 127 HA ASP 127 9.126 -7.609 1.230 964 HB2 ASP 127 HB2 ASP 127 11.830 -6.428 0.550 965 HB3 ASP 127 HB3 ASP 127 11.629 -8.126 0.947 966 H ALA 128 H ALA 128 10.761 -5.138 2.976 967 HA ALA 128 HA ALA 128 11.846 -6.804 4.993 968 HB1 ALA 128 HB1 ALA 128 12.262 -4.744 6.238 969 HB2 ALA 128 HB2 ALA 128 11.245 -3.849 5.114 970 HB3 ALA 128 HB3 ALA 128 12.757 -4.568 4.555 971 H LEU 129 H LEU 129 8.836 -4.936 4.754 972 HA LEU 129 HA LEU 129 8.064 -5.620 7.432 973 HB2 LEU 129 HB2 LEU 129 5.915 -4.591 6.952 974 HB3 LEU 129 HB3 LEU 129 7.222 -3.562 6.421 975 HG LEU 129 HG LEU 129 6.738 -4.743 4.128 976 HD11 LEU 129 HD11 LEU 129 4.348 -5.164 3.778 977 HD12 LEU 129 HD12 LEU 129 4.076 -4.893 5.506 978 HD13 LEU 129 HD13 LEU 129 5.078 -6.246 4.978 979 HD21 LEU 129 HD21 LEU 129 6.645 -2.346 4.474 980 HD22 LEU 129 HD22 LEU 129 5.082 -2.497 5.277 981 HD23 LEU 129 HD23 LEU 129 5.227 -2.859 3.560 982 H HIS 130 H HIS 130 7.484 -7.021 4.315 983 HA HIS 130 HA HIS 130 5.615 -9.008 5.091 984 HB2 HIS 130 HB2 HIS 130 5.969 -8.369 2.741 985 HB3 HIS 130 HB3 HIS 130 7.642 -8.882 2.826 986 HD1 HIS 130 HD1 HIS 130 4.141 -10.250 2.289 987 HD2 HIS 130 HD2 HIS 130 8.060 -11.646 2.616 988 HE1 HIS 130 HE1 HIS 130 4.122 -12.589 1.440 989 H ALA 131 H ALA 131 8.902 -8.581 5.576 990 HA ALA 131 HA ALA 131 9.351 -11.389 6.370 991 HB1 ALA 131 HB1 ALA 131 11.723 -10.888 6.262 992 HB2 ALA 131 HB2 ALA 131 11.361 -9.200 5.896 993 HB3 ALA 131 HB3 ALA 131 10.920 -10.465 4.750 994 H HIS 132 H HIS 132 8.178 -8.836 7.834 995 HA HIS 132 HA HIS 132 8.014 -8.033 9.938 996 HB2 HIS 132 HB2 HIS 132 9.232 -10.721 10.606 997 HB3 HIS 132 HB3 HIS 132 8.664 -9.602 11.843 998 HD1 HIS 132 HD1 HIS 132 7.427 -12.095 9.328 999 HD2 HIS 132 HD2 HIS 132 5.858 -9.266 11.942 1000 HE1 HIS 132 HE1 HIS 132 4.984 -12.562 9.455 1001 H GLN 133 H GLN 133 10.334 -7.444 8.398 1002 HA GLN 133 HA GLN 133 12.274 -6.617 10.433 1003 HB2 GLN 133 HB2 GLN 133 12.476 -6.744 7.403 1004 HB3 GLN 133 HB3 GLN 133 13.742 -6.119 8.457 1005 HG2 GLN 133 HG2 GLN 133 13.924 -8.299 9.525 1006 HG3 GLN 133 HG3 GLN 133 12.667 -8.930 8.467 1007 HE21 GLN 133 HE21 GLN 133 13.998 -10.469 7.651 1008 HE22 GLN 133 HE22 GLN 133 15.308 -10.185 6.587 1009 H ALA 134 H ALA 134 9.694 -5.662 9.998 1010 HA ALA 134 HA ALA 134 9.225 -3.459 8.435 1011 HB1 ALA 134 HB1 ALA 134 7.994 -4.019 11.116 1012 HB2 ALA 134 HB2 ALA 134 7.501 -4.755 9.591 1013 HB3 ALA 134 HB3 ALA 134 7.325 -3.014 9.829 1014 H ARG 135 H ARG 135 11.002 -3.513 11.443 1015 HA ARG 135 HA ARG 135 10.616 -0.861 12.229 1016 HB2 ARG 135 HB2 ARG 135 13.019 -2.602 12.581 1017 HB3 ARG 135 HB3 ARG 135 12.893 -1.011 13.295 1018 HG2 ARG 135 HG2 ARG 135 11.160 -3.407 13.881 1019 HG3 ARG 135 HG3 ARG 135 12.323 -2.625 14.951 1020 HD2 ARG 135 HD2 ARG 135 9.717 -1.461 13.945 1021 HD3 ARG 135 HD3 ARG 135 10.079 -1.981 15.578 1022 HE ARG 135 HE ARG 135 11.960 -0.048 14.911 1023 HH11 ARG 135 HH11 ARG 135 8.445 -0.194 15.409 1024 HH12 ARG 135 HH12 ARG 135 8.313 1.434 15.865 1025 HH21 ARG 135 HH21 ARG 135 11.749 2.189 15.545 1026 HH22 ARG 135 HH22 ARG 135 10.204 2.823 15.899 1027 H GLU 136 H GLU 136 12.891 -2.075 9.810 1028 HA GLU 136 HA GLU 136 14.159 0.439 9.451 1029 HB2 GLU 136 HB2 GLU 136 13.892 -1.949 7.660 1030 HB3 GLU 136 HB3 GLU 136 14.825 -0.523 7.188 1031 HG2 GLU 136 HG2 GLU 136 15.313 -2.342 9.535 1032 HG3 GLU 136 HG3 GLU 136 16.272 -2.246 8.059 1033 H VAL 137 H VAL 137 11.280 -0.978 8.205 1034 HA VAL 137 HA VAL 137 10.729 0.904 6.134 1035 HB VAL 137 HB VAL 137 8.781 -0.776 7.743 1036 HG11 VAL 137 HG11 VAL 137 7.296 -0.571 5.806 1037 HG12 VAL 137 HG12 VAL 137 8.478 0.480 5.024 1038 HG13 VAL 137 HG13 VAL 137 7.678 1.004 6.505 1039 HG21 VAL 137 HG21 VAL 137 10.199 -1.428 5.169 1040 HG22 VAL 137 HG22 VAL 137 8.932 -2.403 5.912 1041 HG23 VAL 137 HG23 VAL 137 10.476 -2.178 6.738 1042 H VAL 138 H VAL 138 9.618 0.489 9.457 1043 HA VAL 138 HA VAL 138 8.062 2.797 9.706 1044 HB VAL 138 HB VAL 138 9.682 1.420 11.883 1045 HG11 VAL 138 HG11 VAL 138 7.309 3.269 12.109 1046 HG12 VAL 138 HG12 VAL 138 8.967 3.645 12.574 1047 HG13 VAL 138 HG13 VAL 138 8.066 2.404 13.447 1048 HG21 VAL 138 HG21 VAL 138 8.145 -0.117 10.778 1049 HG22 VAL 138 HG22 VAL 138 6.814 1.010 11.035 1050 HG23 VAL 138 HG23 VAL 138 7.597 0.239 12.416 1051 H ARG 139 H ARG 139 11.481 2.260 10.274 1052 HA ARG 139 HA ARG 139 12.267 4.754 11.251 1053 HB2 ARG 139 HB2 ARG 139 13.785 2.901 11.288 1054 HB3 ARG 139 HB3 ARG 139 13.698 2.715 9.547 1055 HG2 ARG 139 HG2 ARG 139 14.837 4.911 9.319 1056 HG3 ARG 139 HG3 ARG 139 15.023 4.937 11.075 1057 HD2 ARG 139 HD2 ARG 139 16.377 2.974 11.037 1058 HD3 ARG 139 HD3 ARG 139 16.017 2.698 9.329 1059 HE ARG 139 HE ARG 139 17.281 5.204 9.966 1060 HH11 ARG 139 HH11 ARG 139 17.874 1.779 9.022 1061 HH12 ARG 139 HH12 ARG 139 19.306 2.147 8.203 1062 HH21 ARG 139 HH21 ARG 139 19.286 5.633 8.820 1063 HH22 ARG 139 HH22 ARG 139 20.137 4.355 8.089 1064 H ARG 140 H ARG 140 12.088 3.607 7.889 1065 HA ARG 140 HA ARG 140 12.951 6.042 6.764 1066 HB2 ARG 140 HB2 ARG 140 11.482 3.730 5.516 1067 HB3 ARG 140 HB3 ARG 140 12.137 5.090 4.611 1068 HG2 ARG 140 HG2 ARG 140 14.390 4.531 5.448 1069 HG3 ARG 140 HG3 ARG 140 13.702 3.144 6.288 1070 HD2 ARG 140 HD2 ARG 140 12.942 2.241 4.200 1071 HD3 ARG 140 HD3 ARG 140 13.620 3.601 3.313 1072 HE ARG 140 HE ARG 140 15.411 2.018 4.983 1073 HH11 ARG 140 HH11 ARG 140 14.348 2.798 1.645 1074 HH12 ARG 140 HH12 ARG 140 15.764 2.161 0.957 1075 HH21 ARG 140 HH21 ARG 140 17.367 1.154 3.901 1076 HH22 ARG 140 HH22 ARG 140 17.458 1.273 2.205 1077 H ALA 141 H ALA 141 9.829 4.732 7.572 1078 HA ALA 141 HA ALA 141 8.238 6.646 6.254 1079 HB1 ALA 141 HB1 ALA 141 6.463 5.874 7.768 1080 HB2 ALA 141 HB2 ALA 141 7.665 4.950 8.677 1081 HB3 ALA 141 HB3 ALA 141 7.322 4.547 6.991 1082 H GLN 142 H GLN 142 9.384 6.419 9.613 1083 HA GLN 142 HA GLN 142 8.274 8.783 10.636 1084 HB2 GLN 142 HB2 GLN 142 10.925 7.526 11.394 1085 HB3 GLN 142 HB3 GLN 142 10.040 8.697 12.355 1086 HG2 GLN 142 HG2 GLN 142 9.085 5.924 11.665 1087 HG3 GLN 142 HG3 GLN 142 9.833 6.388 13.183 1088 HE21 GLN 142 HE21 GLN 142 8.450 8.917 13.400 1089 HE22 GLN 142 HE22 GLN 142 6.809 8.560 13.765 1090 H ALA 143 H ALA 143 11.296 8.186 8.957 1091 HA ALA 143 HA ALA 143 12.371 10.794 9.189 1092 HB1 ALA 143 HB1 ALA 143 13.731 8.808 8.731 1093 HB2 ALA 143 HB2 ALA 143 13.972 10.054 7.506 1094 HB3 ALA 143 HB3 ALA 143 12.964 8.649 7.155 1095 H MET 144 H MET 144 10.222 9.276 6.932 1096 HA MET 144 HA MET 144 10.454 11.292 4.913 1097 HB2 MET 144 HB2 MET 144 9.822 8.920 4.470 1098 HB3 MET 144 HB3 MET 144 8.317 9.200 5.320 1099 HG2 MET 144 HG2 MET 144 7.910 9.279 2.962 1100 HG3 MET 144 HG3 MET 144 7.707 10.894 3.633 1101 HE1 MET 144 HE1 MET 144 11.140 9.049 2.860 1102 HE2 MET 144 HE2 MET 144 11.406 9.559 1.197 1103 HE3 MET 144 HE3 MET 144 10.054 8.495 1.585 1104 H ALA 145 H ALA 145 8.047 10.483 7.391 1105 HA ALA 145 HA ALA 145 6.308 12.612 6.550 1106 HB1 ALA 145 HB1 ALA 145 5.417 10.473 7.338 1107 HB2 ALA 145 HB2 ALA 145 4.786 11.847 8.251 1108 HB3 ALA 145 HB3 ALA 145 6.039 10.824 8.950 1109 H TYR 146 H TYR 146 8.706 12.259 9.103 1110 HA TYR 146 HA TYR 146 7.809 14.859 10.076 1111 HB2 TYR 146 HB2 TYR 146 9.396 12.742 11.543 1112 HB3 TYR 146 HB3 TYR 146 8.986 14.325 12.196 1113 HD1 TYR 146 HD1 TYR 146 6.621 14.840 12.752 1114 HD2 TYR 146 HD2 TYR 146 7.823 10.973 11.478 1115 HE1 TYR 146 HE1 TYR 146 4.507 13.911 13.591 1116 HE2 TYR 146 HE2 TYR 146 5.725 10.040 12.302 1117 HH TYR 146 HH TYR 146 3.053 11.882 13.090 Start of MODEL 15 1 H MET 1 H MET 1 -31.292 19.543 20.765 2 HA MET 1 HA MET 1 -29.396 19.116 22.278 3 HB2 MET 1 HB2 MET 1 -29.660 17.637 20.346 4 HB3 MET 1 HB3 MET 1 -28.877 18.812 19.304 5 HG2 MET 1 HG2 MET 1 -26.771 18.495 20.494 6 HG3 MET 1 HG3 MET 1 -27.547 17.346 21.577 7 HE1 MET 1 HE1 MET 1 -25.551 15.645 21.005 8 HE2 MET 1 HE2 MET 1 -24.852 16.796 19.868 9 HE3 MET 1 HE3 MET 1 -25.147 15.130 19.365 10 HA PRO 2 HA PRO 2 -26.506 22.500 22.122 11 HB2 PRO 2 HB2 PRO 2 -25.002 21.777 24.271 12 HB3 PRO 2 HB3 PRO 2 -26.567 22.573 24.439 13 HG2 PRO 2 HG2 PRO 2 -25.866 19.706 24.794 14 HG3 PRO 2 HG3 PRO 2 -27.060 20.688 25.656 15 HD2 PRO 2 HD2 PRO 2 -27.634 18.896 23.624 16 HD3 PRO 2 HD3 PRO 2 -28.692 20.225 24.132 17 H GLY 3 H GLY 3 -25.509 21.951 20.223 18 HA2 GLY 3 HA2 GLY 3 -23.677 19.749 20.063 19 HA3 GLY 3 HA3 GLY 3 -24.010 20.936 18.805 20 H ARG 4 H ARG 4 -22.052 20.075 21.449 21 HA ARG 4 HA ARG 4 -20.692 22.558 21.700 22 HB2 ARG 4 HB2 ARG 4 -20.113 19.784 22.682 23 HB3 ARG 4 HB3 ARG 4 -18.972 21.095 22.907 24 HG2 ARG 4 HG2 ARG 4 -20.650 22.316 24.208 25 HG3 ARG 4 HG3 ARG 4 -21.794 20.991 23.962 26 HD2 ARG 4 HD2 ARG 4 -20.625 20.908 26.166 27 HD3 ARG 4 HD3 ARG 4 -20.383 19.467 25.181 28 HE ARG 4 HE ARG 4 -18.289 21.202 24.633 29 HH11 ARG 4 HH11 ARG 4 -19.436 19.521 27.541 30 HH12 ARG 4 HH12 ARG 4 -17.863 19.178 28.105 31 HH21 ARG 4 HH21 ARG 4 -16.157 20.716 25.424 32 HH22 ARG 4 HH22 ARG 4 -15.982 19.890 26.904 33 H ALA 5 H ALA 5 -18.915 23.238 20.726 34 HA ALA 5 HA ALA 5 -17.939 21.747 18.462 35 HB1 ALA 5 HB1 ALA 5 -17.162 24.456 19.573 36 HB2 ALA 5 HB2 ALA 5 -18.274 24.164 18.232 37 HB3 ALA 5 HB3 ALA 5 -16.563 23.770 18.061 38 HA PRO 6 HA PRO 6 -14.870 19.976 21.170 39 HB2 PRO 6 HB2 PRO 6 -13.431 18.656 19.265 40 HB3 PRO 6 HB3 PRO 6 -14.968 18.057 19.895 41 HG2 PRO 6 HG2 PRO 6 -14.407 19.510 17.347 42 HG3 PRO 6 HG3 PRO 6 -15.509 18.157 17.649 43 HD2 PRO 6 HD2 PRO 6 -16.332 20.742 17.434 44 HD3 PRO 6 HD3 PRO 6 -17.181 19.531 18.413 45 H GLY 7 H GLY 7 -12.746 20.408 21.725 46 HA2 GLY 7 HA2 GLY 7 -11.629 22.791 20.547 47 HA3 GLY 7 HA3 GLY 7 -11.032 21.962 21.979 48 H SER 8 H SER 8 -11.572 20.977 18.659 49 HA SER 8 HA SER 8 -9.001 20.895 17.681 50 HB2 SER 8 HB2 SER 8 -8.604 19.095 19.381 51 HB3 SER 8 HB3 SER 8 -9.973 18.197 18.732 52 HG SER 8 HG SER 8 -7.399 18.416 17.816 53 H THR 9 H THR 9 -9.307 20.680 15.532 54 HA THR 9 HA THR 9 -11.877 20.234 14.461 55 HB THR 9 HB THR 9 -9.179 20.122 13.052 56 HG1 THR 9 HG1 THR 9 -9.261 22.133 13.872 57 HG21 THR 9 HG21 THR 9 -11.957 20.694 12.052 58 HG22 THR 9 HG22 THR 9 -11.039 19.235 11.719 59 HG23 THR 9 HG23 THR 9 -10.499 20.792 11.072 60 H LEU 10 H LEU 10 -12.793 18.327 13.841 61 HA LEU 10 HA LEU 10 -11.776 15.942 14.887 62 HB2 LEU 10 HB2 LEU 10 -13.911 16.306 12.803 63 HB3 LEU 10 HB3 LEU 10 -13.589 14.822 13.672 64 HG LEU 10 HG LEU 10 -14.645 17.397 14.826 65 HD11 LEU 10 HD11 LEU 10 -16.620 16.026 15.293 66 HD12 LEU 10 HD12 LEU 10 -15.835 14.675 14.460 67 HD13 LEU 10 HD13 LEU 10 -16.263 16.136 13.565 68 HD21 LEU 10 HD21 LEU 10 -14.855 16.119 16.933 69 HD22 LEU 10 HD22 LEU 10 -13.173 16.352 16.448 70 HD23 LEU 10 HD23 LEU 10 -13.961 14.799 16.185 71 H ALA 11 H ALA 11 -10.945 14.148 13.970 72 HA ALA 11 HA ALA 11 -9.383 14.674 11.588 73 HB1 ALA 11 HB1 ALA 11 -8.211 12.592 12.166 74 HB2 ALA 11 HB2 ALA 11 -9.338 12.331 13.499 75 HB3 ALA 11 HB3 ALA 11 -8.239 13.711 13.532 76 H ARG 12 H ARG 12 -9.568 13.431 9.751 77 HA ARG 12 HA ARG 12 -12.015 11.864 9.659 78 HB2 ARG 12 HB2 ARG 12 -11.918 12.203 7.145 79 HB3 ARG 12 HB3 ARG 12 -12.294 13.617 8.109 80 HG2 ARG 12 HG2 ARG 12 -10.020 14.427 7.839 81 HG3 ARG 12 HG3 ARG 12 -9.599 12.972 6.928 82 HD2 ARG 12 HD2 ARG 12 -10.072 14.952 5.497 83 HD3 ARG 12 HD3 ARG 12 -11.119 13.574 5.171 84 HE ARG 12 HE ARG 12 -12.763 14.737 6.654 85 HH11 ARG 12 HH11 ARG 12 -10.423 16.619 4.732 86 HH12 ARG 12 HH12 ARG 12 -11.456 17.968 4.629 87 HH21 ARG 12 HH21 ARG 12 -14.139 16.605 6.435 88 HH22 ARG 12 HH22 ARG 12 -13.553 17.970 5.599 89 H VAL 13 H VAL 13 -11.393 9.979 10.277 90 HA VAL 13 HA VAL 13 -9.218 8.692 8.808 91 HB VAL 13 HB VAL 13 -10.662 7.631 11.248 92 HG11 VAL 13 HG11 VAL 13 -8.717 6.132 11.474 93 HG12 VAL 13 HG12 VAL 13 -8.047 6.800 9.984 94 HG13 VAL 13 HG13 VAL 13 -9.566 5.903 9.945 95 HG21 VAL 13 HG21 VAL 13 -8.719 8.323 12.591 96 HG22 VAL 13 HG22 VAL 13 -9.539 9.705 11.867 97 HG23 VAL 13 HG23 VAL 13 -8.027 9.109 11.176 98 H GLY 14 H GLY 14 -10.490 8.526 6.961 99 HA2 GLY 14 HA2 GLY 14 -12.507 6.427 7.136 100 HA3 GLY 14 HA3 GLY 14 -12.741 7.864 6.142 101 H SER 15 H SER 15 -12.960 6.391 4.446 102 HA SER 15 HA SER 15 -11.137 4.494 3.597 103 HB2 SER 15 HB2 SER 15 -12.921 6.175 1.854 104 HB3 SER 15 HB3 SER 15 -12.272 4.580 1.469 105 HG SER 15 HG SER 15 -14.324 5.323 3.204 106 H ILE 16 H ILE 16 -9.153 4.629 3.052 107 HA ILE 16 HA ILE 16 -7.871 7.035 2.255 108 HB ILE 16 HB ILE 16 -6.890 4.139 2.289 109 HG12 ILE 16 HG12 ILE 16 -5.372 5.007 4.162 110 HG13 ILE 16 HG13 ILE 16 -6.359 6.451 4.167 111 HG21 ILE 16 HG21 ILE 16 -5.218 6.582 1.741 112 HG22 ILE 16 HG22 ILE 16 -5.652 5.329 0.581 113 HG23 ILE 16 HG23 ILE 16 -4.613 4.939 1.952 114 HD11 ILE 16 HD11 ILE 16 -6.979 4.922 5.947 115 HD12 ILE 16 HD12 ILE 16 -7.316 3.660 4.762 116 HD13 ILE 16 HD13 ILE 16 -8.304 5.122 4.799 117 HA PRO 17 HA PRO 17 -8.896 6.609 -2.082 118 HB2 PRO 17 HB2 PRO 17 -7.131 8.402 -3.089 119 HB3 PRO 17 HB3 PRO 17 -8.590 8.899 -2.220 120 HG2 PRO 17 HG2 PRO 17 -5.777 8.666 -1.219 121 HG3 PRO 17 HG3 PRO 17 -6.946 9.979 -0.967 122 HD2 PRO 17 HD2 PRO 17 -6.492 8.098 0.898 123 HD3 PRO 17 HD3 PRO 17 -8.102 8.805 0.656 124 H ALA 18 H ALA 18 -7.904 5.951 -4.089 125 HA ALA 18 HA ALA 18 -5.233 4.727 -3.849 126 HB1 ALA 18 HB1 ALA 18 -5.997 3.161 -5.582 127 HB2 ALA 18 HB2 ALA 18 -7.600 3.903 -5.561 128 HB3 ALA 18 HB3 ALA 18 -6.998 3.041 -4.137 129 H GLY 19 H GLY 19 -3.792 5.785 -5.133 130 HA2 GLY 19 HA2 GLY 19 -4.939 7.438 -7.264 131 HA3 GLY 19 HA3 GLY 19 -3.512 7.850 -6.333 132 H ASP 20 H ASP 20 -1.634 7.492 -7.252 133 HA ASP 20 HA ASP 20 -1.794 6.189 -9.826 134 HB2 ASP 20 HB2 ASP 20 -0.899 8.399 -9.894 135 HB3 ASP 20 HB3 ASP 20 0.346 7.975 -8.712 136 H ASP 21 H ASP 21 -1.528 4.280 -9.843 137 HA ASP 21 HA ASP 21 -0.350 2.420 -8.271 138 HB2 ASP 21 HB2 ASP 21 -1.694 1.737 -10.034 139 HB3 ASP 21 HB3 ASP 21 -0.712 2.552 -11.239 140 H VAL 22 H VAL 22 1.600 2.345 -7.456 141 HA VAL 22 HA VAL 22 3.874 3.242 -9.017 142 HB VAL 22 HB VAL 22 3.701 2.523 -6.068 143 HG11 VAL 22 HG11 VAL 22 5.944 2.008 -6.964 144 HG12 VAL 22 HG12 VAL 22 5.980 3.368 -5.848 145 HG13 VAL 22 HG13 VAL 22 6.060 3.654 -7.588 146 HG21 VAL 22 HG21 VAL 22 4.054 5.164 -7.473 147 HG22 VAL 22 HG22 VAL 22 4.072 4.926 -5.726 148 HG23 VAL 22 HG23 VAL 22 2.598 4.613 -6.643 149 H LEU 23 H LEU 23 2.537 0.232 -7.730 150 HA LEU 23 HA LEU 23 5.022 -1.020 -8.064 151 HB2 LEU 23 HB2 LEU 23 3.837 -3.265 -7.708 152 HB3 LEU 23 HB3 LEU 23 3.987 -2.157 -6.380 153 HG LEU 23 HG LEU 23 1.623 -1.667 -6.448 154 HD11 LEU 23 HD11 LEU 23 1.292 -1.810 -8.905 155 HD12 LEU 23 HD12 LEU 23 0.132 -2.803 -8.020 156 HD13 LEU 23 HD13 LEU 23 1.521 -3.555 -8.812 157 HD21 LEU 23 HD21 LEU 23 0.731 -3.896 -6.011 158 HD22 LEU 23 HD22 LEU 23 2.284 -3.594 -5.231 159 HD23 LEU 23 HD23 LEU 23 2.203 -4.592 -6.683 160 H ASP 24 H ASP 24 5.789 -2.516 -9.252 161 HA ASP 24 HA ASP 24 5.701 -2.005 -11.992 162 HB2 ASP 24 HB2 ASP 24 7.675 -2.816 -10.793 163 HB3 ASP 24 HB3 ASP 24 6.868 -4.333 -10.444 164 HA PRO 25 HA PRO 25 2.371 -4.499 -13.666 165 HB2 PRO 25 HB2 PRO 25 4.452 -5.304 -15.646 166 HB3 PRO 25 HB3 PRO 25 2.783 -4.786 -15.923 167 HG2 PRO 25 HG2 PRO 25 4.745 -3.076 -16.327 168 HG3 PRO 25 HG3 PRO 25 3.278 -2.548 -15.485 169 HD2 PRO 25 HD2 PRO 25 5.977 -3.187 -14.365 170 HD3 PRO 25 HD3 PRO 25 4.822 -1.921 -13.894 171 H ASP 26 H ASP 26 5.444 -6.060 -12.879 172 HA ASP 26 HA ASP 26 4.109 -8.635 -13.083 173 HB2 ASP 26 HB2 ASP 26 7.005 -7.901 -12.867 174 HB3 ASP 26 HB3 ASP 26 6.455 -9.543 -12.563 175 H GLU 27 H GLU 27 4.243 -6.395 -10.798 176 HA GLU 27 HA GLU 27 4.767 -8.095 -8.537 177 HB2 GLU 27 HB2 GLU 27 3.613 -5.321 -8.821 178 HB3 GLU 27 HB3 GLU 27 3.690 -6.148 -7.272 179 HG2 GLU 27 HG2 GLU 27 6.086 -5.626 -8.996 180 HG3 GLU 27 HG3 GLU 27 5.549 -4.535 -7.718 181 HA PRO 28 HA PRO 28 0.781 -9.980 -8.771 182 HB2 PRO 28 HB2 PRO 28 0.787 -11.203 -6.342 183 HB3 PRO 28 HB3 PRO 28 1.705 -11.791 -7.730 184 HG2 PRO 28 HG2 PRO 28 2.643 -10.162 -5.399 185 HG3 PRO 28 HG3 PRO 28 3.430 -11.541 -6.184 186 HD2 PRO 28 HD2 PRO 28 4.148 -8.986 -6.673 187 HD3 PRO 28 HD3 PRO 28 4.240 -10.256 -7.912 188 H THR 29 H THR 29 -1.291 -9.644 -8.047 189 HA THR 29 HA THR 29 -1.664 -7.767 -5.850 190 HB THR 29 HB THR 29 -3.516 -6.730 -7.293 191 HG1 THR 29 HG1 THR 29 -1.907 -7.779 -9.371 192 HG21 THR 29 HG21 THR 29 -1.461 -5.507 -6.741 193 HG22 THR 29 HG22 THR 29 -1.948 -5.172 -8.401 194 HG23 THR 29 HG23 THR 29 -0.622 -6.288 -8.083 195 H TYR 30 H TYR 30 -4.035 -7.577 -5.374 196 HA TYR 30 HA TYR 30 -5.610 -9.992 -5.772 197 HB2 TYR 30 HB2 TYR 30 -5.076 -8.484 -3.206 198 HB3 TYR 30 HB3 TYR 30 -6.542 -9.421 -3.450 199 HD1 TYR 30 HD1 TYR 30 -5.829 -11.859 -4.585 200 HD2 TYR 30 HD2 TYR 30 -3.585 -9.548 -1.822 201 HE1 TYR 30 HE1 TYR 30 -4.705 -13.884 -3.840 202 HE2 TYR 30 HE2 TYR 30 -2.443 -11.576 -1.050 203 HH TYR 30 HH TYR 30 -2.718 -13.945 -1.004 204 H ASP 31 H ASP 31 -7.901 -9.433 -5.441 205 HA ASP 31 HA ASP 31 -8.453 -6.630 -6.135 206 HB2 ASP 31 HB2 ASP 31 -8.335 -8.278 -8.152 207 HB3 ASP 31 HB3 ASP 31 -9.762 -9.026 -7.463 208 H LEU 32 H LEU 32 -10.939 -6.464 -5.934 209 HA LEU 32 HA LEU 32 -11.489 -6.796 -3.233 210 HB2 LEU 32 HB2 LEU 32 -13.453 -6.303 -5.474 211 HB3 LEU 32 HB3 LEU 32 -13.819 -6.110 -3.774 212 HG LEU 32 HG LEU 32 -11.808 -4.493 -5.347 213 HD11 LEU 32 HD11 LEU 32 -13.395 -2.653 -5.054 214 HD12 LEU 32 HD12 LEU 32 -14.527 -3.759 -4.276 215 HD13 LEU 32 HD13 LEU 32 -14.098 -3.985 -5.972 216 HD21 LEU 32 HD21 LEU 32 -11.703 -3.076 -3.334 217 HD22 LEU 32 HD22 LEU 32 -11.126 -4.711 -3.012 218 HD23 LEU 32 HD23 LEU 32 -12.736 -4.228 -2.484 219 HA PRO 33 HA PRO 33 -14.395 -10.536 -4.076 220 HB2 PRO 33 HB2 PRO 33 -14.055 -11.912 -6.412 221 HB3 PRO 33 HB3 PRO 33 -15.285 -10.662 -6.189 222 HG2 PRO 33 HG2 PRO 33 -12.588 -10.455 -7.471 223 HG3 PRO 33 HG3 PRO 33 -14.137 -9.784 -8.016 224 HD2 PRO 33 HD2 PRO 33 -12.313 -8.266 -6.770 225 HD3 PRO 33 HD3 PRO 33 -14.054 -8.041 -6.507 226 H ARG 34 H ARG 34 -11.113 -10.606 -5.535 227 HA ARG 34 HA ARG 34 -10.664 -13.223 -4.778 228 HB2 ARG 34 HB2 ARG 34 -9.429 -12.031 -6.592 229 HB3 ARG 34 HB3 ARG 34 -8.561 -11.141 -5.347 230 HG2 ARG 34 HG2 ARG 34 -7.305 -13.089 -6.259 231 HG3 ARG 34 HG3 ARG 34 -7.572 -13.161 -4.508 232 HD2 ARG 34 HD2 ARG 34 -9.398 -14.622 -4.766 233 HD3 ARG 34 HD3 ARG 34 -9.366 -14.459 -6.522 234 HE ARG 34 HE ARG 34 -6.995 -15.552 -6.065 235 HH11 ARG 34 HH11 ARG 34 -10.076 -16.353 -4.566 236 HH12 ARG 34 HH12 ARG 34 -9.686 -17.923 -4.115 237 HH21 ARG 34 HH21 ARG 34 -6.387 -17.752 -5.501 238 HH22 ARG 34 HH22 ARG 34 -7.497 -18.754 -4.680 239 H VAL 35 H VAL 35 -10.019 -10.150 -3.131 240 HA VAL 35 HA VAL 35 -8.501 -11.304 -1.011 241 HB VAL 35 HB VAL 35 -10.203 -8.779 -0.897 242 HG11 VAL 35 HG11 VAL 35 -9.627 -9.596 1.332 243 HG12 VAL 35 HG12 VAL 35 -8.742 -8.111 0.972 244 HG13 VAL 35 HG13 VAL 35 -7.924 -9.671 0.878 245 HG21 VAL 35 HG21 VAL 35 -7.266 -9.079 -1.487 246 HG22 VAL 35 HG22 VAL 35 -8.127 -7.551 -1.311 247 HG23 VAL 35 HG23 VAL 35 -8.517 -8.630 -2.651 248 H ALA 36 H ALA 36 -11.874 -10.660 -1.538 249 HA ALA 36 HA ALA 36 -12.926 -11.464 0.910 250 HB1 ALA 36 HB1 ALA 36 -14.206 -10.308 -0.841 251 HB2 ALA 36 HB2 ALA 36 -15.005 -11.792 -0.317 252 HB3 ALA 36 HB3 ALA 36 -14.127 -11.757 -1.850 253 H GLU 37 H GLU 37 -12.316 -13.285 -2.033 254 HA GLU 37 HA GLU 37 -13.164 -15.841 -1.242 255 HB2 GLU 37 HB2 GLU 37 -12.158 -14.629 -3.491 256 HB3 GLU 37 HB3 GLU 37 -10.840 -15.663 -3.012 257 HG2 GLU 37 HG2 GLU 37 -13.647 -16.568 -3.617 258 HG3 GLU 37 HG3 GLU 37 -12.234 -16.753 -4.649 259 H LEU 38 H LEU 38 -10.025 -14.222 -1.092 260 HA LEU 38 HA LEU 38 -8.412 -16.349 -0.260 261 HB2 LEU 38 HB2 LEU 38 -7.589 -14.237 -1.207 262 HB3 LEU 38 HB3 LEU 38 -8.103 -13.394 0.236 263 HG LEU 38 HG LEU 38 -6.487 -14.840 1.513 264 HD11 LEU 38 HD11 LEU 38 -5.467 -15.450 -1.255 265 HD12 LEU 38 HD12 LEU 38 -6.193 -16.606 -0.135 266 HD13 LEU 38 HD13 LEU 38 -4.648 -15.851 0.253 267 HD21 LEU 38 HD21 LEU 38 -4.553 -13.469 0.896 268 HD22 LEU 38 HD22 LEU 38 -6.028 -12.505 0.991 269 HD23 LEU 38 HD23 LEU 38 -5.376 -12.976 -0.582 270 H LEU 39 H LEU 39 -9.972 -13.773 1.622 271 HA LEU 39 HA LEU 39 -9.049 -14.966 4.101 272 HB2 LEU 39 HB2 LEU 39 -10.625 -12.488 3.523 273 HB3 LEU 39 HB3 LEU 39 -10.228 -13.011 5.148 274 HG LEU 39 HG LEU 39 -8.230 -12.259 3.009 275 HD11 LEU 39 HD11 LEU 39 -9.140 -10.775 5.472 276 HD12 LEU 39 HD12 LEU 39 -9.498 -10.333 3.801 277 HD13 LEU 39 HD13 LEU 39 -7.839 -10.278 4.393 278 HD21 LEU 39 HD21 LEU 39 -7.864 -12.943 5.929 279 HD22 LEU 39 HD22 LEU 39 -6.605 -12.331 4.856 280 HD23 LEU 39 HD23 LEU 39 -7.325 -13.908 4.554 281 H GLY 40 H GLY 40 -11.874 -15.137 2.208 282 HA2 GLY 40 HA2 GLY 40 -13.718 -16.488 2.569 283 HA3 GLY 40 HA3 GLY 40 -13.081 -16.872 4.170 284 H VAL 41 H VAL 41 -13.417 -13.657 3.051 285 HA VAL 41 HA VAL 41 -15.712 -13.210 4.841 286 HB VAL 41 HB VAL 41 -14.811 -11.019 5.473 287 HG11 VAL 41 HG11 VAL 41 -14.159 -12.843 6.891 288 HG12 VAL 41 HG12 VAL 41 -12.863 -11.645 6.801 289 HG13 VAL 41 HG13 VAL 41 -12.742 -13.150 5.891 290 HG21 VAL 41 HG21 VAL 41 -12.443 -11.681 3.715 291 HG22 VAL 41 HG22 VAL 41 -12.533 -10.295 4.808 292 HG23 VAL 41 HG23 VAL 41 -13.638 -10.414 3.445 293 HA PRO 42 HA PRO 42 -17.316 -11.216 1.198 294 HB2 PRO 42 HB2 PRO 42 -18.904 -9.262 2.187 295 HB3 PRO 42 HB3 PRO 42 -19.336 -10.971 2.298 296 HG2 PRO 42 HG2 PRO 42 -18.161 -9.174 4.375 297 HG3 PRO 42 HG3 PRO 42 -19.420 -10.411 4.537 298 HD2 PRO 42 HD2 PRO 42 -16.819 -10.812 5.247 299 HD3 PRO 42 HD3 PRO 42 -17.902 -12.114 4.721 300 H VAL 43 H VAL 43 -17.301 -9.218 -0.025 301 HA VAL 43 HA VAL 43 -14.896 -7.778 0.078 302 HB VAL 43 HB VAL 43 -17.467 -6.911 -1.283 303 HG11 VAL 43 HG11 VAL 43 -14.601 -6.189 -1.840 304 HG12 VAL 43 HG12 VAL 43 -15.860 -5.125 -1.204 305 HG13 VAL 43 HG13 VAL 43 -15.973 -5.739 -2.854 306 HG21 VAL 43 HG21 VAL 43 -15.248 -8.666 -2.322 307 HG22 VAL 43 HG22 VAL 43 -16.607 -8.051 -3.275 308 HG23 VAL 43 HG23 VAL 43 -16.901 -9.156 -1.930 309 H SER 44 H SER 44 -18.056 -7.177 1.362 310 HA SER 44 HA SER 44 -17.928 -4.563 2.127 311 HB2 SER 44 HB2 SER 44 -19.130 -6.879 3.607 312 HB3 SER 44 HB3 SER 44 -19.697 -5.191 3.633 313 HG SER 44 HG SER 44 -20.687 -5.532 1.819 314 H LYS 45 H LYS 45 -16.713 -7.479 3.880 315 HA LYS 45 HA LYS 45 -15.791 -5.934 6.089 316 HB2 LYS 45 HB2 LYS 45 -15.299 -8.785 5.303 317 HB3 LYS 45 HB3 LYS 45 -14.327 -8.036 6.561 318 HG2 LYS 45 HG2 LYS 45 -16.512 -7.451 7.696 319 HG3 LYS 45 HG3 LYS 45 -17.286 -8.562 6.558 320 HD2 LYS 45 HD2 LYS 45 -15.988 -10.396 7.366 321 HD3 LYS 45 HD3 LYS 45 -14.965 -9.331 8.323 322 HE2 LYS 45 HE2 LYS 45 -16.505 -10.440 9.797 323 HE3 LYS 45 HE3 LYS 45 -16.937 -8.742 9.705 324 HZ1 LYS 45 HZ1 LYS 45 -18.888 -10.129 9.612 325 HZ2 LYS 45 HZ2 LYS 45 -18.289 -10.974 8.291 326 HZ3 LYS 45 HZ3 LYS 45 -18.723 -9.351 8.140 327 H VAL 46 H VAL 46 -14.392 -6.942 3.101 328 HA VAL 46 HA VAL 46 -11.715 -6.232 3.678 329 HB VAL 46 HB VAL 46 -13.140 -6.066 0.999 330 HG11 VAL 46 HG11 VAL 46 -10.911 -6.279 0.002 331 HG12 VAL 46 HG12 VAL 46 -10.198 -6.242 1.620 332 HG13 VAL 46 HG13 VAL 46 -11.054 -4.830 1.004 333 HG21 VAL 46 HG21 VAL 46 -13.307 -8.308 1.944 334 HG22 VAL 46 HG22 VAL 46 -11.562 -8.348 2.192 335 HG23 VAL 46 HG23 VAL 46 -12.217 -8.300 0.557 336 H ALA 47 H ALA 47 -14.372 -4.402 2.310 337 HA ALA 47 HA ALA 47 -13.047 -1.955 2.039 338 HB1 ALA 47 HB1 ALA 47 -15.975 -2.464 2.544 339 HB2 ALA 47 HB2 ALA 47 -15.186 -2.460 0.968 340 HB3 ALA 47 HB3 ALA 47 -15.277 -0.975 1.913 341 H GLN 48 H GLN 48 -14.690 -3.419 4.761 342 HA GLN 48 HA GLN 48 -14.669 -1.158 6.464 343 HB2 GLN 48 HB2 GLN 48 -14.634 -4.081 7.246 344 HB3 GLN 48 HB3 GLN 48 -14.944 -2.750 8.345 345 HG2 GLN 48 HG2 GLN 48 -16.649 -3.572 6.001 346 HG3 GLN 48 HG3 GLN 48 -17.011 -3.834 7.700 347 HE21 GLN 48 HE21 GLN 48 -16.942 -1.557 5.112 348 HE22 GLN 48 HE22 GLN 48 -17.778 -0.298 5.922 349 H GLN 49 H GLN 49 -12.312 -3.705 5.893 350 HA GLN 49 HA GLN 49 -10.464 -2.920 7.911 351 HB2 GLN 49 HB2 GLN 49 -9.830 -4.278 5.280 352 HB3 GLN 49 HB3 GLN 49 -8.824 -4.272 6.717 353 HG2 GLN 49 HG2 GLN 49 -10.683 -5.472 7.884 354 HG3 GLN 49 HG3 GLN 49 -11.459 -5.629 6.327 355 HE21 GLN 49 HE21 GLN 49 -10.618 -7.010 4.802 356 HE22 GLN 49 HE22 GLN 49 -9.411 -8.198 5.167 357 H LEU 50 H LEU 50 -10.859 -2.231 4.566 358 HA LEU 50 HA LEU 50 -8.518 -0.767 4.017 359 HB2 LEU 50 HB2 LEU 50 -10.167 -1.845 2.409 360 HB3 LEU 50 HB3 LEU 50 -11.225 -0.494 2.692 361 HG LEU 50 HG LEU 50 -10.104 -0.344 0.540 362 HD11 LEU 50 HD11 LEU 50 -9.172 1.913 0.638 363 HD12 LEU 50 HD12 LEU 50 -9.158 1.815 2.397 364 HD13 LEU 50 HD13 LEU 50 -10.689 1.758 1.522 365 HD21 LEU 50 HD21 LEU 50 -8.083 -1.557 1.035 366 HD22 LEU 50 HD22 LEU 50 -7.528 -0.256 2.086 367 HD23 LEU 50 HD23 LEU 50 -7.698 0.024 0.354 368 H ARG 51 H ARG 51 -11.783 0.269 4.971 369 HA ARG 51 HA ARG 51 -11.251 3.000 4.677 370 HB2 ARG 51 HB2 ARG 51 -13.365 3.462 5.619 371 HB3 ARG 51 HB3 ARG 51 -13.501 1.968 4.694 372 HG2 ARG 51 HG2 ARG 51 -13.498 0.664 6.716 373 HG3 ARG 51 HG3 ARG 51 -13.207 2.115 7.676 374 HD2 ARG 51 HD2 ARG 51 -15.346 3.046 6.883 375 HD3 ARG 51 HD3 ARG 51 -15.644 1.544 6.010 376 HE ARG 51 HE ARG 51 -15.263 0.645 8.484 377 HH11 ARG 51 HH11 ARG 51 -17.231 3.340 7.367 378 HH12 ARG 51 HH12 ARG 51 -18.437 3.191 8.537 379 HH21 ARG 51 HH21 ARG 51 -16.869 0.399 10.124 380 HH22 ARG 51 HH22 ARG 51 -18.227 1.417 10.201 381 H GLU 52 H GLU 52 -10.446 0.898 7.248 382 HA GLU 52 HA GLU 52 -10.029 3.261 8.913 383 HB2 GLU 52 HB2 GLU 52 -10.165 0.382 9.784 384 HB3 GLU 52 HB3 GLU 52 -9.793 1.731 10.851 385 HG2 GLU 52 HG2 GLU 52 -11.990 2.747 10.176 386 HG3 GLU 52 HG3 GLU 52 -12.345 1.224 9.363 387 H GLY 53 H GLY 53 -8.348 1.946 6.716 388 HA2 GLY 53 HA2 GLY 53 -6.121 2.216 6.224 389 HA3 GLY 53 HA3 GLY 53 -5.898 2.897 7.828 390 H HIS 54 H HIS 54 -7.251 -0.269 7.260 391 HA HIS 54 HA HIS 54 -4.915 -1.385 8.613 392 HB2 HIS 54 HB2 HIS 54 -7.616 -2.634 8.010 393 HB3 HIS 54 HB3 HIS 54 -6.302 -3.462 8.836 394 HD1 HIS 54 HD1 HIS 54 -9.374 -2.108 9.781 395 HD2 HIS 54 HD2 HIS 54 -5.491 -1.466 11.136 396 HE1 HIS 54 HE1 HIS 54 -9.590 -1.193 12.094 397 H LEU 55 H LEU 55 -5.918 -0.794 5.557 398 HA LEU 55 HA LEU 55 -3.954 -2.460 4.348 399 HB2 LEU 55 HB2 LEU 55 -5.936 -3.997 4.635 400 HB3 LEU 55 HB3 LEU 55 -6.886 -2.874 3.694 401 HG LEU 55 HG LEU 55 -5.420 -3.314 1.746 402 HD11 LEU 55 HD11 LEU 55 -3.913 -5.250 1.811 403 HD12 LEU 55 HD12 LEU 55 -4.208 -5.419 3.538 404 HD13 LEU 55 HD13 LEU 55 -3.397 -3.982 2.916 405 HD21 LEU 55 HD21 LEU 55 -7.528 -4.509 2.036 406 HD22 LEU 55 HD22 LEU 55 -6.711 -5.736 3.003 407 HD23 LEU 55 HD23 LEU 55 -6.319 -5.558 1.296 408 H VAL 56 H VAL 56 -3.724 -1.692 2.011 409 HA VAL 56 HA VAL 56 -5.419 0.557 1.388 410 HB VAL 56 HB VAL 56 -3.409 1.530 2.413 411 HG11 VAL 56 HG11 VAL 56 -1.848 0.167 0.245 412 HG12 VAL 56 HG12 VAL 56 -1.788 -0.184 1.973 413 HG13 VAL 56 HG13 VAL 56 -1.205 1.365 1.365 414 HG21 VAL 56 HG21 VAL 56 -2.732 3.078 0.609 415 HG22 VAL 56 HG22 VAL 56 -4.478 2.830 0.680 416 HG23 VAL 56 HG23 VAL 56 -3.527 2.020 -0.560 417 H ALA 57 H ALA 57 -5.594 0.982 -0.823 418 HA ALA 57 HA ALA 57 -4.845 -1.281 -2.551 419 HB1 ALA 57 HB1 ALA 57 -6.999 -1.054 -3.669 420 HB2 ALA 57 HB2 ALA 57 -7.430 0.280 -2.599 421 HB3 ALA 57 HB3 ALA 57 -7.239 -1.343 -1.944 422 H VAL 58 H VAL 58 -4.897 -0.695 -4.890 423 HA VAL 58 HA VAL 58 -4.137 2.089 -5.337 424 HB VAL 58 HB VAL 58 -2.388 1.385 -6.889 425 HG11 VAL 58 HG11 VAL 58 -0.787 0.518 -5.274 426 HG12 VAL 58 HG12 VAL 58 -2.131 0.110 -4.186 427 HG13 VAL 58 HG13 VAL 58 -1.812 1.793 -4.610 428 HG21 VAL 58 HG21 VAL 58 -3.299 -0.766 -7.619 429 HG22 VAL 58 HG22 VAL 58 -3.012 -1.445 -6.015 430 HG23 VAL 58 HG23 VAL 58 -1.650 -0.961 -7.022 431 H ARG 59 H ARG 59 -4.369 2.766 -7.575 432 HA ARG 59 HA ARG 59 -6.552 1.336 -8.908 433 HB2 ARG 59 HB2 ARG 59 -7.235 3.527 -8.084 434 HB3 ARG 59 HB3 ARG 59 -5.845 4.281 -8.847 435 HG2 ARG 59 HG2 ARG 59 -6.720 3.698 -11.030 436 HG3 ARG 59 HG3 ARG 59 -8.123 2.940 -10.281 437 HD2 ARG 59 HD2 ARG 59 -8.833 5.060 -9.376 438 HD3 ARG 59 HD3 ARG 59 -7.364 5.843 -9.961 439 HE ARG 59 HE ARG 59 -8.199 5.141 -12.235 440 HH11 ARG 59 HH11 ARG 59 -10.404 6.040 -9.599 441 HH12 ARG 59 HH12 ARG 59 -11.653 6.543 -10.640 442 HH21 ARG 59 HH21 ARG 59 -9.904 5.867 -13.643 443 HH22 ARG 59 HH22 ARG 59 -11.363 6.455 -12.975 444 H ARG 60 H ARG 60 -5.974 0.379 -10.729 445 HA ARG 60 HA ARG 60 -4.085 1.640 -12.513 446 HB2 ARG 60 HB2 ARG 60 -2.800 -0.544 -12.729 447 HB3 ARG 60 HB3 ARG 60 -2.489 0.408 -11.290 448 HG2 ARG 60 HG2 ARG 60 -4.015 -1.058 -10.024 449 HG3 ARG 60 HG3 ARG 60 -4.244 -2.030 -11.477 450 HD2 ARG 60 HD2 ARG 60 -1.571 -1.525 -10.188 451 HD3 ARG 60 HD3 ARG 60 -2.571 -2.929 -9.847 452 HE ARG 60 HE ARG 60 -2.397 -3.333 -12.341 453 HH11 ARG 60 HH11 ARG 60 0.199 -1.637 -10.604 454 HH12 ARG 60 HH12 ARG 60 1.455 -2.363 -11.437 455 HH21 ARG 60 HH21 ARG 60 -0.715 -4.308 -13.540 456 HH22 ARG 60 HH22 ARG 60 0.923 -3.905 -13.212 457 H ALA 61 H ALA 61 -4.663 1.392 -14.528 458 HA ALA 61 HA ALA 61 -5.663 0.710 -16.428 459 HB1 ALA 61 HB1 ALA 61 -5.686 -2.019 -15.141 460 HB2 ALA 61 HB2 ALA 61 -4.343 -1.334 -16.056 461 HB3 ALA 61 HB3 ALA 61 -5.879 -1.678 -16.860 462 H GLY 62 H GLY 62 -7.281 1.598 -14.172 463 HA2 GLY 62 HA2 GLY 62 -9.546 2.147 -14.072 464 HA3 GLY 62 HA3 GLY 62 -9.868 0.922 -15.292 465 H GLY 63 H GLY 63 -7.964 -0.350 -12.844 466 HA2 GLY 63 HA2 GLY 63 -10.339 -1.367 -11.441 467 HA3 GLY 63 HA3 GLY 63 -8.981 -2.392 -11.904 468 H VAL 64 H VAL 64 -10.212 -1.534 -9.289 469 HA VAL 64 HA VAL 64 -7.833 -0.382 -8.051 470 HB VAL 64 HB VAL 64 -10.596 -0.871 -6.862 471 HG11 VAL 64 HG11 VAL 64 -8.234 0.639 -5.736 472 HG12 VAL 64 HG12 VAL 64 -8.847 -0.910 -5.162 473 HG13 VAL 64 HG13 VAL 64 -9.836 0.543 -5.004 474 HG21 VAL 64 HG21 VAL 64 -10.673 0.865 -8.569 475 HG22 VAL 64 HG22 VAL 64 -9.332 1.708 -7.794 476 HG23 VAL 64 HG23 VAL 64 -10.882 1.567 -6.965 477 H VAL 65 H VAL 65 -6.493 -1.721 -7.136 478 HA VAL 65 HA VAL 65 -7.407 -4.364 -6.275 479 HB VAL 65 HB VAL 65 -5.305 -5.349 -7.240 480 HG11 VAL 65 HG11 VAL 65 -7.449 -5.679 -8.373 481 HG12 VAL 65 HG12 VAL 65 -6.148 -5.508 -9.553 482 HG13 VAL 65 HG13 VAL 65 -7.236 -4.158 -9.240 483 HG21 VAL 65 HG21 VAL 65 -4.198 -4.159 -9.073 484 HG22 VAL 65 HG22 VAL 65 -4.035 -3.293 -7.537 485 HG23 VAL 65 HG23 VAL 65 -5.205 -2.751 -8.751 486 H ILE 66 H ILE 66 -5.799 -5.422 -4.945 487 HA ILE 66 HA ILE 66 -4.413 -3.447 -3.281 488 HB ILE 66 HB ILE 66 -5.515 -6.171 -2.461 489 HG12 ILE 66 HG12 ILE 66 -6.942 -4.773 -0.842 490 HG13 ILE 66 HG13 ILE 66 -6.493 -3.379 -1.806 491 HG21 ILE 66 HG21 ILE 66 -4.864 -5.586 -0.180 492 HG22 ILE 66 HG22 ILE 66 -4.131 -4.100 -0.779 493 HG23 ILE 66 HG23 ILE 66 -3.475 -5.662 -1.269 494 HD11 ILE 66 HD11 ILE 66 -8.708 -4.197 -2.381 495 HD12 ILE 66 HD12 ILE 66 -8.039 -5.784 -2.772 496 HD13 ILE 66 HD13 ILE 66 -7.603 -4.381 -3.747 497 HA PRO 67 HA PRO 67 -0.625 -5.483 -4.693 498 HB2 PRO 67 HB2 PRO 67 0.277 -4.403 -2.060 499 HB3 PRO 67 HB3 PRO 67 1.054 -4.286 -3.641 500 HG2 PRO 67 HG2 PRO 67 -0.198 -2.186 -2.647 501 HG3 PRO 67 HG3 PRO 67 -0.392 -2.595 -4.364 502 HD2 PRO 67 HD2 PRO 67 -2.276 -3.046 -2.083 503 HD3 PRO 67 HD3 PRO 67 -2.620 -2.546 -3.752 504 H GLN 68 H GLN 68 -0.337 -7.675 -4.457 505 HA GLN 68 HA GLN 68 -1.325 -9.102 -2.265 506 HB2 GLN 68 HB2 GLN 68 -1.256 -10.009 -4.474 507 HB3 GLN 68 HB3 GLN 68 0.486 -9.859 -4.536 508 HG2 GLN 68 HG2 GLN 68 0.794 -11.624 -3.009 509 HG3 GLN 68 HG3 GLN 68 -0.913 -11.635 -2.565 510 HE21 GLN 68 HE21 GLN 68 -1.837 -11.336 -5.350 511 HE22 GLN 68 HE22 GLN 68 -1.557 -12.850 -6.060 512 H VAL 69 H VAL 69 1.699 -7.656 -2.905 513 HA VAL 69 HA VAL 69 3.344 -9.132 -1.162 514 HB VAL 69 HB VAL 69 4.881 -7.200 -1.256 515 HG11 VAL 69 HG11 VAL 69 5.238 -7.209 -3.688 516 HG12 VAL 69 HG12 VAL 69 3.639 -7.918 -3.911 517 HG13 VAL 69 HG13 VAL 69 4.898 -8.829 -3.075 518 HG21 VAL 69 HG21 VAL 69 3.214 -5.416 -1.180 519 HG22 VAL 69 HG22 VAL 69 2.648 -5.865 -2.787 520 HG23 VAL 69 HG23 VAL 69 4.277 -5.218 -2.575 521 H PHE 70 H PHE 70 0.763 -7.101 -0.388 522 HA PHE 70 HA PHE 70 1.792 -6.258 2.186 523 HB2 PHE 70 HB2 PHE 70 -0.812 -5.904 0.752 524 HB3 PHE 70 HB3 PHE 70 -0.702 -5.574 2.466 525 HD1 PHE 70 HD1 PHE 70 2.123 -4.282 2.396 526 HD2 PHE 70 HD2 PHE 70 -1.357 -3.788 -0.020 527 HE1 PHE 70 HE1 PHE 70 2.788 -1.958 1.907 528 HE2 PHE 70 HE2 PHE 70 -0.701 -1.486 -0.487 529 HZ PHE 70 HZ PHE 70 1.380 -0.564 0.468 530 H PHE 71 H PHE 71 0.745 -9.084 0.995 531 HA PHE 71 HA PHE 71 -0.464 -9.919 3.532 532 HB2 PHE 71 HB2 PHE 71 -0.926 -10.999 0.742 533 HB3 PHE 71 HB3 PHE 71 -1.505 -11.777 2.206 534 HD1 PHE 71 HD1 PHE 71 -1.834 -8.791 0.064 535 HD2 PHE 71 HD2 PHE 71 -3.483 -11.038 3.277 536 HE1 PHE 71 HE1 PHE 71 -3.896 -7.474 -0.077 537 HE2 PHE 71 HE2 PHE 71 -5.549 -9.716 3.147 538 HZ PHE 71 HZ PHE 71 -5.760 -7.931 1.465 539 H THR 72 H THR 72 0.250 -11.842 4.373 540 HA THR 72 HA THR 72 2.916 -12.623 3.635 541 HB THR 72 HB THR 72 2.703 -14.127 5.604 542 HG1 THR 72 HG1 THR 72 0.711 -13.817 6.837 543 HG21 THR 72 HG21 THR 72 3.352 -11.760 5.937 544 HG22 THR 72 HG22 THR 72 2.444 -12.376 7.317 545 HG23 THR 72 HG23 THR 72 1.657 -11.330 6.143 546 H ASN 73 H ASN 73 3.242 -15.183 3.603 547 HA ASN 73 HA ASN 73 1.791 -16.192 1.414 548 HB2 ASN 73 HB2 ASN 73 2.920 -18.392 1.840 549 HB3 ASN 73 HB3 ASN 73 4.026 -17.040 1.688 550 HD21 ASN 73 HD21 ASN 73 5.591 -18.309 2.726 551 HD22 ASN 73 HD22 ASN 73 5.583 -18.568 4.433 552 H SER 74 H SER 74 1.024 -16.172 4.695 553 HA SER 74 HA SER 74 -0.766 -18.407 4.668 554 HB2 SER 74 HB2 SER 74 -0.705 -16.058 6.558 555 HB3 SER 74 HB3 SER 74 -1.291 -17.691 6.883 556 HG SER 74 HG SER 74 1.049 -18.162 6.147 557 H GLY 75 H GLY 75 -0.823 -15.324 3.313 558 HA2 GLY 75 HA2 GLY 75 -2.490 -14.256 2.140 559 HA3 GLY 75 HA3 GLY 75 -3.630 -15.479 2.697 560 H GLN 76 H GLN 76 -1.619 -13.870 4.961 561 HA GLN 76 HA GLN 76 -3.998 -12.541 6.030 562 HB2 GLN 76 HB2 GLN 76 -2.998 -14.306 7.448 563 HB3 GLN 76 HB3 GLN 76 -1.470 -13.446 7.425 564 HG2 GLN 76 HG2 GLN 76 -2.657 -13.104 9.525 565 HG3 GLN 76 HG3 GLN 76 -2.476 -11.590 8.638 566 HE21 GLN 76 HE21 GLN 76 -4.204 -10.634 9.715 567 HE22 GLN 76 HE22 GLN 76 -5.836 -11.092 9.381 568 H VAL 77 H VAL 77 -3.839 -10.394 6.563 569 HA VAL 77 HA VAL 77 -2.046 -8.736 5.164 570 HB VAL 77 HB VAL 77 -3.677 -8.052 7.641 571 HG11 VAL 77 HG11 VAL 77 -2.031 -6.349 7.053 572 HG12 VAL 77 HG12 VAL 77 -3.677 -5.771 6.789 573 HG13 VAL 77 HG13 VAL 77 -2.694 -6.292 5.418 574 HG21 VAL 77 HG21 VAL 77 -5.452 -7.322 6.105 575 HG22 VAL 77 HG22 VAL 77 -5.130 -9.050 5.961 576 HG23 VAL 77 HG23 VAL 77 -4.512 -7.933 4.744 577 H VAL 78 H VAL 78 -0.048 -7.967 5.766 578 HA VAL 78 HA VAL 78 1.430 -9.095 7.856 579 HB VAL 78 HB VAL 78 1.882 -6.373 6.585 580 HG11 VAL 78 HG11 VAL 78 4.240 -6.663 7.166 581 HG12 VAL 78 HG12 VAL 78 3.852 -8.167 7.993 582 HG13 VAL 78 HG13 VAL 78 3.212 -6.636 8.598 583 HG21 VAL 78 HG21 VAL 78 3.401 -7.483 5.054 584 HG22 VAL 78 HG22 VAL 78 1.760 -8.097 4.887 585 HG23 VAL 78 HG23 VAL 78 2.972 -9.055 5.747 586 H LYS 79 H LYS 79 1.515 -8.633 9.992 587 HA LYS 79 HA LYS 79 -0.558 -6.993 11.027 588 HB2 LYS 79 HB2 LYS 79 0.234 -7.530 13.270 589 HB3 LYS 79 HB3 LYS 79 0.095 -8.959 12.262 590 HG2 LYS 79 HG2 LYS 79 2.434 -8.943 11.860 591 HG3 LYS 79 HG3 LYS 79 2.606 -7.472 12.812 592 HD2 LYS 79 HD2 LYS 79 1.447 -10.007 13.999 593 HD3 LYS 79 HD3 LYS 79 3.182 -9.732 13.982 594 HE2 LYS 79 HE2 LYS 79 2.260 -9.112 16.149 595 HE3 LYS 79 HE3 LYS 79 2.858 -7.687 15.324 596 HZ1 LYS 79 HZ1 LYS 79 0.596 -6.991 14.885 597 HZ2 LYS 79 HZ2 LYS 79 0.744 -7.376 16.490 598 HZ3 LYS 79 HZ3 LYS 79 -0.043 -8.438 15.480 599 H SER 80 H SER 80 2.677 -6.299 10.296 600 HA SER 80 HA SER 80 2.752 -3.925 11.932 601 HB2 SER 80 HB2 SER 80 4.673 -4.962 9.860 602 HB3 SER 80 HB3 SER 80 5.006 -3.711 11.069 603 HG SER 80 HG SER 80 4.204 -5.602 12.521 604 H LEU 81 H LEU 81 1.235 -4.667 9.086 605 HA LEU 81 HA LEU 81 2.022 -2.581 7.397 606 HB2 LEU 81 HB2 LEU 81 1.033 -4.607 6.548 607 HB3 LEU 81 HB3 LEU 81 -0.477 -4.293 7.345 608 HG LEU 81 HG LEU 81 0.619 -2.605 5.072 609 HD11 LEU 81 HD11 LEU 81 0.264 -4.919 4.404 610 HD12 LEU 81 HD12 LEU 81 -0.951 -3.845 3.702 611 HD13 LEU 81 HD13 LEU 81 -1.360 -4.857 5.088 612 HD21 LEU 81 HD21 LEU 81 -1.687 -1.876 4.824 613 HD22 LEU 81 HD22 LEU 81 -1.110 -1.498 6.449 614 HD23 LEU 81 HD23 LEU 81 -2.173 -2.884 6.189 615 HA PRO 82 HA PRO 82 -2.036 -0.248 8.813 616 HB2 PRO 82 HB2 PRO 82 -2.377 -1.222 11.595 617 HB3 PRO 82 HB3 PRO 82 -3.597 -0.890 10.368 618 HG2 PRO 82 HG2 PRO 82 -2.983 -3.402 11.046 619 HG3 PRO 82 HG3 PRO 82 -3.353 -2.971 9.365 620 HD2 PRO 82 HD2 PRO 82 -0.706 -3.451 10.665 621 HD3 PRO 82 HD3 PRO 82 -1.288 -3.955 9.065 622 H GLY 83 H GLY 83 0.424 -1.235 11.043 623 HA2 GLY 83 HA2 GLY 83 0.657 1.078 12.612 624 HA3 GLY 83 HA3 GLY 83 1.944 -0.086 12.324 625 H LEU 84 H LEU 84 2.208 0.206 9.519 626 HA LEU 84 HA LEU 84 3.772 2.574 9.509 627 HB2 LEU 84 HB2 LEU 84 4.534 1.997 7.324 628 HB3 LEU 84 HB3 LEU 84 4.407 0.503 8.214 629 HG LEU 84 HG LEU 84 2.049 0.432 6.963 630 HD11 LEU 84 HD11 LEU 84 2.233 1.260 4.658 631 HD12 LEU 84 HD12 LEU 84 3.760 2.023 5.057 632 HD13 LEU 84 HD13 LEU 84 2.279 2.569 5.830 633 HD21 LEU 84 HD21 LEU 84 4.684 -0.339 5.705 634 HD22 LEU 84 HD22 LEU 84 3.106 -0.983 5.253 635 HD23 LEU 84 HD23 LEU 84 3.767 -1.300 6.861 636 H LEU 85 H LEU 85 0.689 1.666 8.125 637 HA LEU 85 HA LEU 85 0.295 4.022 6.641 638 HB2 LEU 85 HB2 LEU 85 -1.754 2.193 7.882 639 HB3 LEU 85 HB3 LEU 85 -2.127 3.465 6.737 640 HG LEU 85 HG LEU 85 -0.457 1.011 6.162 641 HD11 LEU 85 HD11 LEU 85 -2.340 0.350 4.768 642 HD12 LEU 85 HD12 LEU 85 -3.242 1.766 5.323 643 HD13 LEU 85 HD13 LEU 85 -2.791 0.499 6.466 644 HD21 LEU 85 HD21 LEU 85 -0.569 1.731 3.828 645 HD22 LEU 85 HD22 LEU 85 0.261 2.932 4.815 646 HD23 LEU 85 HD23 LEU 85 -1.412 3.198 4.309 647 H THR 86 H THR 86 -0.337 3.216 9.928 648 HA THR 86 HA THR 86 -1.896 5.429 10.678 649 HB THR 86 HB THR 86 0.055 3.851 12.380 650 HG1 THR 86 HG1 THR 86 -2.006 2.963 11.273 651 HG21 THR 86 HG21 THR 86 -0.473 6.005 13.451 652 HG22 THR 86 HG22 THR 86 -1.220 4.665 14.323 653 HG23 THR 86 HG23 THR 86 -2.196 5.684 13.260 654 H ILE 87 H ILE 87 1.668 5.092 10.757 655 HA ILE 87 HA ILE 87 1.962 7.679 11.856 656 HB ILE 87 HB ILE 87 3.660 5.972 12.297 657 HG12 ILE 87 HG12 ILE 87 4.355 8.414 12.331 658 HG13 ILE 87 HG13 ILE 87 5.664 7.246 12.211 659 HG21 ILE 87 HG21 ILE 87 5.302 5.223 10.678 660 HG22 ILE 87 HG22 ILE 87 4.441 6.104 9.423 661 HG23 ILE 87 HG23 ILE 87 3.654 4.751 10.240 662 HD11 ILE 87 HD11 ILE 87 4.532 8.887 9.948 663 HD12 ILE 87 HD12 ILE 87 5.876 7.757 9.827 664 HD13 ILE 87 HD13 ILE 87 6.038 9.220 10.802 665 H LEU 88 H LEU 88 2.164 6.498 8.526 666 HA LEU 88 HA LEU 88 2.823 9.064 7.510 667 HB2 LEU 88 HB2 LEU 88 1.620 6.697 6.141 668 HB3 LEU 88 HB3 LEU 88 1.852 8.210 5.309 669 HG LEU 88 HG LEU 88 3.633 6.925 4.665 670 HD11 LEU 88 HD11 LEU 88 5.645 7.911 5.556 671 HD12 LEU 88 HD12 LEU 88 4.741 8.541 6.927 672 HD13 LEU 88 HD13 LEU 88 4.381 9.116 5.297 673 HD21 LEU 88 HD21 LEU 88 5.061 5.611 6.152 674 HD22 LEU 88 HD22 LEU 88 3.376 5.095 6.193 675 HD23 LEU 88 HD23 LEU 88 4.025 6.072 7.506 676 H HIS 89 H HIS 89 -0.207 7.531 8.209 677 HA HIS 89 HA HIS 89 -1.911 9.413 6.998 678 HB2 HIS 89 HB2 HIS 89 -2.606 7.159 7.901 679 HB3 HIS 89 HB3 HIS 89 -2.445 7.810 9.521 680 HD1 HIS 89 HD1 HIS 89 -4.413 9.282 10.383 681 HD2 HIS 89 HD2 HIS 89 -4.816 8.051 6.433 682 HE1 HIS 89 HE1 HIS 89 -6.784 9.830 9.706 683 H ASP 90 H ASP 90 -0.221 9.364 10.055 684 HA ASP 90 HA ASP 90 -1.472 11.612 11.280 685 HB2 ASP 90 HB2 ASP 90 -0.107 9.986 12.538 686 HB3 ASP 90 HB3 ASP 90 1.317 10.501 11.649 687 H GLY 91 H GLY 91 1.136 11.219 9.011 688 HA2 GLY 91 HA2 GLY 91 1.822 14.054 9.116 689 HA3 GLY 91 HA3 GLY 91 2.677 12.817 8.205 690 H GLY 92 H GLY 92 -0.391 12.190 7.586 691 HA2 GLY 92 HA2 GLY 92 -1.921 12.714 5.952 692 HA3 GLY 92 HA3 GLY 92 -1.144 14.276 5.798 693 H TYR 93 H TYR 93 0.408 11.142 5.319 694 HA TYR 93 HA TYR 93 0.975 12.033 2.616 695 HB2 TYR 93 HB2 TYR 93 2.239 9.899 4.318 696 HB3 TYR 93 HB3 TYR 93 2.513 9.943 2.581 697 HD1 TYR 93 HD1 TYR 93 2.906 11.912 5.710 698 HD2 TYR 93 HD2 TYR 93 4.036 11.467 1.633 699 HE1 TYR 93 HE1 TYR 93 4.647 13.619 6.010 700 HE2 TYR 93 HE2 TYR 93 5.785 13.161 1.924 701 HH TYR 93 HH TYR 93 6.871 14.197 4.883 702 H ARG 94 H ARG 94 0.099 11.326 0.911 703 HA ARG 94 HA ARG 94 -2.229 9.696 1.002 704 HB2 ARG 94 HB2 ARG 94 -2.353 10.079 -1.409 705 HB3 ARG 94 HB3 ARG 94 -1.950 11.584 -0.585 706 HG2 ARG 94 HG2 ARG 94 0.375 11.272 -1.125 707 HG3 ARG 94 HG3 ARG 94 0.015 9.760 -1.955 708 HD2 ARG 94 HD2 ARG 94 -1.402 11.091 -3.539 709 HD3 ARG 94 HD3 ARG 94 -0.827 12.552 -2.730 710 HE ARG 94 HE ARG 94 1.489 11.391 -3.340 711 HH11 ARG 94 HH11 ARG 94 -1.286 12.118 -5.404 712 HH12 ARG 94 HH12 ARG 94 -0.344 12.041 -6.843 713 HH21 ARG 94 HH21 ARG 94 2.680 11.328 -5.206 714 HH22 ARG 94 HH22 ARG 94 1.965 11.621 -6.743 715 H ASP 95 H ASP 95 -2.546 7.952 -0.674 716 HA ASP 95 HA ASP 95 -1.218 5.627 0.040 717 HB2 ASP 95 HB2 ASP 95 -2.440 4.605 -1.837 718 HB3 ASP 95 HB3 ASP 95 -3.477 5.693 -0.917 719 H THR 96 H THR 96 -0.838 7.626 -2.794 720 HA THR 96 HA THR 96 0.895 5.990 -4.188 721 HB THR 96 HB THR 96 0.621 8.999 -4.394 722 HG1 THR 96 HG1 THR 96 -1.169 6.993 -4.838 723 HG21 THR 96 HG21 THR 96 2.547 7.978 -5.617 724 HG22 THR 96 HG22 THR 96 1.334 8.654 -6.715 725 HG23 THR 96 HG23 THR 96 1.415 6.911 -6.439 726 H GLU 97 H GLU 97 1.512 8.526 -1.816 727 HA GLU 97 HA GLU 97 4.319 8.552 -2.225 728 HB2 GLU 97 HB2 GLU 97 2.774 9.386 0.233 729 HB3 GLU 97 HB3 GLU 97 4.471 9.720 -0.067 730 HG2 GLU 97 HG2 GLU 97 2.120 10.757 -1.599 731 HG3 GLU 97 HG3 GLU 97 3.176 11.690 -0.528 732 H ILE 98 H ILE 98 2.141 6.693 -0.174 733 HA ILE 98 HA ILE 98 4.047 5.640 1.634 734 HB ILE 98 HB ILE 98 1.712 4.044 0.587 735 HG12 ILE 98 HG12 ILE 98 0.673 6.134 1.192 736 HG13 ILE 98 HG13 ILE 98 0.381 4.958 2.473 737 HG21 ILE 98 HG21 ILE 98 3.073 4.079 3.258 738 HG22 ILE 98 HG22 ILE 98 3.226 2.842 2.011 739 HG23 ILE 98 HG23 ILE 98 1.682 3.081 2.835 740 HD11 ILE 98 HD11 ILE 98 0.870 7.166 3.332 741 HD12 ILE 98 HD12 ILE 98 2.457 7.109 2.560 742 HD13 ILE 98 HD13 ILE 98 2.046 5.953 3.836 743 H MET 99 H MET 99 2.697 4.379 -1.352 744 HA MET 99 HA MET 99 4.415 2.116 -1.336 745 HB2 MET 99 HB2 MET 99 3.495 1.668 -3.644 746 HB3 MET 99 HB3 MET 99 2.348 1.678 -2.323 747 HG2 MET 99 HG2 MET 99 1.570 3.863 -2.962 748 HG3 MET 99 HG3 MET 99 2.809 3.972 -4.207 749 HE1 MET 99 HE1 MET 99 0.557 4.655 -5.739 750 HE2 MET 99 HE2 MET 99 -0.491 4.260 -4.371 751 HE3 MET 99 HE3 MET 99 -0.779 3.527 -5.946 752 H ARG 100 H ARG 100 4.835 5.272 -2.388 753 HA ARG 100 HA ARG 100 6.495 4.941 -4.616 754 HB2 ARG 100 HB2 ARG 100 5.359 7.023 -3.806 755 HB3 ARG 100 HB3 ARG 100 6.546 7.114 -2.530 756 HG2 ARG 100 HG2 ARG 100 8.302 7.444 -4.159 757 HG3 ARG 100 HG3 ARG 100 7.128 7.272 -5.474 758 HD2 ARG 100 HD2 ARG 100 5.855 9.169 -4.535 759 HD3 ARG 100 HD3 ARG 100 7.112 9.380 -3.321 760 HE ARG 100 HE ARG 100 8.224 9.420 -5.892 761 HH11 ARG 100 HH11 ARG 100 6.238 11.425 -3.680 762 HH12 ARG 100 HH12 ARG 100 6.683 12.874 -4.414 763 HH21 ARG 100 HH21 ARG 100 8.785 11.498 -6.892 764 HH22 ARG 100 HH22 ARG 100 8.135 12.944 -6.262 765 H TRP 101 H TRP 101 7.498 5.812 -1.304 766 HA TRP 101 HA TRP 101 10.162 4.975 -1.816 767 HB2 TRP 101 HB2 TRP 101 10.464 5.306 0.721 768 HB3 TRP 101 HB3 TRP 101 10.114 6.712 -0.266 769 HD1 TRP 101 HD1 TRP 101 7.990 8.075 0.308 770 HE1 TRP 101 HE1 TRP 101 6.204 7.935 2.130 771 HE3 TRP 101 HE3 TRP 101 9.087 3.432 2.248 772 HZ2 TRP 101 HZ2 TRP 101 5.371 6.142 4.103 773 HZ3 TRP 101 HZ3 TRP 101 7.742 2.615 4.101 774 HH2 TRP 101 HH2 TRP 101 5.916 3.930 5.012 775 H LEU 102 H LEU 102 7.432 3.381 -0.502 776 HA LEU 102 HA LEU 102 8.723 1.386 1.015 777 HB2 LEU 102 HB2 LEU 102 6.410 2.145 1.251 778 HB3 LEU 102 HB3 LEU 102 6.029 1.410 -0.282 779 HG LEU 102 HG LEU 102 6.369 -0.812 0.680 780 HD11 LEU 102 HD11 LEU 102 7.001 0.765 3.165 781 HD12 LEU 102 HD12 LEU 102 8.031 -0.438 2.355 782 HD13 LEU 102 HD13 LEU 102 6.548 -0.927 3.156 783 HD21 LEU 102 HD21 LEU 102 4.467 -0.740 2.213 784 HD22 LEU 102 HD22 LEU 102 4.187 0.225 0.749 785 HD23 LEU 102 HD23 LEU 102 4.635 1.019 2.262 786 H PHE 103 H PHE 103 7.600 1.433 -2.334 787 HA PHE 103 HA PHE 103 8.216 -1.375 -2.612 788 HB2 PHE 103 HB2 PHE 103 6.892 0.650 -4.349 789 HB3 PHE 103 HB3 PHE 103 7.483 -0.842 -5.050 790 HD1 PHE 103 HD1 PHE 103 5.258 0.387 -2.258 791 HD2 PHE 103 HD2 PHE 103 6.161 -2.679 -5.067 792 HE1 PHE 103 HE1 PHE 103 3.185 -0.775 -1.664 793 HE2 PHE 103 HE2 PHE 103 4.105 -3.830 -4.471 794 HZ PHE 103 HZ PHE 103 2.597 -2.888 -2.801 795 H THR 104 H THR 104 9.901 1.510 -3.085 796 HA THR 104 HA THR 104 11.395 0.631 -5.362 797 HB THR 104 HB THR 104 11.744 3.045 -3.576 798 HG1 THR 104 HG1 THR 104 9.914 3.497 -4.584 799 HG21 THR 104 HG21 THR 104 13.783 2.479 -4.872 800 HG22 THR 104 HG22 THR 104 13.034 3.976 -5.432 801 HG23 THR 104 HG23 THR 104 12.821 2.486 -6.352 802 HA PRO 105 HA PRO 105 14.576 -1.505 -2.917 803 HB2 PRO 105 HB2 PRO 105 16.126 -1.368 -5.424 804 HB3 PRO 105 HB3 PRO 105 15.626 -2.790 -4.501 805 HG2 PRO 105 HG2 PRO 105 14.493 -2.207 -6.856 806 HG3 PRO 105 HG3 PRO 105 13.549 -2.884 -5.519 807 HD2 PRO 105 HD2 PRO 105 13.718 -0.044 -6.461 808 HD3 PRO 105 HD3 PRO 105 12.303 -1.001 -5.960 809 H ASP 106 H ASP 106 16.154 -0.631 -1.700 810 HA ASP 106 HA ASP 106 17.416 1.815 -2.711 811 HB2 ASP 106 HB2 ASP 106 15.905 2.339 -0.884 812 HB3 ASP 106 HB3 ASP 106 16.692 1.129 0.125 813 HA PRO 107 HA PRO 107 21.256 -0.534 -2.395 814 HB2 PRO 107 HB2 PRO 107 22.394 2.192 -2.596 815 HB3 PRO 107 HB3 PRO 107 22.715 0.768 -3.589 816 HG2 PRO 107 HG2 PRO 107 21.266 2.820 -4.495 817 HG3 PRO 107 HG3 PRO 107 20.900 1.143 -4.949 818 HD2 PRO 107 HD2 PRO 107 19.509 2.950 -3.036 819 HD3 PRO 107 HD3 PRO 107 18.853 1.698 -4.118 820 H SER 108 H SER 108 20.378 2.294 -0.540 821 HA SER 108 HA SER 108 22.509 1.897 1.362 822 HB2 SER 108 HB2 SER 108 20.208 3.862 1.365 823 HB3 SER 108 HB3 SER 108 21.600 3.905 2.450 824 HG SER 108 HG SER 108 21.372 4.767 -0.129 825 H LEU 109 H LEU 109 19.648 0.342 0.861 826 HA LEU 109 HA LEU 109 19.246 -0.138 3.713 827 HB2 LEU 109 HB2 LEU 109 17.237 0.568 2.472 828 HB3 LEU 109 HB3 LEU 109 17.440 -0.786 1.377 829 HG LEU 109 HG LEU 109 17.089 -2.333 3.291 830 HD11 LEU 109 HD11 LEU 109 17.778 -0.898 5.113 831 HD12 LEU 109 HD12 LEU 109 16.128 -1.458 5.367 832 HD13 LEU 109 HD13 LEU 109 16.425 0.187 4.798 833 HD21 LEU 109 HD21 LEU 109 14.882 -0.347 2.799 834 HD22 LEU 109 HD22 LEU 109 14.686 -1.967 3.473 835 HD23 LEU 109 HD23 LEU 109 15.257 -1.765 1.814 836 H THR 110 H THR 110 19.870 -1.988 4.505 837 HA THR 110 HA THR 110 20.333 -4.265 2.738 838 HB THR 110 HB THR 110 22.150 -3.399 5.001 839 HG1 THR 110 HG1 THR 110 22.868 -2.051 3.568 840 HG21 THR 110 HG21 THR 110 22.179 -5.810 4.570 841 HG22 THR 110 HG22 THR 110 23.703 -5.083 4.060 842 HG23 THR 110 HG23 THR 110 22.482 -5.520 2.859 843 H ILE 111 H ILE 111 19.036 -5.827 3.411 844 HA ILE 111 HA ILE 111 18.493 -6.138 6.277 845 HB ILE 111 HB ILE 111 16.112 -6.700 5.630 846 HG12 ILE 111 HG12 ILE 111 16.903 -5.166 3.150 847 HG13 ILE 111 HG13 ILE 111 16.477 -6.863 3.206 848 HG21 ILE 111 HG21 ILE 111 17.026 -3.844 5.434 849 HG22 ILE 111 HG22 ILE 111 16.660 -4.772 6.899 850 HG23 ILE 111 HG23 ILE 111 15.368 -4.378 5.762 851 HD11 ILE 111 HD11 ILE 111 14.201 -6.195 3.932 852 HD12 ILE 111 HD12 ILE 111 14.651 -5.595 2.330 853 HD13 ILE 111 HD13 ILE 111 14.701 -4.513 3.716 854 H THR 112 H THR 112 17.463 -8.233 6.713 855 HA THR 112 HA THR 112 18.523 -10.185 4.851 856 HB THR 112 HB THR 112 19.526 -10.471 6.958 857 HG1 THR 112 HG1 THR 112 19.115 -12.375 6.152 858 HG21 THR 112 HG21 THR 112 16.781 -10.537 8.237 859 HG22 THR 112 HG22 THR 112 17.936 -9.213 8.348 860 HG23 THR 112 HG23 THR 112 18.311 -10.772 9.091 861 H ARG 113 H ARG 113 17.213 -11.450 3.881 862 HA ARG 113 HA ARG 113 14.393 -10.802 4.319 863 HB2 ARG 113 HB2 ARG 113 13.994 -11.490 1.974 864 HB3 ARG 113 HB3 ARG 113 15.000 -10.069 2.194 865 HG2 ARG 113 HG2 ARG 113 16.989 -11.394 1.743 866 HG3 ARG 113 HG3 ARG 113 15.999 -12.843 1.582 867 HD2 ARG 113 HD2 ARG 113 16.645 -11.790 -0.582 868 HD3 ARG 113 HD3 ARG 113 14.905 -11.975 -0.354 869 HE ARG 113 HE ARG 113 15.113 -9.527 0.473 870 HH11 ARG 113 HH11 ARG 113 16.790 -10.915 -2.338 871 HH12 ARG 113 HH12 ARG 113 16.949 -9.411 -3.123 872 HH21 ARG 113 HH21 ARG 113 15.267 -7.638 -0.546 873 HH22 ARG 113 HH22 ARG 113 16.035 -7.434 -2.089 874 H ASP 114 H ASP 114 12.805 -12.257 3.733 875 HA ASP 114 HA ASP 114 12.937 -14.758 5.002 876 HB2 ASP 114 HB2 ASP 114 10.834 -13.628 4.887 877 HB3 ASP 114 HB3 ASP 114 10.962 -13.417 3.149 878 H GLY 115 H GLY 115 13.929 -16.506 4.215 879 HA2 GLY 115 HA2 GLY 115 14.062 -18.197 2.535 880 HA3 GLY 115 HA3 GLY 115 13.872 -16.943 1.317 881 H SER 116 H SER 116 15.931 -15.600 3.490 882 HA SER 116 HA SER 116 18.293 -16.836 2.361 883 HB2 SER 116 HB2 SER 116 17.806 -14.709 1.145 884 HB3 SER 116 HB3 SER 116 17.805 -13.857 2.691 885 HG SER 116 HG SER 116 19.914 -14.899 1.210 886 H ARG 117 H ARG 117 20.087 -16.495 3.737 887 HA ARG 117 HA ARG 117 19.291 -16.364 6.575 888 HB2 ARG 117 HB2 ARG 117 21.444 -17.456 7.080 889 HB3 ARG 117 HB3 ARG 117 20.449 -18.398 5.983 890 HG2 ARG 117 HG2 ARG 117 21.797 -17.792 4.113 891 HG3 ARG 117 HG3 ARG 117 22.684 -16.606 5.066 892 HD2 ARG 117 HD2 ARG 117 23.618 -18.365 6.423 893 HD3 ARG 117 HD3 ARG 117 22.685 -19.581 5.557 894 HE ARG 117 HE ARG 117 23.974 -18.718 3.543 895 HH11 ARG 117 HH11 ARG 117 25.396 -18.724 6.816 896 HH12 ARG 117 HH12 ARG 117 26.956 -19.123 6.273 897 HH21 ARG 117 HH21 ARG 117 26.163 -19.233 2.824 898 HH22 ARG 117 HH22 ARG 117 27.415 -19.407 3.954 899 H ASP 118 H ASP 118 21.186 -14.737 4.214 900 HA ASP 118 HA ASP 118 22.651 -13.276 6.296 901 HB2 ASP 118 HB2 ASP 118 23.763 -14.546 4.277 902 HB3 ASP 118 HB3 ASP 118 23.277 -13.128 3.362 903 H ALA 119 H ALA 119 23.248 -10.990 4.895 904 HA ALA 119 HA ALA 119 20.610 -9.739 4.739 905 HB1 ALA 119 HB1 ALA 119 23.291 -8.479 5.318 906 HB2 ALA 119 HB2 ALA 119 22.082 -8.921 6.525 907 HB3 ALA 119 HB3 ALA 119 21.722 -7.670 5.342 908 H VAL 120 H VAL 120 20.015 -8.736 2.954 909 HA VAL 120 HA VAL 120 21.860 -8.762 0.685 910 HB VAL 120 HB VAL 120 18.821 -8.726 0.694 911 HG11 VAL 120 HG11 VAL 120 20.759 -9.030 -1.594 912 HG12 VAL 120 HG12 VAL 120 19.751 -7.623 -1.263 913 HG13 VAL 120 HG13 VAL 120 19.004 -9.156 -1.712 914 HG21 VAL 120 HG21 VAL 120 19.655 -10.880 1.469 915 HG22 VAL 120 HG22 VAL 120 20.711 -10.997 0.061 916 HG23 VAL 120 HG23 VAL 120 18.961 -11.034 -0.146 917 H SER 121 H SER 121 22.477 -6.838 -0.007 918 HA SER 121 HA SER 121 21.242 -4.450 1.055 919 HB2 SER 121 HB2 SER 121 23.787 -4.916 0.856 920 HB3 SER 121 HB3 SER 121 23.567 -4.608 -0.865 921 HG SER 121 HG SER 121 23.009 -2.887 1.294 922 H ASN 122 H ASN 122 20.698 -2.695 -0.469 923 HA ASN 122 HA ASN 122 19.585 -1.788 -2.244 924 HB2 ASN 122 HB2 ASN 122 21.495 -2.740 -3.615 925 HB3 ASN 122 HB3 ASN 122 20.550 -4.202 -3.829 926 HD21 ASN 122 HD21 ASN 122 20.467 -4.041 -6.037 927 HD22 ASN 122 HD22 ASN 122 19.548 -2.836 -6.859 928 H ALA 123 H ALA 123 18.222 -3.109 -0.407 929 HA ALA 123 HA ALA 123 16.331 -4.799 -1.844 930 HB1 ALA 123 HB1 ALA 123 16.714 -4.437 1.113 931 HB2 ALA 123 HB2 ALA 123 17.353 -5.770 0.147 932 HB3 ALA 123 HB3 ALA 123 15.612 -5.574 0.335 933 H ARG 124 H ARG 124 14.103 -4.504 -1.404 934 HA ARG 124 HA ARG 124 13.386 -1.680 -1.222 935 HB2 ARG 124 HB2 ARG 124 11.256 -2.393 -2.248 936 HB3 ARG 124 HB3 ARG 124 12.623 -2.940 -3.203 937 HG2 ARG 124 HG2 ARG 124 12.363 -5.152 -1.899 938 HG3 ARG 124 HG3 ARG 124 10.772 -4.535 -1.476 939 HD2 ARG 124 HD2 ARG 124 11.831 -4.941 -4.271 940 HD3 ARG 124 HD3 ARG 124 10.708 -6.004 -3.443 941 HE ARG 124 HE ARG 124 10.091 -3.221 -4.198 942 HH11 ARG 124 HH11 ARG 124 9.014 -6.606 -3.695 943 HH12 ARG 124 HH12 ARG 124 7.614 -6.380 -4.666 944 HH21 ARG 124 HH21 ARG 124 8.088 -3.075 -5.535 945 HH22 ARG 124 HH22 ARG 124 7.109 -4.502 -5.615 946 HA PRO 125 HA PRO 125 11.949 -1.992 2.985 947 HB2 PRO 125 HB2 PRO 125 9.797 -0.260 1.841 948 HB3 PRO 125 HB3 PRO 125 10.671 -0.055 3.374 949 HG2 PRO 125 HG2 PRO 125 11.340 1.401 1.319 950 HG3 PRO 125 HG3 PRO 125 12.633 0.602 2.239 951 HD2 PRO 125 HD2 PRO 125 11.463 -0.140 -0.416 952 HD3 PRO 125 HD3 PRO 125 13.154 -0.186 0.139 953 H VAL 126 H VAL 126 9.677 -2.647 0.352 954 HA VAL 126 HA VAL 126 7.608 -3.868 1.826 955 HB VAL 126 HB VAL 126 8.566 -4.576 -0.979 956 HG11 VAL 126 HG11 VAL 126 6.362 -5.578 -1.316 957 HG12 VAL 126 HG12 VAL 126 5.963 -5.278 0.377 958 HG13 VAL 126 HG13 VAL 126 7.248 -6.411 -0.037 959 HG21 VAL 126 HG21 VAL 126 6.285 -2.857 -0.056 960 HG22 VAL 126 HG22 VAL 126 6.724 -3.191 -1.731 961 HG23 VAL 126 HG23 VAL 126 7.823 -2.268 -0.692 962 H ASP 127 H ASP 127 10.636 -5.130 0.651 963 HA ASP 127 HA ASP 127 10.207 -7.864 1.262 964 HB2 ASP 127 HB2 ASP 127 11.884 -7.101 -0.362 965 HB3 ASP 127 HB3 ASP 127 12.752 -6.261 0.909 966 H ALA 128 H ALA 128 11.400 -5.119 3.003 967 HA ALA 128 HA ALA 128 12.411 -6.469 5.288 968 HB1 ALA 128 HB1 ALA 128 11.410 -3.629 5.112 969 HB2 ALA 128 HB2 ALA 128 13.042 -4.146 4.721 970 HB3 ALA 128 HB3 ALA 128 12.444 -4.297 6.372 971 H LEU 129 H LEU 129 9.302 -4.877 4.639 972 HA LEU 129 HA LEU 129 8.275 -5.375 7.253 973 HB2 LEU 129 HB2 LEU 129 6.135 -4.624 6.439 974 HB3 LEU 129 HB3 LEU 129 7.389 -3.577 5.817 975 HG LEU 129 HG LEU 129 7.193 -5.178 3.739 976 HD11 LEU 129 HD11 LEU 129 4.884 -5.868 3.304 977 HD12 LEU 129 HD12 LEU 129 4.442 -5.338 4.935 978 HD13 LEU 129 HD13 LEU 129 5.587 -6.660 4.724 979 HD21 LEU 129 HD21 LEU 129 5.592 -3.572 2.749 980 HD22 LEU 129 HD22 LEU 129 6.888 -2.800 3.663 981 HD23 LEU 129 HD23 LEU 129 5.274 -2.939 4.366 982 H HIS 130 H HIS 130 8.224 -7.154 4.288 983 HA HIS 130 HA HIS 130 6.376 -9.144 5.029 984 HB2 HIS 130 HB2 HIS 130 7.103 -8.674 2.696 985 HB3 HIS 130 HB3 HIS 130 8.712 -9.251 3.098 986 HD1 HIS 130 HD1 HIS 130 9.117 -11.630 2.425 987 HD2 HIS 130 HD2 HIS 130 5.093 -10.822 3.102 988 HE1 HIS 130 HE1 HIS 130 7.869 -13.741 1.885 989 H ALA 131 H ALA 131 9.724 -8.616 5.552 990 HA ALA 131 HA ALA 131 10.155 -11.249 6.752 991 HB1 ALA 131 HB1 ALA 131 12.509 -10.598 6.883 992 HB2 ALA 131 HB2 ALA 131 12.086 -8.968 6.355 993 HB3 ALA 131 HB3 ALA 131 11.868 -10.332 5.259 994 H HIS 132 H HIS 132 8.605 -8.791 7.877 995 HA HIS 132 HA HIS 132 7.987 -7.974 9.907 996 HB2 HIS 132 HB2 HIS 132 8.080 -10.439 10.509 997 HB3 HIS 132 HB3 HIS 132 9.718 -10.191 11.088 998 HD1 HIS 132 HD1 HIS 132 9.943 -9.469 13.517 999 HD2 HIS 132 HD2 HIS 132 6.071 -9.062 12.068 1000 HE1 HIS 132 HE1 HIS 132 8.505 -8.938 15.516 1001 H GLN 133 H GLN 133 10.385 -7.033 8.568 1002 HA GLN 133 HA GLN 133 11.888 -5.869 10.807 1003 HB2 GLN 133 HB2 GLN 133 12.613 -6.233 7.898 1004 HB3 GLN 133 HB3 GLN 133 13.618 -5.373 9.067 1005 HG2 GLN 133 HG2 GLN 133 13.984 -7.311 10.336 1006 HG3 GLN 133 HG3 GLN 133 12.717 -8.191 9.498 1007 HE21 GLN 133 HE21 GLN 133 13.993 -9.801 8.948 1008 HE22 GLN 133 HE22 GLN 133 15.178 -9.670 7.690 1009 H ALA 134 H ALA 134 9.327 -5.257 9.760 1010 HA ALA 134 HA ALA 134 9.077 -2.973 8.248 1011 HB1 ALA 134 HB1 ALA 134 7.323 -3.793 10.548 1012 HB2 ALA 134 HB2 ALA 134 7.189 -4.391 8.899 1013 HB3 ALA 134 HB3 ALA 134 6.889 -2.688 9.250 1014 H ARG 135 H ARG 135 10.173 -3.276 11.475 1015 HA ARG 135 HA ARG 135 9.707 -0.759 12.579 1016 HB2 ARG 135 HB2 ARG 135 12.157 -2.497 12.861 1017 HB3 ARG 135 HB3 ARG 135 11.761 -1.144 13.905 1018 HG2 ARG 135 HG2 ARG 135 10.094 -3.611 13.558 1019 HG3 ARG 135 HG3 ARG 135 11.223 -3.325 14.883 1020 HD2 ARG 135 HD2 ARG 135 9.936 -1.348 15.531 1021 HD3 ARG 135 HD3 ARG 135 8.810 -1.654 14.212 1022 HE ARG 135 HE ARG 135 8.902 -3.958 15.654 1023 HH11 ARG 135 HH11 ARG 135 7.998 -0.597 16.308 1024 HH12 ARG 135 HH12 ARG 135 6.889 -0.988 17.542 1025 HH21 ARG 135 HH21 ARG 135 7.375 -4.492 17.335 1026 HH22 ARG 135 HH22 ARG 135 6.517 -3.248 18.112 1027 H GLU 136 H GLU 136 12.322 -1.776 10.342 1028 HA GLU 136 HA GLU 136 13.586 0.788 10.398 1029 HB2 GLU 136 HB2 GLU 136 13.859 -1.508 8.454 1030 HB3 GLU 136 HB3 GLU 136 14.826 -0.045 8.383 1031 HG2 GLU 136 HG2 GLU 136 14.773 -2.029 10.649 1032 HG3 GLU 136 HG3 GLU 136 16.052 -1.851 9.449 1033 H VAL 137 H VAL 137 11.050 -0.662 8.603 1034 HA VAL 137 HA VAL 137 10.942 1.199 6.450 1035 HB VAL 137 HB VAL 137 8.717 -0.510 7.616 1036 HG11 VAL 137 HG11 VAL 137 7.630 -0.258 5.440 1037 HG12 VAL 137 HG12 VAL 137 8.919 0.829 4.924 1038 HG13 VAL 137 HG13 VAL 137 7.848 1.297 6.246 1039 HG21 VAL 137 HG21 VAL 137 9.229 -2.082 5.800 1040 HG22 VAL 137 HG22 VAL 137 10.593 -1.876 6.899 1041 HG23 VAL 137 HG23 VAL 137 10.598 -1.076 5.328 1042 H VAL 138 H VAL 138 9.158 0.834 9.473 1043 HA VAL 138 HA VAL 138 7.679 3.202 9.370 1044 HB VAL 138 HB VAL 138 8.643 1.654 11.807 1045 HG11 VAL 138 HG11 VAL 138 6.449 3.727 11.619 1046 HG12 VAL 138 HG12 VAL 138 8.001 3.955 12.419 1047 HG13 VAL 138 HG13 VAL 138 6.849 2.776 13.049 1048 HG21 VAL 138 HG21 VAL 138 6.046 1.592 10.274 1049 HG22 VAL 138 HG22 VAL 138 6.346 0.728 11.781 1050 HG23 VAL 138 HG23 VAL 138 7.265 0.321 10.334 1051 H ARG 139 H ARG 139 10.850 2.514 10.646 1052 HA ARG 139 HA ARG 139 11.544 4.955 11.789 1053 HB2 ARG 139 HB2 ARG 139 12.789 2.764 11.819 1054 HB3 ARG 139 HB3 ARG 139 13.325 3.114 10.192 1055 HG2 ARG 139 HG2 ARG 139 14.521 5.069 11.001 1056 HG3 ARG 139 HG3 ARG 139 13.950 4.730 12.642 1057 HD2 ARG 139 HD2 ARG 139 14.999 2.459 12.428 1058 HD3 ARG 139 HD3 ARG 139 15.725 3.007 10.926 1059 HE ARG 139 HE ARG 139 16.351 4.849 12.891 1060 HH11 ARG 139 HH11 ARG 139 17.141 1.501 11.988 1061 HH12 ARG 139 HH12 ARG 139 18.569 1.445 12.904 1062 HH21 ARG 139 HH21 ARG 139 18.344 4.758 14.193 1063 HH22 ARG 139 HH22 ARG 139 19.254 3.330 14.202 1064 H ARG 140 H ARG 140 11.960 3.828 8.414 1065 HA ARG 140 HA ARG 140 12.929 6.299 7.417 1066 HB2 ARG 140 HB2 ARG 140 11.730 3.926 6.042 1067 HB3 ARG 140 HB3 ARG 140 12.252 5.361 5.170 1068 HG2 ARG 140 HG2 ARG 140 14.497 5.070 6.076 1069 HG3 ARG 140 HG3 ARG 140 13.960 3.590 6.881 1070 HD2 ARG 140 HD2 ARG 140 13.418 2.597 4.801 1071 HD3 ARG 140 HD3 ARG 140 13.777 4.087 3.929 1072 HE ARG 140 HE ARG 140 15.903 2.892 5.502 1073 HH11 ARG 140 HH11 ARG 140 14.509 3.406 2.261 1074 HH12 ARG 140 HH12 ARG 140 16.007 3.156 1.490 1075 HH21 ARG 140 HH21 ARG 140 17.917 2.584 4.361 1076 HH22 ARG 140 HH22 ARG 140 17.897 2.696 2.633 1077 H ALA 141 H ALA 141 9.740 4.908 7.648 1078 HA ALA 141 HA ALA 141 8.301 6.744 6.170 1079 HB1 ALA 141 HB1 ALA 141 7.301 4.703 7.026 1080 HB2 ALA 141 HB2 ALA 141 6.385 6.103 7.612 1081 HB3 ALA 141 HB3 ALA 141 7.512 5.279 8.679 1082 H GLN 142 H GLN 142 9.287 6.771 9.553 1083 HA GLN 142 HA GLN 142 8.128 9.213 10.321 1084 HB2 GLN 142 HB2 GLN 142 10.575 7.794 11.395 1085 HB3 GLN 142 HB3 GLN 142 9.825 9.177 12.168 1086 HG2 GLN 142 HG2 GLN 142 7.785 7.935 12.535 1087 HG3 GLN 142 HG3 GLN 142 8.436 6.555 11.655 1088 HE21 GLN 142 HE21 GLN 142 7.450 6.728 14.385 1089 HE22 GLN 142 HE22 GLN 142 8.733 6.249 15.417 1090 H ALA 143 H ALA 143 11.208 8.442 8.829 1091 HA ALA 143 HA ALA 143 12.310 11.043 8.996 1092 HB1 ALA 143 HB1 ALA 143 12.970 8.826 7.059 1093 HB2 ALA 143 HB2 ALA 143 13.686 9.041 8.656 1094 HB3 ALA 143 HB3 ALA 143 13.969 10.241 7.396 1095 H MET 144 H MET 144 10.343 9.408 6.628 1096 HA MET 144 HA MET 144 10.486 11.499 4.668 1097 HB2 MET 144 HB2 MET 144 8.514 9.219 4.943 1098 HB3 MET 144 HB3 MET 144 8.592 10.304 3.568 1099 HG2 MET 144 HG2 MET 144 10.754 8.394 4.451 1100 HG3 MET 144 HG3 MET 144 9.653 8.160 3.101 1101 HE1 MET 144 HE1 MET 144 10.817 10.991 0.617 1102 HE2 MET 144 HE2 MET 144 9.555 11.136 1.841 1103 HE3 MET 144 HE3 MET 144 9.688 9.661 0.883 1104 H ALA 145 H ALA 145 8.304 10.639 7.257 1105 HA ALA 145 HA ALA 145 6.293 12.498 6.479 1106 HB1 ALA 145 HB1 ALA 145 6.563 11.068 9.110 1107 HB2 ALA 145 HB2 ALA 145 5.757 10.431 7.678 1108 HB3 ALA 145 HB3 ALA 145 5.120 11.864 8.485 1109 H TYR 146 H TYR 146 8.707 12.537 9.111 1110 HA TYR 146 HA TYR 146 7.780 15.244 9.724 1111 HB2 TYR 146 HB2 TYR 146 9.456 13.369 11.405 1112 HB3 TYR 146 HB3 TYR 146 8.906 14.969 11.884 1113 HD1 TYR 146 HD1 TYR 146 6.379 15.343 12.042 1114 HD2 TYR 146 HD2 TYR 146 8.136 11.476 11.809 1115 HE1 TYR 146 HE1 TYR 146 4.333 14.363 12.987 1116 HE2 TYR 146 HE2 TYR 146 6.091 10.485 12.751 1117 HH TYR 146 HH TYR 146 3.162 12.192 13.023 Start of MODEL 16 1 H MET 1 H MET 1 -24.644 25.629 35.191 2 HA MET 1 HA MET 1 -24.308 23.548 36.297 3 HB2 MET 1 HB2 MET 1 -26.597 23.204 37.110 4 HB3 MET 1 HB3 MET 1 -27.177 23.105 35.455 5 HG2 MET 1 HG2 MET 1 -25.955 21.039 35.122 6 HG3 MET 1 HG3 MET 1 -25.310 21.131 36.755 7 HE1 MET 1 HE1 MET 1 -26.127 18.692 37.253 8 HE2 MET 1 HE2 MET 1 -26.777 18.560 35.617 9 HE3 MET 1 HE3 MET 1 -27.781 18.133 37.002 10 HA PRO 2 HA PRO 2 -22.961 22.433 32.134 11 HB2 PRO 2 HB2 PRO 2 -22.656 19.748 33.405 12 HB3 PRO 2 HB3 PRO 2 -21.485 20.663 32.445 13 HG2 PRO 2 HG2 PRO 2 -21.219 20.481 35.089 14 HG3 PRO 2 HG3 PRO 2 -20.860 21.996 34.243 15 HD2 PRO 2 HD2 PRO 2 -23.226 21.264 35.898 16 HD3 PRO 2 HD3 PRO 2 -22.395 22.827 35.739 17 H GLY 3 H GLY 3 -24.576 22.214 30.738 18 HA2 GLY 3 HA2 GLY 3 -26.851 20.558 31.348 19 HA3 GLY 3 HA3 GLY 3 -26.696 21.691 30.015 20 H ARG 4 H ARG 4 -27.661 20.070 28.789 21 HA ARG 4 HA ARG 4 -26.541 17.529 28.373 22 HB2 ARG 4 HB2 ARG 4 -28.877 17.898 27.954 23 HB3 ARG 4 HB3 ARG 4 -28.520 19.153 26.782 24 HG2 ARG 4 HG2 ARG 4 -27.599 17.527 25.263 25 HG3 ARG 4 HG3 ARG 4 -27.807 16.252 26.464 26 HD2 ARG 4 HD2 ARG 4 -30.190 16.449 26.345 27 HD3 ARG 4 HD3 ARG 4 -30.069 17.888 25.327 28 HE ARG 4 HE ARG 4 -28.703 16.031 23.966 29 HH11 ARG 4 HH11 ARG 4 -31.990 16.005 25.266 30 HH12 ARG 4 HH12 ARG 4 -32.639 15.105 23.986 31 HH21 ARG 4 HH21 ARG 4 -29.569 14.857 22.205 32 HH22 ARG 4 HH22 ARG 4 -31.221 14.425 22.178 33 H ALA 5 H ALA 5 -25.075 16.821 27.024 34 HA ALA 5 HA ALA 5 -23.888 18.704 25.123 35 HB1 ALA 5 HB1 ALA 5 -22.569 16.457 26.650 36 HB2 ALA 5 HB2 ALA 5 -22.372 18.181 26.966 37 HB3 ALA 5 HB3 ALA 5 -21.777 17.486 25.460 38 HA PRO 6 HA PRO 6 -25.174 15.529 22.211 39 HB2 PRO 6 HB2 PRO 6 -24.333 16.806 19.968 40 HB3 PRO 6 HB3 PRO 6 -25.810 17.274 20.810 41 HG2 PRO 6 HG2 PRO 6 -23.127 18.553 20.831 42 HG3 PRO 6 HG3 PRO 6 -24.730 19.300 20.889 43 HD2 PRO 6 HD2 PRO 6 -23.078 18.931 23.068 44 HD3 PRO 6 HD3 PRO 6 -24.838 19.144 23.157 45 H GLY 7 H GLY 7 -23.855 14.820 19.979 46 HA2 GLY 7 HA2 GLY 7 -21.410 13.676 21.042 47 HA3 GLY 7 HA3 GLY 7 -22.214 13.229 19.539 48 H SER 8 H SER 8 -21.123 13.781 17.778 49 HA SER 8 HA SER 8 -19.982 16.377 17.486 50 HB2 SER 8 HB2 SER 8 -18.159 15.090 18.669 51 HB3 SER 8 HB3 SER 8 -18.194 13.914 17.358 52 HG SER 8 HG SER 8 -16.577 15.310 16.910 53 H THR 9 H THR 9 -19.403 16.658 15.223 54 HA THR 9 HA THR 9 -21.027 14.970 13.526 55 HB THR 9 HB THR 9 -19.505 17.516 12.864 56 HG1 THR 9 HG1 THR 9 -21.975 17.019 14.111 57 HG21 THR 9 HG21 THR 9 -20.221 16.128 10.907 58 HG22 THR 9 HG22 THR 9 -21.072 17.677 10.971 59 HG23 THR 9 HG23 THR 9 -21.876 16.202 11.501 60 H LEU 10 H LEU 10 -20.134 13.839 11.743 61 HA LEU 10 HA LEU 10 -17.358 13.057 12.172 62 HB2 LEU 10 HB2 LEU 10 -19.539 11.806 10.539 63 HB3 LEU 10 HB3 LEU 10 -17.945 11.113 10.785 64 HG LEU 10 HG LEU 10 -20.076 11.531 12.885 65 HD11 LEU 10 HD11 LEU 10 -18.948 9.015 11.671 66 HD12 LEU 10 HD12 LEU 10 -20.566 9.676 11.422 67 HD13 LEU 10 HD13 LEU 10 -20.090 9.090 13.012 68 HD21 LEU 10 HD21 LEU 10 -17.305 10.365 13.158 69 HD22 LEU 10 HD22 LEU 10 -18.555 10.338 14.401 70 HD23 LEU 10 HD23 LEU 10 -17.882 11.874 13.869 71 H ALA 11 H ALA 11 -16.151 12.408 10.130 72 HA ALA 11 HA ALA 11 -16.756 14.058 7.820 73 HB1 ALA 11 HB1 ALA 11 -14.474 14.964 7.769 74 HB2 ALA 11 HB2 ALA 11 -14.120 14.158 9.301 75 HB3 ALA 11 HB3 ALA 11 -15.320 15.448 9.239 76 H ARG 12 H ARG 12 -14.773 13.551 6.202 77 HA ARG 12 HA ARG 12 -14.809 10.717 5.961 78 HB2 ARG 12 HB2 ARG 12 -13.864 12.852 4.127 79 HB3 ARG 12 HB3 ARG 12 -13.383 11.185 3.846 80 HG2 ARG 12 HG2 ARG 12 -16.187 12.173 4.099 81 HG3 ARG 12 HG3 ARG 12 -15.371 11.812 2.558 82 HD2 ARG 12 HD2 ARG 12 -15.029 9.472 3.547 83 HD3 ARG 12 HD3 ARG 12 -16.192 9.949 4.778 84 HE ARG 12 HE ARG 12 -16.914 10.172 1.979 85 HH11 ARG 12 HH11 ARG 12 -17.460 8.628 5.138 86 HH12 ARG 12 HH12 ARG 12 -18.791 7.707 4.617 87 HH21 ARG 12 HH21 ARG 12 -18.765 8.879 1.271 88 HH22 ARG 12 HH22 ARG 12 -19.558 7.876 2.383 89 H VAL 13 H VAL 13 -13.777 10.215 7.725 90 HA VAL 13 HA VAL 13 -10.872 10.043 7.310 91 HB VAL 13 HB VAL 13 -12.354 9.489 9.906 92 HG11 VAL 13 HG11 VAL 13 -10.228 8.309 9.712 93 HG12 VAL 13 HG12 VAL 13 -10.128 9.556 10.951 94 HG13 VAL 13 HG13 VAL 13 -9.405 9.828 9.363 95 HG21 VAL 13 HG21 VAL 13 -11.462 11.623 10.760 96 HG22 VAL 13 HG22 VAL 13 -12.553 11.862 9.394 97 HG23 VAL 13 HG23 VAL 13 -10.808 11.975 9.160 98 H GLY 14 H GLY 14 -11.232 8.468 5.795 99 HA2 GLY 14 HA2 GLY 14 -11.832 5.867 6.895 100 HA3 GLY 14 HA3 GLY 14 -12.921 6.451 5.642 101 H SER 15 H SER 15 -12.451 5.797 3.679 102 HA SER 15 HA SER 15 -9.883 4.591 3.266 103 HB2 SER 15 HB2 SER 15 -11.052 3.844 1.115 104 HB3 SER 15 HB3 SER 15 -11.671 3.194 2.638 105 HG SER 15 HG SER 15 -12.934 4.671 0.774 106 H ILE 16 H ILE 16 -8.439 5.306 1.859 107 HA ILE 16 HA ILE 16 -8.846 7.959 0.798 108 HB ILE 16 HB ILE 16 -6.342 6.215 0.791 109 HG12 ILE 16 HG12 ILE 16 -5.477 7.956 2.479 110 HG13 ILE 16 HG13 ILE 16 -7.151 8.443 2.681 111 HG21 ILE 16 HG21 ILE 16 -6.315 7.811 -1.013 112 HG22 ILE 16 HG22 ILE 16 -5.142 8.259 0.230 113 HG23 ILE 16 HG23 ILE 16 -6.671 9.125 0.113 114 HD11 ILE 16 HD11 ILE 16 -6.454 6.958 4.466 115 HD12 ILE 16 HD12 ILE 16 -5.995 5.724 3.290 116 HD13 ILE 16 HD13 ILE 16 -7.687 6.179 3.475 117 HA PRO 17 HA PRO 17 -10.013 6.108 -3.134 118 HB2 PRO 17 HB2 PRO 17 -8.908 8.673 -4.186 119 HB3 PRO 17 HB3 PRO 17 -10.478 7.923 -4.499 120 HG2 PRO 17 HG2 PRO 17 -10.311 10.028 -2.891 121 HG3 PRO 17 HG3 PRO 17 -11.386 8.676 -2.496 122 HD2 PRO 17 HD2 PRO 17 -8.715 9.366 -1.345 123 HD3 PRO 17 HD3 PRO 17 -10.174 8.738 -0.545 124 H ALA 18 H ALA 18 -8.867 4.934 -4.593 125 HA ALA 18 HA ALA 18 -6.001 4.807 -4.201 126 HB1 ALA 18 HB1 ALA 18 -7.308 2.752 -4.361 127 HB2 ALA 18 HB2 ALA 18 -6.168 2.850 -5.698 128 HB3 ALA 18 HB3 ALA 18 -7.871 3.205 -5.964 129 H GLY 19 H GLY 19 -4.608 5.815 -5.413 130 HA2 GLY 19 HA2 GLY 19 -5.599 7.116 -7.861 131 HA3 GLY 19 HA3 GLY 19 -4.302 7.730 -6.851 132 H ASP 20 H ASP 20 -2.239 7.037 -7.195 133 HA ASP 20 HA ASP 20 -1.934 5.694 -9.784 134 HB2 ASP 20 HB2 ASP 20 -0.989 7.930 -9.688 135 HB3 ASP 20 HB3 ASP 20 -0.001 7.473 -8.303 136 H ASP 21 H ASP 21 -1.312 3.759 -9.843 137 HA ASP 21 HA ASP 21 -0.297 2.329 -7.597 138 HB2 ASP 21 HB2 ASP 21 -1.585 1.050 -9.135 139 HB3 ASP 21 HB3 ASP 21 -0.627 1.609 -10.505 140 H VAL 22 H VAL 22 1.732 1.422 -7.357 141 HA VAL 22 HA VAL 22 3.822 2.954 -8.725 142 HB VAL 22 HB VAL 22 3.854 2.069 -5.815 143 HG11 VAL 22 HG11 VAL 22 6.061 2.176 -6.798 144 HG12 VAL 22 HG12 VAL 22 5.840 3.460 -5.596 145 HG13 VAL 22 HG13 VAL 22 5.769 3.834 -7.327 146 HG21 VAL 22 HG21 VAL 22 3.445 4.820 -6.983 147 HG22 VAL 22 HG22 VAL 22 3.632 4.455 -5.266 148 HG23 VAL 22 HG23 VAL 22 2.233 3.847 -6.154 149 H LEU 23 H LEU 23 2.609 -0.201 -8.190 150 HA LEU 23 HA LEU 23 5.283 -1.272 -8.313 151 HB2 LEU 23 HB2 LEU 23 4.245 -3.573 -8.032 152 HB3 LEU 23 HB3 LEU 23 4.217 -2.493 -6.669 153 HG LEU 23 HG LEU 23 1.838 -2.123 -6.975 154 HD11 LEU 23 HD11 LEU 23 2.056 -4.156 -9.236 155 HD12 LEU 23 HD12 LEU 23 1.688 -2.444 -9.446 156 HD13 LEU 23 HD13 LEU 23 0.549 -3.490 -8.601 157 HD21 LEU 23 HD21 LEU 23 2.602 -5.024 -6.943 158 HD22 LEU 23 HD22 LEU 23 1.069 -4.359 -6.384 159 HD23 LEU 23 HD23 LEU 23 2.571 -3.921 -5.569 160 H ASP 24 H ASP 24 5.550 -3.385 -9.580 161 HA ASP 24 HA ASP 24 5.016 -2.671 -12.374 162 HB2 ASP 24 HB2 ASP 24 7.389 -2.909 -11.611 163 HB3 ASP 24 HB3 ASP 24 7.042 -4.557 -11.122 164 HA PRO 25 HA PRO 25 2.151 -6.115 -12.792 165 HB2 PRO 25 HB2 PRO 25 3.816 -6.779 -15.183 166 HB3 PRO 25 HB3 PRO 25 2.057 -6.679 -15.037 167 HG2 PRO 25 HG2 PRO 25 3.398 -4.704 -16.176 168 HG3 PRO 25 HG3 PRO 25 2.050 -4.355 -15.084 169 HD2 PRO 25 HD2 PRO 25 4.982 -4.098 -14.611 170 HD3 PRO 25 HD3 PRO 25 3.643 -3.111 -13.994 171 H ASP 26 H ASP 26 5.639 -6.626 -12.862 172 HA ASP 26 HA ASP 26 5.635 -9.455 -12.679 173 HB2 ASP 26 HB2 ASP 26 7.625 -8.007 -13.184 174 HB3 ASP 26 HB3 ASP 26 7.701 -7.600 -11.472 175 H GLU 27 H GLU 27 5.221 -6.913 -10.314 176 HA GLU 27 HA GLU 27 5.310 -8.637 -8.050 177 HB2 GLU 27 HB2 GLU 27 4.256 -5.841 -8.482 178 HB3 GLU 27 HB3 GLU 27 3.970 -6.693 -6.979 179 HG2 GLU 27 HG2 GLU 27 5.794 -5.218 -6.642 180 HG3 GLU 27 HG3 GLU 27 6.437 -6.848 -6.679 181 HA PRO 28 HA PRO 28 1.215 -10.312 -8.908 182 HB2 PRO 28 HB2 PRO 28 1.270 -11.517 -6.249 183 HB3 PRO 28 HB3 PRO 28 1.348 -12.311 -7.818 184 HG2 PRO 28 HG2 PRO 28 3.452 -12.191 -6.088 185 HG3 PRO 28 HG3 PRO 28 3.632 -12.334 -7.839 186 HD2 PRO 28 HD2 PRO 28 3.934 -9.939 -6.088 187 HD3 PRO 28 HD3 PRO 28 4.843 -10.428 -7.537 188 H THR 29 H THR 29 -0.970 -10.016 -8.088 189 HA THR 29 HA THR 29 -1.153 -8.153 -5.869 190 HB THR 29 HB THR 29 -2.947 -6.929 -7.268 191 HG1 THR 29 HG1 THR 29 -1.339 -7.937 -9.346 192 HG21 THR 29 HG21 THR 29 -0.015 -6.622 -7.952 193 HG22 THR 29 HG22 THR 29 -0.848 -5.860 -6.596 194 HG23 THR 29 HG23 THR 29 -1.262 -5.410 -8.251 195 H TYR 30 H TYR 30 -3.406 -7.729 -5.317 196 HA TYR 30 HA TYR 30 -5.177 -10.040 -5.469 197 HB2 TYR 30 HB2 TYR 30 -4.385 -8.231 -3.216 198 HB3 TYR 30 HB3 TYR 30 -5.976 -8.991 -3.242 199 HD1 TYR 30 HD1 TYR 30 -5.968 -11.540 -3.578 200 HD2 TYR 30 HD2 TYR 30 -2.618 -9.316 -2.234 201 HE1 TYR 30 HE1 TYR 30 -5.056 -13.556 -2.609 202 HE2 TYR 30 HE2 TYR 30 -1.670 -11.340 -1.229 203 HH TYR 30 HH TYR 30 -2.314 -13.471 -0.471 204 H ASP 31 H ASP 31 -7.379 -9.253 -5.203 205 HA ASP 31 HA ASP 31 -7.780 -6.559 -6.299 206 HB2 ASP 31 HB2 ASP 31 -7.780 -8.591 -7.982 207 HB3 ASP 31 HB3 ASP 31 -9.304 -9.006 -7.209 208 H LEU 32 H LEU 32 -10.113 -5.987 -5.738 209 HA LEU 32 HA LEU 32 -10.451 -6.609 -3.042 210 HB2 LEU 32 HB2 LEU 32 -12.483 -5.323 -4.868 211 HB3 LEU 32 HB3 LEU 32 -12.639 -5.432 -3.129 212 HG LEU 32 HG LEU 32 -10.550 -3.866 -4.649 213 HD11 LEU 32 HD11 LEU 32 -12.798 -2.973 -2.859 214 HD12 LEU 32 HD12 LEU 32 -12.746 -2.824 -4.612 215 HD13 LEU 32 HD13 LEU 32 -11.599 -1.927 -3.619 216 HD21 LEU 32 HD21 LEU 32 -9.526 -4.786 -2.646 217 HD22 LEU 32 HD22 LEU 32 -10.886 -4.223 -1.668 218 HD23 LEU 32 HD23 LEU 32 -9.814 -3.060 -2.442 219 HA PRO 33 HA PRO 33 -14.048 -9.700 -4.108 220 HB2 PRO 33 HB2 PRO 33 -13.626 -10.932 -6.565 221 HB3 PRO 33 HB3 PRO 33 -14.863 -9.715 -6.238 222 HG2 PRO 33 HG2 PRO 33 -12.164 -9.384 -7.479 223 HG3 PRO 33 HG3 PRO 33 -13.697 -8.607 -7.905 224 HD2 PRO 33 HD2 PRO 33 -11.824 -7.306 -6.521 225 HD3 PRO 33 HD3 PRO 33 -13.551 -7.088 -6.160 226 H ARG 34 H ARG 34 -10.731 -10.026 -5.423 227 HA ARG 34 HA ARG 34 -10.490 -12.753 -4.808 228 HB2 ARG 34 HB2 ARG 34 -9.056 -11.307 -6.419 229 HB3 ARG 34 HB3 ARG 34 -8.193 -10.837 -4.963 230 HG2 ARG 34 HG2 ARG 34 -7.048 -12.640 -6.118 231 HG3 ARG 34 HG3 ARG 34 -7.619 -13.162 -4.526 232 HD2 ARG 34 HD2 ARG 34 -9.533 -14.228 -5.509 233 HD3 ARG 34 HD3 ARG 34 -9.098 -13.611 -7.104 234 HE ARG 34 HE ARG 34 -6.954 -15.051 -6.404 235 HH11 ARG 34 HH11 ARG 34 -10.413 -15.821 -6.398 236 HH12 ARG 34 HH12 ARG 34 -10.176 -17.508 -6.420 237 HH21 ARG 34 HH21 ARG 34 -6.634 -17.373 -6.499 238 HH22 ARG 34 HH22 ARG 34 -7.973 -18.415 -6.497 239 H VAL 35 H VAL 35 -9.739 -9.786 -3.063 240 HA VAL 35 HA VAL 35 -8.524 -11.089 -0.851 241 HB VAL 35 HB VAL 35 -9.883 -8.356 -0.925 242 HG11 VAL 35 HG11 VAL 35 -9.674 -9.169 1.364 243 HG12 VAL 35 HG12 VAL 35 -8.561 -7.828 1.076 244 HG13 VAL 35 HG13 VAL 35 -7.957 -9.483 1.111 245 HG21 VAL 35 HG21 VAL 35 -7.626 -7.450 -1.130 246 HG22 VAL 35 HG22 VAL 35 -8.034 -8.496 -2.489 247 HG23 VAL 35 HG23 VAL 35 -6.973 -9.085 -1.204 248 H ALA 36 H ALA 36 -11.751 -10.090 -1.649 249 HA ALA 36 HA ALA 36 -13.072 -10.803 0.684 250 HB1 ALA 36 HB1 ALA 36 -14.043 -10.984 -2.168 251 HB2 ALA 36 HB2 ALA 36 -14.103 -9.543 -1.147 252 HB3 ALA 36 HB3 ALA 36 -15.064 -10.959 -0.728 253 H GLU 37 H GLU 37 -12.034 -12.712 -2.068 254 HA GLU 37 HA GLU 37 -13.214 -15.220 -1.439 255 HB2 GLU 37 HB2 GLU 37 -12.090 -14.363 -3.594 256 HB3 GLU 37 HB3 GLU 37 -10.593 -14.709 -2.794 257 HG2 GLU 37 HG2 GLU 37 -11.019 -16.554 -4.191 258 HG3 GLU 37 HG3 GLU 37 -11.308 -17.084 -2.535 259 H LEU 38 H LEU 38 -10.032 -13.787 -0.879 260 HA LEU 38 HA LEU 38 -8.747 -15.958 0.340 261 HB2 LEU 38 HB2 LEU 38 -7.573 -14.105 -0.710 262 HB3 LEU 38 HB3 LEU 38 -8.182 -13.003 0.502 263 HG LEU 38 HG LEU 38 -6.902 -14.298 2.216 264 HD11 LEU 38 HD11 LEU 38 -6.654 -16.398 1.033 265 HD12 LEU 38 HD12 LEU 38 -5.072 -15.741 1.452 266 HD13 LEU 38 HD13 LEU 38 -5.672 -15.608 -0.201 267 HD21 LEU 38 HD21 LEU 38 -6.064 -12.192 1.336 268 HD22 LEU 38 HD22 LEU 38 -5.320 -13.035 -0.022 269 HD23 LEU 38 HD23 LEU 38 -4.730 -13.310 1.613 270 H LEU 39 H LEU 39 -10.307 -13.104 1.740 271 HA LEU 39 HA LEU 39 -9.802 -14.136 4.395 272 HB2 LEU 39 HB2 LEU 39 -11.195 -11.633 3.502 273 HB3 LEU 39 HB3 LEU 39 -10.851 -12.042 5.171 274 HG LEU 39 HG LEU 39 -8.835 -11.434 3.008 275 HD11 LEU 39 HD11 LEU 39 -8.301 -9.498 4.391 276 HD12 LEU 39 HD12 LEU 39 -9.595 -9.944 5.504 277 HD13 LEU 39 HD13 LEU 39 -9.979 -9.473 3.849 278 HD21 LEU 39 HD21 LEU 39 -7.923 -13.142 4.476 279 HD22 LEU 39 HD22 LEU 39 -8.387 -12.201 5.896 280 HD23 LEU 39 HD23 LEU 39 -7.150 -11.592 4.802 281 H GLY 40 H GLY 40 -12.298 -14.293 2.109 282 HA2 GLY 40 HA2 GLY 40 -14.254 -15.487 2.207 283 HA3 GLY 40 HA3 GLY 40 -13.851 -15.933 3.862 284 H VAL 41 H VAL 41 -13.966 -12.670 2.771 285 HA VAL 41 HA VAL 41 -16.437 -12.234 4.324 286 HB VAL 41 HB VAL 41 -15.582 -10.096 5.134 287 HG11 VAL 41 HG11 VAL 41 -13.785 -10.859 6.630 288 HG12 VAL 41 HG12 VAL 41 -13.658 -12.333 5.666 289 HG13 VAL 41 HG13 VAL 41 -15.147 -11.980 6.542 290 HG21 VAL 41 HG21 VAL 41 -14.154 -9.451 3.278 291 HG22 VAL 41 HG22 VAL 41 -13.023 -10.751 3.664 292 HG23 VAL 41 HG23 VAL 41 -13.242 -9.398 4.783 293 HA PRO 42 HA PRO 42 -17.825 -9.995 0.721 294 HB2 PRO 42 HB2 PRO 42 -19.197 -7.903 1.781 295 HB3 PRO 42 HB3 PRO 42 -19.839 -9.548 1.756 296 HG2 PRO 42 HG2 PRO 42 -18.485 -8.080 3.987 297 HG3 PRO 42 HG3 PRO 42 -19.929 -9.109 4.045 298 HD2 PRO 42 HD2 PRO 42 -17.527 -10.012 4.814 299 HD3 PRO 42 HD3 PRO 42 -18.695 -11.063 3.993 300 H VAL 43 H VAL 43 -17.520 -8.093 -0.483 301 HA VAL 43 HA VAL 43 -15.013 -6.845 -0.248 302 HB VAL 43 HB VAL 43 -17.408 -5.996 -1.890 303 HG11 VAL 43 HG11 VAL 43 -14.492 -5.248 -2.208 304 HG12 VAL 43 HG12 VAL 43 -15.799 -4.163 -1.737 305 HG13 VAL 43 HG13 VAL 43 -15.767 -4.853 -3.358 306 HG21 VAL 43 HG21 VAL 43 -15.051 -7.715 -2.637 307 HG22 VAL 43 HG22 VAL 43 -16.331 -7.191 -3.734 308 HG23 VAL 43 HG23 VAL 43 -16.708 -8.263 -2.380 309 H SER 44 H SER 44 -18.169 -5.864 0.787 310 HA SER 44 HA SER 44 -17.663 -3.212 1.383 311 HB2 SER 44 HB2 SER 44 -19.613 -3.614 2.983 312 HB3 SER 44 HB3 SER 44 -19.832 -3.988 1.256 313 HG SER 44 HG SER 44 -20.174 -5.964 1.741 314 H LYS 45 H LYS 45 -17.148 -6.147 3.313 315 HA LYS 45 HA LYS 45 -16.274 -4.770 5.650 316 HB2 LYS 45 HB2 LYS 45 -17.074 -7.182 5.605 317 HB3 LYS 45 HB3 LYS 45 -15.535 -7.591 4.855 318 HG2 LYS 45 HG2 LYS 45 -14.329 -6.843 6.815 319 HG3 LYS 45 HG3 LYS 45 -15.831 -6.315 7.570 320 HD2 LYS 45 HD2 LYS 45 -16.639 -8.668 7.482 321 HD3 LYS 45 HD3 LYS 45 -15.066 -9.141 6.853 322 HE2 LYS 45 HE2 LYS 45 -15.524 -7.809 9.514 323 HE3 LYS 45 HE3 LYS 45 -15.305 -9.538 9.275 324 HZ1 LYS 45 HZ1 LYS 45 -13.264 -8.403 9.975 325 HZ2 LYS 45 HZ2 LYS 45 -13.284 -7.456 8.603 326 HZ3 LYS 45 HZ3 LYS 45 -13.054 -9.120 8.490 327 H VAL 46 H VAL 46 -14.735 -5.986 2.774 328 HA VAL 46 HA VAL 46 -12.067 -5.583 3.561 329 HB VAL 46 HB VAL 46 -13.213 -5.428 0.751 330 HG11 VAL 46 HG11 VAL 46 -11.022 -4.400 0.893 331 HG12 VAL 46 HG12 VAL 46 -10.933 -5.916 -0.012 332 HG13 VAL 46 HG13 VAL 46 -10.368 -5.846 1.661 333 HG21 VAL 46 HG21 VAL 46 -11.977 -7.758 2.225 334 HG22 VAL 46 HG22 VAL 46 -12.467 -7.765 0.531 335 HG23 VAL 46 HG23 VAL 46 -13.679 -7.581 1.797 336 H ALA 47 H ALA 47 -14.384 -3.539 1.928 337 HA ALA 47 HA ALA 47 -12.792 -1.259 1.609 338 HB1 ALA 47 HB1 ALA 47 -14.929 -1.577 0.442 339 HB2 ALA 47 HB2 ALA 47 -14.889 -0.044 1.313 340 HB3 ALA 47 HB3 ALA 47 -15.786 -1.413 1.976 341 H GLN 48 H GLN 48 -14.741 -2.400 4.289 342 HA GLN 48 HA GLN 48 -14.473 -0.053 5.812 343 HB2 GLN 48 HB2 GLN 48 -15.161 -2.842 6.712 344 HB3 GLN 48 HB3 GLN 48 -15.089 -1.472 7.808 345 HG2 GLN 48 HG2 GLN 48 -16.946 -1.829 5.477 346 HG3 GLN 48 HG3 GLN 48 -17.356 -1.849 7.190 347 HE21 GLN 48 HE21 GLN 48 -17.345 0.131 8.344 348 HE22 GLN 48 HE22 GLN 48 -17.427 1.644 7.528 349 H GLN 49 H GLN 49 -12.453 -2.885 5.575 350 HA GLN 49 HA GLN 49 -10.678 -2.241 7.685 351 HB2 GLN 49 HB2 GLN 49 -9.947 -3.560 5.058 352 HB3 GLN 49 HB3 GLN 49 -9.019 -3.642 6.546 353 HG2 GLN 49 HG2 GLN 49 -11.004 -4.718 7.584 354 HG3 GLN 49 HG3 GLN 49 -11.699 -4.842 5.977 355 HE21 GLN 49 HE21 GLN 49 -10.716 -6.212 4.457 356 HE22 GLN 49 HE22 GLN 49 -9.636 -7.470 4.929 357 H LEU 50 H LEU 50 -10.771 -1.388 4.349 358 HA LEU 50 HA LEU 50 -8.493 0.291 4.225 359 HB2 LEU 50 HB2 LEU 50 -9.638 -0.626 2.245 360 HB3 LEU 50 HB3 LEU 50 -11.050 0.333 2.605 361 HG LEU 50 HG LEU 50 -9.749 2.389 2.103 362 HD11 LEU 50 HD11 LEU 50 -7.605 2.214 0.979 363 HD12 LEU 50 HD12 LEU 50 -7.593 0.474 1.264 364 HD13 LEU 50 HD13 LEU 50 -7.519 1.592 2.625 365 HD21 LEU 50 HD21 LEU 50 -9.661 2.053 -0.320 366 HD22 LEU 50 HD22 LEU 50 -11.120 1.353 0.384 367 HD23 LEU 50 HD23 LEU 50 -9.773 0.311 -0.079 368 H ARG 51 H ARG 51 -11.827 0.861 5.130 369 HA ARG 51 HA ARG 51 -11.759 3.669 5.443 370 HB2 ARG 51 HB2 ARG 51 -13.551 1.562 6.644 371 HB3 ARG 51 HB3 ARG 51 -13.764 3.271 6.959 372 HG2 ARG 51 HG2 ARG 51 -13.715 2.206 4.160 373 HG3 ARG 51 HG3 ARG 51 -15.188 2.193 5.129 374 HD2 ARG 51 HD2 ARG 51 -15.168 4.553 5.343 375 HD3 ARG 51 HD3 ARG 51 -13.541 4.661 4.679 376 HE ARG 51 HE ARG 51 -14.376 4.132 2.562 377 HH11 ARG 51 HH11 ARG 51 -16.984 4.853 4.908 378 HH12 ARG 51 HH12 ARG 51 -18.131 5.179 3.701 379 HH21 ARG 51 HH21 ARG 51 -15.989 4.652 0.937 380 HH22 ARG 51 HH22 ARG 51 -17.572 5.057 1.446 381 H GLU 52 H GLU 52 -10.734 1.077 7.588 382 HA GLU 52 HA GLU 52 -10.379 3.080 9.690 383 HB2 GLU 52 HB2 GLU 52 -10.038 1.168 11.233 384 HB3 GLU 52 HB3 GLU 52 -11.617 1.185 10.471 385 HG2 GLU 52 HG2 GLU 52 -10.940 -0.543 8.944 386 HG3 GLU 52 HG3 GLU 52 -9.299 -0.509 9.586 387 H GLY 53 H GLY 53 -8.662 2.135 7.237 388 HA2 GLY 53 HA2 GLY 53 -6.433 2.361 6.738 389 HA3 GLY 53 HA3 GLY 53 -6.201 3.018 8.352 390 H HIS 54 H HIS 54 -7.420 -0.130 7.416 391 HA HIS 54 HA HIS 54 -5.167 -1.403 8.858 392 HB2 HIS 54 HB2 HIS 54 -7.623 -1.861 9.474 393 HB3 HIS 54 HB3 HIS 54 -7.740 -2.703 7.940 394 HD1 HIS 54 HD1 HIS 54 -6.920 -3.257 11.446 395 HD2 HIS 54 HD2 HIS 54 -5.870 -4.959 7.816 396 HE1 HIS 54 HE1 HIS 54 -6.085 -5.563 11.991 397 H LEU 55 H LEU 55 -6.378 -0.750 5.739 398 HA LEU 55 HA LEU 55 -4.383 -2.436 4.515 399 HB2 LEU 55 HB2 LEU 55 -6.482 -3.820 4.710 400 HB3 LEU 55 HB3 LEU 55 -7.313 -2.606 3.765 401 HG LEU 55 HG LEU 55 -5.827 -3.116 1.850 402 HD11 LEU 55 HD11 LEU 55 -3.881 -3.931 3.061 403 HD12 LEU 55 HD12 LEU 55 -4.448 -5.151 1.922 404 HD13 LEU 55 HD13 LEU 55 -4.802 -5.321 3.639 405 HD21 LEU 55 HD21 LEU 55 -6.829 -5.293 1.317 406 HD22 LEU 55 HD22 LEU 55 -8.006 -4.197 2.038 407 HD23 LEU 55 HD23 LEU 55 -7.296 -5.491 3.005 408 H VAL 56 H VAL 56 -4.094 -1.734 2.198 409 HA VAL 56 HA VAL 56 -5.298 0.849 1.528 410 HB VAL 56 HB VAL 56 -2.295 0.269 1.454 411 HG11 VAL 56 HG11 VAL 56 -3.748 2.772 0.586 412 HG12 VAL 56 HG12 VAL 56 -2.995 1.600 -0.493 413 HG13 VAL 56 HG13 VAL 56 -1.999 2.538 0.621 414 HG21 VAL 56 HG21 VAL 56 -3.860 2.289 3.035 415 HG22 VAL 56 HG22 VAL 56 -2.103 2.137 2.991 416 HG23 VAL 56 HG23 VAL 56 -3.081 0.832 3.662 417 H ALA 57 H ALA 57 -5.375 1.237 -0.753 418 HA ALA 57 HA ALA 57 -4.836 -1.106 -2.435 419 HB1 ALA 57 HB1 ALA 57 -7.271 0.679 -2.473 420 HB2 ALA 57 HB2 ALA 57 -7.218 -0.984 -1.884 421 HB3 ALA 57 HB3 ALA 57 -6.935 -0.644 -3.590 422 H VAL 58 H VAL 58 -4.667 -0.521 -4.710 423 HA VAL 58 HA VAL 58 -4.153 2.283 -5.329 424 HB VAL 58 HB VAL 58 -2.226 1.548 -6.819 425 HG11 VAL 58 HG11 VAL 58 -1.835 1.262 -3.852 426 HG12 VAL 58 HG12 VAL 58 -1.849 2.770 -4.771 427 HG13 VAL 58 HG13 VAL 58 -0.577 1.574 -5.054 428 HG21 VAL 58 HG21 VAL 58 -2.340 -0.928 -5.089 429 HG22 VAL 58 HG22 VAL 58 -1.031 -0.515 -6.199 430 HG23 VAL 58 HG23 VAL 58 -2.643 -0.850 -6.825 431 H ARG 59 H ARG 59 -4.020 2.553 -7.767 432 HA ARG 59 HA ARG 59 -5.923 0.672 -8.991 433 HB2 ARG 59 HB2 ARG 59 -6.846 2.956 -8.475 434 HB3 ARG 59 HB3 ARG 59 -5.647 3.625 -9.570 435 HG2 ARG 59 HG2 ARG 59 -6.623 2.332 -11.409 436 HG3 ARG 59 HG3 ARG 59 -7.847 1.705 -10.305 437 HD2 ARG 59 HD2 ARG 59 -8.564 4.045 -9.860 438 HD3 ARG 59 HD3 ARG 59 -7.407 4.578 -11.075 439 HE ARG 59 HE ARG 59 -9.395 2.627 -11.898 440 HH11 ARG 59 HH11 ARG 59 -8.391 6.026 -11.891 441 HH12 ARG 59 HH12 ARG 59 -9.378 6.479 -13.193 442 HH21 ARG 59 HH21 ARG 59 -10.806 3.264 -13.689 443 HH22 ARG 59 HH22 ARG 59 -10.793 4.869 -14.237 444 H ARG 60 H ARG 60 -5.035 -0.460 -10.494 445 HA ARG 60 HA ARG 60 -2.869 0.733 -12.056 446 HB2 ARG 60 HB2 ARG 60 -1.839 -1.529 -12.303 447 HB3 ARG 60 HB3 ARG 60 -1.933 -1.040 -10.626 448 HG2 ARG 60 HG2 ARG 60 -2.496 -3.291 -10.565 449 HG3 ARG 60 HG3 ARG 60 -4.073 -2.502 -10.574 450 HD2 ARG 60 HD2 ARG 60 -4.081 -2.835 -13.079 451 HD3 ARG 60 HD3 ARG 60 -2.659 -3.851 -12.868 452 HE ARG 60 HE ARG 60 -4.030 -5.318 -11.486 453 HH11 ARG 60 HH11 ARG 60 -5.751 -3.052 -13.611 454 HH12 ARG 60 HH12 ARG 60 -7.129 -4.051 -13.769 455 HH21 ARG 60 HH21 ARG 60 -6.001 -6.646 -11.680 456 HH22 ARG 60 HH22 ARG 60 -7.293 -6.047 -12.621 457 H ALA 61 H ALA 61 -3.232 0.936 -14.100 458 HA ALA 61 HA ALA 61 -4.249 0.924 -16.145 459 HB1 ALA 61 HB1 ALA 61 -4.702 -1.996 -15.514 460 HB2 ALA 61 HB2 ALA 61 -3.224 -1.310 -16.188 461 HB3 ALA 61 HB3 ALA 61 -4.722 -1.262 -17.117 462 H GLY 62 H GLY 62 -6.000 1.404 -13.749 463 HA2 GLY 62 HA2 GLY 62 -8.233 2.271 -14.051 464 HA3 GLY 62 HA3 GLY 62 -8.550 0.930 -15.137 465 H GLY 63 H GLY 63 -7.118 -0.863 -13.076 466 HA2 GLY 63 HA2 GLY 63 -9.601 -1.367 -11.571 467 HA3 GLY 63 HA3 GLY 63 -8.343 -2.540 -11.926 468 H VAL 64 H VAL 64 -9.656 -1.575 -9.410 469 HA VAL 64 HA VAL 64 -7.288 -0.571 -8.062 470 HB VAL 64 HB VAL 64 -9.339 0.677 -7.566 471 HG11 VAL 64 HG11 VAL 64 -11.185 -0.262 -6.327 472 HG12 VAL 64 HG12 VAL 64 -10.462 -1.867 -6.433 473 HG13 VAL 64 HG13 VAL 64 -11.015 -1.049 -7.899 474 HG21 VAL 64 HG21 VAL 64 -9.313 0.585 -5.120 475 HG22 VAL 64 HG22 VAL 64 -7.692 0.563 -5.816 476 HG23 VAL 64 HG23 VAL 64 -8.409 -0.929 -5.210 477 H VAL 65 H VAL 65 -6.078 -1.744 -6.864 478 HA VAL 65 HA VAL 65 -6.823 -4.509 -6.192 479 HB VAL 65 HB VAL 65 -4.552 -5.201 -7.014 480 HG11 VAL 65 HG11 VAL 65 -5.192 -5.327 -9.388 481 HG12 VAL 65 HG12 VAL 65 -6.436 -4.109 -9.110 482 HG13 VAL 65 HG13 VAL 65 -6.561 -5.688 -8.337 483 HG21 VAL 65 HG21 VAL 65 -3.545 -2.962 -7.085 484 HG22 VAL 65 HG22 VAL 65 -4.658 -2.533 -8.385 485 HG23 VAL 65 HG23 VAL 65 -3.432 -3.776 -8.653 486 H ILE 66 H ILE 66 -5.155 -5.497 -4.883 487 HA ILE 66 HA ILE 66 -3.918 -3.627 -2.961 488 HB ILE 66 HB ILE 66 -4.852 -6.470 -2.449 489 HG12 ILE 66 HG12 ILE 66 -6.848 -5.080 -2.856 490 HG13 ILE 66 HG13 ILE 66 -6.755 -5.613 -1.186 491 HG21 ILE 66 HG21 ILE 66 -3.100 -5.823 -0.955 492 HG22 ILE 66 HG22 ILE 66 -4.627 -5.874 -0.061 493 HG23 ILE 66 HG23 ILE 66 -3.947 -4.331 -0.552 494 HD11 ILE 66 HD11 ILE 66 -6.048 -2.887 -2.216 495 HD12 ILE 66 HD12 ILE 66 -5.934 -3.414 -0.536 496 HD13 ILE 66 HD13 ILE 66 -7.507 -3.331 -1.330 497 HA PRO 67 HA PRO 67 -0.291 -5.872 -4.552 498 HB2 PRO 67 HB2 PRO 67 1.081 -5.025 -2.089 499 HB3 PRO 67 HB3 PRO 67 1.476 -4.661 -3.772 500 HG2 PRO 67 HG2 PRO 67 0.487 -2.779 -2.142 501 HG3 PRO 67 HG3 PRO 67 0.038 -2.845 -3.857 502 HD2 PRO 67 HD2 PRO 67 -1.494 -3.787 -1.459 503 HD3 PRO 67 HD3 PRO 67 -2.062 -2.892 -2.889 504 H GLN 68 H GLN 68 0.424 -7.988 -4.316 505 HA GLN 68 HA GLN 68 -0.490 -9.845 -2.466 506 HB2 GLN 68 HB2 GLN 68 0.586 -10.427 -4.587 507 HB3 GLN 68 HB3 GLN 68 2.111 -9.784 -4.015 508 HG2 GLN 68 HG2 GLN 68 2.300 -12.127 -3.881 509 HG3 GLN 68 HG3 GLN 68 2.068 -11.566 -2.231 510 HE21 GLN 68 HE21 GLN 68 -0.470 -11.935 -4.683 511 HE22 GLN 68 HE22 GLN 68 -1.275 -13.196 -3.852 512 H VAL 69 H VAL 69 2.257 -7.771 -2.399 513 HA VAL 69 HA VAL 69 3.668 -8.968 -0.269 514 HB VAL 69 HB VAL 69 5.048 -6.854 -0.347 515 HG11 VAL 69 HG11 VAL 69 5.973 -7.344 -2.568 516 HG12 VAL 69 HG12 VAL 69 4.525 -8.262 -2.970 517 HG13 VAL 69 HG13 VAL 69 5.605 -8.833 -1.697 518 HG21 VAL 69 HG21 VAL 69 3.251 -5.357 -1.070 519 HG22 VAL 69 HG22 VAL 69 3.164 -6.201 -2.611 520 HG23 VAL 69 HG23 VAL 69 4.621 -5.301 -2.189 521 H PHE 70 H PHE 70 0.835 -7.221 -0.089 522 HA PHE 70 HA PHE 70 1.444 -6.008 2.481 523 HB2 PHE 70 HB2 PHE 70 -0.842 -5.870 0.574 524 HB3 PHE 70 HB3 PHE 70 -1.228 -5.664 2.277 525 HD1 PHE 70 HD1 PHE 70 1.701 -4.505 0.248 526 HD2 PHE 70 HD2 PHE 70 -1.652 -3.439 2.640 527 HE1 PHE 70 HE1 PHE 70 2.403 -2.142 0.186 528 HE2 PHE 70 HE2 PHE 70 -0.947 -1.085 2.597 529 HZ PHE 70 HZ PHE 70 1.068 -0.431 1.370 530 H PHE 71 H PHE 71 0.782 -8.940 1.341 531 HA PHE 71 HA PHE 71 -0.380 -9.864 3.861 532 HB2 PHE 71 HB2 PHE 71 -0.832 -10.954 1.070 533 HB3 PHE 71 HB3 PHE 71 -1.325 -11.771 2.542 534 HD1 PHE 71 HD1 PHE 71 -2.006 -9.002 0.258 535 HD2 PHE 71 HD2 PHE 71 -3.235 -10.999 3.804 536 HE1 PHE 71 HE1 PHE 71 -4.165 -7.849 0.150 537 HE2 PHE 71 HE2 PHE 71 -5.401 -9.841 3.709 538 HZ PHE 71 HZ PHE 71 -5.871 -8.260 1.876 539 H THR 72 H THR 72 0.425 -11.908 4.504 540 HA THR 72 HA THR 72 3.139 -12.408 3.681 541 HB THR 72 HB THR 72 3.021 -14.189 5.432 542 HG1 THR 72 HG1 THR 72 1.086 -14.162 6.743 543 HG21 THR 72 HG21 THR 72 1.964 -11.506 6.346 544 HG22 THR 72 HG22 THR 72 3.661 -11.901 6.081 545 HG23 THR 72 HG23 THR 72 2.762 -12.695 7.374 546 H ASN 73 H ASN 73 3.699 -14.726 3.094 547 HA ASN 73 HA ASN 73 2.002 -15.541 0.980 548 HB2 ASN 73 HB2 ASN 73 3.546 -17.435 0.591 549 HB3 ASN 73 HB3 ASN 73 4.404 -15.917 0.753 550 HD21 ASN 73 HD21 ASN 73 6.288 -16.850 1.268 551 HD22 ASN 73 HD22 ASN 73 6.639 -17.655 2.736 552 H SER 74 H SER 74 1.934 -16.165 4.233 553 HA SER 74 HA SER 74 0.559 -18.667 4.182 554 HB2 SER 74 HB2 SER 74 0.792 -16.609 6.377 555 HB3 SER 74 HB3 SER 74 0.383 -18.317 6.571 556 HG SER 74 HG SER 74 2.500 -18.643 5.454 557 H GLY 75 H GLY 75 -0.375 -15.563 3.304 558 HA2 GLY 75 HA2 GLY 75 -2.461 -14.970 2.489 559 HA3 GLY 75 HA3 GLY 75 -3.149 -16.387 3.262 560 H GLN 76 H GLN 76 -1.164 -14.326 5.145 561 HA GLN 76 HA GLN 76 -3.580 -13.260 6.462 562 HB2 GLN 76 HB2 GLN 76 -0.868 -13.849 7.608 563 HB3 GLN 76 HB3 GLN 76 -2.126 -12.974 8.459 564 HG2 GLN 76 HG2 GLN 76 -3.544 -14.990 8.318 565 HG3 GLN 76 HG3 GLN 76 -2.184 -15.836 7.567 566 HE21 GLN 76 HE21 GLN 76 -2.047 -17.277 9.282 567 HE22 GLN 76 HE22 GLN 76 -1.416 -16.807 10.829 568 H VAL 77 H VAL 77 -3.357 -11.160 7.382 569 HA VAL 77 HA VAL 77 -1.846 -9.319 5.798 570 HB VAL 77 HB VAL 77 -3.586 -8.996 8.278 571 HG11 VAL 77 HG11 VAL 77 -3.380 -6.566 8.024 572 HG12 VAL 77 HG12 VAL 77 -2.196 -6.801 6.737 573 HG13 VAL 77 HG13 VAL 77 -1.812 -7.290 8.385 574 HG21 VAL 77 HG21 VAL 77 -5.045 -7.782 6.751 575 HG22 VAL 77 HG22 VAL 77 -4.733 -9.423 6.166 576 HG23 VAL 77 HG23 VAL 77 -3.885 -8.042 5.453 577 H VAL 78 H VAL 78 0.087 -8.360 6.316 578 HA VAL 78 HA VAL 78 1.819 -9.594 8.173 579 HB VAL 78 HB VAL 78 2.071 -6.787 7.019 580 HG11 VAL 78 HG11 VAL 78 3.599 -7.173 8.869 581 HG12 VAL 78 HG12 VAL 78 4.486 -7.086 7.347 582 HG13 VAL 78 HG13 VAL 78 4.183 -8.650 8.104 583 HG21 VAL 78 HG21 VAL 78 3.082 -9.400 5.885 584 HG22 VAL 78 HG22 VAL 78 3.444 -7.798 5.242 585 HG23 VAL 78 HG23 VAL 78 1.789 -8.408 5.216 586 H LYS 79 H LYS 79 2.109 -9.221 10.305 587 HA LYS 79 HA LYS 79 0.099 -7.997 11.786 588 HB2 LYS 79 HB2 LYS 79 1.436 -8.407 13.759 589 HB3 LYS 79 HB3 LYS 79 1.470 -9.791 12.673 590 HG2 LYS 79 HG2 LYS 79 3.612 -9.097 11.851 591 HG3 LYS 79 HG3 LYS 79 3.553 -7.688 12.912 592 HD2 LYS 79 HD2 LYS 79 3.436 -9.212 14.878 593 HD3 LYS 79 HD3 LYS 79 3.623 -10.585 13.790 594 HE2 LYS 79 HE2 LYS 79 5.751 -10.003 14.831 595 HE3 LYS 79 HE3 LYS 79 5.809 -9.741 13.090 596 HZ1 LYS 79 HZ1 LYS 79 6.819 -7.933 14.368 597 HZ2 LYS 79 HZ2 LYS 79 5.362 -7.626 15.124 598 HZ3 LYS 79 HZ3 LYS 79 5.530 -7.352 13.463 599 H SER 80 H SER 80 2.972 -6.594 10.555 600 HA SER 80 HA SER 80 2.715 -4.270 12.281 601 HB2 SER 80 HB2 SER 80 4.864 -4.965 10.283 602 HB3 SER 80 HB3 SER 80 4.941 -3.723 11.539 603 HG SER 80 HG SER 80 5.862 -5.334 12.565 604 H LEU 81 H LEU 81 1.199 -5.164 9.560 605 HA LEU 81 HA LEU 81 1.742 -3.153 7.682 606 HB2 LEU 81 HB2 LEU 81 0.475 -5.282 7.256 607 HB3 LEU 81 HB3 LEU 81 -0.905 -4.553 8.046 608 HG LEU 81 HG LEU 81 -0.769 -2.717 6.302 609 HD11 LEU 81 HD11 LEU 81 1.025 -4.739 5.020 610 HD12 LEU 81 HD12 LEU 81 1.512 -3.130 5.582 611 HD13 LEU 81 HD13 LEU 81 0.373 -3.303 4.236 612 HD21 LEU 81 HD21 LEU 81 -1.935 -4.018 4.642 613 HD22 LEU 81 HD22 LEU 81 -2.427 -4.515 6.261 614 HD23 LEU 81 HD23 LEU 81 -1.293 -5.512 5.335 615 HA PRO 82 HA PRO 82 -2.033 -0.620 9.475 616 HB2 PRO 82 HB2 PRO 82 -2.641 -1.079 12.117 617 HB3 PRO 82 HB3 PRO 82 -3.510 -1.825 10.772 618 HG2 PRO 82 HG2 PRO 82 -1.300 -2.942 12.456 619 HG3 PRO 82 HG3 PRO 82 -2.796 -3.727 11.918 620 HD2 PRO 82 HD2 PRO 82 -0.455 -4.184 10.691 621 HD3 PRO 82 HD3 PRO 82 -1.983 -4.081 9.769 622 H GLY 83 H GLY 83 0.721 -1.623 11.263 623 HA2 GLY 83 HA2 GLY 83 1.024 0.605 12.986 624 HA3 GLY 83 HA3 GLY 83 2.296 -0.527 12.545 625 H LEU 84 H LEU 84 2.381 -0.152 9.804 626 HA LEU 84 HA LEU 84 3.914 2.240 9.678 627 HB2 LEU 84 HB2 LEU 84 4.414 1.699 7.389 628 HB3 LEU 84 HB3 LEU 84 4.396 0.200 8.278 629 HG LEU 84 HG LEU 84 1.891 0.163 7.324 630 HD11 LEU 84 HD11 LEU 84 2.043 2.284 6.138 631 HD12 LEU 84 HD12 LEU 84 1.820 0.981 4.999 632 HD13 LEU 84 HD13 LEU 84 3.413 1.699 5.208 633 HD21 LEU 84 HD21 LEU 84 2.731 -1.271 5.504 634 HD22 LEU 84 HD22 LEU 84 3.524 -1.618 7.042 635 HD23 LEU 84 HD23 LEU 84 4.363 -0.676 5.807 636 H LEU 85 H LEU 85 0.754 1.316 8.664 637 HA LEU 85 HA LEU 85 0.039 3.626 7.267 638 HB2 LEU 85 HB2 LEU 85 -1.709 1.735 8.825 639 HB3 LEU 85 HB3 LEU 85 -2.269 2.907 7.646 640 HG LEU 85 HG LEU 85 -0.493 0.542 7.060 641 HD11 LEU 85 HD11 LEU 85 -3.379 1.057 6.387 642 HD12 LEU 85 HD12 LEU 85 -2.783 -0.084 7.584 643 HD13 LEU 85 HD13 LEU 85 -2.424 -0.338 5.870 644 HD21 LEU 85 HD21 LEU 85 0.003 2.413 5.588 645 HD22 LEU 85 HD22 LEU 85 -1.713 2.606 5.238 646 HD23 LEU 85 HD23 LEU 85 -0.864 1.154 4.719 647 H THR 86 H THR 86 -0.026 2.863 10.647 648 HA THR 86 HA THR 86 -1.734 4.940 11.516 649 HB THR 86 HB THR 86 0.608 3.838 13.124 650 HG1 THR 86 HG1 THR 86 -1.074 2.302 12.200 651 HG21 THR 86 HG21 THR 86 -0.763 4.427 15.072 652 HG22 THR 86 HG22 THR 86 -2.020 5.055 14.004 653 HG23 THR 86 HG23 THR 86 -0.456 5.855 14.081 654 H ILE 87 H ILE 87 1.836 4.996 11.242 655 HA ILE 87 HA ILE 87 1.978 7.712 12.021 656 HB ILE 87 HB ILE 87 3.899 6.364 12.442 657 HG12 ILE 87 HG12 ILE 87 4.368 8.778 11.695 658 HG13 ILE 87 HG13 ILE 87 5.736 7.680 11.731 659 HG21 ILE 87 HG21 ILE 87 4.111 5.729 9.535 660 HG22 ILE 87 HG22 ILE 87 3.680 4.640 10.851 661 HG23 ILE 87 HG23 ILE 87 5.312 5.303 10.754 662 HD11 ILE 87 HD11 ILE 87 5.601 7.458 9.281 663 HD12 ILE 87 HD12 ILE 87 5.804 9.143 9.768 664 HD13 ILE 87 HD13 ILE 87 4.223 8.546 9.261 665 H LEU 88 H LEU 88 1.912 6.163 8.883 666 HA LEU 88 HA LEU 88 2.373 8.511 7.382 667 HB2 LEU 88 HB2 LEU 88 1.096 5.906 6.671 668 HB3 LEU 88 HB3 LEU 88 1.450 7.161 5.504 669 HG LEU 88 HG LEU 88 3.606 5.824 7.184 670 HD11 LEU 88 HD11 LEU 88 2.274 4.358 5.632 671 HD12 LEU 88 HD12 LEU 88 4.001 4.359 5.575 672 HD13 LEU 88 HD13 LEU 88 3.088 5.245 4.327 673 HD21 LEU 88 HD21 LEU 88 5.090 6.865 5.582 674 HD22 LEU 88 HD22 LEU 88 4.087 8.101 6.328 675 HD23 LEU 88 HD23 LEU 88 3.717 7.537 4.700 676 H HIS 89 H HIS 89 -0.577 6.949 8.445 677 HA HIS 89 HA HIS 89 -2.328 8.683 7.066 678 HB2 HIS 89 HB2 HIS 89 -2.697 6.761 9.347 679 HB3 HIS 89 HB3 HIS 89 -4.032 7.773 8.843 680 HD1 HIS 89 HD1 HIS 89 -5.530 6.024 7.743 681 HD2 HIS 89 HD2 HIS 89 -1.610 5.831 6.387 682 HE1 HIS 89 HE1 HIS 89 -5.515 4.351 5.854 683 H ASP 90 H ASP 90 -0.836 8.771 10.246 684 HA ASP 90 HA ASP 90 -2.288 11.026 11.194 685 HB2 ASP 90 HB2 ASP 90 -0.968 9.595 12.724 686 HB3 ASP 90 HB3 ASP 90 0.512 10.112 11.929 687 H GLY 91 H GLY 91 0.531 10.604 9.186 688 HA2 GLY 91 HA2 GLY 91 1.208 13.411 9.106 689 HA3 GLY 91 HA3 GLY 91 1.957 12.117 8.183 690 H GLY 92 H GLY 92 -1.234 11.716 7.730 691 HA2 GLY 92 HA2 GLY 92 -2.778 12.385 6.186 692 HA3 GLY 92 HA3 GLY 92 -1.838 13.845 5.933 693 H TYR 93 H TYR 93 -0.614 10.569 5.515 694 HA TYR 93 HA TYR 93 -0.096 11.261 2.744 695 HB2 TYR 93 HB2 TYR 93 1.084 9.130 4.510 696 HB3 TYR 93 HB3 TYR 93 1.363 9.176 2.771 697 HD1 TYR 93 HD1 TYR 93 2.249 11.396 1.823 698 HD2 TYR 93 HD2 TYR 93 2.503 10.341 5.926 699 HE1 TYR 93 HE1 TYR 93 4.054 13.021 2.108 700 HE2 TYR 93 HE2 TYR 93 4.308 11.978 6.233 701 HH TYR 93 HH TYR 93 6.088 13.114 4.714 702 H ARG 94 H ARG 94 -1.168 10.574 1.185 703 HA ARG 94 HA ARG 94 -3.338 8.774 1.446 704 HB2 ARG 94 HB2 ARG 94 -3.808 9.195 -0.882 705 HB3 ARG 94 HB3 ARG 94 -3.398 10.708 -0.093 706 HG2 ARG 94 HG2 ARG 94 -1.256 10.730 -1.123 707 HG3 ARG 94 HG3 ARG 94 -1.479 9.088 -1.737 708 HD2 ARG 94 HD2 ARG 94 -3.107 11.508 -2.495 709 HD3 ARG 94 HD3 ARG 94 -1.857 10.745 -3.482 710 HE ARG 94 HE ARG 94 -3.824 8.814 -2.798 711 HH11 ARG 94 HH11 ARG 94 -3.373 11.573 -4.951 712 HH12 ARG 94 HH12 ARG 94 -4.570 11.047 -6.049 713 HH21 ARG 94 HH21 ARG 94 -5.389 8.129 -4.178 714 HH22 ARG 94 HH22 ARG 94 -5.785 9.003 -5.587 715 H ASP 95 H ASP 95 -3.654 7.177 -0.425 716 HA ASP 95 HA ASP 95 -2.313 4.816 0.074 717 HB2 ASP 95 HB2 ASP 95 -3.491 4.026 -1.959 718 HB3 ASP 95 HB3 ASP 95 -4.553 5.022 -0.960 719 H THR 96 H THR 96 -1.935 7.066 -2.605 720 HA THR 96 HA THR 96 -0.025 5.663 -4.031 721 HB THR 96 HB THR 96 -0.629 8.630 -3.992 722 HG1 THR 96 HG1 THR 96 -2.241 6.641 -4.663 723 HG21 THR 96 HG21 THR 96 0.266 8.620 -6.280 724 HG22 THR 96 HG22 THR 96 0.647 6.903 -6.122 725 HG23 THR 96 HG23 THR 96 1.491 8.085 -5.124 726 H GLU 97 H GLU 97 0.220 8.070 -1.487 727 HA GLU 97 HA GLU 97 3.021 8.454 -1.703 728 HB2 GLU 97 HB2 GLU 97 1.149 9.033 0.582 729 HB3 GLU 97 HB3 GLU 97 2.841 9.515 0.538 730 HG2 GLU 97 HG2 GLU 97 0.690 10.380 -1.366 731 HG3 GLU 97 HG3 GLU 97 1.394 11.371 -0.085 732 H ILE 98 H ILE 98 1.002 6.275 0.182 733 HA ILE 98 HA ILE 98 2.958 5.282 1.972 734 HB ILE 98 HB ILE 98 0.780 3.602 0.694 735 HG12 ILE 98 HG12 ILE 98 -0.526 5.413 1.530 736 HG13 ILE 98 HG13 ILE 98 -0.591 4.121 2.729 737 HG21 ILE 98 HG21 ILE 98 2.167 3.328 3.327 738 HG22 ILE 98 HG22 ILE 98 2.231 2.243 1.929 739 HG23 ILE 98 HG23 ILE 98 0.743 2.406 2.852 740 HD11 ILE 98 HD11 ILE 98 1.172 6.528 2.943 741 HD12 ILE 98 HD12 ILE 98 0.933 5.265 4.145 742 HD13 ILE 98 HD13 ILE 98 -0.398 6.342 3.723 743 H MET 99 H MET 99 1.895 4.235 -1.195 744 HA MET 99 HA MET 99 3.681 2.019 -1.428 745 HB2 MET 99 HB2 MET 99 2.169 3.459 -3.598 746 HB3 MET 99 HB3 MET 99 2.855 1.848 -3.698 747 HG2 MET 99 HG2 MET 99 0.614 2.691 -1.885 748 HG3 MET 99 HG3 MET 99 0.425 1.858 -3.417 749 HE1 MET 99 HE1 MET 99 -0.969 0.846 -0.867 750 HE2 MET 99 HE2 MET 99 -0.616 -0.881 -0.910 751 HE3 MET 99 HE3 MET 99 -1.020 -0.031 -2.398 752 H ARG 100 H ARG 100 3.927 5.387 -2.018 753 HA ARG 100 HA ARG 100 5.537 5.585 -4.267 754 HB2 ARG 100 HB2 ARG 100 4.401 7.478 -3.313 755 HB3 ARG 100 HB3 ARG 100 5.305 7.336 -1.825 756 HG2 ARG 100 HG2 ARG 100 7.340 7.990 -3.024 757 HG3 ARG 100 HG3 ARG 100 6.393 8.151 -4.507 758 HD2 ARG 100 HD2 ARG 100 5.041 9.882 -3.518 759 HD3 ARG 100 HD3 ARG 100 5.827 9.659 -1.955 760 HE ARG 100 HE ARG 100 7.785 10.228 -3.836 761 HH11 ARG 100 HH11 ARG 100 5.046 11.952 -2.297 762 HH12 ARG 100 HH12 ARG 100 5.809 13.459 -2.428 763 HH21 ARG 100 HH21 ARG 100 8.761 12.247 -3.976 764 HH22 ARG 100 HH22 ARG 100 7.983 13.655 -3.412 765 H TRP 101 H TRP 101 6.752 6.035 -0.963 766 HA TRP 101 HA TRP 101 9.397 5.477 -1.834 767 HB2 TRP 101 HB2 TRP 101 9.964 5.562 0.652 768 HB3 TRP 101 HB3 TRP 101 9.304 7.023 -0.063 769 HD1 TRP 101 HD1 TRP 101 6.994 7.884 0.849 770 HE1 TRP 101 HE1 TRP 101 5.551 7.205 2.886 771 HE3 TRP 101 HE3 TRP 101 9.234 3.450 2.063 772 HZ2 TRP 101 HZ2 TRP 101 5.403 5.159 4.683 773 HZ3 TRP 101 HZ3 TRP 101 8.359 2.196 3.945 774 HH2 TRP 101 HH2 TRP 101 6.454 3.049 5.264 775 H LEU 102 H LEU 102 6.880 3.564 -0.473 776 HA LEU 102 HA LEU 102 8.374 1.442 0.515 777 HB2 LEU 102 HB2 LEU 102 5.615 1.997 -0.049 778 HB3 LEU 102 HB3 LEU 102 5.963 0.276 -0.176 779 HG LEU 102 HG LEU 102 6.435 2.082 2.215 780 HD11 LEU 102 HD11 LEU 102 4.106 1.710 1.752 781 HD12 LEU 102 HD12 LEU 102 4.606 0.864 3.220 782 HD13 LEU 102 HD13 LEU 102 4.359 -0.039 1.713 783 HD21 LEU 102 HD21 LEU 102 6.634 -0.902 1.984 784 HD22 LEU 102 HD22 LEU 102 6.921 0.061 3.428 785 HD23 LEU 102 HD23 LEU 102 8.004 0.186 2.027 786 H PHE 103 H PHE 103 7.121 1.900 -2.760 787 HA PHE 103 HA PHE 103 8.195 -0.719 -3.419 788 HB2 PHE 103 HB2 PHE 103 6.402 1.141 -4.884 789 HB3 PHE 103 HB3 PHE 103 7.220 -0.169 -5.726 790 HD1 PHE 103 HD1 PHE 103 4.794 0.640 -3.079 791 HD2 PHE 103 HD2 PHE 103 6.550 -2.398 -5.474 792 HE1 PHE 103 HE1 PHE 103 3.021 -0.902 -2.413 793 HE2 PHE 103 HE2 PHE 103 4.782 -3.953 -4.812 794 HZ PHE 103 HZ PHE 103 3.002 -3.218 -3.314 795 H THR 104 H THR 104 9.288 2.404 -3.497 796 HA THR 104 HA THR 104 10.884 2.037 -5.856 797 HB THR 104 HB THR 104 10.919 4.238 -3.763 798 HG1 THR 104 HG1 THR 104 9.034 4.564 -4.733 799 HG21 THR 104 HG21 THR 104 12.065 4.157 -6.573 800 HG22 THR 104 HG22 THR 104 13.013 4.137 -5.086 801 HG23 THR 104 HG23 THR 104 12.062 5.563 -5.513 802 HA PRO 105 HA PRO 105 14.077 -0.205 -3.623 803 HB2 PRO 105 HB2 PRO 105 15.850 0.929 -5.727 804 HB3 PRO 105 HB3 PRO 105 15.612 -0.761 -5.264 805 HG2 PRO 105 HG2 PRO 105 14.600 0.175 -7.539 806 HG3 PRO 105 HG3 PRO 105 13.688 -0.973 -6.541 807 HD2 PRO 105 HD2 PRO 105 13.349 1.985 -6.812 808 HD3 PRO 105 HD3 PRO 105 12.117 0.714 -6.687 809 H ASP 106 H ASP 106 15.176 0.534 -1.930 810 HA ASP 106 HA ASP 106 15.784 3.377 -1.870 811 HB2 ASP 106 HB2 ASP 106 14.479 2.167 -0.029 812 HB3 ASP 106 HB3 ASP 106 16.006 1.429 0.411 813 HA PRO 107 HA PRO 107 19.976 2.225 -2.892 814 HB2 PRO 107 HB2 PRO 107 21.089 4.696 -2.409 815 HB3 PRO 107 HB3 PRO 107 20.288 4.236 -3.913 816 HG2 PRO 107 HG2 PRO 107 19.228 5.778 -1.590 817 HG3 PRO 107 HG3 PRO 107 18.973 6.052 -3.323 818 HD2 PRO 107 HD2 PRO 107 17.109 4.900 -1.768 819 HD3 PRO 107 HD3 PRO 107 17.337 4.418 -3.462 820 H SER 108 H SER 108 18.946 3.473 0.173 821 HA SER 108 HA SER 108 21.551 2.931 1.365 822 HB2 SER 108 HB2 SER 108 19.108 4.226 2.580 823 HB3 SER 108 HB3 SER 108 20.750 4.222 3.226 824 HG SER 108 HG SER 108 21.325 5.288 1.199 825 H LEU 109 H LEU 109 18.930 1.165 0.571 826 HA LEU 109 HA LEU 109 18.796 -0.174 3.156 827 HB2 LEU 109 HB2 LEU 109 16.677 0.662 2.247 828 HB3 LEU 109 HB3 LEU 109 16.902 -0.361 0.834 829 HG LEU 109 HG LEU 109 16.874 -2.334 2.364 830 HD11 LEU 109 HD11 LEU 109 15.992 -0.285 4.378 831 HD12 LEU 109 HD12 LEU 109 17.466 -1.260 4.431 832 HD13 LEU 109 HD13 LEU 109 15.887 -2.033 4.585 833 HD21 LEU 109 HD21 LEU 109 14.430 -0.584 2.341 834 HD22 LEU 109 HD22 LEU 109 14.461 -2.323 2.658 835 HD23 LEU 109 HD23 LEU 109 14.942 -1.708 1.072 836 H THR 110 H THR 110 19.757 -1.969 3.345 837 HA THR 110 HA THR 110 20.029 -3.772 1.075 838 HB THR 110 HB THR 110 22.146 -3.250 3.192 839 HG1 THR 110 HG1 THR 110 21.550 -2.034 0.857 840 HG21 THR 110 HG21 THR 110 23.577 -4.672 1.766 841 HG22 THR 110 HG22 THR 110 22.212 -4.950 0.682 842 HG23 THR 110 HG23 THR 110 22.160 -5.554 2.339 843 H ILE 111 H ILE 111 18.898 -5.507 1.586 844 HA ILE 111 HA ILE 111 18.594 -6.257 4.414 845 HB ILE 111 HB ILE 111 16.219 -6.883 3.850 846 HG12 ILE 111 HG12 ILE 111 16.683 -4.974 1.545 847 HG13 ILE 111 HG13 ILE 111 16.458 -6.703 1.378 848 HG21 ILE 111 HG21 ILE 111 16.719 -5.076 5.319 849 HG22 ILE 111 HG22 ILE 111 15.364 -4.618 4.280 850 HG23 ILE 111 HG23 ILE 111 16.982 -3.983 3.961 851 HD11 ILE 111 HD11 ILE 111 14.433 -5.528 0.821 852 HD12 ILE 111 HD12 ILE 111 14.453 -4.702 2.378 853 HD13 ILE 111 HD13 ILE 111 14.186 -6.445 2.310 854 H THR 112 H THR 112 17.758 -8.377 4.721 855 HA THR 112 HA THR 112 18.627 -10.248 2.675 856 HB THR 112 HB THR 112 19.471 -10.504 5.002 857 HG1 THR 112 HG1 THR 112 18.595 -12.473 3.525 858 HG21 THR 112 HG21 THR 112 16.588 -11.004 5.725 859 HG22 THR 112 HG22 THR 112 17.584 -9.646 6.246 860 HG23 THR 112 HG23 THR 112 17.964 -11.280 6.797 861 H ARG 113 H ARG 113 17.042 -12.071 2.304 862 HA ARG 113 HA ARG 113 14.283 -11.071 2.446 863 HB2 ARG 113 HB2 ARG 113 15.093 -10.464 0.303 864 HB3 ARG 113 HB3 ARG 113 15.846 -12.010 0.041 865 HG2 ARG 113 HG2 ARG 113 13.679 -13.038 -0.269 866 HG3 ARG 113 HG3 ARG 113 12.878 -11.516 0.151 867 HD2 ARG 113 HD2 ARG 113 14.801 -11.878 -2.118 868 HD3 ARG 113 HD3 ARG 113 13.039 -11.892 -2.300 869 HE ARG 113 HE ARG 113 13.513 -9.586 -0.983 870 HH11 ARG 113 HH11 ARG 113 14.763 -10.833 -4.064 871 HH12 ARG 113 HH12 ARG 113 15.009 -9.282 -4.714 872 HH21 ARG 113 HH21 ARG 113 13.890 -7.609 -1.793 873 HH22 ARG 113 HH22 ARG 113 14.528 -7.319 -3.366 874 H ASP 114 H ASP 114 12.660 -12.788 2.072 875 HA ASP 114 HA ASP 114 13.006 -15.058 3.652 876 HB2 ASP 114 HB2 ASP 114 11.031 -14.612 1.401 877 HB3 ASP 114 HB3 ASP 114 10.939 -15.911 2.575 878 H GLY 115 H GLY 115 14.384 -16.666 3.270 879 HA2 GLY 115 HA2 GLY 115 15.111 -18.590 2.195 880 HA3 GLY 115 HA3 GLY 115 14.264 -18.084 0.744 881 H SER 116 H SER 116 15.945 -15.456 1.689 882 HA SER 116 HA SER 116 18.358 -16.237 0.231 883 HB2 SER 116 HB2 SER 116 16.854 -13.629 0.052 884 HB3 SER 116 HB3 SER 116 18.388 -13.971 -0.742 885 HG SER 116 HG SER 116 17.187 -15.796 -1.713 886 H ARG 117 H ARG 117 19.745 -16.384 1.883 887 HA ARG 117 HA ARG 117 19.735 -14.474 4.075 888 HB2 ARG 117 HB2 ARG 117 21.657 -16.721 3.447 889 HB3 ARG 117 HB3 ARG 117 21.599 -15.805 4.950 890 HG2 ARG 117 HG2 ARG 117 19.419 -17.510 3.838 891 HG3 ARG 117 HG3 ARG 117 20.492 -17.979 5.173 892 HD2 ARG 117 HD2 ARG 117 18.579 -15.650 5.127 893 HD3 ARG 117 HD3 ARG 117 18.292 -17.160 5.994 894 HE ARG 117 HE ARG 117 20.589 -16.417 7.059 895 HH11 ARG 117 HH11 ARG 117 17.688 -14.406 6.518 896 HH12 ARG 117 HH12 ARG 117 18.045 -13.354 7.804 897 HH21 ARG 117 HH21 ARG 117 21.021 -14.947 8.820 898 HH22 ARG 117 HH22 ARG 117 19.959 -13.668 9.138 899 H ASP 118 H ASP 118 20.913 -14.784 1.137 900 HA ASP 118 HA ASP 118 23.218 -13.095 1.299 901 HB2 ASP 118 HB2 ASP 118 23.033 -12.914 -1.184 902 HB3 ASP 118 HB3 ASP 118 23.006 -14.577 -0.624 903 H ALA 119 H ALA 119 23.335 -10.927 0.947 904 HA ALA 119 HA ALA 119 20.923 -9.525 1.689 905 HB1 ALA 119 HB1 ALA 119 23.018 -9.044 2.856 906 HB2 ALA 119 HB2 ALA 119 22.356 -7.614 2.067 907 HB3 ALA 119 HB3 ALA 119 23.720 -8.467 1.342 908 H VAL 120 H VAL 120 19.815 -8.164 0.494 909 HA VAL 120 HA VAL 120 20.571 -7.856 -2.323 910 HB VAL 120 HB VAL 120 17.852 -7.464 -1.027 911 HG11 VAL 120 HG11 VAL 120 18.124 -6.184 -3.072 912 HG12 VAL 120 HG12 VAL 120 16.981 -7.506 -3.322 913 HG13 VAL 120 HG13 VAL 120 18.630 -7.636 -3.934 914 HG21 VAL 120 HG21 VAL 120 18.845 -9.838 -2.609 915 HG22 VAL 120 HG22 VAL 120 17.193 -9.602 -2.041 916 HG23 VAL 120 HG23 VAL 120 18.503 -9.819 -0.879 917 H SER 121 H SER 121 21.346 -5.918 -2.813 918 HA SER 121 HA SER 121 20.889 -3.638 -1.061 919 HB2 SER 121 HB2 SER 121 22.556 -3.879 -3.582 920 HB3 SER 121 HB3 SER 121 22.639 -2.579 -2.393 921 HG SER 121 HG SER 121 23.209 -5.313 -1.955 922 H ASN 122 H ASN 122 19.982 -1.655 -1.899 923 HA ASN 122 HA ASN 122 18.333 -0.500 -2.852 924 HB2 ASN 122 HB2 ASN 122 19.460 -1.760 -5.364 925 HB3 ASN 122 HB3 ASN 122 18.197 -0.531 -5.360 926 HD21 ASN 122 HD21 ASN 122 21.564 -1.172 -4.948 927 HD22 ASN 122 HD22 ASN 122 22.056 0.474 -4.807 928 H ALA 123 H ALA 123 17.041 -2.128 -1.606 929 HA ALA 123 HA ALA 123 15.236 -3.483 -3.478 930 HB1 ALA 123 HB1 ALA 123 14.623 -4.952 -1.618 931 HB2 ALA 123 HB2 ALA 123 15.750 -4.092 -0.568 932 HB3 ALA 123 HB3 ALA 123 16.356 -5.019 -1.940 933 H ARG 124 H ARG 124 12.990 -3.320 -3.001 934 HA ARG 124 HA ARG 124 12.249 -0.787 -1.954 935 HB2 ARG 124 HB2 ARG 124 9.925 -1.390 -2.327 936 HB3 ARG 124 HB3 ARG 124 10.885 -1.816 -3.727 937 HG2 ARG 124 HG2 ARG 124 10.361 -3.942 -1.712 938 HG3 ARG 124 HG3 ARG 124 9.012 -3.409 -2.707 939 HD2 ARG 124 HD2 ARG 124 11.661 -4.446 -3.712 940 HD3 ARG 124 HD3 ARG 124 10.133 -5.326 -3.690 941 HE ARG 124 HE ARG 124 10.408 -2.814 -5.175 942 HH11 ARG 124 HH11 ARG 124 9.722 -6.314 -5.254 943 HH12 ARG 124 HH12 ARG 124 8.944 -6.222 -6.779 944 HH21 ARG 124 HH21 ARG 124 9.300 -2.753 -7.240 945 HH22 ARG 124 HH22 ARG 124 8.657 -4.173 -7.865 946 HA PRO 125 HA PRO 125 12.066 -1.750 2.355 947 HB2 PRO 125 HB2 PRO 125 9.839 0.225 2.457 948 HB3 PRO 125 HB3 PRO 125 11.330 0.158 3.391 949 HG2 PRO 125 HG2 PRO 125 11.054 1.918 1.412 950 HG3 PRO 125 HG3 PRO 125 12.601 1.108 1.716 951 HD2 PRO 125 HD2 PRO 125 10.576 0.584 -0.420 952 HD3 PRO 125 HD3 PRO 125 12.351 0.536 -0.491 953 H VAL 126 H VAL 126 9.165 -2.029 0.362 954 HA VAL 126 HA VAL 126 7.429 -3.186 2.298 955 HB VAL 126 HB VAL 126 7.508 -4.129 -0.583 956 HG11 VAL 126 HG11 VAL 126 5.121 -4.549 -0.224 957 HG12 VAL 126 HG12 VAL 126 5.290 -3.992 1.438 958 HG13 VAL 126 HG13 VAL 126 6.142 -5.443 0.906 959 HG21 VAL 126 HG21 VAL 126 5.865 -1.839 0.455 960 HG22 VAL 126 HG22 VAL 126 5.933 -2.434 -1.192 961 HG23 VAL 126 HG23 VAL 126 7.345 -1.633 -0.492 962 H ASP 127 H ASP 127 10.013 -4.475 0.397 963 HA ASP 127 HA ASP 127 9.492 -7.243 0.713 964 HB2 ASP 127 HB2 ASP 127 10.944 -6.052 -1.018 965 HB3 ASP 127 HB3 ASP 127 12.160 -5.923 0.240 966 H ALA 128 H ALA 128 11.174 -4.822 2.508 967 HA ALA 128 HA ALA 128 12.557 -6.489 4.331 968 HB1 ALA 128 HB1 ALA 128 13.221 -4.156 3.877 969 HB2 ALA 128 HB2 ALA 128 12.978 -4.453 5.596 970 HB3 ALA 128 HB3 ALA 128 11.748 -3.601 4.666 971 H LEU 129 H LEU 129 9.424 -4.809 4.468 972 HA LEU 129 HA LEU 129 8.952 -5.509 7.201 973 HB2 LEU 129 HB2 LEU 129 6.724 -4.628 6.939 974 HB3 LEU 129 HB3 LEU 129 7.869 -3.541 6.196 975 HG LEU 129 HG LEU 129 7.187 -4.892 4.045 976 HD11 LEU 129 HD11 LEU 129 4.803 -5.470 4.023 977 HD12 LEU 129 HD12 LEU 129 4.728 -5.120 5.756 978 HD13 LEU 129 HD13 LEU 129 5.741 -6.439 5.171 979 HD21 LEU 129 HD21 LEU 129 6.976 -2.489 4.284 980 HD22 LEU 129 HD22 LEU 129 5.533 -2.688 5.275 981 HD23 LEU 129 HD23 LEU 129 5.500 -3.142 3.573 982 H HIS 130 H HIS 130 8.197 -7.045 4.174 983 HA HIS 130 HA HIS 130 6.425 -9.039 5.128 984 HB2 HIS 130 HB2 HIS 130 6.856 -8.493 2.700 985 HB3 HIS 130 HB3 HIS 130 8.428 -9.260 2.856 986 HD1 HIS 130 HD1 HIS 130 8.454 -11.957 2.885 987 HD2 HIS 130 HD2 HIS 130 4.672 -10.203 2.569 988 HE1 HIS 130 HE1 HIS 130 6.892 -13.770 2.206 989 H ALA 131 H ALA 131 9.781 -8.596 5.174 990 HA ALA 131 HA ALA 131 10.319 -11.317 6.177 991 HB1 ALA 131 HB1 ALA 131 11.761 -10.569 4.378 992 HB2 ALA 131 HB2 ALA 131 12.708 -10.740 5.860 993 HB3 ALA 131 HB3 ALA 131 12.208 -9.138 5.301 994 H HIS 132 H HIS 132 9.131 -8.846 7.564 995 HA HIS 132 HA HIS 132 9.069 -7.861 9.527 996 HB2 HIS 132 HB2 HIS 132 10.188 -10.520 10.321 997 HB3 HIS 132 HB3 HIS 132 9.852 -9.279 11.525 998 HD1 HIS 132 HD1 HIS 132 8.216 -12.018 9.872 999 HD2 HIS 132 HD2 HIS 132 7.072 -8.281 11.250 1000 HE1 HIS 132 HE1 HIS 132 5.705 -12.082 10.062 1001 H GLN 133 H GLN 133 11.210 -7.114 8.006 1002 HA GLN 133 HA GLN 133 13.058 -6.089 10.044 1003 HB2 GLN 133 HB2 GLN 133 13.156 -5.995 7.007 1004 HB3 GLN 133 HB3 GLN 133 14.385 -5.301 8.061 1005 HG2 GLN 133 HG2 GLN 133 14.958 -7.493 8.890 1006 HG3 GLN 133 HG3 GLN 133 13.642 -8.218 7.972 1007 HE21 GLN 133 HE21 GLN 133 13.818 -8.368 5.780 1008 HE22 GLN 133 HE22 GLN 133 15.299 -8.321 4.932 1009 H ALA 134 H ALA 134 10.301 -5.538 9.681 1010 HA ALA 134 HA ALA 134 9.509 -3.291 8.298 1011 HB1 ALA 134 HB1 ALA 134 7.988 -4.938 9.300 1012 HB2 ALA 134 HB2 ALA 134 7.549 -3.278 9.697 1013 HB3 ALA 134 HB3 ALA 134 8.360 -4.285 10.895 1014 H ARG 135 H ARG 135 11.187 -3.434 11.334 1015 HA ARG 135 HA ARG 135 10.537 -0.980 12.481 1016 HB2 ARG 135 HB2 ARG 135 13.230 -2.341 12.469 1017 HB3 ARG 135 HB3 ARG 135 12.756 -1.036 13.538 1018 HG2 ARG 135 HG2 ARG 135 11.029 -2.483 14.511 1019 HG3 ARG 135 HG3 ARG 135 11.558 -3.784 13.444 1020 HD2 ARG 135 HD2 ARG 135 13.298 -2.405 15.483 1021 HD3 ARG 135 HD3 ARG 135 12.523 -3.972 15.704 1022 HE ARG 135 HE ARG 135 13.853 -4.565 13.601 1023 HH11 ARG 135 HH11 ARG 135 15.049 -2.366 16.138 1024 HH12 ARG 135 HH12 ARG 135 16.666 -2.856 15.995 1025 HH21 ARG 135 HH21 ARG 135 16.121 -5.232 13.419 1026 HH22 ARG 135 HH22 ARG 135 17.281 -4.515 14.435 1027 H GLU 136 H GLU 136 12.919 -1.688 9.974 1028 HA GLU 136 HA GLU 136 13.991 0.964 9.897 1029 HB2 GLU 136 HB2 GLU 136 14.129 -1.208 7.795 1030 HB3 GLU 136 HB3 GLU 136 15.175 0.202 7.907 1031 HG2 GLU 136 HG2 GLU 136 15.029 -2.098 9.845 1032 HG3 GLU 136 HG3 GLU 136 16.345 -1.729 8.731 1033 H VAL 137 H VAL 137 11.378 -0.702 8.443 1034 HA VAL 137 HA VAL 137 10.877 1.080 6.269 1035 HB VAL 137 HB VAL 137 8.969 -0.840 7.638 1036 HG11 VAL 137 HG11 VAL 137 7.736 -0.830 5.536 1037 HG12 VAL 137 HG12 VAL 137 8.880 0.324 4.863 1038 HG13 VAL 137 HG13 VAL 137 7.839 0.800 6.206 1039 HG21 VAL 137 HG21 VAL 137 10.807 -1.296 5.296 1040 HG22 VAL 137 HG22 VAL 137 9.589 -2.435 5.866 1041 HG23 VAL 137 HG23 VAL 137 10.953 -2.012 6.899 1042 H VAL 138 H VAL 138 9.645 0.653 9.531 1043 HA VAL 138 HA VAL 138 7.754 2.719 9.663 1044 HB VAL 138 HB VAL 138 9.675 1.857 11.826 1045 HG11 VAL 138 HG11 VAL 138 8.560 3.945 12.396 1046 HG12 VAL 138 HG12 VAL 138 7.905 2.651 13.404 1047 HG13 VAL 138 HG13 VAL 138 6.988 3.242 12.023 1048 HG21 VAL 138 HG21 VAL 138 7.869 0.350 12.609 1049 HG22 VAL 138 HG22 VAL 138 8.439 -0.064 10.991 1050 HG23 VAL 138 HG23 VAL 138 6.914 0.799 11.198 1051 H ARG 139 H ARG 139 11.193 2.659 10.348 1052 HA ARG 139 HA ARG 139 11.405 5.377 10.933 1053 HB2 ARG 139 HB2 ARG 139 13.436 3.342 10.159 1054 HB3 ARG 139 HB3 ARG 139 13.909 5.004 10.597 1055 HG2 ARG 139 HG2 ARG 139 12.507 4.481 12.731 1056 HG3 ARG 139 HG3 ARG 139 12.732 2.801 12.251 1057 HD2 ARG 139 HD2 ARG 139 14.948 4.783 12.698 1058 HD3 ARG 139 HD3 ARG 139 14.387 3.614 13.893 1059 HE ARG 139 HE ARG 139 15.124 2.201 11.635 1060 HH11 ARG 139 HH11 ARG 139 16.670 4.377 13.953 1061 HH12 ARG 139 HH12 ARG 139 18.191 3.607 13.880 1062 HH21 ARG 139 HH21 ARG 139 17.247 1.133 11.566 1063 HH22 ARG 139 HH22 ARG 139 18.515 1.732 12.535 1064 H ARG 140 H ARG 140 11.790 3.689 7.859 1065 HA ARG 140 HA ARG 140 12.550 5.987 6.419 1066 HB2 ARG 140 HB2 ARG 140 12.783 3.743 5.422 1067 HB3 ARG 140 HB3 ARG 140 11.034 3.558 5.395 1068 HG2 ARG 140 HG2 ARG 140 11.830 4.109 3.173 1069 HG3 ARG 140 HG3 ARG 140 10.876 5.445 3.812 1070 HD2 ARG 140 HD2 ARG 140 12.765 6.439 2.792 1071 HD3 ARG 140 HD3 ARG 140 13.087 6.507 4.517 1072 HE ARG 140 HE ARG 140 14.344 4.733 2.546 1073 HH11 ARG 140 HH11 ARG 140 14.386 5.983 5.891 1074 HH12 ARG 140 HH12 ARG 140 15.981 5.489 6.168 1075 HH21 ARG 140 HH21 ARG 140 16.528 4.115 2.946 1076 HH22 ARG 140 HH22 ARG 140 17.232 4.375 4.473 1077 H ALA 141 H ALA 141 9.403 4.730 7.329 1078 HA ALA 141 HA ALA 141 7.794 6.542 5.896 1079 HB1 ALA 141 HB1 ALA 141 7.235 5.247 8.571 1080 HB2 ALA 141 HB2 ALA 141 6.892 4.532 6.994 1081 HB3 ALA 141 HB3 ALA 141 6.033 5.984 7.511 1082 H GLN 142 H GLN 142 9.205 6.673 9.115 1083 HA GLN 142 HA GLN 142 8.247 9.162 9.981 1084 HB2 GLN 142 HB2 GLN 142 10.935 7.917 10.512 1085 HB3 GLN 142 HB3 GLN 142 10.228 9.242 11.417 1086 HG2 GLN 142 HG2 GLN 142 8.504 7.802 12.252 1087 HG3 GLN 142 HG3 GLN 142 9.082 6.475 11.236 1088 HE21 GLN 142 HE21 GLN 142 8.849 6.605 14.126 1089 HE22 GLN 142 HE22 GLN 142 10.444 6.329 14.730 1090 H ALA 143 H ALA 143 11.132 8.282 8.173 1091 HA ALA 143 HA ALA 143 12.278 10.821 7.927 1092 HB1 ALA 143 HB1 ALA 143 12.492 8.466 6.060 1093 HB2 ALA 143 HB2 ALA 143 13.487 8.741 7.490 1094 HB3 ALA 143 HB3 ALA 143 13.591 9.841 6.114 1095 H MET 144 H MET 144 9.696 9.332 6.182 1096 HA MET 144 HA MET 144 9.712 11.247 4.024 1097 HB2 MET 144 HB2 MET 144 8.917 8.983 3.596 1098 HB3 MET 144 HB3 MET 144 7.670 9.165 4.821 1099 HG2 MET 144 HG2 MET 144 6.711 9.370 2.613 1100 HG3 MET 144 HG3 MET 144 6.601 10.906 3.462 1101 HE1 MET 144 HE1 MET 144 6.055 12.155 1.204 1102 HE2 MET 144 HE2 MET 144 6.135 10.616 0.343 1103 HE3 MET 144 HE3 MET 144 7.032 12.011 -0.257 1104 H ALA 145 H ALA 145 8.057 10.830 7.060 1105 HA ALA 145 HA ALA 145 6.167 12.958 6.514 1106 HB1 ALA 145 HB1 ALA 145 5.286 12.507 8.736 1107 HB2 ALA 145 HB2 ALA 145 6.663 11.467 9.091 1108 HB3 ALA 145 HB3 ALA 145 5.500 10.994 7.856 1109 H TYR 146 H TYR 146 9.017 12.484 8.521 1110 HA TYR 146 HA TYR 146 9.100 15.355 9.011 1111 HB2 TYR 146 HB2 TYR 146 9.900 13.165 10.942 1112 HB3 TYR 146 HB3 TYR 146 10.001 14.896 11.219 1113 HD1 TYR 146 HD1 TYR 146 7.709 16.179 11.010 1114 HD2 TYR 146 HD2 TYR 146 8.075 12.013 11.764 1115 HE1 TYR 146 HE1 TYR 146 5.456 16.163 11.989 1116 HE2 TYR 146 HE2 TYR 146 5.826 11.986 12.739 1117 HH TYR 146 HH TYR 146 4.334 13.615 13.832 Start of MODEL 17 1 H MET 1 H MET 1 -12.280 13.173 44.899 2 HA MET 1 HA MET 1 -12.792 15.496 44.288 3 HB2 MET 1 HB2 MET 1 -10.635 14.148 42.634 4 HB3 MET 1 HB3 MET 1 -10.778 15.885 42.842 5 HG2 MET 1 HG2 MET 1 -10.439 15.617 45.256 6 HG3 MET 1 HG3 MET 1 -10.275 13.878 45.023 7 HE1 MET 1 HE1 MET 1 -8.126 15.666 46.541 8 HE2 MET 1 HE2 MET 1 -6.631 14.996 45.886 9 HE3 MET 1 HE3 MET 1 -7.967 13.926 46.307 10 HA PRO 2 HA PRO 2 -15.422 15.753 40.777 11 HB2 PRO 2 HB2 PRO 2 -15.529 18.459 40.532 12 HB3 PRO 2 HB3 PRO 2 -16.408 17.566 41.778 13 HG2 PRO 2 HG2 PRO 2 -13.833 19.072 41.983 14 HG3 PRO 2 HG3 PRO 2 -15.178 18.998 43.133 15 HD2 PRO 2 HD2 PRO 2 -12.889 17.568 43.432 16 HD3 PRO 2 HD3 PRO 2 -14.466 17.013 44.031 17 H GLY 3 H GLY 3 -14.308 14.960 39.048 18 HA2 GLY 3 HA2 GLY 3 -13.562 16.721 37.021 19 HA3 GLY 3 HA3 GLY 3 -12.091 16.275 37.866 20 H ARG 4 H ARG 4 -14.708 13.975 37.546 21 HA ARG 4 HA ARG 4 -12.956 12.171 36.168 22 HB2 ARG 4 HB2 ARG 4 -15.906 11.938 36.818 23 HB3 ARG 4 HB3 ARG 4 -14.917 10.646 36.164 24 HG2 ARG 4 HG2 ARG 4 -13.567 10.604 38.164 25 HG3 ARG 4 HG3 ARG 4 -14.453 11.982 38.823 26 HD2 ARG 4 HD2 ARG 4 -16.505 10.645 38.810 27 HD3 ARG 4 HD3 ARG 4 -15.604 9.268 38.174 28 HE ARG 4 HE ARG 4 -14.246 9.822 40.402 29 HH11 ARG 4 HH11 ARG 4 -17.720 9.402 39.867 30 HH12 ARG 4 HH12 ARG 4 -18.026 8.835 41.444 31 HH21 ARG 4 HH21 ARG 4 -14.680 9.043 42.552 32 HH22 ARG 4 HH22 ARG 4 -16.283 8.652 43.005 33 H ALA 5 H ALA 5 -12.875 11.750 34.025 34 HA ALA 5 HA ALA 5 -14.731 13.267 32.343 35 HB1 ALA 5 HB1 ALA 5 -12.963 13.371 30.672 36 HB2 ALA 5 HB2 ALA 5 -11.910 12.416 31.711 37 HB3 ALA 5 HB3 ALA 5 -12.395 14.040 32.203 38 HA PRO 6 HA PRO 6 -16.065 9.300 30.855 39 HB2 PRO 6 HB2 PRO 6 -17.364 10.124 28.624 40 HB3 PRO 6 HB3 PRO 6 -18.036 10.339 30.243 41 HG2 PRO 6 HG2 PRO 6 -16.581 12.299 28.522 42 HG3 PRO 6 HG3 PRO 6 -18.043 12.545 29.497 43 HD2 PRO 6 HD2 PRO 6 -15.601 13.338 30.330 44 HD3 PRO 6 HD3 PRO 6 -16.840 12.762 31.463 45 H GLY 7 H GLY 7 -15.346 7.795 29.434 46 HA2 GLY 7 HA2 GLY 7 -12.968 8.411 27.967 47 HA3 GLY 7 HA3 GLY 7 -13.728 6.838 28.174 48 H SER 8 H SER 8 -13.678 9.747 26.278 49 HA SER 8 HA SER 8 -15.415 8.471 24.336 50 HB2 SER 8 HB2 SER 8 -14.224 11.254 24.317 51 HB3 SER 8 HB3 SER 8 -15.476 10.644 23.234 52 HG SER 8 HG SER 8 -16.085 10.205 25.806 53 H THR 9 H THR 9 -14.343 7.045 23.121 54 HA THR 9 HA THR 9 -11.551 7.407 22.412 55 HB THR 9 HB THR 9 -13.459 5.194 21.592 56 HG1 THR 9 HG1 THR 9 -12.267 5.752 24.045 57 HG21 THR 9 HG21 THR 9 -11.332 5.278 20.341 58 HG22 THR 9 HG22 THR 9 -11.397 3.857 21.384 59 HG23 THR 9 HG23 THR 9 -10.440 5.255 21.862 60 H LEU 10 H LEU 10 -10.842 7.704 20.249 61 HA LEU 10 HA LEU 10 -12.786 8.961 18.519 62 HB2 LEU 10 HB2 LEU 10 -9.809 8.575 18.181 63 HB3 LEU 10 HB3 LEU 10 -10.831 9.525 17.129 64 HG LEU 10 HG LEU 10 -10.232 10.143 20.025 65 HD11 LEU 10 HD11 LEU 10 -9.304 11.469 17.487 66 HD12 LEU 10 HD12 LEU 10 -8.318 10.512 18.591 67 HD13 LEU 10 HD13 LEU 10 -8.993 12.050 19.124 68 HD21 LEU 10 HD21 LEU 10 -11.387 12.275 19.589 69 HD22 LEU 10 HD22 LEU 10 -12.470 10.896 19.417 70 HD23 LEU 10 HD23 LEU 10 -11.831 11.698 17.983 71 H ALA 11 H ALA 11 -12.854 8.386 16.253 72 HA ALA 11 HA ALA 11 -13.334 5.579 15.957 73 HB1 ALA 11 HB1 ALA 11 -14.830 7.232 14.979 74 HB2 ALA 11 HB2 ALA 11 -14.122 6.227 13.715 75 HB3 ALA 11 HB3 ALA 11 -13.516 7.858 13.988 76 H ARG 12 H ARG 12 -12.296 4.229 14.494 77 HA ARG 12 HA ARG 12 -9.580 5.112 13.963 78 HB2 ARG 12 HB2 ARG 12 -8.822 2.803 13.660 79 HB3 ARG 12 HB3 ARG 12 -9.694 2.915 15.169 80 HG2 ARG 12 HG2 ARG 12 -10.957 1.881 12.648 81 HG3 ARG 12 HG3 ARG 12 -10.045 0.846 13.735 82 HD2 ARG 12 HD2 ARG 12 -11.611 1.086 15.442 83 HD3 ARG 12 HD3 ARG 12 -12.365 2.496 14.716 84 HE ARG 12 HE ARG 12 -12.535 0.304 12.965 85 HH11 ARG 12 HH11 ARG 12 -13.943 1.364 16.021 86 HH12 ARG 12 HH12 ARG 12 -15.482 0.746 15.684 87 HH21 ARG 12 HH21 ARG 12 -14.467 -0.557 12.524 88 HH22 ARG 12 HH22 ARG 12 -15.820 -0.464 13.573 89 H VAL 13 H VAL 13 -9.841 6.366 12.343 90 HA VAL 13 HA VAL 13 -10.912 5.209 9.920 91 HB VAL 13 HB VAL 13 -11.325 7.566 9.173 92 HG11 VAL 13 HG11 VAL 13 -13.148 6.205 10.042 93 HG12 VAL 13 HG12 VAL 13 -13.343 7.889 10.536 94 HG13 VAL 13 HG13 VAL 13 -12.743 6.696 11.687 95 HG21 VAL 13 HG21 VAL 13 -10.732 8.216 12.064 96 HG22 VAL 13 HG22 VAL 13 -11.416 9.328 10.880 97 HG23 VAL 13 HG23 VAL 13 -9.771 8.723 10.673 98 H GLY 14 H GLY 14 -9.692 4.997 8.364 99 HA2 GLY 14 HA2 GLY 14 -7.398 6.719 7.897 100 HA3 GLY 14 HA3 GLY 14 -7.078 4.987 8.062 101 H SER 15 H SER 15 -9.753 6.756 6.680 102 HA SER 15 HA SER 15 -9.984 4.864 4.558 103 HB2 SER 15 HB2 SER 15 -11.428 7.480 4.923 104 HB3 SER 15 HB3 SER 15 -11.937 6.102 3.945 105 HG SER 15 HG SER 15 -11.522 5.221 6.421 106 H ILE 16 H ILE 16 -8.311 4.968 3.210 107 HA ILE 16 HA ILE 16 -7.912 7.514 1.837 108 HB ILE 16 HB ILE 16 -6.039 5.120 2.022 109 HG12 ILE 16 HG12 ILE 16 -6.145 6.350 4.155 110 HG13 ILE 16 HG13 ILE 16 -4.576 6.547 3.388 111 HG21 ILE 16 HG21 ILE 16 -4.383 6.558 0.921 112 HG22 ILE 16 HG22 ILE 16 -5.608 7.813 0.742 113 HG23 ILE 16 HG23 ILE 16 -5.794 6.271 -0.098 114 HD11 ILE 16 HD11 ILE 16 -5.330 8.642 4.360 115 HD12 ILE 16 HD12 ILE 16 -6.817 8.572 3.414 116 HD13 ILE 16 HD13 ILE 16 -5.268 8.779 2.603 117 HA PRO 17 HA PRO 17 -10.042 5.272 -1.486 118 HB2 PRO 17 HB2 PRO 17 -9.136 7.608 -3.076 119 HB3 PRO 17 HB3 PRO 17 -10.774 6.989 -2.837 120 HG2 PRO 17 HG2 PRO 17 -9.999 9.254 -1.667 121 HG3 PRO 17 HG3 PRO 17 -11.050 8.103 -0.826 122 HD2 PRO 17 HD2 PRO 17 -8.105 8.554 -0.503 123 HD3 PRO 17 HD3 PRO 17 -9.360 8.296 0.730 124 H ALA 18 H ALA 18 -9.341 4.555 -3.712 125 HA ALA 18 HA ALA 18 -6.581 3.745 -3.508 126 HB1 ALA 18 HB1 ALA 18 -8.631 3.123 -5.641 127 HB2 ALA 18 HB2 ALA 18 -8.304 2.150 -4.203 128 HB3 ALA 18 HB3 ALA 18 -7.057 2.346 -5.434 129 H GLY 19 H GLY 19 -4.919 4.750 -4.444 130 HA2 GLY 19 HA2 GLY 19 -5.503 6.960 -6.218 131 HA3 GLY 19 HA3 GLY 19 -4.005 6.649 -5.361 132 H ASP 20 H ASP 20 -2.378 6.119 -6.591 133 HA ASP 20 HA ASP 20 -2.993 5.143 -9.286 134 HB2 ASP 20 HB2 ASP 20 -2.070 7.395 -9.236 135 HB3 ASP 20 HB3 ASP 20 -0.679 6.825 -8.324 136 H ASP 21 H ASP 21 -2.177 3.302 -9.940 137 HA ASP 21 HA ASP 21 -0.920 1.515 -8.150 138 HB2 ASP 21 HB2 ASP 21 -2.423 0.701 -9.850 139 HB3 ASP 21 HB3 ASP 21 -1.427 1.380 -11.122 140 H VAL 22 H VAL 22 1.057 1.654 -7.512 141 HA VAL 22 HA VAL 22 3.067 3.028 -9.074 142 HB VAL 22 HB VAL 22 3.133 1.997 -6.225 143 HG11 VAL 22 HG11 VAL 22 5.215 3.263 -5.951 144 HG12 VAL 22 HG12 VAL 22 5.209 3.640 -7.676 145 HG13 VAL 22 HG13 VAL 22 5.405 1.971 -7.139 146 HG21 VAL 22 HG21 VAL 22 1.668 3.868 -6.567 147 HG22 VAL 22 HG22 VAL 22 2.946 4.755 -7.394 148 HG23 VAL 22 HG23 VAL 22 3.101 4.386 -5.678 149 H LEU 23 H LEU 23 2.399 -0.294 -8.191 150 HA LEU 23 HA LEU 23 5.077 -0.933 -8.986 151 HB2 LEU 23 HB2 LEU 23 4.504 -3.371 -8.512 152 HB3 LEU 23 HB3 LEU 23 4.591 -2.289 -7.153 153 HG LEU 23 HG LEU 23 2.157 -2.339 -6.912 154 HD11 LEU 23 HD11 LEU 23 2.197 -4.174 -9.295 155 HD12 LEU 23 HD12 LEU 23 1.534 -2.537 -9.268 156 HD13 LEU 23 HD13 LEU 23 0.797 -3.811 -8.292 157 HD21 LEU 23 HD21 LEU 23 3.361 -4.064 -5.791 158 HD22 LEU 23 HD22 LEU 23 3.389 -5.055 -7.254 159 HD23 LEU 23 HD23 LEU 23 1.861 -4.726 -6.446 160 H ASP 24 H ASP 24 5.285 -3.018 -10.373 161 HA ASP 24 HA ASP 24 4.472 -2.115 -12.960 162 HB2 ASP 24 HB2 ASP 24 6.654 -3.290 -12.361 163 HB3 ASP 24 HB3 ASP 24 5.726 -4.780 -12.280 164 HA PRO 25 HA PRO 25 0.539 -4.225 -13.192 165 HB2 PRO 25 HB2 PRO 25 0.598 -4.755 -15.930 166 HB3 PRO 25 HB3 PRO 25 -0.028 -3.295 -15.160 167 HG2 PRO 25 HG2 PRO 25 2.629 -3.784 -16.422 168 HG3 PRO 25 HG3 PRO 25 1.630 -2.320 -16.441 169 HD2 PRO 25 HD2 PRO 25 3.792 -2.520 -14.886 170 HD3 PRO 25 HD3 PRO 25 2.339 -1.666 -14.325 171 H ASP 26 H ASP 26 3.478 -5.693 -14.326 172 HA ASP 26 HA ASP 26 2.347 -8.273 -14.867 173 HB2 ASP 26 HB2 ASP 26 4.441 -7.564 -15.922 174 HB3 ASP 26 HB3 ASP 26 5.212 -7.496 -14.343 175 H GLU 27 H GLU 27 3.326 -6.653 -12.018 176 HA GLU 27 HA GLU 27 4.077 -8.864 -10.433 177 HB2 GLU 27 HB2 GLU 27 2.864 -6.231 -9.575 178 HB3 GLU 27 HB3 GLU 27 3.642 -7.389 -8.508 179 HG2 GLU 27 HG2 GLU 27 4.967 -5.907 -10.755 180 HG3 GLU 27 HG3 GLU 27 5.097 -5.507 -9.043 181 HA PRO 28 HA PRO 28 0.162 -10.778 -9.869 182 HB2 PRO 28 HB2 PRO 28 0.690 -12.143 -7.551 183 HB3 PRO 28 HB3 PRO 28 1.251 -12.673 -9.140 184 HG2 PRO 28 HG2 PRO 28 2.734 -11.232 -6.989 185 HG3 PRO 28 HG3 PRO 28 3.304 -12.505 -8.081 186 HD2 PRO 28 HD2 PRO 28 3.874 -9.869 -8.434 187 HD3 PRO 28 HD3 PRO 28 3.742 -11.009 -9.780 188 H THR 29 H THR 29 -1.329 -9.304 -9.358 189 HA THR 29 HA THR 29 -1.179 -8.076 -6.744 190 HB THR 29 HB THR 29 -2.943 -6.543 -7.800 191 HG1 THR 29 HG1 THR 29 -3.374 -7.730 -9.703 192 HG21 THR 29 HG21 THR 29 -0.091 -6.559 -8.808 193 HG22 THR 29 HG22 THR 29 -0.654 -5.839 -7.300 194 HG23 THR 29 HG23 THR 29 -1.172 -5.169 -8.850 195 H TYR 30 H TYR 30 -3.305 -7.526 -5.829 196 HA TYR 30 HA TYR 30 -5.125 -9.784 -5.992 197 HB2 TYR 30 HB2 TYR 30 -4.398 -7.863 -3.803 198 HB3 TYR 30 HB3 TYR 30 -5.904 -8.774 -3.766 199 HD1 TYR 30 HD1 TYR 30 -5.700 -11.297 -4.043 200 HD2 TYR 30 HD2 TYR 30 -2.465 -8.806 -2.898 201 HE1 TYR 30 HE1 TYR 30 -4.587 -13.223 -3.095 202 HE2 TYR 30 HE2 TYR 30 -1.318 -10.750 -1.912 203 HH TYR 30 HH TYR 30 -1.764 -12.904 -1.110 204 H ASP 31 H ASP 31 -7.343 -9.145 -5.736 205 HA ASP 31 HA ASP 31 -8.024 -6.459 -6.665 206 HB2 ASP 31 HB2 ASP 31 -7.880 -8.239 -8.573 207 HB3 ASP 31 HB3 ASP 31 -9.228 -9.023 -7.768 208 H LEU 32 H LEU 32 -10.466 -6.312 -6.244 209 HA LEU 32 HA LEU 32 -10.806 -6.890 -3.525 210 HB2 LEU 32 HB2 LEU 32 -12.856 -5.966 -5.525 211 HB3 LEU 32 HB3 LEU 32 -13.136 -6.054 -3.798 212 HG LEU 32 HG LEU 32 -11.106 -4.280 -5.169 213 HD11 LEU 32 HD11 LEU 32 -12.525 -2.446 -4.397 214 HD12 LEU 32 HD12 LEU 32 -13.703 -3.612 -3.806 215 HD13 LEU 32 HD13 LEU 32 -13.363 -3.498 -5.533 216 HD21 LEU 32 HD21 LEU 32 -10.287 -4.960 -2.983 217 HD22 LEU 32 HD22 LEU 32 -11.833 -4.520 -2.250 218 HD23 LEU 32 HD23 LEU 32 -10.800 -3.274 -2.942 219 HA PRO 33 HA PRO 33 -13.948 -10.448 -4.694 220 HB2 PRO 33 HB2 PRO 33 -13.250 -11.656 -7.108 221 HB3 PRO 33 HB3 PRO 33 -14.655 -10.612 -6.863 222 HG2 PRO 33 HG2 PRO 33 -11.964 -9.945 -7.976 223 HG3 PRO 33 HG3 PRO 33 -13.564 -9.379 -8.493 224 HD2 PRO 33 HD2 PRO 33 -11.958 -7.813 -7.046 225 HD3 PRO 33 HD3 PRO 33 -13.710 -7.836 -6.753 226 H ARG 34 H ARG 34 -10.604 -10.427 -5.946 227 HA ARG 34 HA ARG 34 -9.998 -13.085 -5.320 228 HB2 ARG 34 HB2 ARG 34 -8.743 -11.542 -6.892 229 HB3 ARG 34 HB3 ARG 34 -8.073 -10.776 -5.469 230 HG2 ARG 34 HG2 ARG 34 -6.527 -12.399 -6.456 231 HG3 ARG 34 HG3 ARG 34 -6.999 -12.850 -4.810 232 HD2 ARG 34 HD2 ARG 34 -8.552 -14.434 -5.596 233 HD3 ARG 34 HD3 ARG 34 -8.392 -13.863 -7.254 234 HE ARG 34 HE ARG 34 -5.897 -14.718 -6.583 235 HH11 ARG 34 HH11 ARG 34 -9.107 -16.253 -6.373 236 HH12 ARG 34 HH12 ARG 34 -8.510 -17.819 -6.690 237 HH21 ARG 34 HH21 ARG 34 -5.095 -16.907 -6.972 238 HH22 ARG 34 HH22 ARG 34 -6.207 -18.189 -7.055 239 H VAL 35 H VAL 35 -9.610 -10.060 -3.519 240 HA VAL 35 HA VAL 35 -8.315 -11.370 -1.360 241 HB VAL 35 HB VAL 35 -9.696 -8.650 -1.316 242 HG11 VAL 35 HG11 VAL 35 -8.339 -8.155 0.667 243 HG12 VAL 35 HG12 VAL 35 -7.695 -9.796 0.635 244 HG13 VAL 35 HG13 VAL 35 -9.411 -9.529 0.942 245 HG21 VAL 35 HG21 VAL 35 -7.909 -8.697 -2.935 246 HG22 VAL 35 HG22 VAL 35 -6.798 -9.350 -1.729 247 HG23 VAL 35 HG23 VAL 35 -7.437 -7.721 -1.542 248 H ALA 36 H ALA 36 -11.613 -10.572 -2.050 249 HA ALA 36 HA ALA 36 -12.811 -11.351 0.331 250 HB1 ALA 36 HB1 ALA 36 -14.784 -11.887 -1.018 251 HB2 ALA 36 HB2 ALA 36 -13.800 -11.864 -2.486 252 HB3 ALA 36 HB3 ALA 36 -14.049 -10.377 -1.564 253 H GLU 37 H GLU 37 -11.606 -13.208 -2.347 254 HA GLU 37 HA GLU 37 -12.302 -15.805 -1.492 255 HB2 GLU 37 HB2 GLU 37 -10.198 -14.692 -3.244 256 HB3 GLU 37 HB3 GLU 37 -10.359 -16.403 -3.075 257 HG2 GLU 37 HG2 GLU 37 -12.834 -15.925 -3.807 258 HG3 GLU 37 HG3 GLU 37 -12.195 -14.357 -4.279 259 H LEU 38 H LEU 38 -9.397 -13.871 -1.134 260 HA LEU 38 HA LEU 38 -7.748 -15.815 0.026 261 HB2 LEU 38 HB2 LEU 38 -6.941 -13.782 -1.064 262 HB3 LEU 38 HB3 LEU 38 -7.636 -12.817 0.220 263 HG LEU 38 HG LEU 38 -6.079 -13.918 1.812 264 HD11 LEU 38 HD11 LEU 38 -5.621 -15.962 0.592 265 HD12 LEU 38 HD12 LEU 38 -4.119 -15.095 0.907 266 HD13 LEU 38 HD13 LEU 38 -4.844 -15.045 -0.696 267 HD21 LEU 38 HD21 LEU 38 -4.820 -12.452 -0.505 268 HD22 LEU 38 HD22 LEU 38 -4.112 -12.642 1.100 269 HD23 LEU 38 HD23 LEU 38 -5.598 -11.720 0.899 270 H LEU 39 H LEU 39 -9.703 -13.261 1.514 271 HA LEU 39 HA LEU 39 -8.947 -14.263 4.153 272 HB2 LEU 39 HB2 LEU 39 -10.501 -11.824 3.362 273 HB3 LEU 39 HB3 LEU 39 -10.125 -12.261 5.019 274 HG LEU 39 HG LEU 39 -8.128 -11.537 2.867 275 HD11 LEU 39 HD11 LEU 39 -7.746 -9.534 4.213 276 HD12 LEU 39 HD12 LEU 39 -9.033 -10.030 5.312 277 HD13 LEU 39 HD13 LEU 39 -9.410 -9.624 3.636 278 HD21 LEU 39 HD21 LEU 39 -6.479 -11.565 4.691 279 HD22 LEU 39 HD22 LEU 39 -7.182 -13.160 4.430 280 HD23 LEU 39 HD23 LEU 39 -7.714 -12.177 5.791 281 H GLY 40 H GLY 40 -11.409 -14.786 1.982 282 HA2 GLY 40 HA2 GLY 40 -13.339 -16.011 2.154 283 HA3 GLY 40 HA3 GLY 40 -12.878 -16.393 3.811 284 H VAL 41 H VAL 41 -13.227 -13.181 2.586 285 HA VAL 41 HA VAL 41 -15.623 -12.781 4.270 286 HB VAL 41 HB VAL 41 -14.819 -10.604 4.994 287 HG11 VAL 41 HG11 VAL 41 -12.687 -12.667 5.435 288 HG12 VAL 41 HG12 VAL 41 -14.152 -12.434 6.386 289 HG13 VAL 41 HG13 VAL 41 -12.895 -11.194 6.384 290 HG21 VAL 41 HG21 VAL 41 -13.580 -9.885 3.044 291 HG22 VAL 41 HG22 VAL 41 -12.358 -11.125 3.323 292 HG23 VAL 41 HG23 VAL 41 -12.533 -9.788 4.461 293 HA PRO 42 HA PRO 42 -17.288 -10.866 0.625 294 HB2 PRO 42 HB2 PRO 42 -18.726 -8.784 1.650 295 HB3 PRO 42 HB3 PRO 42 -19.292 -10.459 1.705 296 HG2 PRO 42 HG2 PRO 42 -17.939 -8.850 3.842 297 HG3 PRO 42 HG3 PRO 42 -19.324 -9.946 3.984 298 HD2 PRO 42 HD2 PRO 42 -16.855 -10.710 4.704 299 HD3 PRO 42 HD3 PRO 42 -17.988 -11.841 3.939 300 H VAL 43 H VAL 43 -17.044 -9.043 -0.725 301 HA VAL 43 HA VAL 43 -14.669 -7.594 -0.542 302 HB VAL 43 HB VAL 43 -17.147 -7.056 -2.213 303 HG11 VAL 43 HG11 VAL 43 -15.636 -5.677 -3.656 304 HG12 VAL 43 HG12 VAL 43 -14.422 -5.775 -2.362 305 HG13 VAL 43 HG13 VAL 43 -15.961 -4.989 -2.068 306 HG21 VAL 43 HG21 VAL 43 -15.876 -8.060 -4.023 307 HG22 VAL 43 HG22 VAL 43 -16.006 -9.179 -2.670 308 HG23 VAL 43 HG23 VAL 43 -14.500 -8.300 -2.950 309 H SER 44 H SER 44 -17.881 -6.839 0.501 310 HA SER 44 HA SER 44 -17.640 -4.134 1.054 311 HB2 SER 44 HB2 SER 44 -19.758 -5.407 1.120 312 HB3 SER 44 HB3 SER 44 -19.230 -6.206 2.598 313 HG SER 44 HG SER 44 -19.888 -3.512 2.142 314 H LYS 45 H LYS 45 -16.636 -6.950 3.068 315 HA LYS 45 HA LYS 45 -15.862 -5.315 5.276 316 HB2 LYS 45 HB2 LYS 45 -16.387 -7.758 5.554 317 HB3 LYS 45 HB3 LYS 45 -14.902 -8.124 4.678 318 HG2 LYS 45 HG2 LYS 45 -13.583 -7.032 6.384 319 HG3 LYS 45 HG3 LYS 45 -15.047 -6.611 7.268 320 HD2 LYS 45 HD2 LYS 45 -15.537 -9.004 7.567 321 HD3 LYS 45 HD3 LYS 45 -14.066 -9.402 6.677 322 HE2 LYS 45 HE2 LYS 45 -13.662 -9.579 9.062 323 HE3 LYS 45 HE3 LYS 45 -12.741 -8.241 8.381 324 HZ1 LYS 45 HZ1 LYS 45 -13.768 -7.661 10.485 325 HZ2 LYS 45 HZ2 LYS 45 -15.295 -7.982 9.871 326 HZ3 LYS 45 HZ3 LYS 45 -14.402 -6.698 9.261 327 H VAL 46 H VAL 46 -14.268 -6.598 2.461 328 HA VAL 46 HA VAL 46 -11.609 -5.942 3.125 329 HB VAL 46 HB VAL 46 -12.871 -5.934 0.357 330 HG11 VAL 46 HG11 VAL 46 -10.600 -6.354 -0.478 331 HG12 VAL 46 HG12 VAL 46 -9.984 -6.211 1.174 332 HG13 VAL 46 HG13 VAL 46 -10.715 -4.818 0.385 333 HG21 VAL 46 HG21 VAL 46 -13.217 -8.081 1.465 334 HG22 VAL 46 HG22 VAL 46 -11.494 -8.184 1.833 335 HG23 VAL 46 HG23 VAL 46 -12.043 -8.246 0.160 336 H ALA 47 H ALA 47 -14.125 -4.147 1.465 337 HA ALA 47 HA ALA 47 -12.746 -1.754 1.005 338 HB1 ALA 47 HB1 ALA 47 -14.967 -0.733 0.774 339 HB2 ALA 47 HB2 ALA 47 -15.698 -2.149 1.525 340 HB3 ALA 47 HB3 ALA 47 -14.905 -2.296 -0.042 341 H GLN 48 H GLN 48 -14.490 -2.949 3.796 342 HA GLN 48 HA GLN 48 -14.442 -0.578 5.319 343 HB2 GLN 48 HB2 GLN 48 -14.551 -3.445 6.236 344 HB3 GLN 48 HB3 GLN 48 -14.661 -2.075 7.322 345 HG2 GLN 48 HG2 GLN 48 -16.672 -1.324 6.130 346 HG3 GLN 48 HG3 GLN 48 -16.558 -2.752 5.100 347 HE21 GLN 48 HE21 GLN 48 -17.136 -1.606 8.301 348 HE22 GLN 48 HE22 GLN 48 -17.910 -3.018 8.906 349 H GLN 49 H GLN 49 -12.173 -3.247 5.085 350 HA GLN 49 HA GLN 49 -10.410 -2.528 7.161 351 HB2 GLN 49 HB2 GLN 49 -9.688 -3.832 4.533 352 HB3 GLN 49 HB3 GLN 49 -8.721 -3.860 6.000 353 HG2 GLN 49 HG2 GLN 49 -11.462 -5.056 5.727 354 HG3 GLN 49 HG3 GLN 49 -9.951 -5.931 5.538 355 HE21 GLN 49 HE21 GLN 49 -10.540 -7.310 7.252 356 HE22 GLN 49 HE22 GLN 49 -10.465 -6.806 8.893 357 H LEU 50 H LEU 50 -10.493 -1.655 3.814 358 HA LEU 50 HA LEU 50 -8.213 -0.012 3.647 359 HB2 LEU 50 HB2 LEU 50 -9.443 -0.798 1.687 360 HB3 LEU 50 HB3 LEU 50 -10.853 0.108 2.180 361 HG LEU 50 HG LEU 50 -9.586 2.210 1.791 362 HD11 LEU 50 HD11 LEU 50 -7.344 1.384 2.107 363 HD12 LEU 50 HD12 LEU 50 -7.505 2.113 0.510 364 HD13 LEU 50 HD13 LEU 50 -7.488 0.358 0.686 365 HD21 LEU 50 HD21 LEU 50 -9.754 0.333 -0.564 366 HD22 LEU 50 HD22 LEU 50 -9.660 2.091 -0.655 367 HD23 LEU 50 HD23 LEU 50 -11.067 1.321 0.074 368 H ARG 51 H ARG 51 -11.557 0.673 4.464 369 HA ARG 51 HA ARG 51 -11.160 3.441 4.876 370 HB2 ARG 51 HB2 ARG 51 -13.441 1.639 5.675 371 HB3 ARG 51 HB3 ARG 51 -13.461 3.389 5.852 372 HG2 ARG 51 HG2 ARG 51 -13.240 3.693 3.476 373 HG3 ARG 51 HG3 ARG 51 -13.046 1.962 3.233 374 HD2 ARG 51 HD2 ARG 51 -15.284 2.630 2.633 375 HD3 ARG 51 HD3 ARG 51 -15.334 1.622 4.070 376 HE ARG 51 HE ARG 51 -15.375 3.959 5.227 377 HH11 ARG 51 HH11 ARG 51 -17.062 3.076 2.221 378 HH12 ARG 51 HH12 ARG 51 -18.395 4.060 2.499 379 HH21 ARG 51 HH21 ARG 51 -17.237 5.352 5.617 380 HH22 ARG 51 HH22 ARG 51 -18.508 5.399 4.493 381 H GLU 52 H GLU 52 -10.665 0.689 6.902 382 HA GLU 52 HA GLU 52 -10.804 2.120 9.427 383 HB2 GLU 52 HB2 GLU 52 -9.588 -0.579 8.795 384 HB3 GLU 52 HB3 GLU 52 -9.908 0.058 10.388 385 HG2 GLU 52 HG2 GLU 52 -12.031 -0.582 8.355 386 HG3 GLU 52 HG3 GLU 52 -11.477 -1.692 9.600 387 H GLY 53 H GLY 53 -8.574 1.817 6.892 388 HA2 GLY 53 HA2 GLY 53 -6.395 2.547 6.700 389 HA3 GLY 53 HA3 GLY 53 -6.447 3.019 8.396 390 H HIS 54 H HIS 54 -7.247 -0.182 7.259 391 HA HIS 54 HA HIS 54 -4.960 -1.238 8.773 392 HB2 HIS 54 HB2 HIS 54 -7.422 -2.645 7.702 393 HB3 HIS 54 HB3 HIS 54 -6.085 -3.470 8.483 394 HD1 HIS 54 HD1 HIS 54 -9.162 -3.330 9.484 395 HD2 HIS 54 HD2 HIS 54 -5.904 -1.228 10.999 396 HE1 HIS 54 HE1 HIS 54 -9.731 -2.778 11.861 397 H LEU 55 H LEU 55 -5.944 -0.575 5.612 398 HA LEU 55 HA LEU 55 -3.721 -1.930 4.443 399 HB2 LEU 55 HB2 LEU 55 -5.456 -3.713 4.725 400 HB3 LEU 55 HB3 LEU 55 -6.559 -2.748 3.777 401 HG LEU 55 HG LEU 55 -5.082 -3.027 1.813 402 HD11 LEU 55 HD11 LEU 55 -3.296 -4.692 1.902 403 HD12 LEU 55 HD12 LEU 55 -3.538 -4.870 3.640 404 HD13 LEU 55 HD13 LEU 55 -2.961 -3.339 2.979 405 HD21 LEU 55 HD21 LEU 55 -5.581 -5.422 1.483 406 HD22 LEU 55 HD22 LEU 55 -6.951 -4.527 2.148 407 HD23 LEU 55 HD23 LEU 55 -5.974 -5.545 3.196 408 H VAL 56 H VAL 56 -3.552 -1.198 2.161 409 HA VAL 56 HA VAL 56 -5.408 0.912 1.437 410 HB VAL 56 HB VAL 56 -3.525 2.220 0.405 411 HG11 VAL 56 HG11 VAL 56 -3.346 1.866 3.386 412 HG12 VAL 56 HG12 VAL 56 -4.457 2.931 2.524 413 HG13 VAL 56 HG13 VAL 56 -2.721 3.241 2.475 414 HG21 VAL 56 HG21 VAL 56 -1.862 0.449 0.262 415 HG22 VAL 56 HG22 VAL 56 -1.784 0.371 2.020 416 HG23 VAL 56 HG23 VAL 56 -1.231 1.820 1.175 417 H ALA 57 H ALA 57 -5.393 1.373 -0.902 418 HA ALA 57 HA ALA 57 -4.569 -0.909 -2.503 419 HB1 ALA 57 HB1 ALA 57 -7.388 0.156 -2.363 420 HB2 ALA 57 HB2 ALA 57 -6.852 -1.393 -1.719 421 HB3 ALA 57 HB3 ALA 57 -6.811 -1.098 -3.460 422 H VAL 58 H VAL 58 -4.815 -0.404 -4.806 423 HA VAL 58 HA VAL 58 -4.863 2.448 -5.345 424 HB VAL 58 HB VAL 58 -3.058 2.070 -7.094 425 HG11 VAL 58 HG11 VAL 58 -2.687 3.264 -5.032 426 HG12 VAL 58 HG12 VAL 58 -1.255 2.310 -5.446 427 HG13 VAL 58 HG13 VAL 58 -2.368 1.753 -4.187 428 HG21 VAL 58 HG21 VAL 58 -3.101 -0.361 -7.180 429 HG22 VAL 58 HG22 VAL 58 -2.650 -0.453 -5.476 430 HG23 VAL 58 HG23 VAL 58 -1.507 0.181 -6.654 431 H ARG 59 H ARG 59 -5.000 2.860 -7.739 432 HA ARG 59 HA ARG 59 -7.055 1.049 -8.745 433 HB2 ARG 59 HB2 ARG 59 -7.955 3.206 -8.205 434 HB3 ARG 59 HB3 ARG 59 -6.659 4.018 -9.066 435 HG2 ARG 59 HG2 ARG 59 -7.515 3.122 -11.175 436 HG3 ARG 59 HG3 ARG 59 -8.818 2.326 -10.296 437 HD2 ARG 59 HD2 ARG 59 -9.720 4.425 -9.595 438 HD3 ARG 59 HD3 ARG 59 -8.323 5.288 -10.238 439 HE ARG 59 HE ARG 59 -9.043 4.530 -12.457 440 HH11 ARG 59 HH11 ARG 59 -11.508 4.703 -9.881 441 HH12 ARG 59 HH12 ARG 59 -12.785 4.943 -10.968 442 HH21 ARG 59 HH21 ARG 59 -10.802 4.891 -13.906 443 HH22 ARG 59 HH22 ARG 59 -12.390 5.065 -13.298 444 H ARG 60 H ARG 60 -6.564 -0.055 -10.394 445 HA ARG 60 HA ARG 60 -4.598 0.898 -12.357 446 HB2 ARG 60 HB2 ARG 60 -3.575 -0.948 -11.256 447 HB3 ARG 60 HB3 ARG 60 -5.076 -1.869 -11.270 448 HG2 ARG 60 HG2 ARG 60 -4.970 -1.996 -13.683 449 HG3 ARG 60 HG3 ARG 60 -3.423 -1.149 -13.688 450 HD2 ARG 60 HD2 ARG 60 -4.014 -3.791 -12.348 451 HD3 ARG 60 HD3 ARG 60 -3.125 -3.585 -13.857 452 HE ARG 60 HE ARG 60 -1.762 -2.062 -12.030 453 HH11 ARG 60 HH11 ARG 60 -2.654 -5.480 -12.208 454 HH12 ARG 60 HH12 ARG 60 -1.346 -6.008 -11.285 455 HH21 ARG 60 HH21 ARG 60 -0.044 -2.691 -10.902 456 HH22 ARG 60 HH22 ARG 60 0.292 -4.331 -10.538 457 H ALA 61 H ALA 61 -5.684 1.405 -14.134 458 HA ALA 61 HA ALA 61 -7.056 1.332 -15.948 459 HB1 ALA 61 HB1 ALA 61 -7.424 -1.577 -15.214 460 HB2 ALA 61 HB2 ALA 61 -6.151 -0.945 -16.254 461 HB3 ALA 61 HB3 ALA 61 -7.839 -0.841 -16.759 462 H GLY 62 H GLY 62 -8.052 1.716 -13.169 463 HA2 GLY 62 HA2 GLY 62 -10.181 2.601 -12.611 464 HA3 GLY 62 HA3 GLY 62 -10.890 1.543 -13.823 465 H GLY 63 H GLY 63 -8.935 -0.571 -12.515 466 HA2 GLY 63 HA2 GLY 63 -11.009 -1.526 -10.719 467 HA3 GLY 63 HA3 GLY 63 -9.634 -2.442 -11.327 468 H VAL 64 H VAL 64 -10.577 -2.161 -8.621 469 HA VAL 64 HA VAL 64 -8.425 -0.597 -7.412 470 HB VAL 64 HB VAL 64 -10.737 -2.072 -6.083 471 HG11 VAL 64 HG11 VAL 64 -8.835 -1.779 -4.596 472 HG12 VAL 64 HG12 VAL 64 -10.178 -0.746 -4.100 473 HG13 VAL 64 HG13 VAL 64 -8.804 -0.052 -4.956 474 HG21 VAL 64 HG21 VAL 64 -11.755 0.138 -5.745 475 HG22 VAL 64 HG22 VAL 64 -11.582 -0.248 -7.459 476 HG23 VAL 64 HG23 VAL 64 -10.458 0.874 -6.688 477 H VAL 65 H VAL 65 -6.655 -1.620 -6.906 478 HA VAL 65 HA VAL 65 -6.742 -4.499 -6.499 479 HB VAL 65 HB VAL 65 -4.566 -4.674 -7.784 480 HG11 VAL 65 HG11 VAL 65 -6.665 -5.419 -8.781 481 HG12 VAL 65 HG12 VAL 65 -5.622 -4.693 -10.007 482 HG13 VAL 65 HG13 VAL 65 -6.986 -3.785 -9.357 483 HG21 VAL 65 HG21 VAL 65 -4.046 -2.919 -9.411 484 HG22 VAL 65 HG22 VAL 65 -3.963 -2.302 -7.757 485 HG23 VAL 65 HG23 VAL 65 -5.371 -1.945 -8.770 486 H ILE 66 H ILE 66 -4.988 -5.313 -5.371 487 HA ILE 66 HA ILE 66 -3.648 -3.355 -3.640 488 HB ILE 66 HB ILE 66 -4.866 -6.010 -2.759 489 HG12 ILE 66 HG12 ILE 66 -5.737 -3.177 -2.139 490 HG13 ILE 66 HG13 ILE 66 -6.543 -4.253 -3.266 491 HG21 ILE 66 HG21 ILE 66 -3.515 -3.850 -1.133 492 HG22 ILE 66 HG22 ILE 66 -2.852 -5.446 -1.486 493 HG23 ILE 66 HG23 ILE 66 -4.296 -5.291 -0.481 494 HD11 ILE 66 HD11 ILE 66 -6.283 -4.638 -0.298 495 HD12 ILE 66 HD12 ILE 66 -7.078 -5.757 -1.408 496 HD13 ILE 66 HD13 ILE 66 -7.731 -4.138 -1.170 497 HA PRO 67 HA PRO 67 -0.086 -5.654 -5.122 498 HB2 PRO 67 HB2 PRO 67 1.237 -4.621 -2.690 499 HB3 PRO 67 HB3 PRO 67 1.706 -4.443 -4.374 500 HG2 PRO 67 HG2 PRO 67 0.682 -2.378 -3.041 501 HG3 PRO 67 HG3 PRO 67 0.265 -2.663 -4.742 502 HD2 PRO 67 HD2 PRO 67 -1.323 -3.253 -2.275 503 HD3 PRO 67 HD3 PRO 67 -1.852 -2.584 -3.836 504 H GLN 68 H GLN 68 0.725 -7.615 -4.781 505 HA GLN 68 HA GLN 68 -0.220 -9.604 -3.149 506 HB2 GLN 68 HB2 GLN 68 1.295 -9.795 -5.137 507 HB3 GLN 68 HB3 GLN 68 2.623 -9.322 -4.105 508 HG2 GLN 68 HG2 GLN 68 2.777 -11.657 -4.337 509 HG3 GLN 68 HG3 GLN 68 2.145 -11.370 -2.723 510 HE21 GLN 68 HE21 GLN 68 0.164 -11.100 -5.611 511 HE22 GLN 68 HE22 GLN 68 -0.777 -12.516 -5.302 512 H VAL 69 H VAL 69 2.486 -7.488 -2.619 513 HA VAL 69 HA VAL 69 3.551 -8.775 -0.332 514 HB VAL 69 HB VAL 69 5.091 -6.838 -0.274 515 HG11 VAL 69 HG11 VAL 69 6.176 -7.359 -2.427 516 HG12 VAL 69 HG12 VAL 69 4.698 -8.148 -2.976 517 HG13 VAL 69 HG13 VAL 69 5.605 -8.820 -1.622 518 HG21 VAL 69 HG21 VAL 69 3.519 -5.163 -1.079 519 HG22 VAL 69 HG22 VAL 69 3.466 -5.946 -2.653 520 HG23 VAL 69 HG23 VAL 69 4.966 -5.194 -2.103 521 H PHE 70 H PHE 70 0.802 -6.953 -0.415 522 HA PHE 70 HA PHE 70 1.367 -5.711 2.150 523 HB2 PHE 70 HB2 PHE 70 -0.902 -5.456 0.212 524 HB3 PHE 70 HB3 PHE 70 -1.191 -5.084 1.909 525 HD1 PHE 70 HD1 PHE 70 1.275 -4.302 -0.771 526 HD2 PHE 70 HD2 PHE 70 -0.869 -2.919 2.621 527 HE1 PHE 70 HE1 PHE 70 2.235 -2.059 -1.073 528 HE2 PHE 70 HE2 PHE 70 0.084 -0.695 2.341 529 HZ PHE 70 HZ PHE 70 1.635 -0.244 0.499 530 H PHE 71 H PHE 71 0.554 -8.593 0.994 531 HA PHE 71 HA PHE 71 -0.747 -9.369 3.485 532 HB2 PHE 71 HB2 PHE 71 -1.071 -10.583 0.740 533 HB3 PHE 71 HB3 PHE 71 -1.688 -11.297 2.223 534 HD1 PHE 71 HD1 PHE 71 -3.477 -10.109 3.488 535 HD2 PHE 71 HD2 PHE 71 -2.228 -8.888 -0.384 536 HE1 PHE 71 HE1 PHE 71 -5.571 -8.854 3.214 537 HE2 PHE 71 HE2 PHE 71 -4.311 -7.634 -0.668 538 HZ PHE 71 HZ PHE 71 -5.991 -7.613 1.134 539 H THR 72 H THR 72 0.080 -11.130 4.459 540 HA THR 72 HA THR 72 2.788 -11.843 3.843 541 HB THR 72 HB THR 72 2.506 -13.448 5.742 542 HG1 THR 72 HG1 THR 72 -0.066 -12.334 6.094 543 HG21 THR 72 HG21 THR 72 3.149 -11.114 6.226 544 HG22 THR 72 HG22 THR 72 2.134 -11.785 7.509 545 HG23 THR 72 HG23 THR 72 1.438 -10.682 6.322 546 H ASN 73 H ASN 73 3.259 -14.335 3.786 547 HA ASN 73 HA ASN 73 1.893 -15.398 1.526 548 HB2 ASN 73 HB2 ASN 73 4.289 -15.874 1.951 549 HB3 ASN 73 HB3 ASN 73 3.855 -16.768 3.400 550 HD21 ASN 73 HD21 ASN 73 3.817 -16.747 -0.063 551 HD22 ASN 73 HD22 ASN 73 3.498 -18.428 -0.268 552 H SER 74 H SER 74 1.356 -15.440 4.865 553 HA SER 74 HA SER 74 -0.207 -17.820 5.006 554 HB2 SER 74 HB2 SER 74 -0.140 -15.470 6.891 555 HB3 SER 74 HB3 SER 74 -0.595 -17.137 7.251 556 HG SER 74 HG SER 74 1.644 -17.618 6.485 557 H GLY 75 H GLY 75 -0.733 -14.753 3.664 558 HA2 GLY 75 HA2 GLY 75 -2.664 -14.251 2.437 559 HA3 GLY 75 HA3 GLY 75 -3.584 -15.331 3.472 560 H GLN 76 H GLN 76 -2.017 -13.781 5.701 561 HA GLN 76 HA GLN 76 -4.166 -11.838 5.989 562 HB2 GLN 76 HB2 GLN 76 -2.477 -13.314 7.920 563 HB3 GLN 76 HB3 GLN 76 -3.039 -11.714 8.393 564 HG2 GLN 76 HG2 GLN 76 -4.883 -13.850 7.378 565 HG3 GLN 76 HG3 GLN 76 -4.478 -13.662 9.086 566 HE21 GLN 76 HE21 GLN 76 -6.625 -13.192 9.574 567 HE22 GLN 76 HE22 GLN 76 -7.334 -11.657 9.223 568 H VAL 77 H VAL 77 -3.802 -9.787 6.774 569 HA VAL 77 HA VAL 77 -1.794 -8.363 5.405 570 HB VAL 77 HB VAL 77 -3.460 -7.430 7.772 571 HG11 VAL 77 HG11 VAL 77 -3.158 -5.175 6.860 572 HG12 VAL 77 HG12 VAL 77 -2.107 -5.832 5.607 573 HG13 VAL 77 HG13 VAL 77 -1.619 -5.920 7.298 574 HG21 VAL 77 HG21 VAL 77 -5.044 -6.540 6.118 575 HG22 VAL 77 HG22 VAL 77 -4.909 -8.295 6.019 576 HG23 VAL 77 HG23 VAL 77 -4.100 -7.280 4.826 577 H VAL 78 H VAL 78 0.116 -7.503 6.132 578 HA VAL 78 HA VAL 78 1.579 -8.879 8.092 579 HB VAL 78 HB VAL 78 2.156 -6.105 7.065 580 HG11 VAL 78 HG11 VAL 78 3.569 -6.725 8.891 581 HG12 VAL 78 HG12 VAL 78 4.518 -6.693 7.408 582 HG13 VAL 78 HG13 VAL 78 4.007 -8.235 8.096 583 HG21 VAL 78 HG21 VAL 78 1.731 -7.530 5.166 584 HG22 VAL 78 HG22 VAL 78 2.885 -8.727 5.766 585 HG23 VAL 78 HG23 VAL 78 3.440 -7.124 5.258 586 H LYS 79 H LYS 79 1.943 -8.474 10.214 587 HA LYS 79 HA LYS 79 -0.052 -7.295 11.732 588 HB2 LYS 79 HB2 LYS 79 1.341 -9.096 12.546 589 HB3 LYS 79 HB3 LYS 79 2.754 -8.065 12.516 590 HG2 LYS 79 HG2 LYS 79 1.983 -8.349 14.773 591 HG3 LYS 79 HG3 LYS 79 1.761 -6.675 14.276 592 HD2 LYS 79 HD2 LYS 79 -0.599 -7.071 13.880 593 HD3 LYS 79 HD3 LYS 79 -0.399 -8.781 14.262 594 HE2 LYS 79 HE2 LYS 79 0.096 -6.487 16.164 595 HE3 LYS 79 HE3 LYS 79 -1.342 -7.506 16.143 596 HZ1 LYS 79 HZ1 LYS 79 1.429 -8.480 16.667 597 HZ2 LYS 79 HZ2 LYS 79 0.031 -9.411 16.676 598 HZ3 LYS 79 HZ3 LYS 79 0.256 -8.208 17.830 599 H SER 80 H SER 80 3.126 -5.975 10.965 600 HA SER 80 HA SER 80 2.493 -3.603 12.509 601 HB2 SER 80 HB2 SER 80 4.735 -4.628 12.710 602 HB3 SER 80 HB3 SER 80 5.030 -4.308 11.007 603 HG SER 80 HG SER 80 4.562 -2.036 11.627 604 H LEU 81 H LEU 81 1.589 -4.506 9.546 605 HA LEU 81 HA LEU 81 2.408 -2.308 8.010 606 HB2 LEU 81 HB2 LEU 81 1.934 -4.314 6.940 607 HB3 LEU 81 HB3 LEU 81 0.260 -4.376 7.471 608 HG LEU 81 HG LEU 81 1.378 -2.321 5.544 609 HD11 LEU 81 HD11 LEU 81 0.089 -4.990 4.968 610 HD12 LEU 81 HD12 LEU 81 1.790 -4.592 4.733 611 HD13 LEU 81 HD13 LEU 81 0.560 -3.782 3.774 612 HD21 LEU 81 HD21 LEU 81 -1.430 -3.361 5.999 613 HD22 LEU 81 HD22 LEU 81 -0.959 -2.128 4.829 614 HD23 LEU 81 HD23 LEU 81 -0.826 -1.803 6.557 615 HA PRO 82 HA PRO 82 -2.039 -0.398 9.016 616 HB2 PRO 82 HB2 PRO 82 -2.209 -1.546 11.774 617 HB3 PRO 82 HB3 PRO 82 -3.519 -1.143 10.656 618 HG2 PRO 82 HG2 PRO 82 -2.848 -3.672 11.019 619 HG3 PRO 82 HG3 PRO 82 -3.194 -3.078 9.384 620 HD2 PRO 82 HD2 PRO 82 -0.561 -3.648 10.676 621 HD3 PRO 82 HD3 PRO 82 -1.099 -3.971 9.015 622 H GLY 83 H GLY 83 0.484 -1.189 11.299 623 HA2 GLY 83 HA2 GLY 83 0.475 1.181 12.846 624 HA3 GLY 83 HA3 GLY 83 1.827 0.067 12.679 625 H LEU 84 H LEU 84 2.271 0.254 9.916 626 HA LEU 84 HA LEU 84 3.737 2.680 9.859 627 HB2 LEU 84 HB2 LEU 84 4.613 2.027 7.724 628 HB3 LEU 84 HB3 LEU 84 4.500 0.575 8.682 629 HG LEU 84 HG LEU 84 2.211 0.331 7.377 630 HD11 LEU 84 HD11 LEU 84 2.402 1.078 5.045 631 HD12 LEU 84 HD12 LEU 84 3.860 1.970 5.455 632 HD13 LEU 84 HD13 LEU 84 2.318 2.421 6.174 633 HD21 LEU 84 HD21 LEU 84 4.882 -0.310 6.121 634 HD22 LEU 84 HD22 LEU 84 3.348 -1.087 5.741 635 HD23 LEU 84 HD23 LEU 84 4.069 -1.290 7.341 636 H LEU 85 H LEU 85 0.757 1.594 8.405 637 HA LEU 85 HA LEU 85 0.280 3.840 6.804 638 HB2 LEU 85 HB2 LEU 85 -1.720 2.060 8.186 639 HB3 LEU 85 HB3 LEU 85 -2.117 3.220 6.942 640 HG LEU 85 HG LEU 85 -0.408 0.757 6.585 641 HD11 LEU 85 HD11 LEU 85 -3.185 1.427 5.650 642 HD12 LEU 85 HD12 LEU 85 -2.756 0.277 6.914 643 HD13 LEU 85 HD13 LEU 85 -2.282 -0.035 5.242 644 HD21 LEU 85 HD21 LEU 85 -0.504 1.298 4.190 645 HD22 LEU 85 HD22 LEU 85 0.317 2.565 5.101 646 HD23 LEU 85 HD23 LEU 85 -1.345 2.800 4.563 647 H THR 86 H THR 86 -0.256 3.226 10.152 648 HA THR 86 HA THR 86 -1.953 5.408 10.724 649 HB THR 86 HB THR 86 0.007 4.058 12.614 650 HG1 THR 86 HG1 THR 86 -1.690 2.719 11.565 651 HG21 THR 86 HG21 THR 86 -2.472 5.692 13.202 652 HG22 THR 86 HG22 THR 86 -0.809 6.223 13.456 653 HG23 THR 86 HG23 THR 86 -1.458 4.881 14.398 654 H ILE 87 H ILE 87 1.613 5.176 10.970 655 HA ILE 87 HA ILE 87 1.865 7.827 11.868 656 HB ILE 87 HB ILE 87 3.615 6.320 12.454 657 HG12 ILE 87 HG12 ILE 87 4.363 8.714 11.932 658 HG13 ILE 87 HG13 ILE 87 5.623 7.504 12.073 659 HG21 ILE 87 HG21 ILE 87 3.534 4.679 10.814 660 HG22 ILE 87 HG22 ILE 87 5.198 5.283 10.878 661 HG23 ILE 87 HG23 ILE 87 4.124 5.782 9.577 662 HD11 ILE 87 HD11 ILE 87 6.054 9.076 10.243 663 HD12 ILE 87 HD12 ILE 87 4.526 8.628 9.489 664 HD13 ILE 87 HD13 ILE 87 5.825 7.443 9.620 665 H LEU 88 H LEU 88 2.078 6.464 8.636 666 HA LEU 88 HA LEU 88 2.672 8.958 7.428 667 HB2 LEU 88 HB2 LEU 88 1.595 6.415 6.304 668 HB3 LEU 88 HB3 LEU 88 1.706 7.849 5.319 669 HG LEU 88 HG LEU 88 3.558 6.516 4.801 670 HD11 LEU 88 HD11 LEU 88 5.480 7.866 5.384 671 HD12 LEU 88 HD12 LEU 88 4.546 8.669 6.638 672 HD13 LEU 88 HD13 LEU 88 4.090 8.858 4.944 673 HD21 LEU 88 HD21 LEU 88 5.120 5.609 6.339 674 HD22 LEU 88 HD22 LEU 88 3.507 5.089 6.800 675 HD23 LEU 88 HD23 LEU 88 4.309 6.387 7.703 676 H HIS 89 H HIS 89 -0.360 7.403 8.207 677 HA HIS 89 HA HIS 89 -2.089 9.097 6.790 678 HB2 HIS 89 HB2 HIS 89 -2.843 6.992 7.827 679 HB3 HIS 89 HB3 HIS 89 -2.525 7.650 9.423 680 HD1 HIS 89 HD1 HIS 89 -4.465 8.799 10.546 681 HD2 HIS 89 HD2 HIS 89 -5.018 8.327 6.455 682 HE1 HIS 89 HE1 HIS 89 -6.829 9.539 10.061 683 H ASP 90 H ASP 90 -0.796 9.313 10.054 684 HA ASP 90 HA ASP 90 -2.042 11.816 10.638 685 HB2 ASP 90 HB2 ASP 90 -1.436 10.335 12.446 686 HB3 ASP 90 HB3 ASP 90 0.248 10.357 11.961 687 H GLY 91 H GLY 91 0.884 10.847 9.098 688 HA2 GLY 91 HA2 GLY 91 2.174 13.417 9.199 689 HA3 GLY 91 HA3 GLY 91 2.679 12.023 8.255 690 H GLY 92 H GLY 92 -0.360 12.173 7.364 691 HA2 GLY 92 HA2 GLY 92 -1.646 13.384 5.849 692 HA3 GLY 92 HA3 GLY 92 -0.349 14.549 5.706 693 H TYR 93 H TYR 93 0.132 11.102 5.231 694 HA TYR 93 HA TYR 93 0.665 11.691 2.416 695 HB2 TYR 93 HB2 TYR 93 1.818 9.570 4.223 696 HB3 TYR 93 HB3 TYR 93 2.047 9.559 2.477 697 HD1 TYR 93 HD1 TYR 93 2.883 11.274 5.621 698 HD2 TYR 93 HD2 TYR 93 3.501 11.164 1.416 699 HE1 TYR 93 HE1 TYR 93 4.788 12.798 5.869 700 HE2 TYR 93 HE2 TYR 93 5.417 12.676 1.650 701 HH TYR 93 HH TYR 93 6.948 13.279 4.501 702 H ARG 94 H ARG 94 0.006 10.335 0.826 703 HA ARG 94 HA ARG 94 -2.478 8.870 1.411 704 HB2 ARG 94 HB2 ARG 94 -3.068 9.243 -0.878 705 HB3 ARG 94 HB3 ARG 94 -2.443 10.759 -0.244 706 HG2 ARG 94 HG2 ARG 94 -0.208 9.949 -1.200 707 HG3 ARG 94 HG3 ARG 94 -1.172 8.881 -2.206 708 HD2 ARG 94 HD2 ARG 94 -0.843 10.881 -3.462 709 HD3 ARG 94 HD3 ARG 94 -2.495 10.994 -2.834 710 HE ARG 94 HE ARG 94 -0.451 12.119 -1.157 711 HH11 ARG 94 HH11 ARG 94 -2.805 12.813 -3.715 712 HH12 ARG 94 HH12 ARG 94 -2.861 14.481 -3.427 713 HH21 ARG 94 HH21 ARG 94 -0.519 14.452 -0.754 714 HH22 ARG 94 HH22 ARG 94 -1.524 15.444 -1.699 715 H ASP 95 H ASP 95 -2.885 7.034 -0.275 716 HA ASP 95 HA ASP 95 -1.395 4.806 0.448 717 HB2 ASP 95 HB2 ASP 95 -2.677 3.668 -1.369 718 HB3 ASP 95 HB3 ASP 95 -3.708 4.673 -0.347 719 H THR 96 H THR 96 -1.313 6.630 -2.546 720 HA THR 96 HA THR 96 0.472 5.011 -3.928 721 HB THR 96 HB THR 96 -0.006 7.971 -4.279 722 HG1 THR 96 HG1 THR 96 -1.724 5.837 -4.474 723 HG21 THR 96 HG21 THR 96 0.690 5.794 -6.260 724 HG22 THR 96 HG22 THR 96 1.842 6.946 -5.586 725 HG23 THR 96 HG23 THR 96 0.525 7.519 -6.613 726 H GLU 97 H GLU 97 0.933 7.785 -1.823 727 HA GLU 97 HA GLU 97 3.711 8.099 -2.297 728 HB2 GLU 97 HB2 GLU 97 2.002 8.985 0.030 729 HB3 GLU 97 HB3 GLU 97 3.689 9.432 -0.187 730 HG2 GLU 97 HG2 GLU 97 3.183 10.634 -2.173 731 HG3 GLU 97 HG3 GLU 97 1.520 10.065 -2.177 732 H ILE 98 H ILE 98 1.796 6.231 -0.019 733 HA ILE 98 HA ILE 98 3.867 5.481 1.773 734 HB ILE 98 HB ILE 98 1.705 3.533 0.972 735 HG12 ILE 98 HG12 ILE 98 0.460 5.559 1.333 736 HG13 ILE 98 HG13 ILE 98 0.246 4.483 2.714 737 HG21 ILE 98 HG21 ILE 98 1.821 2.850 3.312 738 HG22 ILE 98 HG22 ILE 98 3.056 4.071 3.597 739 HG23 ILE 98 HG23 ILE 98 3.383 2.731 2.500 740 HD11 ILE 98 HD11 ILE 98 1.777 5.796 4.014 741 HD12 ILE 98 HD12 ILE 98 0.478 6.807 3.388 742 HD13 ILE 98 HD13 ILE 98 2.079 6.862 2.639 743 H MET 99 H MET 99 2.546 3.905 -1.089 744 HA MET 99 HA MET 99 4.476 1.853 -0.946 745 HB2 MET 99 HB2 MET 99 3.551 0.985 -3.060 746 HB3 MET 99 HB3 MET 99 2.375 1.201 -1.773 747 HG2 MET 99 HG2 MET 99 1.550 3.198 -2.843 748 HG3 MET 99 HG3 MET 99 2.784 3.057 -4.099 749 HE1 MET 99 HE1 MET 99 0.754 0.093 -2.425 750 HE2 MET 99 HE2 MET 99 -0.636 0.009 -3.501 751 HE3 MET 99 HE3 MET 99 -0.394 1.428 -2.481 752 H ARG 100 H ARG 100 4.580 4.940 -2.230 753 HA ARG 100 HA ARG 100 6.163 4.658 -4.516 754 HB2 ARG 100 HB2 ARG 100 4.947 6.689 -3.638 755 HB3 ARG 100 HB3 ARG 100 6.228 6.877 -2.469 756 HG2 ARG 100 HG2 ARG 100 7.813 7.291 -4.276 757 HG3 ARG 100 HG3 ARG 100 6.514 7.073 -5.464 758 HD2 ARG 100 HD2 ARG 100 5.244 8.873 -4.313 759 HD3 ARG 100 HD3 ARG 100 6.638 9.163 -3.291 760 HE ARG 100 HE ARG 100 6.994 9.361 -6.170 761 HH11 ARG 100 HH11 ARG 100 6.949 11.008 -3.037 762 HH12 ARG 100 HH12 ARG 100 7.128 12.567 -3.682 763 HH21 ARG 100 HH21 ARG 100 7.301 11.514 -7.056 764 HH22 ARG 100 HH22 ARG 100 7.275 12.876 -6.015 765 H TRP 101 H TRP 101 7.250 5.602 -1.248 766 HA TRP 101 HA TRP 101 9.908 4.877 -1.871 767 HB2 TRP 101 HB2 TRP 101 10.332 5.240 0.653 768 HB3 TRP 101 HB3 TRP 101 9.882 6.611 -0.341 769 HD1 TRP 101 HD1 TRP 101 7.753 7.919 0.329 770 HE1 TRP 101 HE1 TRP 101 6.070 7.739 2.240 771 HE3 TRP 101 HE3 TRP 101 9.100 3.345 2.194 772 HZ2 TRP 101 HZ2 TRP 101 5.393 5.923 4.265 773 HZ3 TRP 101 HZ3 TRP 101 7.875 2.470 4.110 774 HH2 TRP 101 HH2 TRP 101 6.059 3.730 5.137 775 H LEU 102 H LEU 102 7.324 3.129 -0.377 776 HA LEU 102 HA LEU 102 8.740 1.083 0.906 777 HB2 LEU 102 HB2 LEU 102 6.085 1.387 -0.230 778 HB3 LEU 102 HB3 LEU 102 6.552 -0.270 0.106 779 HG LEU 102 HG LEU 102 6.295 2.027 2.071 780 HD11 LEU 102 HD11 LEU 102 4.663 -0.477 1.685 781 HD12 LEU 102 HD12 LEU 102 4.175 1.158 1.238 782 HD13 LEU 102 HD13 LEU 102 4.429 0.747 2.939 783 HD21 LEU 102 HD21 LEU 102 7.101 -0.845 2.444 784 HD22 LEU 102 HD22 LEU 102 6.603 0.234 3.766 785 HD23 LEU 102 HD23 LEU 102 8.022 0.625 2.810 786 H PHE 103 H PHE 103 7.754 1.309 -2.482 787 HA PHE 103 HA PHE 103 8.800 -1.329 -2.963 788 HB2 PHE 103 HB2 PHE 103 7.359 0.638 -4.691 789 HB3 PHE 103 HB3 PHE 103 8.155 -0.772 -5.383 790 HD1 PHE 103 HD1 PHE 103 5.647 0.200 -2.799 791 HD2 PHE 103 HD2 PHE 103 7.087 -2.800 -5.440 792 HE1 PHE 103 HE1 PHE 103 3.692 -1.179 -2.291 793 HE2 PHE 103 HE2 PHE 103 5.151 -4.191 -4.923 794 HZ PHE 103 HZ PHE 103 3.433 -3.381 -3.358 795 H THR 104 H THR 104 10.090 1.690 -2.846 796 HA THR 104 HA THR 104 12.056 1.195 -4.885 797 HB THR 104 HB THR 104 11.774 3.479 -2.907 798 HG1 THR 104 HG1 THR 104 10.057 3.730 -4.233 799 HG21 THR 104 HG21 THR 104 13.269 4.690 -4.454 800 HG22 THR 104 HG22 THR 104 13.388 3.249 -5.466 801 HG23 THR 104 HG23 THR 104 14.063 3.240 -3.839 802 HA PRO 105 HA PRO 105 14.561 -1.097 -1.888 803 HB2 PRO 105 HB2 PRO 105 16.671 -0.482 -3.891 804 HB3 PRO 105 HB3 PRO 105 16.210 -2.037 -3.195 805 HG2 PRO 105 HG2 PRO 105 15.525 -1.440 -5.687 806 HG3 PRO 105 HG3 PRO 105 14.385 -2.281 -4.619 807 HD2 PRO 105 HD2 PRO 105 14.455 0.599 -5.433 808 HD3 PRO 105 HD3 PRO 105 13.069 -0.502 -5.247 809 H ASP 106 H ASP 106 15.558 -0.300 -0.155 810 HA ASP 106 HA ASP 106 16.476 2.423 -0.144 811 HB2 ASP 106 HB2 ASP 106 15.276 1.537 1.813 812 HB3 ASP 106 HB3 ASP 106 16.509 0.305 2.028 813 HA PRO 107 HA PRO 107 20.509 1.267 -1.553 814 HB2 PRO 107 HB2 PRO 107 21.786 3.589 -0.862 815 HB3 PRO 107 HB3 PRO 107 20.789 3.392 -2.310 816 HG2 PRO 107 HG2 PRO 107 20.057 4.571 0.344 817 HG3 PRO 107 HG3 PRO 107 19.680 5.166 -1.283 818 HD2 PRO 107 HD2 PRO 107 17.870 3.859 0.163 819 HD3 PRO 107 HD3 PRO 107 17.981 3.612 -1.592 820 H SER 108 H SER 108 19.802 1.941 1.771 821 HA SER 108 HA SER 108 22.528 1.134 2.464 822 HB2 SER 108 HB2 SER 108 21.884 3.522 2.920 823 HB3 SER 108 HB3 SER 108 20.666 2.917 4.037 824 HG SER 108 HG SER 108 23.307 2.056 4.318 825 H LEU 109 H LEU 109 19.550 -0.111 2.229 826 HA LEU 109 HA LEU 109 19.421 -1.256 4.917 827 HB2 LEU 109 HB2 LEU 109 17.425 -0.191 3.913 828 HB3 LEU 109 HB3 LEU 109 17.474 -1.392 2.637 829 HG LEU 109 HG LEU 109 17.062 -3.153 4.338 830 HD11 LEU 109 HD11 LEU 109 17.912 -2.017 6.307 831 HD12 LEU 109 HD12 LEU 109 16.228 -2.481 6.545 832 HD13 LEU 109 HD13 LEU 109 16.639 -0.803 6.184 833 HD21 LEU 109 HD21 LEU 109 15.240 -2.271 3.014 834 HD22 LEU 109 HD22 LEU 109 15.031 -0.936 4.152 835 HD23 LEU 109 HD23 LEU 109 14.694 -2.586 4.663 836 H THR 110 H THR 110 19.904 -3.273 5.294 837 HA THR 110 HA THR 110 20.114 -5.198 3.104 838 HB THR 110 HB THR 110 22.048 -4.854 5.405 839 HG1 THR 110 HG1 THR 110 21.890 -3.416 3.358 840 HG21 THR 110 HG21 THR 110 21.847 -7.168 4.655 841 HG22 THR 110 HG22 THR 110 23.420 -6.515 4.205 842 HG23 THR 110 HG23 THR 110 22.153 -6.674 2.987 843 H ILE 111 H ILE 111 18.692 -6.789 3.576 844 HA ILE 111 HA ILE 111 18.248 -7.397 6.393 845 HB ILE 111 HB ILE 111 15.782 -7.672 5.946 846 HG12 ILE 111 HG12 ILE 111 14.911 -6.009 4.127 847 HG13 ILE 111 HG13 ILE 111 16.517 -6.156 3.450 848 HG21 ILE 111 HG21 ILE 111 16.605 -5.932 7.305 849 HG22 ILE 111 HG22 ILE 111 15.279 -5.307 6.319 850 HG23 ILE 111 HG23 ILE 111 16.957 -4.918 5.907 851 HD11 ILE 111 HD11 ILE 111 14.573 -8.417 3.844 852 HD12 ILE 111 HD12 ILE 111 16.187 -8.556 3.147 853 HD13 ILE 111 HD13 ILE 111 14.944 -7.616 2.320 854 H THR 112 H THR 112 17.230 -9.342 6.885 855 HA THR 112 HA THR 112 17.525 -11.404 4.857 856 HB THR 112 HB THR 112 19.174 -11.894 6.457 857 HG1 THR 112 HG1 THR 112 17.658 -13.675 6.052 858 HG21 THR 112 HG21 THR 112 18.854 -11.859 8.905 859 HG22 THR 112 HG22 THR 112 17.187 -11.323 8.667 860 HG23 THR 112 HG23 THR 112 18.516 -10.281 8.182 861 H ARG 113 H ARG 113 15.791 -12.519 4.499 862 HA ARG 113 HA ARG 113 13.331 -11.628 5.888 863 HB2 ARG 113 HB2 ARG 113 12.137 -12.016 3.831 864 HB3 ARG 113 HB3 ARG 113 13.535 -11.003 3.478 865 HG2 ARG 113 HG2 ARG 113 14.754 -12.926 2.669 866 HG3 ARG 113 HG3 ARG 113 13.403 -13.987 3.048 867 HD2 ARG 113 HD2 ARG 113 13.368 -13.571 0.714 868 HD3 ARG 113 HD3 ARG 113 12.052 -12.646 1.424 869 HE ARG 113 HE ARG 113 13.239 -10.671 1.052 870 HH11 ARG 113 HH11 ARG 113 15.117 -13.488 -0.095 871 HH12 ARG 113 HH12 ARG 113 15.950 -12.600 -1.267 872 HH21 ARG 113 HH21 ARG 113 14.352 -9.525 -0.577 873 HH22 ARG 113 HH22 ARG 113 15.527 -10.294 -1.575 874 H ASP 114 H ASP 114 11.539 -13.255 5.802 875 HA ASP 114 HA ASP 114 12.387 -15.872 6.580 876 HB2 ASP 114 HB2 ASP 114 10.295 -14.801 7.456 877 HB3 ASP 114 HB3 ASP 114 9.615 -14.868 5.833 878 H GLY 115 H GLY 115 13.367 -16.971 5.010 879 HA2 GLY 115 HA2 GLY 115 12.652 -18.411 3.072 880 HA3 GLY 115 HA3 GLY 115 12.222 -16.881 2.310 881 H SER 116 H SER 116 14.681 -15.743 3.850 882 HA SER 116 HA SER 116 16.842 -16.975 2.352 883 HB2 SER 116 HB2 SER 116 16.339 -13.981 2.167 884 HB3 SER 116 HB3 SER 116 17.589 -14.903 1.349 885 HG SER 116 HG SER 116 15.846 -16.060 0.323 886 H ARG 117 H ARG 117 18.140 -17.431 3.992 887 HA ARG 117 HA ARG 117 18.189 -15.874 6.408 888 HB2 ARG 117 HB2 ARG 117 19.933 -17.407 7.167 889 HB3 ARG 117 HB3 ARG 117 18.517 -18.252 6.564 890 HG2 ARG 117 HG2 ARG 117 19.668 -18.775 4.507 891 HG3 ARG 117 HG3 ARG 117 21.074 -17.841 5.032 892 HD2 ARG 117 HD2 ARG 117 21.402 -20.216 5.416 893 HD3 ARG 117 HD3 ARG 117 21.344 -19.278 6.921 894 HE ARG 117 HE ARG 117 18.986 -20.720 5.927 895 HH11 ARG 117 HH11 ARG 117 21.298 -20.092 8.553 896 HH12 ARG 117 HH12 ARG 117 20.449 -21.010 9.701 897 HH21 ARG 117 HH21 ARG 117 17.836 -21.932 7.486 898 HH22 ARG 117 HH22 ARG 117 18.393 -22.084 9.086 899 H ASP 118 H ASP 118 19.892 -15.848 3.489 900 HA ASP 118 HA ASP 118 22.153 -14.391 4.479 901 HB2 ASP 118 HB2 ASP 118 21.159 -14.847 1.660 902 HB3 ASP 118 HB3 ASP 118 22.598 -13.911 2.032 903 H ALA 119 H ALA 119 22.511 -12.222 4.311 904 HA ALA 119 HA ALA 119 20.082 -10.675 4.306 905 HB1 ALA 119 HB1 ALA 119 21.816 -10.422 6.070 906 HB2 ALA 119 HB2 ALA 119 21.364 -8.929 5.272 907 HB3 ALA 119 HB3 ALA 119 22.890 -9.720 4.852 908 H VAL 120 H VAL 120 19.391 -9.524 2.689 909 HA VAL 120 HA VAL 120 21.024 -9.293 0.285 910 HB VAL 120 HB VAL 120 18.055 -8.793 0.665 911 HG11 VAL 120 HG11 VAL 120 17.930 -8.910 -1.782 912 HG12 VAL 120 HG12 VAL 120 19.684 -9.094 -1.852 913 HG13 VAL 120 HG13 VAL 120 18.978 -7.597 -1.244 914 HG21 VAL 120 HG21 VAL 120 18.571 -11.140 1.078 915 HG22 VAL 120 HG22 VAL 120 19.450 -11.228 -0.448 916 HG23 VAL 120 HG23 VAL 120 17.710 -10.959 -0.447 917 H SER 121 H SER 121 21.875 -7.434 -0.204 918 HA SER 121 HA SER 121 21.255 -5.053 1.324 919 HB2 SER 121 HB2 SER 121 23.355 -5.533 -0.807 920 HB3 SER 121 HB3 SER 121 23.267 -4.152 0.287 921 HG SER 121 HG SER 121 23.857 -5.347 1.935 922 H ASN 122 H ASN 122 20.537 -3.104 0.422 923 HA ASN 122 HA ASN 122 19.341 -1.743 -0.824 924 HB2 ASN 122 HB2 ASN 122 20.365 -3.339 -3.204 925 HB3 ASN 122 HB3 ASN 122 19.453 -1.833 -3.280 926 HD21 ASN 122 HD21 ASN 122 20.489 0.086 -2.925 927 HD22 ASN 122 HD22 ASN 122 22.187 0.223 -2.714 928 H ALA 123 H ALA 123 17.882 -3.206 0.443 929 HA ALA 123 HA ALA 123 16.075 -4.641 -1.341 930 HB1 ALA 123 HB1 ALA 123 16.377 -4.795 1.653 931 HB2 ALA 123 HB2 ALA 123 16.995 -5.967 0.493 932 HB3 ALA 123 HB3 ALA 123 15.255 -5.747 0.680 933 H ARG 124 H ARG 124 13.814 -4.397 -0.846 934 HA ARG 124 HA ARG 124 13.110 -1.596 -0.560 935 HB2 ARG 124 HB2 ARG 124 11.235 -3.946 -0.786 936 HB3 ARG 124 HB3 ARG 124 10.913 -2.272 -1.203 937 HG2 ARG 124 HG2 ARG 124 12.501 -2.444 -3.060 938 HG3 ARG 124 HG3 ARG 124 12.778 -4.134 -2.605 939 HD2 ARG 124 HD2 ARG 124 10.344 -4.547 -2.924 940 HD3 ARG 124 HD3 ARG 124 10.204 -2.913 -3.571 941 HE ARG 124 HE ARG 124 12.195 -4.534 -4.851 942 HH11 ARG 124 HH11 ARG 124 8.869 -3.404 -4.964 943 HH12 ARG 124 HH12 ARG 124 8.561 -4.020 -6.521 944 HH21 ARG 124 HH21 ARG 124 11.813 -5.347 -6.974 945 HH22 ARG 124 HH22 ARG 124 10.285 -5.195 -7.710 946 HA PRO 125 HA PRO 125 12.048 -1.843 3.792 947 HB2 PRO 125 HB2 PRO 125 9.690 -0.216 3.018 948 HB3 PRO 125 HB3 PRO 125 10.887 0.094 4.280 949 HG2 PRO 125 HG2 PRO 125 10.931 1.492 2.012 950 HG3 PRO 125 HG3 PRO 125 12.435 0.968 2.786 951 HD2 PRO 125 HD2 PRO 125 11.059 -0.135 0.381 952 HD3 PRO 125 HD3 PRO 125 12.797 0.030 0.725 953 H VAL 126 H VAL 126 9.679 -2.423 1.257 954 HA VAL 126 HA VAL 126 7.703 -3.761 2.782 955 HB VAL 126 HB VAL 126 8.429 -4.258 -0.126 956 HG11 VAL 126 HG11 VAL 126 5.909 -4.893 1.395 957 HG12 VAL 126 HG12 VAL 126 7.086 -6.063 0.793 958 HG13 VAL 126 HG13 VAL 126 6.150 -5.081 -0.341 959 HG21 VAL 126 HG21 VAL 126 6.597 -2.752 -0.647 960 HG22 VAL 126 HG22 VAL 126 7.854 -1.949 0.293 961 HG23 VAL 126 HG23 VAL 126 6.353 -2.450 1.076 962 H ASP 127 H ASP 127 10.701 -4.849 1.341 963 HA ASP 127 HA ASP 127 10.257 -7.645 1.699 964 HB2 ASP 127 HB2 ASP 127 11.989 -6.322 0.232 965 HB3 ASP 127 HB3 ASP 127 12.959 -6.326 1.692 966 H ALA 128 H ALA 128 11.794 -5.061 3.463 967 HA ALA 128 HA ALA 128 12.874 -6.493 5.613 968 HB1 ALA 128 HB1 ALA 128 13.587 -4.256 4.985 969 HB2 ALA 128 HB2 ALA 128 13.155 -4.343 6.697 970 HB3 ALA 128 HB3 ALA 128 12.047 -3.606 5.540 971 H LEU 129 H LEU 129 9.654 -5.059 5.227 972 HA LEU 129 HA LEU 129 8.990 -5.524 7.956 973 HB2 LEU 129 HB2 LEU 129 6.644 -5.045 7.321 974 HB3 LEU 129 HB3 LEU 129 7.764 -3.798 6.833 975 HG LEU 129 HG LEU 129 7.714 -5.081 4.574 976 HD11 LEU 129 HD11 LEU 129 5.032 -5.791 5.697 977 HD12 LEU 129 HD12 LEU 129 6.372 -6.901 5.434 978 HD13 LEU 129 HD13 LEU 129 5.598 -6.110 4.046 979 HD21 LEU 129 HD21 LEU 129 5.832 -3.626 3.839 980 HD22 LEU 129 HD22 LEU 129 7.025 -2.773 4.825 981 HD23 LEU 129 HD23 LEU 129 5.498 -3.278 5.535 982 H HIS 130 H HIS 130 8.724 -7.475 5.107 983 HA HIS 130 HA HIS 130 7.363 -9.620 6.445 984 HB2 HIS 130 HB2 HIS 130 8.765 -9.373 3.800 985 HB3 HIS 130 HB3 HIS 130 8.286 -10.952 4.406 986 HD1 HIS 130 HD1 HIS 130 6.975 -8.020 2.597 987 HD2 HIS 130 HD2 HIS 130 5.464 -11.219 4.783 988 HE1 HIS 130 HE1 HIS 130 4.546 -8.231 1.968 989 H ALA 131 H ALA 131 10.402 -8.409 6.405 990 HA ALA 131 HA ALA 131 11.766 -10.870 7.180 991 HB1 ALA 131 HB1 ALA 131 12.919 -9.220 5.759 992 HB2 ALA 131 HB2 ALA 131 13.774 -9.491 7.274 993 HB3 ALA 131 HB3 ALA 131 12.795 -8.037 7.062 994 H HIS 132 H HIS 132 9.704 -8.924 8.675 995 HA HIS 132 HA HIS 132 9.065 -8.457 10.792 996 HB2 HIS 132 HB2 HIS 132 9.489 -10.892 11.139 997 HB3 HIS 132 HB3 HIS 132 11.164 -10.553 11.515 998 HD1 HIS 132 HD1 HIS 132 7.689 -9.741 12.996 999 HD2 HIS 132 HD2 HIS 132 11.642 -10.353 14.151 1000 HE1 HIS 132 HE1 HIS 132 7.701 -9.699 15.498 1001 H GLN 133 H GLN 133 11.178 -7.065 9.452 1002 HA GLN 133 HA GLN 133 12.493 -5.788 11.719 1003 HB2 GLN 133 HB2 GLN 133 13.377 -5.856 8.815 1004 HB3 GLN 133 HB3 GLN 133 14.198 -4.966 10.094 1005 HG2 GLN 133 HG2 GLN 133 14.500 -7.149 11.287 1006 HG3 GLN 133 HG3 GLN 133 13.905 -7.948 9.839 1007 HE21 GLN 133 HE21 GLN 133 15.789 -9.029 9.472 1008 HE22 GLN 133 HE22 GLN 133 17.254 -8.227 8.979 1009 H ALA 134 H ALA 134 9.883 -5.555 10.701 1010 HA ALA 134 HA ALA 134 9.257 -3.370 9.149 1011 HB1 ALA 134 HB1 ALA 134 7.085 -3.400 10.211 1012 HB2 ALA 134 HB2 ALA 134 7.728 -4.370 11.537 1013 HB3 ALA 134 HB3 ALA 134 7.647 -5.045 9.909 1014 H ARG 135 H ARG 135 10.358 -3.409 12.441 1015 HA ARG 135 HA ARG 135 9.573 -0.896 13.399 1016 HB2 ARG 135 HB2 ARG 135 12.311 -2.072 13.841 1017 HB3 ARG 135 HB3 ARG 135 11.420 -1.007 14.903 1018 HG2 ARG 135 HG2 ARG 135 9.832 -2.779 15.378 1019 HG3 ARG 135 HG3 ARG 135 10.705 -3.864 14.288 1020 HD2 ARG 135 HD2 ARG 135 12.744 -3.469 15.693 1021 HD3 ARG 135 HD3 ARG 135 11.705 -2.612 16.827 1022 HE ARG 135 HE ARG 135 10.901 -5.301 16.142 1023 HH11 ARG 135 HH11 ARG 135 12.636 -3.246 18.426 1024 HH12 ARG 135 HH12 ARG 135 12.621 -4.382 19.686 1025 HH21 ARG 135 HH21 ARG 135 10.884 -6.873 17.840 1026 HH22 ARG 135 HH22 ARG 135 11.574 -6.523 19.345 1027 H GLU 136 H GLU 136 12.355 -1.875 11.440 1028 HA GLU 136 HA GLU 136 13.633 0.629 11.282 1029 HB2 GLU 136 HB2 GLU 136 13.732 -1.656 9.299 1030 HB3 GLU 136 HB3 GLU 136 14.892 -0.344 9.428 1031 HG2 GLU 136 HG2 GLU 136 14.378 -2.503 11.451 1032 HG3 GLU 136 HG3 GLU 136 15.796 -2.340 10.416 1033 H VAL 137 H VAL 137 11.259 -1.022 9.359 1034 HA VAL 137 HA VAL 137 11.119 0.707 7.142 1035 HB VAL 137 HB VAL 137 8.890 -0.952 8.352 1036 HG11 VAL 137 HG11 VAL 137 7.927 -0.963 6.089 1037 HG12 VAL 137 HG12 VAL 137 9.204 0.127 5.549 1038 HG13 VAL 137 HG13 VAL 137 8.036 0.667 6.750 1039 HG21 VAL 137 HG21 VAL 137 10.932 -1.669 6.260 1040 HG22 VAL 137 HG22 VAL 137 9.568 -2.680 6.739 1041 HG23 VAL 137 HG23 VAL 137 10.845 -2.309 7.900 1042 H VAL 138 H VAL 138 9.261 0.595 10.137 1043 HA VAL 138 HA VAL 138 7.683 2.859 9.657 1044 HB VAL 138 HB VAL 138 8.588 1.774 12.354 1045 HG11 VAL 138 HG11 VAL 138 7.719 4.050 12.545 1046 HG12 VAL 138 HG12 VAL 138 6.587 2.896 13.253 1047 HG13 VAL 138 HG13 VAL 138 6.270 3.579 11.659 1048 HG21 VAL 138 HG21 VAL 138 7.422 0.079 11.047 1049 HG22 VAL 138 HG22 VAL 138 6.095 1.203 10.749 1050 HG23 VAL 138 HG23 VAL 138 6.410 0.625 12.383 1051 H ARG 139 H ARG 139 10.849 2.521 11.159 1052 HA ARG 139 HA ARG 139 11.182 5.230 11.869 1053 HB2 ARG 139 HB2 ARG 139 12.586 3.432 12.757 1054 HB3 ARG 139 HB3 ARG 139 13.277 3.179 11.165 1055 HG2 ARG 139 HG2 ARG 139 14.233 5.419 11.216 1056 HG3 ARG 139 HG3 ARG 139 13.535 5.677 12.819 1057 HD2 ARG 139 HD2 ARG 139 14.817 3.820 13.688 1058 HD3 ARG 139 HD3 ARG 139 15.506 3.528 12.090 1059 HE ARG 139 HE ARG 139 15.906 6.177 13.085 1060 HH11 ARG 139 HH11 ARG 139 17.197 2.908 12.964 1061 HH12 ARG 139 HH12 ARG 139 18.795 3.355 13.380 1062 HH21 ARG 139 HH21 ARG 139 18.083 6.800 13.680 1063 HH22 ARG 139 HH22 ARG 139 19.294 5.619 13.821 1064 H ARG 140 H ARG 140 11.981 3.486 8.890 1065 HA ARG 140 HA ARG 140 13.189 5.689 7.545 1066 HB2 ARG 140 HB2 ARG 140 11.698 3.370 6.271 1067 HB3 ARG 140 HB3 ARG 140 12.852 4.418 5.466 1068 HG2 ARG 140 HG2 ARG 140 13.493 2.516 7.715 1069 HG3 ARG 140 HG3 ARG 140 13.781 2.210 6.008 1070 HD2 ARG 140 HD2 ARG 140 15.434 3.927 5.907 1071 HD3 ARG 140 HD3 ARG 140 14.988 4.533 7.503 1072 HE ARG 140 HE ARG 140 15.916 2.578 8.472 1073 HH11 ARG 140 HH11 ARG 140 16.761 2.922 5.000 1074 HH12 ARG 140 HH12 ARG 140 18.104 1.969 5.088 1075 HH21 ARG 140 HH21 ARG 140 17.772 1.199 8.576 1076 HH22 ARG 140 HH22 ARG 140 18.735 0.932 7.210 1077 H ALA 141 H ALA 141 9.914 4.544 7.862 1078 HA ALA 141 HA ALA 141 8.595 6.319 6.128 1079 HB1 ALA 141 HB1 ALA 141 7.670 5.032 8.689 1080 HB2 ALA 141 HB2 ALA 141 7.463 4.388 7.054 1081 HB3 ALA 141 HB3 ALA 141 6.629 5.869 7.549 1082 H GLN 142 H GLN 142 9.481 6.575 9.529 1083 HA GLN 142 HA GLN 142 8.423 9.129 10.041 1084 HB2 GLN 142 HB2 GLN 142 10.888 7.842 11.221 1085 HB3 GLN 142 HB3 GLN 142 10.079 9.257 11.869 1086 HG2 GLN 142 HG2 GLN 142 8.107 7.944 12.351 1087 HG3 GLN 142 HG3 GLN 142 8.851 6.525 11.611 1088 HE21 GLN 142 HE21 GLN 142 7.886 6.896 14.314 1089 HE22 GLN 142 HE22 GLN 142 9.237 6.618 15.354 1090 H ALA 143 H ALA 143 11.513 8.106 8.702 1091 HA ALA 143 HA ALA 143 12.656 10.685 8.531 1092 HB1 ALA 143 HB1 ALA 143 13.997 8.622 8.430 1093 HB2 ALA 143 HB2 ALA 143 14.302 9.661 7.037 1094 HB3 ALA 143 HB3 ALA 143 13.273 8.240 6.870 1095 H MET 144 H MET 144 10.352 9.053 6.578 1096 HA MET 144 HA MET 144 10.657 10.908 4.347 1097 HB2 MET 144 HB2 MET 144 8.509 8.811 4.777 1098 HB3 MET 144 HB3 MET 144 8.812 9.696 3.293 1099 HG2 MET 144 HG2 MET 144 10.643 7.688 4.581 1100 HG3 MET 144 HG3 MET 144 9.642 7.425 3.165 1101 HE1 MET 144 HE1 MET 144 11.839 6.466 1.970 1102 HE2 MET 144 HE2 MET 144 12.805 6.843 3.396 1103 HE3 MET 144 HE3 MET 144 13.341 7.381 1.806 1104 H ALA 145 H ALA 145 8.676 10.437 7.143 1105 HA ALA 145 HA ALA 145 6.657 12.302 6.283 1106 HB1 ALA 145 HB1 ALA 145 6.032 10.342 7.612 1107 HB2 ALA 145 HB2 ALA 145 5.566 11.845 8.413 1108 HB3 ALA 145 HB3 ALA 145 6.986 10.959 8.962 1109 H TYR 146 H TYR 146 9.229 12.234 8.697 1110 HA TYR 146 HA TYR 146 8.749 15.063 9.240 1111 HB2 TYR 146 HB2 TYR 146 10.444 13.074 10.781 1112 HB3 TYR 146 HB3 TYR 146 10.029 14.703 11.286 1113 HD1 TYR 146 HD1 TYR 146 7.541 15.179 11.761 1114 HD2 TYR 146 HD2 TYR 146 9.124 11.251 11.386 1115 HE1 TYR 146 HE1 TYR 146 5.589 14.279 12.953 1116 HE2 TYR 146 HE2 TYR 146 7.180 10.339 12.574 1117 HH TYR 146 HH TYR 146 4.383 12.118 13.086 Start of MODEL 18 1 H MET 1 H MET 1 -25.489 -4.805 31.195 2 HA MET 1 HA MET 1 -22.694 -3.892 31.164 3 HB2 MET 1 HB2 MET 1 -23.972 -6.484 30.236 4 HB3 MET 1 HB3 MET 1 -22.326 -6.001 29.878 5 HG2 MET 1 HG2 MET 1 -21.768 -6.136 32.232 6 HG3 MET 1 HG3 MET 1 -23.433 -6.578 32.619 7 HE1 MET 1 HE1 MET 1 -22.585 -8.742 33.887 8 HE2 MET 1 HE2 MET 1 -20.905 -8.365 33.507 9 HE3 MET 1 HE3 MET 1 -21.547 -9.968 33.161 10 HA PRO 2 HA PRO 2 -24.251 -2.561 27.155 11 HB2 PRO 2 HB2 PRO 2 -21.558 -2.145 26.192 12 HB3 PRO 2 HB3 PRO 2 -22.736 -0.917 26.662 13 HG2 PRO 2 HG2 PRO 2 -20.424 -1.434 28.054 14 HG3 PRO 2 HG3 PRO 2 -21.882 -0.729 28.766 15 HD2 PRO 2 HD2 PRO 2 -20.901 -3.550 28.876 16 HD3 PRO 2 HD3 PRO 2 -21.671 -2.563 30.138 17 H GLY 3 H GLY 3 -24.835 -4.792 26.758 18 HA2 GLY 3 HA2 GLY 3 -22.906 -6.549 25.522 19 HA3 GLY 3 HA3 GLY 3 -24.621 -6.872 25.769 20 H ARG 4 H ARG 4 -22.472 -4.811 23.941 21 HA ARG 4 HA ARG 4 -24.349 -3.996 22.010 22 HB2 ARG 4 HB2 ARG 4 -21.346 -4.106 21.873 23 HB3 ARG 4 HB3 ARG 4 -22.372 -3.293 20.707 24 HG2 ARG 4 HG2 ARG 4 -23.121 -1.746 22.430 25 HG3 ARG 4 HG3 ARG 4 -22.139 -2.599 23.628 26 HD2 ARG 4 HD2 ARG 4 -20.123 -2.048 22.436 27 HD3 ARG 4 HD3 ARG 4 -21.043 -1.314 21.131 28 HE ARG 4 HE ARG 4 -21.824 0.084 23.279 29 HH11 ARG 4 HH11 ARG 4 -18.595 -0.764 22.096 30 HH12 ARG 4 HH12 ARG 4 -17.871 0.703 22.513 31 HH21 ARG 4 HH21 ARG 4 -20.813 2.149 23.889 32 HH22 ARG 4 HH22 ARG 4 -19.155 2.401 23.603 33 H ALA 5 H ALA 5 -25.032 -4.936 20.252 34 HA ALA 5 HA ALA 5 -23.769 -7.397 19.341 35 HB1 ALA 5 HB1 ALA 5 -26.154 -7.598 19.880 36 HB2 ALA 5 HB2 ALA 5 -25.924 -7.750 18.139 37 HB3 ALA 5 HB3 ALA 5 -26.524 -6.237 18.821 38 HA PRO 6 HA PRO 6 -22.371 -5.018 15.867 39 HB2 PRO 6 HB2 PRO 6 -22.713 -7.285 14.049 40 HB3 PRO 6 HB3 PRO 6 -21.219 -6.518 14.600 41 HG2 PRO 6 HG2 PRO 6 -21.954 -8.993 15.407 42 HG3 PRO 6 HG3 PRO 6 -21.039 -7.885 16.443 43 HD2 PRO 6 HD2 PRO 6 -23.967 -8.522 16.472 44 HD3 PRO 6 HD3 PRO 6 -22.838 -8.317 17.827 45 H GLY 7 H GLY 7 -24.247 -3.777 15.881 46 HA2 GLY 7 HA2 GLY 7 -26.182 -4.377 13.755 47 HA3 GLY 7 HA3 GLY 7 -26.417 -3.209 15.057 48 H SER 8 H SER 8 -23.873 -2.069 14.958 49 HA SER 8 HA SER 8 -24.107 -0.410 12.589 50 HB2 SER 8 HB2 SER 8 -22.392 -0.114 15.071 51 HB3 SER 8 HB3 SER 8 -22.641 1.105 13.819 52 HG SER 8 HG SER 8 -24.972 0.151 14.764 53 H THR 9 H THR 9 -21.655 0.360 11.987 54 HA THR 9 HA THR 9 -19.809 -1.863 12.024 55 HB THR 9 HB THR 9 -20.783 -0.488 9.498 56 HG1 THR 9 HG1 THR 9 -21.624 -2.615 10.878 57 HG21 THR 9 HG21 THR 9 -18.822 -2.776 9.846 58 HG22 THR 9 HG22 THR 9 -18.391 -1.120 9.422 59 HG23 THR 9 HG23 THR 9 -19.355 -2.087 8.312 60 H LEU 10 H LEU 10 -17.650 -1.091 11.708 61 HA LEU 10 HA LEU 10 -17.222 1.544 12.580 62 HB2 LEU 10 HB2 LEU 10 -15.325 -0.484 11.441 63 HB3 LEU 10 HB3 LEU 10 -14.824 1.050 12.122 64 HG LEU 10 HG LEU 10 -16.228 -1.164 13.632 65 HD11 LEU 10 HD11 LEU 10 -14.115 -1.410 14.780 66 HD12 LEU 10 HD12 LEU 10 -13.429 -0.148 13.750 67 HD13 LEU 10 HD13 LEU 10 -13.930 -1.686 13.041 68 HD21 LEU 10 HD21 LEU 10 -16.840 0.998 14.536 69 HD22 LEU 10 HD22 LEU 10 -15.140 1.486 14.562 70 HD23 LEU 10 HD23 LEU 10 -15.699 0.185 15.607 71 H ALA 11 H ALA 11 -16.323 3.246 11.576 72 HA ALA 11 HA ALA 11 -17.115 3.455 8.773 73 HB1 ALA 11 HB1 ALA 11 -18.163 5.016 10.339 74 HB2 ALA 11 HB2 ALA 11 -17.171 5.871 9.160 75 HB3 ALA 11 HB3 ALA 11 -16.574 5.625 10.802 76 H ARG 12 H ARG 12 -15.769 5.017 7.444 77 HA ARG 12 HA ARG 12 -13.117 4.108 7.499 78 HB2 ARG 12 HB2 ARG 12 -14.363 4.321 5.423 79 HB3 ARG 12 HB3 ARG 12 -14.589 6.032 5.700 80 HG2 ARG 12 HG2 ARG 12 -12.358 6.490 5.346 81 HG3 ARG 12 HG3 ARG 12 -11.914 4.769 5.406 82 HD2 ARG 12 HD2 ARG 12 -13.118 4.337 3.346 83 HD3 ARG 12 HD3 ARG 12 -13.770 5.968 3.339 84 HE ARG 12 HE ARG 12 -11.897 6.709 2.386 85 HH11 ARG 12 HH11 ARG 12 -11.012 3.522 3.717 86 HH12 ARG 12 HH12 ARG 12 -9.682 3.303 2.711 87 HH21 ARG 12 HH21 ARG 12 -10.064 6.351 0.929 88 HH22 ARG 12 HH22 ARG 12 -9.111 4.972 1.076 89 H VAL 13 H VAL 13 -12.112 4.829 9.191 90 HA VAL 13 HA VAL 13 -11.872 7.712 9.644 91 HB VAL 13 HB VAL 13 -10.785 7.132 11.792 92 HG11 VAL 13 HG11 VAL 13 -12.739 6.175 12.929 93 HG12 VAL 13 HG12 VAL 13 -13.418 5.729 11.364 94 HG13 VAL 13 HG13 VAL 13 -13.184 7.429 11.773 95 HG21 VAL 13 HG21 VAL 13 -9.735 5.022 11.144 96 HG22 VAL 13 HG22 VAL 13 -11.319 4.263 10.999 97 HG23 VAL 13 HG23 VAL 13 -10.740 4.792 12.577 98 H GLY 14 H GLY 14 -10.459 5.362 7.983 99 HA2 GLY 14 HA2 GLY 14 -7.852 6.729 7.982 100 HA3 GLY 14 HA3 GLY 14 -8.018 4.990 7.714 101 H SER 15 H SER 15 -9.237 8.065 6.466 102 HA SER 15 HA SER 15 -9.805 6.810 3.961 103 HB2 SER 15 HB2 SER 15 -10.087 9.711 4.760 104 HB3 SER 15 HB3 SER 15 -10.695 8.975 3.275 105 HG SER 15 HG SER 15 -11.511 8.600 5.925 106 H ILE 16 H ILE 16 -7.564 6.185 3.578 107 HA ILE 16 HA ILE 16 -6.002 8.367 2.443 108 HB ILE 16 HB ILE 16 -5.361 5.374 2.558 109 HG12 ILE 16 HG12 ILE 16 -3.414 6.159 4.046 110 HG13 ILE 16 HG13 ILE 16 -4.258 7.691 4.168 111 HG21 ILE 16 HG21 ILE 16 -3.629 7.624 1.553 112 HG22 ILE 16 HG22 ILE 16 -4.371 6.355 0.583 113 HG23 ILE 16 HG23 ILE 16 -3.112 5.950 1.753 114 HD11 ILE 16 HD11 ILE 16 -5.284 5.018 5.106 115 HD12 ILE 16 HD12 ILE 16 -6.149 6.550 5.225 116 HD13 ILE 16 HD13 ILE 16 -4.648 6.314 6.119 117 HA PRO 17 HA PRO 17 -8.298 7.521 -1.271 118 HB2 PRO 17 HB2 PRO 17 -7.224 9.460 -2.810 119 HB3 PRO 17 HB3 PRO 17 -8.366 9.819 -1.510 120 HG2 PRO 17 HG2 PRO 17 -5.387 10.049 -1.528 121 HG3 PRO 17 HG3 PRO 17 -6.591 11.151 -0.846 122 HD2 PRO 17 HD2 PRO 17 -5.169 9.344 0.627 123 HD3 PRO 17 HD3 PRO 17 -6.777 9.939 1.087 124 H ALA 18 H ALA 18 -7.982 6.411 -3.163 125 HA ALA 18 HA ALA 18 -5.364 5.267 -3.575 126 HB1 ALA 18 HB1 ALA 18 -7.407 3.872 -3.731 127 HB2 ALA 18 HB2 ALA 18 -6.453 3.861 -5.207 128 HB3 ALA 18 HB3 ALA 18 -7.923 4.830 -5.124 129 H GLY 19 H GLY 19 -3.991 5.935 -5.031 130 HA2 GLY 19 HA2 GLY 19 -4.898 7.898 -7.009 131 HA3 GLY 19 HA3 GLY 19 -3.338 7.982 -6.190 132 H ASP 20 H ASP 20 -1.645 6.934 -7.048 133 HA ASP 20 HA ASP 20 -2.254 5.264 -9.385 134 HB2 ASP 20 HB2 ASP 20 -1.334 7.505 -9.967 135 HB3 ASP 20 HB3 ASP 20 0.104 7.123 -9.034 136 H ASP 21 H ASP 21 -1.047 3.446 -9.637 137 HA ASP 21 HA ASP 21 -0.027 2.316 -7.232 138 HB2 ASP 21 HB2 ASP 21 0.227 0.291 -8.476 139 HB3 ASP 21 HB3 ASP 21 -1.282 1.041 -8.988 140 H VAL 22 H VAL 22 2.016 1.378 -6.982 141 HA VAL 22 HA VAL 22 4.216 2.531 -8.560 142 HB VAL 22 HB VAL 22 4.266 1.786 -5.591 143 HG11 VAL 22 HG11 VAL 22 6.266 3.320 -7.233 144 HG12 VAL 22 HG12 VAL 22 6.397 1.624 -6.799 145 HG13 VAL 22 HG13 VAL 22 6.435 2.860 -5.527 146 HG21 VAL 22 HG21 VAL 22 4.138 4.523 -6.855 147 HG22 VAL 22 HG22 VAL 22 4.341 4.198 -5.133 148 HG23 VAL 22 HG23 VAL 22 2.845 3.741 -5.950 149 H LEU 23 H LEU 23 2.731 0.302 -9.092 150 HA LEU 23 HA LEU 23 4.255 -2.065 -8.270 151 HB2 LEU 23 HB2 LEU 23 1.488 -1.623 -9.309 152 HB3 LEU 23 HB3 LEU 23 2.239 -3.201 -9.322 153 HG LEU 23 HG LEU 23 1.941 -1.634 -6.772 154 HD11 LEU 23 HD11 LEU 23 -0.111 -3.012 -6.437 155 HD12 LEU 23 HD12 LEU 23 0.038 -3.549 -8.120 156 HD13 LEU 23 HD13 LEU 23 -0.277 -1.859 -7.761 157 HD21 LEU 23 HD21 LEU 23 2.079 -3.892 -5.832 158 HD22 LEU 23 HD22 LEU 23 3.503 -3.495 -6.796 159 HD23 LEU 23 HD23 LEU 23 2.258 -4.546 -7.466 160 H ASP 24 H ASP 24 4.132 -3.765 -10.005 161 HA ASP 24 HA ASP 24 4.897 -2.715 -12.588 162 HB2 ASP 24 HB2 ASP 24 6.220 -4.578 -11.660 163 HB3 ASP 24 HB3 ASP 24 4.774 -5.551 -11.479 164 HA PRO 25 HA PRO 25 0.723 -2.740 -14.036 165 HB2 PRO 25 HB2 PRO 25 1.840 -3.877 -16.542 166 HB3 PRO 25 HB3 PRO 25 0.772 -2.490 -16.319 167 HG2 PRO 25 HG2 PRO 25 3.346 -2.108 -16.812 168 HG3 PRO 25 HG3 PRO 25 2.494 -1.092 -15.636 169 HD2 PRO 25 HD2 PRO 25 4.430 -3.314 -15.169 170 HD3 PRO 25 HD3 PRO 25 4.181 -1.809 -14.260 171 H ASP 26 H ASP 26 2.555 -5.752 -14.336 172 HA ASP 26 HA ASP 26 -0.043 -7.080 -14.095 173 HB2 ASP 26 HB2 ASP 26 0.964 -7.314 -16.455 174 HB3 ASP 26 HB3 ASP 26 2.172 -8.353 -15.703 175 H GLU 27 H GLU 27 1.833 -6.325 -12.059 176 HA GLU 27 HA GLU 27 3.055 -8.734 -11.087 177 HB2 GLU 27 HB2 GLU 27 3.630 -6.371 -10.304 178 HB3 GLU 27 HB3 GLU 27 2.075 -6.326 -9.510 179 HG2 GLU 27 HG2 GLU 27 3.859 -6.795 -7.931 180 HG3 GLU 27 HG3 GLU 27 2.755 -8.164 -8.052 181 HA PRO 28 HA PRO 28 -0.874 -10.695 -10.052 182 HB2 PRO 28 HB2 PRO 28 0.821 -12.034 -7.998 183 HB3 PRO 28 HB3 PRO 28 -0.285 -12.748 -9.178 184 HG2 PRO 28 HG2 PRO 28 2.337 -12.891 -9.555 185 HG3 PRO 28 HG3 PRO 28 1.244 -12.584 -10.916 186 HD2 PRO 28 HD2 PRO 28 3.008 -10.675 -9.441 187 HD3 PRO 28 HD3 PRO 28 2.613 -10.756 -11.172 188 H THR 29 H THR 29 -1.969 -9.020 -9.109 189 HA THR 29 HA THR 29 -1.353 -8.383 -6.349 190 HB THR 29 HB THR 29 -2.897 -6.400 -6.925 191 HG1 THR 29 HG1 THR 29 -3.722 -6.905 -8.915 192 HG21 THR 29 HG21 THR 29 -0.219 -6.666 -8.300 193 HG22 THR 29 HG22 THR 29 -0.450 -6.262 -6.596 194 HG23 THR 29 HG23 THR 29 -1.036 -5.166 -7.848 195 H TYR 30 H TYR 30 -3.504 -7.395 -5.362 196 HA TYR 30 HA TYR 30 -5.486 -9.476 -5.560 197 HB2 TYR 30 HB2 TYR 30 -4.507 -7.855 -3.236 198 HB3 TYR 30 HB3 TYR 30 -6.087 -8.636 -3.228 199 HD1 TYR 30 HD1 TYR 30 -6.141 -11.111 -3.763 200 HD2 TYR 30 HD2 TYR 30 -2.628 -9.076 -2.571 201 HE1 TYR 30 HE1 TYR 30 -5.156 -13.246 -3.121 202 HE2 TYR 30 HE2 TYR 30 -1.614 -11.190 -1.894 203 HH TYR 30 HH TYR 30 -2.203 -13.442 -1.343 204 H ASP 31 H ASP 31 -7.577 -8.723 -5.095 205 HA ASP 31 HA ASP 31 -8.239 -5.970 -5.819 206 HB2 ASP 31 HB2 ASP 31 -9.767 -8.413 -6.794 207 HB3 ASP 31 HB3 ASP 31 -9.891 -6.764 -7.381 208 H LEU 32 H LEU 32 -10.542 -5.692 -4.933 209 HA LEU 32 HA LEU 32 -10.756 -6.610 -2.343 210 HB2 LEU 32 HB2 LEU 32 -13.033 -5.688 -4.117 211 HB3 LEU 32 HB3 LEU 32 -13.128 -5.875 -2.381 212 HG LEU 32 HG LEU 32 -11.370 -3.886 -3.824 213 HD11 LEU 32 HD11 LEU 32 -13.909 -3.498 -2.250 214 HD12 LEU 32 HD12 LEU 32 -13.728 -3.327 -3.996 215 HD13 LEU 32 HD13 LEU 32 -12.893 -2.217 -2.910 216 HD21 LEU 32 HD21 LEU 32 -10.364 -4.594 -1.711 217 HD22 LEU 32 HD22 LEU 32 -11.891 -4.290 -0.877 218 HD23 LEU 32 HD23 LEU 32 -10.992 -2.952 -1.585 219 HA PRO 33 HA PRO 33 -13.814 -10.210 -3.744 220 HB2 PRO 33 HB2 PRO 33 -13.285 -11.117 -6.300 221 HB3 PRO 33 HB3 PRO 33 -14.637 -10.064 -5.876 222 HG2 PRO 33 HG2 PRO 33 -11.956 -9.347 -7.002 223 HG3 PRO 33 HG3 PRO 33 -13.559 -8.736 -7.458 224 HD2 PRO 33 HD2 PRO 33 -11.956 -7.290 -5.909 225 HD3 PRO 33 HD3 PRO 33 -13.701 -7.363 -5.577 226 H ARG 34 H ARG 34 -10.574 -9.945 -5.182 227 HA ARG 34 HA ARG 34 -9.884 -12.673 -4.876 228 HB2 ARG 34 HB2 ARG 34 -8.810 -10.812 -6.354 229 HB3 ARG 34 HB3 ARG 34 -7.951 -10.421 -4.869 230 HG2 ARG 34 HG2 ARG 34 -6.544 -11.774 -6.226 231 HG3 ARG 34 HG3 ARG 34 -7.051 -12.703 -4.811 232 HD2 ARG 34 HD2 ARG 34 -8.641 -13.910 -6.060 233 HD3 ARG 34 HD3 ARG 34 -8.439 -12.849 -7.458 234 HE ARG 34 HE ARG 34 -6.523 -14.826 -6.437 235 HH11 ARG 34 HH11 ARG 34 -7.674 -12.759 -9.111 236 HH12 ARG 34 HH12 ARG 34 -6.590 -13.358 -10.255 237 HH21 ARG 34 HH21 ARG 34 -4.983 -15.669 -8.062 238 HH22 ARG 34 HH22 ARG 34 -5.007 -15.042 -9.634 239 H VAL 35 H VAL 35 -9.455 -9.785 -2.853 240 HA VAL 35 HA VAL 35 -7.875 -11.098 -0.886 241 HB VAL 35 HB VAL 35 -9.607 -8.621 -0.529 242 HG11 VAL 35 HG11 VAL 35 -7.344 -9.651 1.180 243 HG12 VAL 35 HG12 VAL 35 -9.050 -9.642 1.615 244 HG13 VAL 35 HG13 VAL 35 -8.187 -8.119 1.410 245 HG21 VAL 35 HG21 VAL 35 -7.937 -8.255 -2.233 246 HG22 VAL 35 HG22 VAL 35 -6.679 -8.881 -1.163 247 HG23 VAL 35 HG23 VAL 35 -7.501 -7.377 -0.763 248 H ALA 36 H ALA 36 -11.290 -10.524 -1.272 249 HA ALA 36 HA ALA 36 -12.227 -11.604 1.120 250 HB1 ALA 36 HB1 ALA 36 -13.486 -11.717 -1.626 251 HB2 ALA 36 HB2 ALA 36 -13.628 -10.382 -0.485 252 HB3 ALA 36 HB3 ALA 36 -14.326 -11.956 -0.093 253 H GLU 37 H GLU 37 -11.350 -13.041 -1.900 254 HA GLU 37 HA GLU 37 -12.086 -15.725 -1.446 255 HB2 GLU 37 HB2 GLU 37 -11.471 -14.369 -3.564 256 HB3 GLU 37 HB3 GLU 37 -9.842 -14.745 -3.130 257 HG2 GLU 37 HG2 GLU 37 -10.161 -17.076 -3.381 258 HG3 GLU 37 HG3 GLU 37 -11.903 -16.863 -3.607 259 H LEU 38 H LEU 38 -9.168 -13.865 -0.895 260 HA LEU 38 HA LEU 38 -7.467 -16.012 -0.162 261 HB2 LEU 38 HB2 LEU 38 -6.612 -13.910 -1.015 262 HB3 LEU 38 HB3 LEU 38 -7.285 -13.055 0.356 263 HG LEU 38 HG LEU 38 -5.745 -14.364 1.829 264 HD11 LEU 38 HD11 LEU 38 -5.314 -16.254 0.389 265 HD12 LEU 38 HD12 LEU 38 -3.805 -15.444 0.807 266 HD13 LEU 38 HD13 LEU 38 -4.521 -15.206 -0.785 267 HD21 LEU 38 HD21 LEU 38 -3.766 -13.033 1.261 268 HD22 LEU 38 HD22 LEU 38 -5.246 -12.079 1.182 269 HD23 LEU 38 HD23 LEU 38 -4.486 -12.647 -0.303 270 H LEU 39 H LEU 39 -9.316 -13.627 1.686 271 HA LEU 39 HA LEU 39 -8.373 -14.727 4.196 272 HB2 LEU 39 HB2 LEU 39 -10.323 -12.531 3.612 273 HB3 LEU 39 HB3 LEU 39 -9.757 -12.954 5.218 274 HG LEU 39 HG LEU 39 -8.076 -11.848 2.961 275 HD11 LEU 39 HD11 LEU 39 -9.052 -10.590 5.515 276 HD12 LEU 39 HD12 LEU 39 -9.592 -10.200 3.881 277 HD13 LEU 39 HD13 LEU 39 -7.932 -9.854 4.369 278 HD21 LEU 39 HD21 LEU 39 -6.754 -13.318 4.379 279 HD22 LEU 39 HD22 LEU 39 -7.350 -12.494 5.819 280 HD23 LEU 39 HD23 LEU 39 -6.323 -11.638 4.673 281 H GLY 40 H GLY 40 -11.069 -15.244 2.148 282 HA2 GLY 40 HA2 GLY 40 -12.747 -16.797 2.376 283 HA3 GLY 40 HA3 GLY 40 -12.117 -17.207 3.970 284 H VAL 41 H VAL 41 -12.840 -13.977 3.034 285 HA VAL 41 HA VAL 41 -15.186 -13.949 4.822 286 HB VAL 41 HB VAL 41 -14.590 -11.696 5.572 287 HG11 VAL 41 HG11 VAL 41 -13.741 -13.477 6.921 288 HG12 VAL 41 HG12 VAL 41 -12.577 -12.150 6.885 289 HG13 VAL 41 HG13 VAL 41 -12.297 -13.598 5.918 290 HG21 VAL 41 HG21 VAL 41 -12.172 -11.972 3.796 291 HG22 VAL 41 HG22 VAL 41 -12.373 -10.697 5.007 292 HG23 VAL 41 HG23 VAL 41 -13.487 -10.815 3.646 293 HA PRO 42 HA PRO 42 -17.184 -12.013 1.362 294 HB2 PRO 42 HB2 PRO 42 -18.748 -10.090 2.530 295 HB3 PRO 42 HB3 PRO 42 -19.175 -11.806 2.498 296 HG2 PRO 42 HG2 PRO 42 -17.923 -10.204 4.686 297 HG3 PRO 42 HG3 PRO 42 -19.179 -11.453 4.797 298 HD2 PRO 42 HD2 PRO 42 -16.605 -11.963 5.408 299 HD3 PRO 42 HD3 PRO 42 -17.648 -13.182 4.649 300 H VAL 43 H VAL 43 -17.116 -10.167 0.053 301 HA VAL 43 HA VAL 43 -14.862 -8.553 0.118 302 HB VAL 43 HB VAL 43 -17.501 -7.994 -1.260 303 HG11 VAL 43 HG11 VAL 43 -16.214 -6.597 -2.827 304 HG12 VAL 43 HG12 VAL 43 -14.767 -6.876 -1.860 305 HG13 VAL 43 HG13 VAL 43 -16.120 -5.970 -1.179 306 HG21 VAL 43 HG21 VAL 43 -16.428 -8.981 -3.246 307 HG22 VAL 43 HG22 VAL 43 -16.570 -10.127 -1.913 308 HG23 VAL 43 HG23 VAL 43 -15.019 -9.366 -2.259 309 H SER 44 H SER 44 -18.040 -8.004 1.444 310 HA SER 44 HA SER 44 -17.870 -5.326 2.086 311 HB2 SER 44 HB2 SER 44 -19.935 -6.644 2.305 312 HB3 SER 44 HB3 SER 44 -19.232 -7.518 3.663 313 HG SER 44 HG SER 44 -20.658 -5.663 4.112 314 H LYS 45 H LYS 45 -16.708 -8.154 3.988 315 HA LYS 45 HA LYS 45 -15.850 -6.544 6.162 316 HB2 LYS 45 HB2 LYS 45 -15.063 -9.338 5.366 317 HB3 LYS 45 HB3 LYS 45 -14.310 -8.521 6.719 318 HG2 LYS 45 HG2 LYS 45 -16.616 -8.261 7.702 319 HG3 LYS 45 HG3 LYS 45 -17.193 -9.335 6.425 320 HD2 LYS 45 HD2 LYS 45 -15.624 -11.075 7.181 321 HD3 LYS 45 HD3 LYS 45 -15.036 -9.996 8.438 322 HE2 LYS 45 HE2 LYS 45 -17.829 -11.078 8.175 323 HE3 LYS 45 HE3 LYS 45 -16.616 -11.638 9.316 324 HZ1 LYS 45 HZ1 LYS 45 -16.633 -9.399 10.317 325 HZ2 LYS 45 HZ2 LYS 45 -18.127 -10.157 10.408 326 HZ3 LYS 45 HZ3 LYS 45 -17.890 -8.946 9.281 327 H VAL 46 H VAL 46 -14.303 -7.622 3.237 328 HA VAL 46 HA VAL 46 -11.703 -6.670 3.845 329 HB VAL 46 HB VAL 46 -13.042 -6.818 1.120 330 HG11 VAL 46 HG11 VAL 46 -10.772 -6.916 0.207 331 HG12 VAL 46 HG12 VAL 46 -10.116 -6.724 1.836 332 HG13 VAL 46 HG13 VAL 46 -11.052 -5.422 1.105 333 HG21 VAL 46 HG21 VAL 46 -13.069 -8.981 2.225 334 HG22 VAL 46 HG22 VAL 46 -11.342 -8.858 2.556 335 HG23 VAL 46 HG23 VAL 46 -11.913 -8.994 0.893 336 H ALA 47 H ALA 47 -14.457 -5.159 2.244 337 HA ALA 47 HA ALA 47 -13.318 -2.652 1.767 338 HB1 ALA 47 HB1 ALA 47 -15.406 -3.423 0.728 339 HB2 ALA 47 HB2 ALA 47 -15.595 -1.850 1.498 340 HB3 ALA 47 HB3 ALA 47 -16.220 -3.299 2.292 341 H GLN 48 H GLN 48 -14.931 -3.980 4.575 342 HA GLN 48 HA GLN 48 -15.128 -1.656 6.122 343 HB2 GLN 48 HB2 GLN 48 -14.718 -4.505 7.037 344 HB3 GLN 48 HB3 GLN 48 -15.161 -3.166 8.091 345 HG2 GLN 48 HG2 GLN 48 -17.211 -2.849 6.879 346 HG3 GLN 48 HG3 GLN 48 -16.755 -4.108 5.736 347 HE21 GLN 48 HE21 GLN 48 -19.038 -3.914 7.308 348 HE22 GLN 48 HE22 GLN 48 -19.134 -5.305 8.329 349 H GLN 49 H GLN 49 -12.586 -4.109 5.886 350 HA GLN 49 HA GLN 49 -10.735 -3.105 7.754 351 HB2 GLN 49 HB2 GLN 49 -10.195 -4.577 5.176 352 HB3 GLN 49 HB3 GLN 49 -9.058 -4.394 6.505 353 HG2 GLN 49 HG2 GLN 49 -10.559 -5.573 7.948 354 HG3 GLN 49 HG3 GLN 49 -11.709 -5.766 6.644 355 HE21 GLN 49 HE21 GLN 49 -11.613 -7.975 6.832 356 HE22 GLN 49 HE22 GLN 49 -10.297 -8.910 6.217 357 H LEU 50 H LEU 50 -11.111 -2.565 4.392 358 HA LEU 50 HA LEU 50 -8.967 -0.779 3.927 359 HB2 LEU 50 HB2 LEU 50 -10.251 -1.865 2.118 360 HB3 LEU 50 HB3 LEU 50 -11.651 -0.908 2.535 361 HG LEU 50 HG LEU 50 -10.406 1.139 1.866 362 HD11 LEU 50 HD11 LEU 50 -8.327 -0.823 0.914 363 HD12 LEU 50 HD12 LEU 50 -8.136 0.366 2.203 364 HD13 LEU 50 HD13 LEU 50 -8.364 0.898 0.540 365 HD21 LEU 50 HD21 LEU 50 -10.550 0.725 -0.545 366 HD22 LEU 50 HD22 LEU 50 -11.931 0.047 0.318 367 HD23 LEU 50 HD23 LEU 50 -10.631 -1.009 -0.238 368 H ARG 51 H ARG 51 -12.299 -0.227 4.966 369 HA ARG 51 HA ARG 51 -12.026 2.578 5.115 370 HB2 ARG 51 HB2 ARG 51 -14.086 0.702 6.268 371 HB3 ARG 51 HB3 ARG 51 -14.167 2.447 6.476 372 HG2 ARG 51 HG2 ARG 51 -14.104 2.638 3.963 373 HG3 ARG 51 HG3 ARG 51 -14.302 0.891 3.907 374 HD2 ARG 51 HD2 ARG 51 -16.191 2.735 5.333 375 HD3 ARG 51 HD3 ARG 51 -16.384 2.256 3.648 376 HE ARG 51 HE ARG 51 -16.359 -0.095 4.676 377 HH11 ARG 51 HH11 ARG 51 -17.788 2.750 6.306 378 HH12 ARG 51 HH12 ARG 51 -19.118 1.876 6.913 379 HH21 ARG 51 HH21 ARG 51 -18.290 -1.244 5.501 380 HH22 ARG 51 HH22 ARG 51 -19.410 -0.378 6.452 381 H GLU 52 H GLU 52 -11.242 0.005 7.305 382 HA GLU 52 HA GLU 52 -11.127 1.620 9.677 383 HB2 GLU 52 HB2 GLU 52 -9.824 -1.044 9.095 384 HB3 GLU 52 HB3 GLU 52 -10.018 -0.325 10.678 385 HG2 GLU 52 HG2 GLU 52 -12.446 -0.557 10.479 386 HG3 GLU 52 HG3 GLU 52 -12.238 -1.259 8.875 387 H GLY 53 H GLY 53 -9.172 1.309 6.960 388 HA2 GLY 53 HA2 GLY 53 -7.139 2.326 6.474 389 HA3 GLY 53 HA3 GLY 53 -7.040 2.852 8.154 390 H HIS 54 H HIS 54 -7.708 -0.436 7.488 391 HA HIS 54 HA HIS 54 -5.133 -1.155 8.650 392 HB2 HIS 54 HB2 HIS 54 -7.660 -2.767 8.259 393 HB3 HIS 54 HB3 HIS 54 -6.147 -3.462 8.821 394 HD1 HIS 54 HD1 HIS 54 -9.060 -3.015 10.396 395 HD2 HIS 54 HD2 HIS 54 -5.412 -1.110 11.014 396 HE1 HIS 54 HE1 HIS 54 -8.996 -2.350 12.812 397 H LEU 55 H LEU 55 -6.268 -0.660 5.676 398 HA LEU 55 HA LEU 55 -4.167 -2.092 4.435 399 HB2 LEU 55 HB2 LEU 55 -6.010 -3.809 4.728 400 HB3 LEU 55 HB3 LEU 55 -7.035 -2.790 3.749 401 HG LEU 55 HG LEU 55 -5.573 -3.158 1.816 402 HD11 LEU 55 HD11 LEU 55 -3.442 -3.450 2.977 403 HD12 LEU 55 HD12 LEU 55 -3.778 -4.843 1.951 404 HD13 LEU 55 HD13 LEU 55 -4.026 -4.951 3.694 405 HD21 LEU 55 HD21 LEU 55 -6.449 -5.670 3.236 406 HD22 LEU 55 HD22 LEU 55 -6.072 -5.550 1.519 407 HD23 LEU 55 HD23 LEU 55 -7.441 -4.659 2.186 408 H VAL 56 H VAL 56 -3.949 -1.216 2.204 409 HA VAL 56 HA VAL 56 -5.790 0.958 1.622 410 HB VAL 56 HB VAL 56 -3.775 1.910 2.675 411 HG11 VAL 56 HG11 VAL 56 -1.598 1.877 1.538 412 HG12 VAL 56 HG12 VAL 56 -2.251 0.726 0.369 413 HG13 VAL 56 HG13 VAL 56 -2.123 0.280 2.070 414 HG21 VAL 56 HG21 VAL 56 -3.192 3.578 0.941 415 HG22 VAL 56 HG22 VAL 56 -4.927 3.301 1.084 416 HG23 VAL 56 HG23 VAL 56 -4.026 2.583 -0.250 417 H ALA 57 H ALA 57 -5.984 1.410 -0.573 418 HA ALA 57 HA ALA 57 -5.008 -0.725 -2.341 419 HB1 ALA 57 HB1 ALA 57 -7.146 -0.617 -3.519 420 HB2 ALA 57 HB2 ALA 57 -7.715 0.606 -2.386 421 HB3 ALA 57 HB3 ALA 57 -7.385 -1.032 -1.820 422 H VAL 58 H VAL 58 -4.774 -0.118 -4.532 423 HA VAL 58 HA VAL 58 -4.507 2.748 -5.073 424 HB VAL 58 HB VAL 58 -2.478 2.241 -6.451 425 HG11 VAL 58 HG11 VAL 58 -2.233 1.560 -3.537 426 HG12 VAL 58 HG12 VAL 58 -2.210 3.174 -4.246 427 HG13 VAL 58 HG13 VAL 58 -0.904 2.037 -4.592 428 HG21 VAL 58 HG21 VAL 58 -2.592 -0.455 -5.088 429 HG22 VAL 58 HG22 VAL 58 -1.248 0.141 -6.066 430 HG23 VAL 58 HG23 VAL 58 -2.823 -0.144 -6.808 431 H ARG 59 H ARG 59 -4.330 3.087 -7.486 432 HA ARG 59 HA ARG 59 -6.139 1.192 -8.834 433 HB2 ARG 59 HB2 ARG 59 -5.651 4.106 -9.398 434 HB3 ARG 59 HB3 ARG 59 -6.735 3.056 -10.293 435 HG2 ARG 59 HG2 ARG 59 -8.164 2.832 -8.363 436 HG3 ARG 59 HG3 ARG 59 -7.036 3.777 -7.386 437 HD2 ARG 59 HD2 ARG 59 -8.553 4.748 -9.806 438 HD3 ARG 59 HD3 ARG 59 -8.891 5.169 -8.126 439 HE ARG 59 HE ARG 59 -6.213 5.772 -9.035 440 HH11 ARG 59 HH11 ARG 59 -9.479 7.052 -8.697 441 HH12 ARG 59 HH12 ARG 59 -8.976 8.677 -8.658 442 HH21 ARG 59 HH21 ARG 59 -5.538 7.980 -9.077 443 HH22 ARG 59 HH22 ARG 59 -6.650 9.222 -8.818 444 H ARG 60 H ARG 60 -5.330 0.122 -10.495 445 HA ARG 60 HA ARG 60 -3.141 1.392 -11.950 446 HB2 ARG 60 HB2 ARG 60 -1.985 -0.662 -12.345 447 HB3 ARG 60 HB3 ARG 60 -2.337 -0.665 -10.631 448 HG2 ARG 60 HG2 ARG 60 -4.129 -2.239 -10.959 449 HG3 ARG 60 HG3 ARG 60 -3.951 -2.125 -12.707 450 HD2 ARG 60 HD2 ARG 60 -1.596 -2.958 -12.416 451 HD3 ARG 60 HD3 ARG 60 -1.999 -3.283 -10.730 452 HE ARG 60 HE ARG 60 -3.857 -4.412 -12.570 453 HH11 ARG 60 HH11 ARG 60 -0.734 -4.995 -11.022 454 HH12 ARG 60 HH12 ARG 60 -0.850 -6.697 -11.122 455 HH21 ARG 60 HH21 ARG 60 -3.959 -6.684 -12.809 456 HH22 ARG 60 HH22 ARG 60 -2.694 -7.680 -12.245 457 H ALA 61 H ALA 61 -3.668 1.792 -13.934 458 HA ALA 61 HA ALA 61 -4.625 1.780 -15.966 459 HB1 ALA 61 HB1 ALA 61 -5.617 -0.994 -15.303 460 HB2 ALA 61 HB2 ALA 61 -4.077 -0.613 -16.082 461 HB3 ALA 61 HB3 ALA 61 -5.598 -0.262 -16.905 462 H GLY 62 H GLY 62 -6.455 1.455 -13.191 463 HA2 GLY 62 HA2 GLY 62 -8.395 3.108 -13.281 464 HA3 GLY 62 HA3 GLY 62 -8.963 2.065 -14.587 465 H GLY 63 H GLY 63 -7.581 -0.136 -12.903 466 HA2 GLY 63 HA2 GLY 63 -10.022 -0.760 -11.441 467 HA3 GLY 63 HA3 GLY 63 -8.711 -1.873 -11.818 468 H VAL 64 H VAL 64 -9.984 -1.417 -9.278 469 HA VAL 64 HA VAL 64 -7.890 -0.072 -7.758 470 HB VAL 64 HB VAL 64 -10.563 -1.198 -6.835 471 HG11 VAL 64 HG11 VAL 64 -10.165 0.054 -4.766 472 HG12 VAL 64 HG12 VAL 64 -8.577 0.530 -5.365 473 HG13 VAL 64 HG13 VAL 64 -8.923 -1.169 -5.041 474 HG21 VAL 64 HG21 VAL 64 -9.753 1.671 -7.313 475 HG22 VAL 64 HG22 VAL 64 -11.298 1.129 -6.662 476 HG23 VAL 64 HG23 VAL 64 -10.848 0.727 -8.321 477 H VAL 65 H VAL 65 -6.364 -1.233 -6.892 478 HA VAL 65 HA VAL 65 -6.767 -4.076 -6.349 479 HB VAL 65 HB VAL 65 -4.484 -4.521 -7.298 480 HG11 VAL 65 HG11 VAL 65 -5.255 -4.660 -9.624 481 HG12 VAL 65 HG12 VAL 65 -6.624 -3.618 -9.217 482 HG13 VAL 65 HG13 VAL 65 -6.469 -5.211 -8.468 483 HG21 VAL 65 HG21 VAL 65 -3.595 -2.978 -8.971 484 HG22 VAL 65 HG22 VAL 65 -3.690 -2.197 -7.391 485 HG23 VAL 65 HG23 VAL 65 -4.904 -1.846 -8.627 486 H ILE 66 H ILE 66 -5.171 -4.955 -5.078 487 HA ILE 66 HA ILE 66 -3.860 -3.068 -3.273 488 HB ILE 66 HB ILE 66 -5.177 -5.727 -2.573 489 HG12 ILE 66 HG12 ILE 66 -6.015 -2.915 -1.810 490 HG13 ILE 66 HG13 ILE 66 -6.755 -3.851 -3.100 491 HG21 ILE 66 HG21 ILE 66 -4.685 -5.123 -0.241 492 HG22 ILE 66 HG22 ILE 66 -3.874 -3.658 -0.788 493 HG23 ILE 66 HG23 ILE 66 -3.201 -5.237 -1.191 494 HD11 ILE 66 HD11 ILE 66 -6.729 -4.583 -0.186 495 HD12 ILE 66 HD12 ILE 66 -7.518 -5.483 -1.480 496 HD13 ILE 66 HD13 ILE 66 -8.081 -3.863 -1.058 497 HA PRO 67 HA PRO 67 -0.278 -5.251 -4.870 498 HB2 PRO 67 HB2 PRO 67 0.879 -4.352 -2.293 499 HB3 PRO 67 HB3 PRO 67 1.520 -4.170 -3.927 500 HG2 PRO 67 HG2 PRO 67 0.443 -2.101 -2.697 501 HG3 PRO 67 HG3 PRO 67 0.103 -2.385 -4.412 502 HD2 PRO 67 HD2 PRO 67 -1.619 -2.916 -2.027 503 HD3 PRO 67 HD3 PRO 67 -2.056 -2.286 -3.633 504 H GLN 68 H GLN 68 0.469 -7.262 -4.689 505 HA GLN 68 HA GLN 68 -0.461 -9.276 -3.033 506 HB2 GLN 68 HB2 GLN 68 0.764 -9.604 -5.154 507 HB3 GLN 68 HB3 GLN 68 2.238 -9.051 -4.380 508 HG2 GLN 68 HG2 GLN 68 2.356 -11.418 -4.437 509 HG3 GLN 68 HG3 GLN 68 2.007 -10.958 -2.776 510 HE21 GLN 68 HE21 GLN 68 -0.267 -11.030 -5.460 511 HE22 GLN 68 HE22 GLN 68 -1.266 -12.266 -4.811 512 H VAL 69 H VAL 69 2.211 -7.153 -2.735 513 HA VAL 69 HA VAL 69 3.632 -8.481 -0.701 514 HB VAL 69 HB VAL 69 5.047 -6.486 -0.714 515 HG11 VAL 69 HG11 VAL 69 5.779 -6.683 -3.057 516 HG12 VAL 69 HG12 VAL 69 4.264 -7.497 -3.451 517 HG13 VAL 69 HG13 VAL 69 5.412 -8.260 -2.354 518 HG21 VAL 69 HG21 VAL 69 4.558 -4.670 -2.317 519 HG22 VAL 69 HG22 VAL 69 3.356 -4.791 -1.028 520 HG23 VAL 69 HG23 VAL 69 2.985 -5.414 -2.633 521 H PHE 70 H PHE 70 0.774 -6.892 -0.363 522 HA PHE 70 HA PHE 70 1.458 -5.790 2.245 523 HB2 PHE 70 HB2 PHE 70 -0.917 -5.530 0.437 524 HB3 PHE 70 HB3 PHE 70 -1.128 -5.254 2.163 525 HD1 PHE 70 HD1 PHE 70 1.501 -4.304 -0.341 526 HD2 PHE 70 HD2 PHE 70 -1.209 -3.039 2.679 527 HE1 PHE 70 HE1 PHE 70 2.315 -1.989 -0.573 528 HE2 PHE 70 HE2 PHE 70 -0.397 -0.750 2.463 529 HZ PHE 70 HZ PHE 70 1.340 -0.206 0.851 530 H PHE 71 H PHE 71 0.831 -8.641 0.971 531 HA PHE 71 HA PHE 71 -0.514 -9.612 3.371 532 HB2 PHE 71 HB2 PHE 71 -0.754 -10.673 0.559 533 HB3 PHE 71 HB3 PHE 71 -1.402 -11.468 1.987 534 HD1 PHE 71 HD1 PHE 71 -3.301 -10.518 3.179 535 HD2 PHE 71 HD2 PHE 71 -1.781 -8.740 -0.360 536 HE1 PHE 71 HE1 PHE 71 -5.369 -9.209 2.951 537 HE2 PHE 71 HE2 PHE 71 -3.820 -7.436 -0.604 538 HZ PHE 71 HZ PHE 71 -5.637 -7.660 1.061 539 H THR 72 H THR 72 0.339 -11.300 4.309 540 HA THR 72 HA THR 72 3.107 -11.882 3.792 541 HB THR 72 HB THR 72 2.857 -13.324 5.821 542 HG1 THR 72 HG1 THR 72 0.245 -12.283 6.052 543 HG21 THR 72 HG21 THR 72 1.679 -10.540 6.106 544 HG22 THR 72 HG22 THR 72 3.397 -10.927 6.117 545 HG23 THR 72 HG23 THR 72 2.348 -11.483 7.422 546 H ASN 73 H ASN 73 3.821 -14.208 3.749 547 HA ASN 73 HA ASN 73 2.722 -15.754 1.723 548 HB2 ASN 73 HB2 ASN 73 4.141 -17.608 2.513 549 HB3 ASN 73 HB3 ASN 73 5.029 -16.096 2.533 550 HD21 ASN 73 HD21 ASN 73 5.669 -15.235 4.497 551 HD22 ASN 73 HD22 ASN 73 5.603 -16.103 5.979 552 H SER 74 H SER 74 1.744 -15.519 5.011 553 HA SER 74 HA SER 74 0.377 -18.037 5.119 554 HB2 SER 74 HB2 SER 74 1.398 -16.923 7.116 555 HB3 SER 74 HB3 SER 74 0.188 -15.653 6.987 556 HG SER 74 HG SER 74 -1.333 -17.008 7.709 557 H GLY 75 H GLY 75 -0.281 -15.084 3.631 558 HA2 GLY 75 HA2 GLY 75 -2.124 -14.556 2.368 559 HA3 GLY 75 HA3 GLY 75 -2.984 -15.905 3.091 560 H GLN 76 H GLN 76 -1.465 -13.754 5.244 561 HA GLN 76 HA GLN 76 -4.050 -12.459 5.758 562 HB2 GLN 76 HB2 GLN 76 -3.458 -12.382 8.152 563 HB3 GLN 76 HB3 GLN 76 -3.528 -14.033 7.564 564 HG2 GLN 76 HG2 GLN 76 -1.094 -14.097 7.435 565 HG3 GLN 76 HG3 GLN 76 -1.012 -12.435 8.001 566 HE21 GLN 76 HE21 GLN 76 0.203 -13.022 9.824 567 HE22 GLN 76 HE22 GLN 76 -0.509 -13.858 11.143 568 H VAL 77 H VAL 77 -3.814 -10.321 6.833 569 HA VAL 77 HA VAL 77 -1.925 -8.750 5.356 570 HB VAL 77 HB VAL 77 -3.807 -7.880 7.587 571 HG11 VAL 77 HG11 VAL 77 -2.508 -6.252 5.404 572 HG12 VAL 77 HG12 VAL 77 -2.091 -6.227 7.115 573 HG13 VAL 77 HG13 VAL 77 -3.671 -5.651 6.586 574 HG21 VAL 77 HG21 VAL 77 -4.303 -7.942 4.615 575 HG22 VAL 77 HG22 VAL 77 -5.382 -7.224 5.809 576 HG23 VAL 77 HG23 VAL 77 -5.087 -8.962 5.820 577 H VAL 78 H VAL 78 -0.176 -7.638 6.212 578 HA VAL 78 HA VAL 78 1.206 -8.779 8.409 579 HB VAL 78 HB VAL 78 1.589 -6.057 7.193 580 HG11 VAL 78 HG11 VAL 78 3.955 -6.282 7.906 581 HG12 VAL 78 HG12 VAL 78 3.544 -7.803 8.697 582 HG13 VAL 78 HG13 VAL 78 2.827 -6.292 9.261 583 HG21 VAL 78 HG21 VAL 78 3.262 -7.059 5.728 584 HG22 VAL 78 HG22 VAL 78 1.649 -7.702 5.435 585 HG23 VAL 78 HG23 VAL 78 2.833 -8.658 6.337 586 H LYS 79 H LYS 79 0.969 -8.392 10.500 587 HA LYS 79 HA LYS 79 -1.232 -7.044 11.536 588 HB2 LYS 79 HB2 LYS 79 -0.327 -8.778 12.825 589 HB3 LYS 79 HB3 LYS 79 1.264 -8.033 12.870 590 HG2 LYS 79 HG2 LYS 79 0.488 -6.306 14.273 591 HG3 LYS 79 HG3 LYS 79 -1.185 -6.887 14.201 592 HD2 LYS 79 HD2 LYS 79 -0.405 -9.017 15.237 593 HD3 LYS 79 HD3 LYS 79 1.203 -8.305 15.401 594 HE2 LYS 79 HE2 LYS 79 -1.337 -7.259 16.644 595 HE3 LYS 79 HE3 LYS 79 -0.081 -8.162 17.490 596 HZ1 LYS 79 HZ1 LYS 79 1.447 -6.376 17.088 597 HZ2 LYS 79 HZ2 LYS 79 0.077 -5.774 17.841 598 HZ3 LYS 79 HZ3 LYS 79 0.320 -5.507 16.192 599 H SER 80 H SER 80 2.085 -5.867 11.468 600 HA SER 80 HA SER 80 1.133 -3.423 12.706 601 HB2 SER 80 HB2 SER 80 3.884 -4.490 12.215 602 HB3 SER 80 HB3 SER 80 3.570 -2.909 12.978 603 HG SER 80 HG SER 80 2.189 -4.267 14.406 604 H LEU 81 H LEU 81 1.027 -4.354 9.707 605 HA LEU 81 HA LEU 81 2.320 -2.282 8.327 606 HB2 LEU 81 HB2 LEU 81 1.858 -4.243 7.185 607 HB3 LEU 81 HB3 LEU 81 0.129 -4.194 7.496 608 HG LEU 81 HG LEU 81 1.571 -2.226 5.693 609 HD11 LEU 81 HD11 LEU 81 0.283 -4.866 4.994 610 HD12 LEU 81 HD12 LEU 81 2.008 -4.506 4.919 611 HD13 LEU 81 HD13 LEU 81 0.887 -3.684 3.837 612 HD21 LEU 81 HD21 LEU 81 -0.723 -1.615 6.411 613 HD22 LEU 81 HD22 LEU 81 -1.312 -3.157 5.790 614 HD23 LEU 81 HD23 LEU 81 -0.649 -1.957 4.683 615 HA PRO 82 HA PRO 82 -2.109 0.003 8.551 616 HB2 PRO 82 HB2 PRO 82 -2.657 -0.930 11.328 617 HB3 PRO 82 HB3 PRO 82 -3.791 -0.504 10.040 618 HG2 PRO 82 HG2 PRO 82 -3.373 -3.051 10.638 619 HG3 PRO 82 HG3 PRO 82 -3.506 -2.548 8.946 620 HD2 PRO 82 HD2 PRO 82 -1.060 -3.224 10.523 621 HD3 PRO 82 HD3 PRO 82 -1.453 -3.586 8.826 622 H GLY 83 H GLY 83 0.167 -0.745 11.072 623 HA2 GLY 83 HA2 GLY 83 0.079 1.641 12.555 624 HA3 GLY 83 HA3 GLY 83 1.446 0.531 12.473 625 H LEU 84 H LEU 84 1.913 0.708 9.666 626 HA LEU 84 HA LEU 84 3.407 3.130 9.649 627 HB2 LEU 84 HB2 LEU 84 4.307 2.501 7.517 628 HB3 LEU 84 HB3 LEU 84 4.177 1.037 8.455 629 HG LEU 84 HG LEU 84 1.904 0.824 7.130 630 HD11 LEU 84 HD11 LEU 84 2.042 2.922 5.931 631 HD12 LEU 84 HD12 LEU 84 2.117 1.586 4.794 632 HD13 LEU 84 HD13 LEU 84 3.587 2.454 5.226 633 HD21 LEU 84 HD21 LEU 84 4.603 0.135 5.955 634 HD22 LEU 84 HD22 LEU 84 3.064 -0.568 5.456 635 HD23 LEU 84 HD23 LEU 84 3.669 -0.846 7.085 636 H LEU 85 H LEU 85 0.439 2.059 8.152 637 HA LEU 85 HA LEU 85 -0.022 4.316 6.539 638 HB2 LEU 85 HB2 LEU 85 -2.039 2.493 7.855 639 HB3 LEU 85 HB3 LEU 85 -2.412 3.652 6.596 640 HG LEU 85 HG LEU 85 -0.605 1.252 6.266 641 HD11 LEU 85 HD11 LEU 85 -2.941 0.627 6.579 642 HD12 LEU 85 HD12 LEU 85 -2.419 0.340 4.918 643 HD13 LEU 85 HD13 LEU 85 -3.417 1.746 5.300 644 HD21 LEU 85 HD21 LEU 85 -0.728 1.790 3.878 645 HD22 LEU 85 HD22 LEU 85 0.014 3.104 4.789 646 HD23 LEU 85 HD23 LEU 85 -1.658 3.240 4.250 647 H THR 86 H THR 86 -0.621 3.678 9.861 648 HA THR 86 HA THR 86 -2.278 5.871 10.469 649 HB THR 86 HB THR 86 -0.268 4.530 12.317 650 HG1 THR 86 HG1 THR 86 -1.971 3.154 11.235 651 HG21 THR 86 HG21 THR 86 -1.144 6.644 13.217 652 HG22 THR 86 HG22 THR 86 -1.795 5.267 14.109 653 HG23 THR 86 HG23 THR 86 -2.792 6.095 12.914 654 H ILE 87 H ILE 87 1.295 5.574 10.644 655 HA ILE 87 HA ILE 87 1.592 8.252 11.497 656 HB ILE 87 HB ILE 87 3.261 6.614 12.160 657 HG12 ILE 87 HG12 ILE 87 4.028 9.012 11.885 658 HG13 ILE 87 HG13 ILE 87 5.303 7.810 11.929 659 HG21 ILE 87 HG21 ILE 87 4.057 6.311 9.301 660 HG22 ILE 87 HG22 ILE 87 3.239 5.131 10.316 661 HG23 ILE 87 HG23 ILE 87 4.900 5.607 10.683 662 HD11 ILE 87 HD11 ILE 87 4.237 9.166 9.455 663 HD12 ILE 87 HD12 ILE 87 5.563 8.010 9.501 664 HD13 ILE 87 HD13 ILE 87 5.737 9.586 10.282 665 H LEU 88 H LEU 88 1.822 6.781 8.282 666 HA LEU 88 HA LEU 88 2.614 9.228 7.094 667 HB2 LEU 88 HB2 LEU 88 1.400 6.797 5.853 668 HB3 LEU 88 HB3 LEU 88 1.697 8.238 4.918 669 HG LEU 88 HG LEU 88 3.501 6.923 4.425 670 HD11 LEU 88 HD11 LEU 88 5.490 7.861 5.398 671 HD12 LEU 88 HD12 LEU 88 4.536 8.573 6.691 672 HD13 LEU 88 HD13 LEU 88 4.288 9.097 5.023 673 HD21 LEU 88 HD21 LEU 88 3.089 5.154 6.004 674 HD22 LEU 88 HD22 LEU 88 3.746 6.139 7.306 675 HD23 LEU 88 HD23 LEU 88 4.791 5.593 5.982 676 H HIS 89 H HIS 89 -0.538 7.924 7.769 677 HA HIS 89 HA HIS 89 -2.024 9.870 6.364 678 HB2 HIS 89 HB2 HIS 89 -3.021 7.787 7.293 679 HB3 HIS 89 HB3 HIS 89 -2.754 8.390 8.917 680 HD1 HIS 89 HD1 HIS 89 -4.595 9.859 9.899 681 HD2 HIS 89 HD2 HIS 89 -5.034 9.203 5.821 682 HE1 HIS 89 HE1 HIS 89 -6.871 10.746 9.288 683 H ASP 90 H ASP 90 -0.525 9.815 9.521 684 HA ASP 90 HA ASP 90 -1.566 12.284 10.511 685 HB2 ASP 90 HB2 ASP 90 -0.647 10.551 11.998 686 HB3 ASP 90 HB3 ASP 90 0.936 10.741 11.265 687 H GLY 91 H GLY 91 1.163 11.350 8.587 688 HA2 GLY 91 HA2 GLY 91 2.382 13.989 8.669 689 HA3 GLY 91 HA3 GLY 91 2.994 12.585 7.807 690 H GLY 92 H GLY 92 -0.026 12.539 6.853 691 HA2 GLY 92 HA2 GLY 92 -1.302 13.513 5.174 692 HA3 GLY 92 HA3 GLY 92 -0.143 14.831 5.101 693 H TYR 93 H TYR 93 0.184 11.320 4.557 694 HA TYR 93 HA TYR 93 1.123 12.019 1.870 695 HB2 TYR 93 HB2 TYR 93 2.035 9.783 3.664 696 HB3 TYR 93 HB3 TYR 93 2.417 9.847 1.945 697 HD1 TYR 93 HD1 TYR 93 3.884 11.595 1.072 698 HD2 TYR 93 HD2 TYR 93 3.126 11.230 5.235 699 HE1 TYR 93 HE1 TYR 93 5.812 13.033 1.539 700 HE2 TYR 93 HE2 TYR 93 5.041 12.671 5.718 701 HH TYR 93 HH TYR 93 7.233 13.283 4.496 702 H ARG 94 H ARG 94 0.388 11.000 0.165 703 HA ARG 94 HA ARG 94 -2.051 9.467 0.445 704 HB2 ARG 94 HB2 ARG 94 -2.221 9.635 -1.985 705 HB3 ARG 94 HB3 ARG 94 -1.935 11.218 -1.283 706 HG2 ARG 94 HG2 ARG 94 0.400 11.098 -1.921 707 HG3 ARG 94 HG3 ARG 94 0.149 9.482 -2.578 708 HD2 ARG 94 HD2 ARG 94 -1.439 10.401 -4.204 709 HD3 ARG 94 HD3 ARG 94 -1.158 12.019 -3.557 710 HE ARG 94 HE ARG 94 1.297 11.397 -4.169 711 HH11 ARG 94 HH11 ARG 94 -1.621 10.802 -6.117 712 HH12 ARG 94 HH12 ARG 94 -0.810 10.782 -7.601 713 HH21 ARG 94 HH21 ARG 94 2.438 11.337 -6.219 714 HH22 ARG 94 HH22 ARG 94 1.562 11.113 -7.648 715 H ASP 95 H ASP 95 -2.307 7.604 -1.148 716 HA ASP 95 HA ASP 95 -0.915 5.391 -0.229 717 HB2 ASP 95 HB2 ASP 95 -2.137 4.157 -1.931 718 HB3 ASP 95 HB3 ASP 95 -3.190 5.371 -1.218 719 H THR 96 H THR 96 -0.577 7.185 -3.181 720 HA THR 96 HA THR 96 1.226 5.583 -4.544 721 HB THR 96 HB THR 96 1.038 8.597 -4.694 722 HG1 THR 96 HG1 THR 96 -0.921 6.838 -5.002 723 HG21 THR 96 HG21 THR 96 1.670 8.255 -7.028 724 HG22 THR 96 HG22 THR 96 1.672 6.503 -6.779 725 HG23 THR 96 HG23 THR 96 2.860 7.497 -5.954 726 H GLU 97 H GLU 97 1.738 8.217 -2.246 727 HA GLU 97 HA GLU 97 4.548 8.266 -2.550 728 HB2 GLU 97 HB2 GLU 97 2.868 9.280 -0.259 729 HB3 GLU 97 HB3 GLU 97 4.586 9.586 -0.459 730 HG2 GLU 97 HG2 GLU 97 2.352 10.521 -2.232 731 HG3 GLU 97 HG3 GLU 97 3.378 11.509 -1.193 732 H ILE 98 H ILE 98 2.351 6.498 -0.476 733 HA ILE 98 HA ILE 98 4.172 5.586 1.489 734 HB ILE 98 HB ILE 98 1.935 3.886 0.382 735 HG12 ILE 98 HG12 ILE 98 0.859 6.020 0.781 736 HG13 ILE 98 HG13 ILE 98 0.426 4.889 2.066 737 HG21 ILE 98 HG21 ILE 98 3.097 4.089 3.142 738 HG22 ILE 98 HG22 ILE 98 3.355 2.793 1.977 739 HG23 ILE 98 HG23 ILE 98 1.752 3.051 2.669 740 HD11 ILE 98 HD11 ILE 98 0.832 7.132 2.882 741 HD12 ILE 98 HD12 ILE 98 2.489 7.048 2.278 742 HD13 ILE 98 HD13 ILE 98 1.950 5.948 3.557 743 H MET 99 H MET 99 3.044 4.197 -1.524 744 HA MET 99 HA MET 99 4.733 1.936 -1.281 745 HB2 MET 99 HB2 MET 99 3.062 2.828 -3.620 746 HB3 MET 99 HB3 MET 99 3.861 1.263 -3.466 747 HG2 MET 99 HG2 MET 99 2.569 0.824 -1.432 748 HG3 MET 99 HG3 MET 99 1.734 2.358 -1.656 749 HE1 MET 99 HE1 MET 99 0.142 -0.193 -1.173 750 HE2 MET 99 HE2 MET 99 -1.095 -0.085 -2.424 751 HE3 MET 99 HE3 MET 99 -0.587 1.365 -1.556 752 H ARG 100 H ARG 100 5.138 5.064 -2.546 753 HA ARG 100 HA ARG 100 6.943 4.671 -4.629 754 HB2 ARG 100 HB2 ARG 100 5.785 6.787 -3.974 755 HB3 ARG 100 HB3 ARG 100 6.883 6.919 -2.615 756 HG2 ARG 100 HG2 ARG 100 8.757 7.149 -4.143 757 HG3 ARG 100 HG3 ARG 100 7.657 6.983 -5.521 758 HD2 ARG 100 HD2 ARG 100 6.386 8.938 -4.619 759 HD3 ARG 100 HD3 ARG 100 7.668 9.150 -3.436 760 HE ARG 100 HE ARG 100 9.000 9.144 -5.785 761 HH11 ARG 100 HH11 ARG 100 6.294 11.085 -4.498 762 HH12 ARG 100 HH12 ARG 100 6.551 12.352 -5.608 763 HH21 ARG 100 HH21 ARG 100 9.336 10.931 -7.235 764 HH22 ARG 100 HH22 ARG 100 8.286 12.285 -7.159 765 H TRP 101 H TRP 101 7.704 5.546 -1.254 766 HA TRP 101 HA TRP 101 10.402 4.772 -1.618 767 HB2 TRP 101 HB2 TRP 101 10.539 5.021 0.967 768 HB3 TRP 101 HB3 TRP 101 10.287 6.452 -0.019 769 HD1 TRP 101 HD1 TRP 101 8.117 7.809 0.371 770 HE1 TRP 101 HE1 TRP 101 6.195 7.648 2.045 771 HE3 TRP 101 HE3 TRP 101 9.120 3.194 2.313 772 HZ2 TRP 101 HZ2 TRP 101 5.223 5.817 3.945 773 HZ3 TRP 101 HZ3 TRP 101 7.647 2.310 4.039 774 HH2 TRP 101 HH2 TRP 101 5.735 3.593 4.859 775 H LEU 102 H LEU 102 7.632 3.038 -0.452 776 HA LEU 102 HA LEU 102 8.911 0.922 0.851 777 HB2 LEU 102 HB2 LEU 102 6.337 1.296 -0.495 778 HB3 LEU 102 HB3 LEU 102 6.780 -0.365 -0.148 779 HG LEU 102 HG LEU 102 6.417 1.880 1.854 780 HD11 LEU 102 HD11 LEU 102 4.705 -0.523 1.213 781 HD12 LEU 102 HD12 LEU 102 4.322 1.152 0.810 782 HD13 LEU 102 HD13 LEU 102 4.408 0.650 2.495 783 HD21 LEU 102 HD21 LEU 102 8.018 0.302 2.691 784 HD22 LEU 102 HD22 LEU 102 6.995 -1.055 2.193 785 HD23 LEU 102 HD23 LEU 102 6.475 0.020 3.488 786 H PHE 103 H PHE 103 8.170 1.308 -2.602 787 HA PHE 103 HA PHE 103 9.225 -1.322 -3.124 788 HB2 PHE 103 HB2 PHE 103 7.991 0.774 -4.889 789 HB3 PHE 103 HB3 PHE 103 8.776 -0.646 -5.567 790 HD1 PHE 103 HD1 PHE 103 6.133 0.275 -3.061 791 HD2 PHE 103 HD2 PHE 103 7.530 -2.542 -5.933 792 HE1 PHE 103 HE1 PHE 103 4.070 -1.014 -2.793 793 HE2 PHE 103 HE2 PHE 103 5.457 -3.838 -5.656 794 HZ PHE 103 HZ PHE 103 3.730 -3.075 -4.086 795 H THR 104 H THR 104 10.531 1.716 -2.824 796 HA THR 104 HA THR 104 12.648 1.265 -4.735 797 HB THR 104 HB THR 104 12.235 3.536 -2.765 798 HG1 THR 104 HG1 THR 104 10.600 3.649 -4.250 799 HG21 THR 104 HG21 THR 104 14.047 3.317 -5.189 800 HG22 THR 104 HG22 THR 104 14.584 3.295 -3.507 801 HG23 THR 104 HG23 THR 104 13.843 4.748 -4.179 802 HA PRO 105 HA PRO 105 15.027 -1.072 -1.676 803 HB2 PRO 105 HB2 PRO 105 17.180 -0.274 -3.584 804 HB3 PRO 105 HB3 PRO 105 16.821 -1.864 -2.908 805 HG2 PRO 105 HG2 PRO 105 16.160 -1.313 -5.416 806 HG3 PRO 105 HG3 PRO 105 15.056 -2.238 -4.383 807 HD2 PRO 105 HD2 PRO 105 14.908 0.626 -5.218 808 HD3 PRO 105 HD3 PRO 105 13.607 -0.564 -5.000 809 H ASP 106 H ASP 106 15.990 -0.339 0.088 810 HA ASP 106 HA ASP 106 16.587 2.497 0.175 811 HB2 ASP 106 HB2 ASP 106 15.094 1.529 1.877 812 HB3 ASP 106 HB3 ASP 106 16.411 0.511 2.430 813 HA PRO 107 HA PRO 107 20.956 1.718 -0.241 814 HB2 PRO 107 HB2 PRO 107 21.763 4.231 0.522 815 HB3 PRO 107 HB3 PRO 107 21.201 3.813 -1.099 816 HG2 PRO 107 HG2 PRO 107 19.706 5.082 1.158 817 HG3 PRO 107 HG3 PRO 107 19.678 5.482 -0.568 818 HD2 PRO 107 HD2 PRO 107 17.724 4.079 0.578 819 HD3 PRO 107 HD3 PRO 107 18.257 3.729 -1.081 820 H SER 108 H SER 108 19.410 2.504 2.771 821 HA SER 108 HA SER 108 21.934 1.970 4.154 822 HB2 SER 108 HB2 SER 108 21.103 4.300 4.431 823 HB3 SER 108 HB3 SER 108 19.588 3.667 5.066 824 HG SER 108 HG SER 108 21.910 2.791 6.292 825 H LEU 109 H LEU 109 19.360 0.340 3.195 826 HA LEU 109 HA LEU 109 18.659 -0.715 5.826 827 HB2 LEU 109 HB2 LEU 109 16.839 0.019 4.377 828 HB3 LEU 109 HB3 LEU 109 17.347 -1.142 3.162 829 HG LEU 109 HG LEU 109 16.810 -2.965 4.753 830 HD11 LEU 109 HD11 LEU 109 15.431 -2.461 6.714 831 HD12 LEU 109 HD12 LEU 109 15.675 -0.736 6.435 832 HD13 LEU 109 HD13 LEU 109 17.047 -1.769 6.847 833 HD21 LEU 109 HD21 LEU 109 14.379 -2.764 4.532 834 HD22 LEU 109 HD22 LEU 109 15.215 -2.304 3.048 835 HD23 LEU 109 HD23 LEU 109 14.565 -1.059 4.119 836 H THR 110 H THR 110 19.271 -2.593 6.468 837 HA THR 110 HA THR 110 20.232 -4.609 4.563 838 HB THR 110 HB THR 110 21.155 -4.345 7.441 839 HG1 THR 110 HG1 THR 110 22.085 -3.057 5.108 840 HG21 THR 110 HG21 THR 110 21.531 -6.495 6.297 841 HG22 THR 110 HG22 THR 110 23.056 -5.675 6.643 842 HG23 THR 110 HG23 THR 110 22.393 -5.652 5.009 843 H ILE 111 H ILE 111 18.856 -6.331 4.669 844 HA ILE 111 HA ILE 111 17.474 -6.905 7.197 845 HB ILE 111 HB ILE 111 15.496 -7.668 5.902 846 HG12 ILE 111 HG12 ILE 111 16.674 -6.024 3.666 847 HG13 ILE 111 HG13 ILE 111 16.627 -7.782 3.684 848 HG21 ILE 111 HG21 ILE 111 14.533 -5.435 5.631 849 HG22 ILE 111 HG22 ILE 111 16.149 -4.741 5.876 850 HG23 ILE 111 HG23 ILE 111 15.379 -5.705 7.150 851 HD11 ILE 111 HD11 ILE 111 14.260 -5.926 3.670 852 HD12 ILE 111 HD12 ILE 111 14.179 -7.687 3.742 853 HD13 ILE 111 HD13 ILE 111 14.854 -6.896 2.321 854 H THR 112 H THR 112 16.560 -9.043 7.264 855 HA THR 112 HA THR 112 18.408 -10.926 6.035 856 HB THR 112 HB THR 112 17.848 -11.135 8.468 857 HG1 THR 112 HG1 THR 112 18.534 -13.013 7.559 858 HG21 THR 112 HG21 THR 112 15.641 -11.976 9.159 859 HG22 THR 112 HG22 THR 112 15.098 -11.921 7.473 860 HG23 THR 112 HG23 THR 112 15.497 -10.427 8.312 861 H ARG 113 H ARG 113 17.441 -12.917 5.015 862 HA ARG 113 HA ARG 113 15.044 -12.213 3.461 863 HB2 ARG 113 HB2 ARG 113 17.169 -11.712 2.287 864 HB3 ARG 113 HB3 ARG 113 17.621 -13.392 2.431 865 HG2 ARG 113 HG2 ARG 113 16.905 -12.896 0.199 866 HG3 ARG 113 HG3 ARG 113 15.763 -13.997 0.964 867 HD2 ARG 113 HD2 ARG 113 15.214 -11.062 1.041 868 HD3 ARG 113 HD3 ARG 113 14.938 -11.928 -0.464 869 HE ARG 113 HE ARG 113 13.535 -12.320 2.079 870 HH11 ARG 113 HH11 ARG 113 13.746 -12.849 -1.420 871 HH12 ARG 113 HH12 ARG 113 12.234 -13.611 -1.548 872 HH21 ARG 113 HH21 ARG 113 11.434 -13.484 1.882 873 HH22 ARG 113 HH22 ARG 113 10.918 -13.978 0.352 874 H ASP 114 H ASP 114 14.145 -14.225 2.305 875 HA ASP 114 HA ASP 114 14.000 -16.427 4.208 876 HB2 ASP 114 HB2 ASP 114 12.434 -15.776 1.715 877 HB3 ASP 114 HB3 ASP 114 12.241 -17.285 2.590 878 H GLY 115 H GLY 115 14.635 -18.475 3.816 879 HA2 GLY 115 HA2 GLY 115 15.581 -20.282 2.734 880 HA3 GLY 115 HA3 GLY 115 15.589 -19.346 1.237 881 H SER 116 H SER 116 17.011 -17.573 1.205 882 HA SER 116 HA SER 116 19.608 -18.246 2.252 883 HB2 SER 116 HB2 SER 116 20.214 -16.205 0.723 884 HB3 SER 116 HB3 SER 116 19.758 -17.725 -0.046 885 HG SER 116 HG SER 116 18.569 -15.311 -0.123 886 H ARG 117 H ARG 117 19.049 -17.859 4.318 887 HA ARG 117 HA ARG 117 17.806 -15.537 5.357 888 HB2 ARG 117 HB2 ARG 117 18.186 -16.437 7.527 889 HB3 ARG 117 HB3 ARG 117 17.618 -17.686 6.433 890 HG2 ARG 117 HG2 ARG 117 20.498 -17.360 7.328 891 HG3 ARG 117 HG3 ARG 117 19.342 -18.416 8.120 892 HD2 ARG 117 HD2 ARG 117 20.522 -19.888 6.742 893 HD3 ARG 117 HD3 ARG 117 19.115 -19.494 5.765 894 HE ARG 117 HE ARG 117 21.213 -17.727 5.127 895 HH11 ARG 117 HH11 ARG 117 20.302 -21.120 4.674 896 HH12 ARG 117 HH12 ARG 117 21.236 -21.322 3.274 897 HH21 ARG 117 HH21 ARG 117 22.446 -18.013 3.148 898 HH22 ARG 117 HH22 ARG 117 22.484 -19.569 2.434 899 H ASP 118 H ASP 118 20.386 -15.232 3.990 900 HA ASP 118 HA ASP 118 22.264 -14.219 5.932 901 HB2 ASP 118 HB2 ASP 118 22.255 -13.890 2.922 902 HB3 ASP 118 HB3 ASP 118 23.606 -13.558 3.995 903 H ALA 119 H ALA 119 23.178 -11.913 5.280 904 HA ALA 119 HA ALA 119 20.931 -10.120 5.653 905 HB1 ALA 119 HB1 ALA 119 22.632 -8.454 6.230 906 HB2 ALA 119 HB2 ALA 119 23.904 -9.594 5.793 907 HB3 ALA 119 HB3 ALA 119 22.852 -9.931 7.167 908 H VAL 120 H VAL 120 20.135 -8.968 4.088 909 HA VAL 120 HA VAL 120 21.619 -8.758 1.571 910 HB VAL 120 HB VAL 120 18.644 -8.437 2.083 911 HG11 VAL 120 HG11 VAL 120 19.409 -7.063 0.210 912 HG12 VAL 120 HG12 VAL 120 18.416 -8.404 -0.361 913 HG13 VAL 120 HG13 VAL 120 20.172 -8.477 -0.517 914 HG21 VAL 120 HG21 VAL 120 19.360 -10.753 2.325 915 HG22 VAL 120 HG22 VAL 120 20.167 -10.680 0.757 916 HG23 VAL 120 HG23 VAL 120 18.413 -10.550 0.850 917 H SER 121 H SER 121 22.532 -6.868 1.216 918 HA SER 121 HA SER 121 21.674 -4.501 2.631 919 HB2 SER 121 HB2 SER 121 23.968 -5.001 0.730 920 HB3 SER 121 HB3 SER 121 23.751 -3.557 1.709 921 HG SER 121 HG SER 121 24.153 -4.692 3.526 922 H ASN 122 H ASN 122 20.800 -2.748 1.678 923 HA ASN 122 HA ASN 122 19.500 -1.588 0.336 924 HB2 ASN 122 HB2 ASN 122 21.532 -1.106 -0.939 925 HB3 ASN 122 HB3 ASN 122 21.360 -2.596 -1.848 926 HD21 ASN 122 HD21 ASN 122 20.011 0.590 -1.335 927 HD22 ASN 122 HD22 ASN 122 19.226 0.712 -2.868 928 H ALA 123 H ALA 123 18.030 -3.147 1.085 929 HA ALA 123 HA ALA 123 16.816 -4.569 -1.163 930 HB1 ALA 123 HB1 ALA 123 16.450 -5.061 1.781 931 HB2 ALA 123 HB2 ALA 123 17.462 -6.019 0.698 932 HB3 ALA 123 HB3 ALA 123 15.712 -5.986 0.471 933 H ARG 124 H ARG 124 14.319 -4.824 -0.516 934 HA ARG 124 HA ARG 124 13.336 -2.093 -0.716 935 HB2 ARG 124 HB2 ARG 124 11.853 -4.728 -0.948 936 HB3 ARG 124 HB3 ARG 124 11.145 -3.156 -1.227 937 HG2 ARG 124 HG2 ARG 124 11.529 -4.187 -3.343 938 HG3 ARG 124 HG3 ARG 124 12.705 -2.890 -3.171 939 HD2 ARG 124 HD2 ARG 124 13.823 -4.847 -4.090 940 HD3 ARG 124 HD3 ARG 124 14.332 -4.511 -2.422 941 HE ARG 124 HE ARG 124 12.302 -6.369 -2.262 942 HH11 ARG 124 HH11 ARG 124 15.583 -6.210 -3.605 943 HH12 ARG 124 HH12 ARG 124 15.940 -7.850 -3.380 944 HH21 ARG 124 HH21 ARG 124 12.868 -8.718 -1.821 945 HH22 ARG 124 HH22 ARG 124 14.361 -9.278 -2.356 946 HA PRO 125 HA PRO 125 11.864 -2.058 3.571 947 HB2 PRO 125 HB2 PRO 125 9.800 -0.351 2.255 948 HB3 PRO 125 HB3 PRO 125 10.692 -0.038 3.754 949 HG2 PRO 125 HG2 PRO 125 11.360 1.256 1.551 950 HG3 PRO 125 HG3 PRO 125 12.629 0.597 2.599 951 HD2 PRO 125 HD2 PRO 125 11.590 -0.443 -0.005 952 HD3 PRO 125 HD3 PRO 125 13.257 -0.412 0.617 953 H VAL 126 H VAL 126 9.882 -2.522 0.690 954 HA VAL 126 HA VAL 126 7.661 -3.807 1.836 955 HB VAL 126 HB VAL 126 8.914 -4.211 -0.902 956 HG11 VAL 126 HG11 VAL 126 6.228 -5.082 0.117 957 HG12 VAL 126 HG12 VAL 126 7.577 -6.161 -0.253 958 HG13 VAL 126 HG13 VAL 126 6.796 -5.236 -1.543 959 HG21 VAL 126 HG21 VAL 126 6.517 -2.649 0.005 960 HG22 VAL 126 HG22 VAL 126 7.050 -2.849 -1.670 961 HG23 VAL 126 HG23 VAL 126 8.078 -2.005 -0.509 962 H ASP 127 H ASP 127 10.765 -5.111 0.701 963 HA ASP 127 HA ASP 127 10.065 -7.803 1.231 964 HB2 ASP 127 HB2 ASP 127 12.013 -6.887 -0.211 965 HB3 ASP 127 HB3 ASP 127 12.886 -6.743 1.309 966 H ALA 128 H ALA 128 11.469 -5.242 3.082 967 HA ALA 128 HA ALA 128 12.360 -6.632 5.354 968 HB1 ALA 128 HB1 ALA 128 12.472 -4.489 6.442 969 HB2 ALA 128 HB2 ALA 128 11.380 -3.795 5.250 970 HB3 ALA 128 HB3 ALA 128 12.989 -4.313 4.759 971 H LEU 129 H LEU 129 9.177 -5.293 4.600 972 HA LEU 129 HA LEU 129 8.191 -5.701 7.245 973 HB2 LEU 129 HB2 LEU 129 5.963 -5.209 6.342 974 HB3 LEU 129 HB3 LEU 129 7.142 -4.013 5.864 975 HG LEU 129 HG LEU 129 7.268 -5.507 3.720 976 HD11 LEU 129 HD11 LEU 129 4.467 -6.002 4.643 977 HD12 LEU 129 HD12 LEU 129 5.764 -7.189 4.604 978 HD13 LEU 129 HD13 LEU 129 5.156 -6.500 3.086 979 HD21 LEU 129 HD21 LEU 129 5.034 -3.553 4.275 980 HD22 LEU 129 HD22 LEU 129 5.569 -4.048 2.670 981 HD23 LEU 129 HD23 LEU 129 6.660 -3.151 3.729 982 H HIS 130 H HIS 130 8.308 -7.696 4.414 983 HA HIS 130 HA HIS 130 6.661 -9.797 5.432 984 HB2 HIS 130 HB2 HIS 130 8.796 -9.723 3.317 985 HB3 HIS 130 HB3 HIS 130 7.912 -11.185 3.721 986 HD1 HIS 130 HD1 HIS 130 7.769 -8.232 1.587 987 HD2 HIS 130 HD2 HIS 130 5.081 -10.918 3.233 988 HE1 HIS 130 HE1 HIS 130 5.718 -8.126 0.154 989 H ALA 131 H ALA 131 9.829 -8.764 5.858 990 HA ALA 131 HA ALA 131 10.807 -11.261 6.990 991 HB1 ALA 131 HB1 ALA 131 12.125 -8.545 6.924 992 HB2 ALA 131 HB2 ALA 131 12.320 -9.801 5.705 993 HB3 ALA 131 HB3 ALA 131 12.906 -10.069 7.348 994 H HIS 132 H HIS 132 8.779 -9.007 8.040 995 HA HIS 132 HA HIS 132 7.949 -8.259 9.969 996 HB2 HIS 132 HB2 HIS 132 9.483 -10.601 11.159 997 HB3 HIS 132 HB3 HIS 132 8.312 -9.635 12.051 998 HD1 HIS 132 HD1 HIS 132 8.560 -12.472 9.686 999 HD2 HIS 132 HD2 HIS 132 5.608 -9.921 11.115 1000 HE1 HIS 132 HE1 HIS 132 6.364 -13.523 9.054 1001 H GLN 133 H GLN 133 10.373 -7.304 8.914 1002 HA GLN 133 HA GLN 133 11.643 -6.118 11.248 1003 HB2 GLN 133 HB2 GLN 133 12.500 -6.065 8.333 1004 HB3 GLN 133 HB3 GLN 133 13.382 -5.334 9.667 1005 HG2 GLN 133 HG2 GLN 133 13.488 -7.693 10.656 1006 HG3 GLN 133 HG3 GLN 133 12.975 -8.253 9.068 1007 HE21 GLN 133 HE21 GLN 133 15.128 -5.568 9.738 1008 HE22 GLN 133 HE22 GLN 133 16.536 -6.257 9.031 1009 H ALA 134 H ALA 134 9.030 -5.676 10.265 1010 HA ALA 134 HA ALA 134 8.556 -3.431 8.745 1011 HB1 ALA 134 HB1 ALA 134 6.822 -5.020 9.476 1012 HB2 ALA 134 HB2 ALA 134 6.370 -3.340 9.760 1013 HB3 ALA 134 HB3 ALA 134 6.920 -4.342 11.101 1014 H ARG 135 H ARG 135 9.624 -3.577 12.074 1015 HA ARG 135 HA ARG 135 8.971 -1.005 12.929 1016 HB2 ARG 135 HB2 ARG 135 11.446 -2.584 13.569 1017 HB3 ARG 135 HB3 ARG 135 10.916 -1.151 14.428 1018 HG2 ARG 135 HG2 ARG 135 8.816 -2.361 15.006 1019 HG3 ARG 135 HG3 ARG 135 9.537 -3.807 14.294 1020 HD2 ARG 135 HD2 ARG 135 9.888 -3.792 16.671 1021 HD3 ARG 135 HD3 ARG 135 11.428 -3.594 15.805 1022 HE ARG 135 HE ARG 135 9.945 -1.377 17.049 1023 HH11 ARG 135 HH11 ARG 135 13.047 -3.007 16.423 1024 HH12 ARG 135 HH12 ARG 135 13.972 -1.784 17.166 1025 HH21 ARG 135 HH21 ARG 135 11.276 0.261 18.105 1026 HH22 ARG 135 HH22 ARG 135 12.957 0.071 18.146 1027 H GLU 136 H GLU 136 11.770 -2.163 11.086 1028 HA GLU 136 HA GLU 136 13.097 0.285 10.858 1029 HB2 GLU 136 HB2 GLU 136 13.176 -2.145 9.045 1030 HB3 GLU 136 HB3 GLU 136 14.260 -0.775 8.899 1031 HG2 GLU 136 HG2 GLU 136 15.528 -2.365 10.027 1032 HG3 GLU 136 HG3 GLU 136 14.960 -1.301 11.302 1033 H VAL 137 H VAL 137 10.544 -1.189 9.051 1034 HA VAL 137 HA VAL 137 10.515 0.616 6.852 1035 HB VAL 137 HB VAL 137 8.228 -1.037 7.977 1036 HG11 VAL 137 HG11 VAL 137 8.573 0.182 5.238 1037 HG12 VAL 137 HG12 VAL 137 7.447 0.719 6.482 1038 HG13 VAL 137 HG13 VAL 137 7.249 -0.870 5.740 1039 HG21 VAL 137 HG21 VAL 137 10.139 -2.434 7.413 1040 HG22 VAL 137 HG22 VAL 137 10.208 -1.712 5.808 1041 HG23 VAL 137 HG23 VAL 137 8.820 -2.696 6.268 1042 H VAL 138 H VAL 138 8.722 0.419 9.895 1043 HA VAL 138 HA VAL 138 7.210 2.766 9.600 1044 HB VAL 138 HB VAL 138 8.225 1.539 12.195 1045 HG11 VAL 138 HG11 VAL 138 5.934 3.457 11.727 1046 HG12 VAL 138 HG12 VAL 138 7.461 3.839 12.525 1047 HG13 VAL 138 HG13 VAL 138 6.338 2.699 13.268 1048 HG21 VAL 138 HG21 VAL 138 6.909 -0.051 10.889 1049 HG22 VAL 138 HG22 VAL 138 5.609 1.131 10.741 1050 HG23 VAL 138 HG23 VAL 138 6.017 0.460 12.322 1051 H ARG 139 H ARG 139 10.402 2.215 10.985 1052 HA ARG 139 HA ARG 139 10.996 4.815 11.785 1053 HB2 ARG 139 HB2 ARG 139 12.389 2.913 12.391 1054 HB3 ARG 139 HB3 ARG 139 12.818 2.659 10.709 1055 HG2 ARG 139 HG2 ARG 139 13.999 4.801 10.682 1056 HG3 ARG 139 HG3 ARG 139 13.571 5.055 12.374 1057 HD2 ARG 139 HD2 ARG 139 14.845 3.126 13.040 1058 HD3 ARG 139 HD3 ARG 139 15.162 2.706 11.358 1059 HE ARG 139 HE ARG 139 16.053 5.325 11.985 1060 HH11 ARG 139 HH11 ARG 139 16.981 1.942 12.440 1061 HH12 ARG 139 HH12 ARG 139 18.656 2.272 12.358 1062 HH21 ARG 139 HH21 ARG 139 18.351 5.742 11.902 1063 HH22 ARG 139 HH22 ARG 139 19.434 4.423 12.043 1064 H ARG 140 H ARG 140 11.446 3.263 8.614 1065 HA ARG 140 HA ARG 140 12.544 5.553 7.355 1066 HB2 ARG 140 HB2 ARG 140 11.109 3.184 6.167 1067 HB3 ARG 140 HB3 ARG 140 11.782 4.479 5.197 1068 HG2 ARG 140 HG2 ARG 140 13.290 2.586 6.980 1069 HG3 ARG 140 HG3 ARG 140 13.285 2.616 5.216 1070 HD2 ARG 140 HD2 ARG 140 14.190 4.987 5.396 1071 HD3 ARG 140 HD3 ARG 140 14.464 4.647 7.104 1072 HE ARG 140 HE ARG 140 15.777 3.445 4.813 1073 HH11 ARG 140 HH11 ARG 140 15.669 3.871 8.326 1074 HH12 ARG 140 HH12 ARG 140 17.082 2.953 8.611 1075 HH21 ARG 140 HH21 ARG 140 17.701 2.312 5.195 1076 HH22 ARG 140 HH22 ARG 140 18.303 2.048 6.783 1077 H ALA 141 H ALA 141 9.251 4.420 7.726 1078 HA ALA 141 HA ALA 141 7.946 6.283 6.119 1079 HB1 ALA 141 HB1 ALA 141 6.003 5.866 7.572 1080 HB2 ALA 141 HB2 ALA 141 7.054 4.993 8.695 1081 HB3 ALA 141 HB3 ALA 141 6.800 4.383 7.058 1082 H GLN 142 H GLN 142 8.844 6.444 9.522 1083 HA GLN 142 HA GLN 142 7.894 9.033 10.080 1084 HB2 GLN 142 HB2 GLN 142 10.220 7.525 11.275 1085 HB3 GLN 142 HB3 GLN 142 9.511 8.979 11.962 1086 HG2 GLN 142 HG2 GLN 142 7.445 7.843 12.372 1087 HG3 GLN 142 HG3 GLN 142 8.019 6.407 11.525 1088 HE21 GLN 142 HE21 GLN 142 7.084 6.719 14.249 1089 HE22 GLN 142 HE22 GLN 142 8.355 6.160 15.266 1090 H ALA 143 H ALA 143 10.989 7.852 8.926 1091 HA ALA 143 HA ALA 143 12.305 10.356 8.882 1092 HB1 ALA 143 HB1 ALA 143 14.083 9.212 7.734 1093 HB2 ALA 143 HB2 ALA 143 13.015 7.865 7.351 1094 HB3 ALA 143 HB3 ALA 143 13.468 8.178 9.027 1095 H MET 144 H MET 144 10.160 8.861 6.677 1096 HA MET 144 HA MET 144 10.907 10.649 4.509 1097 HB2 MET 144 HB2 MET 144 8.623 8.676 4.723 1098 HB3 MET 144 HB3 MET 144 8.947 9.655 3.302 1099 HG2 MET 144 HG2 MET 144 10.716 7.515 4.467 1100 HG3 MET 144 HG3 MET 144 9.780 7.418 2.983 1101 HE1 MET 144 HE1 MET 144 11.644 10.070 0.715 1102 HE2 MET 144 HE2 MET 144 10.306 10.422 1.809 1103 HE3 MET 144 HE3 MET 144 10.281 8.958 0.825 1104 H ALA 145 H ALA 145 8.775 10.552 7.150 1105 HA ALA 145 HA ALA 145 7.038 12.590 6.113 1106 HB1 ALA 145 HB1 ALA 145 6.139 10.904 7.667 1107 HB2 ALA 145 HB2 ALA 145 5.983 12.529 8.334 1108 HB3 ALA 145 HB3 ALA 145 7.258 11.460 8.911 1109 H TYR 146 H TYR 146 9.293 12.386 8.856 1110 HA TYR 146 HA TYR 146 9.837 15.214 8.446 1111 HB2 TYR 146 HB2 TYR 146 9.466 13.784 11.090 1112 HB3 TYR 146 HB3 TYR 146 10.129 15.408 10.929 1113 HD1 TYR 146 HD1 TYR 146 8.719 17.265 10.237 1114 HD2 TYR 146 HD2 TYR 146 7.100 13.370 10.762 1115 HE1 TYR 146 HE1 TYR 146 6.457 18.208 10.198 1116 HE2 TYR 146 HE2 TYR 146 4.832 14.301 10.729 1117 HH TYR 146 HH TYR 146 3.708 16.386 11.086 Start of MODEL 19 1 H MET 1 H MET 1 -1.248 -20.015 -0.615 2 HA MET 1 HA MET 1 1.021 -19.733 -1.095 3 HB2 MET 1 HB2 MET 1 0.682 -22.339 -2.604 4 HB3 MET 1 HB3 MET 1 2.043 -21.255 -2.849 5 HG2 MET 1 HG2 MET 1 1.313 -22.601 -0.260 6 HG3 MET 1 HG3 MET 1 2.548 -23.147 -1.388 7 HE1 MET 1 HE1 MET 1 5.285 -20.389 -1.129 8 HE2 MET 1 HE2 MET 1 4.038 -20.583 -2.359 9 HE3 MET 1 HE3 MET 1 4.885 -21.996 -1.733 10 HA PRO 2 HA PRO 2 -0.634 -17.605 -4.641 11 HB2 PRO 2 HB2 PRO 2 1.645 -16.551 -5.651 12 HB3 PRO 2 HB3 PRO 2 0.887 -15.909 -4.188 13 HG2 PRO 2 HG2 PRO 2 3.218 -17.755 -4.479 14 HG3 PRO 2 HG3 PRO 2 2.999 -16.390 -3.369 15 HD2 PRO 2 HD2 PRO 2 2.666 -18.975 -2.612 16 HD3 PRO 2 HD3 PRO 2 1.759 -17.632 -1.887 17 H GLY 3 H GLY 3 -0.676 -17.781 -6.952 18 HA2 GLY 3 HA2 GLY 3 1.198 -19.301 -8.421 19 HA3 GLY 3 HA3 GLY 3 -0.203 -20.289 -8.026 20 H ARG 4 H ARG 4 -2.302 -18.927 -8.310 21 HA ARG 4 HA ARG 4 -2.577 -18.402 -11.092 22 HB2 ARG 4 HB2 ARG 4 -4.456 -17.764 -8.817 23 HB3 ARG 4 HB3 ARG 4 -4.855 -17.631 -10.516 24 HG2 ARG 4 HG2 ARG 4 -4.168 -20.162 -9.051 25 HG3 ARG 4 HG3 ARG 4 -5.779 -19.643 -9.512 26 HD2 ARG 4 HD2 ARG 4 -4.988 -19.665 -11.897 27 HD3 ARG 4 HD3 ARG 4 -3.510 -20.438 -11.318 28 HE ARG 4 HE ARG 4 -6.060 -21.634 -10.608 29 HH11 ARG 4 HH11 ARG 4 -3.095 -21.880 -12.520 30 HH12 ARG 4 HH12 ARG 4 -3.402 -23.484 -13.003 31 HH21 ARG 4 HH21 ARG 4 -6.482 -23.761 -11.287 32 HH22 ARG 4 HH22 ARG 4 -5.376 -24.577 -12.307 33 H ALA 5 H ALA 5 -2.863 -16.488 -12.145 34 HA ALA 5 HA ALA 5 -1.755 -14.147 -10.881 35 HB1 ALA 5 HB1 ALA 5 -2.017 -13.130 -13.117 36 HB2 ALA 5 HB2 ALA 5 -2.856 -14.581 -13.669 37 HB3 ALA 5 HB3 ALA 5 -1.157 -14.668 -13.204 38 HA PRO 6 HA PRO 6 -5.989 -13.184 -9.612 39 HB2 PRO 6 HB2 PRO 6 -4.674 -10.807 -8.440 40 HB3 PRO 6 HB3 PRO 6 -5.675 -12.037 -7.654 41 HG2 PRO 6 HG2 PRO 6 -3.073 -12.025 -7.227 42 HG3 PRO 6 HG3 PRO 6 -3.912 -13.562 -7.520 43 HD2 PRO 6 HD2 PRO 6 -2.347 -11.888 -9.467 44 HD3 PRO 6 HD3 PRO 6 -2.200 -13.624 -9.093 45 H GLY 7 H GLY 7 -7.154 -10.910 -9.437 46 HA2 GLY 7 HA2 GLY 7 -7.765 -8.998 -10.675 47 HA3 GLY 7 HA3 GLY 7 -6.752 -9.576 -12.014 48 H SER 8 H SER 8 -8.917 -11.351 -9.970 49 HA SER 8 HA SER 8 -10.002 -12.932 -12.030 50 HB2 SER 8 HB2 SER 8 -11.245 -12.449 -9.318 51 HB3 SER 8 HB3 SER 8 -11.229 -13.940 -10.265 52 HG SER 8 HG SER 8 -9.207 -12.733 -8.749 53 H THR 9 H THR 9 -11.228 -10.321 -10.087 54 HA THR 9 HA THR 9 -12.869 -9.393 -12.265 55 HB THR 9 HB THR 9 -13.917 -9.742 -9.437 56 HG1 THR 9 HG1 THR 9 -14.324 -11.146 -11.847 57 HG21 THR 9 HG21 THR 9 -14.827 -7.765 -10.630 58 HG22 THR 9 HG22 THR 9 -16.068 -8.991 -10.356 59 HG23 THR 9 HG23 THR 9 -15.336 -8.813 -11.948 60 H LEU 10 H LEU 10 -12.584 -7.236 -12.417 61 HA LEU 10 HA LEU 10 -10.917 -5.924 -10.496 62 HB2 LEU 10 HB2 LEU 10 -12.370 -4.884 -12.901 63 HB3 LEU 10 HB3 LEU 10 -11.250 -3.932 -11.943 64 HG LEU 10 HG LEU 10 -10.580 -6.356 -13.622 65 HD11 LEU 10 HD11 LEU 10 -9.234 -4.739 -14.884 66 HD12 LEU 10 HD12 LEU 10 -9.903 -3.460 -13.850 67 HD13 LEU 10 HD13 LEU 10 -10.966 -4.375 -14.914 68 HD21 LEU 10 HD21 LEU 10 -8.239 -5.897 -13.019 69 HD22 LEU 10 HD22 LEU 10 -9.198 -6.344 -11.607 70 HD23 LEU 10 HD23 LEU 10 -8.778 -4.655 -11.892 71 H ALA 11 H ALA 11 -11.484 -4.248 -9.195 72 HA ALA 11 HA ALA 11 -14.172 -4.628 -8.215 73 HB1 ALA 11 HB1 ALA 11 -12.319 -4.778 -6.665 74 HB2 ALA 11 HB2 ALA 11 -13.455 -3.504 -6.207 75 HB3 ALA 11 HB3 ALA 11 -11.919 -3.087 -6.968 76 H ARG 12 H ARG 12 -15.505 -3.545 -9.528 77 HA ARG 12 HA ARG 12 -15.208 -0.657 -9.491 78 HB2 ARG 12 HB2 ARG 12 -16.709 -2.486 -11.339 79 HB3 ARG 12 HB3 ARG 12 -17.190 -0.801 -11.180 80 HG2 ARG 12 HG2 ARG 12 -15.023 -0.069 -11.934 81 HG3 ARG 12 HG3 ARG 12 -14.436 -1.733 -11.959 82 HD2 ARG 12 HD2 ARG 12 -16.809 -0.865 -13.577 83 HD3 ARG 12 HD3 ARG 12 -15.159 -0.694 -14.183 84 HE ARG 12 HE ARG 12 -14.957 -3.119 -13.814 85 HH11 ARG 12 HH11 ARG 12 -18.246 -1.810 -14.364 86 HH12 ARG 12 HH12 ARG 12 -18.782 -3.249 -15.098 87 HH21 ARG 12 HH21 ARG 12 -15.761 -5.013 -14.865 88 HH22 ARG 12 HH22 ARG 12 -17.373 -5.073 -15.400 89 H VAL 13 H VAL 13 -15.719 -0.675 -7.296 90 HA VAL 13 HA VAL 13 -18.534 -0.383 -6.837 91 HB VAL 13 HB VAL 13 -18.292 -1.422 -4.537 92 HG11 VAL 13 HG11 VAL 13 -18.478 -3.770 -5.227 93 HG12 VAL 13 HG12 VAL 13 -17.856 -3.341 -6.821 94 HG13 VAL 13 HG13 VAL 13 -19.403 -2.695 -6.273 95 HG21 VAL 13 HG21 VAL 13 -16.460 -3.007 -4.127 96 HG22 VAL 13 HG22 VAL 13 -15.872 -1.356 -4.338 97 HG23 VAL 13 HG23 VAL 13 -15.719 -2.521 -5.652 98 H GLY 14 H GLY 14 -18.861 1.073 -5.104 99 HA2 GLY 14 HA2 GLY 14 -16.658 3.013 -5.081 100 HA3 GLY 14 HA3 GLY 14 -18.353 3.394 -4.864 101 H SER 15 H SER 15 -16.577 0.877 -3.132 102 HA SER 15 HA SER 15 -16.901 2.506 -0.714 103 HB2 SER 15 HB2 SER 15 -17.021 -0.502 -0.948 104 HB3 SER 15 HB3 SER 15 -17.325 0.462 0.499 105 HG SER 15 HG SER 15 -19.011 1.503 -0.947 106 H ILE 16 H ILE 16 -14.690 1.948 -2.700 107 HA ILE 16 HA ILE 16 -12.638 0.978 -0.809 108 HB ILE 16 HB ILE 16 -12.683 0.733 -3.812 109 HG12 ILE 16 HG12 ILE 16 -12.919 -1.442 -1.734 110 HG13 ILE 16 HG13 ILE 16 -14.285 -0.741 -2.598 111 HG21 ILE 16 HG21 ILE 16 -10.687 -0.710 -3.465 112 HG22 ILE 16 HG22 ILE 16 -10.665 -0.201 -1.771 113 HG23 ILE 16 HG23 ILE 16 -10.433 0.982 -3.049 114 HD11 ILE 16 HD11 ILE 16 -13.327 -1.469 -4.692 115 HD12 ILE 16 HD12 ILE 16 -13.623 -2.816 -3.595 116 HD13 ILE 16 HD13 ILE 16 -11.975 -2.207 -3.823 117 HA PRO 17 HA PRO 17 -10.752 4.964 -2.009 118 HB2 PRO 17 HB2 PRO 17 -8.812 4.397 0.093 119 HB3 PRO 17 HB3 PRO 17 -9.980 5.717 0.027 120 HG2 PRO 17 HG2 PRO 17 -10.149 3.672 1.824 121 HG3 PRO 17 HG3 PRO 17 -11.559 4.556 1.213 122 HD2 PRO 17 HD2 PRO 17 -10.495 1.884 0.387 123 HD3 PRO 17 HD3 PRO 17 -12.180 2.405 0.632 124 H ALA 18 H ALA 18 -9.126 4.987 -3.571 125 HA ALA 18 HA ALA 18 -7.067 2.925 -3.382 126 HB1 ALA 18 HB1 ALA 18 -7.084 2.537 -5.735 127 HB2 ALA 18 HB2 ALA 18 -8.407 3.688 -5.974 128 HB3 ALA 18 HB3 ALA 18 -8.683 2.185 -5.077 129 H GLY 19 H GLY 19 -5.063 3.450 -4.215 130 HA2 GLY 19 HA2 GLY 19 -4.715 6.302 -4.787 131 HA3 GLY 19 HA3 GLY 19 -3.497 5.265 -4.045 132 H ASP 20 H ASP 20 -2.303 6.270 -5.889 133 HA ASP 20 HA ASP 20 -2.877 5.015 -8.456 134 HB2 ASP 20 HB2 ASP 20 -2.192 7.388 -8.483 135 HB3 ASP 20 HB3 ASP 20 -0.667 6.952 -7.720 136 H ASP 21 H ASP 21 -1.605 3.488 -9.409 137 HA ASP 21 HA ASP 21 -0.383 1.787 -7.495 138 HB2 ASP 21 HB2 ASP 21 -0.229 0.123 -9.206 139 HB3 ASP 21 HB3 ASP 21 -1.764 0.944 -9.415 140 H VAL 22 H VAL 22 1.539 2.202 -6.731 141 HA VAL 22 HA VAL 22 3.689 2.930 -8.579 142 HB VAL 22 HB VAL 22 3.892 2.547 -5.547 143 HG11 VAL 22 HG11 VAL 22 5.720 4.038 -7.434 144 HG12 VAL 22 HG12 VAL 22 6.004 2.423 -6.805 145 HG13 VAL 22 HG13 VAL 22 5.975 3.794 -5.698 146 HG21 VAL 22 HG21 VAL 22 3.483 5.105 -7.092 147 HG22 VAL 22 HG22 VAL 22 3.778 4.997 -5.357 148 HG23 VAL 22 HG23 VAL 22 2.294 4.332 -6.048 149 H LEU 23 H LEU 23 2.615 0.648 -9.135 150 HA LEU 23 HA LEU 23 4.272 -1.505 -8.027 151 HB2 LEU 23 HB2 LEU 23 1.605 -1.497 -9.395 152 HB3 LEU 23 HB3 LEU 23 2.558 -2.949 -9.229 153 HG LEU 23 HG LEU 23 1.692 -1.337 -6.835 154 HD11 LEU 23 HD11 LEU 23 0.373 -3.712 -8.176 155 HD12 LEU 23 HD12 LEU 23 -0.294 -2.076 -8.148 156 HD13 LEU 23 HD13 LEU 23 -0.138 -2.996 -6.647 157 HD21 LEU 23 HD21 LEU 23 3.524 -2.894 -6.563 158 HD22 LEU 23 HD22 LEU 23 2.537 -4.198 -7.218 159 HD23 LEU 23 HD23 LEU 23 2.088 -3.431 -5.691 160 H ASP 24 H ASP 24 5.036 -3.035 -9.489 161 HA ASP 24 HA ASP 24 5.578 -2.063 -12.180 162 HB2 ASP 24 HB2 ASP 24 7.545 -2.843 -10.985 163 HB3 ASP 24 HB3 ASP 24 6.757 -4.311 -10.474 164 HA PRO 25 HA PRO 25 2.209 -4.473 -13.833 165 HB2 PRO 25 HB2 PRO 25 4.209 -5.443 -15.826 166 HB3 PRO 25 HB3 PRO 25 2.583 -4.806 -16.092 167 HG2 PRO 25 HG2 PRO 25 4.675 -3.259 -16.546 168 HG3 PRO 25 HG3 PRO 25 3.243 -2.601 -15.736 169 HD2 PRO 25 HD2 PRO 25 5.890 -3.365 -14.577 170 HD3 PRO 25 HD3 PRO 25 4.803 -2.031 -14.142 171 H ASP 26 H ASP 26 5.248 -6.132 -13.126 172 HA ASP 26 HA ASP 26 3.795 -8.637 -13.198 173 HB2 ASP 26 HB2 ASP 26 6.712 -8.051 -13.206 174 HB3 ASP 26 HB3 ASP 26 6.130 -9.639 -12.721 175 H GLU 27 H GLU 27 4.140 -6.371 -10.932 176 HA GLU 27 HA GLU 27 4.689 -8.149 -8.761 177 HB2 GLU 27 HB2 GLU 27 3.562 -5.348 -8.796 178 HB3 GLU 27 HB3 GLU 27 3.857 -6.260 -7.320 179 HG2 GLU 27 HG2 GLU 27 5.881 -5.468 -9.357 180 HG3 GLU 27 HG3 GLU 27 5.669 -4.691 -7.778 181 HA PRO 28 HA PRO 28 0.712 -9.957 -8.807 182 HB2 PRO 28 HB2 PRO 28 0.831 -11.190 -6.381 183 HB3 PRO 28 HB3 PRO 28 1.664 -11.784 -7.821 184 HG2 PRO 28 HG2 PRO 28 2.747 -10.182 -5.539 185 HG3 PRO 28 HG3 PRO 28 3.473 -11.562 -6.384 186 HD2 PRO 28 HD2 PRO 28 4.185 -9.008 -6.884 187 HD3 PRO 28 HD3 PRO 28 4.197 -10.262 -8.143 188 H THR 29 H THR 29 -1.280 -9.446 -8.158 189 HA THR 29 HA THR 29 -1.583 -7.653 -5.892 190 HB THR 29 HB THR 29 -3.635 -6.932 -7.305 191 HG1 THR 29 HG1 THR 29 -3.439 -7.299 -9.489 192 HG21 THR 29 HG21 THR 29 -2.257 -5.245 -8.488 193 HG22 THR 29 HG22 THR 29 -0.813 -6.169 -8.097 194 HG23 THR 29 HG23 THR 29 -1.760 -5.428 -6.806 195 H TYR 30 H TYR 30 -4.087 -7.606 -5.547 196 HA TYR 30 HA TYR 30 -5.399 -10.176 -5.697 197 HB2 TYR 30 HB2 TYR 30 -5.048 -8.397 -3.290 198 HB3 TYR 30 HB3 TYR 30 -6.429 -9.470 -3.485 199 HD1 TYR 30 HD1 TYR 30 -5.579 -11.934 -4.326 200 HD2 TYR 30 HD2 TYR 30 -3.450 -9.213 -1.867 201 HE1 TYR 30 HE1 TYR 30 -4.329 -13.802 -3.374 202 HE2 TYR 30 HE2 TYR 30 -2.178 -11.074 -0.903 203 HH TYR 30 HH TYR 30 -2.436 -13.478 -0.584 204 H ASP 31 H ASP 31 -7.655 -9.846 -5.490 205 HA ASP 31 HA ASP 31 -8.516 -7.207 -6.314 206 HB2 ASP 31 HB2 ASP 31 -10.042 -8.282 -7.979 207 HB3 ASP 31 HB3 ASP 31 -8.357 -8.556 -8.394 208 H LEU 32 H LEU 32 -10.849 -7.062 -5.823 209 HA LEU 32 HA LEU 32 -11.083 -7.755 -3.195 210 HB2 LEU 32 HB2 LEU 32 -12.978 -6.483 -5.047 211 HB3 LEU 32 HB3 LEU 32 -13.611 -7.080 -3.527 212 HG LEU 32 HG LEU 32 -13.018 -4.716 -3.400 213 HD11 LEU 32 HD11 LEU 32 -11.725 -4.784 -1.351 214 HD12 LEU 32 HD12 LEU 32 -11.244 -6.443 -1.688 215 HD13 LEU 32 HD13 LEU 32 -12.934 -6.062 -1.379 216 HD21 LEU 32 HD21 LEU 32 -10.178 -5.626 -3.881 217 HD22 LEU 32 HD22 LEU 32 -10.655 -4.002 -3.386 218 HD23 LEU 32 HD23 LEU 32 -11.141 -4.619 -4.963 219 HA PRO 33 HA PRO 33 -14.182 -11.316 -4.012 220 HB2 PRO 33 HB2 PRO 33 -13.442 -12.578 -6.454 221 HB3 PRO 33 HB3 PRO 33 -14.998 -11.866 -6.049 222 HG2 PRO 33 HG2 PRO 33 -12.874 -10.824 -7.747 223 HG3 PRO 33 HG3 PRO 33 -14.558 -10.300 -7.593 224 HD2 PRO 33 HD2 PRO 33 -12.319 -8.917 -6.667 225 HD3 PRO 33 HD3 PRO 33 -13.995 -8.622 -6.180 226 H ARG 34 H ARG 34 -10.869 -11.244 -5.398 227 HA ARG 34 HA ARG 34 -10.192 -13.852 -4.566 228 HB2 ARG 34 HB2 ARG 34 -9.005 -12.175 -6.218 229 HB3 ARG 34 HB3 ARG 34 -8.163 -11.666 -4.765 230 HG2 ARG 34 HG2 ARG 34 -6.809 -13.271 -5.861 231 HG3 ARG 34 HG3 ARG 34 -7.498 -14.057 -4.431 232 HD2 ARG 34 HD2 ARG 34 -9.267 -15.026 -5.824 233 HD3 ARG 34 HD3 ARG 34 -8.562 -14.249 -7.236 234 HE ARG 34 HE ARG 34 -6.948 -16.106 -5.687 235 HH11 ARG 34 HH11 ARG 34 -8.616 -15.318 -8.739 236 HH12 ARG 34 HH12 ARG 34 -8.135 -16.761 -9.501 237 HH21 ARG 34 HH21 ARG 34 -6.313 -18.089 -6.759 238 HH22 ARG 34 HH22 ARG 34 -6.827 -18.366 -8.356 239 H VAL 35 H VAL 35 -9.857 -10.672 -3.099 240 HA VAL 35 HA VAL 35 -8.389 -11.559 -0.839 241 HB VAL 35 HB VAL 35 -10.111 -9.061 -1.072 242 HG11 VAL 35 HG11 VAL 35 -7.935 -9.719 0.912 243 HG12 VAL 35 HG12 VAL 35 -9.659 -9.601 1.259 244 HG13 VAL 35 HG13 VAL 35 -8.759 -8.166 0.769 245 HG21 VAL 35 HG21 VAL 35 -7.170 -9.460 -1.504 246 HG22 VAL 35 HG22 VAL 35 -7.991 -7.900 -1.491 247 HG23 VAL 35 HG23 VAL 35 -8.382 -9.085 -2.737 248 H ALA 36 H ALA 36 -11.776 -11.081 -1.475 249 HA ALA 36 HA ALA 36 -12.780 -11.608 1.076 250 HB1 ALA 36 HB1 ALA 36 -14.018 -12.248 -1.610 251 HB2 ALA 36 HB2 ALA 36 -14.141 -10.710 -0.741 252 HB3 ALA 36 HB3 ALA 36 -14.867 -12.164 -0.061 253 H GLU 37 H GLU 37 -11.901 -13.675 -1.572 254 HA GLU 37 HA GLU 37 -12.757 -16.133 -0.482 255 HB2 GLU 37 HB2 GLU 37 -11.933 -15.336 -2.898 256 HB3 GLU 37 HB3 GLU 37 -10.440 -16.004 -2.300 257 HG2 GLU 37 HG2 GLU 37 -11.644 -17.706 -3.538 258 HG3 GLU 37 HG3 GLU 37 -11.487 -18.144 -1.833 259 H LEU 38 H LEU 38 -9.726 -14.370 -0.474 260 HA LEU 38 HA LEU 38 -8.077 -16.367 0.647 261 HB2 LEU 38 HB2 LEU 38 -7.287 -14.458 -0.698 262 HB3 LEU 38 HB3 LEU 38 -7.740 -13.376 0.601 263 HG LEU 38 HG LEU 38 -6.088 -14.584 2.053 264 HD11 LEU 38 HD11 LEU 38 -4.318 -15.860 0.941 265 HD12 LEU 38 HD12 LEU 38 -5.185 -15.737 -0.583 266 HD13 LEU 38 HD13 LEU 38 -5.888 -16.644 0.761 267 HD21 LEU 38 HD21 LEU 38 -5.024 -13.190 -0.400 268 HD22 LEU 38 HD22 LEU 38 -4.165 -13.397 1.119 269 HD23 LEU 38 HD23 LEU 38 -5.616 -12.401 1.062 270 H LEU 39 H LEU 39 -9.764 -13.569 2.038 271 HA LEU 39 HA LEU 39 -8.788 -14.219 4.691 272 HB2 LEU 39 HB2 LEU 39 -10.588 -11.997 3.756 273 HB3 LEU 39 HB3 LEU 39 -10.020 -12.188 5.399 274 HG LEU 39 HG LEU 39 -8.322 -11.587 2.973 275 HD11 LEU 39 HD11 LEU 39 -7.947 -9.438 4.073 276 HD12 LEU 39 HD12 LEU 39 -9.059 -9.902 5.359 277 HD13 LEU 39 HD13 LEU 39 -9.654 -9.695 3.711 278 HD21 LEU 39 HD21 LEU 39 -7.063 -12.973 4.541 279 HD22 LEU 39 HD22 LEU 39 -7.520 -11.909 5.873 280 HD23 LEU 39 HD23 LEU 39 -6.476 -11.313 4.584 281 H GLY 40 H GLY 40 -11.480 -15.001 2.815 282 HA2 GLY 40 HA2 GLY 40 -13.190 -16.457 3.338 283 HA3 GLY 40 HA3 GLY 40 -12.563 -16.531 4.980 284 H VAL 41 H VAL 41 -13.251 -13.497 3.540 285 HA VAL 41 HA VAL 41 -15.761 -13.300 5.014 286 HB VAL 41 HB VAL 41 -15.225 -11.014 5.786 287 HG11 VAL 41 HG11 VAL 41 -13.197 -13.022 6.706 288 HG12 VAL 41 HG12 VAL 41 -14.831 -12.813 7.334 289 HG13 VAL 41 HG13 VAL 41 -13.629 -11.540 7.561 290 HG21 VAL 41 HG21 VAL 41 -12.429 -11.518 4.760 291 HG22 VAL 41 HG22 VAL 41 -12.953 -10.105 5.682 292 HG23 VAL 41 HG23 VAL 41 -13.596 -10.400 4.062 293 HA PRO 42 HA PRO 42 -17.199 -11.652 1.185 294 HB2 PRO 42 HB2 PRO 42 -19.065 -9.861 2.173 295 HB3 PRO 42 HB3 PRO 42 -19.352 -11.587 1.920 296 HG2 PRO 42 HG2 PRO 42 -18.630 -10.132 4.425 297 HG3 PRO 42 HG3 PRO 42 -19.780 -11.461 4.187 298 HD2 PRO 42 HD2 PRO 42 -17.372 -11.895 5.236 299 HD3 PRO 42 HD3 PRO 42 -18.105 -13.058 4.116 300 H VAL 43 H VAL 43 -17.135 -9.836 -0.100 301 HA VAL 43 HA VAL 43 -15.032 -8.071 0.121 302 HB VAL 43 HB VAL 43 -17.579 -7.744 -1.504 303 HG11 VAL 43 HG11 VAL 43 -16.470 -5.574 -1.295 304 HG12 VAL 43 HG12 VAL 43 -16.324 -6.198 -2.939 305 HG13 VAL 43 HG13 VAL 43 -14.952 -6.291 -1.834 306 HG21 VAL 43 HG21 VAL 43 -16.229 -8.604 -3.354 307 HG22 VAL 43 HG22 VAL 43 -16.308 -9.760 -2.026 308 HG23 VAL 43 HG23 VAL 43 -14.855 -8.791 -2.266 309 H SER 44 H SER 44 -18.339 -7.599 1.180 310 HA SER 44 HA SER 44 -18.309 -4.879 1.725 311 HB2 SER 44 HB2 SER 44 -20.336 -6.308 1.764 312 HB3 SER 44 HB3 SER 44 -19.750 -7.069 3.242 313 HG SER 44 HG SER 44 -20.059 -4.282 3.102 314 H LYS 45 H LYS 45 -17.221 -7.595 3.769 315 HA LYS 45 HA LYS 45 -16.611 -5.944 6.010 316 HB2 LYS 45 HB2 LYS 45 -15.764 -8.761 5.346 317 HB3 LYS 45 HB3 LYS 45 -15.360 -7.956 6.854 318 HG2 LYS 45 HG2 LYS 45 -17.760 -7.711 7.339 319 HG3 LYS 45 HG3 LYS 45 -18.134 -8.583 5.854 320 HD2 LYS 45 HD2 LYS 45 -16.956 -10.545 6.700 321 HD3 LYS 45 HD3 LYS 45 -16.523 -9.678 8.167 322 HE2 LYS 45 HE2 LYS 45 -19.313 -10.339 7.246 323 HE3 LYS 45 HE3 LYS 45 -18.428 -11.172 8.516 324 HZ1 LYS 45 HZ1 LYS 45 -19.320 -8.335 8.575 325 HZ2 LYS 45 HZ2 LYS 45 -18.383 -9.083 9.761 326 HZ3 LYS 45 HZ3 LYS 45 -19.954 -9.612 9.464 327 H VAL 46 H VAL 46 -14.814 -7.131 3.270 328 HA VAL 46 HA VAL 46 -12.246 -6.231 4.132 329 HB VAL 46 HB VAL 46 -13.220 -6.457 1.264 330 HG11 VAL 46 HG11 VAL 46 -10.846 -6.773 0.726 331 HG12 VAL 46 HG12 VAL 46 -10.443 -6.555 2.432 332 HG13 VAL 46 HG13 VAL 46 -11.149 -5.222 1.518 333 HG21 VAL 46 HG21 VAL 46 -13.592 -8.575 2.419 334 HG22 VAL 46 HG22 VAL 46 -11.926 -8.574 2.992 335 HG23 VAL 46 HG23 VAL 46 -12.266 -8.728 1.268 336 H ALA 47 H ALA 47 -14.824 -4.729 2.302 337 HA ALA 47 HA ALA 47 -13.601 -2.299 1.708 338 HB1 ALA 47 HB1 ALA 47 -15.734 -3.006 0.726 339 HB2 ALA 47 HB2 ALA 47 -15.856 -1.397 1.447 340 HB3 ALA 47 HB3 ALA 47 -16.514 -2.795 2.295 341 H GLN 48 H GLN 48 -15.203 -3.373 4.624 342 HA GLN 48 HA GLN 48 -15.242 -0.851 5.925 343 HB2 GLN 48 HB2 GLN 48 -15.219 -3.626 7.128 344 HB3 GLN 48 HB3 GLN 48 -15.518 -2.152 8.032 345 HG2 GLN 48 HG2 GLN 48 -17.222 -3.184 5.770 346 HG3 GLN 48 HG3 GLN 48 -17.577 -3.384 7.482 347 HE21 GLN 48 HE21 GLN 48 -19.491 -2.292 7.365 348 HE22 GLN 48 HE22 GLN 48 -19.630 -0.592 7.125 349 H GLN 49 H GLN 49 -12.906 -3.463 5.871 350 HA GLN 49 HA GLN 49 -10.999 -2.405 7.685 351 HB2 GLN 49 HB2 GLN 49 -10.513 -4.059 5.209 352 HB3 GLN 49 HB3 GLN 49 -9.379 -3.840 6.530 353 HG2 GLN 49 HG2 GLN 49 -10.955 -4.907 8.021 354 HG3 GLN 49 HG3 GLN 49 -12.050 -5.182 6.678 355 HE21 GLN 49 HE21 GLN 49 -11.938 -7.369 6.897 356 HE22 GLN 49 HE22 GLN 49 -10.559 -8.306 6.412 357 H LEU 50 H LEU 50 -11.406 -2.175 4.278 358 HA LEU 50 HA LEU 50 -9.222 -0.515 3.628 359 HB2 LEU 50 HB2 LEU 50 -11.876 -0.950 2.289 360 HB3 LEU 50 HB3 LEU 50 -10.609 0.031 1.561 361 HG LEU 50 HG LEU 50 -10.345 -2.909 2.244 362 HD11 LEU 50 HD11 LEU 50 -10.905 -1.564 -0.389 363 HD12 LEU 50 HD12 LEU 50 -12.010 -2.614 0.498 364 HD13 LEU 50 HD13 LEU 50 -10.519 -3.268 -0.176 365 HD21 LEU 50 HD21 LEU 50 -8.371 -2.801 0.813 366 HD22 LEU 50 HD22 LEU 50 -8.217 -1.701 2.182 367 HD23 LEU 50 HD23 LEU 50 -8.625 -1.072 0.584 368 H ARG 51 H ARG 51 -12.493 0.236 4.664 369 HA ARG 51 HA ARG 51 -12.325 3.019 4.318 370 HB2 ARG 51 HB2 ARG 51 -14.076 1.334 6.081 371 HB3 ARG 51 HB3 ARG 51 -14.159 3.086 6.114 372 HG2 ARG 51 HG2 ARG 51 -14.683 1.325 3.724 373 HG3 ARG 51 HG3 ARG 51 -15.897 2.153 4.704 374 HD2 ARG 51 HD2 ARG 51 -14.790 4.314 4.099 375 HD3 ARG 51 HD3 ARG 51 -13.762 3.409 2.993 376 HE ARG 51 HE ARG 51 -16.559 3.008 2.592 377 HH11 ARG 51 HH11 ARG 51 -13.766 4.963 1.748 378 HH12 ARG 51 HH12 ARG 51 -14.439 5.627 0.336 379 HH21 ARG 51 HH21 ARG 51 -17.562 3.928 0.686 380 HH22 ARG 51 HH22 ARG 51 -16.691 5.017 -0.296 381 H GLU 52 H GLU 52 -11.253 0.965 6.955 382 HA GLU 52 HA GLU 52 -10.767 3.273 8.636 383 HB2 GLU 52 HB2 GLU 52 -10.001 0.391 9.029 384 HB3 GLU 52 HB3 GLU 52 -9.773 1.668 10.210 385 HG2 GLU 52 HG2 GLU 52 -12.240 2.010 10.188 386 HG3 GLU 52 HG3 GLU 52 -12.364 0.562 9.181 387 H GLY 53 H GLY 53 -9.168 1.783 6.137 388 HA2 GLY 53 HA2 GLY 53 -7.063 2.260 5.273 389 HA3 GLY 53 HA3 GLY 53 -6.731 3.223 6.712 390 H HIS 54 H HIS 54 -7.886 -0.051 6.789 391 HA HIS 54 HA HIS 54 -5.593 -0.941 8.312 392 HB2 HIS 54 HB2 HIS 54 -7.817 -1.745 8.925 393 HB3 HIS 54 HB3 HIS 54 -8.087 -2.363 7.306 394 HD1 HIS 54 HD1 HIS 54 -7.640 -4.885 7.065 395 HD2 HIS 54 HD2 HIS 54 -5.651 -3.184 10.309 396 HE1 HIS 54 HE1 HIS 54 -6.498 -6.754 8.233 397 H LEU 55 H LEU 55 -6.607 -0.810 5.089 398 HA LEU 55 HA LEU 55 -4.326 -2.239 4.105 399 HB2 LEU 55 HB2 LEU 55 -6.067 -3.975 4.472 400 HB3 LEU 55 HB3 LEU 55 -7.194 -3.044 3.524 401 HG LEU 55 HG LEU 55 -5.831 -3.466 1.510 402 HD11 LEU 55 HD11 LEU 55 -3.644 -3.702 2.556 403 HD12 LEU 55 HD12 LEU 55 -4.034 -5.133 1.605 404 HD13 LEU 55 HD13 LEU 55 -4.175 -5.178 3.361 405 HD21 LEU 55 HD21 LEU 55 -6.355 -5.869 1.349 406 HD22 LEU 55 HD22 LEU 55 -7.677 -4.939 2.054 407 HD23 LEU 55 HD23 LEU 55 -6.627 -5.903 3.089 408 H VAL 56 H VAL 56 -4.142 -1.674 1.716 409 HA VAL 56 HA VAL 56 -5.770 0.671 1.015 410 HB VAL 56 HB VAL 56 -2.770 0.331 0.568 411 HG11 VAL 56 HG11 VAL 56 -3.804 1.567 -1.258 412 HG12 VAL 56 HG12 VAL 56 -2.774 2.614 -0.286 413 HG13 VAL 56 HG13 VAL 56 -4.530 2.689 -0.105 414 HG21 VAL 56 HG21 VAL 56 -3.256 0.849 2.887 415 HG22 VAL 56 HG22 VAL 56 -4.217 2.243 2.395 416 HG23 VAL 56 HG23 VAL 56 -2.479 2.214 2.090 417 H ALA 57 H ALA 57 -6.228 0.822 -1.198 418 HA ALA 57 HA ALA 57 -5.455 -1.472 -2.836 419 HB1 ALA 57 HB1 ALA 57 -7.608 -1.212 -3.967 420 HB2 ALA 57 HB2 ALA 57 -8.011 0.134 -2.906 421 HB3 ALA 57 HB3 ALA 57 -7.856 -1.490 -2.243 422 H VAL 58 H VAL 58 -5.323 -0.911 -5.134 423 HA VAL 58 HA VAL 58 -4.865 1.913 -5.586 424 HB VAL 58 HB VAL 58 -2.855 1.409 -6.970 425 HG11 VAL 58 HG11 VAL 58 -2.647 0.687 -4.061 426 HG12 VAL 58 HG12 VAL 58 -2.756 2.306 -4.728 427 HG13 VAL 58 HG13 VAL 58 -1.330 1.306 -5.078 428 HG21 VAL 58 HG21 VAL 58 -3.006 -1.295 -5.617 429 HG22 VAL 58 HG22 VAL 58 -1.645 -0.701 -6.569 430 HG23 VAL 58 HG23 VAL 58 -3.208 -0.981 -7.339 431 H ARG 59 H ARG 59 -4.651 2.427 -7.815 432 HA ARG 59 HA ARG 59 -6.610 0.907 -9.371 433 HB2 ARG 59 HB2 ARG 59 -7.104 3.233 -8.541 434 HB3 ARG 59 HB3 ARG 59 -5.765 3.798 -9.516 435 HG2 ARG 59 HG2 ARG 59 -6.962 3.086 -11.541 436 HG3 ARG 59 HG3 ARG 59 -8.305 2.538 -10.530 437 HD2 ARG 59 HD2 ARG 59 -8.493 4.812 -9.588 438 HD3 ARG 59 HD3 ARG 59 -7.226 5.348 -10.684 439 HE ARG 59 HE ARG 59 -9.122 4.276 -12.306 440 HH11 ARG 59 HH11 ARG 59 -9.138 6.806 -9.787 441 HH12 ARG 59 HH12 ARG 59 -10.386 7.689 -10.502 442 HH21 ARG 59 HH21 ARG 59 -10.872 5.578 -13.299 443 HH22 ARG 59 HH22 ARG 59 -11.368 7.000 -12.500 444 H ARG 60 H ARG 60 -5.610 -0.226 -10.922 445 HA ARG 60 HA ARG 60 -3.399 1.031 -12.358 446 HB2 ARG 60 HB2 ARG 60 -2.091 -0.992 -12.436 447 HB3 ARG 60 HB3 ARG 60 -2.549 -0.799 -10.761 448 HG2 ARG 60 HG2 ARG 60 -4.446 -2.420 -11.252 449 HG3 ARG 60 HG3 ARG 60 -3.624 -2.753 -12.770 450 HD2 ARG 60 HD2 ARG 60 -2.520 -3.150 -9.988 451 HD3 ARG 60 HD3 ARG 60 -3.049 -4.404 -11.090 452 HE ARG 60 HE ARG 60 -0.854 -2.732 -11.984 453 HH11 ARG 60 HH11 ARG 60 -1.893 -5.895 -10.805 454 HH12 ARG 60 HH12 ARG 60 -0.332 -6.561 -10.689 455 HH21 ARG 60 HH21 ARG 60 1.326 -3.656 -11.816 456 HH22 ARG 60 HH22 ARG 60 1.553 -5.255 -11.290 457 H ALA 61 H ALA 61 -3.696 1.002 -14.499 458 HA ALA 61 HA ALA 61 -4.703 0.801 -16.513 459 HB1 ALA 61 HB1 ALA 61 -5.497 -1.409 -17.222 460 HB2 ALA 61 HB2 ALA 61 -5.509 -1.956 -15.546 461 HB3 ALA 61 HB3 ALA 61 -3.980 -1.564 -16.331 462 H GLY 62 H GLY 62 -6.203 1.632 -14.036 463 HA2 GLY 62 HA2 GLY 62 -8.248 2.786 -13.990 464 HA3 GLY 62 HA3 GLY 62 -8.824 1.772 -15.310 465 H GLY 63 H GLY 63 -7.553 -0.485 -13.497 466 HA2 GLY 63 HA2 GLY 63 -10.129 -1.047 -12.225 467 HA3 GLY 63 HA3 GLY 63 -8.858 -2.209 -12.592 468 H VAL 64 H VAL 64 -10.324 -1.586 -10.098 469 HA VAL 64 HA VAL 64 -8.133 -0.665 -8.424 470 HB VAL 64 HB VAL 64 -11.018 -1.254 -7.677 471 HG11 VAL 64 HG11 VAL 64 -9.514 -1.526 -5.784 472 HG12 VAL 64 HG12 VAL 64 -10.495 -0.075 -5.584 473 HG13 VAL 64 HG13 VAL 64 -8.810 0.059 -6.092 474 HG21 VAL 64 HG21 VAL 64 -11.280 1.185 -7.532 475 HG22 VAL 64 HG22 VAL 64 -10.858 0.672 -9.168 476 HG23 VAL 64 HG23 VAL 64 -9.632 1.393 -8.123 477 H VAL 65 H VAL 65 -6.903 -2.030 -7.458 478 HA VAL 65 HA VAL 65 -7.730 -4.720 -6.671 479 HB VAL 65 HB VAL 65 -5.507 -5.561 -7.509 480 HG11 VAL 65 HG11 VAL 65 -6.195 -5.856 -9.853 481 HG12 VAL 65 HG12 VAL 65 -7.394 -4.579 -9.656 482 HG13 VAL 65 HG13 VAL 65 -7.551 -6.084 -8.749 483 HG21 VAL 65 HG21 VAL 65 -4.378 -4.315 -9.288 484 HG22 VAL 65 HG22 VAL 65 -4.394 -3.413 -7.769 485 HG23 VAL 65 HG23 VAL 65 -5.516 -2.985 -9.065 486 H ILE 66 H ILE 66 -5.992 -5.624 -5.280 487 HA ILE 66 HA ILE 66 -4.844 -3.458 -3.658 488 HB ILE 66 HB ILE 66 -5.905 -6.168 -2.767 489 HG12 ILE 66 HG12 ILE 66 -6.887 -3.364 -2.187 490 HG13 ILE 66 HG13 ILE 66 -7.634 -4.485 -3.316 491 HG21 ILE 66 HG21 ILE 66 -3.941 -5.528 -1.448 492 HG22 ILE 66 HG22 ILE 66 -5.415 -5.432 -0.477 493 HG23 ILE 66 HG23 ILE 66 -4.678 -3.961 -1.106 494 HD11 ILE 66 HD11 ILE 66 -8.840 -4.343 -1.205 495 HD12 ILE 66 HD12 ILE 66 -7.401 -4.873 -0.338 496 HD13 ILE 66 HD13 ILE 66 -8.210 -5.961 -1.473 497 HA PRO 67 HA PRO 67 -1.003 -5.453 -4.888 498 HB2 PRO 67 HB2 PRO 67 0.200 -4.169 -2.522 499 HB3 PRO 67 HB3 PRO 67 0.614 -3.974 -4.226 500 HG2 PRO 67 HG2 PRO 67 -0.628 -2.027 -2.862 501 HG3 PRO 67 HG3 PRO 67 -0.990 -2.343 -4.567 502 HD2 PRO 67 HD2 PRO 67 -2.541 -3.111 -2.125 503 HD3 PRO 67 HD3 PRO 67 -3.117 -2.506 -3.696 504 H GLN 68 H GLN 68 -0.417 -7.560 -4.481 505 HA GLN 68 HA GLN 68 -1.182 -8.895 -2.158 506 HB2 GLN 68 HB2 GLN 68 -1.018 -9.981 -4.295 507 HB3 GLN 68 HB3 GLN 68 0.693 -9.644 -4.391 508 HG2 GLN 68 HG2 GLN 68 1.203 -11.238 -2.730 509 HG3 GLN 68 HG3 GLN 68 -0.483 -11.382 -2.242 510 HE21 GLN 68 HE21 GLN 68 -1.507 -11.437 -4.996 511 HE22 GLN 68 HE22 GLN 68 -1.107 -12.972 -5.600 512 H VAL 69 H VAL 69 1.630 -7.123 -2.926 513 HA VAL 69 HA VAL 69 3.373 -8.236 -0.995 514 HB VAL 69 HB VAL 69 4.732 -6.199 -1.261 515 HG11 VAL 69 HG11 VAL 69 4.997 -7.977 -2.882 516 HG12 VAL 69 HG12 VAL 69 5.184 -6.412 -3.672 517 HG13 VAL 69 HG13 VAL 69 3.682 -7.319 -3.853 518 HG21 VAL 69 HG21 VAL 69 2.445 -5.217 -2.975 519 HG22 VAL 69 HG22 VAL 69 4.033 -4.452 -2.841 520 HG23 VAL 69 HG23 VAL 69 2.977 -4.541 -1.430 521 H PHE 70 H PHE 70 0.546 -6.461 -0.507 522 HA PHE 70 HA PHE 70 1.374 -5.284 2.013 523 HB2 PHE 70 HB2 PHE 70 -1.132 -5.211 0.365 524 HB3 PHE 70 HB3 PHE 70 -1.247 -4.851 2.080 525 HD1 PHE 70 HD1 PHE 70 1.103 -3.907 -0.690 526 HD2 PHE 70 HD2 PHE 70 -1.356 -2.617 2.518 527 HE1 PHE 70 HE1 PHE 70 1.781 -1.572 -1.100 528 HE2 PHE 70 HE2 PHE 70 -0.681 -0.308 2.146 529 HZ PHE 70 HZ PHE 70 0.863 0.243 0.332 530 H PHE 71 H PHE 71 0.654 -8.239 0.950 531 HA PHE 71 HA PHE 71 -0.500 -9.175 3.478 532 HB2 PHE 71 HB2 PHE 71 -0.755 -10.311 0.681 533 HB3 PHE 71 HB3 PHE 71 -1.219 -11.182 2.128 534 HD1 PHE 71 HD1 PHE 71 -1.948 -8.104 0.177 535 HD2 PHE 71 HD2 PHE 71 -3.358 -10.966 2.990 536 HE1 PHE 71 HE1 PHE 71 -4.209 -7.161 0.003 537 HE2 PHE 71 HE2 PHE 71 -5.625 -10.029 2.815 538 HZ PHE 71 HZ PHE 71 -6.050 -8.121 1.320 539 H THR 72 H THR 72 0.425 -11.094 4.256 540 HA THR 72 HA THR 72 3.203 -11.383 3.612 541 HB THR 72 HB THR 72 3.186 -12.987 5.500 542 HG1 THR 72 HG1 THR 72 1.044 -12.762 6.725 543 HG21 THR 72 HG21 THR 72 1.813 -10.365 6.100 544 HG22 THR 72 HG22 THR 72 3.552 -10.609 5.948 545 HG23 THR 72 HG23 THR 72 2.665 -11.363 7.275 546 H ASN 73 H ASN 73 3.953 -13.825 3.656 547 HA ASN 73 HA ASN 73 3.288 -14.989 1.193 548 HB2 ASN 73 HB2 ASN 73 5.429 -15.391 2.391 549 HB3 ASN 73 HB3 ASN 73 4.560 -16.332 3.595 550 HD21 ASN 73 HD21 ASN 73 5.994 -16.312 0.527 551 HD22 ASN 73 HD22 ASN 73 5.714 -17.961 0.103 552 H SER 74 H SER 74 2.072 -15.553 4.418 553 HA SER 74 HA SER 74 0.649 -17.947 3.753 554 HB2 SER 74 HB2 SER 74 0.383 -16.192 6.184 555 HB3 SER 74 HB3 SER 74 -0.105 -17.883 6.031 556 HG SER 74 HG SER 74 2.146 -18.311 5.542 557 H GLY 75 H GLY 75 0.002 -14.790 2.969 558 HA2 GLY 75 HA2 GLY 75 -1.903 -13.935 1.973 559 HA3 GLY 75 HA3 GLY 75 -2.752 -15.418 2.396 560 H GLN 76 H GLN 76 -0.994 -13.561 4.686 561 HA GLN 76 HA GLN 76 -3.510 -12.790 6.028 562 HB2 GLN 76 HB2 GLN 76 -2.017 -14.282 7.312 563 HB3 GLN 76 HB3 GLN 76 -0.704 -13.138 7.106 564 HG2 GLN 76 HG2 GLN 76 -2.146 -11.473 8.358 565 HG3 GLN 76 HG3 GLN 76 -3.191 -12.834 8.755 566 HE21 GLN 76 HE21 GLN 76 -2.751 -12.629 10.951 567 HE22 GLN 76 HE22 GLN 76 -1.241 -13.092 11.631 568 H VAL 77 H VAL 77 -3.729 -10.596 6.599 569 HA VAL 77 HA VAL 77 -2.143 -8.678 5.208 570 HB VAL 77 HB VAL 77 -4.215 -8.370 7.430 571 HG11 VAL 77 HG11 VAL 77 -2.591 -6.509 7.566 572 HG12 VAL 77 HG12 VAL 77 -4.173 -5.962 7.012 573 HG13 VAL 77 HG13 VAL 77 -2.861 -6.183 5.854 574 HG21 VAL 77 HG21 VAL 77 -5.579 -7.414 5.656 575 HG22 VAL 77 HG22 VAL 77 -5.061 -9.056 5.240 576 HG23 VAL 77 HG23 VAL 77 -4.250 -7.649 4.525 577 H VAL 78 H VAL 78 -0.343 -7.636 5.882 578 HA VAL 78 HA VAL 78 1.225 -8.582 7.992 579 HB VAL 78 HB VAL 78 1.328 -5.805 6.759 580 HG11 VAL 78 HG11 VAL 78 2.687 -5.962 8.747 581 HG12 VAL 78 HG12 VAL 78 3.706 -5.835 7.312 582 HG13 VAL 78 HG13 VAL 78 3.493 -7.393 8.106 583 HG21 VAL 78 HG21 VAL 78 2.713 -8.316 5.828 584 HG22 VAL 78 HG22 VAL 78 2.961 -6.703 5.168 585 HG23 VAL 78 HG23 VAL 78 1.395 -7.491 4.997 586 H LYS 79 H LYS 79 1.166 -8.160 10.133 587 HA LYS 79 HA LYS 79 -1.070 -6.718 11.120 588 HB2 LYS 79 HB2 LYS 79 -0.318 -7.272 13.381 589 HB3 LYS 79 HB3 LYS 79 -0.342 -8.674 12.324 590 HG2 LYS 79 HG2 LYS 79 2.032 -8.342 11.954 591 HG3 LYS 79 HG3 LYS 79 2.017 -7.083 13.187 592 HD2 LYS 79 HD2 LYS 79 1.172 -9.962 13.633 593 HD3 LYS 79 HD3 LYS 79 2.741 -9.325 14.100 594 HE2 LYS 79 HE2 LYS 79 0.061 -8.395 15.150 595 HE3 LYS 79 HE3 LYS 79 1.173 -9.467 15.985 596 HZ1 LYS 79 HZ1 LYS 79 1.636 -6.592 15.336 597 HZ2 LYS 79 HZ2 LYS 79 2.820 -7.627 15.961 598 HZ3 LYS 79 HZ3 LYS 79 1.440 -7.298 16.843 599 H SER 80 H SER 80 2.186 -5.819 10.597 600 HA SER 80 HA SER 80 1.848 -3.360 12.080 601 HB2 SER 80 HB2 SER 80 4.131 -4.396 10.410 602 HB3 SER 80 HB3 SER 80 4.178 -2.893 11.352 603 HG SER 80 HG SER 80 3.914 -5.556 12.236 604 H LEU 81 H LEU 81 0.530 -4.293 9.306 605 HA LEU 81 HA LEU 81 1.316 -2.414 7.380 606 HB2 LEU 81 HB2 LEU 81 -0.141 -4.528 7.080 607 HB3 LEU 81 HB3 LEU 81 -1.471 -3.528 7.584 608 HG LEU 81 HG LEU 81 -0.884 -1.978 5.674 609 HD11 LEU 81 HD11 LEU 81 0.645 -4.420 4.838 610 HD12 LEU 81 HD12 LEU 81 1.390 -2.884 5.296 611 HD13 LEU 81 HD13 LEU 81 0.371 -2.989 3.852 612 HD21 LEU 81 HD21 LEU 81 -2.137 -3.298 4.134 613 HD22 LEU 81 HD22 LEU 81 -2.758 -3.578 5.752 614 HD23 LEU 81 HD23 LEU 81 -1.706 -4.778 4.985 615 HA PRO 82 HA PRO 82 -2.419 0.358 8.865 616 HB2 PRO 82 HB2 PRO 82 -2.721 -0.422 11.702 617 HB3 PRO 82 HB3 PRO 82 -3.971 -0.080 10.500 618 HG2 PRO 82 HG2 PRO 82 -3.519 -2.579 11.324 619 HG3 PRO 82 HG3 PRO 82 -3.899 -2.225 9.623 620 HD2 PRO 82 HD2 PRO 82 -1.261 -2.767 10.909 621 HD3 PRO 82 HD3 PRO 82 -1.921 -3.411 9.396 622 H GLY 83 H GLY 83 0.054 -0.736 11.034 623 HA2 GLY 83 HA2 GLY 83 0.438 1.662 12.492 624 HA3 GLY 83 HA3 GLY 83 1.611 0.360 12.336 625 H LEU 84 H LEU 84 2.053 0.352 9.609 626 HA LEU 84 HA LEU 84 3.814 2.563 9.390 627 HB2 LEU 84 HB2 LEU 84 4.530 1.678 7.288 628 HB3 LEU 84 HB3 LEU 84 4.273 0.329 8.358 629 HG LEU 84 HG LEU 84 1.898 0.336 7.082 630 HD11 LEU 84 HD11 LEU 84 2.219 0.761 4.700 631 HD12 LEU 84 HD12 LEU 84 3.813 1.431 5.034 632 HD13 LEU 84 HD13 LEU 84 2.378 2.225 5.661 633 HD21 LEU 84 HD21 LEU 84 3.379 -1.588 7.291 634 HD22 LEU 84 HD22 LEU 84 4.456 -0.902 6.072 635 HD23 LEU 84 HD23 LEU 84 2.832 -1.409 5.620 636 H LEU 85 H LEU 85 0.709 1.787 8.014 637 HA LEU 85 HA LEU 85 0.522 3.978 6.278 638 HB2 LEU 85 HB2 LEU 85 -1.665 2.451 7.692 639 HB3 LEU 85 HB3 LEU 85 -1.924 3.568 6.367 640 HG LEU 85 HG LEU 85 -0.333 1.007 6.166 641 HD11 LEU 85 HD11 LEU 85 -2.689 0.549 6.565 642 HD12 LEU 85 HD12 LEU 85 -2.233 0.146 4.909 643 HD13 LEU 85 HD13 LEU 85 -3.132 1.625 5.240 644 HD21 LEU 85 HD21 LEU 85 0.378 2.701 4.577 645 HD22 LEU 85 HD22 LEU 85 -1.290 2.941 4.056 646 HD23 LEU 85 HD23 LEU 85 -0.483 1.402 3.754 647 H THR 86 H THR 86 -0.459 3.547 9.608 648 HA THR 86 HA THR 86 -1.767 6.025 9.835 649 HB THR 86 HB THR 86 -0.607 4.345 12.084 650 HG1 THR 86 HG1 THR 86 -2.344 3.528 10.593 651 HG21 THR 86 HG21 THR 86 -2.165 5.549 13.545 652 HG22 THR 86 HG22 THR 86 -2.695 6.539 12.183 653 HG23 THR 86 HG23 THR 86 -1.048 6.687 12.784 654 H ILE 87 H ILE 87 1.634 5.193 10.604 655 HA ILE 87 HA ILE 87 2.163 7.701 11.731 656 HB ILE 87 HB ILE 87 3.630 5.838 12.248 657 HG12 ILE 87 HG12 ILE 87 4.648 8.192 12.247 658 HG13 ILE 87 HG13 ILE 87 5.769 6.846 12.287 659 HG21 ILE 87 HG21 ILE 87 4.455 5.783 9.386 660 HG22 ILE 87 HG22 ILE 87 3.604 4.534 10.286 661 HG23 ILE 87 HG23 ILE 87 5.291 4.925 10.668 662 HD11 ILE 87 HD11 ILE 87 6.526 8.665 10.830 663 HD12 ILE 87 HD12 ILE 87 5.072 8.490 9.852 664 HD13 ILE 87 HD13 ILE 87 6.259 7.187 9.907 665 H LEU 88 H LEU 88 2.640 6.622 8.390 666 HA LEU 88 HA LEU 88 3.665 9.112 7.475 667 HB2 LEU 88 HB2 LEU 88 2.375 6.822 6.112 668 HB3 LEU 88 HB3 LEU 88 2.716 8.286 5.228 669 HG LEU 88 HG LEU 88 4.347 6.690 4.752 670 HD11 LEU 88 HD11 LEU 88 5.498 8.739 6.626 671 HD12 LEU 88 HD12 LEU 88 5.174 8.947 4.907 672 HD13 LEU 88 HD13 LEU 88 6.424 7.824 5.441 673 HD21 LEU 88 HD21 LEU 88 4.997 6.515 7.663 674 HD22 LEU 88 HD22 LEU 88 5.744 5.587 6.369 675 HD23 LEU 88 HD23 LEU 88 4.049 5.311 6.785 676 H HIS 89 H HIS 89 0.438 7.767 7.581 677 HA HIS 89 HA HIS 89 -0.813 9.799 6.101 678 HB2 HIS 89 HB2 HIS 89 -1.700 7.478 6.638 679 HB3 HIS 89 HB3 HIS 89 -2.077 8.071 8.241 680 HD1 HIS 89 HD1 HIS 89 -4.607 7.944 8.104 681 HD2 HIS 89 HD2 HIS 89 -2.907 9.965 4.901 682 HE1 HIS 89 HE1 HIS 89 -6.525 8.861 6.751 683 H ASP 90 H ASP 90 -0.084 9.402 9.495 684 HA ASP 90 HA ASP 90 -1.428 11.735 10.420 685 HB2 ASP 90 HB2 ASP 90 -0.889 9.965 11.978 686 HB3 ASP 90 HB3 ASP 90 0.821 10.094 11.595 687 H GLY 91 H GLY 91 1.707 11.103 9.072 688 HA2 GLY 91 HA2 GLY 91 2.818 13.677 9.731 689 HA3 GLY 91 HA3 GLY 91 3.534 12.473 8.672 690 H GLY 92 H GLY 92 0.640 12.655 7.401 691 HA2 GLY 92 HA2 GLY 92 -0.469 14.193 5.954 692 HA3 GLY 92 HA3 GLY 92 0.960 15.207 5.996 693 H TYR 93 H TYR 93 0.847 11.753 5.291 694 HA TYR 93 HA TYR 93 1.594 12.380 2.530 695 HB2 TYR 93 HB2 TYR 93 2.564 10.158 4.335 696 HB3 TYR 93 HB3 TYR 93 2.793 10.124 2.589 697 HD1 TYR 93 HD1 TYR 93 3.638 12.022 5.678 698 HD2 TYR 93 HD2 TYR 93 4.534 11.334 1.581 699 HE1 TYR 93 HE1 TYR 93 5.678 13.371 5.902 700 HE2 TYR 93 HE2 TYR 93 6.578 12.674 1.797 701 HH TYR 93 HH TYR 93 7.865 13.573 4.775 702 H ARG 94 H ARG 94 0.515 11.373 0.959 703 HA ARG 94 HA ARG 94 -1.939 10.031 1.757 704 HB2 ARG 94 HB2 ARG 94 -2.580 10.156 -0.626 705 HB3 ARG 94 HB3 ARG 94 -2.090 11.728 -0.013 706 HG2 ARG 94 HG2 ARG 94 0.119 11.380 -1.038 707 HG3 ARG 94 HG3 ARG 94 -0.454 9.857 -1.684 708 HD2 ARG 94 HD2 ARG 94 -0.500 11.741 -3.306 709 HD3 ARG 94 HD3 ARG 94 -2.043 10.934 -3.077 710 HE ARG 94 HE ARG 94 -2.911 12.885 -2.457 711 HH11 ARG 94 HH11 ARG 94 0.466 13.229 -1.273 712 HH12 ARG 94 HH12 ARG 94 0.433 14.915 -1.391 713 HH21 ARG 94 HH21 ARG 94 -2.882 15.237 -2.534 714 HH22 ARG 94 HH22 ARG 94 -1.475 16.081 -2.089 715 H ASP 95 H ASP 95 -2.640 8.198 0.331 716 HA ASP 95 HA ASP 95 -1.285 5.882 0.996 717 HB2 ASP 95 HB2 ASP 95 -2.750 4.825 -0.850 718 HB3 ASP 95 HB3 ASP 95 -3.553 5.628 0.489 719 H THR 96 H THR 96 -1.270 7.511 -2.099 720 HA THR 96 HA THR 96 0.315 5.706 -3.508 721 HB THR 96 HB THR 96 0.122 8.695 -3.978 722 HG1 THR 96 HG1 THR 96 -1.875 7.072 -3.844 723 HG21 THR 96 HG21 THR 96 0.621 6.391 -5.886 724 HG22 THR 96 HG22 THR 96 1.854 7.501 -5.291 725 HG23 THR 96 HG23 THR 96 0.552 8.105 -6.312 726 H GLU 97 H GLU 97 1.151 8.487 -1.516 727 HA GLU 97 HA GLU 97 3.897 8.519 -2.112 728 HB2 GLU 97 HB2 GLU 97 2.397 9.561 0.268 729 HB3 GLU 97 HB3 GLU 97 4.101 9.862 -0.051 730 HG2 GLU 97 HG2 GLU 97 3.545 10.998 -2.095 731 HG3 GLU 97 HG3 GLU 97 1.836 10.640 -1.852 732 H ILE 98 H ILE 98 1.968 6.724 0.230 733 HA ILE 98 HA ILE 98 4.080 5.976 1.977 734 HB ILE 98 HB ILE 98 1.910 4.009 1.296 735 HG12 ILE 98 HG12 ILE 98 0.633 6.050 1.574 736 HG13 ILE 98 HG13 ILE 98 0.435 5.021 2.994 737 HG21 ILE 98 HG21 ILE 98 2.068 3.447 3.668 738 HG22 ILE 98 HG22 ILE 98 3.284 4.703 3.871 739 HG23 ILE 98 HG23 ILE 98 3.619 3.315 2.837 740 HD11 ILE 98 HD11 ILE 98 2.182 7.447 2.785 741 HD12 ILE 98 HD12 ILE 98 1.996 6.411 4.197 742 HD13 ILE 98 HD13 ILE 98 0.619 7.343 3.606 743 H MET 99 H MET 99 2.594 4.338 -0.833 744 HA MET 99 HA MET 99 4.531 2.310 -0.786 745 HB2 MET 99 HB2 MET 99 3.460 1.531 -2.814 746 HB3 MET 99 HB3 MET 99 2.303 1.841 -1.526 747 HG2 MET 99 HG2 MET 99 1.807 4.025 -2.626 748 HG3 MET 99 HG3 MET 99 2.835 3.516 -3.964 749 HE1 MET 99 HE1 MET 99 2.011 0.359 -3.517 750 HE2 MET 99 HE2 MET 99 2.394 1.045 -5.094 751 HE3 MET 99 HE3 MET 99 0.886 0.132 -4.871 752 H ARG 100 H ARG 100 4.583 5.452 -2.006 753 HA ARG 100 HA ARG 100 6.003 5.254 -4.407 754 HB2 ARG 100 HB2 ARG 100 4.868 7.257 -3.506 755 HB3 ARG 100 HB3 ARG 100 6.133 7.414 -2.302 756 HG2 ARG 100 HG2 ARG 100 7.748 7.807 -4.110 757 HG3 ARG 100 HG3 ARG 100 6.426 7.697 -5.282 758 HD2 ARG 100 HD2 ARG 100 5.276 9.533 -4.065 759 HD3 ARG 100 HD3 ARG 100 6.694 9.680 -3.037 760 HE ARG 100 HE ARG 100 7.220 9.903 -5.858 761 HH11 ARG 100 HH11 ARG 100 6.450 11.662 -2.865 762 HH12 ARG 100 HH12 ARG 100 6.937 13.164 -3.489 763 HH21 ARG 100 HH21 ARG 100 7.910 12.037 -6.670 764 HH22 ARG 100 HH22 ARG 100 7.740 13.385 -5.642 765 H TRP 101 H TRP 101 7.353 6.160 -1.239 766 HA TRP 101 HA TRP 101 9.983 5.572 -2.097 767 HB2 TRP 101 HB2 TRP 101 10.594 5.881 0.378 768 HB3 TRP 101 HB3 TRP 101 9.927 7.264 -0.471 769 HD1 TRP 101 HD1 TRP 101 7.734 8.295 0.447 770 HE1 TRP 101 HE1 TRP 101 6.248 7.818 2.468 771 HE3 TRP 101 HE3 TRP 101 9.747 3.816 1.920 772 HZ2 TRP 101 HZ2 TRP 101 5.984 5.827 4.426 773 HZ3 TRP 101 HZ3 TRP 101 8.814 2.708 3.859 774 HH2 TRP 101 HH2 TRP 101 6.967 3.688 5.108 775 H LEU 102 H LEU 102 7.575 3.719 -0.486 776 HA LEU 102 HA LEU 102 9.115 1.652 0.560 777 HB2 LEU 102 HB2 LEU 102 6.359 2.030 -0.242 778 HB3 LEU 102 HB3 LEU 102 6.832 0.341 -0.166 779 HG LEU 102 HG LEU 102 6.976 2.372 2.075 780 HD11 LEU 102 HD11 LEU 102 4.702 1.792 1.461 781 HD12 LEU 102 HD12 LEU 102 5.147 1.132 3.036 782 HD13 LEU 102 HD13 LEU 102 5.086 0.072 1.617 783 HD21 LEU 102 HD21 LEU 102 7.537 -0.585 2.006 784 HD22 LEU 102 HD22 LEU 102 7.370 0.384 3.475 785 HD23 LEU 102 HD23 LEU 102 8.673 0.727 2.352 786 H PHE 103 H PHE 103 7.896 2.042 -2.742 787 HA PHE 103 HA PHE 103 9.056 -0.495 -3.461 788 HB2 PHE 103 HB2 PHE 103 7.446 1.517 -4.996 789 HB3 PHE 103 HB3 PHE 103 8.266 0.193 -5.813 790 HD1 PHE 103 HD1 PHE 103 5.882 0.816 -2.995 791 HD2 PHE 103 HD2 PHE 103 7.169 -1.811 -6.082 792 HE1 PHE 103 HE1 PHE 103 3.977 -0.654 -2.536 793 HE2 PHE 103 HE2 PHE 103 5.248 -3.277 -5.613 794 HZ PHE 103 HZ PHE 103 3.664 -2.696 -3.841 795 H THR 104 H THR 104 10.329 2.435 -2.985 796 HA THR 104 HA THR 104 12.199 2.416 -5.193 797 HB THR 104 HB THR 104 12.129 4.134 -2.680 798 HG1 THR 104 HG1 THR 104 10.270 4.246 -4.297 799 HG21 THR 104 HG21 THR 104 13.551 4.542 -5.323 800 HG22 THR 104 HG22 THR 104 14.322 4.127 -3.794 801 HG23 THR 104 HG23 THR 104 13.530 5.692 -3.988 802 HA PRO 105 HA PRO 105 14.820 -0.528 -2.916 803 HB2 PRO 105 HB2 PRO 105 16.958 0.667 -4.589 804 HB3 PRO 105 HB3 PRO 105 16.490 -1.027 -4.422 805 HG2 PRO 105 HG2 PRO 105 15.905 0.361 -6.628 806 HG3 PRO 105 HG3 PRO 105 14.786 -0.845 -5.973 807 HD2 PRO 105 HD2 PRO 105 14.656 2.128 -5.842 808 HD3 PRO 105 HD3 PRO 105 13.349 0.933 -6.007 809 H ASP 106 H ASP 106 15.950 -0.252 -1.051 810 HA ASP 106 HA ASP 106 16.641 2.492 -0.351 811 HB2 ASP 106 HB2 ASP 106 15.273 1.093 1.204 812 HB3 ASP 106 HB3 ASP 106 16.663 0.038 1.403 813 HA PRO 107 HA PRO 107 20.846 1.655 -1.497 814 HB2 PRO 107 HB2 PRO 107 21.952 3.863 -0.303 815 HB3 PRO 107 HB3 PRO 107 21.148 3.880 -1.874 816 HG2 PRO 107 HG2 PRO 107 20.072 4.642 0.809 817 HG3 PRO 107 HG3 PRO 107 19.846 5.443 -0.755 818 HD2 PRO 107 HD2 PRO 107 17.960 3.889 0.325 819 HD3 PRO 107 HD3 PRO 107 18.223 3.931 -1.432 820 H SER 108 H SER 108 19.781 1.789 1.806 821 HA SER 108 HA SER 108 22.376 0.690 2.617 822 HB2 SER 108 HB2 SER 108 20.502 2.388 4.265 823 HB3 SER 108 HB3 SER 108 22.085 1.784 4.758 824 HG SER 108 HG SER 108 23.027 3.036 3.129 825 H LEU 109 H LEU 109 19.576 -0.443 1.779 826 HA LEU 109 HA LEU 109 19.090 -1.890 4.264 827 HB2 LEU 109 HB2 LEU 109 17.202 -0.728 3.238 828 HB3 LEU 109 HB3 LEU 109 17.369 -1.772 1.823 829 HG LEU 109 HG LEU 109 16.984 -3.711 3.355 830 HD11 LEU 109 HD11 LEU 109 16.183 -1.531 5.270 831 HD12 LEU 109 HD12 LEU 109 17.511 -2.680 5.468 832 HD13 LEU 109 HD13 LEU 109 15.843 -3.248 5.477 833 HD21 LEU 109 HD21 LEU 109 15.299 -2.891 1.887 834 HD22 LEU 109 HD22 LEU 109 14.816 -1.662 3.069 835 HD23 LEU 109 HD23 LEU 109 14.592 -3.385 3.432 836 H THR 110 H THR 110 19.944 -3.705 4.414 837 HA THR 110 HA THR 110 20.240 -5.460 2.075 838 HB THR 110 HB THR 110 22.114 -5.295 4.456 839 HG1 THR 110 HG1 THR 110 22.010 -3.673 2.453 840 HG21 THR 110 HG21 THR 110 22.339 -6.873 1.877 841 HG22 THR 110 HG22 THR 110 21.987 -7.543 3.471 842 HG23 THR 110 HG23 THR 110 23.559 -6.810 3.147 843 H ILE 111 H ILE 111 18.841 -7.046 2.333 844 HA ILE 111 HA ILE 111 18.251 -8.040 5.034 845 HB ILE 111 HB ILE 111 15.826 -8.095 4.469 846 HG12 ILE 111 HG12 ILE 111 16.615 -6.161 2.281 847 HG13 ILE 111 HG13 ILE 111 16.087 -7.818 2.026 848 HG21 ILE 111 HG21 ILE 111 15.401 -5.744 5.026 849 HG22 ILE 111 HG22 ILE 111 17.116 -5.399 4.758 850 HG23 ILE 111 HG23 ILE 111 16.622 -6.511 6.038 851 HD11 ILE 111 HD11 ILE 111 14.459 -5.580 3.189 852 HD12 ILE 111 HD12 ILE 111 13.899 -7.238 2.968 853 HD13 ILE 111 HD13 ILE 111 14.307 -6.251 1.565 854 H THR 112 H THR 112 17.063 -9.996 5.035 855 HA THR 112 HA THR 112 17.435 -11.661 2.701 856 HB THR 112 HB THR 112 17.906 -12.628 4.940 857 HG1 THR 112 HG1 THR 112 17.300 -14.194 3.661 858 HG21 THR 112 HG21 THR 112 16.305 -11.298 6.267 859 HG22 THR 112 HG22 THR 112 16.115 -13.028 6.574 860 HG23 THR 112 HG23 THR 112 14.975 -12.181 5.528 861 H ARG 113 H ARG 113 15.483 -12.697 1.845 862 HA ARG 113 HA ARG 113 13.250 -10.764 1.929 863 HB2 ARG 113 HB2 ARG 113 14.910 -10.986 -0.119 864 HB3 ARG 113 HB3 ARG 113 13.943 -12.408 -0.469 865 HG2 ARG 113 HG2 ARG 113 11.973 -11.090 -0.693 866 HG3 ARG 113 HG3 ARG 113 12.838 -9.637 -0.175 867 HD2 ARG 113 HD2 ARG 113 14.390 -10.087 -2.166 868 HD3 ARG 113 HD3 ARG 113 13.136 -11.198 -2.724 869 HE ARG 113 HE ARG 113 11.695 -9.039 -2.283 870 HH11 ARG 113 HH11 ARG 113 14.685 -9.425 -4.149 871 HH12 ARG 113 HH12 ARG 113 14.536 -7.918 -4.934 872 HH21 ARG 113 HH21 ARG 113 11.561 -6.965 -3.310 873 HH22 ARG 113 HH22 ARG 113 12.743 -6.501 -4.468 874 H ASP 114 H ASP 114 11.166 -11.945 0.996 875 HA ASP 114 HA ASP 114 11.048 -14.528 2.297 876 HB2 ASP 114 HB2 ASP 114 9.110 -12.976 2.541 877 HB3 ASP 114 HB3 ASP 114 8.869 -13.035 0.798 878 H GLY 115 H GLY 115 12.226 -15.854 1.149 879 HA2 GLY 115 HA2 GLY 115 11.804 -17.513 -0.681 880 HA3 GLY 115 HA3 GLY 115 11.657 -16.099 -1.730 881 H SER 116 H SER 116 13.578 -14.482 -1.263 882 HA SER 116 HA SER 116 15.996 -15.917 -1.840 883 HB2 SER 116 HB2 SER 116 15.730 -12.951 -1.255 884 HB3 SER 116 HB3 SER 116 16.934 -13.758 -2.250 885 HG SER 116 HG SER 116 14.923 -14.451 -3.489 886 H ARG 117 H ARG 117 16.728 -16.981 -0.094 887 HA ARG 117 HA ARG 117 16.354 -16.013 2.580 888 HB2 ARG 117 HB2 ARG 117 17.543 -18.055 3.286 889 HB3 ARG 117 HB3 ARG 117 16.229 -18.392 2.171 890 HG2 ARG 117 HG2 ARG 117 17.820 -18.643 0.352 891 HG3 ARG 117 HG3 ARG 117 19.153 -18.289 1.458 892 HD2 ARG 117 HD2 ARG 117 18.537 -20.267 2.771 893 HD3 ARG 117 HD3 ARG 117 17.238 -20.604 1.623 894 HE ARG 117 HE ARG 117 19.623 -20.338 0.236 895 HH11 ARG 117 HH11 ARG 117 18.103 -22.626 2.499 896 HH12 ARG 117 HH12 ARG 117 18.916 -23.985 1.898 897 HH21 ARG 117 HH21 ARG 117 20.769 -22.246 -0.586 898 HH22 ARG 117 HH22 ARG 117 20.468 -23.759 0.143 899 H ASP 118 H ASP 118 18.841 -15.957 0.268 900 HA ASP 118 HA ASP 118 20.974 -15.276 2.061 901 HB2 ASP 118 HB2 ASP 118 21.279 -16.432 -0.126 902 HB3 ASP 118 HB3 ASP 118 20.799 -14.949 -0.942 903 H ALA 119 H ALA 119 22.032 -13.189 2.086 904 HA ALA 119 HA ALA 119 20.102 -11.127 2.425 905 HB1 ALA 119 HB1 ALA 119 22.036 -11.355 3.921 906 HB2 ALA 119 HB2 ALA 119 21.939 -9.750 3.202 907 HB3 ALA 119 HB3 ALA 119 23.104 -10.922 2.584 908 H VAL 120 H VAL 120 19.438 -9.679 1.076 909 HA VAL 120 HA VAL 120 20.889 -9.237 -1.418 910 HB VAL 120 HB VAL 120 17.978 -8.679 -0.750 911 HG11 VAL 120 HG11 VAL 120 17.694 -8.278 -3.146 912 HG12 VAL 120 HG12 VAL 120 19.420 -8.535 -3.390 913 HG13 VAL 120 HG13 VAL 120 18.862 -7.154 -2.443 914 HG21 VAL 120 HG21 VAL 120 17.458 -10.557 -2.257 915 HG22 VAL 120 HG22 VAL 120 18.404 -11.079 -0.861 916 HG23 VAL 120 HG23 VAL 120 19.182 -10.881 -2.430 917 H SER 121 H SER 121 21.881 -7.339 -1.588 918 HA SER 121 HA SER 121 21.499 -5.254 0.376 919 HB2 SER 121 HB2 SER 121 23.387 -5.439 -1.976 920 HB3 SER 121 HB3 SER 121 23.502 -4.314 -0.623 921 HG SER 121 HG SER 121 24.682 -5.782 0.220 922 H ASN 122 H ASN 122 20.909 -3.098 -0.167 923 HA ASN 122 HA ASN 122 19.672 -1.506 -1.079 924 HB2 ASN 122 HB2 ASN 122 21.001 -2.554 -3.584 925 HB3 ASN 122 HB3 ASN 122 19.879 -1.198 -3.587 926 HD21 ASN 122 HD21 ASN 122 21.408 0.230 -4.293 927 HD22 ASN 122 HD22 ASN 122 22.692 0.815 -3.310 928 H ALA 123 H ALA 123 18.262 -3.595 -0.393 929 HA ALA 123 HA ALA 123 16.590 -4.481 -2.573 930 HB1 ALA 123 HB1 ALA 123 16.396 -5.094 0.366 931 HB2 ALA 123 HB2 ALA 123 17.263 -6.055 -0.828 932 HB3 ALA 123 HB3 ALA 123 15.507 -5.899 -0.924 933 H ARG 124 H ARG 124 14.168 -4.602 -1.959 934 HA ARG 124 HA ARG 124 13.248 -1.877 -1.754 935 HB2 ARG 124 HB2 ARG 124 12.424 -3.288 -3.550 936 HB3 ARG 124 HB3 ARG 124 11.849 -4.477 -2.399 937 HG2 ARG 124 HG2 ARG 124 10.215 -2.865 -1.558 938 HG3 ARG 124 HG3 ARG 124 10.792 -1.681 -2.729 939 HD2 ARG 124 HD2 ARG 124 8.766 -2.797 -3.526 940 HD3 ARG 124 HD3 ARG 124 10.161 -3.158 -4.552 941 HE ARG 124 HE ARG 124 9.954 -5.167 -2.618 942 HH11 ARG 124 HH11 ARG 124 8.240 -4.120 -5.554 943 HH12 ARG 124 HH12 ARG 124 7.522 -5.669 -5.783 944 HH21 ARG 124 HH21 ARG 124 9.022 -7.208 -2.994 945 HH22 ARG 124 HH22 ARG 124 7.994 -7.450 -4.346 946 HA PRO 125 HA PRO 125 12.382 -2.131 2.680 947 HB2 PRO 125 HB2 PRO 125 10.391 -0.084 1.822 948 HB3 PRO 125 HB3 PRO 125 11.507 -0.044 3.196 949 HG2 PRO 125 HG2 PRO 125 12.064 1.347 1.037 950 HG3 PRO 125 HG3 PRO 125 13.344 0.411 1.834 951 HD2 PRO 125 HD2 PRO 125 11.848 -0.191 -0.684 952 HD3 PRO 125 HD3 PRO 125 13.556 -0.465 -0.284 953 H VAL 126 H VAL 126 9.839 -2.313 0.253 954 HA VAL 126 HA VAL 126 7.684 -3.087 1.910 955 HB VAL 126 HB VAL 126 8.196 -3.976 -0.956 956 HG11 VAL 126 HG11 VAL 126 5.777 -4.357 -1.072 957 HG12 VAL 126 HG12 VAL 126 5.637 -3.976 0.645 958 HG13 VAL 126 HG13 VAL 126 6.545 -5.398 0.128 959 HG21 VAL 126 HG21 VAL 126 6.686 -2.175 -1.587 960 HG22 VAL 126 HG22 VAL 126 8.094 -1.551 -0.727 961 HG23 VAL 126 HG23 VAL 126 6.542 -1.706 0.105 962 H ASP 127 H ASP 127 10.268 -4.936 0.441 963 HA ASP 127 HA ASP 127 9.231 -7.468 1.140 964 HB2 ASP 127 HB2 ASP 127 12.017 -6.620 0.388 965 HB3 ASP 127 HB3 ASP 127 11.507 -8.293 0.618 966 H ALA 128 H ALA 128 11.195 -5.142 2.743 967 HA ALA 128 HA ALA 128 12.192 -6.812 4.794 968 HB1 ALA 128 HB1 ALA 128 12.670 -4.755 6.024 969 HB2 ALA 128 HB2 ALA 128 11.645 -3.846 4.915 970 HB3 ALA 128 HB3 ALA 128 13.135 -4.577 4.331 971 H LEU 129 H LEU 129 9.285 -4.798 4.553 972 HA LEU 129 HA LEU 129 8.404 -5.499 7.185 973 HB2 LEU 129 HB2 LEU 129 6.329 -4.368 6.663 974 HB3 LEU 129 HB3 LEU 129 7.668 -3.399 6.110 975 HG LEU 129 HG LEU 129 7.129 -4.638 3.845 976 HD11 LEU 129 HD11 LEU 129 4.451 -4.587 5.212 977 HD12 LEU 129 HD12 LEU 129 5.388 -6.007 4.768 978 HD13 LEU 129 HD13 LEU 129 4.739 -4.952 3.500 979 HD21 LEU 129 HD21 LEU 129 5.598 -2.264 4.908 980 HD22 LEU 129 HD22 LEU 129 5.742 -2.694 3.204 981 HD23 LEU 129 HD23 LEU 129 7.175 -2.229 4.119 982 H HIS 130 H HIS 130 7.928 -6.800 4.015 983 HA HIS 130 HA HIS 130 5.916 -8.691 4.628 984 HB2 HIS 130 HB2 HIS 130 6.509 -7.893 2.335 985 HB3 HIS 130 HB3 HIS 130 8.052 -8.719 2.474 986 HD1 HIS 130 HD1 HIS 130 8.028 -10.825 1.141 987 HD2 HIS 130 HD2 HIS 130 4.312 -9.931 2.738 988 HE1 HIS 130 HE1 HIS 130 6.477 -12.657 0.367 989 H ALA 131 H ALA 131 9.302 -8.544 5.043 990 HA ALA 131 HA ALA 131 9.575 -11.366 5.765 991 HB1 ALA 131 HB1 ALA 131 11.327 -10.341 4.384 992 HB2 ALA 131 HB2 ALA 131 11.977 -10.909 5.924 993 HB3 ALA 131 HB3 ALA 131 11.665 -9.190 5.675 994 H HIS 132 H HIS 132 8.371 -8.849 7.295 995 HA HIS 132 HA HIS 132 7.873 -8.341 9.421 996 HB2 HIS 132 HB2 HIS 132 9.163 -11.011 10.019 997 HB3 HIS 132 HB3 HIS 132 8.376 -10.031 11.254 998 HD1 HIS 132 HD1 HIS 132 7.614 -12.410 8.473 999 HD2 HIS 132 HD2 HIS 132 5.577 -9.723 10.899 1000 HE1 HIS 132 HE1 HIS 132 5.183 -12.957 8.231 1001 H GLN 133 H GLN 133 10.233 -7.367 8.255 1002 HA GLN 133 HA GLN 133 11.769 -6.641 10.655 1003 HB2 GLN 133 HB2 GLN 133 12.507 -6.340 7.730 1004 HB3 GLN 133 HB3 GLN 133 13.524 -5.882 9.088 1005 HG2 GLN 133 HG2 GLN 133 13.530 -8.274 9.788 1006 HG3 GLN 133 HG3 GLN 133 12.686 -8.656 8.288 1007 HE21 GLN 133 HE21 GLN 133 14.350 -9.902 7.519 1008 HE22 GLN 133 HE22 GLN 133 15.849 -9.235 6.984 1009 H ALA 134 H ALA 134 9.185 -5.782 9.866 1010 HA ALA 134 HA ALA 134 8.942 -3.468 8.370 1011 HB1 ALA 134 HB1 ALA 134 7.063 -4.886 9.054 1012 HB2 ALA 134 HB2 ALA 134 6.780 -3.180 9.401 1013 HB3 ALA 134 HB3 ALA 134 7.223 -4.281 10.702 1014 H ARG 135 H ARG 135 9.954 -3.771 11.709 1015 HA ARG 135 HA ARG 135 9.496 -1.136 12.582 1016 HB2 ARG 135 HB2 ARG 135 11.751 -2.982 13.369 1017 HB3 ARG 135 HB3 ARG 135 11.332 -1.504 14.213 1018 HG2 ARG 135 HG2 ARG 135 9.167 -2.408 14.786 1019 HG3 ARG 135 HG3 ARG 135 9.521 -3.881 13.881 1020 HD2 ARG 135 HD2 ARG 135 11.444 -4.280 15.382 1021 HD3 ARG 135 HD3 ARG 135 10.969 -2.863 16.315 1022 HE ARG 135 HE ARG 135 8.745 -4.181 16.468 1023 HH11 ARG 135 HH11 ARG 135 12.040 -5.501 16.744 1024 HH12 ARG 135 HH12 ARG 135 11.558 -6.815 17.707 1025 HH21 ARG 135 HH21 ARG 135 8.132 -6.049 17.793 1026 HH22 ARG 135 HH22 ARG 135 9.350 -7.141 18.291 1027 H GLU 136 H GLU 136 12.104 -2.452 10.662 1028 HA GLU 136 HA GLU 136 13.732 -0.115 10.783 1029 HB2 GLU 136 HB2 GLU 136 13.741 -2.541 8.982 1030 HB3 GLU 136 HB3 GLU 136 14.850 -1.207 8.735 1031 HG2 GLU 136 HG2 GLU 136 15.861 -3.081 9.975 1032 HG3 GLU 136 HG3 GLU 136 15.871 -1.578 10.887 1033 H VAL 137 H VAL 137 11.186 -1.244 8.794 1034 HA VAL 137 HA VAL 137 11.428 0.705 6.722 1035 HB VAL 137 HB VAL 137 8.997 -0.897 7.592 1036 HG11 VAL 137 HG11 VAL 137 8.384 1.029 6.231 1037 HG12 VAL 137 HG12 VAL 137 8.140 -0.479 5.349 1038 HG13 VAL 137 HG13 VAL 137 9.541 0.532 4.994 1039 HG21 VAL 137 HG21 VAL 137 9.578 -2.410 5.744 1040 HG22 VAL 137 HG22 VAL 137 10.836 -2.358 6.981 1041 HG23 VAL 137 HG23 VAL 137 11.045 -1.481 5.463 1042 H VAL 138 H VAL 138 9.539 0.349 9.666 1043 HA VAL 138 HA VAL 138 8.087 2.728 9.547 1044 HB VAL 138 HB VAL 138 9.057 1.259 12.030 1045 HG11 VAL 138 HG11 VAL 138 7.240 2.405 13.226 1046 HG12 VAL 138 HG12 VAL 138 6.850 3.310 11.764 1047 HG13 VAL 138 HG13 VAL 138 8.398 3.562 12.566 1048 HG21 VAL 138 HG21 VAL 138 7.659 -0.136 10.597 1049 HG22 VAL 138 HG22 VAL 138 6.416 1.116 10.571 1050 HG23 VAL 138 HG23 VAL 138 6.801 0.287 12.079 1051 H ARG 139 H ARG 139 11.281 2.051 10.898 1052 HA ARG 139 HA ARG 139 11.768 4.600 11.925 1053 HB2 ARG 139 HB2 ARG 139 13.158 2.638 12.434 1054 HB3 ARG 139 HB3 ARG 139 13.788 2.666 10.789 1055 HG2 ARG 139 HG2 ARG 139 14.655 4.934 11.202 1056 HG3 ARG 139 HG3 ARG 139 14.119 4.800 12.869 1057 HD2 ARG 139 HD2 ARG 139 15.603 2.911 13.213 1058 HD3 ARG 139 HD3 ARG 139 16.116 2.995 11.521 1059 HE ARG 139 HE ARG 139 16.399 5.442 12.952 1060 HH11 ARG 139 HH11 ARG 139 18.020 2.409 12.205 1061 HH12 ARG 139 HH12 ARG 139 19.587 3.015 12.459 1062 HH21 ARG 139 HH21 ARG 139 18.505 6.285 13.255 1063 HH22 ARG 139 HH22 ARG 139 19.879 5.287 13.066 1064 H ARG 140 H ARG 140 12.576 3.295 8.683 1065 HA ARG 140 HA ARG 140 13.690 5.674 7.647 1066 HB2 ARG 140 HB2 ARG 140 13.965 3.567 6.424 1067 HB3 ARG 140 HB3 ARG 140 12.229 3.431 6.199 1068 HG2 ARG 140 HG2 ARG 140 13.174 4.133 4.121 1069 HG3 ARG 140 HG3 ARG 140 12.319 5.513 4.803 1070 HD2 ARG 140 HD2 ARG 140 14.321 6.436 4.016 1071 HD3 ARG 140 HD3 ARG 140 14.632 6.210 5.730 1072 HE ARG 140 HE ARG 140 15.467 4.021 4.012 1073 HH11 ARG 140 HH11 ARG 140 16.530 7.001 5.602 1074 HH12 ARG 140 HH12 ARG 140 18.186 6.643 5.447 1075 HH21 ARG 140 HH21 ARG 140 17.646 3.587 3.717 1076 HH22 ARG 140 HH22 ARG 140 18.861 4.661 4.287 1077 H ALA 141 H ALA 141 10.400 4.494 7.815 1078 HA ALA 141 HA ALA 141 9.053 6.429 6.330 1079 HB1 ALA 141 HB1 ALA 141 7.966 4.411 7.030 1080 HB2 ALA 141 HB2 ALA 141 7.117 5.793 7.772 1081 HB3 ALA 141 HB3 ALA 141 8.225 4.824 8.721 1082 H GLN 142 H GLN 142 9.780 6.307 9.792 1083 HA GLN 142 HA GLN 142 8.603 8.716 10.580 1084 HB2 GLN 142 HB2 GLN 142 11.049 7.359 11.718 1085 HB3 GLN 142 HB3 GLN 142 10.138 8.633 12.518 1086 HG2 GLN 142 HG2 GLN 142 8.206 7.244 12.680 1087 HG3 GLN 142 HG3 GLN 142 8.959 6.001 11.685 1088 HE21 GLN 142 HE21 GLN 142 7.862 5.762 14.305 1089 HE22 GLN 142 HE22 GLN 142 9.120 5.255 15.353 1090 H ALA 143 H ALA 143 11.846 8.105 9.359 1091 HA ALA 143 HA ALA 143 12.844 10.733 9.680 1092 HB1 ALA 143 HB1 ALA 143 13.697 8.598 7.730 1093 HB2 ALA 143 HB2 ALA 143 14.291 8.786 9.379 1094 HB3 ALA 143 HB3 ALA 143 14.632 10.028 8.173 1095 H MET 144 H MET 144 11.103 9.151 7.117 1096 HA MET 144 HA MET 144 11.404 11.327 5.255 1097 HB2 MET 144 HB2 MET 144 11.180 9.010 4.472 1098 HB3 MET 144 HB3 MET 144 9.587 8.903 5.196 1099 HG2 MET 144 HG2 MET 144 9.388 9.209 2.815 1100 HG3 MET 144 HG3 MET 144 8.784 10.635 3.647 1101 HE1 MET 144 HE1 MET 144 8.870 12.050 1.403 1102 HE2 MET 144 HE2 MET 144 9.446 10.625 0.537 1103 HE3 MET 144 HE3 MET 144 10.296 12.160 0.371 1104 H ALA 145 H ALA 145 9.013 10.237 7.541 1105 HA ALA 145 HA ALA 145 6.898 11.861 6.603 1106 HB1 ALA 145 HB1 ALA 145 6.571 9.791 7.901 1107 HB2 ALA 145 HB2 ALA 145 5.674 11.174 8.527 1108 HB3 ALA 145 HB3 ALA 145 7.150 10.641 9.332 1109 H TYR 146 H TYR 146 9.118 12.236 9.360 1110 HA TYR 146 HA TYR 146 7.939 14.890 9.756 1111 HB2 TYR 146 HB2 TYR 146 9.577 13.252 11.711 1112 HB3 TYR 146 HB3 TYR 146 8.789 14.784 12.045 1113 HD1 TYR 146 HD1 TYR 146 6.239 14.844 12.041 1114 HD2 TYR 146 HD2 TYR 146 8.449 11.209 11.954 1115 HE1 TYR 146 HE1 TYR 146 4.250 13.619 12.809 1116 HE2 TYR 146 HE2 TYR 146 6.467 9.979 12.722 1117 HH TYR 146 HH TYR 146 3.322 11.365 12.836 Start of MODEL 20 1 H MET 1 H MET 1 -11.953 -2.543 -15.622 2 HA MET 1 HA MET 1 -11.772 -0.934 -17.438 3 HB2 MET 1 HB2 MET 1 -14.107 -0.439 -15.575 4 HB3 MET 1 HB3 MET 1 -14.023 0.137 -17.229 5 HG2 MET 1 HG2 MET 1 -13.966 -2.178 -18.019 6 HG3 MET 1 HG3 MET 1 -14.036 -2.727 -16.344 7 HE1 MET 1 HE1 MET 1 -17.498 -0.441 -18.398 8 HE2 MET 1 HE2 MET 1 -15.955 -0.780 -19.174 9 HE3 MET 1 HE3 MET 1 -16.033 0.364 -17.837 10 HA PRO 2 HA PRO 2 -10.199 2.963 -15.795 11 HB2 PRO 2 HB2 PRO 2 -9.250 3.892 -18.190 12 HB3 PRO 2 HB3 PRO 2 -8.330 2.800 -17.157 13 HG2 PRO 2 HG2 PRO 2 -9.870 2.217 -19.633 14 HG3 PRO 2 HG3 PRO 2 -8.383 1.469 -19.034 15 HD2 PRO 2 HD2 PRO 2 -10.900 0.354 -18.861 16 HD3 PRO 2 HD3 PRO 2 -9.535 -0.076 -17.815 17 H GLY 3 H GLY 3 -12.037 4.122 -15.363 18 HA2 GLY 3 HA2 GLY 3 -13.389 5.296 -17.675 19 HA3 GLY 3 HA3 GLY 3 -14.316 4.487 -16.423 20 H ARG 4 H ARG 4 -13.366 7.341 -17.507 21 HA ARG 4 HA ARG 4 -12.897 8.769 -15.067 22 HB2 ARG 4 HB2 ARG 4 -13.521 9.536 -17.902 23 HB3 ARG 4 HB3 ARG 4 -13.617 10.742 -16.642 24 HG2 ARG 4 HG2 ARG 4 -11.503 10.863 -17.885 25 HG3 ARG 4 HG3 ARG 4 -11.238 10.500 -16.193 26 HD2 ARG 4 HD2 ARG 4 -11.316 8.308 -18.258 27 HD3 ARG 4 HD3 ARG 4 -9.853 9.249 -17.998 28 HE ARG 4 HE ARG 4 -10.962 8.134 -15.589 29 HH11 ARG 4 HH11 ARG 4 -8.851 7.401 -18.336 30 HH12 ARG 4 HH12 ARG 4 -7.876 6.308 -17.496 31 HH21 ARG 4 HH21 ARG 4 -9.660 6.624 -14.432 32 HH22 ARG 4 HH22 ARG 4 -8.350 5.833 -15.212 33 H ALA 5 H ALA 5 -14.446 9.891 -13.835 34 HA ALA 5 HA ALA 5 -17.216 9.350 -14.609 35 HB1 ALA 5 HB1 ALA 5 -16.553 7.742 -12.906 36 HB2 ALA 5 HB2 ALA 5 -17.774 8.858 -12.291 37 HB3 ALA 5 HB3 ALA 5 -16.084 9.060 -11.832 38 HA PRO 6 HA PRO 6 -17.049 13.801 -13.704 39 HB2 PRO 6 HB2 PRO 6 -19.179 13.941 -15.698 40 HB3 PRO 6 HB3 PRO 6 -17.607 14.742 -15.710 41 HG2 PRO 6 HG2 PRO 6 -18.226 12.739 -17.413 42 HG3 PRO 6 HG3 PRO 6 -16.580 12.992 -16.805 43 HD2 PRO 6 HD2 PRO 6 -18.648 11.016 -15.918 44 HD3 PRO 6 HD3 PRO 6 -16.903 10.793 -16.163 45 H GLY 7 H GLY 7 -18.148 14.252 -11.927 46 HA2 GLY 7 HA2 GLY 7 -20.818 14.649 -11.662 47 HA3 GLY 7 HA3 GLY 7 -20.594 12.948 -11.245 48 H SER 8 H SER 8 -20.593 12.758 -9.114 49 HA SER 8 HA SER 8 -18.532 13.997 -7.605 50 HB2 SER 8 HB2 SER 8 -20.273 15.834 -7.669 51 HB3 SER 8 HB3 SER 8 -21.393 14.726 -6.878 52 HG SER 8 HG SER 8 -19.550 16.299 -5.817 53 H THR 9 H THR 9 -17.933 12.430 -6.289 54 HA THR 9 HA THR 9 -19.417 10.103 -5.764 55 HB THR 9 HB THR 9 -17.102 11.310 -4.201 56 HG1 THR 9 HG1 THR 9 -16.048 10.970 -5.992 57 HG21 THR 9 HG21 THR 9 -18.178 9.394 -3.061 58 HG22 THR 9 HG22 THR 9 -16.563 8.971 -3.635 59 HG23 THR 9 HG23 THR 9 -17.988 8.428 -4.521 60 H LEU 10 H LEU 10 -20.568 9.526 -3.816 61 HA LEU 10 HA LEU 10 -21.995 11.652 -2.560 62 HB2 LEU 10 HB2 LEU 10 -21.862 8.717 -1.862 63 HB3 LEU 10 HB3 LEU 10 -23.010 9.855 -1.192 64 HG LEU 10 HG LEU 10 -22.862 8.962 -4.074 65 HD11 LEU 10 HD11 LEU 10 -24.864 8.400 -1.903 66 HD12 LEU 10 HD12 LEU 10 -23.712 7.253 -2.595 67 HD13 LEU 10 HD13 LEU 10 -25.009 7.915 -3.591 68 HD21 LEU 10 HD21 LEU 10 -23.615 11.274 -3.939 69 HD22 LEU 10 HD22 LEU 10 -24.805 10.831 -2.712 70 HD23 LEU 10 HD23 LEU 10 -24.957 10.209 -4.355 71 H ALA 11 H ALA 11 -22.242 11.136 0.056 72 HA ALA 11 HA ALA 11 -19.954 12.298 1.175 73 HB1 ALA 11 HB1 ALA 11 -22.196 10.855 2.580 74 HB2 ALA 11 HB2 ALA 11 -22.196 12.561 2.139 75 HB3 ALA 11 HB3 ALA 11 -21.045 11.958 3.331 76 H ARG 12 H ARG 12 -18.092 11.273 1.193 77 HA ARG 12 HA ARG 12 -18.090 8.484 2.023 78 HB2 ARG 12 HB2 ARG 12 -15.871 8.289 0.963 79 HB3 ARG 12 HB3 ARG 12 -17.150 8.660 -0.182 80 HG2 ARG 12 HG2 ARG 12 -16.360 10.951 -0.327 81 HG3 ARG 12 HG3 ARG 12 -15.164 10.648 0.937 82 HD2 ARG 12 HD2 ARG 12 -14.105 8.949 -0.494 83 HD3 ARG 12 HD3 ARG 12 -15.283 9.287 -1.756 84 HE ARG 12 HE ARG 12 -14.332 11.522 -1.908 85 HH11 ARG 12 HH11 ARG 12 -12.325 9.073 -0.277 86 HH12 ARG 12 HH12 ARG 12 -10.851 9.816 -0.669 87 HH21 ARG 12 HH21 ARG 12 -12.261 12.501 -2.500 88 HH22 ARG 12 HH22 ARG 12 -10.816 11.797 -1.984 89 H VAL 13 H VAL 13 -17.292 7.970 3.888 90 HA VAL 13 HA VAL 13 -15.479 9.872 5.140 91 HB VAL 13 HB VAL 13 -16.257 8.980 7.382 92 HG11 VAL 13 HG11 VAL 13 -18.340 10.275 7.431 93 HG12 VAL 13 HG12 VAL 13 -18.357 10.298 5.668 94 HG13 VAL 13 HG13 VAL 13 -17.062 11.113 6.549 95 HG21 VAL 13 HG21 VAL 13 -17.261 6.865 6.612 96 HG22 VAL 13 HG22 VAL 13 -18.502 7.772 5.750 97 HG23 VAL 13 HG23 VAL 13 -18.428 7.831 7.511 98 H GLY 14 H GLY 14 -13.531 9.200 4.944 99 HA2 GLY 14 HA2 GLY 14 -11.652 7.902 5.236 100 HA3 GLY 14 HA3 GLY 14 -12.652 6.791 6.164 101 H SER 15 H SER 15 -13.579 7.554 2.952 102 HA SER 15 HA SER 15 -13.010 4.774 2.212 103 HB2 SER 15 HB2 SER 15 -15.085 6.588 0.971 104 HB3 SER 15 HB3 SER 15 -14.938 4.845 0.819 105 HG SER 15 HG SER 15 -15.133 5.734 3.403 106 H ILE 16 H ILE 16 -11.424 4.621 0.807 107 HA ILE 16 HA ILE 16 -10.683 7.046 -0.651 108 HB ILE 16 HB ILE 16 -8.863 4.916 0.500 109 HG12 ILE 16 HG12 ILE 16 -9.331 7.760 1.392 110 HG13 ILE 16 HG13 ILE 16 -10.030 6.350 2.166 111 HG21 ILE 16 HG21 ILE 16 -7.056 6.470 -0.091 112 HG22 ILE 16 HG22 ILE 16 -8.231 7.568 -0.808 113 HG23 ILE 16 HG23 ILE 16 -7.956 5.979 -1.527 114 HD11 ILE 16 HD11 ILE 16 -7.110 7.004 1.954 115 HD12 ILE 16 HD12 ILE 16 -7.813 5.556 2.707 116 HD13 ILE 16 HD13 ILE 16 -8.176 7.154 3.362 117 HA PRO 17 HA PRO 17 -11.150 4.355 -4.281 118 HB2 PRO 17 HB2 PRO 17 -9.900 6.744 -5.525 119 HB3 PRO 17 HB3 PRO 17 -11.394 5.915 -5.972 120 HG2 PRO 17 HG2 PRO 17 -11.465 8.291 -4.783 121 HG3 PRO 17 HG3 PRO 17 -12.650 7.037 -4.382 122 HD2 PRO 17 HD2 PRO 17 -10.231 7.908 -2.859 123 HD3 PRO 17 HD3 PRO 17 -11.852 7.472 -2.271 124 H ALA 18 H ALA 18 -9.474 3.701 -5.947 125 HA ALA 18 HA ALA 18 -7.044 3.239 -4.482 126 HB1 ALA 18 HB1 ALA 18 -6.500 1.718 -6.263 127 HB2 ALA 18 HB2 ALA 18 -7.909 2.270 -7.195 128 HB3 ALA 18 HB3 ALA 18 -8.125 1.434 -5.648 129 H GLY 19 H GLY 19 -5.114 4.068 -4.884 130 HA2 GLY 19 HA2 GLY 19 -5.102 6.503 -6.400 131 HA3 GLY 19 HA3 GLY 19 -3.865 5.933 -5.298 132 H ASP 20 H ASP 20 -2.425 6.734 -6.835 133 HA ASP 20 HA ASP 20 -2.413 5.627 -9.512 134 HB2 ASP 20 HB2 ASP 20 -1.984 7.966 -9.315 135 HB3 ASP 20 HB3 ASP 20 -0.669 7.680 -8.174 136 H ASP 21 H ASP 21 -1.579 3.845 -9.880 137 HA ASP 21 HA ASP 21 -0.160 2.180 -8.282 138 HB2 ASP 21 HB2 ASP 21 0.463 0.913 -10.355 139 HB3 ASP 21 HB3 ASP 21 -1.244 1.298 -10.215 140 H VAL 22 H VAL 22 1.635 2.510 -7.286 141 HA VAL 22 HA VAL 22 3.922 3.734 -8.591 142 HB VAL 22 HB VAL 22 3.672 2.460 -5.834 143 HG11 VAL 22 HG11 VAL 22 5.974 2.360 -6.772 144 HG12 VAL 22 HG12 VAL 22 5.849 3.330 -5.325 145 HG13 VAL 22 HG13 VAL 22 5.968 4.122 -6.908 146 HG21 VAL 22 HG21 VAL 22 2.384 4.521 -6.091 147 HG22 VAL 22 HG22 VAL 22 3.823 5.356 -6.674 148 HG23 VAL 22 HG23 VAL 22 3.760 4.770 -5.014 149 H LEU 23 H LEU 23 2.778 0.632 -7.573 150 HA LEU 23 HA LEU 23 5.118 -0.769 -8.372 151 HB2 LEU 23 HB2 LEU 23 3.554 -2.811 -8.176 152 HB3 LEU 23 HB3 LEU 23 4.017 -1.960 -6.724 153 HG LEU 23 HG LEU 23 1.796 -0.982 -6.532 154 HD11 LEU 23 HD11 LEU 23 1.115 -2.486 -9.079 155 HD12 LEU 23 HD12 LEU 23 1.245 -0.735 -8.938 156 HD13 LEU 23 HD13 LEU 23 -0.034 -1.595 -8.082 157 HD21 LEU 23 HD21 LEU 23 2.132 -3.166 -5.581 158 HD22 LEU 23 HD22 LEU 23 1.663 -3.930 -7.096 159 HD23 LEU 23 HD23 LEU 23 0.481 -3.003 -6.172 160 H ASP 24 H ASP 24 5.033 -2.509 -10.006 161 HA ASP 24 HA ASP 24 4.319 -1.484 -12.545 162 HB2 ASP 24 HB2 ASP 24 5.329 -4.153 -11.601 163 HB3 ASP 24 HB3 ASP 24 4.753 -3.971 -13.251 164 HA PRO 25 HA PRO 25 0.094 -2.523 -13.046 165 HB2 PRO 25 HB2 PRO 25 0.853 -3.855 -15.595 166 HB3 PRO 25 HB3 PRO 25 -0.385 -2.632 -15.294 167 HG2 PRO 25 HG2 PRO 25 1.922 -1.962 -16.448 168 HG3 PRO 25 HG3 PRO 25 1.142 -0.892 -15.272 169 HD2 PRO 25 HD2 PRO 25 3.527 -2.647 -14.945 170 HD3 PRO 25 HD3 PRO 25 3.166 -1.068 -14.220 171 H ASP 26 H ASP 26 2.313 -5.158 -13.922 172 HA ASP 26 HA ASP 26 0.299 -7.020 -12.908 173 HB2 ASP 26 HB2 ASP 26 2.478 -7.380 -14.913 174 HB3 ASP 26 HB3 ASP 26 1.896 -8.771 -14.010 175 H GLU 27 H GLU 27 2.135 -5.460 -11.233 176 HA GLU 27 HA GLU 27 3.971 -7.277 -10.003 177 HB2 GLU 27 HB2 GLU 27 3.918 -4.741 -9.736 178 HB3 GLU 27 HB3 GLU 27 2.465 -4.932 -8.783 179 HG2 GLU 27 HG2 GLU 27 4.224 -4.583 -7.246 180 HG3 GLU 27 HG3 GLU 27 3.844 -6.297 -7.166 181 HA PRO 28 HA PRO 28 1.194 -10.299 -8.092 182 HB2 PRO 28 HB2 PRO 28 2.353 -9.770 -5.477 183 HB3 PRO 28 HB3 PRO 28 2.483 -11.217 -6.469 184 HG2 PRO 28 HG2 PRO 28 4.355 -8.990 -6.191 185 HG3 PRO 28 HG3 PRO 28 4.623 -10.590 -6.897 186 HD2 PRO 28 HD2 PRO 28 4.574 -8.322 -8.366 187 HD3 PRO 28 HD3 PRO 28 4.028 -9.882 -9.016 188 H THR 29 H THR 29 -0.871 -9.632 -7.907 189 HA THR 29 HA THR 29 -1.535 -7.841 -5.714 190 HB THR 29 HB THR 29 -3.322 -6.994 -7.486 191 HG1 THR 29 HG1 THR 29 -1.058 -7.414 -9.123 192 HG21 THR 29 HG21 THR 29 -0.458 -6.010 -7.327 193 HG22 THR 29 HG22 THR 29 -1.797 -5.520 -6.289 194 HG23 THR 29 HG23 THR 29 -1.803 -5.088 -7.999 195 H TYR 30 H TYR 30 -3.963 -7.722 -5.507 196 HA TYR 30 HA TYR 30 -5.306 -10.220 -6.093 197 HB2 TYR 30 HB2 TYR 30 -5.264 -8.695 -3.489 198 HB3 TYR 30 HB3 TYR 30 -6.541 -9.827 -3.902 199 HD1 TYR 30 HD1 TYR 30 -5.399 -12.127 -4.923 200 HD2 TYR 30 HD2 TYR 30 -3.786 -9.539 -1.974 201 HE1 TYR 30 HE1 TYR 30 -4.132 -13.986 -4.041 202 HE2 TYR 30 HE2 TYR 30 -2.480 -11.386 -1.048 203 HH TYR 30 HH TYR 30 -2.062 -14.352 -2.679 204 H ASP 31 H ASP 31 -7.703 -9.828 -5.973 205 HA ASP 31 HA ASP 31 -8.446 -7.085 -6.757 206 HB2 ASP 31 HB2 ASP 31 -8.043 -8.710 -8.755 207 HB3 ASP 31 HB3 ASP 31 -9.399 -9.632 -8.133 208 H LEU 32 H LEU 32 -11.002 -7.192 -6.701 209 HA LEU 32 HA LEU 32 -11.584 -7.499 -4.014 210 HB2 LEU 32 HB2 LEU 32 -13.590 -7.380 -6.269 211 HB3 LEU 32 HB3 LEU 32 -13.964 -7.143 -4.578 212 HG LEU 32 HG LEU 32 -12.217 -5.359 -6.274 213 HD11 LEU 32 HD11 LEU 32 -14.003 -3.727 -5.993 214 HD12 LEU 32 HD12 LEU 32 -14.949 -4.911 -5.096 215 HD13 LEU 32 HD13 LEU 32 -14.586 -5.183 -6.800 216 HD21 LEU 32 HD21 LEU 32 -11.410 -5.380 -3.976 217 HD22 LEU 32 HD22 LEU 32 -13.046 -5.093 -3.379 218 HD23 LEU 32 HD23 LEU 32 -12.220 -3.855 -4.320 219 HA PRO 33 HA PRO 33 -14.007 -11.674 -4.807 220 HB2 PRO 33 HB2 PRO 33 -12.909 -13.103 -6.940 221 HB3 PRO 33 HB3 PRO 33 -14.459 -12.261 -6.974 222 HG2 PRO 33 HG2 PRO 33 -11.795 -11.359 -7.978 223 HG3 PRO 33 HG3 PRO 33 -13.405 -11.129 -8.687 224 HD2 PRO 33 HD2 PRO 33 -12.169 -9.146 -7.408 225 HD3 PRO 33 HD3 PRO 33 -13.924 -9.387 -7.252 226 H ARG 34 H ARG 34 -10.651 -11.391 -5.861 227 HA ARG 34 HA ARG 34 -9.823 -13.802 -4.576 228 HB2 ARG 34 HB2 ARG 34 -8.258 -11.651 -5.954 229 HB3 ARG 34 HB3 ARG 34 -7.429 -12.826 -4.945 230 HG2 ARG 34 HG2 ARG 34 -7.341 -13.574 -7.197 231 HG3 ARG 34 HG3 ARG 34 -8.427 -14.629 -6.306 232 HD2 ARG 34 HD2 ARG 34 -10.297 -13.153 -7.125 233 HD3 ARG 34 HD3 ARG 34 -9.142 -12.474 -8.280 234 HE ARG 34 HE ARG 34 -9.994 -15.260 -8.104 235 HH11 ARG 34 HH11 ARG 34 -8.611 -12.607 -10.070 236 HH12 ARG 34 HH12 ARG 34 -8.711 -13.486 -11.521 237 HH21 ARG 34 HH21 ARG 34 -10.141 -16.409 -10.162 238 HH22 ARG 34 HH22 ARG 34 -9.561 -15.654 -11.580 239 H VAL 35 H VAL 35 -9.809 -10.463 -3.599 240 HA VAL 35 HA VAL 35 -8.234 -10.976 -1.293 241 HB VAL 35 HB VAL 35 -10.241 -8.710 -1.646 242 HG11 VAL 35 HG11 VAL 35 -8.898 -7.533 0.048 243 HG12 VAL 35 HG12 VAL 35 -7.888 -8.973 0.226 244 HG13 VAL 35 HG13 VAL 35 -9.588 -9.031 0.675 245 HG21 VAL 35 HG21 VAL 35 -7.280 -8.689 -2.187 246 HG22 VAL 35 HG22 VAL 35 -8.384 -7.331 -2.372 247 HG23 VAL 35 HG23 VAL 35 -8.539 -8.737 -3.424 248 H ALA 36 H ALA 36 -11.661 -10.795 -1.935 249 HA ALA 36 HA ALA 36 -12.608 -11.363 0.626 250 HB1 ALA 36 HB1 ALA 36 -14.661 -12.060 -0.524 251 HB2 ALA 36 HB2 ALA 36 -13.794 -12.088 -2.063 252 HB3 ALA 36 HB3 ALA 36 -14.026 -10.562 -1.210 253 H GLU 37 H GLU 37 -11.493 -13.392 -1.994 254 HA GLU 37 HA GLU 37 -12.131 -15.943 -0.993 255 HB2 GLU 37 HB2 GLU 37 -11.375 -15.163 -3.317 256 HB3 GLU 37 HB3 GLU 37 -9.794 -15.130 -2.639 257 HG2 GLU 37 HG2 GLU 37 -9.786 -17.481 -2.156 258 HG3 GLU 37 HG3 GLU 37 -11.436 -17.634 -2.759 259 H LEU 38 H LEU 38 -9.237 -13.930 -0.799 260 HA LEU 38 HA LEU 38 -7.542 -15.798 0.429 261 HB2 LEU 38 HB2 LEU 38 -6.797 -13.806 -0.813 262 HB3 LEU 38 HB3 LEU 38 -7.406 -12.790 0.478 263 HG LEU 38 HG LEU 38 -5.802 -14.002 2.005 264 HD11 LEU 38 HD11 LEU 38 -5.359 -15.941 0.611 265 HD12 LEU 38 HD12 LEU 38 -3.867 -15.066 0.956 266 HD13 LEU 38 HD13 LEU 38 -4.632 -14.900 -0.618 267 HD21 LEU 38 HD21 LEU 38 -5.415 -11.735 1.219 268 HD22 LEU 38 HD22 LEU 38 -4.677 -12.362 -0.254 269 HD23 LEU 38 HD23 LEU 38 -3.898 -12.636 1.302 270 H LEU 39 H LEU 39 -9.367 -13.064 1.726 271 HA LEU 39 HA LEU 39 -8.543 -13.687 4.424 272 HB2 LEU 39 HB2 LEU 39 -10.432 -11.625 3.357 273 HB3 LEU 39 HB3 LEU 39 -9.931 -11.735 5.037 274 HG LEU 39 HG LEU 39 -8.171 -11.083 2.667 275 HD11 LEU 39 HD11 LEU 39 -9.176 -9.370 4.930 276 HD12 LEU 39 HD12 LEU 39 -9.693 -9.288 3.245 277 HD13 LEU 39 HD13 LEU 39 -8.039 -8.862 3.681 278 HD21 LEU 39 HD21 LEU 39 -6.445 -10.594 4.355 279 HD22 LEU 39 HD22 LEU 39 -6.909 -12.296 4.372 280 HD23 LEU 39 HD23 LEU 39 -7.519 -11.201 5.613 281 H GLY 40 H GLY 40 -11.160 -14.571 2.406 282 HA2 GLY 40 HA2 GLY 40 -12.913 -15.998 2.831 283 HA3 GLY 40 HA3 GLY 40 -12.315 -16.176 4.480 284 H VAL 41 H VAL 41 -12.982 -13.138 3.022 285 HA VAL 41 HA VAL 41 -15.313 -12.766 4.784 286 HB VAL 41 HB VAL 41 -14.642 -10.477 5.225 287 HG11 VAL 41 HG11 VAL 41 -12.330 -12.333 5.748 288 HG12 VAL 41 HG12 VAL 41 -13.758 -12.133 6.760 289 HG13 VAL 41 HG13 VAL 41 -12.615 -10.801 6.575 290 HG21 VAL 41 HG21 VAL 41 -12.411 -9.604 4.480 291 HG22 VAL 41 HG22 VAL 41 -13.565 -9.875 3.168 292 HG23 VAL 41 HG23 VAL 41 -12.278 -11.032 3.448 293 HA PRO 42 HA PRO 42 -17.074 -11.083 1.028 294 HB2 PRO 42 HB2 PRO 42 -18.652 -9.045 2.221 295 HB3 PRO 42 HB3 PRO 42 -19.182 -10.657 1.757 296 HG2 PRO 42 HG2 PRO 42 -18.966 -9.698 4.380 297 HG3 PRO 42 HG3 PRO 42 -19.158 -11.391 3.905 298 HD2 PRO 42 HD2 PRO 42 -16.739 -9.924 4.774 299 HD3 PRO 42 HD3 PRO 42 -17.122 -11.650 4.915 300 H VAL 43 H VAL 43 -17.219 -9.126 -0.281 301 HA VAL 43 HA VAL 43 -14.891 -7.565 -0.268 302 HB VAL 43 HB VAL 43 -17.520 -7.051 -1.675 303 HG11 VAL 43 HG11 VAL 43 -16.143 -5.027 -1.648 304 HG12 VAL 43 HG12 VAL 43 -16.211 -5.699 -3.276 305 HG13 VAL 43 HG13 VAL 43 -14.772 -5.938 -2.280 306 HG21 VAL 43 HG21 VAL 43 -16.550 -9.219 -2.224 307 HG22 VAL 43 HG22 VAL 43 -15.028 -8.444 -2.647 308 HG23 VAL 43 HG23 VAL 43 -16.477 -8.132 -3.610 309 H SER 44 H SER 44 -18.038 -6.940 1.059 310 HA SER 44 HA SER 44 -17.804 -4.231 1.565 311 HB2 SER 44 HB2 SER 44 -19.548 -4.809 3.311 312 HB3 SER 44 HB3 SER 44 -19.864 -5.269 1.621 313 HG SER 44 HG SER 44 -19.941 -7.232 2.187 314 H LYS 45 H LYS 45 -16.843 -7.031 3.500 315 HA LYS 45 HA LYS 45 -15.983 -5.497 5.724 316 HB2 LYS 45 HB2 LYS 45 -16.632 -7.903 5.881 317 HB3 LYS 45 HB3 LYS 45 -15.175 -8.319 4.992 318 HG2 LYS 45 HG2 LYS 45 -13.778 -7.632 6.783 319 HG3 LYS 45 HG3 LYS 45 -15.123 -6.861 7.627 320 HD2 LYS 45 HD2 LYS 45 -16.179 -9.058 7.931 321 HD3 LYS 45 HD3 LYS 45 -14.828 -9.826 7.104 322 HE2 LYS 45 HE2 LYS 45 -13.305 -9.089 8.842 323 HE3 LYS 45 HE3 LYS 45 -14.610 -8.225 9.652 324 HZ1 LYS 45 HZ1 LYS 45 -15.720 -10.306 10.044 325 HZ2 LYS 45 HZ2 LYS 45 -14.161 -10.371 10.681 326 HZ3 LYS 45 HZ3 LYS 45 -14.521 -11.176 9.241 327 H VAL 46 H VAL 46 -14.438 -6.596 2.810 328 HA VAL 46 HA VAL 46 -11.745 -5.786 3.433 329 HB VAL 46 HB VAL 46 -13.113 -5.857 0.721 330 HG11 VAL 46 HG11 VAL 46 -10.183 -5.959 1.437 331 HG12 VAL 46 HG12 VAL 46 -11.034 -4.597 0.708 332 HG13 VAL 46 HG13 VAL 46 -10.850 -6.104 -0.190 333 HG21 VAL 46 HG21 VAL 46 -11.550 -8.033 2.107 334 HG22 VAL 46 HG22 VAL 46 -12.130 -8.094 0.443 335 HG23 VAL 46 HG23 VAL 46 -13.283 -8.038 1.777 336 H ALA 47 H ALA 47 -14.457 -4.155 1.961 337 HA ALA 47 HA ALA 47 -13.234 -1.696 1.517 338 HB1 ALA 47 HB1 ALA 47 -15.495 -0.751 1.494 339 HB2 ALA 47 HB2 ALA 47 -16.113 -2.216 2.263 340 HB3 ALA 47 HB3 ALA 47 -15.453 -2.293 0.634 341 H GLN 48 H GLN 48 -14.650 -3.060 4.412 342 HA GLN 48 HA GLN 48 -14.533 -0.714 5.998 343 HB2 GLN 48 HB2 GLN 48 -14.424 -3.576 6.968 344 HB3 GLN 48 HB3 GLN 48 -14.814 -2.167 7.946 345 HG2 GLN 48 HG2 GLN 48 -16.421 -3.301 5.674 346 HG3 GLN 48 HG3 GLN 48 -16.832 -3.327 7.388 347 HE21 GLN 48 HE21 GLN 48 -18.173 -2.217 5.019 348 HE22 GLN 48 HE22 GLN 48 -18.474 -0.555 5.369 349 H GLN 49 H GLN 49 -12.205 -3.235 5.334 350 HA GLN 49 HA GLN 49 -10.247 -2.505 7.272 351 HB2 GLN 49 HB2 GLN 49 -9.717 -3.655 4.519 352 HB3 GLN 49 HB3 GLN 49 -8.656 -3.746 5.912 353 HG2 GLN 49 HG2 GLN 49 -11.331 -5.083 5.627 354 HG3 GLN 49 HG3 GLN 49 -9.755 -5.859 5.505 355 HE21 GLN 49 HE21 GLN 49 -12.014 -6.274 7.279 356 HE22 GLN 49 HE22 GLN 49 -11.369 -6.182 8.884 357 H LEU 50 H LEU 50 -10.759 -1.685 3.932 358 HA LEU 50 HA LEU 50 -8.618 0.072 3.522 359 HB2 LEU 50 HB2 LEU 50 -11.322 -0.262 2.292 360 HB3 LEU 50 HB3 LEU 50 -10.155 0.892 1.622 361 HG LEU 50 HG LEU 50 -9.890 -2.124 1.807 362 HD11 LEU 50 HD11 LEU 50 -10.379 -0.322 -0.561 363 HD12 LEU 50 HD12 LEU 50 -11.552 -1.421 0.166 364 HD13 LEU 50 HD13 LEU 50 -10.112 -2.060 -0.626 365 HD21 LEU 50 HD21 LEU 50 -8.095 -0.086 0.495 366 HD22 LEU 50 HD22 LEU 50 -7.915 -1.834 0.392 367 HD23 LEU 50 HD23 LEU 50 -7.711 -1.021 1.941 368 H ARG 51 H ARG 51 -11.971 0.624 4.479 369 HA ARG 51 HA ARG 51 -11.828 3.413 4.638 370 HB2 ARG 51 HB2 ARG 51 -13.748 1.409 5.722 371 HB3 ARG 51 HB3 ARG 51 -13.901 3.114 6.118 372 HG2 ARG 51 HG2 ARG 51 -14.139 3.691 3.803 373 HG3 ARG 51 HG3 ARG 51 -13.816 2.026 3.316 374 HD2 ARG 51 HD2 ARG 51 -16.242 2.715 3.325 375 HD3 ARG 51 HD3 ARG 51 -15.850 1.266 4.248 376 HE ARG 51 HE ARG 51 -15.993 2.551 6.247 377 HH11 ARG 51 HH11 ARG 51 -17.196 4.344 3.449 378 HH12 ARG 51 HH12 ARG 51 -18.383 5.190 4.328 379 HH21 ARG 51 HH21 ARG 51 -17.552 3.732 7.454 380 HH22 ARG 51 HH22 ARG 51 -18.588 4.835 6.664 381 H GLU 52 H GLU 52 -10.742 1.051 6.943 382 HA GLU 52 HA GLU 52 -10.626 3.237 8.867 383 HB2 GLU 52 HB2 GLU 52 -10.313 0.280 9.406 384 HB3 GLU 52 HB3 GLU 52 -10.189 1.542 10.624 385 HG2 GLU 52 HG2 GLU 52 -12.540 2.227 9.950 386 HG3 GLU 52 HG3 GLU 52 -12.608 0.723 9.046 387 H GLY 53 H GLY 53 -8.822 2.159 6.546 388 HA2 GLY 53 HA2 GLY 53 -6.639 2.653 6.019 389 HA3 GLY 53 HA3 GLY 53 -6.475 3.390 7.605 390 H HIS 54 H HIS 54 -7.421 0.081 6.887 391 HA HIS 54 HA HIS 54 -5.040 -0.864 8.336 392 HB2 HIS 54 HB2 HIS 54 -7.499 -2.406 7.447 393 HB3 HIS 54 HB3 HIS 54 -6.151 -3.083 8.331 394 HD1 HIS 54 HD1 HIS 54 -9.224 -2.997 9.251 395 HD2 HIS 54 HD2 HIS 54 -6.126 -0.570 10.614 396 HE1 HIS 54 HE1 HIS 54 -9.908 -2.206 11.523 397 H LEU 55 H LEU 55 -6.105 -0.334 5.190 398 HA LEU 55 HA LEU 55 -4.097 -2.029 4.029 399 HB2 LEU 55 HB2 LEU 55 -6.069 -3.500 4.479 400 HB3 LEU 55 HB3 LEU 55 -7.038 -2.455 3.473 401 HG LEU 55 HG LEU 55 -5.680 -3.119 1.517 402 HD11 LEU 55 HD11 LEU 55 -4.355 -4.996 3.478 403 HD12 LEU 55 HD12 LEU 55 -3.586 -3.630 2.663 404 HD13 LEU 55 HD13 LEU 55 -4.145 -5.015 1.727 405 HD21 LEU 55 HD21 LEU 55 -6.553 -5.414 1.396 406 HD22 LEU 55 HD22 LEU 55 -7.741 -4.289 2.054 407 HD23 LEU 55 HD23 LEU 55 -6.862 -5.374 3.127 408 H VAL 56 H VAL 56 -4.003 -1.562 1.624 409 HA VAL 56 HA VAL 56 -5.282 0.980 0.870 410 HB VAL 56 HB VAL 56 -2.380 0.188 0.336 411 HG11 VAL 56 HG11 VAL 56 -3.834 2.719 -0.419 412 HG12 VAL 56 HG12 VAL 56 -3.294 1.459 -1.525 413 HG13 VAL 56 HG13 VAL 56 -2.109 2.421 -0.641 414 HG21 VAL 56 HG21 VAL 56 -1.772 2.100 1.744 415 HG22 VAL 56 HG22 VAL 56 -2.695 0.894 2.640 416 HG23 VAL 56 HG23 VAL 56 -3.479 2.376 2.097 417 H ALA 57 H ALA 57 -5.775 1.132 -1.371 418 HA ALA 57 HA ALA 57 -5.468 -1.341 -2.926 419 HB1 ALA 57 HB1 ALA 57 -7.809 -1.024 -2.227 420 HB2 ALA 57 HB2 ALA 57 -7.637 -0.827 -3.972 421 HB3 ALA 57 HB3 ALA 57 -7.802 0.590 -2.935 422 H VAL 58 H VAL 58 -5.116 -1.019 -5.192 423 HA VAL 58 HA VAL 58 -4.290 1.701 -5.909 424 HB VAL 58 HB VAL 58 -2.321 0.881 -7.040 425 HG11 VAL 58 HG11 VAL 58 -2.127 1.452 -4.749 426 HG12 VAL 58 HG12 VAL 58 -1.028 0.104 -5.110 427 HG13 VAL 58 HG13 VAL 58 -2.566 -0.177 -4.263 428 HG21 VAL 58 HG21 VAL 58 -3.061 -1.293 -7.791 429 HG22 VAL 58 HG22 VAL 58 -3.156 -1.877 -6.124 430 HG23 VAL 58 HG23 VAL 58 -1.594 -1.473 -6.828 431 H ARG 59 H ARG 59 -4.279 2.139 -8.179 432 HA ARG 59 HA ARG 59 -6.223 0.477 -9.613 433 HB2 ARG 59 HB2 ARG 59 -6.917 2.779 -9.078 434 HB3 ARG 59 HB3 ARG 59 -5.491 3.392 -9.888 435 HG2 ARG 59 HG2 ARG 59 -6.335 2.445 -12.007 436 HG3 ARG 59 HG3 ARG 59 -7.808 1.956 -11.162 437 HD2 ARG 59 HD2 ARG 59 -8.113 4.095 -12.303 438 HD3 ARG 59 HD3 ARG 59 -8.241 4.284 -10.550 439 HE ARG 59 HE ARG 59 -5.646 4.768 -11.777 440 HH11 ARG 59 HH11 ARG 59 -8.527 6.215 -10.260 441 HH12 ARG 59 HH12 ARG 59 -7.786 7.741 -10.086 442 HH21 ARG 59 HH21 ARG 59 -4.700 6.855 -11.500 443 HH22 ARG 59 HH22 ARG 59 -5.613 8.106 -10.788 444 H ARG 60 H ARG 60 -5.272 -0.726 -11.100 445 HA ARG 60 HA ARG 60 -3.051 0.422 -12.599 446 HB2 ARG 60 HB2 ARG 60 -1.931 -1.812 -12.690 447 HB3 ARG 60 HB3 ARG 60 -2.000 -1.157 -11.068 448 HG2 ARG 60 HG2 ARG 60 -2.539 -3.345 -10.644 449 HG3 ARG 60 HG3 ARG 60 -4.149 -2.686 -10.912 450 HD2 ARG 60 HD2 ARG 60 -3.999 -3.449 -13.274 451 HD3 ARG 60 HD3 ARG 60 -2.459 -4.214 -12.893 452 HE ARG 60 HE ARG 60 -5.038 -4.936 -11.678 453 HH11 ARG 60 HH11 ARG 60 -1.787 -5.958 -12.690 454 HH12 ARG 60 HH12 ARG 60 -2.132 -7.625 -12.606 455 HH21 ARG 60 HH21 ARG 60 -5.468 -7.247 -11.549 456 HH22 ARG 60 HH22 ARG 60 -4.260 -8.370 -11.971 457 H ALA 61 H ALA 61 -3.363 0.500 -14.642 458 HA ALA 61 HA ALA 61 -4.224 0.278 -16.721 459 HB1 ALA 61 HB1 ALA 61 -4.969 -2.532 -15.869 460 HB2 ALA 61 HB2 ALA 61 -3.413 -2.055 -16.547 461 HB3 ALA 61 HB3 ALA 61 -4.875 -1.941 -17.530 462 H GLY 62 H GLY 62 -5.911 0.890 -14.282 463 HA2 GLY 62 HA2 GLY 62 -8.014 1.997 -14.336 464 HA3 GLY 62 HA3 GLY 62 -8.443 1.031 -15.743 465 H GLY 63 H GLY 63 -7.066 -1.026 -13.523 466 HA2 GLY 63 HA2 GLY 63 -9.720 -1.755 -12.510 467 HA3 GLY 63 HA3 GLY 63 -8.360 -2.849 -12.721 468 H VAL 64 H VAL 64 -10.003 -2.139 -10.352 469 HA VAL 64 HA VAL 64 -7.974 -0.923 -8.652 470 HB VAL 64 HB VAL 64 -10.875 -1.640 -8.087 471 HG11 VAL 64 HG11 VAL 64 -10.580 -0.376 -5.983 472 HG12 VAL 64 HG12 VAL 64 -8.847 -0.271 -6.324 473 HG13 VAL 64 HG13 VAL 64 -9.600 -1.839 -6.054 474 HG21 VAL 64 HG21 VAL 64 -11.218 0.800 -8.009 475 HG22 VAL 64 HG22 VAL 64 -10.658 0.258 -9.591 476 HG23 VAL 64 HG23 VAL 64 -9.537 1.037 -8.481 477 H VAL 65 H VAL 65 -6.685 -2.162 -7.591 478 HA VAL 65 HA VAL 65 -7.504 -4.841 -6.784 479 HB VAL 65 HB VAL 65 -5.202 -5.655 -7.401 480 HG11 VAL 65 HG11 VAL 65 -7.104 -6.224 -8.798 481 HG12 VAL 65 HG12 VAL 65 -5.674 -5.949 -9.796 482 HG13 VAL 65 HG13 VAL 65 -6.925 -4.710 -9.682 483 HG21 VAL 65 HG21 VAL 65 -4.093 -3.498 -7.587 484 HG22 VAL 65 HG22 VAL 65 -5.119 -3.090 -8.963 485 HG23 VAL 65 HG23 VAL 65 -3.951 -4.404 -9.099 486 H ILE 66 H ILE 66 -5.831 -5.687 -5.269 487 HA ILE 66 HA ILE 66 -4.804 -3.487 -3.649 488 HB ILE 66 HB ILE 66 -6.003 -6.105 -2.668 489 HG12 ILE 66 HG12 ILE 66 -6.901 -3.226 -2.366 490 HG13 ILE 66 HG13 ILE 66 -7.674 -4.453 -3.357 491 HG21 ILE 66 HG21 ILE 66 -4.791 -3.857 -1.050 492 HG22 ILE 66 HG22 ILE 66 -4.055 -5.431 -1.320 493 HG23 ILE 66 HG23 ILE 66 -5.560 -5.313 -0.406 494 HD11 ILE 66 HD11 ILE 66 -7.495 -4.414 -0.357 495 HD12 ILE 66 HD12 ILE 66 -8.249 -5.696 -1.304 496 HD13 ILE 66 HD13 ILE 66 -8.921 -4.071 -1.331 497 HA PRO 67 HA PRO 67 -0.838 -5.347 -4.497 498 HB2 PRO 67 HB2 PRO 67 -0.145 -4.096 -1.893 499 HB3 PRO 67 HB3 PRO 67 0.657 -3.946 -3.459 500 HG2 PRO 67 HG2 PRO 67 -0.820 -1.958 -2.499 501 HG3 PRO 67 HG3 PRO 67 -0.843 -2.359 -4.225 502 HD2 PRO 67 HD2 PRO 67 -2.867 -2.953 -2.115 503 HD3 PRO 67 HD3 PRO 67 -3.085 -2.511 -3.823 504 H GLN 68 H GLN 68 -0.405 -7.436 -4.132 505 HA GLN 68 HA GLN 68 -1.468 -8.891 -2.002 506 HB2 GLN 68 HB2 GLN 68 -1.093 -9.876 -4.108 507 HB3 GLN 68 HB3 GLN 68 0.615 -9.493 -4.065 508 HG2 GLN 68 HG2 GLN 68 1.011 -11.112 -2.367 509 HG3 GLN 68 HG3 GLN 68 -0.718 -11.381 -2.149 510 HE21 GLN 68 HE21 GLN 68 -1.286 -11.290 -5.018 511 HE22 GLN 68 HE22 GLN 68 -0.689 -12.763 -5.642 512 H VAL 69 H VAL 69 1.485 -7.163 -2.367 513 HA VAL 69 HA VAL 69 2.947 -8.589 -0.390 514 HB VAL 69 HB VAL 69 4.561 -6.793 -0.506 515 HG11 VAL 69 HG11 VAL 69 5.119 -6.941 -2.909 516 HG12 VAL 69 HG12 VAL 69 3.524 -7.640 -3.208 517 HG13 VAL 69 HG13 VAL 69 4.688 -8.497 -2.204 518 HG21 VAL 69 HG21 VAL 69 2.494 -5.369 -2.185 519 HG22 VAL 69 HG22 VAL 69 4.188 -4.872 -2.057 520 HG23 VAL 69 HG23 VAL 69 3.155 -4.865 -0.633 521 H PHE 70 H PHE 70 0.338 -6.574 -0.076 522 HA PHE 70 HA PHE 70 1.092 -5.466 2.482 523 HB2 PHE 70 HB2 PHE 70 -1.320 -5.226 0.709 524 HB3 PHE 70 HB3 PHE 70 -1.462 -4.813 2.411 525 HD1 PHE 70 HD1 PHE 70 1.174 -4.173 -0.187 526 HD2 PHE 70 HD2 PHE 70 -1.485 -2.545 2.711 527 HE1 PHE 70 HE1 PHE 70 2.068 -1.930 -0.625 528 HE2 PHE 70 HE2 PHE 70 -0.579 -0.304 2.297 529 HZ PHE 70 HZ PHE 70 1.186 0.014 0.616 530 H PHE 71 H PHE 71 0.181 -8.362 1.349 531 HA PHE 71 HA PHE 71 -1.071 -9.175 3.860 532 HB2 PHE 71 HB2 PHE 71 -1.267 -10.459 1.126 533 HB3 PHE 71 HB3 PHE 71 -1.974 -11.090 2.602 534 HD1 PHE 71 HD1 PHE 71 -3.905 -9.966 3.621 535 HD2 PHE 71 HD2 PHE 71 -2.282 -8.708 -0.099 536 HE1 PHE 71 HE1 PHE 71 -5.976 -8.731 3.137 537 HE2 PHE 71 HE2 PHE 71 -4.348 -7.478 -0.593 538 HZ PHE 71 HZ PHE 71 -6.201 -7.492 1.025 539 H THR 72 H THR 72 -0.227 -11.068 4.719 540 HA THR 72 HA THR 72 2.492 -11.655 3.982 541 HB THR 72 HB THR 72 2.363 -13.274 5.893 542 HG1 THR 72 HG1 THR 72 -0.179 -12.189 6.440 543 HG21 THR 72 HG21 THR 72 3.010 -10.930 6.331 544 HG22 THR 72 HG22 THR 72 2.101 -11.600 7.686 545 HG23 THR 72 HG23 THR 72 1.314 -10.508 6.548 546 H ASN 73 H ASN 73 3.053 -14.037 3.683 547 HA ASN 73 HA ASN 73 1.530 -15.094 1.544 548 HB2 ASN 73 HB2 ASN 73 4.025 -15.444 1.897 549 HB3 ASN 73 HB3 ASN 73 3.612 -16.605 3.150 550 HD21 ASN 73 HD21 ASN 73 2.863 -18.640 2.540 551 HD22 ASN 73 HD22 ASN 73 2.845 -19.178 0.900 552 H SER 74 H SER 74 1.187 -15.345 4.895 553 HA SER 74 HA SER 74 -0.178 -17.857 4.995 554 HB2 SER 74 HB2 SER 74 -0.066 -15.612 7.009 555 HB3 SER 74 HB3 SER 74 -0.519 -17.291 7.321 556 HG SER 74 HG SER 74 1.597 -17.836 6.514 557 H GLY 75 H GLY 75 -1.119 -14.928 3.703 558 HA2 GLY 75 HA2 GLY 75 -3.201 -14.283 2.935 559 HA3 GLY 75 HA3 GLY 75 -3.895 -15.694 3.727 560 H GLN 76 H GLN 76 -1.919 -13.461 5.414 561 HA GLN 76 HA GLN 76 -4.280 -12.349 6.753 562 HB2 GLN 76 HB2 GLN 76 -3.163 -13.967 8.222 563 HB3 GLN 76 HB3 GLN 76 -1.624 -13.169 7.956 564 HG2 GLN 76 HG2 GLN 76 -2.444 -11.193 9.135 565 HG3 GLN 76 HG3 GLN 76 -3.998 -11.986 9.382 566 HE21 GLN 76 HE21 GLN 76 -3.782 -11.825 11.606 567 HE22 GLN 76 HE22 GLN 76 -2.702 -12.827 12.505 568 H VAL 77 H VAL 77 -4.150 -10.142 7.173 569 HA VAL 77 HA VAL 77 -2.408 -8.590 5.533 570 HB VAL 77 HB VAL 77 -4.086 -7.662 7.902 571 HG11 VAL 77 HG11 VAL 77 -2.442 -6.000 7.226 572 HG12 VAL 77 HG12 VAL 77 -4.071 -5.460 6.817 573 HG13 VAL 77 HG13 VAL 77 -3.011 -6.094 5.559 574 HG21 VAL 77 HG21 VAL 77 -5.491 -8.814 6.274 575 HG22 VAL 77 HG22 VAL 77 -4.843 -7.803 4.984 576 HG23 VAL 77 HG23 VAL 77 -5.823 -7.082 6.262 577 H VAL 78 H VAL 78 -0.535 -7.479 6.114 578 HA VAL 78 HA VAL 78 1.080 -8.494 8.177 579 HB VAL 78 HB VAL 78 1.231 -5.771 6.916 580 HG11 VAL 78 HG11 VAL 78 3.407 -7.382 8.265 581 HG12 VAL 78 HG12 VAL 78 2.650 -5.920 8.895 582 HG13 VAL 78 HG13 VAL 78 3.654 -5.839 7.448 583 HG21 VAL 78 HG21 VAL 78 2.559 -8.315 5.999 584 HG22 VAL 78 HG22 VAL 78 2.852 -6.702 5.347 585 HG23 VAL 78 HG23 VAL 78 1.255 -7.439 5.180 586 H LYS 79 H LYS 79 1.016 -8.124 10.287 587 HA LYS 79 HA LYS 79 -1.128 -6.620 11.349 588 HB2 LYS 79 HB2 LYS 79 -0.437 -7.335 13.539 589 HB3 LYS 79 HB3 LYS 79 -0.419 -8.676 12.404 590 HG2 LYS 79 HG2 LYS 79 1.986 -8.306 12.139 591 HG3 LYS 79 HG3 LYS 79 1.896 -7.132 13.451 592 HD2 LYS 79 HD2 LYS 79 1.143 -10.067 13.655 593 HD3 LYS 79 HD3 LYS 79 2.615 -9.353 14.309 594 HE2 LYS 79 HE2 LYS 79 1.302 -7.998 15.850 595 HE3 LYS 79 HE3 LYS 79 -0.193 -8.593 15.133 596 HZ1 LYS 79 HZ1 LYS 79 0.317 -9.742 17.182 597 HZ2 LYS 79 HZ2 LYS 79 1.800 -10.251 16.561 598 HZ3 LYS 79 HZ3 LYS 79 0.357 -10.794 15.877 599 H SER 80 H SER 80 2.194 -5.809 10.922 600 HA SER 80 HA SER 80 1.981 -3.486 12.649 601 HB2 SER 80 HB2 SER 80 4.242 -4.362 10.845 602 HB3 SER 80 HB3 SER 80 4.333 -3.170 12.144 603 HG SER 80 HG SER 80 3.492 -5.058 13.463 604 H LEU 81 H LEU 81 1.024 -4.199 9.554 605 HA LEU 81 HA LEU 81 2.011 -1.991 8.160 606 HB2 LEU 81 HB2 LEU 81 1.499 -3.966 7.058 607 HB3 LEU 81 HB3 LEU 81 -0.208 -3.902 7.476 608 HG LEU 81 HG LEU 81 1.137 -1.880 5.669 609 HD11 LEU 81 HD11 LEU 81 1.574 -4.127 4.836 610 HD12 LEU 81 HD12 LEU 81 0.412 -3.281 3.816 611 HD13 LEU 81 HD13 LEU 81 -0.143 -4.506 4.957 612 HD21 LEU 81 HD21 LEU 81 -1.120 -1.611 4.780 613 HD22 LEU 81 HD22 LEU 81 -1.126 -1.338 6.522 614 HD23 LEU 81 HD23 LEU 81 -1.721 -2.863 5.868 615 HA PRO 82 HA PRO 82 -2.431 0.066 8.950 616 HB2 PRO 82 HB2 PRO 82 -3.185 -0.524 11.595 617 HB3 PRO 82 HB3 PRO 82 -3.984 -1.131 10.146 618 HG2 PRO 82 HG2 PRO 82 -1.940 -2.445 11.876 619 HG3 PRO 82 HG3 PRO 82 -3.338 -3.157 11.050 620 HD2 PRO 82 HD2 PRO 82 -0.871 -3.499 10.104 621 HD3 PRO 82 HD3 PRO 82 -2.234 -3.229 8.997 622 H GLY 83 H GLY 83 0.026 -0.742 11.289 623 HA2 GLY 83 HA2 GLY 83 0.004 1.649 12.802 624 HA3 GLY 83 HA3 GLY 83 1.330 0.499 12.708 625 H LEU 84 H LEU 84 1.820 0.641 9.910 626 HA LEU 84 HA LEU 84 3.400 3.000 9.865 627 HB2 LEU 84 HB2 LEU 84 4.288 2.317 7.767 628 HB3 LEU 84 HB3 LEU 84 4.031 0.848 8.669 629 HG LEU 84 HG LEU 84 1.780 0.803 7.272 630 HD11 LEU 84 HD11 LEU 84 2.066 2.946 6.160 631 HD12 LEU 84 HD12 LEU 84 2.077 1.648 4.985 632 HD13 LEU 84 HD13 LEU 84 3.591 2.407 5.462 633 HD21 LEU 84 HD21 LEU 84 2.921 -0.599 5.601 634 HD22 LEU 84 HD22 LEU 84 3.515 -0.927 7.230 635 HD23 LEU 84 HD23 LEU 84 4.470 0.056 6.123 636 H LEU 85 H LEU 85 0.401 2.053 8.387 637 HA LEU 85 HA LEU 85 0.036 4.357 6.833 638 HB2 LEU 85 HB2 LEU 85 -2.019 2.532 8.085 639 HB3 LEU 85 HB3 LEU 85 -2.394 3.773 6.905 640 HG LEU 85 HG LEU 85 -0.646 1.359 6.399 641 HD11 LEU 85 HD11 LEU 85 -2.496 0.587 5.013 642 HD12 LEU 85 HD12 LEU 85 -3.459 1.975 5.510 643 HD13 LEU 85 HD13 LEU 85 -2.991 0.756 6.696 644 HD21 LEU 85 HD21 LEU 85 0.001 3.272 5.044 645 HD22 LEU 85 HD22 LEU 85 -1.674 3.499 4.543 646 HD23 LEU 85 HD23 LEU 85 -0.798 2.047 4.060 647 H THR 86 H THR 86 -0.719 3.607 10.120 648 HA THR 86 HA THR 86 -2.233 5.874 10.776 649 HB THR 86 HB THR 86 -0.417 4.220 12.550 650 HG1 THR 86 HG1 THR 86 -2.198 3.127 11.562 651 HG21 THR 86 HG21 THR 86 -0.870 6.408 13.589 652 HG22 THR 86 HG22 THR 86 -1.716 5.117 14.444 653 HG23 THR 86 HG23 THR 86 -2.598 6.167 13.334 654 H ILE 87 H ILE 87 1.295 5.391 11.118 655 HA ILE 87 HA ILE 87 1.703 8.010 12.048 656 HB ILE 87 HB ILE 87 3.305 6.375 12.716 657 HG12 ILE 87 HG12 ILE 87 4.218 8.724 12.140 658 HG13 ILE 87 HG13 ILE 87 5.371 7.441 12.456 659 HG21 ILE 87 HG21 ILE 87 4.846 5.189 11.212 660 HG22 ILE 87 HG22 ILE 87 3.918 5.811 9.846 661 HG23 ILE 87 HG23 ILE 87 3.147 4.754 11.022 662 HD11 ILE 87 HD11 ILE 87 5.760 7.201 10.037 663 HD12 ILE 87 HD12 ILE 87 6.054 8.850 10.585 664 HD13 ILE 87 HD13 ILE 87 4.564 8.458 9.732 665 H LEU 88 H LEU 88 1.934 6.646 8.810 666 HA LEU 88 HA LEU 88 2.872 9.034 7.637 667 HB2 LEU 88 HB2 LEU 88 1.619 6.570 6.564 668 HB3 LEU 88 HB3 LEU 88 1.715 7.977 5.534 669 HG LEU 88 HG LEU 88 3.511 6.441 5.074 670 HD11 LEU 88 HD11 LEU 88 3.952 8.781 4.727 671 HD12 LEU 88 HD12 LEU 88 5.414 7.949 5.248 672 HD13 LEU 88 HD13 LEU 88 4.520 8.951 6.388 673 HD21 LEU 88 HD21 LEU 88 4.431 6.893 7.903 674 HD22 LEU 88 HD22 LEU 88 5.294 6.014 6.642 675 HD23 LEU 88 HD23 LEU 88 3.755 5.391 7.259 676 H HIS 89 H HIS 89 -0.374 7.863 8.253 677 HA HIS 89 HA HIS 89 -1.659 9.971 6.899 678 HB2 HIS 89 HB2 HIS 89 -2.617 8.115 9.063 679 HB3 HIS 89 HB3 HIS 89 -3.631 9.426 8.479 680 HD1 HIS 89 HD1 HIS 89 -3.619 6.018 8.037 681 HD2 HIS 89 HD2 HIS 89 -3.313 9.159 5.335 682 HE1 HIS 89 HE1 HIS 89 -4.426 5.124 5.833 683 H ASP 90 H ASP 90 -0.339 9.710 10.108 684 HA ASP 90 HA ASP 90 -1.383 12.139 11.127 685 HB2 ASP 90 HB2 ASP 90 -0.353 10.474 12.612 686 HB3 ASP 90 HB3 ASP 90 1.200 10.713 11.821 687 H GLY 91 H GLY 91 1.308 11.383 9.071 688 HA2 GLY 91 HA2 GLY 91 2.367 14.079 9.138 689 HA3 GLY 91 HA3 GLY 91 2.944 12.760 8.125 690 H GLY 92 H GLY 92 -0.252 12.715 7.731 691 HA2 GLY 92 HA2 GLY 92 -1.779 13.596 6.260 692 HA3 GLY 92 HA3 GLY 92 -0.683 14.944 5.996 693 H TYR 93 H TYR 93 0.100 11.537 5.496 694 HA TYR 93 HA TYR 93 0.585 12.227 2.711 695 HB2 TYR 93 HB2 TYR 93 1.553 9.882 4.349 696 HB3 TYR 93 HB3 TYR 93 1.902 10.110 2.636 697 HD1 TYR 93 HD1 TYR 93 3.284 12.042 1.917 698 HD2 TYR 93 HD2 TYR 93 2.748 11.093 6.018 699 HE1 TYR 93 HE1 TYR 93 5.222 13.436 2.489 700 HE2 TYR 93 HE2 TYR 93 4.666 12.491 6.605 701 HH TYR 93 HH TYR 93 6.779 13.295 5.402 702 H ARG 94 H ARG 94 -0.161 11.051 1.042 703 HA ARG 94 HA ARG 94 -2.739 9.744 1.527 704 HB2 ARG 94 HB2 ARG 94 -3.250 10.238 -0.737 705 HB3 ARG 94 HB3 ARG 94 -2.452 11.668 -0.095 706 HG2 ARG 94 HG2 ARG 94 -0.329 10.622 -1.059 707 HG3 ARG 94 HG3 ARG 94 -1.401 9.644 -2.048 708 HD2 ARG 94 HD2 ARG 94 -0.888 11.575 -3.339 709 HD3 ARG 94 HD3 ARG 94 -2.506 11.872 -2.690 710 HE ARG 94 HE ARG 94 -0.413 12.795 -0.997 711 HH11 ARG 94 HH11 ARG 94 -2.474 13.722 -3.725 712 HH12 ARG 94 HH12 ARG 94 -2.202 15.385 -3.573 713 HH21 ARG 94 HH21 ARG 94 -0.060 15.071 -0.749 714 HH22 ARG 94 HH22 ARG 94 -0.764 16.186 -1.824 715 H ASP 95 H ASP 95 -3.242 7.980 -0.141 716 HA ASP 95 HA ASP 95 -1.860 5.669 0.473 717 HB2 ASP 95 HB2 ASP 95 -3.146 4.650 -1.441 718 HB3 ASP 95 HB3 ASP 95 -4.126 5.543 -0.283 719 H THR 96 H THR 96 -1.638 7.533 -2.514 720 HA THR 96 HA THR 96 0.142 5.850 -3.801 721 HB THR 96 HB THR 96 -0.268 8.830 -4.243 722 HG1 THR 96 HG1 THR 96 -2.046 6.962 -4.444 723 HG21 THR 96 HG21 THR 96 0.611 8.430 -6.478 724 HG22 THR 96 HG22 THR 96 0.767 6.700 -6.135 725 HG23 THR 96 HG23 THR 96 1.790 7.847 -5.295 726 H GLU 97 H GLU 97 0.736 8.527 -1.624 727 HA GLU 97 HA GLU 97 3.536 8.667 -2.034 728 HB2 GLU 97 HB2 GLU 97 1.824 9.543 0.294 729 HB3 GLU 97 HB3 GLU 97 3.541 9.893 0.150 730 HG2 GLU 97 HG2 GLU 97 3.176 11.221 -1.789 731 HG3 GLU 97 HG3 GLU 97 1.481 10.756 -1.867 732 H ILE 98 H ILE 98 1.454 6.835 0.115 733 HA ILE 98 HA ILE 98 3.417 5.843 1.923 734 HB ILE 98 HB ILE 98 1.062 4.215 0.974 735 HG12 ILE 98 HG12 ILE 98 0.022 6.285 1.579 736 HG13 ILE 98 HG13 ILE 98 -0.187 5.149 2.913 737 HG21 ILE 98 HG21 ILE 98 2.500 4.273 3.608 738 HG22 ILE 98 HG22 ILE 98 2.630 3.038 2.357 739 HG23 ILE 98 HG23 ILE 98 1.105 3.268 3.215 740 HD11 ILE 98 HD11 ILE 98 1.852 7.340 2.826 741 HD12 ILE 98 HD12 ILE 98 1.548 6.228 4.159 742 HD13 ILE 98 HD13 ILE 98 0.309 7.392 3.684 743 H MET 99 H MET 99 2.041 4.493 -1.009 744 HA MET 99 HA MET 99 3.753 2.245 -0.916 745 HB2 MET 99 HB2 MET 99 2.820 1.676 -3.180 746 HB3 MET 99 HB3 MET 99 1.673 1.771 -1.858 747 HG2 MET 99 HG2 MET 99 0.869 3.866 -2.625 748 HG3 MET 99 HG3 MET 99 2.153 3.977 -3.832 749 HE1 MET 99 HE1 MET 99 -1.336 3.392 -5.709 750 HE2 MET 99 HE2 MET 99 -0.043 4.558 -5.439 751 HE3 MET 99 HE3 MET 99 -1.157 4.149 -4.130 752 H ARG 100 H ARG 100 4.278 5.379 -2.024 753 HA ARG 100 HA ARG 100 5.859 4.931 -4.264 754 HB2 ARG 100 HB2 ARG 100 5.180 7.184 -3.559 755 HB3 ARG 100 HB3 ARG 100 6.243 7.066 -2.163 756 HG2 ARG 100 HG2 ARG 100 8.156 6.786 -3.697 757 HG3 ARG 100 HG3 ARG 100 7.065 7.059 -5.054 758 HD2 ARG 100 HD2 ARG 100 6.526 9.270 -4.152 759 HD3 ARG 100 HD3 ARG 100 7.634 8.962 -2.810 760 HE ARG 100 HE ARG 100 8.998 8.538 -5.185 761 HH11 ARG 100 HH11 ARG 100 7.658 11.232 -3.343 762 HH12 ARG 100 HH12 ARG 100 8.704 12.411 -3.979 763 HH21 ARG 100 HH21 ARG 100 10.428 10.144 -6.103 764 HH22 ARG 100 HH22 ARG 100 10.302 11.773 -5.614 765 H TRP 101 H TRP 101 7.098 5.533 -0.984 766 HA TRP 101 HA TRP 101 9.660 4.581 -1.682 767 HB2 TRP 101 HB2 TRP 101 10.053 4.667 0.880 768 HB3 TRP 101 HB3 TRP 101 9.766 6.168 0.018 769 HD1 TRP 101 HD1 TRP 101 7.638 7.530 0.634 770 HE1 TRP 101 HE1 TRP 101 5.898 7.347 2.501 771 HE3 TRP 101 HE3 TRP 101 8.757 2.854 2.335 772 HZ2 TRP 101 HZ2 TRP 101 5.086 5.470 4.422 773 HZ3 TRP 101 HZ3 TRP 101 7.443 1.925 4.157 774 HH2 TRP 101 HH2 TRP 101 5.641 3.207 5.208 775 H LEU 102 H LEU 102 6.900 3.032 -0.292 776 HA LEU 102 HA LEU 102 8.089 0.716 0.711 777 HB2 LEU 102 HB2 LEU 102 5.444 1.482 -0.243 778 HB3 LEU 102 HB3 LEU 102 5.723 -0.261 -0.151 779 HG LEU 102 HG LEU 102 5.957 1.731 2.118 780 HD11 LEU 102 HD11 LEU 102 3.856 0.772 2.889 781 HD12 LEU 102 HD12 LEU 102 3.792 -0.269 1.468 782 HD13 LEU 102 HD13 LEU 102 3.651 1.482 1.287 783 HD21 LEU 102 HD21 LEU 102 5.968 -1.265 2.028 784 HD22 LEU 102 HD22 LEU 102 5.995 -0.293 3.507 785 HD23 LEU 102 HD23 LEU 102 7.356 -0.238 2.375 786 H PHE 103 H PHE 103 7.076 1.447 -2.612 787 HA PHE 103 HA PHE 103 8.003 -1.192 -3.376 788 HB2 PHE 103 HB2 PHE 103 6.409 0.860 -4.858 789 HB3 PHE 103 HB3 PHE 103 7.078 -0.567 -5.646 790 HD1 PHE 103 HD1 PHE 103 4.676 0.621 -3.127 791 HD2 PHE 103 HD2 PHE 103 6.176 -2.719 -5.281 792 HE1 PHE 103 HE1 PHE 103 2.718 -0.686 -2.452 793 HE2 PHE 103 HE2 PHE 103 4.232 -4.040 -4.586 794 HZ PHE 103 HZ PHE 103 2.490 -3.011 -3.192 795 H THR 104 H THR 104 9.371 1.715 -3.046 796 HA THR 104 HA THR 104 11.059 1.508 -5.374 797 HB THR 104 HB THR 104 11.092 3.460 -3.047 798 HG1 THR 104 HG1 THR 104 9.311 3.783 -4.310 799 HG21 THR 104 HG21 THR 104 12.627 3.531 -5.662 800 HG22 THR 104 HG22 THR 104 13.328 3.249 -4.070 801 HG23 THR 104 HG23 THR 104 12.608 4.814 -4.452 802 HA PRO 105 HA PRO 105 13.862 -1.136 -2.996 803 HB2 PRO 105 HB2 PRO 105 15.593 -0.587 -5.348 804 HB3 PRO 105 HB3 PRO 105 15.117 -2.145 -4.667 805 HG2 PRO 105 HG2 PRO 105 14.083 -1.318 -6.972 806 HG3 PRO 105 HG3 PRO 105 13.071 -2.145 -5.775 807 HD2 PRO 105 HD2 PRO 105 13.277 0.780 -6.377 808 HD3 PRO 105 HD3 PRO 105 11.834 -0.220 -6.076 809 H ASP 106 H ASP 106 15.224 -0.342 -1.510 810 HA ASP 106 HA ASP 106 15.999 2.415 -1.730 811 HB2 ASP 106 HB2 ASP 106 15.196 1.469 0.420 812 HB3 ASP 106 HB3 ASP 106 16.623 0.439 0.457 813 HA PRO 107 HA PRO 107 19.817 1.534 -3.756 814 HB2 PRO 107 HB2 PRO 107 21.053 3.925 -3.193 815 HB3 PRO 107 HB3 PRO 107 19.877 3.691 -4.490 816 HG2 PRO 107 HG2 PRO 107 19.464 4.769 -1.728 817 HG3 PRO 107 HG3 PRO 107 18.821 5.373 -3.266 818 HD2 PRO 107 HD2 PRO 107 17.326 3.942 -1.606 819 HD3 PRO 107 HD3 PRO 107 17.192 3.708 -3.364 820 H SER 108 H SER 108 19.662 2.320 -0.370 821 HA SER 108 HA SER 108 22.475 1.528 -0.130 822 HB2 SER 108 HB2 SER 108 22.436 2.702 2.059 823 HB3 SER 108 HB3 SER 108 22.128 3.758 0.683 824 HG SER 108 HG SER 108 19.724 3.019 1.412 825 H LEU 109 H LEU 109 19.499 0.218 0.134 826 HA LEU 109 HA LEU 109 20.179 -1.141 2.607 827 HB2 LEU 109 HB2 LEU 109 17.994 0.040 2.449 828 HB3 LEU 109 HB3 LEU 109 17.555 -1.086 1.177 829 HG LEU 109 HG LEU 109 17.518 -2.928 2.709 830 HD11 LEU 109 HD11 LEU 109 19.376 -2.303 4.131 831 HD12 LEU 109 HD12 LEU 109 17.934 -2.619 5.101 832 HD13 LEU 109 HD13 LEU 109 18.447 -0.954 4.791 833 HD21 LEU 109 HD21 LEU 109 15.720 -2.218 4.179 834 HD22 LEU 109 HD22 LEU 109 15.524 -1.550 2.555 835 HD23 LEU 109 HD23 LEU 109 16.124 -0.528 3.866 836 H THR 110 H THR 110 20.721 -3.125 2.663 837 HA THR 110 HA THR 110 20.410 -4.837 0.304 838 HB THR 110 HB THR 110 22.468 -5.087 2.519 839 HG1 THR 110 HG1 THR 110 23.170 -3.318 1.709 840 HG21 THR 110 HG21 THR 110 22.049 -7.061 1.085 841 HG22 THR 110 HG22 THR 110 23.681 -6.426 0.862 842 HG23 THR 110 HG23 THR 110 22.432 -6.093 -0.337 843 H ILE 111 H ILE 111 19.043 -6.532 0.736 844 HA ILE 111 HA ILE 111 18.500 -7.113 3.573 845 HB ILE 111 HB ILE 111 16.449 -7.077 1.371 846 HG12 ILE 111 HG12 ILE 111 16.896 -5.040 3.560 847 HG13 ILE 111 HG13 ILE 111 17.197 -4.798 1.843 848 HG21 ILE 111 HG21 ILE 111 16.127 -7.324 4.347 849 HG22 ILE 111 HG22 ILE 111 15.961 -8.622 3.160 850 HG23 ILE 111 HG23 ILE 111 14.821 -7.259 3.149 851 HD11 ILE 111 HD11 ILE 111 15.105 -3.763 2.584 852 HD12 ILE 111 HD12 ILE 111 14.527 -5.348 3.090 853 HD13 ILE 111 HD13 ILE 111 14.812 -5.026 1.387 854 H THR 112 H THR 112 18.156 -9.190 4.021 855 HA THR 112 HA THR 112 18.632 -11.211 1.978 856 HB THR 112 HB THR 112 18.788 -12.649 4.101 857 HG1 THR 112 HG1 THR 112 17.665 -11.244 5.479 858 HG21 THR 112 HG21 THR 112 20.657 -10.300 3.841 859 HG22 THR 112 HG22 THR 112 20.807 -11.829 2.978 860 HG23 THR 112 HG23 THR 112 21.022 -11.778 4.735 861 H ARG 113 H ARG 113 16.766 -12.382 1.319 862 HA ARG 113 HA ARG 113 14.429 -11.871 2.981 863 HB2 ARG 113 HB2 ARG 113 13.005 -11.617 0.994 864 HB3 ARG 113 HB3 ARG 113 14.239 -10.386 1.107 865 HG2 ARG 113 HG2 ARG 113 15.542 -11.543 -0.620 866 HG3 ARG 113 HG3 ARG 113 14.275 -12.770 -0.739 867 HD2 ARG 113 HD2 ARG 113 12.651 -11.022 -1.331 868 HD3 ARG 113 HD3 ARG 113 13.927 -9.811 -1.248 869 HE ARG 113 HE ARG 113 14.652 -11.840 -3.054 870 HH11 ARG 113 HH11 ARG 113 12.430 -9.038 -2.797 871 HH12 ARG 113 HH12 ARG 113 12.307 -8.827 -4.469 872 HH21 ARG 113 HH21 ARG 113 14.453 -11.509 -5.348 873 HH22 ARG 113 HH22 ARG 113 13.421 -10.287 -5.965 874 H ASP 114 H ASP 114 12.499 -13.285 1.723 875 HA ASP 114 HA ASP 114 13.349 -15.959 2.495 876 HB2 ASP 114 HB2 ASP 114 11.342 -14.989 3.559 877 HB3 ASP 114 HB3 ASP 114 10.586 -14.844 1.980 878 H GLY 115 H GLY 115 13.535 -17.578 1.107 879 HA2 GLY 115 HA2 GLY 115 12.904 -18.724 -0.923 880 HA3 GLY 115 HA3 GLY 115 12.710 -17.138 -1.689 881 H SER 116 H SER 116 14.626 -15.749 -1.665 882 HA SER 116 HA SER 116 17.056 -17.322 -1.970 883 HB2 SER 116 HB2 SER 116 16.476 -14.461 -2.781 884 HB3 SER 116 HB3 SER 116 17.938 -15.375 -3.162 885 HG SER 116 HG SER 116 15.303 -15.988 -3.958 886 H ARG 117 H ARG 117 17.897 -17.506 -0.012 887 HA ARG 117 HA ARG 117 17.390 -15.499 1.962 888 HB2 ARG 117 HB2 ARG 117 18.645 -16.977 3.537 889 HB3 ARG 117 HB3 ARG 117 17.206 -17.660 2.812 890 HG2 ARG 117 HG2 ARG 117 18.848 -19.381 2.932 891 HG3 ARG 117 HG3 ARG 117 18.698 -18.923 1.248 892 HD2 ARG 117 HD2 ARG 117 20.789 -17.759 1.303 893 HD3 ARG 117 HD3 ARG 117 20.875 -17.874 3.065 894 HE ARG 117 HE ARG 117 20.720 -20.437 2.294 895 HH11 ARG 117 HH11 ARG 117 22.980 -17.897 1.067 896 HH12 ARG 117 HH12 ARG 117 24.244 -19.000 0.945 897 HH21 ARG 117 HH21 ARG 117 22.518 -21.844 2.089 898 HH22 ARG 117 HH22 ARG 117 24.013 -21.268 1.531 899 H ASP 118 H ASP 118 19.498 -15.478 -0.314 900 HA ASP 118 HA ASP 118 21.779 -14.566 1.207 901 HB2 ASP 118 HB2 ASP 118 21.311 -14.667 -1.769 902 HB3 ASP 118 HB3 ASP 118 22.782 -14.055 -1.019 903 H ALA 119 H ALA 119 22.767 -12.481 0.705 904 HA ALA 119 HA ALA 119 20.917 -10.416 1.226 905 HB1 ALA 119 HB1 ALA 119 22.869 -8.950 1.176 906 HB2 ALA 119 HB2 ALA 119 23.834 -10.249 0.475 907 HB3 ALA 119 HB3 ALA 119 23.193 -10.410 2.111 908 H VAL 120 H VAL 120 19.774 -9.322 -0.127 909 HA VAL 120 HA VAL 120 20.519 -9.176 -2.951 910 HB VAL 120 HB VAL 120 17.831 -8.640 -1.641 911 HG11 VAL 120 HG11 VAL 120 16.932 -8.728 -3.919 912 HG12 VAL 120 HG12 VAL 120 18.566 -8.931 -4.547 913 HG13 VAL 120 HG13 VAL 120 18.120 -7.437 -3.727 914 HG21 VAL 120 HG21 VAL 120 18.748 -11.095 -3.136 915 HG22 VAL 120 HG22 VAL 120 17.094 -10.786 -2.602 916 HG23 VAL 120 HG23 VAL 120 18.381 -10.999 -1.414 917 H SER 121 H SER 121 21.344 -7.272 -3.507 918 HA SER 121 HA SER 121 21.139 -5.023 -1.738 919 HB2 SER 121 HB2 SER 121 22.592 -4.013 -3.624 920 HB3 SER 121 HB3 SER 121 23.288 -5.316 -2.656 921 HG SER 121 HG SER 121 23.638 -5.709 -4.833 922 H ASN 122 H ASN 122 19.989 -3.209 -2.012 923 HA ASN 122 HA ASN 122 18.480 -1.794 -2.698 924 HB2 ASN 122 HB2 ASN 122 18.765 -2.948 -5.501 925 HB3 ASN 122 HB3 ASN 122 17.944 -1.462 -5.041 926 HD21 ASN 122 HD21 ASN 122 20.981 -2.976 -5.648 927 HD22 ASN 122 HD22 ASN 122 21.947 -1.558 -5.564 928 H ALA 123 H ALA 123 17.292 -3.401 -1.279 929 HA ALA 123 HA ALA 123 15.141 -4.534 -2.894 930 HB1 ALA 123 HB1 ALA 123 16.262 -6.203 -1.561 931 HB2 ALA 123 HB2 ALA 123 14.644 -5.942 -0.895 932 HB3 ALA 123 HB3 ALA 123 16.062 -5.232 -0.114 933 H ARG 124 H ARG 124 12.976 -4.528 -1.598 934 HA ARG 124 HA ARG 124 12.409 -1.717 -1.121 935 HB2 ARG 124 HB2 ARG 124 10.647 -4.149 -1.315 936 HB3 ARG 124 HB3 ARG 124 10.079 -2.498 -1.162 937 HG2 ARG 124 HG2 ARG 124 10.979 -1.957 -3.324 938 HG3 ARG 124 HG3 ARG 124 11.697 -3.578 -3.426 939 HD2 ARG 124 HD2 ARG 124 9.556 -4.612 -3.420 940 HD3 ARG 124 HD3 ARG 124 8.750 -3.084 -3.095 941 HE ARG 124 HE ARG 124 9.893 -2.530 -5.394 942 HH11 ARG 124 HH11 ARG 124 8.215 -5.526 -4.454 943 HH12 ARG 124 HH12 ARG 124 7.581 -5.823 -5.980 944 HH21 ARG 124 HH21 ARG 124 8.963 -2.964 -7.552 945 HH22 ARG 124 HH22 ARG 124 7.956 -4.327 -7.744 946 HA PRO 125 HA PRO 125 11.777 -2.219 3.341 947 HB2 PRO 125 HB2 PRO 125 9.226 -0.742 2.875 948 HB3 PRO 125 HB3 PRO 125 10.525 -0.382 4.017 949 HG2 PRO 125 HG2 PRO 125 10.222 1.093 1.823 950 HG3 PRO 125 HG3 PRO 125 11.838 0.655 2.410 951 HD2 PRO 125 HD2 PRO 125 10.277 -0.483 0.126 952 HD3 PRO 125 HD3 PRO 125 12.019 -0.154 0.257 953 H VAL 126 H VAL 126 9.353 -2.827 0.941 954 HA VAL 126 HA VAL 126 7.526 -4.412 2.383 955 HB VAL 126 HB VAL 126 8.284 -4.533 -0.562 956 HG11 VAL 126 HG11 VAL 126 5.852 -5.617 0.841 957 HG12 VAL 126 HG12 VAL 126 7.144 -6.583 0.111 958 HG13 VAL 126 HG13 VAL 126 6.109 -5.558 -0.896 959 HG21 VAL 126 HG21 VAL 126 6.291 -3.184 -0.908 960 HG22 VAL 126 HG22 VAL 126 7.456 -2.366 0.130 961 HG23 VAL 126 HG23 VAL 126 6.023 -3.126 0.834 962 H ASP 127 H ASP 127 10.545 -5.208 0.688 963 HA ASP 127 HA ASP 127 10.412 -8.005 1.183 964 HB2 ASP 127 HB2 ASP 127 12.821 -6.232 0.670 965 HB3 ASP 127 HB3 ASP 127 12.878 -7.986 0.730 966 H ALA 128 H ALA 128 11.811 -5.276 2.828 967 HA ALA 128 HA ALA 128 13.273 -6.583 4.809 968 HB1 ALA 128 HB1 ALA 128 11.941 -3.899 5.052 969 HB2 ALA 128 HB2 ALA 128 13.504 -4.177 4.296 970 HB3 ALA 128 HB3 ALA 128 13.289 -4.486 6.019 971 H LEU 129 H LEU 129 9.875 -5.580 4.856 972 HA LEU 129 HA LEU 129 9.560 -6.196 7.595 973 HB2 LEU 129 HB2 LEU 129 7.151 -5.952 7.267 974 HB3 LEU 129 HB3 LEU 129 8.040 -4.635 6.540 975 HG LEU 129 HG LEU 129 7.762 -6.099 4.376 976 HD11 LEU 129 HD11 LEU 129 5.626 -7.278 4.317 977 HD12 LEU 129 HD12 LEU 129 5.421 -6.951 6.045 978 HD13 LEU 129 HD13 LEU 129 6.756 -7.963 5.496 979 HD21 LEU 129 HD21 LEU 129 5.707 -4.838 3.860 980 HD22 LEU 129 HD22 LEU 129 6.927 -3.827 4.633 981 HD23 LEU 129 HD23 LEU 129 5.554 -4.415 5.566 982 H HIS 130 H HIS 130 9.040 -8.204 4.740 983 HA HIS 130 HA HIS 130 8.168 -10.420 6.340 984 HB2 HIS 130 HB2 HIS 130 8.846 -10.118 3.426 985 HB3 HIS 130 HB3 HIS 130 8.641 -11.718 4.127 986 HD1 HIS 130 HD1 HIS 130 6.732 -9.302 2.329 987 HD2 HIS 130 HD2 HIS 130 5.996 -11.784 5.579 988 HE1 HIS 130 HE1 HIS 130 4.226 -9.511 2.505 989 H ALA 131 H ALA 131 11.079 -9.038 5.629 990 HA ALA 131 HA ALA 131 12.662 -11.467 6.009 991 HB1 ALA 131 HB1 ALA 131 14.578 -10.066 5.512 992 HB2 ALA 131 HB2 ALA 131 13.553 -8.633 5.552 993 HB3 ALA 131 HB3 ALA 131 13.321 -9.844 4.291 994 H HIS 132 H HIS 132 11.072 -9.568 8.024 995 HA HIS 132 HA HIS 132 11.107 -9.118 10.239 996 HB2 HIS 132 HB2 HIS 132 13.428 -11.068 10.248 997 HB3 HIS 132 HB3 HIS 132 12.786 -10.342 11.715 998 HD1 HIS 132 HD1 HIS 132 12.479 -13.374 9.833 999 HD2 HIS 132 HD2 HIS 132 9.824 -10.873 11.839 1000 HE1 HIS 132 HE1 HIS 132 10.425 -14.750 10.294 1001 H GLN 133 H GLN 133 12.547 -7.493 8.357 1002 HA GLN 133 HA GLN 133 14.334 -6.109 10.221 1003 HB2 GLN 133 HB2 GLN 133 14.344 -6.124 7.191 1004 HB3 GLN 133 HB3 GLN 133 15.371 -5.080 8.173 1005 HG2 GLN 133 HG2 GLN 133 16.336 -7.118 9.214 1006 HG3 GLN 133 HG3 GLN 133 15.389 -8.089 8.099 1007 HE21 GLN 133 HE21 GLN 133 17.228 -9.005 7.271 1008 HE22 GLN 133 HE22 GLN 133 18.319 -8.165 6.228 1009 H ALA 134 H ALA 134 11.494 -6.124 9.968 1010 HA ALA 134 HA ALA 134 10.276 -3.963 8.722 1011 HB1 ALA 134 HB1 ALA 134 9.457 -5.250 11.321 1012 HB2 ALA 134 HB2 ALA 134 9.071 -5.866 9.717 1013 HB3 ALA 134 HB3 ALA 134 8.423 -4.312 10.245 1014 H ARG 135 H ARG 135 12.083 -4.074 11.679 1015 HA ARG 135 HA ARG 135 11.335 -1.705 12.942 1016 HB2 ARG 135 HB2 ARG 135 14.078 -2.936 12.731 1017 HB3 ARG 135 HB3 ARG 135 13.629 -1.685 13.878 1018 HG2 ARG 135 HG2 ARG 135 12.132 -3.140 15.005 1019 HG3 ARG 135 HG3 ARG 135 12.279 -4.366 13.751 1020 HD2 ARG 135 HD2 ARG 135 14.426 -3.408 15.613 1021 HD3 ARG 135 HD3 ARG 135 13.619 -4.979 15.675 1022 HE ARG 135 HE ARG 135 15.470 -4.068 13.565 1023 HH11 ARG 135 HH11 ARG 135 13.835 -6.795 15.186 1024 HH12 ARG 135 HH12 ARG 135 14.836 -7.958 14.443 1025 HH21 ARG 135 HH21 ARG 135 16.742 -5.676 12.571 1026 HH22 ARG 135 HH22 ARG 135 16.497 -7.324 12.920 1027 H GLU 136 H GLU 136 13.591 -2.212 10.242 1028 HA GLU 136 HA GLU 136 14.376 0.520 10.110 1029 HB2 GLU 136 HB2 GLU 136 14.767 -1.838 8.312 1030 HB3 GLU 136 HB3 GLU 136 15.174 -0.221 7.756 1031 HG2 GLU 136 HG2 GLU 136 16.287 -1.559 10.206 1032 HG3 GLU 136 HG3 GLU 136 17.113 -1.405 8.651 1033 H VAL 137 H VAL 137 11.820 -1.357 8.771 1034 HA VAL 137 HA VAL 137 11.047 0.436 6.705 1035 HB VAL 137 HB VAL 137 9.300 -1.503 8.257 1036 HG11 VAL 137 HG11 VAL 137 7.851 -1.485 6.272 1037 HG12 VAL 137 HG12 VAL 137 8.878 -0.255 5.537 1038 HG13 VAL 137 HG13 VAL 137 7.977 0.112 7.008 1039 HG21 VAL 137 HG21 VAL 137 9.723 -3.082 6.436 1040 HG22 VAL 137 HG22 VAL 137 11.214 -2.628 7.263 1041 HG23 VAL 137 HG23 VAL 137 10.828 -1.920 5.698 1042 H VAL 138 H VAL 138 9.929 -0.071 10.021 1043 HA VAL 138 HA VAL 138 8.069 2.042 10.088 1044 HB VAL 138 HB VAL 138 9.627 0.872 12.419 1045 HG11 VAL 138 HG11 VAL 138 8.594 3.005 12.983 1046 HG12 VAL 138 HG12 VAL 138 7.761 1.684 13.807 1047 HG13 VAL 138 HG13 VAL 138 7.044 2.431 12.376 1048 HG21 VAL 138 HG21 VAL 138 8.394 -0.853 11.206 1049 HG22 VAL 138 HG22 VAL 138 6.921 0.111 11.314 1050 HG23 VAL 138 HG23 VAL 138 7.654 -0.549 12.776 1051 H ARG 139 H ARG 139 11.449 1.881 11.106 1052 HA ARG 139 HA ARG 139 11.799 4.471 12.065 1053 HB2 ARG 139 HB2 ARG 139 13.436 2.729 12.386 1054 HB3 ARG 139 HB3 ARG 139 13.706 2.614 10.656 1055 HG2 ARG 139 HG2 ARG 139 14.631 4.913 10.693 1056 HG3 ARG 139 HG3 ARG 139 14.443 4.914 12.450 1057 HD2 ARG 139 HD2 ARG 139 15.911 3.036 12.664 1058 HD3 ARG 139 HD3 ARG 139 16.043 2.888 10.917 1059 HE ARG 139 HE ARG 139 16.846 5.436 11.923 1060 HH11 ARG 139 HH11 ARG 139 17.924 2.128 11.188 1061 HH12 ARG 139 HH12 ARG 139 19.582 2.548 11.188 1062 HH21 ARG 139 HH21 ARG 139 19.074 5.959 11.913 1063 HH22 ARG 139 HH22 ARG 139 20.264 4.750 11.640 1064 H ARG 140 H ARG 140 12.234 3.202 8.784 1065 HA ARG 140 HA ARG 140 13.126 5.645 7.693 1066 HB2 ARG 140 HB2 ARG 140 13.371 3.187 6.881 1067 HB3 ARG 140 HB3 ARG 140 11.849 3.496 6.072 1068 HG2 ARG 140 HG2 ARG 140 12.753 5.066 4.648 1069 HG3 ARG 140 HG3 ARG 140 14.127 5.386 5.712 1070 HD2 ARG 140 HD2 ARG 140 13.633 2.868 4.143 1071 HD3 ARG 140 HD3 ARG 140 14.848 4.109 3.786 1072 HE ARG 140 HE ARG 140 15.007 2.893 6.423 1073 HH11 ARG 140 HH11 ARG 140 16.360 2.930 3.125 1074 HH12 ARG 140 HH12 ARG 140 17.738 2.072 3.572 1075 HH21 ARG 140 HH21 ARG 140 16.920 1.650 6.993 1076 HH22 ARG 140 HH22 ARG 140 18.051 1.303 5.775 1077 H ALA 141 H ALA 141 9.962 4.153 8.061 1078 HA ALA 141 HA ALA 141 8.489 5.965 6.482 1079 HB1 ALA 141 HB1 ALA 141 7.538 3.855 7.210 1080 HB2 ALA 141 HB2 ALA 141 6.558 5.185 7.831 1081 HB3 ALA 141 HB3 ALA 141 7.680 4.344 8.897 1082 H GLN 142 H GLN 142 9.322 5.916 9.930 1083 HA GLN 142 HA GLN 142 8.124 8.300 10.778 1084 HB2 GLN 142 HB2 GLN 142 10.813 7.214 11.652 1085 HB3 GLN 142 HB3 GLN 142 9.855 8.391 12.525 1086 HG2 GLN 142 HG2 GLN 142 9.013 5.549 11.991 1087 HG3 GLN 142 HG3 GLN 142 9.796 6.099 13.464 1088 HE21 GLN 142 HE21 GLN 142 8.308 8.604 13.614 1089 HE22 GLN 142 HE22 GLN 142 6.702 8.163 14.050 1090 H ALA 143 H ALA 143 11.294 7.726 9.349 1091 HA ALA 143 HA ALA 143 12.241 10.386 9.446 1092 HB1 ALA 143 HB1 ALA 143 13.712 8.425 9.222 1093 HB2 ALA 143 HB2 ALA 143 14.011 9.632 7.972 1094 HB3 ALA 143 HB3 ALA 143 13.097 8.174 7.589 1095 H MET 144 H MET 144 10.452 8.619 7.029 1096 HA MET 144 HA MET 144 10.657 10.614 5.003 1097 HB2 MET 144 HB2 MET 144 10.185 8.233 4.504 1098 HB3 MET 144 HB3 MET 144 8.652 8.362 5.340 1099 HG2 MET 144 HG2 MET 144 9.305 9.994 2.891 1100 HG3 MET 144 HG3 MET 144 8.625 8.379 2.799 1101 HE1 MET 144 HE1 MET 144 7.359 10.940 1.421 1102 HE2 MET 144 HE2 MET 144 5.647 10.723 1.782 1103 HE3 MET 144 HE3 MET 144 6.627 9.338 1.307 1104 H ALA 145 H ALA 145 8.354 9.883 7.533 1105 HA ALA 145 HA ALA 145 6.499 11.823 6.658 1106 HB1 ALA 145 HB1 ALA 145 6.666 10.505 9.343 1107 HB2 ALA 145 HB2 ALA 145 5.821 9.854 7.940 1108 HB3 ALA 145 HB3 ALA 145 5.272 11.362 8.683 1109 H TYR 146 H TYR 146 8.823 11.781 9.359 1110 HA TYR 146 HA TYR 146 8.196 14.614 9.769 1111 HB2 TYR 146 HB2 TYR 146 9.668 12.709 11.606 1112 HB3 TYR 146 HB3 TYR 146 9.198 14.358 11.984 1113 HD1 TYR 146 HD1 TYR 146 6.792 14.894 12.367 1114 HD2 TYR 146 HD2 TYR 146 8.126 10.903 11.770 1115 HE1 TYR 146 HE1 TYR 146 4.679 14.051 13.299 1116 HE2 TYR 146 HE2 TYR 146 6.029 10.053 12.697 1117 HH TYR 146 HH TYR 146 3.302 12.038 13.230 Start of MODEL 21 1 H MET 1 H MET 1 -30.831 2.023 31.082 2 HA MET 1 HA MET 1 -30.289 0.119 32.327 3 HB2 MET 1 HB2 MET 1 -30.705 -2.157 31.403 4 HB3 MET 1 HB3 MET 1 -32.192 -1.332 31.829 5 HG2 MET 1 HG2 MET 1 -32.653 -0.886 29.505 6 HG3 MET 1 HG3 MET 1 -31.086 -1.532 29.035 7 HE1 MET 1 HE1 MET 1 -34.635 -2.394 30.520 8 HE2 MET 1 HE2 MET 1 -33.548 -3.023 31.759 9 HE3 MET 1 HE3 MET 1 -34.502 -4.133 30.775 10 HA PRO 2 HA PRO 2 -26.851 0.363 29.499 11 HB2 PRO 2 HB2 PRO 2 -24.897 -0.079 31.234 12 HB3 PRO 2 HB3 PRO 2 -25.883 1.384 31.376 13 HG2 PRO 2 HG2 PRO 2 -26.014 -1.146 32.955 14 HG3 PRO 2 HG3 PRO 2 -26.195 0.525 33.509 15 HD2 PRO 2 HD2 PRO 2 -28.286 -1.237 32.929 16 HD3 PRO 2 HD3 PRO 2 -28.422 0.527 33.072 17 H GLY 3 H GLY 3 -24.819 -1.156 29.112 18 HA2 GLY 3 HA2 GLY 3 -23.901 -3.363 29.523 19 HA3 GLY 3 HA3 GLY 3 -25.548 -3.939 29.732 20 H ARG 4 H ARG 4 -26.290 -2.192 27.362 21 HA ARG 4 HA ARG 4 -26.012 -4.288 25.441 22 HB2 ARG 4 HB2 ARG 4 -28.048 -2.946 25.492 23 HB3 ARG 4 HB3 ARG 4 -27.122 -1.490 25.180 24 HG2 ARG 4 HG2 ARG 4 -26.526 -2.334 22.976 25 HG3 ARG 4 HG3 ARG 4 -27.463 -3.794 23.275 26 HD2 ARG 4 HD2 ARG 4 -29.479 -2.428 23.545 27 HD3 ARG 4 HD3 ARG 4 -28.533 -0.973 23.232 28 HE ARG 4 HE ARG 4 -28.215 -2.846 21.152 29 HH11 ARG 4 HH11 ARG 4 -30.554 -0.482 22.391 30 HH12 ARG 4 HH12 ARG 4 -31.291 -0.234 20.874 31 HH21 ARG 4 HH21 ARG 4 -29.228 -2.479 19.083 32 HH22 ARG 4 HH22 ARG 4 -30.519 -1.387 18.960 33 H ALA 5 H ALA 5 -24.594 -4.467 23.822 34 HA ALA 5 HA ALA 5 -22.686 -2.268 23.457 35 HB1 ALA 5 HB1 ALA 5 -22.171 -5.234 23.237 36 HB2 ALA 5 HB2 ALA 5 -21.660 -4.194 24.566 37 HB3 ALA 5 HB3 ALA 5 -20.991 -3.955 22.952 38 HA PRO 6 HA PRO 6 -24.647 -2.565 19.352 39 HB2 PRO 6 HB2 PRO 6 -23.075 -0.099 18.931 40 HB3 PRO 6 HB3 PRO 6 -24.812 -0.359 18.747 41 HG2 PRO 6 HG2 PRO 6 -23.832 1.079 20.778 42 HG3 PRO 6 HG3 PRO 6 -25.237 0.019 20.991 43 HD2 PRO 6 HD2 PRO 6 -22.378 -0.447 21.759 44 HD3 PRO 6 HD3 PRO 6 -23.869 -0.798 22.663 45 H GLY 7 H GLY 7 -23.748 -2.743 17.203 46 HA2 GLY 7 HA2 GLY 7 -21.194 -4.075 17.177 47 HA3 GLY 7 HA3 GLY 7 -22.294 -3.875 15.817 48 H SER 8 H SER 8 -20.508 -1.708 17.907 49 HA SER 8 HA SER 8 -19.385 -0.424 15.529 50 HB2 SER 8 HB2 SER 8 -21.070 0.967 16.780 51 HB3 SER 8 HB3 SER 8 -20.039 0.863 18.196 52 HG SER 8 HG SER 8 -19.928 2.576 16.210 53 H THR 9 H THR 9 -17.420 -1.365 15.471 54 HA THR 9 HA THR 9 -15.682 -0.981 17.794 55 HB THR 9 HB THR 9 -16.532 -3.360 17.741 56 HG1 THR 9 HG1 THR 9 -14.158 -2.543 18.163 57 HG21 THR 9 HG21 THR 9 -15.024 -3.461 15.124 58 HG22 THR 9 HG22 THR 9 -16.767 -3.597 15.322 59 HG23 THR 9 HG23 THR 9 -15.704 -4.861 15.957 60 H LEU 10 H LEU 10 -16.251 0.086 14.969 61 HA LEU 10 HA LEU 10 -13.632 -0.425 13.792 62 HB2 LEU 10 HB2 LEU 10 -16.263 0.167 12.526 63 HB3 LEU 10 HB3 LEU 10 -14.750 0.322 11.641 64 HG LEU 10 HG LEU 10 -15.918 -2.200 12.830 65 HD11 LEU 10 HD11 LEU 10 -15.537 -1.268 10.009 66 HD12 LEU 10 HD12 LEU 10 -17.082 -1.394 10.858 67 HD13 LEU 10 HD13 LEU 10 -16.152 -2.853 10.482 68 HD21 LEU 10 HD21 LEU 10 -13.493 -2.291 12.923 69 HD22 LEU 10 HD22 LEU 10 -13.390 -1.757 11.243 70 HD23 LEU 10 HD23 LEU 10 -14.086 -3.325 11.627 71 H ALA 11 H ALA 11 -12.468 1.165 13.074 72 HA ALA 11 HA ALA 11 -13.341 3.892 13.678 73 HB1 ALA 11 HB1 ALA 11 -10.936 4.433 13.930 74 HB2 ALA 11 HB2 ALA 11 -10.542 2.736 13.648 75 HB3 ALA 11 HB3 ALA 11 -11.453 3.203 15.081 76 H ARG 12 H ARG 12 -14.171 4.403 11.768 77 HA ARG 12 HA ARG 12 -12.894 3.599 9.289 78 HB2 ARG 12 HB2 ARG 12 -15.493 5.012 9.876 79 HB3 ARG 12 HB3 ARG 12 -14.958 4.545 8.267 80 HG2 ARG 12 HG2 ARG 12 -15.093 2.230 8.813 81 HG3 ARG 12 HG3 ARG 12 -15.374 2.592 10.516 82 HD2 ARG 12 HD2 ARG 12 -17.507 3.614 9.970 83 HD3 ARG 12 HD3 ARG 12 -17.219 3.343 8.251 84 HE ARG 12 HE ARG 12 -17.270 0.967 8.713 85 HH11 ARG 12 HH11 ARG 12 -18.704 3.040 11.239 86 HH12 ARG 12 HH12 ARG 12 -19.849 1.891 11.738 87 HH21 ARG 12 HH21 ARG 12 -18.881 -0.616 9.402 88 HH22 ARG 12 HH22 ARG 12 -19.942 -0.258 10.667 89 H VAL 13 H VAL 13 -11.780 5.566 11.056 90 HA VAL 13 HA VAL 13 -12.055 8.085 9.668 91 HB VAL 13 HB VAL 13 -11.858 8.038 12.134 92 HG11 VAL 13 HG11 VAL 13 -10.352 6.187 12.414 93 HG12 VAL 13 HG12 VAL 13 -9.709 7.624 13.212 94 HG13 VAL 13 HG13 VAL 13 -9.043 7.104 11.663 95 HG21 VAL 13 HG21 VAL 13 -11.260 10.087 11.000 96 HG22 VAL 13 HG22 VAL 13 -9.609 9.502 10.770 97 HG23 VAL 13 HG23 VAL 13 -10.210 9.836 12.392 98 H GLY 14 H GLY 14 -10.245 5.377 9.446 99 HA2 GLY 14 HA2 GLY 14 -7.910 6.640 8.223 100 HA3 GLY 14 HA3 GLY 14 -8.076 4.928 8.605 101 H SER 15 H SER 15 -9.889 7.281 6.716 102 HA SER 15 HA SER 15 -10.260 5.265 4.651 103 HB2 SER 15 HB2 SER 15 -11.383 8.064 4.845 104 HB3 SER 15 HB3 SER 15 -11.911 6.797 3.734 105 HG SER 15 HG SER 15 -11.939 6.030 6.355 106 H ILE 16 H ILE 16 -8.520 5.156 3.329 107 HA ILE 16 HA ILE 16 -7.243 7.665 2.537 108 HB ILE 16 HB ILE 16 -6.152 4.820 2.382 109 HG12 ILE 16 HG12 ILE 16 -4.256 5.856 3.802 110 HG13 ILE 16 HG13 ILE 16 -5.373 7.179 4.092 111 HG21 ILE 16 HG21 ILE 16 -4.821 7.340 1.439 112 HG22 ILE 16 HG22 ILE 16 -5.440 6.036 0.430 113 HG23 ILE 16 HG23 ILE 16 -4.070 5.743 1.505 114 HD11 ILE 16 HD11 ILE 16 -6.934 5.610 5.131 115 HD12 ILE 16 HD12 ILE 16 -5.365 5.609 5.934 116 HD13 ILE 16 HD13 ILE 16 -5.794 4.296 4.840 117 HA PRO 17 HA PRO 17 -9.376 6.929 -1.344 118 HB2 PRO 17 HB2 PRO 17 -8.139 9.008 -2.686 119 HB3 PRO 17 HB3 PRO 17 -9.601 9.174 -1.721 120 HG2 PRO 17 HG2 PRO 17 -6.817 9.920 -1.073 121 HG3 PRO 17 HG3 PRO 17 -8.334 10.632 -0.526 122 HD2 PRO 17 HD2 PRO 17 -6.750 8.989 1.001 123 HD3 PRO 17 HD3 PRO 17 -8.486 9.231 1.268 124 H ALA 18 H ALA 18 -8.827 5.811 -3.141 125 HA ALA 18 HA ALA 18 -6.091 4.899 -3.405 126 HB1 ALA 18 HB1 ALA 18 -7.971 3.322 -3.594 127 HB2 ALA 18 HB2 ALA 18 -6.999 3.364 -5.061 128 HB3 ALA 18 HB3 ALA 18 -8.553 4.198 -5.013 129 H GLY 19 H GLY 19 -4.630 5.808 -4.755 130 HA2 GLY 19 HA2 GLY 19 -5.666 7.457 -6.946 131 HA3 GLY 19 HA3 GLY 19 -4.178 7.774 -6.061 132 H ASP 20 H ASP 20 -2.293 6.671 -6.608 133 HA ASP 20 HA ASP 20 -2.539 5.233 -9.164 134 HB2 ASP 20 HB2 ASP 20 -0.329 7.003 -8.150 135 HB3 ASP 20 HB3 ASP 20 -0.135 5.929 -9.522 136 H ASP 21 H ASP 21 -1.729 3.316 -9.402 137 HA ASP 21 HA ASP 21 -0.624 1.869 -7.180 138 HB2 ASP 21 HB2 ASP 21 -2.146 0.769 -8.748 139 HB3 ASP 21 HB3 ASP 21 -1.059 1.172 -10.071 140 H VAL 22 H VAL 22 1.424 0.941 -7.122 141 HA VAL 22 HA VAL 22 3.436 2.474 -8.624 142 HB VAL 22 HB VAL 22 3.658 1.480 -5.755 143 HG11 VAL 22 HG11 VAL 22 5.715 2.793 -5.636 144 HG12 VAL 22 HG12 VAL 22 5.546 3.196 -7.350 145 HG13 VAL 22 HG13 VAL 22 5.823 1.524 -6.860 146 HG21 VAL 22 HG21 VAL 22 3.581 3.864 -5.139 147 HG22 VAL 22 HG22 VAL 22 2.098 3.333 -5.937 148 HG23 VAL 22 HG23 VAL 22 3.291 4.274 -6.828 149 H LEU 23 H LEU 23 2.263 -0.698 -7.957 150 HA LEU 23 HA LEU 23 4.876 -1.789 -8.563 151 HB2 LEU 23 HB2 LEU 23 3.840 -4.060 -8.159 152 HB3 LEU 23 HB3 LEU 23 3.967 -3.009 -6.779 153 HG LEU 23 HG LEU 23 1.531 -2.556 -6.935 154 HD11 LEU 23 HD11 LEU 23 0.115 -4.014 -8.305 155 HD12 LEU 23 HD12 LEU 23 1.550 -4.731 -9.038 156 HD13 LEU 23 HD13 LEU 23 1.172 -3.029 -9.318 157 HD21 LEU 23 HD21 LEU 23 2.420 -4.241 -5.458 158 HD22 LEU 23 HD22 LEU 23 2.305 -5.449 -6.736 159 HD23 LEU 23 HD23 LEU 23 0.838 -4.711 -6.079 160 H ASP 24 H ASP 24 4.641 -3.911 -10.038 161 HA ASP 24 HA ASP 24 3.257 -2.909 -12.431 162 HB2 ASP 24 HB2 ASP 24 5.718 -3.361 -12.684 163 HB3 ASP 24 HB3 ASP 24 5.415 -5.050 -12.282 164 HA PRO 25 HA PRO 25 0.138 -5.964 -11.697 165 HB2 PRO 25 HB2 PRO 25 0.080 -6.287 -14.662 166 HB3 PRO 25 HB3 PRO 25 -1.245 -5.989 -13.536 167 HG2 PRO 25 HG2 PRO 25 -0.325 -3.999 -15.020 168 HG3 PRO 25 HG3 PRO 25 -0.749 -3.730 -13.323 169 HD2 PRO 25 HD2 PRO 25 1.957 -4.032 -14.565 170 HD3 PRO 25 HD3 PRO 25 1.416 -2.934 -13.279 171 H ASP 26 H ASP 26 2.959 -6.774 -13.603 172 HA ASP 26 HA ASP 26 2.439 -9.592 -13.660 173 HB2 ASP 26 HB2 ASP 26 3.996 -8.518 -15.259 174 HB3 ASP 26 HB3 ASP 26 5.101 -8.177 -13.928 175 H GLU 27 H GLU 27 3.699 -7.412 -11.290 176 HA GLU 27 HA GLU 27 4.966 -9.423 -9.678 177 HB2 GLU 27 HB2 GLU 27 4.072 -6.598 -8.979 178 HB3 GLU 27 HB3 GLU 27 5.060 -7.619 -7.950 179 HG2 GLU 27 HG2 GLU 27 6.801 -7.618 -9.704 180 HG3 GLU 27 HG3 GLU 27 5.820 -6.489 -10.635 181 HA PRO 28 HA PRO 28 1.426 -11.145 -7.706 182 HB2 PRO 28 HB2 PRO 28 2.179 -11.086 -5.025 183 HB3 PRO 28 HB3 PRO 28 2.638 -12.339 -6.181 184 HG2 PRO 28 HG2 PRO 28 4.171 -9.935 -5.283 185 HG3 PRO 28 HG3 PRO 28 4.747 -11.587 -5.568 186 HD2 PRO 28 HD2 PRO 28 5.194 -9.669 -7.355 187 HD3 PRO 28 HD3 PRO 28 4.763 -11.310 -7.876 188 H THR 29 H THR 29 -0.370 -9.938 -7.766 189 HA THR 29 HA THR 29 -0.692 -7.776 -5.799 190 HB THR 29 HB THR 29 -2.209 -7.842 -8.402 191 HG1 THR 29 HG1 THR 29 0.412 -7.800 -8.468 192 HG21 THR 29 HG21 THR 29 -2.195 -5.412 -8.101 193 HG22 THR 29 HG22 THR 29 -1.175 -5.592 -6.675 194 HG23 THR 29 HG23 THR 29 -2.817 -6.224 -6.662 195 H TYR 30 H TYR 30 -3.131 -7.456 -5.317 196 HA TYR 30 HA TYR 30 -4.775 -9.772 -5.800 197 HB2 TYR 30 HB2 TYR 30 -4.383 -8.310 -3.183 198 HB3 TYR 30 HB3 TYR 30 -5.896 -9.120 -3.560 199 HD1 TYR 30 HD1 TYR 30 -5.148 -11.602 -4.774 200 HD2 TYR 30 HD2 TYR 30 -3.256 -9.525 -1.587 201 HE1 TYR 30 HE1 TYR 30 -4.263 -13.718 -3.944 202 HE2 TYR 30 HE2 TYR 30 -2.348 -11.641 -0.744 203 HH TYR 30 HH TYR 30 -2.440 -14.489 -2.625 204 H ASP 31 H ASP 31 -7.050 -9.088 -5.524 205 HA ASP 31 HA ASP 31 -7.449 -6.383 -6.583 206 HB2 ASP 31 HB2 ASP 31 -7.171 -8.184 -8.420 207 HB3 ASP 31 HB3 ASP 31 -8.627 -8.924 -7.781 208 H LEU 32 H LEU 32 -9.984 -6.156 -6.590 209 HA LEU 32 HA LEU 32 -10.716 -6.328 -3.909 210 HB2 LEU 32 HB2 LEU 32 -12.528 -5.882 -6.286 211 HB3 LEU 32 HB3 LEU 32 -12.997 -5.622 -4.618 212 HG LEU 32 HG LEU 32 -10.833 -4.106 -6.081 213 HD11 LEU 32 HD11 LEU 32 -13.045 -3.569 -6.917 214 HD12 LEU 32 HD12 LEU 32 -12.389 -2.225 -5.982 215 HD13 LEU 32 HD13 LEU 32 -13.614 -3.279 -5.274 216 HD21 LEU 32 HD21 LEU 32 -10.873 -2.625 -4.116 217 HD22 LEU 32 HD22 LEU 32 -10.367 -4.259 -3.689 218 HD23 LEU 32 HD23 LEU 32 -12.006 -3.717 -3.324 219 HA PRO 33 HA PRO 33 -13.632 -10.111 -4.788 220 HB2 PRO 33 HB2 PRO 33 -12.948 -11.600 -7.010 221 HB3 PRO 33 HB3 PRO 33 -14.274 -10.435 -6.968 222 HG2 PRO 33 HG2 PRO 33 -11.484 -10.095 -7.991 223 HG3 PRO 33 HG3 PRO 33 -13.015 -9.538 -8.694 224 HD2 PRO 33 HD2 PRO 33 -11.423 -7.862 -7.374 225 HD3 PRO 33 HD3 PRO 33 -13.190 -7.759 -7.233 226 H ARG 34 H ARG 34 -10.279 -10.067 -5.784 227 HA ARG 34 HA ARG 34 -9.697 -12.749 -4.967 228 HB2 ARG 34 HB2 ARG 34 -8.089 -10.484 -5.955 229 HB3 ARG 34 HB3 ARG 34 -7.230 -11.714 -5.028 230 HG2 ARG 34 HG2 ARG 34 -7.147 -11.999 -7.500 231 HG3 ARG 34 HG3 ARG 34 -7.812 -13.386 -6.646 232 HD2 ARG 34 HD2 ARG 34 -10.045 -12.749 -7.253 233 HD3 ARG 34 HD3 ARG 34 -9.472 -11.227 -7.927 234 HE ARG 34 HE ARG 34 -8.541 -12.385 -9.726 235 HH11 ARG 34 HH11 ARG 34 -10.217 -14.716 -7.567 236 HH12 ARG 34 HH12 ARG 34 -10.597 -15.748 -8.848 237 HH21 ARG 34 HH21 ARG 34 -9.029 -13.863 -11.387 238 HH22 ARG 34 HH22 ARG 34 -9.901 -15.294 -11.047 239 H VAL 35 H VAL 35 -9.383 -9.612 -3.381 240 HA VAL 35 HA VAL 35 -8.027 -10.731 -1.153 241 HB VAL 35 HB VAL 35 -9.664 -8.159 -1.219 242 HG11 VAL 35 HG11 VAL 35 -9.348 -8.935 1.063 243 HG12 VAL 35 HG12 VAL 35 -8.383 -7.489 0.769 244 HG13 VAL 35 HG13 VAL 35 -7.613 -9.078 0.792 245 HG21 VAL 35 HG21 VAL 35 -6.699 -8.577 -1.544 246 HG22 VAL 35 HG22 VAL 35 -7.508 -7.014 -1.437 247 HG23 VAL 35 HG23 VAL 35 -7.831 -8.079 -2.806 248 H ALA 36 H ALA 36 -11.341 -10.037 -1.888 249 HA ALA 36 HA ALA 36 -12.524 -10.868 0.503 250 HB1 ALA 36 HB1 ALA 36 -14.544 -11.129 -0.838 251 HB2 ALA 36 HB2 ALA 36 -13.587 -11.057 -2.320 252 HB3 ALA 36 HB3 ALA 36 -13.703 -9.641 -1.269 253 H GLU 37 H GLU 37 -11.559 -12.564 -2.373 254 HA GLU 37 HA GLU 37 -12.502 -15.149 -1.863 255 HB2 GLU 37 HB2 GLU 37 -11.581 -14.030 -3.990 256 HB3 GLU 37 HB3 GLU 37 -10.034 -14.331 -3.308 257 HG2 GLU 37 HG2 GLU 37 -10.189 -16.655 -3.433 258 HG3 GLU 37 HG3 GLU 37 -11.918 -16.599 -3.773 259 H LEU 38 H LEU 38 -9.397 -13.585 -1.264 260 HA LEU 38 HA LEU 38 -7.986 -15.802 -0.274 261 HB2 LEU 38 HB2 LEU 38 -6.905 -13.792 -1.130 262 HB3 LEU 38 HB3 LEU 38 -7.566 -12.857 0.192 263 HG LEU 38 HG LEU 38 -6.241 -14.341 1.746 264 HD11 LEU 38 HD11 LEU 38 -5.807 -16.189 0.243 265 HD12 LEU 38 HD12 LEU 38 -4.298 -15.483 0.822 266 HD13 LEU 38 HD13 LEU 38 -4.863 -15.131 -0.809 267 HD21 LEU 38 HD21 LEU 38 -4.746 -12.612 -0.213 268 HD22 LEU 38 HD22 LEU 38 -4.162 -13.096 1.376 269 HD23 LEU 38 HD23 LEU 38 -5.581 -12.060 1.234 270 H LEU 39 H LEU 39 -9.593 -13.122 1.408 271 HA LEU 39 HA LEU 39 -8.916 -14.285 3.967 272 HB2 LEU 39 HB2 LEU 39 -10.473 -11.809 3.295 273 HB3 LEU 39 HB3 LEU 39 -10.019 -12.291 4.918 274 HG LEU 39 HG LEU 39 -8.135 -11.502 2.687 275 HD11 LEU 39 HD11 LEU 39 -8.879 -10.103 5.244 276 HD12 LEU 39 HD12 LEU 39 -9.349 -9.623 3.612 277 HD13 LEU 39 HD13 LEU 39 -7.654 -9.574 4.092 278 HD21 LEU 39 HD21 LEU 39 -7.101 -13.197 4.101 279 HD22 LEU 39 HD22 LEU 39 -7.549 -12.284 5.545 280 HD23 LEU 39 HD23 LEU 39 -6.379 -11.620 4.407 281 H GLY 40 H GLY 40 -11.405 -14.714 1.813 282 HA2 GLY 40 HA2 GLY 40 -13.333 -15.944 1.952 283 HA3 GLY 40 HA3 GLY 40 -12.866 -16.377 3.594 284 H VAL 41 H VAL 41 -13.203 -13.127 2.516 285 HA VAL 41 HA VAL 41 -15.627 -12.819 4.164 286 HB VAL 41 HB VAL 41 -14.860 -10.628 4.923 287 HG11 VAL 41 HG11 VAL 41 -12.969 -11.214 6.330 288 HG12 VAL 41 HG12 VAL 41 -12.687 -12.651 5.346 289 HG13 VAL 41 HG13 VAL 41 -14.175 -12.503 6.277 290 HG21 VAL 41 HG21 VAL 41 -12.381 -11.101 3.259 291 HG22 VAL 41 HG22 VAL 41 -12.595 -9.772 4.408 292 HG23 VAL 41 HG23 VAL 41 -13.627 -9.881 2.985 293 HA PRO 42 HA PRO 42 -17.195 -10.784 0.531 294 HB2 PRO 42 HB2 PRO 42 -18.874 -8.919 1.546 295 HB3 PRO 42 HB3 PRO 42 -19.262 -10.643 1.583 296 HG2 PRO 42 HG2 PRO 42 -18.180 -8.896 3.750 297 HG3 PRO 42 HG3 PRO 42 -19.414 -10.165 3.848 298 HD2 PRO 42 HD2 PRO 42 -16.831 -10.539 4.602 299 HD3 PRO 42 HD3 PRO 42 -17.848 -11.847 3.969 300 H VAL 43 H VAL 43 -17.130 -8.807 -0.652 301 HA VAL 43 HA VAL 43 -14.829 -7.257 -0.335 302 HB VAL 43 HB VAL 43 -17.312 -6.529 -1.929 303 HG11 VAL 43 HG11 VAL 43 -15.812 -4.621 -1.650 304 HG12 VAL 43 HG12 VAL 43 -15.798 -5.181 -3.324 305 HG13 VAL 43 HG13 VAL 43 -14.460 -5.583 -2.247 306 HG21 VAL 43 HG21 VAL 43 -14.858 -8.083 -2.759 307 HG22 VAL 43 HG22 VAL 43 -16.137 -7.547 -3.849 308 HG23 VAL 43 HG23 VAL 43 -16.496 -8.715 -2.580 309 H SER 44 H SER 44 -18.095 -6.736 0.771 310 HA SER 44 HA SER 44 -17.944 -4.075 1.575 311 HB2 SER 44 HB2 SER 44 -20.041 -5.411 1.578 312 HB3 SER 44 HB3 SER 44 -19.441 -6.334 2.954 313 HG SER 44 HG SER 44 -19.453 -4.398 4.163 314 H LYS 45 H LYS 45 -16.891 -7.022 3.339 315 HA LYS 45 HA LYS 45 -16.075 -5.540 5.621 316 HB2 LYS 45 HB2 LYS 45 -16.658 -7.977 5.761 317 HB3 LYS 45 HB3 LYS 45 -15.215 -8.315 4.819 318 HG2 LYS 45 HG2 LYS 45 -13.774 -7.693 6.529 319 HG3 LYS 45 HG3 LYS 45 -15.037 -6.832 7.403 320 HD2 LYS 45 HD2 LYS 45 -15.174 -9.803 6.973 321 HD3 LYS 45 HD3 LYS 45 -14.240 -9.119 8.297 322 HE2 LYS 45 HE2 LYS 45 -16.428 -9.743 9.122 323 HE3 LYS 45 HE3 LYS 45 -16.297 -7.992 9.126 324 HZ1 LYS 45 HZ1 LYS 45 -18.455 -8.794 8.349 325 HZ2 LYS 45 HZ2 LYS 45 -17.752 -9.619 7.085 326 HZ3 LYS 45 HZ3 LYS 45 -17.722 -7.926 7.144 327 H VAL 46 H VAL 46 -14.536 -6.524 2.672 328 HA VAL 46 HA VAL 46 -11.874 -5.814 3.336 329 HB VAL 46 HB VAL 46 -13.233 -5.660 0.614 330 HG11 VAL 46 HG11 VAL 46 -11.162 -4.381 0.667 331 HG12 VAL 46 HG12 VAL 46 -10.972 -5.829 -0.323 332 HG13 VAL 46 HG13 VAL 46 -10.292 -5.777 1.304 333 HG21 VAL 46 HG21 VAL 46 -12.241 -7.871 0.196 334 HG22 VAL 46 HG22 VAL 46 -13.371 -7.903 1.550 335 HG23 VAL 46 HG23 VAL 46 -11.632 -7.903 1.852 336 H ALA 47 H ALA 47 -14.536 -3.958 1.976 337 HA ALA 47 HA ALA 47 -13.214 -1.506 1.731 338 HB1 ALA 47 HB1 ALA 47 -15.443 -1.927 0.780 339 HB2 ALA 47 HB2 ALA 47 -15.433 -0.478 1.786 340 HB3 ALA 47 HB3 ALA 47 -16.121 -1.976 2.407 341 H GLN 48 H GLN 48 -14.743 -3.025 4.480 342 HA GLN 48 HA GLN 48 -14.493 -0.773 6.169 343 HB2 GLN 48 HB2 GLN 48 -14.957 -3.661 6.860 344 HB3 GLN 48 HB3 GLN 48 -14.949 -2.360 8.049 345 HG2 GLN 48 HG2 GLN 48 -16.807 -2.631 5.702 346 HG3 GLN 48 HG3 GLN 48 -17.204 -2.869 7.406 347 HE21 GLN 48 HE21 GLN 48 -18.220 -1.004 5.409 348 HE22 GLN 48 HE22 GLN 48 -18.071 0.572 6.079 349 H GLN 49 H GLN 49 -12.404 -3.569 5.661 350 HA GLN 49 HA GLN 49 -10.632 -2.743 7.736 351 HB2 GLN 49 HB2 GLN 49 -9.006 -4.376 6.884 352 HB3 GLN 49 HB3 GLN 49 -10.604 -5.081 6.996 353 HG2 GLN 49 HG2 GLN 49 -10.847 -4.645 4.543 354 HG3 GLN 49 HG3 GLN 49 -9.146 -4.208 4.532 355 HE21 GLN 49 HE21 GLN 49 -10.484 -6.762 6.541 356 HE22 GLN 49 HE22 GLN 49 -9.675 -8.040 5.699 357 H LEU 50 H LEU 50 -10.870 -2.042 4.341 358 HA LEU 50 HA LEU 50 -8.508 -0.556 4.064 359 HB2 LEU 50 HB2 LEU 50 -11.205 -0.237 2.752 360 HB3 LEU 50 HB3 LEU 50 -9.770 0.629 2.217 361 HG LEU 50 HG LEU 50 -10.271 -2.351 2.097 362 HD11 LEU 50 HD11 LEU 50 -10.116 -0.275 -0.078 363 HD12 LEU 50 HD12 LEU 50 -11.575 -1.089 0.476 364 HD13 LEU 50 HD13 LEU 50 -10.299 -2.011 -0.322 365 HD21 LEU 50 HD21 LEU 50 -8.195 -2.472 0.808 366 HD22 LEU 50 HD22 LEU 50 -7.900 -1.897 2.448 367 HD23 LEU 50 HD23 LEU 50 -7.913 -0.757 1.102 368 H ARG 51 H ARG 51 -11.713 0.269 5.240 369 HA ARG 51 HA ARG 51 -11.220 3.038 5.652 370 HB2 ARG 51 HB2 ARG 51 -13.355 1.251 6.793 371 HB3 ARG 51 HB3 ARG 51 -13.295 2.985 7.058 372 HG2 ARG 51 HG2 ARG 51 -13.510 3.328 4.632 373 HG3 ARG 51 HG3 ARG 51 -13.630 1.578 4.420 374 HD2 ARG 51 HD2 ARG 51 -15.600 1.563 5.892 375 HD3 ARG 51 HD3 ARG 51 -15.494 3.315 6.029 376 HE ARG 51 HE ARG 51 -16.156 1.803 3.604 377 HH11 ARG 51 HH11 ARG 51 -16.170 4.897 5.382 378 HH12 ARG 51 HH12 ARG 51 -17.283 5.631 4.342 379 HH21 ARG 51 HH21 ARG 51 -17.682 2.849 2.192 380 HH22 ARG 51 HH22 ARG 51 -18.192 4.456 2.538 381 H GLU 52 H GLU 52 -10.402 0.268 7.539 382 HA GLU 52 HA GLU 52 -10.311 1.599 10.100 383 HB2 GLU 52 HB2 GLU 52 -8.944 -0.902 9.134 384 HB3 GLU 52 HB3 GLU 52 -8.934 -0.352 10.796 385 HG2 GLU 52 HG2 GLU 52 -11.360 -0.730 10.885 386 HG3 GLU 52 HG3 GLU 52 -11.318 -1.297 9.213 387 H GLY 53 H GLY 53 -8.401 1.819 7.321 388 HA2 GLY 53 HA2 GLY 53 -6.246 2.555 6.921 389 HA3 GLY 53 HA3 GLY 53 -6.146 3.008 8.627 390 H HIS 54 H HIS 54 -7.077 -0.064 7.534 391 HA HIS 54 HA HIS 54 -4.924 -1.404 8.977 392 HB2 HIS 54 HB2 HIS 54 -7.220 -1.913 9.558 393 HB3 HIS 54 HB3 HIS 54 -7.630 -2.222 7.893 394 HD1 HIS 54 HD1 HIS 54 -8.629 -4.297 9.476 395 HD2 HIS 54 HD2 HIS 54 -4.582 -4.300 8.511 396 HE1 HIS 54 HE1 HIS 54 -7.846 -6.676 9.742 397 H LEU 55 H LEU 55 -6.341 -0.933 5.801 398 HA LEU 55 HA LEU 55 -4.040 -2.090 4.520 399 HB2 LEU 55 HB2 LEU 55 -5.664 -3.962 4.913 400 HB3 LEU 55 HB3 LEU 55 -6.866 -3.065 4.018 401 HG LEU 55 HG LEU 55 -5.428 -3.251 1.993 402 HD11 LEU 55 HD11 LEU 55 -3.269 -3.509 3.102 403 HD12 LEU 55 HD12 LEU 55 -3.580 -4.859 2.014 404 HD13 LEU 55 HD13 LEU 55 -3.777 -5.066 3.755 405 HD21 LEU 55 HD21 LEU 55 -5.906 -5.643 1.625 406 HD22 LEU 55 HD22 LEU 55 -7.255 -4.805 2.391 407 HD23 LEU 55 HD23 LEU 55 -6.193 -5.831 3.351 408 H VAL 56 H VAL 56 -3.963 -1.265 2.265 409 HA VAL 56 HA VAL 56 -6.046 0.676 1.637 410 HB VAL 56 HB VAL 56 -4.286 2.141 0.564 411 HG11 VAL 56 HG11 VAL 56 -5.295 2.766 2.685 412 HG12 VAL 56 HG12 VAL 56 -3.593 3.226 2.649 413 HG13 VAL 56 HG13 VAL 56 -4.103 1.796 3.548 414 HG21 VAL 56 HG21 VAL 56 -2.479 0.516 0.438 415 HG22 VAL 56 HG22 VAL 56 -2.404 0.449 2.202 416 HG23 VAL 56 HG23 VAL 56 -1.973 1.937 1.357 417 H ALA 57 H ALA 57 -6.060 1.268 -0.683 418 HA ALA 57 HA ALA 57 -5.173 -0.947 -2.365 419 HB1 ALA 57 HB1 ALA 57 -7.332 -0.858 -3.520 420 HB2 ALA 57 HB2 ALA 57 -7.895 0.365 -2.385 421 HB3 ALA 57 HB3 ALA 57 -7.544 -1.269 -1.819 422 H VAL 58 H VAL 58 -4.919 -0.333 -4.557 423 HA VAL 58 HA VAL 58 -4.812 2.541 -5.079 424 HB VAL 58 HB VAL 58 -2.720 2.075 -6.484 425 HG11 VAL 58 HG11 VAL 58 -1.220 2.282 -4.552 426 HG12 VAL 58 HG12 VAL 58 -2.544 1.810 -3.487 427 HG13 VAL 58 HG13 VAL 58 -2.637 3.324 -4.390 428 HG21 VAL 58 HG21 VAL 58 -2.671 -0.401 -4.750 429 HG22 VAL 58 HG22 VAL 58 -1.341 0.163 -5.762 430 HG23 VAL 58 HG23 VAL 58 -2.851 -0.361 -6.503 431 H ARG 59 H ARG 59 -4.528 2.957 -7.503 432 HA ARG 59 HA ARG 59 -6.301 1.076 -8.917 433 HB2 ARG 59 HB2 ARG 59 -6.042 4.053 -9.316 434 HB3 ARG 59 HB3 ARG 59 -7.111 2.975 -10.188 435 HG2 ARG 59 HG2 ARG 59 -8.411 2.604 -8.186 436 HG3 ARG 59 HG3 ARG 59 -7.294 3.609 -7.252 437 HD2 ARG 59 HD2 ARG 59 -7.799 5.515 -8.696 438 HD3 ARG 59 HD3 ARG 59 -8.917 4.521 -9.621 439 HE ARG 59 HE ARG 59 -9.678 4.472 -6.937 440 HH11 ARG 59 HH11 ARG 59 -9.537 6.754 -9.647 441 HH12 ARG 59 HH12 ARG 59 -10.846 7.696 -9.131 442 HH21 ARG 59 HH21 ARG 59 -11.464 5.787 -6.166 443 HH22 ARG 59 HH22 ARG 59 -11.971 7.135 -7.055 444 H ARG 60 H ARG 60 -5.528 0.296 -10.798 445 HA ARG 60 HA ARG 60 -3.742 1.963 -12.357 446 HB2 ARG 60 HB2 ARG 60 -2.043 0.362 -12.798 447 HB3 ARG 60 HB3 ARG 60 -2.361 0.149 -11.096 448 HG2 ARG 60 HG2 ARG 60 -3.490 -1.597 -13.253 449 HG3 ARG 60 HG3 ARG 60 -2.002 -1.961 -12.371 450 HD2 ARG 60 HD2 ARG 60 -3.353 -1.954 -10.302 451 HD3 ARG 60 HD3 ARG 60 -4.797 -1.715 -11.282 452 HE ARG 60 HE ARG 60 -3.062 -4.075 -11.291 453 HH11 ARG 60 HH11 ARG 60 -6.129 -2.597 -12.252 454 HH12 ARG 60 HH12 ARG 60 -6.956 -4.080 -12.443 455 HH21 ARG 60 HH21 ARG 60 -4.163 -6.084 -11.622 456 HH22 ARG 60 HH22 ARG 60 -5.814 -6.108 -12.088 457 H ALA 61 H ALA 61 -4.330 2.093 -14.374 458 HA ALA 61 HA ALA 61 -5.610 2.009 -16.200 459 HB1 ALA 61 HB1 ALA 61 -5.993 -0.172 -17.236 460 HB2 ALA 61 HB2 ALA 61 -5.591 -0.968 -15.715 461 HB3 ALA 61 HB3 ALA 61 -4.356 -0.067 -16.589 462 H GLY 62 H GLY 62 -6.920 2.136 -13.534 463 HA2 GLY 62 HA2 GLY 62 -9.181 2.680 -13.104 464 HA3 GLY 62 HA3 GLY 62 -9.646 1.714 -14.489 465 H GLY 63 H GLY 63 -7.515 -0.147 -12.881 466 HA2 GLY 63 HA2 GLY 63 -9.681 -1.578 -11.517 467 HA3 GLY 63 HA3 GLY 63 -8.114 -2.241 -11.973 468 H VAL 64 H VAL 64 -9.730 -1.874 -9.412 469 HA VAL 64 HA VAL 64 -7.774 -0.421 -7.788 470 HB VAL 64 HB VAL 64 -10.412 -1.652 -6.945 471 HG11 VAL 64 HG11 VAL 64 -8.646 0.364 -5.564 472 HG12 VAL 64 HG12 VAL 64 -8.875 -1.320 -5.097 473 HG13 VAL 64 HG13 VAL 64 -10.219 -0.186 -4.987 474 HG21 VAL 64 HG21 VAL 64 -9.829 1.212 -7.660 475 HG22 VAL 64 HG22 VAL 64 -11.352 0.592 -7.025 476 HG23 VAL 64 HG23 VAL 64 -10.778 0.078 -8.617 477 H VAL 65 H VAL 65 -6.273 -1.547 -6.809 478 HA VAL 65 HA VAL 65 -6.686 -4.387 -6.197 479 HB VAL 65 HB VAL 65 -4.359 -4.821 -6.961 480 HG11 VAL 65 HG11 VAL 65 -6.255 -5.537 -8.289 481 HG12 VAL 65 HG12 VAL 65 -4.945 -4.993 -9.342 482 HG13 VAL 65 HG13 VAL 65 -6.336 -3.952 -9.056 483 HG21 VAL 65 HG21 VAL 65 -3.553 -2.512 -7.021 484 HG22 VAL 65 HG22 VAL 65 -4.680 -2.159 -8.337 485 HG23 VAL 65 HG23 VAL 65 -3.356 -3.295 -8.594 486 H ILE 66 H ILE 66 -5.144 -5.239 -4.834 487 HA ILE 66 HA ILE 66 -3.922 -3.315 -2.993 488 HB ILE 66 HB ILE 66 -5.292 -5.942 -2.262 489 HG12 ILE 66 HG12 ILE 66 -6.676 -4.441 -0.689 490 HG13 ILE 66 HG13 ILE 66 -6.068 -3.081 -1.612 491 HG21 ILE 66 HG21 ILE 66 -3.273 -5.629 -0.970 492 HG22 ILE 66 HG22 ILE 66 -4.701 -5.481 0.046 493 HG23 ILE 66 HG23 ILE 66 -3.826 -4.032 -0.458 494 HD11 ILE 66 HD11 ILE 66 -7.156 -3.974 -3.616 495 HD12 ILE 66 HD12 ILE 66 -8.304 -3.698 -2.311 496 HD13 ILE 66 HD13 ILE 66 -7.764 -5.337 -2.684 497 HA PRO 67 HA PRO 67 -0.352 -5.688 -4.436 498 HB2 PRO 67 HB2 PRO 67 0.736 -4.530 -1.913 499 HB3 PRO 67 HB3 PRO 67 1.448 -4.568 -3.533 500 HG2 PRO 67 HG2 PRO 67 0.392 -2.317 -2.635 501 HG3 PRO 67 HG3 PRO 67 0.100 -2.832 -4.308 502 HD2 PRO 67 HD2 PRO 67 -1.711 -2.991 -1.934 503 HD3 PRO 67 HD3 PRO 67 -2.088 -2.579 -3.625 504 H GLN 68 H GLN 68 -0.110 -7.841 -4.103 505 HA GLN 68 HA GLN 68 -1.127 -9.223 -1.877 506 HB2 GLN 68 HB2 GLN 68 -1.062 -10.207 -4.025 507 HB3 GLN 68 HB3 GLN 68 0.663 -9.967 -4.162 508 HG2 GLN 68 HG2 GLN 68 1.082 -11.672 -2.534 509 HG3 GLN 68 HG3 GLN 68 -0.644 -11.829 -2.198 510 HE21 GLN 68 HE21 GLN 68 -1.420 -11.556 -5.038 511 HE22 GLN 68 HE22 GLN 68 -0.982 -13.049 -5.736 512 H VAL 69 H VAL 69 1.881 -7.867 -2.604 513 HA VAL 69 HA VAL 69 3.508 -9.233 -0.771 514 HB VAL 69 HB VAL 69 5.050 -7.237 -1.058 515 HG11 VAL 69 HG11 VAL 69 5.509 -7.728 -3.421 516 HG12 VAL 69 HG12 VAL 69 3.924 -8.483 -3.571 517 HG13 VAL 69 HG13 VAL 69 5.150 -9.212 -2.533 518 HG21 VAL 69 HG21 VAL 69 3.313 -5.541 -1.421 519 HG22 VAL 69 HG22 VAL 69 2.852 -6.334 -2.926 520 HG23 VAL 69 HG23 VAL 69 4.443 -5.593 -2.778 521 H PHE 70 H PHE 70 0.999 -6.979 -0.197 522 HA PHE 70 HA PHE 70 1.968 -5.899 2.293 523 HB2 PHE 70 HB2 PHE 70 -0.600 -5.815 0.761 524 HB3 PHE 70 HB3 PHE 70 -0.647 -5.447 2.474 525 HD1 PHE 70 HD1 PHE 70 2.036 -4.520 0.039 526 HD2 PHE 70 HD2 PHE 70 -1.203 -3.235 2.464 527 HE1 PHE 70 HE1 PHE 70 2.621 -2.162 -0.416 528 HE2 PHE 70 HE2 PHE 70 -0.622 -0.890 2.032 529 HZ PHE 70 HZ PHE 70 1.256 -0.344 0.603 530 H PHE 71 H PHE 71 0.790 -8.822 1.284 531 HA PHE 71 HA PHE 71 -0.193 -9.571 3.932 532 HB2 PHE 71 HB2 PHE 71 -0.524 -10.912 1.233 533 HB3 PHE 71 HB3 PHE 71 -1.074 -11.594 2.756 534 HD1 PHE 71 HD1 PHE 71 -1.589 -8.860 0.331 535 HD2 PHE 71 HD2 PHE 71 -3.113 -10.898 3.740 536 HE1 PHE 71 HE1 PHE 71 -3.742 -7.704 0.055 537 HE2 PHE 71 HE2 PHE 71 -5.269 -9.751 3.465 538 HZ PHE 71 HZ PHE 71 -5.588 -8.153 1.622 539 H THR 72 H THR 72 0.741 -11.398 4.864 540 HA THR 72 HA THR 72 3.493 -11.836 4.239 541 HB THR 72 HB THR 72 3.349 -13.508 6.098 542 HG1 THR 72 HG1 THR 72 1.260 -13.252 7.298 543 HG21 THR 72 HG21 THR 72 2.147 -10.799 6.719 544 HG22 THR 72 HG22 THR 72 3.871 -11.152 6.589 545 HG23 THR 72 HG23 THR 72 2.919 -11.871 7.886 546 H ASN 73 H ASN 73 4.222 -14.261 4.200 547 HA ASN 73 HA ASN 73 3.215 -15.523 1.903 548 HB2 ASN 73 HB2 ASN 73 5.523 -15.832 2.808 549 HB3 ASN 73 HB3 ASN 73 4.847 -16.723 4.162 550 HD21 ASN 73 HD21 ASN 73 6.077 -18.543 3.640 551 HD22 ASN 73 HD22 ASN 73 5.730 -19.537 2.280 552 H SER 74 H SER 74 2.199 -15.621 5.198 553 HA SER 74 HA SER 74 0.691 -18.064 5.021 554 HB2 SER 74 HB2 SER 74 0.704 -15.920 7.151 555 HB3 SER 74 HB3 SER 74 0.067 -17.560 7.310 556 HG SER 74 HG SER 74 2.205 -18.286 6.815 557 H GLY 75 H GLY 75 0.121 -15.090 3.688 558 HA2 GLY 75 HA2 GLY 75 -1.757 -14.208 2.716 559 HA3 GLY 75 HA3 GLY 75 -2.660 -15.608 3.274 560 H GLN 76 H GLN 76 -0.877 -13.608 5.466 561 HA GLN 76 HA GLN 76 -3.421 -12.540 6.515 562 HB2 GLN 76 HB2 GLN 76 -0.813 -13.062 7.937 563 HB3 GLN 76 HB3 GLN 76 -2.219 -12.308 8.665 564 HG2 GLN 76 HG2 GLN 76 -3.482 -14.361 8.400 565 HG3 GLN 76 HG3 GLN 76 -2.109 -15.111 7.589 566 HE21 GLN 76 HE21 GLN 76 -3.337 -13.939 10.649 567 HE22 GLN 76 HE22 GLN 76 -2.161 -14.745 11.609 568 H VAL 77 H VAL 77 -3.384 -10.339 7.175 569 HA VAL 77 HA VAL 77 -1.653 -8.657 5.666 570 HB VAL 77 HB VAL 77 -3.547 -7.977 7.965 571 HG11 VAL 77 HG11 VAL 77 -1.854 -6.237 7.673 572 HG12 VAL 77 HG12 VAL 77 -3.439 -5.667 7.147 573 HG13 VAL 77 HG13 VAL 77 -2.233 -6.150 5.954 574 HG21 VAL 77 HG21 VAL 77 -5.066 -7.209 6.212 575 HG22 VAL 77 HG22 VAL 77 -4.691 -8.928 6.031 576 HG23 VAL 77 HG23 VAL 77 -3.905 -7.731 4.994 577 H VAL 78 H VAL 78 0.209 -7.700 6.302 578 HA VAL 78 HA VAL 78 1.696 -8.741 8.429 579 HB VAL 78 HB VAL 78 2.104 -6.092 6.983 580 HG11 VAL 78 HG11 VAL 78 3.414 -6.188 9.039 581 HG12 VAL 78 HG12 VAL 78 4.459 -6.292 7.622 582 HG13 VAL 78 HG13 VAL 78 4.087 -7.744 8.550 583 HG21 VAL 78 HG21 VAL 78 3.659 -7.327 5.558 584 HG22 VAL 78 HG22 VAL 78 2.021 -7.970 5.438 585 HG23 VAL 78 HG23 VAL 78 3.237 -8.822 6.391 586 H LYS 79 H LYS 79 1.947 -8.098 10.528 587 HA LYS 79 HA LYS 79 -0.137 -6.720 11.766 588 HB2 LYS 79 HB2 LYS 79 1.232 -6.813 13.833 589 HB3 LYS 79 HB3 LYS 79 1.056 -8.348 12.986 590 HG2 LYS 79 HG2 LYS 79 3.227 -8.014 11.983 591 HG3 LYS 79 HG3 LYS 79 3.407 -6.519 12.897 592 HD2 LYS 79 HD2 LYS 79 4.599 -8.405 14.003 593 HD3 LYS 79 HD3 LYS 79 3.304 -7.762 15.011 594 HE2 LYS 79 HE2 LYS 79 1.851 -9.583 14.375 595 HE3 LYS 79 HE3 LYS 79 3.048 -10.197 13.239 596 HZ1 LYS 79 HZ1 LYS 79 4.484 -10.707 15.067 597 HZ2 LYS 79 HZ2 LYS 79 2.986 -11.418 15.317 598 HZ3 LYS 79 HZ3 LYS 79 3.401 -10.036 16.191 599 H SER 80 H SER 80 2.916 -5.529 10.647 600 HA SER 80 HA SER 80 2.538 -2.965 11.905 601 HB2 SER 80 HB2 SER 80 4.685 -3.923 10.012 602 HB3 SER 80 HB3 SER 80 4.707 -2.418 10.933 603 HG SER 80 HG SER 80 5.066 -3.462 12.720 604 H LEU 81 H LEU 81 1.086 -4.319 9.287 605 HA LEU 81 HA LEU 81 1.471 -2.402 7.240 606 HB2 LEU 81 HB2 LEU 81 0.223 -4.781 7.331 607 HB3 LEU 81 HB3 LEU 81 -1.159 -3.716 7.460 608 HG LEU 81 HG LEU 81 -0.880 -4.319 5.241 609 HD11 LEU 81 HD11 LEU 81 -1.670 -2.088 5.526 610 HD12 LEU 81 HD12 LEU 81 -0.615 -2.136 4.110 611 HD13 LEU 81 HD13 LEU 81 -0.023 -1.476 5.630 612 HD21 LEU 81 HD21 LEU 81 1.960 -3.345 5.425 613 HD22 LEU 81 HD22 LEU 81 1.129 -3.780 3.922 614 HD23 LEU 81 HD23 LEU 81 1.374 -4.995 5.168 615 HA PRO 82 HA PRO 82 -2.487 -0.180 9.029 616 HB2 PRO 82 HB2 PRO 82 -2.449 -1.099 11.849 617 HB3 PRO 82 HB3 PRO 82 -3.834 -0.833 10.789 618 HG2 PRO 82 HG2 PRO 82 -3.082 -3.296 11.411 619 HG3 PRO 82 HG3 PRO 82 -3.608 -2.906 9.764 620 HD2 PRO 82 HD2 PRO 82 -0.846 -3.239 10.846 621 HD3 PRO 82 HD3 PRO 82 -1.534 -3.855 9.334 622 H GLY 83 H GLY 83 0.235 -1.034 11.016 623 HA2 GLY 83 HA2 GLY 83 0.440 1.350 12.526 624 HA3 GLY 83 HA3 GLY 83 1.744 0.202 12.254 625 H LEU 84 H LEU 84 2.025 0.334 9.500 626 HA LEU 84 HA LEU 84 3.527 2.713 9.256 627 HB2 LEU 84 HB2 LEU 84 4.186 1.960 7.074 628 HB3 LEU 84 HB3 LEU 84 4.133 0.567 8.126 629 HG LEU 84 HG LEU 84 1.704 0.345 7.018 630 HD11 LEU 84 HD11 LEU 84 1.785 0.884 4.635 631 HD12 LEU 84 HD12 LEU 84 3.323 1.700 4.867 632 HD13 LEU 84 HD13 LEU 84 1.873 2.329 5.634 633 HD21 LEU 84 HD21 LEU 84 2.699 -1.244 5.431 634 HD22 LEU 84 HD22 LEU 84 3.423 -1.386 7.034 635 HD23 LEU 84 HD23 LEU 84 4.290 -0.549 5.747 636 H LEU 85 H LEU 85 0.420 1.695 8.025 637 HA LEU 85 HA LEU 85 -0.067 3.912 6.390 638 HB2 LEU 85 HB2 LEU 85 -2.018 2.176 7.892 639 HB3 LEU 85 HB3 LEU 85 -2.463 3.330 6.652 640 HG LEU 85 HG LEU 85 -0.739 0.891 6.223 641 HD11 LEU 85 HD11 LEU 85 -2.682 0.069 4.955 642 HD12 LEU 85 HD12 LEU 85 -3.615 1.452 5.535 643 HD13 LEU 85 HD13 LEU 85 -3.004 0.258 6.674 644 HD21 LEU 85 HD21 LEU 85 -0.159 2.698 4.688 645 HD22 LEU 85 HD22 LEU 85 -1.862 2.893 4.261 646 HD23 LEU 85 HD23 LEU 85 -1.012 1.408 3.842 647 H THR 86 H THR 86 -0.803 3.280 9.735 648 HA THR 86 HA THR 86 -2.270 5.624 10.234 649 HB THR 86 HB THR 86 -0.693 3.958 12.218 650 HG1 THR 86 HG1 THR 86 -2.173 2.648 11.406 651 HG21 THR 86 HG21 THR 86 -2.233 4.871 13.909 652 HG22 THR 86 HG22 THR 86 -2.986 5.891 12.684 653 HG23 THR 86 HG23 THR 86 -1.308 6.165 13.152 654 H ILE 87 H ILE 87 1.234 5.049 10.553 655 HA ILE 87 HA ILE 87 1.676 7.545 11.730 656 HB ILE 87 HB ILE 87 3.289 5.796 12.166 657 HG12 ILE 87 HG12 ILE 87 4.214 8.183 12.009 658 HG13 ILE 87 HG13 ILE 87 5.363 6.856 12.043 659 HG21 ILE 87 HG21 ILE 87 3.178 4.429 10.300 660 HG22 ILE 87 HG22 ILE 87 4.872 4.907 10.521 661 HG23 ILE 87 HG23 ILE 87 3.900 5.659 9.265 662 HD11 ILE 87 HD11 ILE 87 5.659 7.062 9.635 663 HD12 ILE 87 HD12 ILE 87 6.020 8.570 10.474 664 HD13 ILE 87 HD13 ILE 87 4.490 8.386 9.612 665 H LEU 88 H LEU 88 1.995 6.506 8.369 666 HA LEU 88 HA LEU 88 2.695 9.086 7.402 667 HB2 LEU 88 HB2 LEU 88 1.646 6.646 6.055 668 HB3 LEU 88 HB3 LEU 88 1.772 8.148 5.178 669 HG LEU 88 HG LEU 88 3.642 6.766 4.659 670 HD11 LEU 88 HD11 LEU 88 4.519 9.010 6.450 671 HD12 LEU 88 HD12 LEU 88 4.100 9.125 4.742 672 HD13 LEU 88 HD13 LEU 88 5.512 8.200 5.241 673 HD21 LEU 88 HD21 LEU 88 3.653 5.374 6.656 674 HD22 LEU 88 HD22 LEU 88 4.278 6.738 7.587 675 HD23 LEU 88 HD23 LEU 88 5.251 6.028 6.290 676 H HIS 89 H HIS 89 -0.374 7.531 7.913 677 HA HIS 89 HA HIS 89 -2.048 9.212 6.443 678 HB2 HIS 89 HB2 HIS 89 -2.763 7.059 7.410 679 HB3 HIS 89 HB3 HIS 89 -2.624 7.729 9.022 680 HD1 HIS 89 HD1 HIS 89 -4.783 8.550 9.977 681 HD2 HIS 89 HD2 HIS 89 -4.853 8.436 5.829 682 HE1 HIS 89 HE1 HIS 89 -7.145 9.081 9.308 683 H ASP 90 H ASP 90 -0.908 9.467 9.773 684 HA ASP 90 HA ASP 90 -2.342 11.830 10.412 685 HB2 ASP 90 HB2 ASP 90 -1.404 10.442 12.182 686 HB3 ASP 90 HB3 ASP 90 0.222 10.739 11.578 687 H GLY 91 H GLY 91 0.656 11.229 8.800 688 HA2 GLY 91 HA2 GLY 91 1.556 13.965 8.879 689 HA3 GLY 91 HA3 GLY 91 2.281 12.655 7.963 690 H GLY 92 H GLY 92 -0.740 12.324 7.049 691 HA2 GLY 92 HA2 GLY 92 -2.152 13.224 5.437 692 HA3 GLY 92 HA3 GLY 92 -1.093 14.620 5.333 693 H TYR 93 H TYR 93 0.218 11.425 4.994 694 HA TYR 93 HA TYR 93 0.926 12.137 2.283 695 HB2 TYR 93 HB2 TYR 93 1.933 9.972 4.113 696 HB3 TYR 93 HB3 TYR 93 2.430 10.107 2.423 697 HD1 TYR 93 HD1 TYR 93 3.757 11.977 1.676 698 HD2 TYR 93 HD2 TYR 93 2.697 11.574 5.767 699 HE1 TYR 93 HE1 TYR 93 5.428 13.661 2.263 700 HE2 TYR 93 HE2 TYR 93 4.370 13.274 6.371 701 HH TYR 93 HH TYR 93 6.561 14.129 5.324 702 H ARG 94 H ARG 94 0.269 11.167 0.520 703 HA ARG 94 HA ARG 94 -2.155 9.664 0.800 704 HB2 ARG 94 HB2 ARG 94 -2.454 9.891 -1.576 705 HB3 ARG 94 HB3 ARG 94 -1.956 11.434 -0.907 706 HG2 ARG 94 HG2 ARG 94 0.272 11.119 -1.770 707 HG3 ARG 94 HG3 ARG 94 -0.150 9.501 -2.340 708 HD2 ARG 94 HD2 ARG 94 -0.259 11.043 -4.196 709 HD3 ARG 94 HD3 ARG 94 -1.878 10.499 -3.785 710 HE ARG 94 HE ARG 94 -0.914 13.022 -2.682 711 HH11 ARG 94 HH11 ARG 94 -3.189 11.329 -4.840 712 HH12 ARG 94 HH12 ARG 94 -4.086 12.733 -5.168 713 HH21 ARG 94 HH21 ARG 94 -2.190 14.898 -3.143 714 HH22 ARG 94 HH22 ARG 94 -3.527 14.789 -4.189 715 H ASP 95 H ASP 95 -2.585 7.927 -0.765 716 HA ASP 95 HA ASP 95 -1.449 5.542 0.018 717 HB2 ASP 95 HB2 ASP 95 -2.768 4.576 -1.840 718 HB3 ASP 95 HB3 ASP 95 -3.695 5.772 -0.934 719 H THR 96 H THR 96 -0.946 7.340 -2.948 720 HA THR 96 HA THR 96 0.749 5.518 -4.167 721 HB THR 96 HB THR 96 0.631 8.509 -4.661 722 HG1 THR 96 HG1 THR 96 -1.289 6.564 -4.894 723 HG21 THR 96 HG21 THR 96 1.182 6.154 -6.483 724 HG22 THR 96 HG22 THR 96 2.421 7.227 -5.831 725 HG23 THR 96 HG23 THR 96 1.202 7.857 -6.939 726 H GLU 97 H GLU 97 1.377 8.247 -2.000 727 HA GLU 97 HA GLU 97 4.200 8.212 -2.321 728 HB2 GLU 97 HB2 GLU 97 2.486 9.353 -0.115 729 HB3 GLU 97 HB3 GLU 97 4.235 9.487 -0.135 730 HG2 GLU 97 HG2 GLU 97 2.338 10.581 -2.178 731 HG3 GLU 97 HG3 GLU 97 3.218 11.500 -0.957 732 H ILE 98 H ILE 98 1.975 6.550 -0.157 733 HA ILE 98 HA ILE 98 3.870 5.585 1.707 734 HB ILE 98 HB ILE 98 1.558 3.888 0.764 735 HG12 ILE 98 HG12 ILE 98 0.477 6.009 1.135 736 HG13 ILE 98 HG13 ILE 98 0.158 4.951 2.508 737 HG21 ILE 98 HG21 ILE 98 1.498 3.150 3.088 738 HG22 ILE 98 HG22 ILE 98 2.839 4.234 3.452 739 HG23 ILE 98 HG23 ILE 98 3.078 2.887 2.342 740 HD11 ILE 98 HD11 ILE 98 0.584 7.237 3.198 741 HD12 ILE 98 HD12 ILE 98 2.183 7.158 2.455 742 HD13 ILE 98 HD13 ILE 98 1.788 6.110 3.823 743 H MET 99 H MET 99 2.539 4.202 -1.240 744 HA MET 99 HA MET 99 4.230 1.933 -1.147 745 HB2 MET 99 HB2 MET 99 2.485 2.926 -3.382 746 HB3 MET 99 HB3 MET 99 3.274 1.356 -3.333 747 HG2 MET 99 HG2 MET 99 2.051 0.880 -1.235 748 HG3 MET 99 HG3 MET 99 1.171 2.388 -1.470 749 HE1 MET 99 HE1 MET 99 -1.599 -0.133 -2.290 750 HE2 MET 99 HE2 MET 99 -1.122 1.319 -1.405 751 HE3 MET 99 HE3 MET 99 -0.371 -0.229 -1.021 752 H ARG 100 H ARG 100 4.666 5.087 -2.258 753 HA ARG 100 HA ARG 100 6.325 4.731 -4.481 754 HB2 ARG 100 HB2 ARG 100 5.305 6.879 -3.780 755 HB3 ARG 100 HB3 ARG 100 6.388 6.929 -2.407 756 HG2 ARG 100 HG2 ARG 100 8.295 7.135 -3.914 757 HG3 ARG 100 HG3 ARG 100 7.202 7.069 -5.304 758 HD2 ARG 100 HD2 ARG 100 6.040 9.061 -4.473 759 HD3 ARG 100 HD3 ARG 100 7.149 9.136 -3.108 760 HE ARG 100 HE ARG 100 8.383 9.182 -5.701 761 HH11 ARG 100 HH11 ARG 100 6.922 11.195 -3.131 762 HH12 ARG 100 HH12 ARG 100 7.831 12.572 -3.539 763 HH21 ARG 100 HH21 ARG 100 9.576 11.153 -6.256 764 HH22 ARG 100 HH22 ARG 100 9.328 12.555 -5.328 765 H TRP 101 H TRP 101 7.387 5.567 -1.165 766 HA TRP 101 HA TRP 101 9.999 4.664 -1.755 767 HB2 TRP 101 HB2 TRP 101 10.371 4.861 0.782 768 HB3 TRP 101 HB3 TRP 101 10.052 6.317 -0.138 769 HD1 TRP 101 HD1 TRP 101 7.971 7.674 0.444 770 HE1 TRP 101 HE1 TRP 101 6.254 7.594 2.305 771 HE3 TRP 101 HE3 TRP 101 9.015 3.037 2.296 772 HZ2 TRP 101 HZ2 TRP 101 5.424 5.850 4.275 773 HZ3 TRP 101 HZ3 TRP 101 7.691 2.219 4.171 774 HH2 TRP 101 HH2 TRP 101 5.920 3.587 5.172 775 H LEU 102 H LEU 102 7.261 3.113 -0.353 776 HA LEU 102 HA LEU 102 8.492 0.901 0.802 777 HB2 LEU 102 HB2 LEU 102 5.876 1.545 -0.258 778 HB3 LEU 102 HB3 LEU 102 6.158 -0.183 -0.102 779 HG LEU 102 HG LEU 102 6.151 1.939 2.062 780 HD11 LEU 102 HD11 LEU 102 4.311 -0.383 1.514 781 HD12 LEU 102 HD12 LEU 102 3.956 1.314 1.191 782 HD13 LEU 102 HD13 LEU 102 4.189 0.760 2.853 783 HD21 LEU 102 HD21 LEU 102 7.778 0.302 2.665 784 HD22 LEU 102 HD22 LEU 102 6.693 -1.012 2.192 785 HD23 LEU 102 HD23 LEU 102 6.311 -0.007 3.587 786 H PHE 103 H PHE 103 7.537 1.407 -2.567 787 HA PHE 103 HA PHE 103 8.561 -1.224 -3.220 788 HB2 PHE 103 HB2 PHE 103 6.992 0.779 -4.812 789 HB3 PHE 103 HB3 PHE 103 7.753 -0.612 -5.574 790 HD1 PHE 103 HD1 PHE 103 5.291 0.358 -2.957 791 HD2 PHE 103 HD2 PHE 103 6.716 -2.704 -5.543 792 HE1 PHE 103 HE1 PHE 103 3.332 -1.021 -2.405 793 HE2 PHE 103 HE2 PHE 103 4.762 -4.083 -4.982 794 HZ PHE 103 HZ PHE 103 3.073 -3.245 -3.418 795 H THR 104 H THR 104 9.780 1.865 -3.052 796 HA THR 104 HA THR 104 11.668 1.487 -5.200 797 HB THR 104 HB THR 104 11.424 3.723 -3.155 798 HG1 THR 104 HG1 THR 104 9.744 3.798 -4.556 799 HG21 THR 104 HG21 THR 104 13.124 3.568 -5.655 800 HG22 THR 104 HG22 THR 104 13.738 3.504 -4.003 801 HG23 THR 104 HG23 THR 104 12.971 4.975 -4.604 802 HA PRO 105 HA PRO 105 14.553 -0.757 -2.571 803 HB2 PRO 105 HB2 PRO 105 16.385 0.350 -4.648 804 HB3 PRO 105 HB3 PRO 105 16.244 -1.308 -4.053 805 HG2 PRO 105 HG2 PRO 105 15.276 -0.680 -6.421 806 HG3 PRO 105 HG3 PRO 105 14.351 -1.739 -5.334 807 HD2 PRO 105 HD2 PRO 105 13.944 1.154 -5.954 808 HD3 PRO 105 HD3 PRO 105 12.751 -0.144 -5.715 809 H ASP 106 H ASP 106 15.538 0.071 -0.817 810 HA ASP 106 HA ASP 106 16.201 2.896 -0.823 811 HB2 ASP 106 HB2 ASP 106 14.922 1.888 1.103 812 HB3 ASP 106 HB3 ASP 106 16.361 0.952 1.483 813 HA PRO 107 HA PRO 107 20.387 1.906 -1.929 814 HB2 PRO 107 HB2 PRO 107 21.103 4.493 -0.767 815 HB3 PRO 107 HB3 PRO 107 21.258 3.933 -2.428 816 HG2 PRO 107 HG2 PRO 107 19.427 5.760 -1.598 817 HG3 PRO 107 HG3 PRO 107 19.203 4.716 -3.014 818 HD2 PRO 107 HD2 PRO 107 17.950 4.609 -0.341 819 HD3 PRO 107 HD3 PRO 107 17.358 4.029 -1.912 820 H SER 108 H SER 108 19.451 2.911 1.280 821 HA SER 108 HA SER 108 22.090 2.196 2.319 822 HB2 SER 108 HB2 SER 108 19.813 3.636 3.687 823 HB3 SER 108 HB3 SER 108 21.471 3.469 4.273 824 HG SER 108 HG SER 108 20.396 5.229 2.556 825 H LEU 109 H LEU 109 19.313 0.610 1.676 826 HA LEU 109 HA LEU 109 19.141 -0.692 4.285 827 HB2 LEU 109 HB2 LEU 109 17.080 0.173 3.275 828 HB3 LEU 109 HB3 LEU 109 17.313 -0.896 1.903 829 HG LEU 109 HG LEU 109 17.170 -2.816 3.534 830 HD11 LEU 109 HD11 LEU 109 16.163 -0.656 5.372 831 HD12 LEU 109 HD12 LEU 109 17.631 -1.611 5.581 832 HD13 LEU 109 HD13 LEU 109 16.052 -2.391 5.664 833 HD21 LEU 109 HD21 LEU 109 14.742 -2.752 3.639 834 HD22 LEU 109 HD22 LEU 109 15.350 -2.228 2.066 835 HD23 LEU 109 HD23 LEU 109 14.768 -1.029 3.231 836 H THR 110 H THR 110 20.012 -2.545 4.575 837 HA THR 110 HA THR 110 20.366 -4.405 2.348 838 HB THR 110 HB THR 110 22.385 -3.937 4.559 839 HG1 THR 110 HG1 THR 110 21.996 -2.497 2.386 840 HG21 THR 110 HG21 THR 110 22.370 -6.213 3.719 841 HG22 THR 110 HG22 THR 110 23.836 -5.395 3.187 842 HG23 THR 110 HG23 THR 110 22.497 -5.638 2.056 843 H ILE 111 H ILE 111 19.096 -6.064 2.852 844 HA ILE 111 HA ILE 111 18.882 -6.913 5.666 845 HB ILE 111 HB ILE 111 16.455 -7.358 5.259 846 HG12 ILE 111 HG12 ILE 111 16.816 -5.417 2.972 847 HG13 ILE 111 HG13 ILE 111 16.587 -7.146 2.783 848 HG21 ILE 111 HG21 ILE 111 17.129 -5.583 6.707 849 HG22 ILE 111 HG22 ILE 111 15.729 -5.073 5.762 850 HG23 ILE 111 HG23 ILE 111 17.343 -4.486 5.341 851 HD11 ILE 111 HD11 ILE 111 14.648 -5.231 4.020 852 HD12 ILE 111 HD12 ILE 111 14.389 -6.959 3.798 853 HD13 ILE 111 HD13 ILE 111 14.542 -5.902 2.390 854 H THR 112 H THR 112 18.222 -9.017 5.935 855 HA THR 112 HA THR 112 18.484 -10.760 3.652 856 HB THR 112 HB THR 112 19.576 -11.643 5.556 857 HG1 THR 112 HG1 THR 112 18.091 -13.152 4.516 858 HG21 THR 112 HG21 THR 112 17.119 -11.019 7.197 859 HG22 THR 112 HG22 THR 112 18.672 -10.194 7.289 860 HG23 THR 112 HG23 THR 112 18.535 -11.878 7.801 861 H ARG 113 H ARG 113 16.742 -11.822 2.817 862 HA ARG 113 HA ARG 113 14.203 -10.590 3.628 863 HB2 ARG 113 HB2 ARG 113 13.380 -10.700 1.439 864 HB3 ARG 113 HB3 ARG 113 15.066 -10.291 1.206 865 HG2 ARG 113 HG2 ARG 113 15.582 -12.519 0.530 866 HG3 ARG 113 HG3 ARG 113 13.975 -13.091 0.971 867 HD2 ARG 113 HD2 ARG 113 13.833 -12.844 -1.344 868 HD3 ARG 113 HD3 ARG 113 13.126 -11.353 -0.740 869 HE ARG 113 HE ARG 113 15.912 -11.534 -1.655 870 HH11 ARG 113 HH11 ARG 113 12.791 -9.741 -1.710 871 HH12 ARG 113 HH12 ARG 113 13.335 -8.697 -2.925 872 HH21 ARG 113 HH21 ARG 113 16.521 -10.057 -3.315 873 HH22 ARG 113 HH22 ARG 113 15.442 -8.830 -3.832 874 H ASP 114 H ASP 114 12.243 -11.981 3.207 875 HA ASP 114 HA ASP 114 12.630 -14.446 4.633 876 HB2 ASP 114 HB2 ASP 114 10.711 -13.020 5.131 877 HB3 ASP 114 HB3 ASP 114 10.131 -13.152 3.477 878 H GLY 115 H GLY 115 13.881 -15.622 3.230 879 HA2 GLY 115 HA2 GLY 115 13.151 -17.564 1.682 880 HA3 GLY 115 HA3 GLY 115 12.809 -16.241 0.570 881 H SER 116 H SER 116 15.353 -15.097 2.263 882 HA SER 116 HA SER 116 17.451 -16.610 0.989 883 HB2 SER 116 HB2 SER 116 17.185 -13.623 0.481 884 HB3 SER 116 HB3 SER 116 18.424 -14.699 -0.143 885 HG SER 116 HG SER 116 16.185 -15.793 -0.808 886 H ARG 117 H ARG 117 18.698 -16.985 2.703 887 HA ARG 117 HA ARG 117 18.698 -15.392 5.056 888 HB2 ARG 117 HB2 ARG 117 20.485 -16.830 5.864 889 HB3 ARG 117 HB3 ARG 117 19.216 -17.785 5.120 890 HG2 ARG 117 HG2 ARG 117 20.559 -18.131 3.146 891 HG3 ARG 117 HG3 ARG 117 21.793 -17.029 3.757 892 HD2 ARG 117 HD2 ARG 117 22.187 -18.485 5.633 893 HD3 ARG 117 HD3 ARG 117 20.934 -19.590 5.056 894 HE ARG 117 HE ARG 117 22.630 -19.409 2.970 895 HH11 ARG 117 HH11 ARG 117 23.146 -20.186 6.384 896 HH12 ARG 117 HH12 ARG 117 24.416 -21.280 6.105 897 HH21 ARG 117 HH21 ARG 117 24.410 -20.920 2.571 898 HH22 ARG 117 HH22 ARG 117 25.153 -21.712 3.872 899 H ASP 118 H ASP 118 20.495 -15.298 2.180 900 HA ASP 118 HA ASP 118 22.674 -13.723 3.093 901 HB2 ASP 118 HB2 ASP 118 23.064 -13.208 0.695 902 HB3 ASP 118 HB3 ASP 118 22.887 -14.932 0.992 903 H ALA 119 H ALA 119 23.055 -11.487 2.427 904 HA ALA 119 HA ALA 119 20.658 -9.976 3.061 905 HB1 ALA 119 HB1 ALA 119 22.140 -8.204 3.747 906 HB2 ALA 119 HB2 ALA 119 23.538 -9.095 3.153 907 HB3 ALA 119 HB3 ALA 119 22.622 -9.708 4.530 908 H VAL 120 H VAL 120 19.705 -8.813 1.616 909 HA VAL 120 HA VAL 120 20.939 -8.391 -0.986 910 HB VAL 120 HB VAL 120 18.071 -7.954 -0.085 911 HG11 VAL 120 HG11 VAL 120 17.541 -7.860 -2.483 912 HG12 VAL 120 HG12 VAL 120 19.260 -7.997 -2.859 913 HG13 VAL 120 HG13 VAL 120 18.656 -6.578 -2.007 914 HG21 VAL 120 HG21 VAL 120 19.254 -10.261 -1.632 915 HG22 VAL 120 HG22 VAL 120 17.538 -10.024 -1.306 916 HG23 VAL 120 HG23 VAL 120 18.659 -10.323 0.025 917 H SER 121 H SER 121 21.813 -6.498 -1.346 918 HA SER 121 HA SER 121 21.272 -4.245 0.403 919 HB2 SER 121 HB2 SER 121 23.617 -4.960 -0.264 920 HB3 SER 121 HB3 SER 121 23.214 -4.511 -1.915 921 HG SER 121 HG SER 121 24.193 -3.038 -0.054 922 H ASN 122 H ASN 122 20.431 -2.281 -0.419 923 HA ASN 122 HA ASN 122 19.157 -0.894 -1.698 924 HB2 ASN 122 HB2 ASN 122 20.990 -1.398 -3.470 925 HB3 ASN 122 HB3 ASN 122 19.887 -2.600 -4.123 926 HD21 ASN 122 HD21 ASN 122 19.512 -1.652 -6.078 927 HD22 ASN 122 HD22 ASN 122 18.721 -0.131 -6.280 928 H ALA 123 H ALA 123 17.981 -2.830 -0.309 929 HA ALA 123 HA ALA 123 16.126 -4.311 -1.989 930 HB1 ALA 123 HB1 ALA 123 17.148 -5.436 -0.067 931 HB2 ALA 123 HB2 ALA 123 15.390 -5.361 0.088 932 HB3 ALA 123 HB3 ALA 123 16.408 -4.256 1.014 933 H ARG 124 H ARG 124 13.789 -4.241 -1.447 934 HA ARG 124 HA ARG 124 13.036 -1.445 -1.132 935 HB2 ARG 124 HB2 ARG 124 11.051 -1.931 -2.386 936 HB3 ARG 124 HB3 ARG 124 12.379 -2.705 -3.227 937 HG2 ARG 124 HG2 ARG 124 11.619 -4.798 -1.850 938 HG3 ARG 124 HG3 ARG 124 10.100 -3.914 -1.732 939 HD2 ARG 124 HD2 ARG 124 11.512 -4.923 -4.172 940 HD3 ARG 124 HD3 ARG 124 9.873 -5.281 -3.637 941 HE ARG 124 HE ARG 124 10.423 -2.522 -4.365 942 HH11 ARG 124 HH11 ARG 124 8.903 -5.584 -5.335 943 HH12 ARG 124 HH12 ARG 124 8.314 -5.006 -6.810 944 HH21 ARG 124 HH21 ARG 124 9.601 -1.703 -6.355 945 HH22 ARG 124 HH22 ARG 124 8.700 -2.714 -7.398 946 HA PRO 125 HA PRO 125 11.650 -2.030 3.028 947 HB2 PRO 125 HB2 PRO 125 9.553 -0.127 2.124 948 HB3 PRO 125 HB3 PRO 125 10.529 -0.080 3.602 949 HG2 PRO 125 HG2 PRO 125 11.156 1.503 1.601 950 HG3 PRO 125 HG3 PRO 125 12.441 0.616 2.441 951 HD2 PRO 125 HD2 PRO 125 11.209 0.082 -0.230 952 HD3 PRO 125 HD3 PRO 125 12.896 -0.086 0.305 953 H VAL 126 H VAL 126 9.204 -2.335 0.441 954 HA VAL 126 HA VAL 126 7.179 -3.504 2.048 955 HB VAL 126 HB VAL 126 7.737 -4.130 -0.880 956 HG11 VAL 126 HG11 VAL 126 6.406 -5.871 0.187 957 HG12 VAL 126 HG12 VAL 126 5.431 -4.931 -0.945 958 HG13 VAL 126 HG13 VAL 126 5.285 -4.654 0.792 959 HG21 VAL 126 HG21 VAL 126 5.774 -2.257 0.399 960 HG22 VAL 126 HG22 VAL 126 5.881 -2.617 -1.326 961 HG23 VAL 126 HG23 VAL 126 7.227 -1.817 -0.514 962 H ASP 127 H ASP 127 9.924 -4.906 0.401 963 HA ASP 127 HA ASP 127 9.193 -7.611 0.884 964 HB2 ASP 127 HB2 ASP 127 10.807 -6.779 -0.898 965 HB3 ASP 127 HB3 ASP 127 11.977 -6.527 0.389 966 H ALA 128 H ALA 128 10.997 -5.170 2.497 967 HA ALA 128 HA ALA 128 12.195 -6.653 4.555 968 HB1 ALA 128 HB1 ALA 128 11.271 -3.787 4.663 969 HB2 ALA 128 HB2 ALA 128 12.791 -4.327 3.972 970 HB3 ALA 128 HB3 ALA 128 12.490 -4.530 5.700 971 H LEU 129 H LEU 129 9.087 -4.871 4.528 972 HA LEU 129 HA LEU 129 8.413 -5.639 7.191 973 HB2 LEU 129 HB2 LEU 129 6.184 -4.749 6.732 974 HB3 LEU 129 HB3 LEU 129 7.425 -3.641 6.198 975 HG LEU 129 HG LEU 129 7.016 -4.824 3.901 976 HD11 LEU 129 HD11 LEU 129 4.669 -5.414 3.527 977 HD12 LEU 129 HD12 LEU 129 4.374 -5.199 5.262 978 HD13 LEU 129 HD13 LEU 129 5.483 -6.452 4.712 979 HD21 LEU 129 HD21 LEU 129 6.739 -2.455 4.262 980 HD22 LEU 129 HD22 LEU 129 5.188 -2.724 5.060 981 HD23 LEU 129 HD23 LEU 129 5.371 -3.070 3.341 982 H HIS 130 H HIS 130 7.826 -7.074 4.104 983 HA HIS 130 HA HIS 130 6.032 -9.109 4.919 984 HB2 HIS 130 HB2 HIS 130 6.407 -8.345 2.566 985 HB3 HIS 130 HB3 HIS 130 8.018 -9.036 2.625 986 HD1 HIS 130 HD1 HIS 130 4.476 -9.904 1.939 987 HD2 HIS 130 HD2 HIS 130 8.064 -11.884 2.636 988 HE1 HIS 130 HE1 HIS 130 4.158 -12.248 1.116 989 H ALA 131 H ALA 131 9.380 -8.620 5.159 990 HA ALA 131 HA ALA 131 9.973 -11.405 5.873 991 HB1 ALA 131 HB1 ALA 131 11.849 -9.060 5.585 992 HB2 ALA 131 HB2 ALA 131 11.543 -10.284 4.356 993 HB3 ALA 131 HB3 ALA 131 12.325 -10.735 5.869 994 H HIS 132 H HIS 132 8.640 -9.004 7.441 995 HA HIS 132 HA HIS 132 8.361 -8.383 9.552 996 HB2 HIS 132 HB2 HIS 132 9.854 -10.958 10.104 997 HB3 HIS 132 HB3 HIS 132 9.211 -9.943 11.392 998 HD1 HIS 132 HD1 HIS 132 8.213 -12.705 9.134 999 HD2 HIS 132 HD2 HIS 132 6.318 -9.641 11.235 1000 HE1 HIS 132 HE1 HIS 132 5.798 -13.335 9.258 1001 H GLN 133 H GLN 133 10.588 -7.411 8.037 1002 HA GLN 133 HA GLN 133 12.498 -6.545 10.102 1003 HB2 GLN 133 HB2 GLN 133 12.437 -6.077 7.095 1004 HB3 GLN 133 HB3 GLN 133 13.743 -5.585 8.162 1005 HG2 GLN 133 HG2 GLN 133 12.936 -8.456 7.729 1006 HG3 GLN 133 HG3 GLN 133 14.160 -7.640 6.766 1007 HE21 GLN 133 HE21 GLN 133 15.683 -9.129 7.457 1008 HE22 GLN 133 HE22 GLN 133 16.367 -9.076 9.051 1009 H ALA 134 H ALA 134 9.689 -5.883 9.853 1010 HA ALA 134 HA ALA 134 9.009 -3.545 8.549 1011 HB1 ALA 134 HB1 ALA 134 7.421 -5.190 9.388 1012 HB2 ALA 134 HB2 ALA 134 7.008 -3.547 9.880 1013 HB3 ALA 134 HB3 ALA 134 7.749 -4.655 11.032 1014 H ARG 135 H ARG 135 10.513 -3.872 11.695 1015 HA ARG 135 HA ARG 135 9.893 -1.379 12.814 1016 HB2 ARG 135 HB2 ARG 135 12.382 -3.042 13.070 1017 HB3 ARG 135 HB3 ARG 135 12.071 -1.604 14.033 1018 HG2 ARG 135 HG2 ARG 135 10.237 -2.608 15.107 1019 HG3 ARG 135 HG3 ARG 135 10.204 -3.957 13.975 1020 HD2 ARG 135 HD2 ARG 135 12.412 -3.298 15.908 1021 HD3 ARG 135 HD3 ARG 135 11.237 -4.607 16.092 1022 HE ARG 135 HE ARG 135 12.284 -5.165 13.715 1023 HH11 ARG 135 HH11 ARG 135 13.865 -4.493 16.805 1024 HH12 ARG 135 HH12 ARG 135 15.291 -5.353 16.402 1025 HH21 ARG 135 HH21 ARG 135 14.252 -6.307 13.189 1026 HH22 ARG 135 HH22 ARG 135 15.512 -6.397 14.325 1027 H GLU 136 H GLU 136 12.506 -2.258 10.617 1028 HA GLU 136 HA GLU 136 13.640 0.344 10.608 1029 HB2 GLU 136 HB2 GLU 136 14.077 -2.046 8.814 1030 HB3 GLU 136 HB3 GLU 136 15.062 -0.582 8.788 1031 HG2 GLU 136 HG2 GLU 136 15.754 -0.935 11.062 1032 HG3 GLU 136 HG3 GLU 136 14.676 -2.315 11.214 1033 H VAL 137 H VAL 137 11.173 -1.247 8.830 1034 HA VAL 137 HA VAL 137 11.021 0.572 6.640 1035 HB VAL 137 HB VAL 137 8.833 -1.158 7.852 1036 HG11 VAL 137 HG11 VAL 137 7.903 0.618 6.465 1037 HG12 VAL 137 HG12 VAL 137 7.705 -0.950 5.685 1038 HG13 VAL 137 HG13 VAL 137 8.966 0.156 5.137 1039 HG21 VAL 137 HG21 VAL 137 9.347 -2.730 6.038 1040 HG22 VAL 137 HG22 VAL 137 10.727 -2.491 7.108 1041 HG23 VAL 137 HG23 VAL 137 10.676 -1.696 5.534 1042 H VAL 138 H VAL 138 9.460 0.311 9.770 1043 HA VAL 138 HA VAL 138 7.845 2.587 9.644 1044 HB VAL 138 HB VAL 138 9.163 1.353 12.091 1045 HG11 VAL 138 HG11 VAL 138 8.434 3.643 12.567 1046 HG12 VAL 138 HG12 VAL 138 7.410 2.477 13.405 1047 HG13 VAL 138 HG13 VAL 138 6.825 3.270 11.943 1048 HG21 VAL 138 HG21 VAL 138 6.403 0.967 10.932 1049 HG22 VAL 138 HG22 VAL 138 6.987 0.265 12.441 1050 HG23 VAL 138 HG23 VAL 138 7.716 -0.208 10.906 1051 H ARG 139 H ARG 139 11.198 2.203 10.630 1052 HA ARG 139 HA ARG 139 11.699 4.838 11.491 1053 HB2 ARG 139 HB2 ARG 139 13.197 2.856 11.832 1054 HB3 ARG 139 HB3 ARG 139 13.644 2.955 10.138 1055 HG2 ARG 139 HG2 ARG 139 14.559 5.215 10.548 1056 HG3 ARG 139 HG3 ARG 139 14.167 5.027 12.259 1057 HD2 ARG 139 HD2 ARG 139 15.581 2.976 12.285 1058 HD3 ARG 139 HD3 ARG 139 16.062 3.354 10.633 1059 HE ARG 139 HE ARG 139 16.520 5.577 12.277 1060 HH11 ARG 139 HH11 ARG 139 17.864 2.393 11.570 1061 HH12 ARG 139 HH12 ARG 139 19.389 2.719 12.247 1062 HH21 ARG 139 HH21 ARG 139 18.623 6.072 13.130 1063 HH22 ARG 139 HH22 ARG 139 19.850 4.894 13.146 1064 H ARG 140 H ARG 140 11.897 3.340 8.316 1065 HA ARG 140 HA ARG 140 12.918 5.527 6.830 1066 HB2 ARG 140 HB2 ARG 140 12.303 2.883 6.355 1067 HB3 ARG 140 HB3 ARG 140 11.015 3.696 5.495 1068 HG2 ARG 140 HG2 ARG 140 13.961 4.145 5.032 1069 HG3 ARG 140 HG3 ARG 140 12.933 3.089 4.072 1070 HD2 ARG 140 HD2 ARG 140 11.563 5.068 3.466 1071 HD3 ARG 140 HD3 ARG 140 12.708 6.075 4.363 1072 HE ARG 140 HE ARG 140 14.251 4.629 2.617 1073 HH11 ARG 140 HH11 ARG 140 11.680 7.042 2.267 1074 HH12 ARG 140 HH12 ARG 140 12.160 7.484 0.696 1075 HH21 ARG 140 HH21 ARG 140 14.898 5.234 0.594 1076 HH22 ARG 140 HH22 ARG 140 14.057 6.425 -0.326 1077 H ALA 141 H ALA 141 9.677 4.407 7.608 1078 HA ALA 141 HA ALA 141 8.120 6.268 6.210 1079 HB1 ALA 141 HB1 ALA 141 6.355 5.624 7.841 1080 HB2 ALA 141 HB2 ALA 141 7.580 4.745 8.755 1081 HB3 ALA 141 HB3 ALA 141 7.179 4.248 7.110 1082 H GLN 142 H GLN 142 9.295 6.267 9.544 1083 HA GLN 142 HA GLN 142 8.308 8.702 10.470 1084 HB2 GLN 142 HB2 GLN 142 10.965 7.405 11.087 1085 HB3 GLN 142 HB3 GLN 142 10.272 8.733 11.998 1086 HG2 GLN 142 HG2 GLN 142 8.459 7.335 12.737 1087 HG3 GLN 142 HG3 GLN 142 9.009 6.018 11.698 1088 HE21 GLN 142 HE21 GLN 142 8.673 6.077 14.601 1089 HE22 GLN 142 HE22 GLN 142 10.218 5.715 15.266 1090 H ALA 143 H ALA 143 11.141 7.999 8.532 1091 HA ALA 143 HA ALA 143 12.290 10.553 8.630 1092 HB1 ALA 143 HB1 ALA 143 13.660 9.836 6.741 1093 HB2 ALA 143 HB2 ALA 143 12.585 8.459 6.477 1094 HB3 ALA 143 HB3 ALA 143 13.544 8.557 7.949 1095 H MET 144 H MET 144 9.878 9.149 6.494 1096 HA MET 144 HA MET 144 9.799 11.576 4.945 1097 HB2 MET 144 HB2 MET 144 9.215 9.725 3.614 1098 HB3 MET 144 HB3 MET 144 8.091 9.091 4.807 1099 HG2 MET 144 HG2 MET 144 6.469 10.669 4.314 1100 HG3 MET 144 HG3 MET 144 7.589 11.735 3.454 1101 HE1 MET 144 HE1 MET 144 9.052 9.699 1.478 1102 HE2 MET 144 HE2 MET 144 8.395 11.265 1.001 1103 HE3 MET 144 HE3 MET 144 7.993 9.825 0.074 1104 H ALA 145 H ALA 145 7.740 10.210 7.454 1105 HA ALA 145 HA ALA 145 5.743 12.183 7.115 1106 HB1 ALA 145 HB1 ALA 145 6.168 10.493 9.537 1107 HB2 ALA 145 HB2 ALA 145 5.289 9.995 8.094 1108 HB3 ALA 145 HB3 ALA 145 4.689 11.334 9.080 1109 H TYR 146 H TYR 146 8.560 12.073 9.201 1110 HA TYR 146 HA TYR 146 7.648 14.564 10.418 1111 HB2 TYR 146 HB2 TYR 146 9.851 12.671 11.274 1112 HB3 TYR 146 HB3 TYR 146 9.395 14.149 12.111 1113 HD1 TYR 146 HD1 TYR 146 8.436 10.690 11.376 1114 HD2 TYR 146 HD2 TYR 146 7.389 14.230 13.475 1115 HE1 TYR 146 HE1 TYR 146 6.817 9.408 12.704 1116 HE2 TYR 146 HE2 TYR 146 5.768 12.962 14.813 1117 HH TYR 146 HH TYR 146 4.466 10.917 14.598 Start of MODEL 22 1 H MET 1 H MET 1 -11.577 30.815 30.460 2 HA MET 1 HA MET 1 -13.176 30.033 31.974 3 HB2 MET 1 HB2 MET 1 -15.076 31.730 30.349 4 HB3 MET 1 HB3 MET 1 -15.625 30.446 31.407 5 HG2 MET 1 HG2 MET 1 -15.827 32.608 32.480 6 HG3 MET 1 HG3 MET 1 -14.658 31.615 33.332 7 HE1 MET 1 HE1 MET 1 -14.873 34.631 33.930 8 HE2 MET 1 HE2 MET 1 -13.191 35.167 33.883 9 HE3 MET 1 HE3 MET 1 -13.610 33.626 34.636 10 HA PRO 2 HA PRO 2 -12.895 27.183 28.444 11 HB2 PRO 2 HB2 PRO 2 -12.567 25.191 30.588 12 HB3 PRO 2 HB3 PRO 2 -11.493 25.559 29.237 13 HG2 PRO 2 HG2 PRO 2 -10.846 26.220 31.753 14 HG3 PRO 2 HG3 PRO 2 -10.415 27.252 30.376 15 HD2 PRO 2 HD2 PRO 2 -12.656 27.562 32.337 16 HD3 PRO 2 HD3 PRO 2 -11.548 28.784 31.672 17 H GLY 3 H GLY 3 -14.834 26.772 27.650 18 HA2 GLY 3 HA2 GLY 3 -16.923 25.658 29.379 19 HA3 GLY 3 HA3 GLY 3 -17.179 26.398 27.800 20 H ARG 4 H ARG 4 -18.450 24.419 27.461 21 HA ARG 4 HA ARG 4 -17.066 21.916 27.151 22 HB2 ARG 4 HB2 ARG 4 -19.762 22.818 26.084 23 HB3 ARG 4 HB3 ARG 4 -19.155 21.170 26.035 24 HG2 ARG 4 HG2 ARG 4 -19.699 22.736 28.551 25 HG3 ARG 4 HG3 ARG 4 -20.801 21.557 27.839 26 HD2 ARG 4 HD2 ARG 4 -17.998 20.972 28.803 27 HD3 ARG 4 HD3 ARG 4 -19.470 20.641 29.708 28 HE ARG 4 HE ARG 4 -19.795 19.362 27.299 29 HH11 ARG 4 HH11 ARG 4 -17.416 19.169 29.911 30 HH12 ARG 4 HH12 ARG 4 -17.087 17.518 29.673 31 HH21 ARG 4 HH21 ARG 4 -19.326 17.111 26.970 32 HH22 ARG 4 HH22 ARG 4 -18.172 16.335 27.951 33 H ALA 5 H ALA 5 -16.086 21.178 25.349 34 HA ALA 5 HA ALA 5 -15.927 23.046 23.104 35 HB1 ALA 5 HB1 ALA 5 -13.836 21.895 22.541 36 HB2 ALA 5 HB2 ALA 5 -14.091 20.771 23.873 37 HB3 ALA 5 HB3 ALA 5 -13.801 22.476 24.206 38 HA PRO 6 HA PRO 6 -18.478 19.817 21.153 39 HB2 PRO 6 HB2 PRO 6 -18.755 21.821 19.021 40 HB3 PRO 6 HB3 PRO 6 -20.012 21.062 20.001 41 HG2 PRO 6 HG2 PRO 6 -19.377 23.644 20.304 42 HG3 PRO 6 HG3 PRO 6 -19.852 22.633 21.678 43 HD2 PRO 6 HD2 PRO 6 -17.105 23.457 20.807 44 HD3 PRO 6 HD3 PRO 6 -17.810 23.418 22.443 45 H GLY 7 H GLY 7 -17.947 18.388 19.489 46 HA2 GLY 7 HA2 GLY 7 -15.346 18.770 18.389 47 HA3 GLY 7 HA3 GLY 7 -16.339 17.312 18.353 48 H SER 8 H SER 8 -15.465 17.566 16.215 49 HA SER 8 HA SER 8 -16.927 19.420 14.474 50 HB2 SER 8 HB2 SER 8 -14.698 17.504 13.768 51 HB3 SER 8 HB3 SER 8 -15.282 18.856 12.798 52 HG SER 8 HG SER 8 -14.717 20.012 14.957 53 H THR 9 H THR 9 -17.264 18.184 12.187 54 HA THR 9 HA THR 9 -19.323 16.323 12.399 55 HB THR 9 HB THR 9 -17.418 16.998 10.144 56 HG1 THR 9 HG1 THR 9 -20.009 18.005 10.693 57 HG21 THR 9 HG21 THR 9 -20.188 15.761 9.966 58 HG22 THR 9 HG22 THR 9 -18.670 14.922 9.652 59 HG23 THR 9 HG23 THR 9 -19.183 16.240 8.602 60 H LEU 10 H LEU 10 -19.261 14.012 11.926 61 HA LEU 10 HA LEU 10 -17.032 12.601 12.906 62 HB2 LEU 10 HB2 LEU 10 -19.413 11.640 11.298 63 HB3 LEU 10 HB3 LEU 10 -18.176 10.564 11.900 64 HG LEU 10 HG LEU 10 -20.117 10.423 13.300 65 HD11 LEU 10 HD11 LEU 10 -19.192 10.970 15.488 66 HD12 LEU 10 HD12 LEU 10 -17.929 11.920 14.714 67 HD13 LEU 10 HD13 LEU 10 -18.021 10.177 14.439 68 HD21 LEU 10 HD21 LEU 10 -19.800 13.366 13.703 69 HD22 LEU 10 HD22 LEU 10 -20.954 12.353 14.582 70 HD23 LEU 10 HD23 LEU 10 -21.115 12.569 12.833 71 H ALA 11 H ALA 11 -15.258 12.765 11.967 72 HA ALA 11 HA ALA 11 -15.023 12.929 9.088 73 HB1 ALA 11 HB1 ALA 11 -12.883 13.003 11.213 74 HB2 ALA 11 HB2 ALA 11 -13.653 14.409 10.476 75 HB3 ALA 11 HB3 ALA 11 -12.647 13.338 9.498 76 H ARG 12 H ARG 12 -14.685 11.254 7.868 77 HA ARG 12 HA ARG 12 -14.203 8.681 9.041 78 HB2 ARG 12 HB2 ARG 12 -14.503 9.542 6.152 79 HB3 ARG 12 HB3 ARG 12 -14.393 7.869 6.690 80 HG2 ARG 12 HG2 ARG 12 -16.452 8.075 7.928 81 HG3 ARG 12 HG3 ARG 12 -16.540 9.793 7.561 82 HD2 ARG 12 HD2 ARG 12 -16.660 7.566 5.532 83 HD3 ARG 12 HD3 ARG 12 -18.049 8.431 6.179 84 HE ARG 12 HE ARG 12 -15.914 9.849 4.747 85 HH11 ARG 12 HH11 ARG 12 -19.321 8.883 4.944 86 HH12 ARG 12 HH12 ARG 12 -19.850 9.997 3.774 87 HH21 ARG 12 HH21 ARG 12 -16.656 11.388 3.117 88 HH22 ARG 12 HH22 ARG 12 -18.318 11.450 2.733 89 H VAL 13 H VAL 13 -12.210 8.529 9.844 90 HA VAL 13 HA VAL 13 -10.017 9.500 8.296 91 HB VAL 13 HB VAL 13 -8.668 9.245 10.348 92 HG11 VAL 13 HG11 VAL 13 -11.167 10.882 10.715 93 HG12 VAL 13 HG12 VAL 13 -9.699 11.381 9.872 94 HG13 VAL 13 HG13 VAL 13 -9.664 11.094 11.612 95 HG21 VAL 13 HG21 VAL 13 -9.880 7.435 11.439 96 HG22 VAL 13 HG22 VAL 13 -11.279 8.487 11.660 97 HG23 VAL 13 HG23 VAL 13 -9.774 8.832 12.512 98 H GLY 14 H GLY 14 -8.551 8.311 7.628 99 HA2 GLY 14 HA2 GLY 14 -7.213 6.292 7.448 100 HA3 GLY 14 HA3 GLY 14 -8.596 5.387 8.066 101 H SER 15 H SER 15 -9.764 7.634 6.041 102 HA SER 15 HA SER 15 -10.131 5.633 4.001 103 HB2 SER 15 HB2 SER 15 -11.448 8.312 4.404 104 HB3 SER 15 HB3 SER 15 -11.915 7.098 3.205 105 HG SER 15 HG SER 15 -11.755 5.965 5.628 106 H ILE 16 H ILE 16 -8.171 5.674 2.976 107 HA ILE 16 HA ILE 16 -7.531 8.159 1.572 108 HB ILE 16 HB ILE 16 -5.794 5.667 1.882 109 HG12 ILE 16 HG12 ILE 16 -4.204 7.354 3.047 110 HG13 ILE 16 HG13 ILE 16 -5.617 8.390 3.171 111 HG21 ILE 16 HG21 ILE 16 -5.407 6.697 -0.261 112 HG22 ILE 16 HG22 ILE 16 -4.009 6.939 0.788 113 HG23 ILE 16 HG23 ILE 16 -5.143 8.263 0.506 114 HD11 ILE 16 HD11 ILE 16 -5.199 7.188 5.239 115 HD12 ILE 16 HD12 ILE 16 -5.324 5.651 4.384 116 HD13 ILE 16 HD13 ILE 16 -6.736 6.698 4.524 117 HA PRO 17 HA PRO 17 -9.371 5.941 -1.926 118 HB2 PRO 17 HB2 PRO 17 -8.719 8.337 -3.476 119 HB3 PRO 17 HB3 PRO 17 -10.308 7.679 -3.077 120 HG2 PRO 17 HG2 PRO 17 -9.387 9.991 -2.018 121 HG3 PRO 17 HG3 PRO 17 -10.480 8.907 -1.138 122 HD2 PRO 17 HD2 PRO 17 -7.515 9.235 -0.878 123 HD3 PRO 17 HD3 PRO 17 -8.766 9.036 0.375 124 H ALA 18 H ALA 18 -8.559 5.394 -4.131 125 HA ALA 18 HA ALA 18 -5.703 4.955 -4.000 126 HB1 ALA 18 HB1 ALA 18 -7.784 3.959 -5.941 127 HB2 ALA 18 HB2 ALA 18 -7.183 3.092 -4.527 128 HB3 ALA 18 HB3 ALA 18 -6.100 3.439 -5.874 129 H GLY 19 H GLY 19 -4.244 5.948 -5.241 130 HA2 GLY 19 HA2 GLY 19 -5.202 7.928 -7.188 131 HA3 GLY 19 HA3 GLY 19 -3.629 7.937 -6.388 132 H ASP 20 H ASP 20 -1.987 6.496 -7.108 133 HA ASP 20 HA ASP 20 -2.656 4.853 -9.351 134 HB2 ASP 20 HB2 ASP 20 -0.747 5.599 -10.709 135 HB3 ASP 20 HB3 ASP 20 -1.942 6.868 -10.510 136 H ASP 21 H ASP 21 -0.868 3.420 -9.971 137 HA ASP 21 HA ASP 21 0.077 2.249 -7.482 138 HB2 ASP 21 HB2 ASP 21 -1.296 0.777 -8.742 139 HB3 ASP 21 HB3 ASP 21 -0.417 1.116 -10.222 140 H VAL 22 H VAL 22 2.095 1.679 -7.077 141 HA VAL 22 HA VAL 22 4.131 3.036 -8.693 142 HB VAL 22 HB VAL 22 4.184 2.267 -5.761 143 HG11 VAL 22 HG11 VAL 22 6.336 3.687 -7.341 144 HG12 VAL 22 HG12 VAL 22 6.427 2.028 -6.753 145 HG13 VAL 22 HG13 VAL 22 6.353 3.357 -5.603 146 HG21 VAL 22 HG21 VAL 22 4.270 4.697 -5.406 147 HG22 VAL 22 HG22 VAL 22 2.809 4.203 -6.264 148 HG23 VAL 22 HG23 VAL 22 4.142 4.940 -7.149 149 H LEU 23 H LEU 23 3.177 -0.147 -7.593 150 HA LEU 23 HA LEU 23 5.808 -1.091 -8.229 151 HB2 LEU 23 HB2 LEU 23 4.934 -3.422 -7.711 152 HB3 LEU 23 HB3 LEU 23 4.993 -2.310 -6.376 153 HG LEU 23 HG LEU 23 2.540 -2.082 -6.447 154 HD11 LEU 23 HD11 LEU 23 2.696 -4.171 -8.618 155 HD12 LEU 23 HD12 LEU 23 2.180 -2.499 -8.828 156 HD13 LEU 23 HD13 LEU 23 1.228 -3.594 -7.830 157 HD21 LEU 23 HD21 LEU 23 1.983 -4.381 -5.803 158 HD22 LEU 23 HD22 LEU 23 3.443 -3.755 -5.024 159 HD23 LEU 23 HD23 LEU 23 3.577 -4.885 -6.368 160 H ASP 24 H ASP 24 5.528 -3.428 -9.590 161 HA ASP 24 HA ASP 24 4.683 -2.280 -12.144 162 HB2 ASP 24 HB2 ASP 24 7.080 -3.033 -11.865 163 HB3 ASP 24 HB3 ASP 24 6.482 -4.667 -11.613 164 HA PRO 25 HA PRO 25 1.231 -5.125 -12.403 165 HB2 PRO 25 HB2 PRO 25 2.303 -5.654 -15.137 166 HB3 PRO 25 HB3 PRO 25 0.654 -5.311 -14.618 167 HG2 PRO 25 HG2 PRO 25 2.108 -3.418 -15.755 168 HG3 PRO 25 HG3 PRO 25 1.043 -3.041 -14.390 169 HD2 PRO 25 HD2 PRO 25 4.013 -3.289 -14.463 170 HD3 PRO 25 HD3 PRO 25 2.985 -2.236 -13.472 171 H ASP 26 H ASP 26 4.502 -6.106 -13.168 172 HA ASP 26 HA ASP 26 4.088 -8.888 -13.319 173 HB2 ASP 26 HB2 ASP 26 6.130 -7.841 -14.141 174 HB3 ASP 26 HB3 ASP 26 6.528 -7.303 -12.519 175 H GLU 27 H GLU 27 4.351 -6.675 -10.605 176 HA GLU 27 HA GLU 27 4.491 -8.815 -8.718 177 HB2 GLU 27 HB2 GLU 27 3.893 -5.868 -8.400 178 HB3 GLU 27 HB3 GLU 27 3.723 -6.993 -7.066 179 HG2 GLU 27 HG2 GLU 27 5.803 -5.932 -6.767 180 HG3 GLU 27 HG3 GLU 27 6.172 -7.535 -7.382 181 HA PRO 28 HA PRO 28 0.222 -9.817 -9.354 182 HB2 PRO 28 HB2 PRO 28 0.318 -11.250 -6.793 183 HB3 PRO 28 HB3 PRO 28 0.041 -11.878 -8.416 184 HG2 PRO 28 HG2 PRO 28 2.331 -12.330 -7.073 185 HG3 PRO 28 HG3 PRO 28 2.282 -12.165 -8.837 186 HD2 PRO 28 HD2 PRO 28 3.146 -10.194 -6.767 187 HD3 PRO 28 HD3 PRO 28 3.819 -10.554 -8.378 188 H THR 29 H THR 29 -1.696 -8.954 -8.797 189 HA THR 29 HA THR 29 -1.800 -7.479 -6.286 190 HB THR 29 HB THR 29 -3.533 -6.110 -7.579 191 HG1 THR 29 HG1 THR 29 -3.757 -7.136 -9.485 192 HG21 THR 29 HG21 THR 29 -1.392 -5.213 -6.815 193 HG22 THR 29 HG22 THR 29 -1.744 -4.621 -8.437 194 HG23 THR 29 HG23 THR 29 -0.578 -5.922 -8.212 195 H TYR 30 H TYR 30 -3.806 -7.214 -5.311 196 HA TYR 30 HA TYR 30 -5.759 -9.327 -5.753 197 HB2 TYR 30 HB2 TYR 30 -5.012 -7.775 -3.275 198 HB3 TYR 30 HB3 TYR 30 -6.461 -8.756 -3.406 199 HD1 TYR 30 HD1 TYR 30 -5.659 -11.181 -4.625 200 HD2 TYR 30 HD2 TYR 30 -3.493 -8.769 -1.892 201 HE1 TYR 30 HE1 TYR 30 -4.430 -13.147 -3.900 202 HE2 TYR 30 HE2 TYR 30 -2.244 -10.739 -1.137 203 HH TYR 30 HH TYR 30 -2.453 -13.122 -1.075 204 H ASP 31 H ASP 31 -7.911 -8.641 -5.211 205 HA ASP 31 HA ASP 31 -8.583 -5.843 -5.829 206 HB2 ASP 31 HB2 ASP 31 -9.910 -8.339 -6.984 207 HB3 ASP 31 HB3 ASP 31 -10.418 -6.687 -7.265 208 H LEU 32 H LEU 32 -10.993 -5.595 -5.151 209 HA LEU 32 HA LEU 32 -11.178 -6.247 -2.491 210 HB2 LEU 32 HB2 LEU 32 -13.309 -5.311 -4.372 211 HB3 LEU 32 HB3 LEU 32 -13.678 -5.672 -2.702 212 HG LEU 32 HG LEU 32 -13.396 -3.360 -2.885 213 HD11 LEU 32 HD11 LEU 32 -11.606 -2.841 -1.345 214 HD12 LEU 32 HD12 LEU 32 -10.933 -4.450 -1.583 215 HD13 LEU 32 HD13 LEU 32 -12.534 -4.259 -0.862 216 HD21 LEU 32 HD21 LEU 32 -11.311 -2.250 -3.652 217 HD22 LEU 32 HD22 LEU 32 -12.143 -3.129 -4.934 218 HD23 LEU 32 HD23 LEU 32 -10.711 -3.824 -4.175 219 HA PRO 33 HA PRO 33 -14.306 -9.909 -3.275 220 HB2 PRO 33 HB2 PRO 33 -14.090 -11.102 -5.746 221 HB3 PRO 33 HB3 PRO 33 -15.331 -9.910 -5.336 222 HG2 PRO 33 HG2 PRO 33 -12.721 -9.509 -6.757 223 HG3 PRO 33 HG3 PRO 33 -14.319 -8.855 -7.155 224 HD2 PRO 33 HD2 PRO 33 -12.502 -7.354 -5.923 225 HD3 PRO 33 HD3 PRO 33 -14.215 -7.254 -5.470 226 H ARG 34 H ARG 34 -11.205 -9.798 -4.906 227 HA ARG 34 HA ARG 34 -10.456 -12.504 -4.617 228 HB2 ARG 34 HB2 ARG 34 -9.594 -10.709 -6.211 229 HB3 ARG 34 HB3 ARG 34 -8.732 -10.107 -4.802 230 HG2 ARG 34 HG2 ARG 34 -7.247 -11.382 -6.203 231 HG3 ARG 34 HG3 ARG 34 -7.500 -12.191 -4.655 232 HD2 ARG 34 HD2 ARG 34 -8.855 -13.828 -5.590 233 HD3 ARG 34 HD3 ARG 34 -9.151 -12.856 -7.042 234 HE ARG 34 HE ARG 34 -6.635 -13.177 -7.373 235 HH11 ARG 34 HH11 ARG 34 -8.729 -15.718 -6.002 236 HH12 ARG 34 HH12 ARG 34 -7.762 -16.962 -6.613 237 HH21 ARG 34 HH21 ARG 34 -5.369 -14.939 -8.187 238 HH22 ARG 34 HH22 ARG 34 -5.840 -16.540 -7.882 239 H VAL 35 H VAL 35 -9.894 -9.547 -2.720 240 HA VAL 35 HA VAL 35 -8.155 -10.806 -0.863 241 HB VAL 35 HB VAL 35 -9.807 -8.283 -0.436 242 HG11 VAL 35 HG11 VAL 35 -9.046 -9.215 1.677 243 HG12 VAL 35 HG12 VAL 35 -8.185 -7.717 1.317 244 HG13 VAL 35 HG13 VAL 35 -7.391 -9.271 1.074 245 HG21 VAL 35 HG21 VAL 35 -8.304 -8.046 -2.327 246 HG22 VAL 35 HG22 VAL 35 -6.947 -8.571 -1.329 247 HG23 VAL 35 HG23 VAL 35 -7.763 -7.049 -0.975 248 H ALA 36 H ALA 36 -11.570 -10.209 -0.986 249 HA ALA 36 HA ALA 36 -12.337 -11.098 1.548 250 HB1 ALA 36 HB1 ALA 36 -14.521 -11.494 0.523 251 HB2 ALA 36 HB2 ALA 36 -13.789 -11.419 -1.078 252 HB3 ALA 36 HB3 ALA 36 -13.821 -9.982 -0.056 253 H GLU 37 H GLU 37 -11.852 -12.759 -1.451 254 HA GLU 37 HA GLU 37 -12.570 -15.385 -0.822 255 HB2 GLU 37 HB2 GLU 37 -12.052 -14.156 -3.034 256 HB3 GLU 37 HB3 GLU 37 -10.404 -14.485 -2.654 257 HG2 GLU 37 HG2 GLU 37 -10.737 -16.858 -2.694 258 HG3 GLU 37 HG3 GLU 37 -12.463 -16.627 -3.002 259 H LEU 38 H LEU 38 -9.482 -13.685 -0.778 260 HA LEU 38 HA LEU 38 -7.799 -15.793 0.008 261 HB2 LEU 38 HB2 LEU 38 -6.999 -13.739 -1.029 262 HB3 LEU 38 HB3 LEU 38 -7.497 -12.818 0.376 263 HG LEU 38 HG LEU 38 -5.859 -14.226 1.707 264 HD11 LEU 38 HD11 LEU 38 -5.557 -16.031 0.129 265 HD12 LEU 38 HD12 LEU 38 -4.023 -15.248 0.491 266 HD13 LEU 38 HD13 LEU 38 -4.838 -14.917 -1.035 267 HD21 LEU 38 HD21 LEU 38 -5.433 -11.904 1.128 268 HD22 LEU 38 HD22 LEU 38 -4.776 -12.400 -0.432 269 HD23 LEU 38 HD23 LEU 38 -3.947 -12.852 1.057 270 H LEU 39 H LEU 39 -9.368 -13.216 1.880 271 HA LEU 39 HA LEU 39 -8.180 -14.179 4.329 272 HB2 LEU 39 HB2 LEU 39 -10.147 -11.967 3.856 273 HB3 LEU 39 HB3 LEU 39 -9.417 -12.330 5.406 274 HG LEU 39 HG LEU 39 -8.012 -11.328 2.930 275 HD11 LEU 39 HD11 LEU 39 -7.574 -9.351 4.292 276 HD12 LEU 39 HD12 LEU 39 -8.514 -10.050 5.613 277 HD13 LEU 39 HD13 LEU 39 -9.302 -9.631 4.093 278 HD21 LEU 39 HD21 LEU 39 -5.994 -11.223 4.353 279 HD22 LEU 39 HD22 LEU 39 -6.550 -12.879 4.113 280 HD23 LEU 39 HD23 LEU 39 -6.877 -12.053 5.634 281 H GLY 40 H GLY 40 -11.073 -14.778 2.667 282 HA2 GLY 40 HA2 GLY 40 -12.709 -16.318 3.180 283 HA3 GLY 40 HA3 GLY 40 -11.918 -16.603 4.729 284 H VAL 41 H VAL 41 -12.762 -13.462 3.604 285 HA VAL 41 HA VAL 41 -14.969 -13.302 5.554 286 HB VAL 41 HB VAL 41 -14.340 -11.041 6.161 287 HG11 VAL 41 HG11 VAL 41 -13.294 -12.733 7.485 288 HG12 VAL 41 HG12 VAL 41 -12.198 -11.363 7.297 289 HG13 VAL 41 HG13 VAL 41 -11.944 -12.835 6.355 290 HG21 VAL 41 HG21 VAL 41 -12.273 -9.945 5.335 291 HG22 VAL 41 HG22 VAL 41 -13.463 -10.217 4.067 292 HG23 VAL 41 HG23 VAL 41 -12.059 -11.274 4.188 293 HA PRO 42 HA PRO 42 -17.289 -11.688 2.145 294 HB2 PRO 42 HB2 PRO 42 -18.690 -9.602 3.171 295 HB3 PRO 42 HB3 PRO 42 -19.131 -11.292 3.441 296 HG2 PRO 42 HG2 PRO 42 -17.654 -9.414 5.238 297 HG3 PRO 42 HG3 PRO 42 -18.892 -10.612 5.656 298 HD2 PRO 42 HD2 PRO 42 -16.275 -11.070 6.068 299 HD3 PRO 42 HD3 PRO 42 -17.394 -12.366 5.612 300 H VAL 43 H VAL 43 -17.436 -10.034 0.632 301 HA VAL 43 HA VAL 43 -15.135 -8.472 0.202 302 HB VAL 43 HB VAL 43 -17.859 -8.043 -0.997 303 HG11 VAL 43 HG11 VAL 43 -15.110 -7.378 -2.080 304 HG12 VAL 43 HG12 VAL 43 -16.302 -6.225 -1.482 305 HG13 VAL 43 HG13 VAL 43 -16.630 -7.145 -2.950 306 HG21 VAL 43 HG21 VAL 43 -17.068 -9.540 -2.849 307 HG22 VAL 43 HG22 VAL 43 -17.299 -10.352 -1.297 308 HG23 VAL 43 HG23 VAL 43 -15.680 -9.942 -1.828 309 H SER 44 H SER 44 -18.285 -7.678 1.507 310 HA SER 44 HA SER 44 -17.996 -4.918 1.632 311 HB2 SER 44 HB2 SER 44 -20.144 -6.139 1.925 312 HB3 SER 44 HB3 SER 44 -19.588 -6.695 3.502 313 HG SER 44 HG SER 44 -20.149 -4.909 4.298 314 H LYS 45 H LYS 45 -16.817 -7.460 3.814 315 HA LYS 45 HA LYS 45 -16.102 -5.682 5.922 316 HB2 LYS 45 HB2 LYS 45 -16.396 -8.138 6.298 317 HB3 LYS 45 HB3 LYS 45 -14.931 -8.415 5.357 318 HG2 LYS 45 HG2 LYS 45 -13.652 -7.112 6.985 319 HG3 LYS 45 HG3 LYS 45 -15.121 -6.874 7.932 320 HD2 LYS 45 HD2 LYS 45 -15.302 -9.322 8.202 321 HD3 LYS 45 HD3 LYS 45 -13.781 -9.497 7.314 322 HE2 LYS 45 HE2 LYS 45 -13.399 -9.610 9.718 323 HE3 LYS 45 HE3 LYS 45 -12.624 -8.191 9.015 324 HZ1 LYS 45 HZ1 LYS 45 -13.817 -7.731 11.116 325 HZ2 LYS 45 HZ2 LYS 45 -15.246 -8.166 10.374 326 HZ3 LYS 45 HZ3 LYS 45 -14.387 -6.805 9.852 327 H VAL 46 H VAL 46 -14.455 -7.008 3.143 328 HA VAL 46 HA VAL 46 -11.882 -6.012 3.716 329 HB VAL 46 HB VAL 46 -13.132 -6.376 0.974 330 HG11 VAL 46 HG11 VAL 46 -10.230 -6.330 1.793 331 HG12 VAL 46 HG12 VAL 46 -11.092 -5.029 0.975 332 HG13 VAL 46 HG13 VAL 46 -10.853 -6.572 0.154 333 HG21 VAL 46 HG21 VAL 46 -13.258 -8.426 2.283 334 HG22 VAL 46 HG22 VAL 46 -11.535 -8.311 2.648 335 HG23 VAL 46 HG23 VAL 46 -12.069 -8.588 0.990 336 H ALA 47 H ALA 47 -14.628 -4.607 2.039 337 HA ALA 47 HA ALA 47 -13.484 -2.155 1.314 338 HB1 ALA 47 HB1 ALA 47 -15.632 -2.967 0.424 339 HB2 ALA 47 HB2 ALA 47 -15.783 -1.340 1.095 340 HB3 ALA 47 HB3 ALA 47 -16.368 -2.732 2.008 341 H GLN 48 H GLN 48 -14.960 -3.246 4.304 342 HA GLN 48 HA GLN 48 -15.098 -0.732 5.618 343 HB2 GLN 48 HB2 GLN 48 -14.812 -3.487 6.828 344 HB3 GLN 48 HB3 GLN 48 -15.204 -2.032 7.725 345 HG2 GLN 48 HG2 GLN 48 -17.300 -1.843 6.502 346 HG3 GLN 48 HG3 GLN 48 -16.889 -3.288 5.573 347 HE21 GLN 48 HE21 GLN 48 -17.946 -2.068 8.629 348 HE22 GLN 48 HE22 GLN 48 -18.343 -3.598 9.318 349 H GLN 49 H GLN 49 -12.661 -3.282 5.546 350 HA GLN 49 HA GLN 49 -10.843 -2.228 7.431 351 HB2 GLN 49 HB2 GLN 49 -10.150 -3.850 4.980 352 HB3 GLN 49 HB3 GLN 49 -9.180 -3.682 6.428 353 HG2 GLN 49 HG2 GLN 49 -11.859 -5.033 6.255 354 HG3 GLN 49 HG3 GLN 49 -10.299 -5.839 6.258 355 HE21 GLN 49 HE21 GLN 49 -10.787 -7.006 8.087 356 HE22 GLN 49 HE22 GLN 49 -10.860 -6.298 9.658 357 H LEU 50 H LEU 50 -11.097 -1.894 3.981 358 HA LEU 50 HA LEU 50 -8.804 -0.359 3.465 359 HB2 LEU 50 HB2 LEU 50 -10.114 -1.499 1.738 360 HB3 LEU 50 HB3 LEU 50 -11.460 -0.424 2.028 361 HG LEU 50 HG LEU 50 -10.080 1.471 1.203 362 HD11 LEU 50 HD11 LEU 50 -7.881 0.586 1.684 363 HD12 LEU 50 HD12 LEU 50 -8.028 0.982 -0.028 364 HD13 LEU 50 HD13 LEU 50 -8.118 -0.699 0.502 365 HD21 LEU 50 HD21 LEU 50 -11.632 0.327 -0.284 366 HD22 LEU 50 HD22 LEU 50 -10.384 -0.847 -0.703 367 HD23 LEU 50 HD23 LEU 50 -10.193 0.843 -1.159 368 H ARG 51 H ARG 51 -12.087 0.563 4.280 369 HA ARG 51 HA ARG 51 -11.656 3.358 4.060 370 HB2 ARG 51 HB2 ARG 51 -13.875 1.802 5.351 371 HB3 ARG 51 HB3 ARG 51 -13.861 3.558 5.204 372 HG2 ARG 51 HG2 ARG 51 -13.806 3.384 2.793 373 HG3 ARG 51 HG3 ARG 51 -13.721 1.626 2.908 374 HD2 ARG 51 HD2 ARG 51 -15.911 1.605 4.001 375 HD3 ARG 51 HD3 ARG 51 -15.986 3.362 3.857 376 HE ARG 51 HE ARG 51 -15.502 2.328 1.342 377 HH11 ARG 51 HH11 ARG 51 -18.136 2.271 3.724 378 HH12 ARG 51 HH12 ARG 51 -19.359 2.131 2.548 379 HH21 ARG 51 HH21 ARG 51 -17.190 2.129 -0.234 380 HH22 ARG 51 HH22 ARG 51 -18.819 2.064 0.282 381 H GLU 52 H GLU 52 -10.989 1.130 6.601 382 HA GLU 52 HA GLU 52 -10.904 3.190 8.651 383 HB2 GLU 52 HB2 GLU 52 -10.111 0.286 8.689 384 HB3 GLU 52 HB3 GLU 52 -9.999 1.362 10.070 385 HG2 GLU 52 HG2 GLU 52 -12.494 0.589 8.615 386 HG3 GLU 52 HG3 GLU 52 -11.969 -0.033 10.175 387 H GLY 53 H GLY 53 -8.888 2.121 6.206 388 HA2 GLY 53 HA2 GLY 53 -6.685 2.609 5.754 389 HA3 GLY 53 HA3 GLY 53 -6.612 3.493 7.278 390 H HIS 54 H HIS 54 -7.699 0.226 7.013 391 HA HIS 54 HA HIS 54 -5.500 -0.668 8.728 392 HB2 HIS 54 HB2 HIS 54 -8.065 -1.174 9.012 393 HB3 HIS 54 HB3 HIS 54 -7.796 -2.355 7.744 394 HD1 HIS 54 HD1 HIS 54 -7.582 -1.891 11.349 395 HD2 HIS 54 HD2 HIS 54 -5.853 -4.392 8.524 396 HE1 HIS 54 HE1 HIS 54 -6.698 -3.871 12.628 397 H LEU 55 H LEU 55 -6.440 -0.455 5.533 398 HA LEU 55 HA LEU 55 -4.216 -1.927 4.522 399 HB2 LEU 55 HB2 LEU 55 -6.059 -3.635 4.750 400 HB3 LEU 55 HB3 LEU 55 -7.073 -2.614 3.756 401 HG LEU 55 HG LEU 55 -5.480 -2.945 1.872 402 HD11 LEU 55 HD11 LEU 55 -4.198 -4.932 3.737 403 HD12 LEU 55 HD12 LEU 55 -3.470 -3.439 3.142 404 HD13 LEU 55 HD13 LEU 55 -3.835 -4.752 2.022 405 HD21 LEU 55 HD21 LEU 55 -6.176 -5.255 1.400 406 HD22 LEU 55 HD22 LEU 55 -7.500 -4.301 2.070 407 HD23 LEU 55 HD23 LEU 55 -6.637 -5.454 3.087 408 H VAL 56 H VAL 56 -3.885 -1.129 2.251 409 HA VAL 56 HA VAL 56 -5.728 0.971 1.481 410 HB VAL 56 HB VAL 56 -3.811 1.993 2.701 411 HG11 VAL 56 HG11 VAL 56 -1.599 2.136 1.620 412 HG12 VAL 56 HG12 VAL 56 -2.136 0.927 0.447 413 HG13 VAL 56 HG13 VAL 56 -2.038 0.517 2.159 414 HG21 VAL 56 HG21 VAL 56 -3.298 3.752 1.039 415 HG22 VAL 56 HG22 VAL 56 -5.014 3.345 1.111 416 HG23 VAL 56 HG23 VAL 56 -4.013 2.738 -0.210 417 H ALA 57 H ALA 57 -5.634 1.460 -0.769 418 HA ALA 57 HA ALA 57 -4.487 -0.699 -2.386 419 HB1 ALA 57 HB1 ALA 57 -6.527 -0.762 -3.690 420 HB2 ALA 57 HB2 ALA 57 -7.223 0.521 -2.706 421 HB3 ALA 57 HB3 ALA 57 -6.907 -1.057 -1.990 422 H VAL 58 H VAL 58 -4.334 -0.119 -4.657 423 HA VAL 58 HA VAL 58 -4.099 2.749 -5.149 424 HB VAL 58 HB VAL 58 -2.158 2.173 -6.712 425 HG11 VAL 58 HG11 VAL 58 -1.861 3.362 -4.626 426 HG12 VAL 58 HG12 VAL 58 -0.513 2.272 -4.930 427 HG13 VAL 58 HG13 VAL 58 -1.757 1.838 -3.745 428 HG21 VAL 58 HG21 VAL 58 -2.468 -0.258 -6.752 429 HG22 VAL 58 HG22 VAL 58 -2.116 -0.334 -5.024 430 HG23 VAL 58 HG23 VAL 58 -0.860 0.162 -6.159 431 H ARG 59 H ARG 59 -3.978 3.141 -7.576 432 HA ARG 59 HA ARG 59 -5.928 1.332 -8.827 433 HB2 ARG 59 HB2 ARG 59 -6.933 3.438 -8.072 434 HB3 ARG 59 HB3 ARG 59 -5.751 4.335 -9.005 435 HG2 ARG 59 HG2 ARG 59 -6.675 3.363 -11.059 436 HG3 ARG 59 HG3 ARG 59 -7.897 2.527 -10.100 437 HD2 ARG 59 HD2 ARG 59 -8.757 4.628 -11.052 438 HD3 ARG 59 HD3 ARG 59 -8.748 4.651 -9.285 439 HE ARG 59 HE ARG 59 -6.373 5.735 -10.436 440 HH11 ARG 59 HH11 ARG 59 -9.691 6.536 -9.543 441 HH12 ARG 59 HH12 ARG 59 -9.404 8.198 -9.345 442 HH21 ARG 59 HH21 ARG 59 -5.946 8.035 -10.146 443 HH22 ARG 59 HH22 ARG 59 -7.233 9.060 -9.683 444 H ARG 60 H ARG 60 -5.401 0.575 -10.760 445 HA ARG 60 HA ARG 60 -3.719 2.102 -12.526 446 HB2 ARG 60 HB2 ARG 60 -2.147 0.332 -13.007 447 HB3 ARG 60 HB3 ARG 60 -2.103 0.675 -11.292 448 HG2 ARG 60 HG2 ARG 60 -3.382 -1.333 -10.826 449 HG3 ARG 60 HG3 ARG 60 -3.525 -1.660 -12.561 450 HD2 ARG 60 HD2 ARG 60 -1.067 -1.736 -12.710 451 HD3 ARG 60 HD3 ARG 60 -0.978 -1.519 -10.968 452 HE ARG 60 HE ARG 60 -2.511 -3.782 -11.913 453 HH11 ARG 60 HH11 ARG 60 0.486 -2.567 -10.464 454 HH12 ARG 60 HH12 ARG 60 1.173 -4.080 -10.203 455 HH21 ARG 60 HH21 ARG 60 -1.568 -5.940 -11.511 456 HH22 ARG 60 HH22 ARG 60 -0.038 -6.070 -10.770 457 H ALA 61 H ALA 61 -4.221 1.787 -14.604 458 HA ALA 61 HA ALA 61 -5.426 1.240 -16.422 459 HB1 ALA 61 HB1 ALA 61 -5.963 -1.105 -16.833 460 HB2 ALA 61 HB2 ALA 61 -5.694 -1.479 -15.129 461 HB3 ALA 61 HB3 ALA 61 -4.346 -0.955 -16.141 462 H GLY 62 H GLY 62 -6.731 2.106 -13.858 463 HA2 GLY 62 HA2 GLY 62 -8.885 2.981 -13.624 464 HA3 GLY 62 HA3 GLY 62 -9.468 1.820 -14.810 465 H GLY 63 H GLY 63 -7.592 0.039 -12.812 466 HA2 GLY 63 HA2 GLY 63 -9.959 -0.763 -11.274 467 HA3 GLY 63 HA3 GLY 63 -8.620 -1.815 -11.721 468 H VAL 64 H VAL 64 -9.840 -1.079 -9.116 469 HA VAL 64 HA VAL 64 -7.562 0.188 -7.789 470 HB VAL 64 HB VAL 64 -10.270 -0.634 -6.667 471 HG11 VAL 64 HG11 VAL 64 -9.689 0.785 -4.752 472 HG12 VAL 64 HG12 VAL 64 -8.104 1.087 -5.462 473 HG13 VAL 64 HG13 VAL 64 -8.546 -0.543 -4.954 474 HG21 VAL 64 HG21 VAL 64 -9.299 2.095 -7.508 475 HG22 VAL 64 HG22 VAL 64 -10.825 1.764 -6.686 476 HG23 VAL 64 HG23 VAL 64 -10.540 1.134 -8.308 477 H VAL 65 H VAL 65 -6.104 -1.101 -6.912 478 HA VAL 65 HA VAL 65 -6.829 -3.853 -6.276 479 HB VAL 65 HB VAL 65 -4.631 -4.575 -7.260 480 HG11 VAL 65 HG11 VAL 65 -6.727 -5.053 -8.401 481 HG12 VAL 65 HG12 VAL 65 -5.473 -4.675 -9.584 482 HG13 VAL 65 HG13 VAL 65 -6.692 -3.469 -9.175 483 HG21 VAL 65 HG21 VAL 65 -3.641 -3.163 -9.028 484 HG22 VAL 65 HG22 VAL 65 -3.547 -2.397 -7.439 485 HG23 VAL 65 HG23 VAL 65 -4.765 -1.875 -8.607 486 H ILE 66 H ILE 66 -5.440 -4.882 -4.887 487 HA ILE 66 HA ILE 66 -3.850 -3.106 -3.162 488 HB ILE 66 HB ILE 66 -5.200 -5.731 -2.392 489 HG12 ILE 66 HG12 ILE 66 -6.551 -4.238 -0.781 490 HG13 ILE 66 HG13 ILE 66 -6.014 -2.886 -1.763 491 HG21 ILE 66 HG21 ILE 66 -4.563 -5.182 -0.089 492 HG22 ILE 66 HG22 ILE 66 -3.690 -3.772 -0.687 493 HG23 ILE 66 HG23 ILE 66 -3.171 -5.392 -1.154 494 HD11 ILE 66 HD11 ILE 66 -7.176 -3.857 -3.697 495 HD12 ILE 66 HD12 ILE 66 -8.272 -3.584 -2.342 496 HD13 ILE 66 HD13 ILE 66 -7.694 -5.214 -2.696 497 HA PRO 67 HA PRO 67 -0.406 -5.570 -4.832 498 HB2 PRO 67 HB2 PRO 67 0.742 -4.499 -2.293 499 HB3 PRO 67 HB3 PRO 67 1.468 -4.538 -3.899 500 HG2 PRO 67 HG2 PRO 67 0.500 -2.269 -2.979 501 HG3 PRO 67 HG3 PRO 67 0.154 -2.741 -4.657 502 HD2 PRO 67 HD2 PRO 67 -1.618 -2.855 -2.250 503 HD3 PRO 67 HD3 PRO 67 -2.011 -2.422 -3.927 504 H GLN 68 H GLN 68 -0.188 -7.805 -4.502 505 HA GLN 68 HA GLN 68 -1.186 -9.172 -2.332 506 HB2 GLN 68 HB2 GLN 68 -0.876 -10.232 -4.420 507 HB3 GLN 68 HB3 GLN 68 0.837 -9.892 -4.426 508 HG2 GLN 68 HG2 GLN 68 1.268 -11.536 -2.763 509 HG3 GLN 68 HG3 GLN 68 -0.455 -11.734 -2.429 510 HE21 GLN 68 HE21 GLN 68 -1.278 -11.706 -5.163 511 HE22 GLN 68 HE22 GLN 68 -0.764 -13.178 -5.861 512 H VAL 69 H VAL 69 1.820 -7.618 -2.675 513 HA VAL 69 HA VAL 69 3.276 -9.042 -0.701 514 HB VAL 69 HB VAL 69 4.883 -7.156 -0.835 515 HG11 VAL 69 HG11 VAL 69 5.024 -9.004 -2.429 516 HG12 VAL 69 HG12 VAL 69 5.472 -7.481 -3.203 517 HG13 VAL 69 HG13 VAL 69 3.881 -8.184 -3.494 518 HG21 VAL 69 HG21 VAL 69 2.835 -5.983 -2.717 519 HG22 VAL 69 HG22 VAL 69 4.469 -5.369 -2.473 520 HG23 VAL 69 HG23 VAL 69 3.317 -5.332 -1.147 521 H PHE 70 H PHE 70 0.674 -6.977 -0.336 522 HA PHE 70 HA PHE 70 1.478 -5.861 2.208 523 HB2 PHE 70 HB2 PHE 70 -0.972 -5.687 0.492 524 HB3 PHE 70 HB3 PHE 70 -1.131 -5.336 2.209 525 HD1 PHE 70 HD1 PHE 70 1.514 -4.541 -0.306 526 HD2 PHE 70 HD2 PHE 70 -1.291 -3.083 2.527 527 HE1 PHE 70 HE1 PHE 70 2.345 -2.253 -0.654 528 HE2 PHE 70 HE2 PHE 70 -0.467 -0.809 2.190 529 HZ PHE 70 HZ PHE 70 1.341 -0.383 0.610 530 H PHE 71 H PHE 71 0.638 -8.762 1.151 531 HA PHE 71 HA PHE 71 -0.394 -9.602 3.739 532 HB2 PHE 71 HB2 PHE 71 -0.965 -10.773 0.991 533 HB3 PHE 71 HB3 PHE 71 -1.497 -11.473 2.513 534 HD1 PHE 71 HD1 PHE 71 -1.927 -8.627 0.206 535 HD2 PHE 71 HD2 PHE 71 -3.413 -10.635 3.644 536 HE1 PHE 71 HE1 PHE 71 -3.976 -7.285 0.097 537 HE2 PHE 71 HE2 PHE 71 -5.465 -9.289 3.544 538 HZ PHE 71 HZ PHE 71 -5.749 -7.612 1.769 539 H THR 72 H THR 72 0.390 -11.742 4.250 540 HA THR 72 HA THR 72 3.134 -12.065 3.361 541 HB THR 72 HB THR 72 3.280 -13.698 5.239 542 HG1 THR 72 HG1 THR 72 0.648 -12.855 5.872 543 HG21 THR 72 HG21 THR 72 3.774 -11.333 5.711 544 HG22 THR 72 HG22 THR 72 2.989 -12.098 7.091 545 HG23 THR 72 HG23 THR 72 2.064 -11.041 6.025 546 H ASN 73 H ASN 73 3.869 -14.274 2.867 547 HA ASN 73 HA ASN 73 2.275 -15.584 0.950 548 HB2 ASN 73 HB2 ASN 73 4.042 -17.237 0.810 549 HB3 ASN 73 HB3 ASN 73 4.792 -15.668 1.042 550 HD21 ASN 73 HD21 ASN 73 4.235 -18.787 2.385 551 HD22 ASN 73 HD22 ASN 73 5.264 -18.628 3.757 552 H SER 74 H SER 74 2.270 -15.743 4.331 553 HA SER 74 HA SER 74 1.354 -18.418 4.678 554 HB2 SER 74 HB2 SER 74 1.129 -16.112 6.596 555 HB3 SER 74 HB3 SER 74 1.266 -17.829 6.967 556 HG SER 74 HG SER 74 3.206 -16.266 7.009 557 H GLY 75 H GLY 75 -0.177 -15.754 3.342 558 HA2 GLY 75 HA2 GLY 75 -2.388 -15.528 2.711 559 HA3 GLY 75 HA3 GLY 75 -2.775 -16.942 3.683 560 H GLN 76 H GLN 76 -1.029 -14.351 5.076 561 HA GLN 76 HA GLN 76 -3.425 -13.430 6.529 562 HB2 GLN 76 HB2 GLN 76 -1.953 -14.863 7.934 563 HB3 GLN 76 HB3 GLN 76 -0.603 -13.807 7.577 564 HG2 GLN 76 HG2 GLN 76 -1.842 -11.963 8.717 565 HG3 GLN 76 HG3 GLN 76 -3.063 -13.150 9.181 566 HE21 GLN 76 HE21 GLN 76 -2.647 -12.846 11.378 567 HE22 GLN 76 HE22 GLN 76 -1.224 -13.459 12.129 568 H VAL 77 H VAL 77 -3.440 -11.154 6.852 569 HA VAL 77 HA VAL 77 -1.841 -9.608 5.058 570 HB VAL 77 HB VAL 77 -4.188 -8.988 5.820 571 HG11 VAL 77 HG11 VAL 77 -4.477 -7.780 7.922 572 HG12 VAL 77 HG12 VAL 77 -2.799 -8.158 8.329 573 HG13 VAL 77 HG13 VAL 77 -3.975 -9.464 8.168 574 HG21 VAL 77 HG21 VAL 77 -2.822 -7.322 4.678 575 HG22 VAL 77 HG22 VAL 77 -2.086 -6.858 6.212 576 HG23 VAL 77 HG23 VAL 77 -3.800 -6.555 5.935 577 H VAL 78 H VAL 78 -0.230 -7.949 5.753 578 HA VAL 78 HA VAL 78 1.466 -8.974 7.805 579 HB VAL 78 HB VAL 78 1.528 -6.260 6.552 580 HG11 VAL 78 HG11 VAL 78 3.948 -6.253 7.170 581 HG12 VAL 78 HG12 VAL 78 3.713 -7.806 7.971 582 HG13 VAL 78 HG13 VAL 78 2.889 -6.369 8.575 583 HG21 VAL 78 HG21 VAL 78 1.670 -7.931 4.819 584 HG22 VAL 78 HG22 VAL 78 2.995 -8.738 5.670 585 HG23 VAL 78 HG23 VAL 78 3.215 -7.106 5.017 586 H LYS 79 H LYS 79 1.010 -8.830 9.768 587 HA LYS 79 HA LYS 79 -1.035 -7.410 10.939 588 HB2 LYS 79 HB2 LYS 79 -0.009 -8.097 13.135 589 HB3 LYS 79 HB3 LYS 79 -0.355 -9.381 11.986 590 HG2 LYS 79 HG2 LYS 79 1.967 -9.278 11.260 591 HG3 LYS 79 HG3 LYS 79 2.292 -8.126 12.558 592 HD2 LYS 79 HD2 LYS 79 1.601 -9.786 14.222 593 HD3 LYS 79 HD3 LYS 79 1.212 -10.930 12.941 594 HE2 LYS 79 HE2 LYS 79 3.608 -10.869 12.245 595 HE3 LYS 79 HE3 LYS 79 3.942 -9.851 13.643 596 HZ1 LYS 79 HZ1 LYS 79 3.165 -11.655 15.077 597 HZ2 LYS 79 HZ2 LYS 79 4.422 -12.181 14.088 598 HZ3 LYS 79 HZ3 LYS 79 2.850 -12.605 13.720 599 H SER 80 H SER 80 2.319 -6.419 10.723 600 HA SER 80 HA SER 80 1.841 -4.152 12.476 601 HB2 SER 80 HB2 SER 80 4.333 -4.922 10.951 602 HB3 SER 80 HB3 SER 80 4.228 -3.756 12.268 603 HG SER 80 HG SER 80 4.929 -5.655 13.111 604 H LEU 81 H LEU 81 1.219 -4.771 9.311 605 HA LEU 81 HA LEU 81 2.304 -2.532 8.040 606 HB2 LEU 81 HB2 LEU 81 1.881 -4.468 6.852 607 HB3 LEU 81 HB3 LEU 81 0.157 -4.454 7.188 608 HG LEU 81 HG LEU 81 1.530 -2.357 5.494 609 HD11 LEU 81 HD11 LEU 81 0.336 -5.002 4.698 610 HD12 LEU 81 HD12 LEU 81 2.045 -4.575 4.622 611 HD13 LEU 81 HD13 LEU 81 0.879 -3.753 3.581 612 HD21 LEU 81 HD21 LEU 81 -0.776 -1.876 6.260 613 HD22 LEU 81 HD22 LEU 81 -1.315 -3.401 5.557 614 HD23 LEU 81 HD23 LEU 81 -0.698 -2.116 4.513 615 HA PRO 82 HA PRO 82 -2.235 -0.566 8.506 616 HB2 PRO 82 HB2 PRO 82 -3.165 -1.169 11.091 617 HB3 PRO 82 HB3 PRO 82 -3.836 -1.793 9.583 618 HG2 PRO 82 HG2 PRO 82 -1.889 -3.055 11.459 619 HG3 PRO 82 HG3 PRO 82 -3.213 -3.801 10.544 620 HD2 PRO 82 HD2 PRO 82 -0.681 -4.078 9.762 621 HD3 PRO 82 HD3 PRO 82 -1.974 -3.835 8.562 622 H GLY 83 H GLY 83 0.084 -1.283 11.006 623 HA2 GLY 83 HA2 GLY 83 -0.109 1.081 12.538 624 HA3 GLY 83 HA3 GLY 83 1.285 0.009 12.476 625 H LEU 84 H LEU 84 1.812 0.256 9.665 626 HA LEU 84 HA LEU 84 3.267 2.695 9.737 627 HB2 LEU 84 HB2 LEU 84 4.227 2.135 7.617 628 HB3 LEU 84 HB3 LEU 84 4.056 0.631 8.480 629 HG LEU 84 HG LEU 84 1.835 0.470 7.088 630 HD11 LEU 84 HD11 LEU 84 3.534 2.226 5.308 631 HD12 LEU 84 HD12 LEU 84 1.976 2.645 6.012 632 HD13 LEU 84 HD13 LEU 84 2.071 1.379 4.803 633 HD21 LEU 84 HD21 LEU 84 3.630 -1.164 6.991 634 HD22 LEU 84 HD22 LEU 84 4.572 -0.106 5.941 635 HD23 LEU 84 HD23 LEU 84 3.066 -0.806 5.361 636 H LEU 85 H LEU 85 0.333 1.640 8.200 637 HA LEU 85 HA LEU 85 -0.164 3.944 6.667 638 HB2 LEU 85 HB2 LEU 85 -2.138 2.053 7.938 639 HB3 LEU 85 HB3 LEU 85 -2.527 3.222 6.695 640 HG LEU 85 HG LEU 85 -0.656 0.883 6.341 641 HD11 LEU 85 HD11 LEU 85 -3.470 1.319 5.367 642 HD12 LEU 85 HD12 LEU 85 -2.972 0.194 6.626 643 HD13 LEU 85 HD13 LEU 85 -2.434 -0.050 4.963 644 HD21 LEU 85 HD21 LEU 85 -0.069 2.767 4.905 645 HD22 LEU 85 HD22 LEU 85 -1.744 2.886 4.364 646 HD23 LEU 85 HD23 LEU 85 -0.785 1.463 3.961 647 H THR 86 H THR 86 -0.669 3.189 9.973 648 HA THR 86 HA THR 86 -2.385 5.318 10.695 649 HB THR 86 HB THR 86 -0.288 4.039 12.484 650 HG1 THR 86 HG1 THR 86 -2.147 2.768 11.203 651 HG21 THR 86 HG21 THR 86 -2.987 5.256 13.108 652 HG22 THR 86 HG22 THR 86 -1.426 6.024 13.403 653 HG23 THR 86 HG23 THR 86 -1.868 4.553 14.274 654 H ILE 87 H ILE 87 1.193 5.052 10.849 655 HA ILE 87 HA ILE 87 1.485 7.706 11.736 656 HB ILE 87 HB ILE 87 3.201 6.163 12.362 657 HG12 ILE 87 HG12 ILE 87 3.982 8.533 11.857 658 HG13 ILE 87 HG13 ILE 87 5.234 7.314 11.994 659 HG21 ILE 87 HG21 ILE 87 4.773 5.074 10.844 660 HG22 ILE 87 HG22 ILE 87 3.784 5.633 9.492 661 HG23 ILE 87 HG23 ILE 87 3.098 4.539 10.689 662 HD11 ILE 87 HD11 ILE 87 4.141 8.448 9.419 663 HD12 ILE 87 HD12 ILE 87 5.445 7.268 9.546 664 HD13 ILE 87 HD13 ILE 87 5.669 8.905 10.172 665 H LEU 88 H LEU 88 1.615 6.319 8.502 666 HA LEU 88 HA LEU 88 2.303 8.793 7.310 667 HB2 LEU 88 HB2 LEU 88 1.118 6.323 6.120 668 HB3 LEU 88 HB3 LEU 88 1.254 7.789 5.180 669 HG LEU 88 HG LEU 88 3.081 6.453 4.586 670 HD11 LEU 88 HD11 LEU 88 3.669 8.773 4.857 671 HD12 LEU 88 HD12 LEU 88 5.029 7.713 5.197 672 HD13 LEU 88 HD13 LEU 88 4.163 8.472 6.527 673 HD21 LEU 88 HD21 LEU 88 4.625 5.433 6.075 674 HD22 LEU 88 HD22 LEU 88 3.001 4.914 6.487 675 HD23 LEU 88 HD23 LEU 88 3.812 6.135 7.479 676 H HIS 89 H HIS 89 -0.791 7.416 8.131 677 HA HIS 89 HA HIS 89 -2.396 9.338 6.847 678 HB2 HIS 89 HB2 HIS 89 -3.392 7.310 7.823 679 HB3 HIS 89 HB3 HIS 89 -2.908 7.824 9.432 680 HD1 HIS 89 HD1 HIS 89 -4.657 9.138 10.732 681 HD2 HIS 89 HD2 HIS 89 -5.411 9.089 6.642 682 HE1 HIS 89 HE1 HIS 89 -6.855 10.298 10.417 683 H ASP 90 H ASP 90 -0.801 9.307 9.984 684 HA ASP 90 HA ASP 90 -1.802 11.775 10.950 685 HB2 ASP 90 HB2 ASP 90 -0.735 10.184 12.455 686 HB3 ASP 90 HB3 ASP 90 0.781 10.322 11.575 687 H GLY 91 H GLY 91 0.849 10.939 8.848 688 HA2 GLY 91 HA2 GLY 91 1.925 13.638 8.880 689 HA3 GLY 91 HA3 GLY 91 2.564 12.277 7.971 690 H GLY 92 H GLY 92 -0.455 12.003 7.213 691 HA2 GLY 92 HA2 GLY 92 -1.914 12.766 5.635 692 HA3 GLY 92 HA3 GLY 92 -0.981 14.250 5.530 693 H TYR 93 H TYR 93 -0.165 10.848 4.845 694 HA TYR 93 HA TYR 93 0.603 11.763 2.166 695 HB2 TYR 93 HB2 TYR 93 1.729 9.515 3.829 696 HB3 TYR 93 HB3 TYR 93 2.079 9.678 2.117 697 HD1 TYR 93 HD1 TYR 93 2.601 11.147 5.441 698 HD2 TYR 93 HD2 TYR 93 3.541 11.438 1.306 699 HE1 TYR 93 HE1 TYR 93 4.393 12.717 5.970 700 HE2 TYR 93 HE2 TYR 93 5.359 13.012 1.821 701 HH TYR 93 HH TYR 93 6.677 13.355 4.757 702 H ARG 94 H ARG 94 -0.095 10.771 0.389 703 HA ARG 94 HA ARG 94 -2.476 9.174 0.676 704 HB2 ARG 94 HB2 ARG 94 -2.805 9.432 -1.702 705 HB3 ARG 94 HB3 ARG 94 -2.358 10.982 -1.003 706 HG2 ARG 94 HG2 ARG 94 -0.104 10.752 -1.852 707 HG3 ARG 94 HG3 ARG 94 -0.482 9.142 -2.467 708 HD2 ARG 94 HD2 ARG 94 -0.548 10.797 -4.251 709 HD3 ARG 94 HD3 ARG 94 -2.144 10.104 -3.977 710 HE ARG 94 HE ARG 94 -2.590 12.161 -2.631 711 HH11 ARG 94 HH11 ARG 94 -0.318 12.203 -5.363 712 HH12 ARG 94 HH12 ARG 94 -0.485 13.884 -5.623 713 HH21 ARG 94 HH21 ARG 94 -2.832 14.430 -3.048 714 HH22 ARG 94 HH22 ARG 94 -1.898 15.174 -4.267 715 H ASP 95 H ASP 95 -2.784 7.414 -1.032 716 HA ASP 95 HA ASP 95 -1.503 5.095 -0.225 717 HB2 ASP 95 HB2 ASP 95 -2.709 4.060 -2.100 718 HB3 ASP 95 HB3 ASP 95 -3.741 5.204 -1.249 719 H THR 96 H THR 96 -1.069 6.977 -3.168 720 HA THR 96 HA THR 96 0.813 5.358 -4.406 721 HB THR 96 HB THR 96 0.541 8.363 -4.712 722 HG1 THR 96 HG1 THR 96 -1.199 6.279 -5.229 723 HG21 THR 96 HG21 THR 96 1.304 6.165 -6.651 724 HG22 THR 96 HG22 THR 96 2.443 7.279 -5.896 725 HG23 THR 96 HG23 THR 96 1.225 7.890 -7.018 726 H GLU 97 H GLU 97 1.159 8.005 -2.133 727 HA GLU 97 HA GLU 97 3.963 8.254 -2.252 728 HB2 GLU 97 HB2 GLU 97 1.931 9.050 -0.191 729 HB3 GLU 97 HB3 GLU 97 3.655 9.305 0.058 730 HG2 GLU 97 HG2 GLU 97 2.108 10.365 -2.286 731 HG3 GLU 97 HG3 GLU 97 2.457 11.280 -0.813 732 H ILE 98 H ILE 98 1.802 6.280 -0.306 733 HA ILE 98 HA ILE 98 3.687 5.303 1.549 734 HB ILE 98 HB ILE 98 1.459 3.592 0.419 735 HG12 ILE 98 HG12 ILE 98 0.322 5.677 0.954 736 HG13 ILE 98 HG13 ILE 98 -0.013 4.469 2.202 737 HG21 ILE 98 HG21 ILE 98 2.672 3.763 3.155 738 HG22 ILE 98 HG22 ILE 98 2.986 2.516 1.950 739 HG23 ILE 98 HG23 ILE 98 1.380 2.661 2.676 740 HD11 ILE 98 HD11 ILE 98 0.342 6.694 3.114 741 HD12 ILE 98 HD12 ILE 98 1.980 6.692 2.455 742 HD13 ILE 98 HD13 ILE 98 1.515 5.511 3.690 743 H MET 99 H MET 99 2.580 4.140 -1.560 744 HA MET 99 HA MET 99 4.135 1.778 -1.643 745 HB2 MET 99 HB2 MET 99 3.021 3.298 -3.994 746 HB3 MET 99 HB3 MET 99 3.513 1.615 -3.955 747 HG2 MET 99 HG2 MET 99 1.186 2.817 -2.482 748 HG3 MET 99 HG3 MET 99 1.126 1.862 -3.957 749 HE1 MET 99 HE1 MET 99 -0.702 0.287 -2.844 750 HE2 MET 99 HE2 MET 99 -0.618 1.322 -1.411 751 HE3 MET 99 HE3 MET 99 -0.491 -0.429 -1.250 752 H ARG 100 H ARG 100 4.860 5.135 -2.441 753 HA ARG 100 HA ARG 100 6.727 4.856 -4.400 754 HB2 ARG 100 HB2 ARG 100 5.848 6.980 -3.861 755 HB3 ARG 100 HB3 ARG 100 6.409 6.872 -2.202 756 HG2 ARG 100 HG2 ARG 100 8.645 7.176 -2.836 757 HG3 ARG 100 HG3 ARG 100 8.268 6.912 -4.539 758 HD2 ARG 100 HD2 ARG 100 8.593 9.270 -4.116 759 HD3 ARG 100 HD3 ARG 100 6.911 8.856 -4.537 760 HE ARG 100 HE ARG 100 6.210 9.574 -2.553 761 HH11 ARG 100 HH11 ARG 100 9.746 9.295 -2.209 762 HH12 ARG 100 HH12 ARG 100 9.876 10.539 -1.068 763 HH21 ARG 100 HH21 ARG 100 6.409 11.316 -1.017 764 HH22 ARG 100 HH22 ARG 100 7.934 11.747 -0.367 765 H TRP 101 H TRP 101 7.619 5.447 -1.038 766 HA TRP 101 HA TRP 101 10.255 4.572 -1.532 767 HB2 TRP 101 HB2 TRP 101 10.301 4.687 1.134 768 HB3 TRP 101 HB3 TRP 101 10.344 6.134 0.127 769 HD1 TRP 101 HD1 TRP 101 8.302 7.725 0.180 770 HE1 TRP 101 HE1 TRP 101 6.211 7.864 1.588 771 HE3 TRP 101 HE3 TRP 101 8.607 3.161 2.430 772 HZ2 TRP 101 HZ2 TRP 101 4.839 6.239 3.481 773 HZ3 TRP 101 HZ3 TRP 101 6.865 2.518 4.015 774 HH2 TRP 101 HH2 TRP 101 5.020 4.027 4.547 775 H LEU 102 H LEU 102 7.429 2.974 -0.347 776 HA LEU 102 HA LEU 102 8.538 0.735 0.862 777 HB2 LEU 102 HB2 LEU 102 6.016 1.282 -0.565 778 HB3 LEU 102 HB3 LEU 102 6.386 -0.402 -0.248 779 HG LEU 102 HG LEU 102 5.979 1.812 1.772 780 HD11 LEU 102 HD11 LEU 102 4.334 -0.620 1.065 781 HD12 LEU 102 HD12 LEU 102 3.936 1.045 0.650 782 HD13 LEU 102 HD13 LEU 102 3.968 0.543 2.339 783 HD21 LEU 102 HD21 LEU 102 7.597 0.247 2.625 784 HD22 LEU 102 HD22 LEU 102 6.587 -1.105 2.096 785 HD23 LEU 102 HD23 LEU 102 6.037 -0.050 3.399 786 H PHE 103 H PHE 103 7.950 1.366 -2.558 787 HA PHE 103 HA PHE 103 9.086 -1.244 -3.155 788 HB2 PHE 103 HB2 PHE 103 7.412 0.602 -4.836 789 HB3 PHE 103 HB3 PHE 103 8.165 -0.863 -5.455 790 HD1 PHE 103 HD1 PHE 103 7.413 -3.032 -4.767 791 HD2 PHE 103 HD2 PHE 103 5.550 0.481 -3.272 792 HE1 PHE 103 HE1 PHE 103 5.520 -4.367 -3.983 793 HE2 PHE 103 HE2 PHE 103 3.648 -0.842 -2.497 794 HZ PHE 103 HZ PHE 103 3.620 -3.264 -2.852 795 H THR 104 H THR 104 10.247 1.731 -2.801 796 HA THR 104 HA THR 104 12.092 1.574 -5.030 797 HB THR 104 HB THR 104 11.963 3.565 -2.737 798 HG1 THR 104 HG1 THR 104 10.185 3.696 -4.202 799 HG21 THR 104 HG21 THR 104 14.226 3.368 -3.715 800 HG22 THR 104 HG22 THR 104 13.491 4.926 -4.100 801 HG23 THR 104 HG23 THR 104 13.545 3.655 -5.318 802 HA PRO 105 HA PRO 105 14.818 -0.889 -2.305 803 HB2 PRO 105 HB2 PRO 105 16.517 -0.743 -4.737 804 HB3 PRO 105 HB3 PRO 105 16.016 -2.170 -3.822 805 HG2 PRO 105 HG2 PRO 105 14.969 -1.670 -6.222 806 HG3 PRO 105 HG3 PRO 105 13.965 -2.302 -4.906 807 HD2 PRO 105 HD2 PRO 105 14.185 0.499 -5.937 808 HD3 PRO 105 HD3 PRO 105 12.742 -0.422 -5.467 809 H ASP 106 H ASP 106 16.259 0.103 -0.995 810 HA ASP 106 HA ASP 106 17.089 2.771 -1.824 811 HB2 ASP 106 HB2 ASP 106 15.818 2.602 0.262 812 HB3 ASP 106 HB3 ASP 106 17.053 1.537 0.920 813 HA PRO 107 HA PRO 107 21.198 1.339 -2.557 814 HB2 PRO 107 HB2 PRO 107 22.425 3.805 -2.513 815 HB3 PRO 107 HB3 PRO 107 21.582 3.129 -3.908 816 HG2 PRO 107 HG2 PRO 107 20.607 5.086 -1.875 817 HG3 PRO 107 HG3 PRO 107 20.351 5.073 -3.629 818 HD2 PRO 107 HD2 PRO 107 18.451 4.276 -1.922 819 HD3 PRO 107 HD3 PRO 107 18.671 3.482 -3.497 820 H SER 108 H SER 108 20.274 3.018 0.356 821 HA SER 108 HA SER 108 22.888 2.358 1.487 822 HB2 SER 108 HB2 SER 108 22.293 4.794 1.408 823 HB3 SER 108 HB3 SER 108 20.912 4.448 2.447 824 HG SER 108 HG SER 108 23.290 3.466 3.353 825 H LEU 109 H LEU 109 20.013 0.990 1.189 826 HA LEU 109 HA LEU 109 19.781 0.391 4.018 827 HB2 LEU 109 HB2 LEU 109 17.753 1.293 3.028 828 HB3 LEU 109 HB3 LEU 109 17.771 -0.016 1.848 829 HG LEU 109 HG LEU 109 17.430 -1.650 3.571 830 HD11 LEU 109 HD11 LEU 109 18.585 -0.527 5.412 831 HD12 LEU 109 HD12 LEU 109 16.965 -1.021 5.867 832 HD13 LEU 109 HD13 LEU 109 17.288 0.673 5.492 833 HD21 LEU 109 HD21 LEU 109 15.471 0.617 3.735 834 HD22 LEU 109 HD22 LEU 109 15.168 -1.058 4.211 835 HD23 LEU 109 HD23 LEU 109 15.492 -0.670 2.516 836 H THR 110 H THR 110 20.487 -1.372 4.692 837 HA THR 110 HA THR 110 20.615 -3.691 2.923 838 HB THR 110 HB THR 110 22.492 -2.953 5.182 839 HG1 THR 110 HG1 THR 110 22.407 -2.276 2.550 840 HG21 THR 110 HG21 THR 110 23.836 -4.851 4.379 841 HG22 THR 110 HG22 THR 110 22.610 -5.208 3.162 842 HG23 THR 110 HG23 THR 110 22.227 -5.374 4.875 843 H ILE 111 H ILE 111 19.292 -5.167 3.515 844 HA ILE 111 HA ILE 111 18.285 -5.240 6.270 845 HB ILE 111 HB ILE 111 16.998 -5.754 3.633 846 HG12 ILE 111 HG12 ILE 111 17.129 -3.436 4.343 847 HG13 ILE 111 HG13 ILE 111 15.465 -3.981 4.183 848 HG21 ILE 111 HG21 ILE 111 15.750 -6.291 6.284 849 HG22 ILE 111 HG22 ILE 111 16.294 -7.472 5.092 850 HG23 ILE 111 HG23 ILE 111 14.950 -6.370 4.691 851 HD11 ILE 111 HD11 ILE 111 15.443 -4.287 6.680 852 HD12 ILE 111 HD12 ILE 111 15.654 -2.620 6.145 853 HD13 ILE 111 HD13 ILE 111 17.042 -3.535 6.720 854 H THR 112 H THR 112 17.967 -7.207 7.073 855 HA THR 112 HA THR 112 19.330 -9.423 5.787 856 HB THR 112 HB THR 112 18.900 -10.411 8.191 857 HG1 THR 112 HG1 THR 112 19.175 -7.826 9.101 858 HG21 THR 112 HG21 THR 112 20.801 -8.182 7.597 859 HG22 THR 112 HG22 THR 112 21.090 -9.889 7.286 860 HG23 THR 112 HG23 THR 112 20.986 -9.301 8.960 861 H ARG 113 H ARG 113 18.135 -11.016 4.915 862 HA ARG 113 HA ARG 113 15.288 -10.746 5.104 863 HB2 ARG 113 HB2 ARG 113 17.045 -12.480 3.403 864 HB3 ARG 113 HB3 ARG 113 15.302 -12.710 3.469 865 HG2 ARG 113 HG2 ARG 113 15.006 -10.363 2.753 866 HG3 ARG 113 HG3 ARG 113 16.758 -10.226 2.608 867 HD2 ARG 113 HD2 ARG 113 16.837 -11.836 0.871 868 HD3 ARG 113 HD3 ARG 113 15.170 -12.321 1.174 869 HE ARG 113 HE ARG 113 14.732 -9.857 0.540 870 HH11 ARG 113 HH11 ARG 113 17.239 -11.852 -0.984 871 HH12 ARG 113 HH12 ARG 113 16.858 -11.330 -2.560 872 HH21 ARG 113 HH21 ARG 113 14.184 -9.245 -1.606 873 HH22 ARG 113 HH22 ARG 113 15.098 -9.786 -2.951 874 H ASP 114 H ASP 114 13.968 -12.757 5.211 875 HA ASP 114 HA ASP 114 14.201 -13.773 7.810 876 HB2 ASP 114 HB2 ASP 114 12.039 -13.547 6.646 877 HB3 ASP 114 HB3 ASP 114 12.512 -14.827 5.534 878 H GLY 115 H GLY 115 15.553 -15.170 8.506 879 HA2 GLY 115 HA2 GLY 115 16.681 -17.262 8.498 880 HA3 GLY 115 HA3 GLY 115 16.497 -17.312 6.736 881 H SER 116 H SER 116 17.871 -15.263 9.256 882 HA SER 116 HA SER 116 19.433 -13.785 7.443 883 HB2 SER 116 HB2 SER 116 19.551 -13.892 10.452 884 HB3 SER 116 HB3 SER 116 20.383 -12.705 9.444 885 HG SER 116 HG SER 116 17.695 -12.988 8.891 886 H ARG 117 H ARG 117 20.578 -15.213 6.329 887 HA ARG 117 HA ARG 117 22.894 -16.514 7.580 888 HB2 ARG 117 HB2 ARG 117 23.240 -17.500 5.321 889 HB3 ARG 117 HB3 ARG 117 21.644 -17.853 5.971 890 HG2 ARG 117 HG2 ARG 117 20.644 -16.158 4.578 891 HG3 ARG 117 HG3 ARG 117 22.227 -15.635 4.026 892 HD2 ARG 117 HD2 ARG 117 22.560 -17.777 2.930 893 HD3 ARG 117 HD3 ARG 117 20.984 -18.333 3.511 894 HE ARG 117 HE ARG 117 20.269 -16.134 2.246 895 HH11 ARG 117 HH11 ARG 117 22.458 -18.672 1.096 896 HH12 ARG 117 HH12 ARG 117 22.061 -18.413 -0.551 897 HH21 ARG 117 HH21 ARG 117 19.772 -15.801 0.048 898 HH22 ARG 117 HH22 ARG 117 20.514 -16.746 -1.156 899 H ASP 118 H ASP 118 21.939 -13.775 5.700 900 HA ASP 118 HA ASP 118 24.519 -12.590 5.623 901 HB2 ASP 118 HB2 ASP 118 24.760 -14.156 3.733 902 HB3 ASP 118 HB3 ASP 118 23.233 -13.614 3.064 903 H ALA 119 H ALA 119 24.277 -10.408 4.728 904 HA ALA 119 HA ALA 119 21.536 -9.442 5.057 905 HB1 ALA 119 HB1 ALA 119 24.147 -7.931 5.158 906 HB2 ALA 119 HB2 ALA 119 23.227 -8.491 6.555 907 HB3 ALA 119 HB3 ALA 119 22.545 -7.270 5.486 908 H VAL 120 H VAL 120 20.562 -8.228 3.465 909 HA VAL 120 HA VAL 120 21.874 -8.411 0.857 910 HB VAL 120 HB VAL 120 18.937 -8.053 1.523 911 HG11 VAL 120 HG11 VAL 120 18.548 -8.625 -0.829 912 HG12 VAL 120 HG12 VAL 120 20.290 -8.678 -1.096 913 HG13 VAL 120 HG13 VAL 120 19.514 -7.159 -0.656 914 HG21 VAL 120 HG21 VAL 120 19.689 -10.240 2.270 915 HG22 VAL 120 HG22 VAL 120 20.414 -10.547 0.690 916 HG23 VAL 120 HG23 VAL 120 18.661 -10.406 0.842 917 H SER 121 H SER 121 22.685 -6.549 0.171 918 HA SER 121 HA SER 121 21.877 -4.046 1.322 919 HB2 SER 121 HB2 SER 121 23.824 -4.608 -0.927 920 HB3 SER 121 HB3 SER 121 23.732 -3.147 0.052 921 HG SER 121 HG SER 121 24.936 -5.520 0.556 922 H ASN 122 H ASN 122 20.942 -2.337 0.153 923 HA ASN 122 HA ASN 122 19.699 -1.249 -1.336 924 HB2 ASN 122 HB2 ASN 122 21.461 -1.942 -2.983 925 HB3 ASN 122 HB3 ASN 122 20.544 -3.391 -3.332 926 HD21 ASN 122 HD21 ASN 122 20.703 0.025 -3.708 927 HD22 ASN 122 HD22 ASN 122 19.560 0.186 -4.993 928 H ALA 123 H ALA 123 18.492 -3.000 0.465 929 HA ALA 123 HA ALA 123 16.556 -4.539 -0.989 930 HB1 ALA 123 HB1 ALA 123 16.791 -3.938 1.955 931 HB2 ALA 123 HB2 ALA 123 17.449 -5.355 1.138 932 HB3 ALA 123 HB3 ALA 123 15.705 -5.118 1.223 933 H ARG 124 H ARG 124 14.298 -4.169 -0.766 934 HA ARG 124 HA ARG 124 13.665 -1.347 -0.428 935 HB2 ARG 124 HB2 ARG 124 11.570 -1.708 -1.719 936 HB3 ARG 124 HB3 ARG 124 12.987 -2.107 -2.660 937 HG2 ARG 124 HG2 ARG 124 11.332 -4.205 -1.271 938 HG3 ARG 124 HG3 ARG 124 10.936 -3.609 -2.878 939 HD2 ARG 124 HD2 ARG 124 13.158 -4.329 -3.669 940 HD3 ARG 124 HD3 ARG 124 13.525 -4.934 -2.061 941 HE ARG 124 HE ARG 124 11.164 -6.115 -2.838 942 HH11 ARG 124 HH11 ARG 124 14.484 -6.074 -4.010 943 HH12 ARG 124 HH12 ARG 124 14.480 -7.690 -4.548 944 HH21 ARG 124 HH21 ARG 124 11.143 -8.348 -3.591 945 HH22 ARG 124 HH22 ARG 124 12.541 -9.016 -4.279 946 HA PRO 125 HA PRO 125 11.708 -1.905 3.424 947 HB2 PRO 125 HB2 PRO 125 9.455 -0.374 2.237 948 HB3 PRO 125 HB3 PRO 125 10.275 -0.132 3.784 949 HG2 PRO 125 HG2 PRO 125 10.851 1.461 1.763 950 HG3 PRO 125 HG3 PRO 125 12.156 0.828 2.785 951 HD2 PRO 125 HD2 PRO 125 11.339 0.010 0.032 952 HD3 PRO 125 HD3 PRO 125 12.959 0.117 0.753 953 H VAL 126 H VAL 126 9.569 -2.540 0.615 954 HA VAL 126 HA VAL 126 7.630 -3.986 2.082 955 HB VAL 126 HB VAL 126 8.389 -4.302 -0.842 956 HG11 VAL 126 HG11 VAL 126 6.214 -5.387 -1.119 957 HG12 VAL 126 HG12 VAL 126 5.936 -5.288 0.621 958 HG13 VAL 126 HG13 VAL 126 7.231 -6.305 -0.007 959 HG21 VAL 126 HG21 VAL 126 6.400 -2.958 -1.251 960 HG22 VAL 126 HG22 VAL 126 7.586 -2.109 -0.259 961 HG23 VAL 126 HG23 VAL 126 6.147 -2.813 0.492 962 H ASP 127 H ASP 127 10.592 -4.973 0.563 963 HA ASP 127 HA ASP 127 10.329 -7.780 0.898 964 HB2 ASP 127 HB2 ASP 127 11.987 -6.539 -0.593 965 HB3 ASP 127 HB3 ASP 127 12.911 -6.198 0.862 966 H ALA 128 H ALA 128 11.595 -5.175 2.782 967 HA ALA 128 HA ALA 128 12.721 -6.652 4.901 968 HB1 ALA 128 HB1 ALA 128 11.713 -3.817 4.926 969 HB2 ALA 128 HB2 ALA 128 13.311 -4.326 4.385 970 HB3 ALA 128 HB3 ALA 128 12.844 -4.531 6.076 971 H LEU 129 H LEU 129 9.510 -5.137 4.535 972 HA LEU 129 HA LEU 129 8.728 -5.781 7.185 973 HB2 LEU 129 HB2 LEU 129 6.458 -5.138 6.558 974 HB3 LEU 129 HB3 LEU 129 7.626 -3.943 6.062 975 HG LEU 129 HG LEU 129 7.471 -5.227 3.790 976 HD11 LEU 129 HD11 LEU 129 5.218 -6.057 3.309 977 HD12 LEU 129 HD12 LEU 129 4.804 -5.803 5.013 978 HD13 LEU 129 HD13 LEU 129 6.048 -6.977 4.581 979 HD21 LEU 129 HD21 LEU 129 6.937 -2.874 4.065 980 HD22 LEU 129 HD22 LEU 129 5.375 -3.287 4.770 981 HD23 LEU 129 HD23 LEU 129 5.695 -3.648 3.077 982 H HIS 130 H HIS 130 8.387 -7.532 4.174 983 HA HIS 130 HA HIS 130 6.713 -9.554 5.306 984 HB2 HIS 130 HB2 HIS 130 6.878 -9.051 2.831 985 HB3 HIS 130 HB3 HIS 130 8.488 -9.759 2.842 986 HD1 HIS 130 HD1 HIS 130 8.369 -12.082 1.835 987 HD2 HIS 130 HD2 HIS 130 4.985 -11.133 4.052 988 HE1 HIS 130 HE1 HIS 130 6.887 -14.115 1.753 989 H ALA 131 H ALA 131 9.944 -8.789 5.474 990 HA ALA 131 HA ALA 131 10.784 -11.466 6.350 991 HB1 ALA 131 HB1 ALA 131 12.439 -8.952 6.073 992 HB2 ALA 131 HB2 ALA 131 12.316 -10.234 4.868 993 HB3 ALA 131 HB3 ALA 131 13.056 -10.560 6.435 994 H HIS 132 H HIS 132 9.144 -9.095 7.703 995 HA HIS 132 HA HIS 132 8.667 -8.340 9.724 996 HB2 HIS 132 HB2 HIS 132 10.180 -10.803 10.601 997 HB3 HIS 132 HB3 HIS 132 9.375 -9.732 11.744 998 HD1 HIS 132 HD1 HIS 132 8.711 -12.697 9.757 999 HD2 HIS 132 HD2 HIS 132 6.506 -9.426 11.068 1000 HE1 HIS 132 HE1 HIS 132 6.300 -13.358 9.574 1001 H GLN 133 H GLN 133 10.933 -7.376 8.365 1002 HA GLN 133 HA GLN 133 12.564 -6.252 10.534 1003 HB2 GLN 133 HB2 GLN 133 12.918 -6.027 7.527 1004 HB3 GLN 133 HB3 GLN 133 14.066 -5.496 8.749 1005 HG2 GLN 133 HG2 GLN 133 13.261 -8.329 8.148 1006 HG3 GLN 133 HG3 GLN 133 14.785 -7.567 7.713 1007 HE21 GLN 133 HE21 GLN 133 16.300 -7.231 9.300 1008 HE22 GLN 133 HE22 GLN 133 16.203 -7.987 10.846 1009 H ALA 134 H ALA 134 9.816 -5.742 9.910 1010 HA ALA 134 HA ALA 134 9.147 -3.509 8.427 1011 HB1 ALA 134 HB1 ALA 134 7.522 -5.121 9.316 1012 HB2 ALA 134 HB2 ALA 134 7.074 -3.453 9.677 1013 HB3 ALA 134 HB3 ALA 134 7.786 -4.464 10.932 1014 H ARG 135 H ARG 135 10.558 -3.659 11.561 1015 HA ARG 135 HA ARG 135 9.989 -1.193 12.669 1016 HB2 ARG 135 HB2 ARG 135 12.047 -1.383 13.873 1017 HB3 ARG 135 HB3 ARG 135 11.221 -2.939 13.813 1018 HG2 ARG 135 HG2 ARG 135 12.768 -3.612 12.017 1019 HG3 ARG 135 HG3 ARG 135 13.610 -2.072 12.214 1020 HD2 ARG 135 HD2 ARG 135 14.830 -3.556 13.547 1021 HD3 ARG 135 HD3 ARG 135 13.709 -2.631 14.585 1022 HE ARG 135 HE ARG 135 12.338 -4.495 14.835 1023 HH11 ARG 135 HH11 ARG 135 15.398 -5.314 13.159 1024 HH12 ARG 135 HH12 ARG 135 15.280 -6.964 13.504 1025 HH21 ARG 135 HH21 ARG 135 12.198 -6.787 15.261 1026 HH22 ARG 135 HH22 ARG 135 13.449 -7.816 14.720 1027 H GLU 136 H GLU 136 12.420 -1.957 10.162 1028 HA GLU 136 HA GLU 136 13.574 0.634 10.105 1029 HB2 GLU 136 HB2 GLU 136 14.805 -1.294 9.470 1030 HB3 GLU 136 HB3 GLU 136 13.597 -1.756 8.290 1031 HG2 GLU 136 HG2 GLU 136 15.536 -0.916 7.239 1032 HG3 GLU 136 HG3 GLU 136 14.194 0.178 6.913 1033 H VAL 137 H VAL 137 10.950 -0.999 8.566 1034 HA VAL 137 HA VAL 137 10.559 0.749 6.366 1035 HB VAL 137 HB VAL 137 8.569 -1.065 7.748 1036 HG11 VAL 137 HG11 VAL 137 8.537 0.091 4.961 1037 HG12 VAL 137 HG12 VAL 137 7.461 0.529 6.285 1038 HG13 VAL 137 HG13 VAL 137 7.395 -1.092 5.591 1039 HG21 VAL 137 HG21 VAL 137 9.182 -2.715 6.017 1040 HG22 VAL 137 HG22 VAL 137 10.529 -2.309 7.079 1041 HG23 VAL 137 HG23 VAL 137 10.447 -1.623 5.464 1042 H VAL 138 H VAL 138 8.998 0.415 9.530 1043 HA VAL 138 HA VAL 138 7.293 2.640 9.305 1044 HB VAL 138 HB VAL 138 8.501 1.485 11.847 1045 HG11 VAL 138 HG11 VAL 138 7.526 3.688 12.220 1046 HG12 VAL 138 HG12 VAL 138 6.544 2.436 12.984 1047 HG13 VAL 138 HG13 VAL 138 6.019 3.165 11.468 1048 HG21 VAL 138 HG21 VAL 138 5.900 0.813 10.465 1049 HG22 VAL 138 HG22 VAL 138 6.426 0.185 12.026 1050 HG23 VAL 138 HG23 VAL 138 7.324 -0.226 10.563 1051 H ARG 139 H ARG 139 10.544 2.284 10.563 1052 HA ARG 139 HA ARG 139 10.938 4.923 11.428 1053 HB2 ARG 139 HB2 ARG 139 12.337 3.136 12.217 1054 HB3 ARG 139 HB3 ARG 139 12.835 2.723 10.599 1055 HG2 ARG 139 HG2 ARG 139 13.550 5.382 11.757 1056 HG3 ARG 139 HG3 ARG 139 14.456 3.940 12.212 1057 HD2 ARG 139 HD2 ARG 139 14.876 3.507 9.803 1058 HD3 ARG 139 HD3 ARG 139 14.078 5.036 9.428 1059 HE ARG 139 HE ARG 139 15.841 5.948 11.037 1060 HH11 ARG 139 HH11 ARG 139 16.395 3.315 8.660 1061 HH12 ARG 139 HH12 ARG 139 18.049 3.691 8.519 1062 HH21 ARG 139 HH21 ARG 139 18.135 6.374 10.742 1063 HH22 ARG 139 HH22 ARG 139 19.031 5.397 9.666 1064 H ARG 140 H ARG 140 11.490 3.413 8.301 1065 HA ARG 140 HA ARG 140 12.737 5.569 6.979 1066 HB2 ARG 140 HB2 ARG 140 12.574 3.160 6.209 1067 HB3 ARG 140 HB3 ARG 140 10.908 3.472 5.782 1068 HG2 ARG 140 HG2 ARG 140 12.289 3.548 3.810 1069 HG3 ARG 140 HG3 ARG 140 11.662 5.159 4.153 1070 HD2 ARG 140 HD2 ARG 140 14.066 5.120 3.497 1071 HD3 ARG 140 HD3 ARG 140 13.754 5.854 5.072 1072 HE ARG 140 HE ARG 140 14.387 3.566 5.975 1073 HH11 ARG 140 HH11 ARG 140 15.849 4.833 3.002 1074 HH12 ARG 140 HH12 ARG 140 17.310 4.008 3.176 1075 HH21 ARG 140 HH21 ARG 140 16.342 2.513 6.309 1076 HH22 ARG 140 HH22 ARG 140 17.636 2.651 5.184 1077 H ALA 141 H ALA 141 9.413 4.610 7.453 1078 HA ALA 141 HA ALA 141 8.166 6.596 5.881 1079 HB1 ALA 141 HB1 ALA 141 7.160 4.954 8.187 1080 HB2 ALA 141 HB2 ALA 141 6.991 4.595 6.456 1081 HB3 ALA 141 HB3 ALA 141 6.176 5.994 7.169 1082 H GLN 142 H GLN 142 9.033 6.380 9.299 1083 HA GLN 142 HA GLN 142 7.894 8.770 10.208 1084 HB2 GLN 142 HB2 GLN 142 10.448 7.429 11.099 1085 HB3 GLN 142 HB3 GLN 142 9.668 8.744 11.960 1086 HG2 GLN 142 HG2 GLN 142 7.737 7.375 12.389 1087 HG3 GLN 142 HG3 GLN 142 8.407 6.073 11.405 1088 HE21 GLN 142 HE21 GLN 142 7.630 6.065 14.216 1089 HE22 GLN 142 HE22 GLN 142 9.054 5.618 15.080 1090 H ALA 143 H ALA 143 11.147 8.177 8.967 1091 HA ALA 143 HA ALA 143 12.050 10.846 8.998 1092 HB1 ALA 143 HB1 ALA 143 13.551 8.923 8.827 1093 HB2 ALA 143 HB2 ALA 143 13.810 10.045 7.489 1094 HB3 ALA 143 HB3 ALA 143 12.899 8.555 7.231 1095 H MET 144 H MET 144 10.025 9.128 6.810 1096 HA MET 144 HA MET 144 10.339 11.020 4.665 1097 HB2 MET 144 HB2 MET 144 9.839 8.683 4.147 1098 HB3 MET 144 HB3 MET 144 8.344 8.788 5.052 1099 HG2 MET 144 HG2 MET 144 7.715 8.862 2.798 1100 HG3 MET 144 HG3 MET 144 7.596 10.518 3.362 1101 HE1 MET 144 HE1 MET 144 10.368 12.352 1.341 1102 HE2 MET 144 HE2 MET 144 10.547 11.877 3.028 1103 HE3 MET 144 HE3 MET 144 9.009 12.497 2.448 1104 H ALA 145 H ALA 145 8.212 10.472 7.328 1105 HA ALA 145 HA ALA 145 6.246 12.310 6.356 1106 HB1 ALA 145 HB1 ALA 145 6.398 10.912 9.017 1107 HB2 ALA 145 HB2 ALA 145 5.547 10.325 7.591 1108 HB3 ALA 145 HB3 ALA 145 5.009 11.802 8.390 1109 H TYR 146 H TYR 146 8.480 12.217 9.136 1110 HA TYR 146 HA TYR 146 8.344 15.132 9.200 1111 HB2 TYR 146 HB2 TYR 146 8.260 13.296 11.621 1112 HB3 TYR 146 HB3 TYR 146 8.392 15.046 11.683 1113 HD1 TYR 146 HD1 TYR 146 6.160 12.219 10.981 1114 HD2 TYR 146 HD2 TYR 146 6.445 16.448 11.310 1115 HE1 TYR 146 HE1 TYR 146 3.716 12.380 10.983 1116 HE2 TYR 146 HE2 TYR 146 3.989 16.609 11.317 1117 HH TYR 146 HH TYR 146 2.007 13.821 11.666 Start of MODEL 23 1 H MET 1 H MET 1 -26.844 -0.338 2.319 2 HA MET 1 HA MET 1 -24.950 -0.473 3.782 3 HB2 MET 1 HB2 MET 1 -26.767 1.900 4.255 4 HB3 MET 1 HB3 MET 1 -25.108 1.842 4.828 5 HG2 MET 1 HG2 MET 1 -25.961 1.624 1.951 6 HG3 MET 1 HG3 MET 1 -25.347 3.081 2.730 7 HE1 MET 1 HE1 MET 1 -22.424 1.887 0.343 8 HE2 MET 1 HE2 MET 1 -23.569 3.182 0.697 9 HE3 MET 1 HE3 MET 1 -24.148 1.646 0.052 10 HA PRO 2 HA PRO 2 -26.130 -2.316 7.645 11 HB2 PRO 2 HB2 PRO 2 -23.589 -2.619 8.633 12 HB3 PRO 2 HB3 PRO 2 -24.337 -3.731 7.481 13 HG2 PRO 2 HG2 PRO 2 -22.390 -1.523 6.997 14 HG3 PRO 2 HG3 PRO 2 -22.477 -3.124 6.242 15 HD2 PRO 2 HD2 PRO 2 -23.343 -0.868 5.026 16 HD3 PRO 2 HD3 PRO 2 -24.081 -2.453 4.733 17 H GLY 3 H GLY 3 -23.728 0.280 7.548 18 HA2 GLY 3 HA2 GLY 3 -24.158 0.988 10.305 19 HA3 GLY 3 HA3 GLY 3 -23.114 1.797 9.153 20 H ARG 4 H ARG 4 -26.063 1.878 10.743 21 HA ARG 4 HA ARG 4 -27.604 3.468 8.952 22 HB2 ARG 4 HB2 ARG 4 -28.602 2.168 10.791 23 HB3 ARG 4 HB3 ARG 4 -27.775 3.180 11.958 24 HG2 ARG 4 HG2 ARG 4 -29.066 5.130 10.990 25 HG3 ARG 4 HG3 ARG 4 -30.021 3.931 10.116 26 HD2 ARG 4 HD2 ARG 4 -30.585 2.853 12.252 27 HD3 ARG 4 HD3 ARG 4 -29.678 4.100 13.104 28 HE ARG 4 HE ARG 4 -32.030 4.642 11.439 29 HH11 ARG 4 HH11 ARG 4 -30.126 5.317 14.376 30 HH12 ARG 4 HH12 ARG 4 -31.324 6.281 15.097 31 HH21 ARG 4 HH21 ARG 4 -33.671 6.048 12.466 32 HH22 ARG 4 HH22 ARG 4 -33.346 6.696 14.017 33 H ALA 5 H ALA 5 -27.739 5.662 8.771 34 HA ALA 5 HA ALA 5 -25.589 7.171 9.998 35 HB1 ALA 5 HB1 ALA 5 -25.915 7.360 7.577 36 HB2 ALA 5 HB2 ALA 5 -26.200 8.909 8.374 37 HB3 ALA 5 HB3 ALA 5 -27.564 7.927 7.838 38 HA PRO 6 HA PRO 6 -28.809 8.764 12.797 39 HB2 PRO 6 HB2 PRO 6 -26.608 9.824 14.375 40 HB3 PRO 6 HB3 PRO 6 -27.732 8.533 14.805 41 HG2 PRO 6 HG2 PRO 6 -25.085 8.109 14.327 42 HG3 PRO 6 HG3 PRO 6 -26.334 6.889 14.025 43 HD2 PRO 6 HD2 PRO 6 -24.980 8.736 12.091 44 HD3 PRO 6 HD3 PRO 6 -25.373 7.006 11.933 45 H GLY 7 H GLY 7 -28.320 11.139 14.171 46 HA2 GLY 7 HA2 GLY 7 -28.462 13.031 12.001 47 HA3 GLY 7 HA3 GLY 7 -28.750 13.360 13.708 48 H SER 8 H SER 8 -26.669 13.012 15.076 49 HA SER 8 HA SER 8 -24.745 14.674 13.750 50 HB2 SER 8 HB2 SER 8 -23.787 14.905 16.137 51 HB3 SER 8 HB3 SER 8 -25.316 15.694 15.756 52 HG SER 8 HG SER 8 -26.363 14.340 17.003 53 H THR 9 H THR 9 -24.018 13.086 12.432 54 HA THR 9 HA THR 9 -21.582 11.947 13.412 55 HB THR 9 HB THR 9 -23.557 10.182 11.903 56 HG1 THR 9 HG1 THR 9 -23.356 10.703 14.561 57 HG21 THR 9 HG21 THR 9 -20.938 9.523 13.274 58 HG22 THR 9 HG22 THR 9 -21.152 9.733 11.540 59 HG23 THR 9 HG23 THR 9 -21.946 8.388 12.369 60 H LEU 10 H LEU 10 -20.146 11.736 11.626 61 HA LEU 10 HA LEU 10 -21.120 12.859 9.085 62 HB2 LEU 10 HB2 LEU 10 -18.564 13.206 10.564 63 HB3 LEU 10 HB3 LEU 10 -18.776 13.754 8.906 64 HG LEU 10 HG LEU 10 -20.338 14.770 11.292 65 HD11 LEU 10 HD11 LEU 10 -17.985 15.427 11.403 66 HD12 LEU 10 HD12 LEU 10 -19.017 16.808 11.039 67 HD13 LEU 10 HD13 LEU 10 -18.082 16.042 9.754 68 HD21 LEU 10 HD21 LEU 10 -21.594 14.934 9.211 69 HD22 LEU 10 HD22 LEU 10 -20.215 15.710 8.428 70 HD23 LEU 10 HD23 LEU 10 -21.063 16.530 9.737 71 H ALA 11 H ALA 11 -19.678 12.209 7.255 72 HA ALA 11 HA ALA 11 -18.936 9.449 7.520 73 HB1 ALA 11 HB1 ALA 11 -20.033 10.164 5.446 74 HB2 ALA 11 HB2 ALA 11 -18.404 9.583 5.098 75 HB3 ALA 11 HB3 ALA 11 -18.738 11.314 5.136 76 H ARG 12 H ARG 12 -17.396 9.525 8.936 77 HA ARG 12 HA ARG 12 -15.085 11.189 8.780 78 HB2 ARG 12 HB2 ARG 12 -14.304 9.867 10.752 79 HB3 ARG 12 HB3 ARG 12 -15.897 10.570 10.965 80 HG2 ARG 12 HG2 ARG 12 -16.941 8.416 10.534 81 HG3 ARG 12 HG3 ARG 12 -15.362 7.693 10.225 82 HD2 ARG 12 HD2 ARG 12 -14.712 8.253 12.533 83 HD3 ARG 12 HD3 ARG 12 -16.344 8.854 12.826 84 HE ARG 12 HE ARG 12 -16.689 6.324 11.882 85 HH11 ARG 12 HH11 ARG 12 -14.893 7.700 14.620 86 HH12 ARG 12 HH12 ARG 12 -15.060 6.308 15.596 87 HH21 ARG 12 HH21 ARG 12 -16.904 4.414 13.252 88 HH22 ARG 12 HH22 ARG 12 -16.165 4.414 14.789 89 H VAL 13 H VAL 13 -13.816 10.860 7.109 90 HA VAL 13 HA VAL 13 -13.372 8.155 6.217 91 HB VAL 13 HB VAL 13 -12.403 10.702 4.941 92 HG11 VAL 13 HG11 VAL 13 -12.206 9.328 2.901 93 HG12 VAL 13 HG12 VAL 13 -12.704 7.911 3.826 94 HG13 VAL 13 HG13 VAL 13 -11.185 8.720 4.207 95 HG21 VAL 13 HG21 VAL 13 -14.841 10.677 5.142 96 HG22 VAL 13 HG22 VAL 13 -14.895 9.119 4.337 97 HG23 VAL 13 HG23 VAL 13 -14.342 10.548 3.453 98 H GLY 14 H GLY 14 -12.157 7.545 7.985 99 HA2 GLY 14 HA2 GLY 14 -9.411 8.548 8.161 100 HA3 GLY 14 HA3 GLY 14 -10.129 7.293 9.184 101 H SER 15 H SER 15 -9.682 7.842 5.755 102 HA SER 15 HA SER 15 -8.528 5.207 5.384 103 HB2 SER 15 HB2 SER 15 -10.994 5.002 5.271 104 HB3 SER 15 HB3 SER 15 -11.025 6.244 4.033 105 HG SER 15 HG SER 15 -9.732 3.719 3.846 106 H ILE 16 H ILE 16 -7.499 5.139 3.303 107 HA ILE 16 HA ILE 16 -7.124 7.763 2.118 108 HB ILE 16 HB ILE 16 -5.291 5.322 1.950 109 HG12 ILE 16 HG12 ILE 16 -3.604 6.894 3.104 110 HG13 ILE 16 HG13 ILE 16 -4.977 7.907 3.502 111 HG21 ILE 16 HG21 ILE 16 -4.914 8.083 0.816 112 HG22 ILE 16 HG22 ILE 16 -5.221 6.605 -0.091 113 HG23 ILE 16 HG23 ILE 16 -3.708 6.795 0.800 114 HD11 ILE 16 HD11 ILE 16 -4.550 5.058 4.396 115 HD12 ILE 16 HD12 ILE 16 -5.941 6.065 4.805 116 HD13 ILE 16 HD13 ILE 16 -4.330 6.506 5.377 117 HA PRO 17 HA PRO 17 -9.500 5.990 -1.327 118 HB2 PRO 17 HB2 PRO 17 -8.305 8.319 -2.739 119 HB3 PRO 17 HB3 PRO 17 -10.003 7.863 -2.587 120 HG2 PRO 17 HG2 PRO 17 -9.055 9.935 -1.230 121 HG3 PRO 17 HG3 PRO 17 -10.213 8.818 -0.483 122 HD2 PRO 17 HD2 PRO 17 -7.243 8.981 -0.118 123 HD3 PRO 17 HD3 PRO 17 -8.527 8.735 1.091 124 H ALA 18 H ALA 18 -8.911 5.328 -3.621 125 HA ALA 18 HA ALA 18 -6.239 4.228 -3.580 126 HB1 ALA 18 HB1 ALA 18 -8.451 3.959 -5.630 127 HB2 ALA 18 HB2 ALA 18 -8.142 2.844 -4.296 128 HB3 ALA 18 HB3 ALA 18 -6.953 3.025 -5.584 129 H GLY 19 H GLY 19 -4.523 5.165 -4.577 130 HA2 GLY 19 HA2 GLY 19 -5.109 7.363 -6.391 131 HA3 GLY 19 HA3 GLY 19 -3.645 7.155 -5.437 132 H ASP 20 H ASP 20 -2.049 6.905 -6.776 133 HA ASP 20 HA ASP 20 -2.501 5.460 -9.287 134 HB2 ASP 20 HB2 ASP 20 -1.696 7.835 -9.336 135 HB3 ASP 20 HB3 ASP 20 -0.230 7.286 -8.528 136 H ASP 21 H ASP 21 -1.626 3.539 -9.521 137 HA ASP 21 HA ASP 21 -0.338 2.277 -7.384 138 HB2 ASP 21 HB2 ASP 21 -0.178 0.301 -8.801 139 HB3 ASP 21 HB3 ASP 21 -1.742 1.064 -9.030 140 H VAL 22 H VAL 22 1.804 1.996 -6.913 141 HA VAL 22 HA VAL 22 3.750 3.095 -8.823 142 HB VAL 22 HB VAL 22 4.078 2.914 -5.794 143 HG11 VAL 22 HG11 VAL 22 5.955 4.462 -6.137 144 HG12 VAL 22 HG12 VAL 22 5.650 4.384 -7.884 145 HG13 VAL 22 HG13 VAL 22 6.150 2.935 -7.020 146 HG21 VAL 22 HG21 VAL 22 3.467 5.370 -7.421 147 HG22 VAL 22 HG22 VAL 22 3.628 5.278 -5.674 148 HG23 VAL 22 HG23 VAL 22 2.264 4.494 -6.491 149 H LEU 23 H LEU 23 2.702 0.451 -8.685 150 HA LEU 23 HA LEU 23 5.238 -0.957 -8.404 151 HB2 LEU 23 HB2 LEU 23 3.799 -3.106 -8.168 152 HB3 LEU 23 HB3 LEU 23 4.068 -2.098 -6.773 153 HG LEU 23 HG LEU 23 1.807 -1.239 -6.918 154 HD11 LEU 23 HD11 LEU 23 1.450 -3.125 -9.274 155 HD12 LEU 23 HD12 LEU 23 1.450 -1.365 -9.369 156 HD13 LEU 23 HD13 LEU 23 0.160 -2.198 -8.503 157 HD21 LEU 23 HD21 LEU 23 1.932 -4.237 -7.046 158 HD22 LEU 23 HD22 LEU 23 0.599 -3.294 -6.379 159 HD23 LEU 23 HD23 LEU 23 2.193 -3.221 -5.627 160 H ASP 24 H ASP 24 5.233 -3.014 -9.812 161 HA ASP 24 HA ASP 24 4.516 -2.126 -12.474 162 HB2 ASP 24 HB2 ASP 24 6.720 -3.217 -12.112 163 HB3 ASP 24 HB3 ASP 24 5.914 -4.678 -11.570 164 HA PRO 25 HA PRO 25 0.555 -4.128 -12.503 165 HB2 PRO 25 HB2 PRO 25 1.356 -4.796 -15.292 166 HB3 PRO 25 HB3 PRO 25 -0.169 -4.123 -14.699 167 HG2 PRO 25 HG2 PRO 25 1.595 -2.537 -15.860 168 HG3 PRO 25 HG3 PRO 25 0.741 -1.999 -14.403 169 HD2 PRO 25 HD2 PRO 25 3.561 -2.930 -14.704 170 HD3 PRO 25 HD3 PRO 25 2.878 -1.687 -13.635 171 H ASP 26 H ASP 26 3.456 -5.958 -13.398 172 HA ASP 26 HA ASP 26 1.891 -8.392 -13.169 173 HB2 ASP 26 HB2 ASP 26 4.607 -7.885 -14.263 174 HB3 ASP 26 HB3 ASP 26 4.230 -9.497 -13.660 175 H GLU 27 H GLU 27 3.315 -6.455 -10.989 176 HA GLU 27 HA GLU 27 4.595 -8.341 -9.280 177 HB2 GLU 27 HB2 GLU 27 3.255 -5.690 -8.697 178 HB3 GLU 27 HB3 GLU 27 4.076 -6.631 -7.470 179 HG2 GLU 27 HG2 GLU 27 5.371 -5.562 -9.952 180 HG3 GLU 27 HG3 GLU 27 5.387 -4.742 -8.393 181 HA PRO 28 HA PRO 28 1.188 -10.586 -7.515 182 HB2 PRO 28 HB2 PRO 28 1.909 -10.365 -4.798 183 HB3 PRO 28 HB3 PRO 28 2.427 -11.633 -5.907 184 HG2 PRO 28 HG2 PRO 28 3.852 -9.148 -5.078 185 HG3 PRO 28 HG3 PRO 28 4.505 -10.765 -5.394 186 HD2 PRO 28 HD2 PRO 28 4.794 -8.796 -7.164 187 HD3 PRO 28 HD3 PRO 28 4.468 -10.460 -7.699 188 H THR 29 H THR 29 -0.787 -9.765 -7.358 189 HA THR 29 HA THR 29 -1.337 -7.406 -5.707 190 HB THR 29 HB THR 29 -2.182 -7.833 -8.599 191 HG1 THR 29 HG1 THR 29 0.042 -7.228 -8.390 192 HG21 THR 29 HG21 THR 29 -3.024 -5.533 -8.505 193 HG22 THR 29 HG22 THR 29 -2.553 -5.432 -6.805 194 HG23 THR 29 HG23 THR 29 -3.821 -6.552 -7.304 195 H TYR 30 H TYR 30 -3.828 -7.284 -5.236 196 HA TYR 30 HA TYR 30 -5.209 -9.794 -5.794 197 HB2 TYR 30 HB2 TYR 30 -5.077 -8.273 -3.197 198 HB3 TYR 30 HB3 TYR 30 -6.454 -9.266 -3.638 199 HD1 TYR 30 HD1 TYR 30 -5.509 -11.668 -4.653 200 HD2 TYR 30 HD2 TYR 30 -3.733 -9.270 -1.630 201 HE1 TYR 30 HE1 TYR 30 -4.412 -13.647 -3.758 202 HE2 TYR 30 HE2 TYR 30 -2.630 -11.251 -0.697 203 HH TYR 30 HH TYR 30 -2.558 -14.248 -2.407 204 H ASP 31 H ASP 31 -7.464 -9.500 -5.753 205 HA ASP 31 HA ASP 31 -8.322 -6.785 -6.407 206 HB2 ASP 31 HB2 ASP 31 -7.796 -8.315 -8.460 207 HB3 ASP 31 HB3 ASP 31 -9.178 -9.264 -7.932 208 H LEU 32 H LEU 32 -10.723 -6.805 -6.221 209 HA LEU 32 HA LEU 32 -11.320 -7.422 -3.602 210 HB2 LEU 32 HB2 LEU 32 -13.292 -6.873 -5.806 211 HB3 LEU 32 HB3 LEU 32 -13.653 -6.821 -4.095 212 HG LEU 32 HG LEU 32 -11.714 -5.004 -5.529 213 HD11 LEU 32 HD11 LEU 32 -14.013 -4.544 -6.127 214 HD12 LEU 32 HD12 LEU 32 -13.370 -3.265 -5.094 215 HD13 LEU 32 HD13 LEU 32 -14.457 -4.481 -4.423 216 HD21 LEU 32 HD21 LEU 32 -12.656 -5.006 -2.658 217 HD22 LEU 32 HD22 LEU 32 -11.678 -3.748 -3.413 218 HD23 LEU 32 HD23 LEU 32 -11.026 -5.372 -3.224 219 HA PRO 33 HA PRO 33 -14.068 -11.260 -4.890 220 HB2 PRO 33 HB2 PRO 33 -13.077 -12.532 -7.157 221 HB3 PRO 33 HB3 PRO 33 -14.526 -11.527 -7.116 222 HG2 PRO 33 HG2 PRO 33 -11.748 -10.811 -7.948 223 HG3 PRO 33 HG3 PRO 33 -13.295 -10.352 -8.688 224 HD2 PRO 33 HD2 PRO 33 -11.949 -8.635 -7.168 225 HD3 PRO 33 HD3 PRO 33 -13.722 -8.736 -7.075 226 H ARG 34 H ARG 34 -10.608 -11.135 -5.843 227 HA ARG 34 HA ARG 34 -10.065 -13.759 -4.961 228 HB2 ARG 34 HB2 ARG 34 -8.775 -12.242 -6.656 229 HB3 ARG 34 HB3 ARG 34 -7.970 -11.633 -5.218 230 HG2 ARG 34 HG2 ARG 34 -6.608 -13.360 -6.157 231 HG3 ARG 34 HG3 ARG 34 -7.328 -13.988 -4.668 232 HD2 ARG 34 HD2 ARG 34 -9.047 -15.119 -5.933 233 HD3 ARG 34 HD3 ARG 34 -8.431 -14.435 -7.431 234 HE ARG 34 HE ARG 34 -6.881 -16.269 -5.734 235 HH11 ARG 34 HH11 ARG 34 -7.845 -15.259 -8.966 236 HH12 ARG 34 HH12 ARG 34 -7.396 -16.714 -9.726 237 HH21 ARG 34 HH21 ARG 34 -6.182 -18.267 -6.794 238 HH22 ARG 34 HH22 ARG 34 -6.420 -18.435 -8.478 239 H VAL 35 H VAL 35 -9.916 -10.573 -3.499 240 HA VAL 35 HA VAL 35 -8.449 -11.415 -1.211 241 HB VAL 35 HB VAL 35 -10.377 -9.073 -1.296 242 HG11 VAL 35 HG11 VAL 35 -7.977 -9.596 0.452 243 HG12 VAL 35 HG12 VAL 35 -9.665 -9.675 0.948 244 HG13 VAL 35 HG13 VAL 35 -8.958 -8.131 0.469 245 HG21 VAL 35 HG21 VAL 35 -7.449 -9.083 -1.930 246 HG22 VAL 35 HG22 VAL 35 -8.491 -7.667 -1.890 247 HG23 VAL 35 HG23 VAL 35 -8.748 -8.913 -3.118 248 H ALA 36 H ALA 36 -11.851 -11.052 -1.919 249 HA ALA 36 HA ALA 36 -12.874 -11.721 0.598 250 HB1 ALA 36 HB1 ALA 36 -14.243 -10.776 -1.218 251 HB2 ALA 36 HB2 ALA 36 -14.934 -12.257 -0.566 252 HB3 ALA 36 HB3 ALA 36 -14.084 -12.294 -2.117 253 H GLU 37 H GLU 37 -11.838 -13.598 -2.097 254 HA GLU 37 HA GLU 37 -12.618 -16.194 -1.304 255 HB2 GLU 37 HB2 GLU 37 -11.832 -15.193 -3.563 256 HB3 GLU 37 HB3 GLU 37 -10.243 -15.444 -2.930 257 HG2 GLU 37 HG2 GLU 37 -10.599 -17.821 -2.694 258 HG3 GLU 37 HG3 GLU 37 -12.234 -17.641 -3.324 259 H LEU 38 H LEU 38 -9.600 -14.367 -1.065 260 HA LEU 38 HA LEU 38 -7.912 -16.341 -0.000 261 HB2 LEU 38 HB2 LEU 38 -7.103 -14.328 -1.079 262 HB3 LEU 38 HB3 LEU 38 -7.774 -13.341 0.202 263 HG LEU 38 HG LEU 38 -6.215 -14.620 1.767 264 HD11 LEU 38 HD11 LEU 38 -4.191 -15.530 0.762 265 HD12 LEU 38 HD12 LEU 38 -4.893 -15.310 -0.836 266 HD13 LEU 38 HD13 LEU 38 -5.632 -16.444 0.299 267 HD21 LEU 38 HD21 LEU 38 -4.341 -13.126 1.248 268 HD22 LEU 38 HD22 LEU 38 -5.892 -12.288 1.177 269 HD23 LEU 38 HD23 LEU 38 -5.080 -12.760 -0.312 270 H LEU 39 H LEU 39 -9.637 -13.694 1.588 271 HA LEU 39 HA LEU 39 -8.674 -14.569 4.175 272 HB2 LEU 39 HB2 LEU 39 -10.519 -12.315 3.444 273 HB3 LEU 39 HB3 LEU 39 -9.838 -12.593 5.035 274 HG LEU 39 HG LEU 39 -8.305 -11.837 2.541 275 HD11 LEU 39 HD11 LEU 39 -8.928 -10.278 5.040 276 HD12 LEU 39 HD12 LEU 39 -9.618 -10.006 3.438 277 HD13 LEU 39 HD13 LEU 39 -7.898 -9.735 3.716 278 HD21 LEU 39 HD21 LEU 39 -6.963 -13.280 3.982 279 HD22 LEU 39 HD22 LEU 39 -7.335 -12.258 5.370 280 HD23 LEU 39 HD23 LEU 39 -6.372 -11.621 4.037 281 H GLY 40 H GLY 40 -11.399 -15.113 2.218 282 HA2 GLY 40 HA2 GLY 40 -13.235 -16.449 2.594 283 HA3 GLY 40 HA3 GLY 40 -12.644 -16.740 4.232 284 H VAL 41 H VAL 41 -13.059 -13.560 2.956 285 HA VAL 41 HA VAL 41 -15.331 -13.143 4.788 286 HB VAL 41 HB VAL 41 -14.490 -10.995 5.452 287 HG11 VAL 41 HG11 VAL 41 -12.219 -12.942 5.581 288 HG12 VAL 41 HG12 VAL 41 -13.569 -12.828 6.704 289 HG13 VAL 41 HG13 VAL 41 -12.405 -11.503 6.583 290 HG21 VAL 41 HG21 VAL 41 -13.551 -10.184 3.382 291 HG22 VAL 41 HG22 VAL 41 -12.243 -11.365 3.466 292 HG23 VAL 41 HG23 VAL 41 -12.336 -10.063 4.651 293 HA PRO 42 HA PRO 42 -17.240 -11.261 1.258 294 HB2 PRO 42 HB2 PRO 42 -18.684 -9.252 2.342 295 HB3 PRO 42 HB3 PRO 42 -19.148 -10.954 2.499 296 HG2 PRO 42 HG2 PRO 42 -17.726 -9.184 4.455 297 HG3 PRO 42 HG3 PRO 42 -19.042 -10.336 4.749 298 HD2 PRO 42 HD2 PRO 42 -16.469 -10.928 5.280 299 HD3 PRO 42 HD3 PRO 42 -17.620 -12.156 4.722 300 H VAL 43 H VAL 43 -17.184 -9.442 -0.076 301 HA VAL 43 HA VAL 43 -14.859 -7.895 -0.060 302 HB VAL 43 HB VAL 43 -17.451 -7.403 -1.569 303 HG11 VAL 43 HG11 VAL 43 -16.108 -6.030 -3.114 304 HG12 VAL 43 HG12 VAL 43 -14.703 -6.235 -2.065 305 HG13 VAL 43 HG13 VAL 43 -16.111 -5.346 -1.487 306 HG21 VAL 43 HG21 VAL 43 -16.292 -8.448 -3.448 307 HG22 VAL 43 HG22 VAL 43 -16.384 -9.546 -2.071 308 HG23 VAL 43 HG23 VAL 43 -14.876 -8.709 -2.433 309 H SER 44 H SER 44 -18.023 -7.243 1.239 310 HA SER 44 HA SER 44 -17.810 -4.524 1.761 311 HB2 SER 44 HB2 SER 44 -19.921 -5.787 2.026 312 HB3 SER 44 HB3 SER 44 -19.235 -6.651 3.394 313 HG SER 44 HG SER 44 -19.612 -5.035 4.621 314 H LYS 45 H LYS 45 -16.661 -7.301 3.694 315 HA LYS 45 HA LYS 45 -15.755 -5.696 5.852 316 HB2 LYS 45 HB2 LYS 45 -16.279 -8.123 6.105 317 HB3 LYS 45 HB3 LYS 45 -14.868 -8.502 5.127 318 HG2 LYS 45 HG2 LYS 45 -13.403 -7.526 6.798 319 HG3 LYS 45 HG3 LYS 45 -14.797 -7.026 7.752 320 HD2 LYS 45 HD2 LYS 45 -15.414 -9.401 8.033 321 HD3 LYS 45 HD3 LYS 45 -13.964 -9.859 7.135 322 HE2 LYS 45 HE2 LYS 45 -12.556 -8.808 8.813 323 HE3 LYS 45 HE3 LYS 45 -13.978 -8.270 9.702 324 HZ1 LYS 45 HZ1 LYS 45 -14.558 -10.620 10.032 325 HZ2 LYS 45 HZ2 LYS 45 -13.052 -10.251 10.696 326 HZ3 LYS 45 HZ3 LYS 45 -13.158 -11.082 9.238 327 H VAL 46 H VAL 46 -14.327 -6.871 2.912 328 HA VAL 46 HA VAL 46 -11.638 -6.158 3.403 329 HB VAL 46 HB VAL 46 -13.111 -6.157 0.746 330 HG11 VAL 46 HG11 VAL 46 -10.159 -6.327 1.323 331 HG12 VAL 46 HG12 VAL 46 -11.013 -4.950 0.633 332 HG13 VAL 46 HG13 VAL 46 -10.903 -6.462 -0.274 333 HG21 VAL 46 HG21 VAL 46 -11.540 -8.364 2.083 334 HG22 VAL 46 HG22 VAL 46 -12.202 -8.428 0.450 335 HG23 VAL 46 HG23 VAL 46 -13.286 -8.326 1.836 336 H ALA 47 H ALA 47 -14.321 -4.414 1.941 337 HA ALA 47 HA ALA 47 -12.995 -2.008 1.392 338 HB1 ALA 47 HB1 ALA 47 -15.915 -2.427 2.045 339 HB2 ALA 47 HB2 ALA 47 -15.190 -2.584 0.446 340 HB3 ALA 47 HB3 ALA 47 -15.228 -1.012 1.247 341 H GLN 48 H GLN 48 -14.597 -3.189 4.277 342 HA GLN 48 HA GLN 48 -14.492 -0.795 5.759 343 HB2 GLN 48 HB2 GLN 48 -14.611 -3.660 6.656 344 HB3 GLN 48 HB3 GLN 48 -14.588 -2.320 7.790 345 HG2 GLN 48 HG2 GLN 48 -16.658 -2.786 5.660 346 HG3 GLN 48 HG3 GLN 48 -16.849 -3.119 7.383 347 HE21 GLN 48 HE21 GLN 48 -16.953 -1.383 8.808 348 HE22 GLN 48 HE22 GLN 48 -17.417 0.198 8.296 349 H GLN 49 H GLN 49 -12.179 -3.404 5.420 350 HA GLN 49 HA GLN 49 -10.294 -2.567 7.343 351 HB2 GLN 49 HB2 GLN 49 -9.712 -3.876 4.681 352 HB3 GLN 49 HB3 GLN 49 -8.653 -3.859 6.086 353 HG2 GLN 49 HG2 GLN 49 -11.336 -5.196 5.901 354 HG3 GLN 49 HG3 GLN 49 -9.760 -5.979 5.817 355 HE21 GLN 49 HE21 GLN 49 -12.028 -6.236 7.697 356 HE22 GLN 49 HE22 GLN 49 -11.342 -6.007 9.270 357 H LEU 50 H LEU 50 -10.650 -1.823 3.968 358 HA LEU 50 HA LEU 50 -8.497 -0.027 3.670 359 HB2 LEU 50 HB2 LEU 50 -9.648 -0.947 1.745 360 HB3 LEU 50 HB3 LEU 50 -11.145 -0.184 2.229 361 HG LEU 50 HG LEU 50 -10.126 2.035 1.778 362 HD11 LEU 50 HD11 LEU 50 -7.794 1.486 2.116 363 HD12 LEU 50 HD12 LEU 50 -8.044 2.163 0.506 364 HD13 LEU 50 HD13 LEU 50 -7.821 0.424 0.711 365 HD21 LEU 50 HD21 LEU 50 -11.486 0.933 0.086 366 HD22 LEU 50 HD22 LEU 50 -10.063 0.095 -0.529 367 HD23 LEU 50 HD23 LEU 50 -10.178 1.850 -0.662 368 H ARG 51 H ARG 51 -11.871 0.480 4.550 369 HA ARG 51 HA ARG 51 -11.749 3.289 4.739 370 HB2 ARG 51 HB2 ARG 51 -13.698 1.388 6.035 371 HB3 ARG 51 HB3 ARG 51 -13.880 3.129 6.002 372 HG2 ARG 51 HG2 ARG 51 -13.783 1.405 3.524 373 HG3 ARG 51 HG3 ARG 51 -15.266 1.851 4.349 374 HD2 ARG 51 HD2 ARG 51 -15.034 3.319 2.498 375 HD3 ARG 51 HD3 ARG 51 -14.655 4.260 3.926 376 HE ARG 51 HE ARG 51 -12.210 3.736 3.197 377 HH11 ARG 51 HH11 ARG 51 -14.897 4.333 0.967 378 HH12 ARG 51 HH12 ARG 51 -13.919 5.040 -0.230 379 HH21 ARG 51 HH21 ARG 51 -10.882 4.747 1.567 380 HH22 ARG 51 HH22 ARG 51 -11.594 5.293 0.106 381 H GLU 52 H GLU 52 -10.681 0.847 6.948 382 HA GLU 52 HA GLU 52 -10.646 2.805 9.115 383 HB2 GLU 52 HB2 GLU 52 -9.977 -0.131 9.192 384 HB3 GLU 52 HB3 GLU 52 -10.019 0.947 10.581 385 HG2 GLU 52 HG2 GLU 52 -12.421 1.365 10.082 386 HG3 GLU 52 HG3 GLU 52 -12.323 0.106 8.852 387 H GLY 53 H GLY 53 -8.668 1.816 6.680 388 HA2 GLY 53 HA2 GLY 53 -6.472 2.418 6.245 389 HA3 GLY 53 HA3 GLY 53 -6.395 3.135 7.850 390 H HIS 54 H HIS 54 -7.308 -0.161 7.121 391 HA HIS 54 HA HIS 54 -4.882 -1.106 8.497 392 HB2 HIS 54 HB2 HIS 54 -7.037 -1.675 9.608 393 HB3 HIS 54 HB3 HIS 54 -7.579 -2.471 8.142 394 HD1 HIS 54 HD1 HIS 54 -7.650 -4.915 8.742 395 HD2 HIS 54 HD2 HIS 54 -4.225 -3.052 10.156 396 HE1 HIS 54 HE1 HIS 54 -6.230 -6.736 9.752 397 H LEU 55 H LEU 55 -6.309 -0.747 5.528 398 HA LEU 55 HA LEU 55 -4.394 -2.423 4.224 399 HB2 LEU 55 HB2 LEU 55 -6.334 -3.946 4.649 400 HB3 LEU 55 HB3 LEU 55 -7.374 -2.815 3.815 401 HG LEU 55 HG LEU 55 -6.122 -3.243 1.723 402 HD11 LEU 55 HD11 LEU 55 -4.680 -5.325 3.362 403 HD12 LEU 55 HD12 LEU 55 -3.968 -3.871 2.662 404 HD13 LEU 55 HD13 LEU 55 -4.579 -5.145 1.612 405 HD21 LEU 55 HD21 LEU 55 -7.002 -5.501 1.353 406 HD22 LEU 55 HD22 LEU 55 -8.157 -4.487 2.218 407 HD23 LEU 55 HD23 LEU 55 -7.217 -5.698 3.091 408 H VAL 56 H VAL 56 -4.278 -1.750 1.923 409 HA VAL 56 HA VAL 56 -5.721 0.726 1.344 410 HB VAL 56 HB VAL 56 -2.750 0.231 0.858 411 HG11 VAL 56 HG11 VAL 56 -4.408 2.673 0.227 412 HG12 VAL 56 HG12 VAL 56 -3.733 1.545 -0.947 413 HG13 VAL 56 HG13 VAL 56 -2.658 2.536 0.041 414 HG21 VAL 56 HG21 VAL 56 -4.107 2.186 2.700 415 HG22 VAL 56 HG22 VAL 56 -2.372 2.090 2.400 416 HG23 VAL 56 HG23 VAL 56 -3.209 0.749 3.185 417 H ALA 57 H ALA 57 -6.169 1.014 -0.868 418 HA ALA 57 HA ALA 57 -5.525 -1.211 -2.635 419 HB1 ALA 57 HB1 ALA 57 -8.187 0.252 -2.479 420 HB2 ALA 57 HB2 ALA 57 -7.874 -1.388 -1.900 421 HB3 ALA 57 HB3 ALA 57 -7.748 -1.039 -3.611 422 H VAL 58 H VAL 58 -5.382 -0.544 -4.824 423 HA VAL 58 HA VAL 58 -4.951 2.325 -5.225 424 HB VAL 58 HB VAL 58 -2.916 1.834 -6.504 425 HG11 VAL 58 HG11 VAL 58 -2.747 2.414 -4.167 426 HG12 VAL 58 HG12 VAL 58 -1.474 1.265 -4.602 427 HG13 VAL 58 HG13 VAL 58 -2.899 0.720 -3.711 428 HG21 VAL 58 HG21 VAL 58 -1.857 -0.389 -6.388 429 HG22 VAL 58 HG22 VAL 58 -3.418 -0.466 -7.206 430 HG23 VAL 58 HG23 VAL 58 -3.267 -1.017 -5.535 431 H ARG 59 H ARG 59 -4.775 2.806 -7.602 432 HA ARG 59 HA ARG 59 -6.699 1.112 -9.034 433 HB2 ARG 59 HB2 ARG 59 -7.440 3.447 -8.588 434 HB3 ARG 59 HB3 ARG 59 -6.035 4.039 -9.463 435 HG2 ARG 59 HG2 ARG 59 -6.868 2.838 -11.484 436 HG3 ARG 59 HG3 ARG 59 -8.333 2.446 -10.585 437 HD2 ARG 59 HD2 ARG 59 -8.780 4.368 -11.929 438 HD3 ARG 59 HD3 ARG 59 -8.694 4.896 -10.251 439 HE ARG 59 HE ARG 59 -6.159 5.197 -11.381 440 HH11 ARG 59 HH11 ARG 59 -9.395 6.665 -11.705 441 HH12 ARG 59 HH12 ARG 59 -8.779 8.139 -12.281 442 HH21 ARG 59 HH21 ARG 59 -5.384 7.257 -12.176 443 HH22 ARG 59 HH22 ARG 59 -6.516 8.482 -12.546 444 H ARG 60 H ARG 60 -5.825 -0.018 -10.637 445 HA ARG 60 HA ARG 60 -3.505 1.166 -11.973 446 HB2 ARG 60 HB2 ARG 60 -2.581 -1.035 -12.460 447 HB3 ARG 60 HB3 ARG 60 -2.791 -0.872 -10.731 448 HG2 ARG 60 HG2 ARG 60 -4.791 -2.276 -10.839 449 HG3 ARG 60 HG3 ARG 60 -4.604 -2.405 -12.589 450 HD2 ARG 60 HD2 ARG 60 -2.367 -3.413 -12.232 451 HD3 ARG 60 HD3 ARG 60 -2.664 -3.391 -10.496 452 HE ARG 60 HE ARG 60 -4.797 -4.723 -11.589 453 HH11 ARG 60 HH11 ARG 60 -1.313 -5.222 -11.359 454 HH12 ARG 60 HH12 ARG 60 -1.369 -6.873 -11.730 455 HH21 ARG 60 HH21 ARG 60 -4.884 -7.087 -12.018 456 HH22 ARG 60 HH22 ARG 60 -3.425 -7.938 -12.099 457 H ALA 61 H ALA 61 -3.922 1.907 -13.738 458 HA ALA 61 HA ALA 61 -4.614 2.281 -15.837 459 HB1 ALA 61 HB1 ALA 61 -5.551 0.456 -17.213 460 HB2 ALA 61 HB2 ALA 61 -5.623 -0.562 -15.766 461 HB3 ALA 61 HB3 ALA 61 -4.069 -0.022 -16.385 462 H GLY 62 H GLY 62 -6.944 0.470 -14.174 463 HA2 GLY 62 HA2 GLY 62 -8.839 2.589 -13.925 464 HA3 GLY 62 HA3 GLY 62 -9.317 1.525 -15.241 465 H GLY 63 H GLY 63 -7.746 -0.413 -12.975 466 HA2 GLY 63 HA2 GLY 63 -10.341 -1.129 -11.835 467 HA3 GLY 63 HA3 GLY 63 -9.003 -2.239 -12.127 468 H VAL 64 H VAL 64 -10.451 -1.640 -9.664 469 HA VAL 64 HA VAL 64 -8.342 -0.393 -8.072 470 HB VAL 64 HB VAL 64 -11.122 -1.289 -7.218 471 HG11 VAL 64 HG11 VAL 64 -9.548 -1.246 -5.365 472 HG12 VAL 64 HG12 VAL 64 -10.725 0.056 -5.208 473 HG13 VAL 64 HG13 VAL 64 -9.090 0.407 -5.773 474 HG21 VAL 64 HG21 VAL 64 -10.132 1.490 -7.859 475 HG22 VAL 64 HG22 VAL 64 -11.719 1.092 -7.202 476 HG23 VAL 64 HG23 VAL 64 -11.271 0.544 -8.818 477 H VAL 65 H VAL 65 -6.973 -1.625 -7.092 478 HA VAL 65 HA VAL 65 -7.496 -4.460 -6.459 479 HB VAL 65 HB VAL 65 -5.230 -4.981 -7.378 480 HG11 VAL 65 HG11 VAL 65 -7.201 -5.526 -8.700 481 HG12 VAL 65 HG12 VAL 65 -5.862 -5.037 -9.745 482 HG13 VAL 65 HG13 VAL 65 -7.179 -3.912 -9.412 483 HG21 VAL 65 HG21 VAL 65 -5.453 -2.251 -8.633 484 HG22 VAL 65 HG22 VAL 65 -4.194 -3.438 -8.971 485 HG23 VAL 65 HG23 VAL 65 -4.315 -2.712 -7.364 486 H ILE 66 H ILE 66 -5.576 -5.227 -5.138 487 HA ILE 66 HA ILE 66 -4.490 -2.972 -3.615 488 HB ILE 66 HB ILE 66 -4.674 -4.210 -1.508 489 HG12 ILE 66 HG12 ILE 66 -6.202 -6.207 -3.049 490 HG13 ILE 66 HG13 ILE 66 -4.511 -6.450 -2.539 491 HG21 ILE 66 HG21 ILE 66 -6.579 -2.833 -2.141 492 HG22 ILE 66 HG22 ILE 66 -7.140 -4.286 -1.280 493 HG23 ILE 66 HG23 ILE 66 -7.236 -4.200 -3.047 494 HD11 ILE 66 HD11 ILE 66 -5.952 -7.614 -0.983 495 HD12 ILE 66 HD12 ILE 66 -6.973 -6.180 -0.812 496 HD13 ILE 66 HD13 ILE 66 -5.335 -6.157 -0.186 497 HA PRO 67 HA PRO 67 -0.673 -5.091 -4.440 498 HB2 PRO 67 HB2 PRO 67 0.395 -3.941 -1.945 499 HB3 PRO 67 HB3 PRO 67 0.927 -3.677 -3.606 500 HG2 PRO 67 HG2 PRO 67 -0.350 -1.761 -2.218 501 HG3 PRO 67 HG3 PRO 67 -0.589 -1.967 -3.963 502 HD2 PRO 67 HD2 PRO 67 -2.340 -2.835 -1.694 503 HD3 PRO 67 HD3 PRO 67 -2.777 -2.106 -3.260 504 H GLN 68 H GLN 68 -0.511 -7.233 -4.070 505 HA GLN 68 HA GLN 68 -1.534 -8.575 -1.839 506 HB2 GLN 68 HB2 GLN 68 -1.388 -9.641 -3.929 507 HB3 GLN 68 HB3 GLN 68 0.333 -9.357 -4.043 508 HG2 GLN 68 HG2 GLN 68 0.760 -11.004 -2.339 509 HG3 GLN 68 HG3 GLN 68 -0.970 -11.206 -2.054 510 HE21 GLN 68 HE21 GLN 68 -1.632 -11.026 -4.926 511 HE22 GLN 68 HE22 GLN 68 -1.138 -12.502 -5.590 512 H VAL 69 H VAL 69 1.488 -7.151 -2.414 513 HA VAL 69 HA VAL 69 3.090 -8.567 -0.597 514 HB VAL 69 HB VAL 69 4.630 -6.654 -0.716 515 HG11 VAL 69 HG11 VAL 69 5.033 -6.738 -3.139 516 HG12 VAL 69 HG12 VAL 69 3.438 -7.454 -3.369 517 HG13 VAL 69 HG13 VAL 69 4.678 -8.332 -2.473 518 HG21 VAL 69 HG21 VAL 69 2.412 -5.321 -2.285 519 HG22 VAL 69 HG22 VAL 69 4.068 -4.720 -2.157 520 HG23 VAL 69 HG23 VAL 69 3.061 -4.812 -0.721 521 H PHE 70 H PHE 70 0.500 -6.498 0.053 522 HA PHE 70 HA PHE 70 1.382 -5.555 2.614 523 HB2 PHE 70 HB2 PHE 70 -1.242 -5.482 1.127 524 HB3 PHE 70 HB3 PHE 70 -1.189 -5.057 2.832 525 HD1 PHE 70 HD1 PHE 70 1.237 -4.264 0.097 526 HD2 PHE 70 HD2 PHE 70 -1.574 -2.766 2.908 527 HE1 PHE 70 HE1 PHE 70 1.910 -1.965 -0.453 528 HE2 PHE 70 HE2 PHE 70 -0.897 -0.475 2.387 529 HZ PHE 70 HZ PHE 70 0.829 -0.058 0.695 530 H PHE 71 H PHE 71 0.487 -8.485 1.433 531 HA PHE 71 HA PHE 71 -0.315 -9.499 4.062 532 HB2 PHE 71 HB2 PHE 71 -0.877 -10.631 1.305 533 HB3 PHE 71 HB3 PHE 71 -1.236 -11.457 2.811 534 HD1 PHE 71 HD1 PHE 71 -2.169 -8.723 0.581 535 HD2 PHE 71 HD2 PHE 71 -3.110 -10.807 4.162 536 HE1 PHE 71 HE1 PHE 71 -4.363 -7.654 0.618 537 HE2 PHE 71 HE2 PHE 71 -5.327 -9.737 4.204 538 HZ PHE 71 HZ PHE 71 -5.957 -8.155 2.430 539 H THR 72 H THR 72 0.604 -11.622 4.491 540 HA THR 72 HA THR 72 3.318 -11.882 3.473 541 HB THR 72 HB THR 72 3.509 -13.644 5.251 542 HG1 THR 72 HG1 THR 72 0.940 -12.817 6.073 543 HG21 THR 72 HG21 THR 72 4.011 -11.284 5.840 544 HG22 THR 72 HG22 THR 72 3.307 -12.148 7.205 545 HG23 THR 72 HG23 THR 72 2.318 -11.040 6.272 546 H ASN 73 H ASN 73 3.975 -14.278 2.926 547 HA ASN 73 HA ASN 73 2.227 -15.141 0.863 548 HB2 ASN 73 HB2 ASN 73 4.742 -16.381 1.942 549 HB3 ASN 73 HB3 ASN 73 3.744 -17.238 0.775 550 HD21 ASN 73 HD21 ASN 73 6.126 -14.828 1.225 551 HD22 ASN 73 HD22 ASN 73 6.205 -14.308 -0.401 552 H SER 74 H SER 74 2.253 -15.856 4.143 553 HA SER 74 HA SER 74 0.949 -18.393 3.922 554 HB2 SER 74 HB2 SER 74 1.218 -16.525 6.279 555 HB3 SER 74 HB3 SER 74 0.765 -18.231 6.342 556 HG SER 74 HG SER 74 2.788 -18.682 5.349 557 H GLY 75 H GLY 75 -0.097 -15.213 3.415 558 HA2 GLY 75 HA2 GLY 75 -2.265 -14.625 2.770 559 HA3 GLY 75 HA3 GLY 75 -2.875 -16.081 3.543 560 H GLN 76 H GLN 76 -0.760 -14.457 5.522 561 HA GLN 76 HA GLN 76 -2.953 -13.355 7.132 562 HB2 GLN 76 HB2 GLN 76 -1.247 -14.882 8.174 563 HB3 GLN 76 HB3 GLN 76 -0.012 -13.704 7.762 564 HG2 GLN 76 HG2 GLN 76 -1.156 -12.065 9.227 565 HG3 GLN 76 HG3 GLN 76 -2.285 -13.336 9.696 566 HE21 GLN 76 HE21 GLN 76 -1.540 -15.030 10.987 567 HE22 GLN 76 HE22 GLN 76 -0.055 -14.954 11.850 568 H VAL 77 H VAL 77 -3.013 -11.129 7.492 569 HA VAL 77 HA VAL 77 -1.631 -9.529 5.563 570 HB VAL 77 HB VAL 77 -3.987 -9.092 6.600 571 HG11 VAL 77 HG11 VAL 77 -3.361 -9.127 8.945 572 HG12 VAL 77 HG12 VAL 77 -4.058 -7.560 8.491 573 HG13 VAL 77 HG13 VAL 77 -2.309 -7.736 8.654 574 HG21 VAL 77 HG21 VAL 77 -2.983 -7.584 4.999 575 HG22 VAL 77 HG22 VAL 77 -2.045 -6.824 6.284 576 HG23 VAL 77 HG23 VAL 77 -3.800 -6.662 6.264 577 H VAL 78 H VAL 78 -0.084 -7.836 6.069 578 HA VAL 78 HA VAL 78 1.872 -8.658 7.924 579 HB VAL 78 HB VAL 78 1.523 -6.018 6.492 580 HG11 VAL 78 HG11 VAL 78 3.863 -5.552 7.006 581 HG12 VAL 78 HG12 VAL 78 3.972 -7.062 7.898 582 HG13 VAL 78 HG13 VAL 78 2.944 -5.758 8.503 583 HG21 VAL 78 HG21 VAL 78 3.282 -8.391 5.898 584 HG22 VAL 78 HG22 VAL 78 3.267 -6.880 4.990 585 HG23 VAL 78 HG23 VAL 78 1.838 -7.913 5.006 586 H LYS 79 H LYS 79 2.079 -8.263 9.937 587 HA LYS 79 HA LYS 79 -0.073 -7.208 11.419 588 HB2 LYS 79 HB2 LYS 79 1.249 -7.608 13.432 589 HB3 LYS 79 HB3 LYS 79 1.261 -8.978 12.327 590 HG2 LYS 79 HG2 LYS 79 3.394 -8.347 11.514 591 HG3 LYS 79 HG3 LYS 79 3.388 -6.916 12.551 592 HD2 LYS 79 HD2 LYS 79 4.747 -8.636 13.620 593 HD3 LYS 79 HD3 LYS 79 3.256 -8.420 14.528 594 HE2 LYS 79 HE2 LYS 79 2.301 -10.377 13.482 595 HE3 LYS 79 HE3 LYS 79 3.748 -10.588 12.497 596 HZ1 LYS 79 HZ1 LYS 79 3.576 -10.795 15.456 597 HZ2 LYS 79 HZ2 LYS 79 5.008 -10.865 14.565 598 HZ3 LYS 79 HZ3 LYS 79 3.839 -12.058 14.356 599 H SER 80 H SER 80 2.947 -5.737 10.496 600 HA SER 80 HA SER 80 2.451 -3.460 12.233 601 HB2 SER 80 HB2 SER 80 4.722 -4.495 11.999 602 HB3 SER 80 HB3 SER 80 4.742 -3.979 10.319 603 HG SER 80 HG SER 80 4.468 -2.270 12.548 604 H LEU 81 H LEU 81 1.086 -4.342 9.526 605 HA LEU 81 HA LEU 81 1.575 -2.410 7.574 606 HB2 LEU 81 HB2 LEU 81 0.300 -4.604 7.386 607 HB3 LEU 81 HB3 LEU 81 -1.074 -3.743 8.023 608 HG LEU 81 HG LEU 81 -0.837 -2.153 6.081 609 HD11 LEU 81 HD11 LEU 81 1.482 -2.715 5.526 610 HD12 LEU 81 HD12 LEU 81 0.402 -3.029 4.159 611 HD13 LEU 81 HD13 LEU 81 0.966 -4.365 5.165 612 HD21 LEU 81 HD21 LEU 81 -2.498 -3.965 6.247 613 HD22 LEU 81 HD22 LEU 81 -1.357 -5.045 5.459 614 HD23 LEU 81 HD23 LEU 81 -2.003 -3.651 4.584 615 HA PRO 82 HA PRO 82 -2.228 0.136 9.291 616 HB2 PRO 82 HB2 PRO 82 -2.778 -0.197 11.961 617 HB3 PRO 82 HB3 PRO 82 -3.665 -1.017 10.668 618 HG2 PRO 82 HG2 PRO 82 -1.404 -2.023 12.355 619 HG3 PRO 82 HG3 PRO 82 -2.903 -2.851 11.897 620 HD2 PRO 82 HD2 PRO 82 -0.613 -3.372 10.640 621 HD3 PRO 82 HD3 PRO 82 -2.144 -3.285 9.742 622 H GLY 83 H GLY 83 0.541 -0.744 11.175 623 HA2 GLY 83 HA2 GLY 83 0.760 1.621 12.736 624 HA3 GLY 83 HA3 GLY 83 2.047 0.460 12.440 625 H LEU 84 H LEU 84 2.280 0.579 9.710 626 HA LEU 84 HA LEU 84 3.783 2.961 9.415 627 HB2 LEU 84 HB2 LEU 84 4.423 2.186 7.254 628 HB3 LEU 84 HB3 LEU 84 4.328 0.778 8.275 629 HG LEU 84 HG LEU 84 1.877 0.682 7.146 630 HD11 LEU 84 HD11 LEU 84 2.029 1.227 4.771 631 HD12 LEU 84 HD12 LEU 84 3.617 1.936 5.033 632 HD13 LEU 84 HD13 LEU 84 2.197 2.659 5.784 633 HD21 LEU 84 HD21 LEU 84 2.817 -0.969 5.581 634 HD22 LEU 84 HD22 LEU 84 3.493 -1.148 7.202 635 HD23 LEU 84 HD23 LEU 84 4.436 -0.366 5.932 636 H LEU 85 H LEU 85 0.660 1.919 8.309 637 HA LEU 85 HA LEU 85 0.090 4.130 6.679 638 HB2 LEU 85 HB2 LEU 85 -1.804 2.334 8.191 639 HB3 LEU 85 HB3 LEU 85 -2.277 3.449 6.926 640 HG LEU 85 HG LEU 85 -0.460 1.065 6.550 641 HD11 LEU 85 HD11 LEU 85 -3.328 1.477 5.736 642 HD12 LEU 85 HD12 LEU 85 -2.753 0.394 7.002 643 HD13 LEU 85 HD13 LEU 85 -2.323 0.091 5.319 644 HD21 LEU 85 HD21 LEU 85 0.068 2.862 4.996 645 HD22 LEU 85 HD22 LEU 85 -1.636 2.998 4.554 646 HD23 LEU 85 HD23 LEU 85 -0.735 1.537 4.159 647 H THR 86 H THR 86 -0.380 3.566 10.090 648 HA THR 86 HA THR 86 -1.964 5.842 10.635 649 HB THR 86 HB THR 86 -0.086 4.359 12.500 650 HG1 THR 86 HG1 THR 86 -1.803 3.103 11.644 651 HG21 THR 86 HG21 THR 86 -0.620 6.598 13.386 652 HG22 THR 86 HG22 THR 86 -1.408 5.340 14.338 653 HG23 THR 86 HG23 THR 86 -2.337 6.277 13.165 654 H ILE 87 H ILE 87 1.560 5.404 10.808 655 HA ILE 87 HA ILE 87 1.964 8.034 11.735 656 HB ILE 87 HB ILE 87 3.554 6.285 12.290 657 HG12 ILE 87 HG12 ILE 87 4.427 8.676 12.126 658 HG13 ILE 87 HG13 ILE 87 5.644 7.415 12.101 659 HG21 ILE 87 HG21 ILE 87 4.272 6.091 9.396 660 HG22 ILE 87 HG22 ILE 87 3.441 4.898 10.381 661 HG23 ILE 87 HG23 ILE 87 5.131 5.295 10.717 662 HD11 ILE 87 HD11 ILE 87 4.600 8.885 9.693 663 HD12 ILE 87 HD12 ILE 87 5.905 7.705 9.700 664 HD13 ILE 87 HD13 ILE 87 6.102 9.253 10.536 665 H LEU 88 H LEU 88 2.183 6.655 8.473 666 HA LEU 88 HA LEU 88 2.941 9.116 7.294 667 HB2 LEU 88 HB2 LEU 88 1.826 6.599 6.172 668 HB3 LEU 88 HB3 LEU 88 1.868 8.026 5.171 669 HG LEU 88 HG LEU 88 3.746 6.631 4.669 670 HD11 LEU 88 HD11 LEU 88 5.607 8.148 5.011 671 HD12 LEU 88 HD12 LEU 88 4.657 9.053 6.184 672 HD13 LEU 88 HD13 LEU 88 4.147 8.990 4.498 673 HD21 LEU 88 HD21 LEU 88 5.457 6.087 6.242 674 HD22 LEU 88 HD22 LEU 88 3.912 5.435 6.784 675 HD23 LEU 88 HD23 LEU 88 4.569 6.897 7.538 676 H HIS 89 H HIS 89 -0.184 7.737 7.981 677 HA HIS 89 HA HIS 89 -1.687 9.675 6.602 678 HB2 HIS 89 HB2 HIS 89 -2.641 7.531 7.425 679 HB3 HIS 89 HB3 HIS 89 -2.464 8.096 9.078 680 HD1 HIS 89 HD1 HIS 89 -4.390 9.422 10.011 681 HD2 HIS 89 HD2 HIS 89 -4.598 8.977 5.897 682 HE1 HIS 89 HE1 HIS 89 -6.641 10.325 9.318 683 H ASP 90 H ASP 90 -0.206 9.630 9.770 684 HA ASP 90 HA ASP 90 -1.344 12.031 10.784 685 HB2 ASP 90 HB2 ASP 90 -0.284 10.466 12.298 686 HB3 ASP 90 HB3 ASP 90 1.246 10.618 11.445 687 H GLY 91 H GLY 91 1.377 11.338 8.727 688 HA2 GLY 91 HA2 GLY 91 2.353 14.067 8.776 689 HA3 GLY 91 HA3 GLY 91 2.991 12.742 7.804 690 H GLY 92 H GLY 92 -0.077 12.442 7.170 691 HA2 GLY 92 HA2 GLY 92 -1.604 13.303 5.645 692 HA3 GLY 92 HA3 GLY 92 -0.570 14.717 5.461 693 H TYR 93 H TYR 93 0.045 11.262 4.932 694 HA TYR 93 HA TYR 93 0.817 11.960 2.198 695 HB2 TYR 93 HB2 TYR 93 1.827 9.768 4.012 696 HB3 TYR 93 HB3 TYR 93 2.169 9.809 2.294 697 HD1 TYR 93 HD1 TYR 93 2.718 11.609 5.491 698 HD2 TYR 93 HD2 TYR 93 3.825 11.254 1.405 699 HE1 TYR 93 HE1 TYR 93 4.639 13.095 5.886 700 HE2 TYR 93 HE2 TYR 93 5.741 12.728 1.786 701 HH TYR 93 HH TYR 93 6.895 13.548 4.821 702 H ARG 94 H ARG 94 -0.027 10.927 0.512 703 HA ARG 94 HA ARG 94 -2.351 9.258 0.965 704 HB2 ARG 94 HB2 ARG 94 -2.728 9.424 -1.462 705 HB3 ARG 94 HB3 ARG 94 -2.520 11.016 -0.754 706 HG2 ARG 94 HG2 ARG 94 -0.304 11.175 -1.606 707 HG3 ARG 94 HG3 ARG 94 -0.338 9.499 -2.181 708 HD2 ARG 94 HD2 ARG 94 -2.164 10.167 -3.721 709 HD3 ARG 94 HD3 ARG 94 -1.978 11.830 -3.171 710 HE ARG 94 HE ARG 94 0.527 11.210 -3.960 711 HH11 ARG 94 HH11 ARG 94 -2.620 10.942 -5.595 712 HH12 ARG 94 HH12 ARG 94 -1.942 11.023 -7.158 713 HH21 ARG 94 HH21 ARG 94 1.399 11.333 -6.146 714 HH22 ARG 94 HH22 ARG 94 0.337 11.221 -7.478 715 H ASP 95 H ASP 95 -2.588 7.390 -0.673 716 HA ASP 95 HA ASP 95 -0.974 5.268 0.081 717 HB2 ASP 95 HB2 ASP 95 -2.176 4.028 -1.643 718 HB3 ASP 95 HB3 ASP 95 -3.291 5.091 -0.788 719 H THR 96 H THR 96 -0.948 7.228 -2.811 720 HA THR 96 HA THR 96 0.926 5.817 -4.273 721 HB THR 96 HB THR 96 0.412 8.795 -4.379 722 HG1 THR 96 HG1 THR 96 -1.258 6.670 -4.790 723 HG21 THR 96 HG21 THR 96 2.309 7.922 -5.741 724 HG22 THR 96 HG22 THR 96 0.987 8.537 -6.742 725 HG23 THR 96 HG23 THR 96 1.191 6.800 -6.512 726 H GLU 97 H GLU 97 1.339 8.415 -1.894 727 HA GLU 97 HA GLU 97 4.145 8.766 -2.256 728 HB2 GLU 97 HB2 GLU 97 2.669 9.185 0.337 729 HB3 GLU 97 HB3 GLU 97 4.142 9.967 -0.212 730 HG2 GLU 97 HG2 GLU 97 1.379 10.362 -1.266 731 HG3 GLU 97 HG3 GLU 97 2.277 11.504 -0.274 732 H ILE 98 H ILE 98 2.123 6.680 -0.275 733 HA ILE 98 HA ILE 98 4.085 5.662 1.483 734 HB ILE 98 HB ILE 98 1.797 4.014 0.386 735 HG12 ILE 98 HG12 ILE 98 0.753 6.090 1.090 736 HG13 ILE 98 HG13 ILE 98 0.412 4.826 2.269 737 HG21 ILE 98 HG21 ILE 98 3.177 3.991 3.045 738 HG22 ILE 98 HG22 ILE 98 3.370 2.805 1.749 739 HG23 ILE 98 HG23 ILE 98 1.823 2.954 2.593 740 HD11 ILE 98 HD11 ILE 98 2.476 6.977 2.558 741 HD12 ILE 98 HD12 ILE 98 2.077 5.733 3.744 742 HD13 ILE 98 HD13 ILE 98 0.878 6.956 3.310 743 H MET 99 H MET 99 2.836 4.536 -1.591 744 HA MET 99 HA MET 99 4.503 2.248 -1.717 745 HB2 MET 99 HB2 MET 99 2.934 3.621 -3.872 746 HB3 MET 99 HB3 MET 99 3.764 2.080 -4.045 747 HG2 MET 99 HG2 MET 99 2.353 1.110 -2.322 748 HG3 MET 99 HG3 MET 99 1.536 2.664 -2.145 749 HE1 MET 99 HE1 MET 99 -0.113 3.694 -3.776 750 HE2 MET 99 HE2 MET 99 -0.363 3.148 -5.432 751 HE3 MET 99 HE3 MET 99 1.194 3.812 -4.949 752 H ARG 100 H ARG 100 4.950 5.538 -2.564 753 HA ARG 100 HA ARG 100 6.822 5.408 -4.621 754 HB2 ARG 100 HB2 ARG 100 5.640 7.446 -3.782 755 HB3 ARG 100 HB3 ARG 100 6.594 7.387 -2.327 756 HG2 ARG 100 HG2 ARG 100 7.732 7.890 -5.084 757 HG3 ARG 100 HG3 ARG 100 7.222 9.159 -3.977 758 HD2 ARG 100 HD2 ARG 100 8.835 8.107 -2.323 759 HD3 ARG 100 HD3 ARG 100 9.509 7.224 -3.692 760 HE ARG 100 HE ARG 100 9.527 10.102 -3.239 761 HH11 ARG 100 HH11 ARG 100 10.574 7.458 -5.322 762 HH12 ARG 100 HH12 ARG 100 11.891 8.294 -5.989 763 HH21 ARG 100 HH21 ARG 100 11.319 11.254 -4.095 764 HH22 ARG 100 HH22 ARG 100 12.356 10.539 -5.227 765 H TRP 101 H TRP 101 7.543 5.884 -1.169 766 HA TRP 101 HA TRP 101 10.265 5.138 -1.518 767 HB2 TRP 101 HB2 TRP 101 10.328 5.170 1.030 768 HB3 TRP 101 HB3 TRP 101 9.914 6.674 0.224 769 HD1 TRP 101 HD1 TRP 101 7.539 7.685 0.680 770 HE1 TRP 101 HE1 TRP 101 5.698 7.175 2.381 771 HE3 TRP 101 HE3 TRP 101 9.140 3.083 2.315 772 HZ2 TRP 101 HZ2 TRP 101 5.013 5.135 4.175 773 HZ3 TRP 101 HZ3 TRP 101 7.833 1.951 4.020 774 HH2 TRP 101 HH2 TRP 101 5.804 2.943 4.939 775 H LEU 102 H LEU 102 7.431 3.409 -0.616 776 HA LEU 102 HA LEU 102 8.603 1.242 0.707 777 HB2 LEU 102 HB2 LEU 102 6.247 2.035 0.825 778 HB3 LEU 102 HB3 LEU 102 6.018 1.376 -0.766 779 HG LEU 102 HG LEU 102 6.197 -0.857 0.010 780 HD11 LEU 102 HD11 LEU 102 6.975 0.374 2.663 781 HD12 LEU 102 HD12 LEU 102 7.999 -0.598 1.584 782 HD13 LEU 102 HD13 LEU 102 6.626 -1.335 2.391 783 HD21 LEU 102 HD21 LEU 102 4.066 0.276 0.357 784 HD22 LEU 102 HD22 LEU 102 4.645 0.814 1.935 785 HD23 LEU 102 HD23 LEU 102 4.376 -0.911 1.639 786 H PHE 103 H PHE 103 7.757 1.710 -2.705 787 HA PHE 103 HA PHE 103 8.607 -1.007 -3.242 788 HB2 PHE 103 HB2 PHE 103 7.185 1.045 -4.901 789 HB3 PHE 103 HB3 PHE 103 7.888 -0.394 -5.632 790 HD1 PHE 103 HD1 PHE 103 5.450 0.707 -3.020 791 HD2 PHE 103 HD2 PHE 103 6.744 -2.408 -5.622 792 HE1 PHE 103 HE1 PHE 103 3.426 -0.589 -2.495 793 HE2 PHE 103 HE2 PHE 103 4.717 -3.689 -5.085 794 HZ PHE 103 HZ PHE 103 3.061 -2.775 -3.533 795 H THR 104 H THR 104 10.307 1.577 -2.719 796 HA THR 104 HA THR 104 12.009 1.459 -5.055 797 HB THR 104 HB THR 104 12.332 2.989 -2.450 798 HG1 THR 104 HG1 THR 104 10.537 3.645 -3.842 799 HG21 THR 104 HG21 THR 104 13.819 3.258 -5.072 800 HG22 THR 104 HG22 THR 104 14.483 2.598 -3.577 801 HG23 THR 104 HG23 THR 104 14.027 4.298 -3.658 802 HA PRO 105 HA PRO 105 14.427 -1.795 -2.954 803 HB2 PRO 105 HB2 PRO 105 16.100 -1.583 -5.381 804 HB3 PRO 105 HB3 PRO 105 15.265 -2.999 -4.740 805 HG2 PRO 105 HG2 PRO 105 14.448 -1.773 -6.993 806 HG3 PRO 105 HG3 PRO 105 13.306 -2.513 -5.856 807 HD2 PRO 105 HD2 PRO 105 14.021 0.377 -6.208 808 HD3 PRO 105 HD3 PRO 105 12.434 -0.375 -5.930 809 H ASP 106 H ASP 106 16.047 -1.275 -1.587 810 HA ASP 106 HA ASP 106 17.567 1.145 -2.241 811 HB2 ASP 106 HB2 ASP 106 15.999 1.434 -0.378 812 HB3 ASP 106 HB3 ASP 106 16.795 0.119 0.479 813 HA PRO 107 HA PRO 107 21.000 -1.705 -2.319 814 HB2 PRO 107 HB2 PRO 107 22.969 0.209 -2.352 815 HB3 PRO 107 HB3 PRO 107 22.082 -0.327 -3.783 816 HG2 PRO 107 HG2 PRO 107 21.619 2.069 -2.056 817 HG3 PRO 107 HG3 PRO 107 21.600 1.957 -3.824 818 HD2 PRO 107 HD2 PRO 107 19.344 2.026 -2.426 819 HD3 PRO 107 HD3 PRO 107 19.483 0.976 -3.855 820 H SER 108 H SER 108 20.645 0.888 -0.006 821 HA SER 108 HA SER 108 22.726 -0.215 1.662 822 HB2 SER 108 HB2 SER 108 21.974 1.851 3.072 823 HB3 SER 108 HB3 SER 108 22.962 2.056 1.620 824 HG SER 108 HG SER 108 20.114 2.166 1.573 825 H LEU 109 H LEU 109 19.607 -0.977 1.194 826 HA LEU 109 HA LEU 109 19.119 -1.468 4.017 827 HB2 LEU 109 HB2 LEU 109 17.380 -0.381 2.631 828 HB3 LEU 109 HB3 LEU 109 17.295 -1.827 1.639 829 HG LEU 109 HG LEU 109 16.581 -3.077 3.677 830 HD11 LEU 109 HD11 LEU 109 16.426 -0.320 4.873 831 HD12 LEU 109 HD12 LEU 109 17.484 -1.636 5.392 832 HD13 LEU 109 HD13 LEU 109 15.738 -1.777 5.583 833 HD21 LEU 109 HD21 LEU 109 14.309 -2.213 3.669 834 HD22 LEU 109 HD22 LEU 109 14.979 -2.307 2.039 835 HD23 LEU 109 HD23 LEU 109 14.869 -0.744 2.859 836 H THR 110 H THR 110 19.394 -3.410 4.774 837 HA THR 110 HA THR 110 19.887 -5.609 2.876 838 HB THR 110 HB THR 110 21.218 -5.229 5.574 839 HG1 THR 110 HG1 THR 110 21.681 -3.668 3.860 840 HG21 THR 110 HG21 THR 110 21.865 -7.051 3.236 841 HG22 THR 110 HG22 THR 110 21.120 -7.552 4.753 842 HG23 THR 110 HG23 THR 110 22.777 -6.948 4.743 843 H ILE 111 H ILE 111 18.313 -7.042 3.048 844 HA ILE 111 HA ILE 111 16.947 -7.387 5.640 845 HB ILE 111 HB ILE 111 15.754 -7.243 2.895 846 HG12 ILE 111 HG12 ILE 111 16.488 -5.069 3.661 847 HG13 ILE 111 HG13 ILE 111 14.740 -5.128 3.506 848 HG21 ILE 111 HG21 ILE 111 14.474 -8.734 4.244 849 HG22 ILE 111 HG22 ILE 111 13.586 -7.246 3.914 850 HG23 ILE 111 HG23 ILE 111 14.318 -7.497 5.510 851 HD11 ILE 111 HD11 ILE 111 16.359 -5.249 6.062 852 HD12 ILE 111 HD12 ILE 111 14.605 -5.422 5.981 853 HD13 ILE 111 HD13 ILE 111 15.363 -3.906 5.506 854 H THR 112 H THR 112 16.272 -9.440 5.971 855 HA THR 112 HA THR 112 16.813 -11.379 3.879 856 HB THR 112 HB THR 112 18.207 -11.914 5.758 857 HG1 THR 112 HG1 THR 112 17.627 -13.718 4.915 858 HG21 THR 112 HG21 THR 112 17.312 -12.484 8.003 859 HG22 THR 112 HG22 THR 112 15.711 -11.985 7.461 860 HG23 THR 112 HG23 THR 112 17.010 -10.800 7.577 861 H ARG 113 H ARG 113 15.170 -12.419 3.188 862 HA ARG 113 HA ARG 113 12.591 -11.575 4.330 863 HB2 ARG 113 HB2 ARG 113 13.432 -10.909 1.930 864 HB3 ARG 113 HB3 ARG 113 12.850 -12.514 1.519 865 HG2 ARG 113 HG2 ARG 113 10.651 -11.713 2.697 866 HG3 ARG 113 HG3 ARG 113 11.316 -10.110 2.385 867 HD2 ARG 113 HD2 ARG 113 9.960 -10.679 0.530 868 HD3 ARG 113 HD3 ARG 113 11.661 -10.828 0.041 869 HE ARG 113 HE ARG 113 10.236 -13.174 1.005 870 HH11 ARG 113 HH11 ARG 113 11.695 -11.469 -1.721 871 HH12 ARG 113 HH12 ARG 113 11.764 -12.842 -2.735 872 HH21 ARG 113 HH21 ARG 113 10.369 -15.043 -0.314 873 HH22 ARG 113 HH22 ARG 113 11.005 -14.970 -1.893 874 H ASP 114 H ASP 114 10.781 -13.109 3.798 875 HA ASP 114 HA ASP 114 11.197 -15.617 4.878 876 HB2 ASP 114 HB2 ASP 114 8.892 -16.032 4.358 877 HB3 ASP 114 HB3 ASP 114 9.031 -14.338 4.789 878 H GLY 115 H GLY 115 11.549 -17.581 4.016 879 HA2 GLY 115 HA2 GLY 115 11.778 -19.183 2.313 880 HA3 GLY 115 HA3 GLY 115 11.698 -17.889 1.120 881 H SER 116 H SER 116 13.733 -16.383 2.909 882 HA SER 116 HA SER 116 16.040 -17.701 1.756 883 HB2 SER 116 HB2 SER 116 15.624 -14.791 2.470 884 HB3 SER 116 HB3 SER 116 16.998 -15.475 1.598 885 HG SER 116 HG SER 116 14.352 -15.765 0.676 886 H ARG 117 H ARG 117 17.717 -17.961 3.057 887 HA ARG 117 HA ARG 117 17.269 -17.781 5.963 888 HB2 ARG 117 HB2 ARG 117 19.354 -19.194 6.115 889 HB3 ARG 117 HB3 ARG 117 17.957 -19.936 5.345 890 HG2 ARG 117 HG2 ARG 117 18.902 -19.730 3.200 891 HG3 ARG 117 HG3 ARG 117 20.145 -18.617 3.774 892 HD2 ARG 117 HD2 ARG 117 19.895 -21.417 4.770 893 HD3 ARG 117 HD3 ARG 117 20.855 -21.011 3.337 894 HE ARG 117 HE ARG 117 21.859 -19.320 5.107 895 HH11 ARG 117 HH11 ARG 117 21.173 -22.765 5.517 896 HH12 ARG 117 HH12 ARG 117 22.461 -23.043 6.585 897 HH21 ARG 117 HH21 ARG 117 23.582 -19.661 6.598 898 HH22 ARG 117 HH22 ARG 117 23.882 -21.212 7.213 899 H ASP 118 H ASP 118 19.227 -16.426 3.496 900 HA ASP 118 HA ASP 118 20.968 -15.158 5.478 901 HB2 ASP 118 HB2 ASP 118 22.469 -14.677 3.532 902 HB3 ASP 118 HB3 ASP 118 22.253 -16.395 3.864 903 H ALA 119 H ALA 119 21.729 -12.957 4.794 904 HA ALA 119 HA ALA 119 19.353 -11.362 4.274 905 HB1 ALA 119 HB1 ALA 119 20.700 -10.862 6.274 906 HB2 ALA 119 HB2 ALA 119 20.624 -9.504 5.161 907 HB3 ALA 119 HB3 ALA 119 22.080 -10.504 5.234 908 H VAL 120 H VAL 120 19.115 -10.049 2.613 909 HA VAL 120 HA VAL 120 21.115 -10.230 0.496 910 HB VAL 120 HB VAL 120 18.147 -9.633 0.296 911 HG11 VAL 120 HG11 VAL 120 19.424 -8.650 -1.519 912 HG12 VAL 120 HG12 VAL 120 18.428 -9.981 -2.107 913 HG13 VAL 120 HG13 VAL 120 20.161 -10.214 -1.866 914 HG21 VAL 120 HG21 VAL 120 19.601 -12.201 -0.329 915 HG22 VAL 120 HG22 VAL 120 17.898 -11.884 -0.659 916 HG23 VAL 120 HG23 VAL 120 18.478 -11.939 1.007 917 H SER 121 H SER 121 22.040 -8.369 -0.064 918 HA SER 121 HA SER 121 21.175 -5.864 1.140 919 HB2 SER 121 HB2 SER 121 23.396 -6.437 -0.852 920 HB3 SER 121 HB3 SER 121 23.181 -4.953 0.076 921 HG SER 121 HG SER 121 23.398 -7.389 1.457 922 H ASN 122 H ASN 122 20.139 -4.281 0.085 923 HA ASN 122 HA ASN 122 19.039 -3.156 -1.463 924 HB2 ASN 122 HB2 ASN 122 20.804 -3.512 -3.156 925 HB3 ASN 122 HB3 ASN 122 20.147 -5.090 -3.523 926 HD21 ASN 122 HD21 ASN 122 19.637 -4.765 -5.595 927 HD22 ASN 122 HD22 ASN 122 18.448 -3.648 -6.146 928 H ALA 123 H ALA 123 17.474 -4.216 -0.035 929 HA ALA 123 HA ALA 123 15.597 -5.701 -1.721 930 HB1 ALA 123 HB1 ALA 123 16.241 -6.919 0.314 931 HB2 ALA 123 HB2 ALA 123 14.546 -6.432 0.383 932 HB3 ALA 123 HB3 ALA 123 15.758 -5.532 1.292 933 H ARG 124 H ARG 124 13.226 -5.098 -0.964 934 HA ARG 124 HA ARG 124 13.098 -2.171 -0.994 935 HB2 ARG 124 HB2 ARG 124 10.833 -4.173 -1.237 936 HB3 ARG 124 HB3 ARG 124 10.788 -2.470 -1.640 937 HG2 ARG 124 HG2 ARG 124 12.254 -2.871 -3.547 938 HG3 ARG 124 HG3 ARG 124 12.348 -4.580 -3.108 939 HD2 ARG 124 HD2 ARG 124 9.845 -4.677 -3.315 940 HD3 ARG 124 HD3 ARG 124 9.905 -3.052 -3.989 941 HE ARG 124 HE ARG 124 11.668 -4.575 -5.446 942 HH11 ARG 124 HH11 ARG 124 8.145 -4.469 -4.916 943 HH12 ARG 124 HH12 ARG 124 7.777 -5.336 -6.349 944 HH21 ARG 124 HH21 ARG 124 11.084 -5.738 -7.450 945 HH22 ARG 124 HH22 ARG 124 9.442 -6.040 -7.787 946 HA PRO 125 HA PRO 125 11.734 -2.298 3.296 947 HB2 PRO 125 HB2 PRO 125 9.564 -0.384 2.636 948 HB3 PRO 125 HB3 PRO 125 10.879 -0.226 3.790 949 HG2 PRO 125 HG2 PRO 125 10.870 1.142 1.479 950 HG3 PRO 125 HG3 PRO 125 12.366 0.560 2.233 951 HD2 PRO 125 HD2 PRO 125 10.874 -0.521 -0.113 952 HD3 PRO 125 HD3 PRO 125 12.625 -0.435 0.174 953 H VAL 126 H VAL 126 9.603 -2.745 0.622 954 HA VAL 126 HA VAL 126 7.334 -3.871 1.845 955 HB VAL 126 HB VAL 126 8.620 -4.603 -0.823 956 HG11 VAL 126 HG11 VAL 126 6.473 -5.566 -1.424 957 HG12 VAL 126 HG12 VAL 126 5.870 -5.230 0.200 958 HG13 VAL 126 HG13 VAL 126 7.173 -6.398 -0.032 959 HG21 VAL 126 HG21 VAL 126 6.914 -3.206 -1.810 960 HG22 VAL 126 HG22 VAL 126 7.874 -2.274 -0.660 961 HG23 VAL 126 HG23 VAL 126 6.261 -2.851 -0.214 962 H ASP 127 H ASP 127 10.428 -5.283 0.826 963 HA ASP 127 HA ASP 127 9.847 -7.964 1.468 964 HB2 ASP 127 HB2 ASP 127 12.499 -6.516 1.338 965 HB3 ASP 127 HB3 ASP 127 12.333 -8.255 1.521 966 H ALA 128 H ALA 128 11.200 -5.293 3.191 967 HA ALA 128 HA ALA 128 12.043 -6.667 5.487 968 HB1 ALA 128 HB1 ALA 128 12.810 -4.411 4.920 969 HB2 ALA 128 HB2 ALA 128 12.171 -4.499 6.564 970 HB3 ALA 128 HB3 ALA 128 11.201 -3.787 5.275 971 H LEU 129 H LEU 129 9.010 -4.874 4.910 972 HA LEU 129 HA LEU 129 7.975 -5.487 7.496 973 HB2 LEU 129 HB2 LEU 129 5.841 -4.606 6.673 974 HB3 LEU 129 HB3 LEU 129 7.170 -3.523 6.360 975 HG LEU 129 HG LEU 129 7.149 -4.707 4.021 976 HD11 LEU 129 HD11 LEU 129 4.920 -5.292 3.248 977 HD12 LEU 129 HD12 LEU 129 4.299 -5.007 4.881 978 HD13 LEU 129 HD13 LEU 129 5.460 -6.310 4.600 979 HD21 LEU 129 HD21 LEU 129 5.631 -2.945 3.198 980 HD22 LEU 129 HD22 LEU 129 6.837 -2.341 4.339 981 HD23 LEU 129 HD23 LEU 129 5.171 -2.603 4.865 982 H HIS 130 H HIS 130 7.729 -7.054 4.422 983 HA HIS 130 HA HIS 130 5.726 -8.936 5.118 984 HB2 HIS 130 HB2 HIS 130 6.396 -8.229 2.805 985 HB3 HIS 130 HB3 HIS 130 7.916 -9.068 3.027 986 HD1 HIS 130 HD1 HIS 130 4.460 -9.561 1.880 987 HD2 HIS 130 HD2 HIS 130 7.602 -11.937 3.190 988 HE1 HIS 130 HE1 HIS 130 4.007 -11.865 1.009 989 H ALA 131 H ALA 131 9.076 -8.630 5.620 990 HA ALA 131 HA ALA 131 9.393 -11.433 6.443 991 HB1 ALA 131 HB1 ALA 131 11.504 -9.313 6.186 992 HB2 ALA 131 HB2 ALA 131 11.043 -10.449 4.928 993 HB3 ALA 131 HB3 ALA 131 11.765 -11.043 6.430 994 H HIS 132 H HIS 132 8.208 -8.942 7.920 995 HA HIS 132 HA HIS 132 7.803 -8.373 10.093 996 HB2 HIS 132 HB2 HIS 132 7.767 -10.898 10.349 997 HB3 HIS 132 HB3 HIS 132 9.452 -10.819 10.826 998 HD1 HIS 132 HD1 HIS 132 9.885 -10.432 13.312 999 HD2 HIS 132 HD2 HIS 132 5.974 -9.656 12.177 1000 HE1 HIS 132 HE1 HIS 132 8.581 -10.143 15.454 1001 H GLN 133 H GLN 133 10.193 -7.483 8.648 1002 HA GLN 133 HA GLN 133 11.882 -6.666 10.909 1003 HB2 GLN 133 HB2 GLN 133 12.558 -6.438 7.964 1004 HB3 GLN 133 HB3 GLN 133 13.643 -6.176 9.319 1005 HG2 GLN 133 HG2 GLN 133 13.074 -8.668 9.865 1006 HG3 GLN 133 HG3 GLN 133 12.638 -8.726 8.165 1007 HE21 GLN 133 HE21 GLN 133 14.746 -6.641 7.622 1008 HE22 GLN 133 HE22 GLN 133 16.242 -7.486 7.696 1009 H ALA 134 H ALA 134 9.338 -5.800 10.194 1010 HA ALA 134 HA ALA 134 9.031 -3.549 8.663 1011 HB1 ALA 134 HB1 ALA 134 7.478 -4.248 11.132 1012 HB2 ALA 134 HB2 ALA 134 7.209 -4.925 9.525 1013 HB3 ALA 134 HB3 ALA 134 6.957 -3.203 9.813 1014 H ARG 135 H ARG 135 10.345 -3.774 11.860 1015 HA ARG 135 HA ARG 135 10.041 -1.169 12.835 1016 HB2 ARG 135 HB2 ARG 135 12.560 -2.823 13.044 1017 HB3 ARG 135 HB3 ARG 135 12.103 -1.498 14.093 1018 HG2 ARG 135 HG2 ARG 135 10.665 -4.126 13.856 1019 HG3 ARG 135 HG3 ARG 135 11.776 -3.668 15.144 1020 HD2 ARG 135 HD2 ARG 135 10.261 -1.840 15.777 1021 HD3 ARG 135 HD3 ARG 135 9.143 -2.335 14.501 1022 HE ARG 135 HE ARG 135 9.627 -4.568 15.987 1023 HH11 ARG 135 HH11 ARG 135 8.167 -1.397 16.628 1024 HH12 ARG 135 HH12 ARG 135 7.195 -1.986 17.892 1025 HH21 ARG 135 HH21 ARG 135 8.331 -5.313 17.705 1026 HH22 ARG 135 HH22 ARG 135 7.272 -4.251 18.530 1027 H GLU 136 H GLU 136 12.348 -2.402 10.414 1028 HA GLU 136 HA GLU 136 13.784 0.053 10.271 1029 HB2 GLU 136 HB2 GLU 136 13.743 -2.266 8.329 1030 HB3 GLU 136 HB3 GLU 136 14.859 -0.908 8.243 1031 HG2 GLU 136 HG2 GLU 136 15.590 -1.527 10.573 1032 HG3 GLU 136 HG3 GLU 136 14.670 -3.008 10.374 1033 H VAL 137 H VAL 137 10.989 -1.215 8.782 1034 HA VAL 137 HA VAL 137 10.833 0.650 6.611 1035 HB VAL 137 HB VAL 137 8.590 -0.927 7.909 1036 HG11 VAL 137 HG11 VAL 137 7.796 0.882 6.477 1037 HG12 VAL 137 HG12 VAL 137 7.446 -0.690 5.760 1038 HG13 VAL 137 HG13 VAL 137 8.791 0.277 5.151 1039 HG21 VAL 137 HG21 VAL 137 10.364 -2.420 7.202 1040 HG22 VAL 137 HG22 VAL 137 10.367 -1.676 5.607 1041 HG23 VAL 137 HG23 VAL 137 8.962 -2.592 6.144 1042 H VAL 138 H VAL 138 9.410 0.325 9.817 1043 HA VAL 138 HA VAL 138 7.839 2.636 9.790 1044 HB VAL 138 HB VAL 138 9.138 1.349 12.208 1045 HG11 VAL 138 HG11 VAL 138 7.294 2.381 13.490 1046 HG12 VAL 138 HG12 VAL 138 6.736 3.182 12.022 1047 HG13 VAL 138 HG13 VAL 138 8.309 3.593 12.705 1048 HG21 VAL 138 HG21 VAL 138 7.004 0.160 12.491 1049 HG22 VAL 138 HG22 VAL 138 7.783 -0.256 10.965 1050 HG23 VAL 138 HG23 VAL 138 6.419 0.863 10.983 1051 H ARG 139 H ARG 139 11.200 2.163 10.870 1052 HA ARG 139 HA ARG 139 11.501 4.803 11.771 1053 HB2 ARG 139 HB2 ARG 139 13.878 4.442 11.878 1054 HB3 ARG 139 HB3 ARG 139 13.065 2.956 12.346 1055 HG2 ARG 139 HG2 ARG 139 13.531 2.005 10.151 1056 HG3 ARG 139 HG3 ARG 139 14.321 3.497 9.666 1057 HD2 ARG 139 HD2 ARG 139 15.206 1.667 11.902 1058 HD3 ARG 139 HD3 ARG 139 15.991 1.858 10.334 1059 HE ARG 139 HE ARG 139 15.813 4.369 11.512 1060 HH11 ARG 139 HH11 ARG 139 17.673 1.355 11.929 1061 HH12 ARG 139 HH12 ARG 139 18.896 2.089 12.846 1062 HH21 ARG 139 HH21 ARG 139 17.466 5.336 12.809 1063 HH22 ARG 139 HH22 ARG 139 18.768 4.414 13.401 1064 H ARG 140 H ARG 140 12.000 3.412 8.555 1065 HA ARG 140 HA ARG 140 12.939 5.814 7.387 1066 HB2 ARG 140 HB2 ARG 140 11.662 3.381 6.185 1067 HB3 ARG 140 HB3 ARG 140 12.187 4.755 5.224 1068 HG2 ARG 140 HG2 ARG 140 14.463 4.458 6.105 1069 HG3 ARG 140 HG3 ARG 140 13.904 3.016 6.962 1070 HD2 ARG 140 HD2 ARG 140 13.294 1.988 4.917 1071 HD3 ARG 140 HD3 ARG 140 13.701 3.436 3.996 1072 HE ARG 140 HE ARG 140 15.783 2.201 5.598 1073 HH11 ARG 140 HH11 ARG 140 14.398 2.718 2.346 1074 HH12 ARG 140 HH12 ARG 140 15.837 2.368 1.533 1075 HH21 ARG 140 HH21 ARG 140 17.776 1.695 4.436 1076 HH22 ARG 140 HH22 ARG 140 17.819 1.759 2.738 1077 H ALA 141 H ALA 141 9.779 4.403 7.823 1078 HA ALA 141 HA ALA 141 8.222 6.159 6.332 1079 HB1 ALA 141 HB1 ALA 141 6.393 5.460 7.858 1080 HB2 ALA 141 HB2 ALA 141 7.598 4.706 8.899 1081 HB3 ALA 141 HB3 ALA 141 7.352 4.105 7.258 1082 H GLN 142 H GLN 142 9.312 6.331 9.678 1083 HA GLN 142 HA GLN 142 8.078 8.754 10.408 1084 HB2 GLN 142 HB2 GLN 142 10.676 7.584 11.380 1085 HB3 GLN 142 HB3 GLN 142 9.766 8.854 12.185 1086 HG2 GLN 142 HG2 GLN 142 7.975 7.344 12.660 1087 HG3 GLN 142 HG3 GLN 142 8.718 6.085 11.674 1088 HE21 GLN 142 HE21 GLN 142 7.975 5.992 14.445 1089 HE22 GLN 142 HE22 GLN 142 9.411 5.629 15.325 1090 H ALA 143 H ALA 143 11.261 8.046 9.067 1091 HA ALA 143 HA ALA 143 12.276 10.675 9.075 1092 HB1 ALA 143 HB1 ALA 143 13.673 8.659 8.861 1093 HB2 ALA 143 HB2 ALA 143 13.987 9.826 7.578 1094 HB3 ALA 143 HB3 ALA 143 13.016 8.393 7.248 1095 H MET 144 H MET 144 10.522 8.824 6.686 1096 HA MET 144 HA MET 144 10.711 10.704 4.575 1097 HB2 MET 144 HB2 MET 144 10.227 8.302 4.255 1098 HB3 MET 144 HB3 MET 144 8.669 8.527 5.033 1099 HG2 MET 144 HG2 MET 144 8.389 8.461 2.658 1100 HG3 MET 144 HG3 MET 144 8.021 10.080 3.255 1101 HE1 MET 144 HE1 MET 144 9.571 10.907 -0.208 1102 HE2 MET 144 HE2 MET 144 8.189 11.121 0.861 1103 HE3 MET 144 HE3 MET 144 8.532 9.534 0.164 1104 H ALA 145 H ALA 145 8.486 10.240 7.207 1105 HA ALA 145 HA ALA 145 6.546 12.053 6.128 1106 HB1 ALA 145 HB1 ALA 145 6.681 10.856 8.886 1107 HB2 ALA 145 HB2 ALA 145 5.866 10.139 7.502 1108 HB3 ALA 145 HB3 ALA 145 5.294 11.674 8.165 1109 H TYR 146 H TYR 146 8.753 12.107 8.927 1110 HA TYR 146 HA TYR 146 8.124 14.932 9.255 1111 HB2 TYR 146 HB2 TYR 146 9.740 13.121 11.072 1112 HB3 TYR 146 HB3 TYR 146 9.147 14.731 11.452 1113 HD1 TYR 146 HD1 TYR 146 6.583 15.036 11.595 1114 HD2 TYR 146 HD2 TYR 146 8.473 11.227 11.568 1115 HE1 TYR 146 HE1 TYR 146 4.559 14.020 12.566 1116 HE2 TYR 146 HE2 TYR 146 6.463 10.211 12.535 1117 HH TYR 146 HH TYR 146 3.469 11.910 12.779 Start of MODEL 24 1 H MET 1 H MET 1 13.400 21.339 4.362 2 HA MET 1 HA MET 1 11.285 20.941 3.314 3 HB2 MET 1 HB2 MET 1 10.312 20.758 6.180 4 HB3 MET 1 HB3 MET 1 9.259 20.920 4.790 5 HG2 MET 1 HG2 MET 1 9.959 18.748 3.971 6 HG3 MET 1 HG3 MET 1 11.106 18.597 5.302 7 HE1 MET 1 HE1 MET 1 10.085 16.234 5.866 8 HE2 MET 1 HE2 MET 1 8.895 16.385 4.577 9 HE3 MET 1 HE3 MET 1 8.376 15.939 6.203 10 HA PRO 2 HA PRO 2 11.146 25.375 3.937 11 HB2 PRO 2 HB2 PRO 2 9.167 25.932 2.118 12 HB3 PRO 2 HB3 PRO 2 10.850 25.670 1.647 13 HG2 PRO 2 HG2 PRO 2 8.524 23.813 1.503 14 HG3 PRO 2 HG3 PRO 2 9.878 24.000 0.377 15 HD2 PRO 2 HD2 PRO 2 9.678 21.975 2.206 16 HD3 PRO 2 HD3 PRO 2 11.225 22.589 1.584 17 H GLY 3 H GLY 3 10.264 25.851 5.828 18 HA2 GLY 3 HA2 GLY 3 8.488 26.492 7.214 19 HA3 GLY 3 HA3 GLY 3 7.381 25.583 6.180 20 H ARG 4 H ARG 4 9.261 25.511 8.959 21 HA ARG 4 HA ARG 4 9.651 22.675 9.076 22 HB2 ARG 4 HB2 ARG 4 10.006 24.870 11.089 23 HB3 ARG 4 HB3 ARG 4 10.125 23.192 11.570 24 HG2 ARG 4 HG2 ARG 4 12.329 24.207 11.189 25 HG3 ARG 4 HG3 ARG 4 12.028 22.864 10.097 26 HD2 ARG 4 HD2 ARG 4 11.638 24.364 8.265 27 HD3 ARG 4 HD3 ARG 4 11.632 25.759 9.342 28 HE ARG 4 HE ARG 4 14.009 24.950 9.838 29 HH11 ARG 4 HH11 ARG 4 12.580 24.773 6.579 30 HH12 ARG 4 HH12 ARG 4 14.040 25.149 5.800 31 HH21 ARG 4 HH21 ARG 4 15.958 25.436 8.753 32 HH22 ARG 4 HH22 ARG 4 16.019 25.531 7.061 33 H ALA 5 H ALA 5 8.471 21.164 9.935 34 HA ALA 5 HA ALA 5 6.738 20.014 10.662 35 HB1 ALA 5 HB1 ALA 5 7.261 21.054 12.843 36 HB2 ALA 5 HB2 ALA 5 5.541 20.711 12.665 37 HB3 ALA 5 HB3 ALA 5 6.135 22.359 12.474 38 HA PRO 6 HA PRO 6 3.729 21.967 7.852 39 HB2 PRO 6 HB2 PRO 6 3.639 19.323 6.620 40 HB3 PRO 6 HB3 PRO 6 4.098 20.858 5.885 41 HG2 PRO 6 HG2 PRO 6 5.884 18.882 6.344 42 HG3 PRO 6 HG3 PRO 6 6.323 20.597 6.401 43 HD2 PRO 6 HD2 PRO 6 5.704 18.731 8.662 44 HD3 PRO 6 HD3 PRO 6 7.011 19.931 8.516 45 H GLY 7 H GLY 7 1.567 21.755 8.060 46 HA2 GLY 7 HA2 GLY 7 -0.353 20.358 8.382 47 HA3 GLY 7 HA3 GLY 7 0.618 19.394 9.490 48 H SER 8 H SER 8 -1.680 21.770 9.301 49 HA SER 8 HA SER 8 -1.001 23.260 11.626 50 HB2 SER 8 HB2 SER 8 -3.436 23.965 11.355 51 HB3 SER 8 HB3 SER 8 -2.405 24.260 9.957 52 HG SER 8 HG SER 8 -4.601 23.081 9.786 53 H THR 9 H THR 9 -2.512 20.321 10.833 54 HA THR 9 HA THR 9 -2.528 19.317 13.499 55 HB THR 9 HB THR 9 -5.126 19.373 11.875 56 HG1 THR 9 HG1 THR 9 -4.102 21.243 13.430 57 HG21 THR 9 HG21 THR 9 -4.842 17.399 13.341 58 HG22 THR 9 HG22 THR 9 -6.159 18.433 13.893 59 HG23 THR 9 HG23 THR 9 -4.600 18.470 14.716 60 H LEU 10 H LEU 10 -2.671 16.907 13.280 61 HA LEU 10 HA LEU 10 -1.524 15.979 10.877 62 HB2 LEU 10 HB2 LEU 10 -2.764 14.483 13.177 63 HB3 LEU 10 HB3 LEU 10 -1.945 13.703 11.839 64 HG LEU 10 HG LEU 10 -0.668 15.642 13.754 65 HD11 LEU 10 HD11 LEU 10 0.519 13.690 14.618 66 HD12 LEU 10 HD12 LEU 10 -0.439 12.646 13.563 67 HD13 LEU 10 HD13 LEU 10 -1.221 13.554 14.852 68 HD21 LEU 10 HD21 LEU 10 1.443 14.844 12.716 69 HD22 LEU 10 HD22 LEU 10 0.411 15.738 11.602 70 HD23 LEU 10 HD23 LEU 10 0.485 13.983 11.516 71 H ALA 11 H ALA 11 -2.376 14.492 9.412 72 HA ALA 11 HA ALA 11 -4.949 15.410 8.529 73 HB1 ALA 11 HB1 ALA 11 -3.099 15.199 6.965 74 HB2 ALA 11 HB2 ALA 11 -4.463 14.179 6.493 75 HB3 ALA 11 HB3 ALA 11 -3.048 13.462 7.262 76 H ARG 12 H ARG 12 -6.793 14.277 8.319 77 HA ARG 12 HA ARG 12 -6.798 11.456 8.850 78 HB2 ARG 12 HB2 ARG 12 -8.659 11.605 10.484 79 HB3 ARG 12 HB3 ARG 12 -7.171 12.302 11.086 80 HG2 ARG 12 HG2 ARG 12 -8.031 14.534 10.685 81 HG3 ARG 12 HG3 ARG 12 -9.513 13.851 10.005 82 HD2 ARG 12 HD2 ARG 12 -9.954 12.729 12.138 83 HD3 ARG 12 HD3 ARG 12 -8.511 13.479 12.821 84 HE ARG 12 HE ARG 12 -9.882 15.581 11.947 85 HH11 ARG 12 HH11 ARG 12 -10.833 12.850 13.974 86 HH12 ARG 12 HH12 ARG 12 -12.033 13.718 14.820 87 HH21 ARG 12 HH21 ARG 12 -11.520 16.753 13.086 88 HH22 ARG 12 HH22 ARG 12 -12.481 15.999 14.262 89 H VAL 13 H VAL 13 -7.778 10.588 7.222 90 HA VAL 13 HA VAL 13 -10.114 11.921 6.074 91 HB VAL 13 HB VAL 13 -7.964 10.438 4.507 92 HG11 VAL 13 HG11 VAL 13 -10.340 12.025 3.568 93 HG12 VAL 13 HG12 VAL 13 -10.157 10.272 3.502 94 HG13 VAL 13 HG13 VAL 13 -9.109 11.307 2.530 95 HG21 VAL 13 HG21 VAL 13 -7.074 12.573 5.298 96 HG22 VAL 13 HG22 VAL 13 -8.464 13.415 4.617 97 HG23 VAL 13 HG23 VAL 13 -7.318 12.602 3.549 98 H GLY 14 H GLY 14 -11.806 10.562 6.187 99 HA2 GLY 14 HA2 GLY 14 -11.464 7.892 7.186 100 HA3 GLY 14 HA3 GLY 14 -12.989 8.659 6.746 101 H SER 15 H SER 15 -12.129 9.334 4.109 102 HA SER 15 HA SER 15 -12.326 6.688 2.901 103 HB2 SER 15 HB2 SER 15 -12.864 9.406 1.694 104 HB3 SER 15 HB3 SER 15 -13.228 7.836 0.970 105 HG SER 15 HG SER 15 -14.396 7.608 3.160 106 H ILE 16 H ILE 16 -10.146 6.152 2.994 107 HA ILE 16 HA ILE 16 -8.081 7.847 2.085 108 HB ILE 16 HB ILE 16 -8.073 4.820 2.463 109 HG12 ILE 16 HG12 ILE 16 -6.555 5.398 4.444 110 HG13 ILE 16 HG13 ILE 16 -7.044 7.067 4.217 111 HG21 ILE 16 HG21 ILE 16 -5.721 6.623 1.925 112 HG22 ILE 16 HG22 ILE 16 -6.377 5.399 0.842 113 HG23 ILE 16 HG23 ILE 16 -5.623 4.918 2.364 114 HD11 ILE 16 HD11 ILE 16 -8.857 4.764 4.913 115 HD12 ILE 16 HD12 ILE 16 -9.361 6.440 4.694 116 HD13 ILE 16 HD13 ILE 16 -8.280 6.010 6.019 117 HA PRO 17 HA PRO 17 -8.939 7.278 -2.230 118 HB2 PRO 17 HB2 PRO 17 -7.021 8.887 -3.202 119 HB3 PRO 17 HB3 PRO 17 -8.457 9.520 -2.390 120 HG2 PRO 17 HG2 PRO 17 -5.703 9.107 -1.291 121 HG3 PRO 17 HG3 PRO 17 -6.775 10.504 -1.106 122 HD2 PRO 17 HD2 PRO 17 -6.507 8.581 0.789 123 HD3 PRO 17 HD3 PRO 17 -8.011 9.493 0.545 124 H ALA 18 H ALA 18 -8.082 6.235 -4.005 125 HA ALA 18 HA ALA 18 -5.519 4.835 -3.681 126 HB1 ALA 18 HB1 ALA 18 -7.472 3.362 -4.023 127 HB2 ALA 18 HB2 ALA 18 -6.377 3.309 -5.397 128 HB3 ALA 18 HB3 ALA 18 -7.872 4.238 -5.504 129 H GLY 19 H GLY 19 -3.973 5.370 -5.106 130 HA2 GLY 19 HA2 GLY 19 -4.704 7.389 -7.119 131 HA3 GLY 19 HA3 GLY 19 -3.159 7.330 -6.287 132 H ASP 20 H ASP 20 -1.557 6.187 -7.135 133 HA ASP 20 HA ASP 20 -2.192 4.620 -9.535 134 HB2 ASP 20 HB2 ASP 20 -1.317 6.791 -10.233 135 HB3 ASP 20 HB3 ASP 20 0.100 6.564 -9.214 136 H ASP 21 H ASP 21 -1.502 2.688 -9.458 137 HA ASP 21 HA ASP 21 -0.185 1.589 -7.279 138 HB2 ASP 21 HB2 ASP 21 -0.185 -0.505 -8.625 139 HB3 ASP 21 HB3 ASP 21 -1.748 0.295 -8.595 140 H VAL 22 H VAL 22 1.948 1.606 -6.840 141 HA VAL 22 HA VAL 22 3.845 2.562 -8.780 142 HB VAL 22 HB VAL 22 4.261 1.650 -5.911 143 HG11 VAL 22 HG11 VAL 22 6.246 3.027 -7.738 144 HG12 VAL 22 HG12 VAL 22 6.360 1.366 -7.162 145 HG13 VAL 22 HG13 VAL 22 6.484 2.704 -6.020 146 HG21 VAL 22 HG21 VAL 22 4.306 4.410 -7.105 147 HG22 VAL 22 HG22 VAL 22 4.453 4.005 -5.402 148 HG23 VAL 22 HG23 VAL 22 2.928 3.719 -6.260 149 H LEU 23 H LEU 23 2.876 -0.537 -7.663 150 HA LEU 23 HA LEU 23 5.205 -1.693 -8.842 151 HB2 LEU 23 HB2 LEU 23 4.057 -3.938 -8.349 152 HB3 LEU 23 HB3 LEU 23 4.715 -3.007 -7.034 153 HG LEU 23 HG LEU 23 2.465 -2.350 -6.333 154 HD11 LEU 23 HD11 LEU 23 1.370 -2.294 -8.536 155 HD12 LEU 23 HD12 LEU 23 0.484 -3.286 -7.377 156 HD13 LEU 23 HD13 LEU 23 1.476 -4.053 -8.618 157 HD21 LEU 23 HD21 LEU 23 2.801 -5.278 -6.864 158 HD22 LEU 23 HD22 LEU 23 1.674 -4.572 -5.703 159 HD23 LEU 23 HD23 LEU 23 3.419 -4.372 -5.480 160 H ASP 24 H ASP 24 5.254 -3.145 -10.487 161 HA ASP 24 HA ASP 24 4.012 -2.146 -12.810 162 HB2 ASP 24 HB2 ASP 24 6.270 -3.164 -12.700 163 HB3 ASP 24 HB3 ASP 24 5.533 -4.727 -12.397 164 HA PRO 25 HA PRO 25 0.139 -4.421 -13.073 165 HB2 PRO 25 HB2 PRO 25 0.914 -4.817 -15.923 166 HB3 PRO 25 HB3 PRO 25 -0.601 -4.223 -15.242 167 HG2 PRO 25 HG2 PRO 25 1.148 -2.542 -16.335 168 HG3 PRO 25 HG3 PRO 25 0.231 -2.101 -14.884 169 HD2 PRO 25 HD2 PRO 25 3.097 -2.868 -15.152 170 HD3 PRO 25 HD3 PRO 25 2.324 -1.739 -14.024 171 H ASP 26 H ASP 26 3.123 -5.840 -14.308 172 HA ASP 26 HA ASP 26 2.028 -8.464 -14.676 173 HB2 ASP 26 HB2 ASP 26 3.959 -7.797 -15.989 174 HB3 ASP 26 HB3 ASP 26 4.896 -7.542 -14.525 175 H GLU 27 H GLU 27 3.275 -6.737 -11.979 176 HA GLU 27 HA GLU 27 4.124 -8.931 -10.425 177 HB2 GLU 27 HB2 GLU 27 3.095 -6.205 -9.613 178 HB3 GLU 27 HB3 GLU 27 3.821 -7.353 -8.501 179 HG2 GLU 27 HG2 GLU 27 5.181 -6.086 -10.868 180 HG3 GLU 27 HG3 GLU 27 5.390 -5.611 -9.184 181 HA PRO 28 HA PRO 28 0.117 -10.803 -9.754 182 HB2 PRO 28 HB2 PRO 28 1.447 -11.847 -7.307 183 HB3 PRO 28 HB3 PRO 28 0.601 -12.732 -8.580 184 HG2 PRO 28 HG2 PRO 28 3.258 -12.789 -8.425 185 HG3 PRO 28 HG3 PRO 28 2.437 -12.717 -9.993 186 HD2 PRO 28 HD2 PRO 28 3.833 -10.551 -8.481 187 HD3 PRO 28 HD3 PRO 28 3.785 -10.873 -10.232 188 H THR 29 H THR 29 -1.280 -9.253 -9.145 189 HA THR 29 HA THR 29 -1.040 -8.187 -6.465 190 HB THR 29 HB THR 29 -2.785 -6.547 -7.456 191 HG1 THR 29 HG1 THR 29 -3.296 -7.109 -9.456 192 HG21 THR 29 HG21 THR 29 -0.983 -5.151 -8.381 193 HG22 THR 29 HG22 THR 29 0.075 -6.561 -8.436 194 HG23 THR 29 HG23 THR 29 -0.477 -5.930 -6.883 195 H TYR 30 H TYR 30 -3.275 -7.618 -5.556 196 HA TYR 30 HA TYR 30 -5.004 -9.879 -5.967 197 HB2 TYR 30 HB2 TYR 30 -4.358 -8.313 -3.487 198 HB3 TYR 30 HB3 TYR 30 -5.884 -9.179 -3.643 199 HD1 TYR 30 HD1 TYR 30 -5.213 -11.661 -4.883 200 HD2 TYR 30 HD2 TYR 30 -3.003 -9.458 -2.004 201 HE1 TYR 30 HE1 TYR 30 -4.196 -13.745 -4.102 202 HE2 TYR 30 HE2 TYR 30 -1.960 -11.534 -1.209 203 HH TYR 30 HH TYR 30 -2.459 -13.924 -1.201 204 H ASP 31 H ASP 31 -7.238 -9.331 -5.454 205 HA ASP 31 HA ASP 31 -7.959 -6.726 -6.633 206 HB2 ASP 31 HB2 ASP 31 -9.289 -9.376 -7.273 207 HB3 ASP 31 HB3 ASP 31 -9.551 -7.842 -8.062 208 H LEU 32 H LEU 32 -10.332 -6.470 -6.137 209 HA LEU 32 HA LEU 32 -10.815 -6.857 -3.440 210 HB2 LEU 32 HB2 LEU 32 -12.843 -6.340 -5.623 211 HB3 LEU 32 HB3 LEU 32 -13.188 -6.230 -3.912 212 HG LEU 32 HG LEU 32 -11.225 -4.489 -5.415 213 HD11 LEU 32 HD11 LEU 32 -13.530 -3.962 -5.992 214 HD12 LEU 32 HD12 LEU 32 -12.830 -2.691 -4.995 215 HD13 LEU 32 HD13 LEU 32 -13.945 -3.855 -4.283 216 HD21 LEU 32 HD21 LEU 32 -11.145 -3.185 -3.325 217 HD22 LEU 32 HD22 LEU 32 -10.510 -4.816 -3.110 218 HD23 LEU 32 HD23 LEU 32 -12.127 -4.416 -2.534 219 HA PRO 33 HA PRO 33 -13.579 -10.786 -4.494 220 HB2 PRO 33 HB2 PRO 33 -12.503 -12.140 -6.684 221 HB3 PRO 33 HB3 PRO 33 -14.030 -11.251 -6.684 222 HG2 PRO 33 HG2 PRO 33 -11.333 -10.397 -7.634 223 HG3 PRO 33 HG3 PRO 33 -12.926 -10.047 -8.323 224 HD2 PRO 33 HD2 PRO 33 -11.599 -8.209 -6.923 225 HD3 PRO 33 HD3 PRO 33 -13.362 -8.371 -6.779 226 H ARG 34 H ARG 34 -10.148 -10.617 -5.435 227 HA ARG 34 HA ARG 34 -9.595 -13.212 -4.375 228 HB2 ARG 34 HB2 ARG 34 -7.782 -11.092 -5.455 229 HB3 ARG 34 HB3 ARG 34 -7.113 -12.440 -4.549 230 HG2 ARG 34 HG2 ARG 34 -6.995 -12.917 -6.900 231 HG3 ARG 34 HG3 ARG 34 -8.160 -13.999 -6.144 232 HD2 ARG 34 HD2 ARG 34 -9.951 -12.446 -6.877 233 HD3 ARG 34 HD3 ARG 34 -8.739 -11.543 -7.779 234 HE ARG 34 HE ARG 34 -9.386 -14.355 -8.247 235 HH11 ARG 34 HH11 ARG 34 -8.253 -11.223 -9.516 236 HH12 ARG 34 HH12 ARG 34 -8.655 -11.576 -11.130 237 HH21 ARG 34 HH21 ARG 34 -9.868 -14.856 -10.517 238 HH22 ARG 34 HH22 ARG 34 -9.562 -13.674 -11.715 239 H VAL 35 H VAL 35 -9.254 -9.997 -3.051 240 HA VAL 35 HA VAL 35 -8.029 -11.034 -0.709 241 HB VAL 35 HB VAL 35 -9.463 -8.365 -1.069 242 HG11 VAL 35 HG11 VAL 35 -9.369 -8.963 1.300 243 HG12 VAL 35 HG12 VAL 35 -8.275 -7.621 0.957 244 HG13 VAL 35 HG13 VAL 35 -7.635 -9.252 1.169 245 HG21 VAL 35 HG21 VAL 35 -7.142 -7.453 -1.181 246 HG22 VAL 35 HG22 VAL 35 -7.556 -8.535 -2.515 247 HG23 VAL 35 HG23 VAL 35 -6.553 -9.109 -1.190 248 H ALA 36 H ALA 36 -11.303 -10.393 -1.665 249 HA ALA 36 HA ALA 36 -12.613 -11.031 0.699 250 HB1 ALA 36 HB1 ALA 36 -13.728 -10.107 -1.292 251 HB2 ALA 36 HB2 ALA 36 -14.517 -11.579 -0.733 252 HB3 ALA 36 HB3 ALA 36 -13.459 -11.629 -2.147 253 H GLU 37 H GLU 37 -11.256 -13.017 -1.832 254 HA GLU 37 HA GLU 37 -12.009 -15.563 -0.952 255 HB2 GLU 37 HB2 GLU 37 -9.751 -14.474 -2.519 256 HB3 GLU 37 HB3 GLU 37 -9.807 -16.178 -2.226 257 HG2 GLU 37 HG2 GLU 37 -11.800 -14.442 -3.703 258 HG3 GLU 37 HG3 GLU 37 -10.729 -15.642 -4.415 259 H LEU 38 H LEU 38 -9.113 -13.627 -0.268 260 HA LEU 38 HA LEU 38 -7.671 -15.576 1.163 261 HB2 LEU 38 HB2 LEU 38 -7.547 -12.584 1.471 262 HB3 LEU 38 HB3 LEU 38 -6.377 -13.712 2.113 263 HG LEU 38 HG LEU 38 -6.899 -13.159 -0.806 264 HD11 LEU 38 HD11 LEU 38 -5.764 -11.349 0.384 265 HD12 LEU 38 HD12 LEU 38 -4.686 -12.170 -0.748 266 HD13 LEU 38 HD13 LEU 38 -4.561 -12.504 0.977 267 HD21 LEU 38 HD21 LEU 38 -4.850 -14.943 0.512 268 HD22 LEU 38 HD22 LEU 38 -4.942 -14.561 -1.207 269 HD23 LEU 38 HD23 LEU 38 -6.237 -15.483 -0.442 270 H LEU 39 H LEU 39 -9.707 -12.947 2.314 271 HA LEU 39 HA LEU 39 -9.329 -13.834 5.056 272 HB2 LEU 39 HB2 LEU 39 -10.884 -11.525 3.945 273 HB3 LEU 39 HB3 LEU 39 -10.620 -11.832 5.651 274 HG LEU 39 HG LEU 39 -8.498 -11.143 3.615 275 HD11 LEU 39 HD11 LEU 39 -9.675 -9.532 5.873 276 HD12 LEU 39 HD12 LEU 39 -9.918 -9.254 4.148 277 HD13 LEU 39 HD13 LEU 39 -8.316 -9.049 4.856 278 HD21 LEU 39 HD21 LEU 39 -8.291 -11.599 6.592 279 HD22 LEU 39 HD22 LEU 39 -7.002 -10.973 5.562 280 HD23 LEU 39 HD23 LEU 39 -7.600 -12.611 5.324 281 H GLY 40 H GLY 40 -11.557 -14.423 2.587 282 HA2 GLY 40 HA2 GLY 40 -13.506 -15.640 2.600 283 HA3 GLY 40 HA3 GLY 40 -13.206 -15.985 4.297 284 H VAL 41 H VAL 41 -13.377 -12.822 2.936 285 HA VAL 41 HA VAL 41 -15.849 -12.261 4.447 286 HB VAL 41 HB VAL 41 -15.031 -10.041 5.008 287 HG11 VAL 41 HG11 VAL 41 -13.158 -10.520 6.501 288 HG12 VAL 41 HG12 VAL 41 -12.953 -12.086 5.714 289 HG13 VAL 41 HG13 VAL 41 -14.436 -11.730 6.592 290 HG21 VAL 41 HG21 VAL 41 -12.686 -9.328 4.480 291 HG22 VAL 41 HG22 VAL 41 -13.738 -9.468 3.070 292 HG23 VAL 41 HG23 VAL 41 -12.572 -10.731 3.404 293 HA PRO 42 HA PRO 42 -17.039 -10.396 0.562 294 HB2 PRO 42 HB2 PRO 42 -18.785 -8.449 1.385 295 HB3 PRO 42 HB3 PRO 42 -19.205 -10.157 1.277 296 HG2 PRO 42 HG2 PRO 42 -18.758 -8.488 3.636 297 HG3 PRO 42 HG3 PRO 42 -19.569 -10.053 3.512 298 HD2 PRO 42 HD2 PRO 42 -16.938 -9.478 4.453 299 HD3 PRO 42 HD3 PRO 42 -17.711 -11.068 4.325 300 H VAL 43 H VAL 43 -17.108 -8.342 -0.644 301 HA VAL 43 HA VAL 43 -14.729 -6.878 -0.392 302 HB VAL 43 HB VAL 43 -17.214 -6.148 -1.984 303 HG11 VAL 43 HG11 VAL 43 -14.371 -5.203 -2.318 304 HG12 VAL 43 HG12 VAL 43 -15.717 -4.235 -1.721 305 HG13 VAL 43 HG13 VAL 43 -15.720 -4.816 -3.388 306 HG21 VAL 43 HG21 VAL 43 -16.054 -7.185 -3.883 307 HG22 VAL 43 HG22 VAL 43 -16.368 -8.342 -2.587 308 HG23 VAL 43 HG23 VAL 43 -14.749 -7.678 -2.801 309 H SER 44 H SER 44 -17.931 -6.278 0.774 310 HA SER 44 HA SER 44 -17.776 -3.602 1.395 311 HB2 SER 44 HB2 SER 44 -19.544 -4.237 3.071 312 HB3 SER 44 HB3 SER 44 -19.809 -4.787 1.404 313 HG SER 44 HG SER 44 -19.695 -6.240 3.594 314 H LYS 45 H LYS 45 -16.801 -6.439 3.307 315 HA LYS 45 HA LYS 45 -15.921 -4.886 5.523 316 HB2 LYS 45 HB2 LYS 45 -15.261 -7.747 4.819 317 HB3 LYS 45 HB3 LYS 45 -14.710 -6.948 6.286 318 HG2 LYS 45 HG2 LYS 45 -17.080 -6.536 6.899 319 HG3 LYS 45 HG3 LYS 45 -17.575 -7.451 5.485 320 HD2 LYS 45 HD2 LYS 45 -17.691 -8.830 7.472 321 HD3 LYS 45 HD3 LYS 45 -16.445 -9.456 6.404 322 HE2 LYS 45 HE2 LYS 45 -14.725 -8.429 7.747 323 HE3 LYS 45 HE3 LYS 45 -15.933 -7.675 8.790 324 HZ1 LYS 45 HZ1 LYS 45 -16.625 -9.873 9.493 325 HZ2 LYS 45 HZ2 LYS 45 -14.985 -9.659 9.784 326 HZ3 LYS 45 HZ3 LYS 45 -15.480 -10.606 8.495 327 H VAL 46 H VAL 46 -14.384 -6.035 2.633 328 HA VAL 46 HA VAL 46 -11.693 -5.364 3.328 329 HB VAL 46 HB VAL 46 -12.968 -5.299 0.565 330 HG11 VAL 46 HG11 VAL 46 -10.688 -5.640 -0.278 331 HG12 VAL 46 HG12 VAL 46 -10.072 -5.554 1.374 332 HG13 VAL 46 HG13 VAL 46 -10.834 -4.142 0.643 333 HG21 VAL 46 HG21 VAL 46 -12.087 -7.585 0.288 334 HG22 VAL 46 HG22 VAL 46 -13.276 -7.486 1.588 335 HG23 VAL 46 HG23 VAL 46 -11.554 -7.571 1.967 336 H ALA 47 H ALA 47 -14.248 -3.513 1.801 337 HA ALA 47 HA ALA 47 -12.823 -1.127 1.467 338 HB1 ALA 47 HB1 ALA 47 -15.777 -1.456 2.022 339 HB2 ALA 47 HB2 ALA 47 -15.014 -1.576 0.436 340 HB3 ALA 47 HB3 ALA 47 -14.997 -0.042 1.309 341 H GLN 48 H GLN 48 -14.520 -2.434 4.222 342 HA GLN 48 HA GLN 48 -14.419 -0.172 5.900 343 HB2 GLN 48 HB2 GLN 48 -14.544 -3.092 6.582 344 HB3 GLN 48 HB3 GLN 48 -14.746 -1.791 7.747 345 HG2 GLN 48 HG2 GLN 48 -16.683 -0.993 6.538 346 HG3 GLN 48 HG3 GLN 48 -16.465 -2.268 5.338 347 HE21 GLN 48 HE21 GLN 48 -18.651 -1.686 7.067 348 HE22 GLN 48 HE22 GLN 48 -18.964 -3.104 8.006 349 H GLN 49 H GLN 49 -12.177 -2.814 5.326 350 HA GLN 49 HA GLN 49 -10.315 -2.342 7.407 351 HB2 GLN 49 HB2 GLN 49 -9.646 -3.377 4.637 352 HB3 GLN 49 HB3 GLN 49 -8.759 -3.691 6.121 353 HG2 GLN 49 HG2 GLN 49 -11.534 -4.663 5.490 354 HG3 GLN 49 HG3 GLN 49 -10.061 -5.616 5.377 355 HE21 GLN 49 HE21 GLN 49 -9.212 -6.466 7.193 356 HE22 GLN 49 HE22 GLN 49 -9.973 -6.395 8.736 357 H LEU 50 H LEU 50 -10.574 -1.236 4.118 358 HA LEU 50 HA LEU 50 -8.267 0.338 3.952 359 HB2 LEU 50 HB2 LEU 50 -10.831 0.105 2.530 360 HB3 LEU 50 HB3 LEU 50 -9.957 1.604 2.254 361 HG LEU 50 HG LEU 50 -8.081 0.288 1.331 362 HD11 LEU 50 HD11 LEU 50 -9.841 -2.117 1.791 363 HD12 LEU 50 HD12 LEU 50 -8.328 -1.762 2.627 364 HD13 LEU 50 HD13 LEU 50 -8.320 -2.097 0.896 365 HD21 LEU 50 HD21 LEU 50 -9.783 1.083 -0.167 366 HD22 LEU 50 HD22 LEU 50 -10.778 -0.340 0.160 367 HD23 LEU 50 HD23 LEU 50 -9.241 -0.517 -0.676 368 H ARG 51 H ARG 51 -11.567 1.132 4.817 369 HA ARG 51 HA ARG 51 -11.297 3.886 5.229 370 HB2 ARG 51 HB2 ARG 51 -13.203 1.876 6.360 371 HB3 ARG 51 HB3 ARG 51 -13.329 3.592 6.711 372 HG2 ARG 51 HG2 ARG 51 -13.720 4.096 4.405 373 HG3 ARG 51 HG3 ARG 51 -13.364 2.433 3.938 374 HD2 ARG 51 HD2 ARG 51 -15.805 2.955 4.037 375 HD3 ARG 51 HD3 ARG 51 -15.298 1.614 5.062 376 HE ARG 51 HE ARG 51 -15.330 4.122 6.422 377 HH11 ARG 51 HH11 ARG 51 -17.419 1.444 5.393 378 HH12 ARG 51 HH12 ARG 51 -18.525 1.627 6.673 379 HH21 ARG 51 HH21 ARG 51 -16.815 4.309 8.226 380 HH22 ARG 51 HH22 ARG 51 -18.180 3.285 8.306 381 H GLU 52 H GLU 52 -10.302 1.271 7.354 382 HA GLU 52 HA GLU 52 -10.082 3.237 9.521 383 HB2 GLU 52 HB2 GLU 52 -9.769 1.347 11.051 384 HB3 GLU 52 HB3 GLU 52 -11.283 1.227 10.168 385 HG2 GLU 52 HG2 GLU 52 -10.452 -0.467 8.774 386 HG3 GLU 52 HG3 GLU 52 -8.800 -0.139 9.309 387 H GLY 53 H GLY 53 -8.243 2.278 7.082 388 HA2 GLY 53 HA2 GLY 53 -5.971 2.412 6.694 389 HA3 GLY 53 HA3 GLY 53 -5.796 3.047 8.326 390 H HIS 54 H HIS 54 -7.189 -0.022 7.410 391 HA HIS 54 HA HIS 54 -5.258 -1.446 9.104 392 HB2 HIS 54 HB2 HIS 54 -7.859 -1.720 9.115 393 HB3 HIS 54 HB3 HIS 54 -7.614 -2.641 7.645 394 HD1 HIS 54 HD1 HIS 54 -8.117 -3.041 11.089 395 HD2 HIS 54 HD2 HIS 54 -5.663 -4.895 8.294 396 HE1 HIS 54 HE1 HIS 54 -7.510 -5.295 12.069 397 H LEU 55 H LEU 55 -6.278 -0.923 5.840 398 HA LEU 55 HA LEU 55 -4.020 -2.213 4.683 399 HB2 LEU 55 HB2 LEU 55 -5.649 -4.089 5.039 400 HB3 LEU 55 HB3 LEU 55 -6.847 -3.187 4.146 401 HG LEU 55 HG LEU 55 -5.442 -3.387 2.112 402 HD11 LEU 55 HD11 LEU 55 -3.576 -4.961 2.099 403 HD12 LEU 55 HD12 LEU 55 -3.742 -5.183 3.840 404 HD13 LEU 55 HD13 LEU 55 -3.262 -3.615 3.193 405 HD21 LEU 55 HD21 LEU 55 -7.235 -4.968 2.531 406 HD22 LEU 55 HD22 LEU 55 -6.148 -5.976 3.488 407 HD23 LEU 55 HD23 LEU 55 -5.867 -5.775 1.760 408 H VAL 56 H VAL 56 -3.969 -1.459 2.344 409 HA VAL 56 HA VAL 56 -6.019 0.516 1.790 410 HB VAL 56 HB VAL 56 -4.026 1.673 2.717 411 HG11 VAL 56 HG11 VAL 56 -1.949 1.834 1.427 412 HG12 VAL 56 HG12 VAL 56 -2.573 0.611 0.313 413 HG13 VAL 56 HG13 VAL 56 -2.287 0.200 2.003 414 HG21 VAL 56 HG21 VAL 56 -3.778 3.374 0.955 415 HG22 VAL 56 HG22 VAL 56 -5.457 2.887 1.196 416 HG23 VAL 56 HG23 VAL 56 -4.547 2.272 -0.187 417 H ALA 57 H ALA 57 -6.255 0.951 -0.456 418 HA ALA 57 HA ALA 57 -5.243 -1.217 -2.154 419 HB1 ALA 57 HB1 ALA 57 -7.345 -1.131 -3.378 420 HB2 ALA 57 HB2 ALA 57 -7.937 0.122 -2.290 421 HB3 ALA 57 HB3 ALA 57 -7.623 -1.507 -1.678 422 H VAL 58 H VAL 58 -5.247 -0.641 -4.437 423 HA VAL 58 HA VAL 58 -4.640 2.177 -4.873 424 HB VAL 58 HB VAL 58 -2.727 1.569 -6.237 425 HG11 VAL 58 HG11 VAL 58 -1.241 0.745 -4.475 426 HG12 VAL 58 HG12 VAL 58 -2.663 0.257 -3.540 427 HG13 VAL 58 HG13 VAL 58 -2.383 1.958 -3.888 428 HG21 VAL 58 HG21 VAL 58 -1.875 -0.751 -6.306 429 HG22 VAL 58 HG22 VAL 58 -3.456 -0.595 -7.074 430 HG23 VAL 58 HG23 VAL 58 -3.320 -1.291 -5.455 431 H ARG 59 H ARG 59 -4.552 2.581 -7.295 432 HA ARG 59 HA ARG 59 -6.880 1.223 -8.537 433 HB2 ARG 59 HB2 ARG 59 -7.219 3.578 -7.722 434 HB3 ARG 59 HB3 ARG 59 -5.950 4.082 -8.822 435 HG2 ARG 59 HG2 ARG 59 -7.932 4.574 -9.958 436 HG3 ARG 59 HG3 ARG 59 -7.386 3.051 -10.658 437 HD2 ARG 59 HD2 ARG 59 -9.759 2.960 -10.242 438 HD3 ARG 59 HD3 ARG 59 -8.919 1.834 -9.181 439 HE ARG 59 HE ARG 59 -9.129 4.125 -7.726 440 HH11 ARG 59 HH11 ARG 59 -11.508 2.095 -9.426 441 HH12 ARG 59 HH12 ARG 59 -12.736 2.346 -8.302 442 HH21 ARG 59 HH21 ARG 59 -10.881 4.480 -6.133 443 HH22 ARG 59 HH22 ARG 59 -12.371 3.721 -6.394 444 H ARG 60 H ARG 60 -6.517 0.370 -10.469 445 HA ARG 60 HA ARG 60 -4.662 1.642 -12.270 446 HB2 ARG 60 HB2 ARG 60 -3.649 -0.510 -13.010 447 HB3 ARG 60 HB3 ARG 60 -3.197 -0.083 -11.369 448 HG2 ARG 60 HG2 ARG 60 -4.579 -1.734 -10.452 449 HG3 ARG 60 HG3 ARG 60 -5.446 -1.968 -11.966 450 HD2 ARG 60 HD2 ARG 60 -3.866 -3.788 -11.463 451 HD3 ARG 60 HD3 ARG 60 -3.518 -2.976 -12.986 452 HE ARG 60 HE ARG 60 -1.823 -1.705 -11.430 453 HH11 ARG 60 HH11 ARG 60 -2.587 -5.182 -11.276 454 HH12 ARG 60 HH12 ARG 60 -1.021 -5.646 -10.870 455 HH21 ARG 60 HH21 ARG 60 0.260 -2.298 -10.941 456 HH22 ARG 60 HH22 ARG 60 0.745 -3.924 -10.706 457 H ALA 61 H ALA 61 -5.592 1.870 -14.145 458 HA ALA 61 HA ALA 61 -6.995 1.702 -15.903 459 HB1 ALA 61 HB1 ALA 61 -7.578 -0.521 -16.698 460 HB2 ALA 61 HB2 ALA 61 -7.140 -1.209 -15.134 461 HB3 ALA 61 HB3 ALA 61 -5.899 -0.483 -16.156 462 H GLY 62 H GLY 62 -8.055 2.185 -13.188 463 HA2 GLY 62 HA2 GLY 62 -10.229 2.888 -12.593 464 HA3 GLY 62 HA3 GLY 62 -10.890 1.790 -13.799 465 H GLY 63 H GLY 63 -8.813 -0.169 -12.421 466 HA2 GLY 63 HA2 GLY 63 -10.923 -1.349 -10.797 467 HA3 GLY 63 HA3 GLY 63 -9.479 -2.144 -11.401 468 H VAL 64 H VAL 64 -10.648 -2.056 -8.752 469 HA VAL 64 HA VAL 64 -8.587 -0.656 -7.234 470 HB VAL 64 HB VAL 64 -10.990 -2.222 -6.237 471 HG11 VAL 64 HG11 VAL 64 -10.620 -1.030 -4.127 472 HG12 VAL 64 HG12 VAL 64 -9.184 -0.276 -4.818 473 HG13 VAL 64 HG13 VAL 64 -9.237 -2.025 -4.582 474 HG21 VAL 64 HG21 VAL 64 -12.068 -0.058 -5.827 475 HG22 VAL 64 HG22 VAL 64 -11.747 -0.314 -7.541 476 HG23 VAL 64 HG23 VAL 64 -10.712 0.758 -6.604 477 H VAL 65 H VAL 65 -6.870 -1.759 -6.668 478 HA VAL 65 HA VAL 65 -6.985 -4.664 -6.260 479 HB VAL 65 HB VAL 65 -4.767 -4.860 -7.426 480 HG11 VAL 65 HG11 VAL 65 -7.073 -3.960 -9.148 481 HG12 VAL 65 HG12 VAL 65 -6.794 -5.597 -8.547 482 HG13 VAL 65 HG13 VAL 65 -5.677 -4.876 -9.705 483 HG21 VAL 65 HG21 VAL 65 -4.118 -3.147 -9.025 484 HG22 VAL 65 HG22 VAL 65 -4.153 -2.500 -7.381 485 HG23 VAL 65 HG23 VAL 65 -5.479 -2.143 -8.500 486 H ILE 66 H ILE 66 -5.160 -5.432 -5.126 487 HA ILE 66 HA ILE 66 -3.935 -3.399 -3.420 488 HB ILE 66 HB ILE 66 -5.203 -6.006 -2.462 489 HG12 ILE 66 HG12 ILE 66 -5.918 -3.122 -1.863 490 HG13 ILE 66 HG13 ILE 66 -6.813 -4.188 -2.927 491 HG21 ILE 66 HG21 ILE 66 -4.544 -5.315 -0.197 492 HG22 ILE 66 HG22 ILE 66 -3.708 -3.913 -0.865 493 HG23 ILE 66 HG23 ILE 66 -3.132 -5.539 -1.231 494 HD11 ILE 66 HD11 ILE 66 -7.440 -5.567 -1.048 495 HD12 ILE 66 HD12 ILE 66 -7.870 -3.893 -0.746 496 HD13 ILE 66 HD13 ILE 66 -6.447 -4.591 0.034 497 HA PRO 67 HA PRO 67 -0.219 -5.579 -4.745 498 HB2 PRO 67 HB2 PRO 67 0.708 -4.461 -2.142 499 HB3 PRO 67 HB3 PRO 67 1.507 -4.385 -3.713 500 HG2 PRO 67 HG2 PRO 67 0.301 -2.242 -2.763 501 HG3 PRO 67 HG3 PRO 67 0.094 -2.673 -4.471 502 HD2 PRO 67 HD2 PRO 67 -1.801 -3.034 -2.183 503 HD3 PRO 67 HD3 PRO 67 -2.121 -2.565 -3.871 504 H GLN 68 H GLN 68 0.318 -7.711 -4.375 505 HA GLN 68 HA GLN 68 -0.854 -9.148 -2.283 506 HB2 GLN 68 HB2 GLN 68 -0.416 -10.079 -4.446 507 HB3 GLN 68 HB3 GLN 68 1.304 -9.840 -4.258 508 HG2 GLN 68 HG2 GLN 68 1.510 -11.577 -2.711 509 HG3 GLN 68 HG3 GLN 68 -0.223 -11.619 -2.392 510 HE21 GLN 68 HE21 GLN 68 -0.940 -11.439 -5.202 511 HE22 GLN 68 HE22 GLN 68 -0.624 -12.978 -5.875 512 H VAL 69 H VAL 69 2.110 -7.512 -2.608 513 HA VAL 69 HA VAL 69 3.542 -8.815 -0.531 514 HB VAL 69 HB VAL 69 5.088 -6.889 -0.644 515 HG11 VAL 69 HG11 VAL 69 4.244 -8.005 -3.320 516 HG12 VAL 69 HG12 VAL 69 5.373 -8.751 -2.194 517 HG13 VAL 69 HG13 VAL 69 5.790 -7.227 -2.985 518 HG21 VAL 69 HG21 VAL 69 4.712 -5.132 -2.315 519 HG22 VAL 69 HG22 VAL 69 3.467 -5.119 -1.061 520 HG23 VAL 69 HG23 VAL 69 3.110 -5.802 -2.648 521 H PHE 70 H PHE 70 0.844 -6.905 -0.289 522 HA PHE 70 HA PHE 70 1.541 -5.708 2.256 523 HB2 PHE 70 HB2 PHE 70 -0.855 -5.608 0.462 524 HB3 PHE 70 HB3 PHE 70 -1.086 -5.267 2.172 525 HD1 PHE 70 HD1 PHE 70 1.554 -4.323 -0.334 526 HD2 PHE 70 HD2 PHE 70 -1.277 -3.031 2.568 527 HE1 PHE 70 HE1 PHE 70 2.265 -1.987 -0.663 528 HE2 PHE 70 HE2 PHE 70 -0.552 -0.726 2.265 529 HZ PHE 70 HZ PHE 70 1.181 -0.179 0.664 530 H PHE 71 H PHE 71 0.713 -8.627 1.127 531 HA PHE 71 HA PHE 71 -0.352 -9.499 3.698 532 HB2 PHE 71 HB2 PHE 71 -0.691 -10.739 0.943 533 HB3 PHE 71 HB3 PHE 71 -1.236 -11.461 2.449 534 HD1 PHE 71 HD1 PHE 71 -1.841 -8.840 -0.029 535 HD2 PHE 71 HD2 PHE 71 -3.192 -10.621 3.589 536 HE1 PHE 71 HE1 PHE 71 -3.989 -7.675 -0.263 537 HE2 PHE 71 HE2 PHE 71 -5.344 -9.455 3.366 538 HZ PHE 71 HZ PHE 71 -5.744 -7.979 1.434 539 H THR 72 H THR 72 0.580 -11.465 4.378 540 HA THR 72 HA THR 72 3.343 -11.681 3.664 541 HB THR 72 HB THR 72 3.395 -13.424 5.422 542 HG1 THR 72 HG1 THR 72 0.704 -12.748 5.978 543 HG21 THR 72 HG21 THR 72 2.818 -11.980 7.322 544 HG22 THR 72 HG22 THR 72 1.911 -10.936 6.228 545 HG23 THR 72 HG23 THR 72 3.669 -11.072 6.062 546 H ASN 73 H ASN 73 4.128 -14.065 3.403 547 HA ASN 73 HA ASN 73 3.250 -14.961 0.926 548 HB2 ASN 73 HB2 ASN 73 5.512 -15.357 1.799 549 HB3 ASN 73 HB3 ASN 73 4.863 -16.481 2.981 550 HD21 ASN 73 HD21 ASN 73 4.446 -18.560 2.362 551 HD22 ASN 73 HD22 ASN 73 4.783 -19.188 0.801 552 H SER 74 H SER 74 1.923 -15.738 4.010 553 HA SER 74 HA SER 74 0.589 -18.100 3.018 554 HB2 SER 74 HB2 SER 74 1.492 -17.936 5.360 555 HB3 SER 74 HB3 SER 74 0.249 -16.738 5.701 556 HG SER 74 HG SER 74 -0.896 -18.877 4.608 557 H GLY 75 H GLY 75 0.006 -14.841 2.622 558 HA2 GLY 75 HA2 GLY 75 -1.798 -13.954 1.491 559 HA3 GLY 75 HA3 GLY 75 -2.746 -15.373 1.892 560 H GLN 76 H GLN 76 -1.138 -13.952 4.539 561 HA GLN 76 HA GLN 76 -3.637 -12.616 5.299 562 HB2 GLN 76 HB2 GLN 76 -3.251 -14.517 6.767 563 HB3 GLN 76 HB3 GLN 76 -1.599 -14.015 7.059 564 HG2 GLN 76 HG2 GLN 76 -3.083 -13.599 8.990 565 HG3 GLN 76 HG3 GLN 76 -2.355 -12.129 8.368 566 HE21 GLN 76 HE21 GLN 76 -4.762 -12.498 10.011 567 HE22 GLN 76 HE22 GLN 76 -6.047 -11.771 9.120 568 H VAL 77 H VAL 77 -3.515 -10.605 6.211 569 HA VAL 77 HA VAL 77 -1.550 -8.933 5.077 570 HB VAL 77 HB VAL 77 -3.872 -8.221 5.530 571 HG11 VAL 77 HG11 VAL 77 -4.571 -7.554 7.780 572 HG12 VAL 77 HG12 VAL 77 -3.058 -8.220 8.406 573 HG13 VAL 77 HG13 VAL 77 -4.232 -9.285 7.635 574 HG21 VAL 77 HG21 VAL 77 -2.211 -6.485 5.183 575 HG22 VAL 77 HG22 VAL 77 -1.815 -6.481 6.901 576 HG23 VAL 77 HG23 VAL 77 -3.408 -5.948 6.364 577 H VAL 78 H VAL 78 0.128 -7.784 5.959 578 HA VAL 78 HA VAL 78 1.626 -9.047 8.010 579 HB VAL 78 HB VAL 78 2.004 -6.234 6.982 580 HG11 VAL 78 HG11 VAL 78 4.374 -6.565 7.529 581 HG12 VAL 78 HG12 VAL 78 3.985 -8.156 8.183 582 HG13 VAL 78 HG13 VAL 78 3.328 -6.707 8.941 583 HG21 VAL 78 HG21 VAL 78 3.114 -8.778 5.803 584 HG22 VAL 78 HG22 VAL 78 3.527 -7.133 5.310 585 HG23 VAL 78 HG23 VAL 78 1.883 -7.730 5.082 586 H LYS 79 H LYS 79 1.691 -8.656 10.135 587 HA LYS 79 HA LYS 79 -0.451 -7.368 11.381 588 HB2 LYS 79 HB2 LYS 79 0.716 -7.813 13.494 589 HB3 LYS 79 HB3 LYS 79 0.604 -9.218 12.442 590 HG2 LYS 79 HG2 LYS 79 2.864 -8.785 11.673 591 HG3 LYS 79 HG3 LYS 79 2.967 -7.441 12.810 592 HD2 LYS 79 HD2 LYS 79 2.448 -10.314 13.592 593 HD3 LYS 79 HD3 LYS 79 4.030 -9.544 13.675 594 HE2 LYS 79 HE2 LYS 79 3.172 -7.930 15.284 595 HE3 LYS 79 HE3 LYS 79 1.563 -8.639 15.168 596 HZ1 LYS 79 HZ1 LYS 79 2.359 -10.639 16.115 597 HZ2 LYS 79 HZ2 LYS 79 2.814 -9.374 17.115 598 HZ3 LYS 79 HZ3 LYS 79 3.958 -10.118 16.108 599 H SER 80 H SER 80 2.782 -6.176 10.732 600 HA SER 80 HA SER 80 2.469 -3.863 12.427 601 HB2 SER 80 HB2 SER 80 4.618 -4.431 10.389 602 HB3 SER 80 HB3 SER 80 4.721 -3.388 11.811 603 HG SER 80 HG SER 80 4.342 -5.353 13.060 604 H LEU 81 H LEU 81 1.322 -4.672 9.424 605 HA LEU 81 HA LEU 81 2.031 -2.405 7.950 606 HB2 LEU 81 HB2 LEU 81 1.615 -4.428 6.869 607 HB3 LEU 81 HB3 LEU 81 -0.048 -4.507 7.415 608 HG LEU 81 HG LEU 81 0.892 -2.303 5.597 609 HD11 LEU 81 HD11 LEU 81 1.665 -4.438 4.687 610 HD12 LEU 81 HD12 LEU 81 0.347 -3.764 3.736 611 HD13 LEU 81 HD13 LEU 81 0.035 -5.094 4.850 612 HD21 LEU 81 HD21 LEU 81 -1.385 -2.198 6.569 613 HD22 LEU 81 HD22 LEU 81 -1.734 -3.785 5.886 614 HD23 LEU 81 HD23 LEU 81 -1.420 -2.417 4.818 615 HA PRO 82 HA PRO 82 -2.583 -0.790 8.968 616 HB2 PRO 82 HB2 PRO 82 -2.518 -1.865 11.765 617 HB3 PRO 82 HB3 PRO 82 -3.914 -1.573 10.724 618 HG2 PRO 82 HG2 PRO 82 -3.058 -4.036 11.087 619 HG3 PRO 82 HG3 PRO 82 -3.538 -3.495 9.470 620 HD2 PRO 82 HD2 PRO 82 -0.804 -3.912 10.593 621 HD3 PRO 82 HD3 PRO 82 -1.416 -4.234 8.960 622 H GLY 83 H GLY 83 -0.003 -1.287 11.283 623 HA2 GLY 83 HA2 GLY 83 -0.188 1.147 12.692 624 HA3 GLY 83 HA3 GLY 83 1.227 0.112 12.608 625 H LEU 84 H LEU 84 1.744 0.217 9.857 626 HA LEU 84 HA LEU 84 3.130 2.683 9.800 627 HB2 LEU 84 HB2 LEU 84 4.134 2.010 7.749 628 HB3 LEU 84 HB3 LEU 84 3.969 0.561 8.705 629 HG LEU 84 HG LEU 84 1.764 0.297 7.249 630 HD11 LEU 84 HD11 LEU 84 1.966 2.393 6.042 631 HD12 LEU 84 HD12 LEU 84 2.094 1.038 4.931 632 HD13 LEU 84 HD13 LEU 84 3.543 1.911 5.420 633 HD21 LEU 84 HD21 LEU 84 3.629 -1.309 7.363 634 HD22 LEU 84 HD22 LEU 84 4.522 -0.344 6.195 635 HD23 LEU 84 HD23 LEU 84 3.024 -1.139 5.713 636 H LEU 85 H LEU 85 0.235 1.502 8.232 637 HA LEU 85 HA LEU 85 -0.156 3.700 6.528 638 HB2 LEU 85 HB2 LEU 85 -2.196 1.885 7.792 639 HB3 LEU 85 HB3 LEU 85 -2.538 3.021 6.502 640 HG LEU 85 HG LEU 85 -0.691 0.645 6.293 641 HD11 LEU 85 HD11 LEU 85 -3.459 1.120 5.213 642 HD12 LEU 85 HD12 LEU 85 -3.020 0.011 6.513 643 HD13 LEU 85 HD13 LEU 85 -2.444 -0.282 4.867 644 HD21 LEU 85 HD21 LEU 85 -0.715 1.141 3.887 645 HD22 LEU 85 HD22 LEU 85 -0.019 2.476 4.807 646 HD23 LEU 85 HD23 LEU 85 -1.665 2.595 4.198 647 H THR 86 H THR 86 -0.903 3.168 9.829 648 HA THR 86 HA THR 86 -2.685 5.314 10.205 649 HB THR 86 HB THR 86 -0.878 3.980 12.242 650 HG1 THR 86 HG1 THR 86 -2.353 2.527 11.254 651 HG21 THR 86 HG21 THR 86 -2.473 4.815 13.917 652 HG22 THR 86 HG22 THR 86 -3.380 5.647 12.653 653 HG23 THR 86 HG23 THR 86 -1.741 6.158 13.037 654 H ILE 87 H ILE 87 0.858 5.194 10.720 655 HA ILE 87 HA ILE 87 0.980 7.924 11.498 656 HB ILE 87 HB ILE 87 2.670 6.434 12.333 657 HG12 ILE 87 HG12 ILE 87 3.394 8.832 11.790 658 HG13 ILE 87 HG13 ILE 87 4.666 7.671 12.123 659 HG21 ILE 87 HG21 ILE 87 3.518 5.848 9.533 660 HG22 ILE 87 HG22 ILE 87 2.747 4.760 10.679 661 HG23 ILE 87 HG23 ILE 87 4.389 5.340 10.979 662 HD11 ILE 87 HD11 ILE 87 5.239 9.190 10.284 663 HD12 ILE 87 HD12 ILE 87 3.822 8.646 9.389 664 HD13 ILE 87 HD13 ILE 87 5.141 7.520 9.714 665 H LEU 88 H LEU 88 1.477 6.371 8.356 666 HA LEU 88 HA LEU 88 2.192 8.810 7.090 667 HB2 LEU 88 HB2 LEU 88 1.143 6.251 5.963 668 HB3 LEU 88 HB3 LEU 88 1.362 7.649 4.948 669 HG LEU 88 HG LEU 88 3.223 6.342 4.574 670 HD11 LEU 88 HD11 LEU 88 5.144 7.570 5.370 671 HD12 LEU 88 HD12 LEU 88 4.140 8.372 6.573 672 HD13 LEU 88 HD13 LEU 88 3.838 8.638 4.854 673 HD21 LEU 88 HD21 LEU 88 3.674 6.040 7.520 674 HD22 LEU 88 HD22 LEU 88 4.629 5.332 6.221 675 HD23 LEU 88 HD23 LEU 88 2.960 4.812 6.468 676 H HIS 89 H HIS 89 -0.869 7.311 7.716 677 HA HIS 89 HA HIS 89 -2.560 8.952 6.233 678 HB2 HIS 89 HB2 HIS 89 -3.384 6.961 7.343 679 HB3 HIS 89 HB3 HIS 89 -2.914 7.586 8.912 680 HD1 HIS 89 HD1 HIS 89 -4.812 8.539 10.229 681 HD2 HIS 89 HD2 HIS 89 -5.526 8.643 6.140 682 HE1 HIS 89 HE1 HIS 89 -7.160 9.341 9.959 683 H ASP 90 H ASP 90 -1.194 9.338 9.458 684 HA ASP 90 HA ASP 90 -2.389 11.813 10.144 685 HB2 ASP 90 HB2 ASP 90 0.135 10.463 11.021 686 HB3 ASP 90 HB3 ASP 90 -0.282 12.029 11.656 687 H GLY 91 H GLY 91 0.390 10.964 8.253 688 HA2 GLY 91 HA2 GLY 91 1.480 13.658 8.254 689 HA3 GLY 91 HA3 GLY 91 2.136 12.268 7.404 690 H GLY 92 H GLY 92 -0.892 12.069 6.535 691 HA2 GLY 92 HA2 GLY 92 -2.218 12.940 4.831 692 HA3 GLY 92 HA3 GLY 92 -1.074 14.263 4.671 693 H TYR 93 H TYR 93 -0.204 10.873 4.540 694 HA TYR 93 HA TYR 93 0.640 11.349 1.792 695 HB2 TYR 93 HB2 TYR 93 1.600 9.309 3.806 696 HB3 TYR 93 HB3 TYR 93 2.104 9.315 2.126 697 HD1 TYR 93 HD1 TYR 93 3.324 11.366 1.249 698 HD2 TYR 93 HD2 TYR 93 2.689 10.697 5.400 699 HE1 TYR 93 HE1 TYR 93 5.129 12.956 1.777 700 HE2 TYR 93 HE2 TYR 93 4.487 12.286 5.935 701 HH TYR 93 HH TYR 93 6.591 13.191 4.750 702 H ARG 94 H ARG 94 -0.351 10.446 0.199 703 HA ARG 94 HA ARG 94 -2.562 8.662 0.578 704 HB2 ARG 94 HB2 ARG 94 -2.814 8.733 -1.872 705 HB3 ARG 94 HB3 ARG 94 -2.658 10.349 -1.195 706 HG2 ARG 94 HG2 ARG 94 -0.409 10.510 -1.920 707 HG3 ARG 94 HG3 ARG 94 -0.385 8.815 -2.441 708 HD2 ARG 94 HD2 ARG 94 -2.098 9.389 -4.120 709 HD3 ARG 94 HD3 ARG 94 -2.006 11.073 -3.599 710 HE ARG 94 HE ARG 94 0.584 10.283 -4.204 711 HH11 ARG 94 HH11 ARG 94 -2.470 10.748 -5.961 712 HH12 ARG 94 HH12 ARG 94 -1.705 11.047 -7.452 713 HH21 ARG 94 HH21 ARG 94 1.592 10.681 -6.224 714 HH22 ARG 94 HH22 ARG 94 0.662 10.999 -7.617 715 H ASP 95 H ASP 95 -2.754 6.744 -1.022 716 HA ASP 95 HA ASP 95 -1.228 4.603 -0.142 717 HB2 ASP 95 HB2 ASP 95 -2.367 3.333 -1.890 718 HB3 ASP 95 HB3 ASP 95 -3.499 4.486 -1.201 719 H THR 96 H THR 96 -1.003 6.500 -3.011 720 HA THR 96 HA THR 96 0.925 5.121 -4.430 721 HB THR 96 HB THR 96 0.426 8.100 -4.447 722 HG1 THR 96 HG1 THR 96 -1.448 6.428 -4.761 723 HG21 THR 96 HG21 THR 96 2.412 7.360 -5.722 724 HG22 THR 96 HG22 THR 96 1.136 7.945 -6.797 725 HG23 THR 96 HG23 THR 96 1.398 6.211 -6.593 726 H GLU 97 H GLU 97 1.251 7.679 -2.006 727 HA GLU 97 HA GLU 97 4.042 7.995 -2.338 728 HB2 GLU 97 HB2 GLU 97 2.467 8.649 0.146 729 HB3 GLU 97 HB3 GLU 97 4.013 9.327 -0.340 730 HG2 GLU 97 HG2 GLU 97 1.318 9.783 -1.531 731 HG3 GLU 97 HG3 GLU 97 2.362 10.970 -0.755 732 H ILE 98 H ILE 98 2.014 5.967 -0.344 733 HA ILE 98 HA ILE 98 3.926 5.072 1.535 734 HB ILE 98 HB ILE 98 1.768 3.271 0.410 735 HG12 ILE 98 HG12 ILE 98 0.576 5.339 0.892 736 HG13 ILE 98 HG13 ILE 98 0.229 4.143 2.140 737 HG21 ILE 98 HG21 ILE 98 3.300 2.255 1.982 738 HG22 ILE 98 HG22 ILE 98 1.688 2.384 2.691 739 HG23 ILE 98 HG23 ILE 98 2.950 3.523 3.157 740 HD11 ILE 98 HD11 ILE 98 0.521 6.374 3.036 741 HD12 ILE 98 HD12 ILE 98 2.166 6.410 2.401 742 HD13 ILE 98 HD13 ILE 98 1.723 5.239 3.648 743 H MET 99 H MET 99 2.849 3.799 -1.541 744 HA MET 99 HA MET 99 4.628 1.577 -1.595 745 HB2 MET 99 HB2 MET 99 3.115 2.922 -3.803 746 HB3 MET 99 HB3 MET 99 4.028 1.430 -3.963 747 HG2 MET 99 HG2 MET 99 2.538 0.319 -2.430 748 HG3 MET 99 HG3 MET 99 1.657 1.829 -2.176 749 HE1 MET 99 HE1 MET 99 1.517 3.172 -5.002 750 HE2 MET 99 HE2 MET 99 0.173 3.008 -3.874 751 HE3 MET 99 HE3 MET 99 -0.033 2.543 -5.554 752 H ARG 100 H ARG 100 4.880 4.901 -2.485 753 HA ARG 100 HA ARG 100 6.778 4.781 -4.518 754 HB2 ARG 100 HB2 ARG 100 5.412 6.786 -3.788 755 HB3 ARG 100 HB3 ARG 100 6.488 6.952 -2.420 756 HG2 ARG 100 HG2 ARG 100 7.374 7.162 -5.302 757 HG3 ARG 100 HG3 ARG 100 6.875 8.536 -4.327 758 HD2 ARG 100 HD2 ARG 100 8.699 8.019 -2.747 759 HD3 ARG 100 HD3 ARG 100 9.213 6.704 -3.795 760 HE ARG 100 HE ARG 100 9.201 9.545 -4.594 761 HH11 ARG 100 HH11 ARG 100 10.767 6.301 -4.765 762 HH12 ARG 100 HH12 ARG 100 11.988 6.865 -5.785 763 HH21 ARG 100 HH21 ARG 100 10.906 10.205 -5.994 764 HH22 ARG 100 HH22 ARG 100 12.084 9.081 -6.520 765 H TRP 101 H TRP 101 7.396 5.552 -1.086 766 HA TRP 101 HA TRP 101 10.146 4.984 -1.453 767 HB2 TRP 101 HB2 TRP 101 10.246 5.150 1.133 768 HB3 TRP 101 HB3 TRP 101 9.870 6.590 0.199 769 HD1 TRP 101 HD1 TRP 101 7.554 7.698 0.562 770 HE1 TRP 101 HE1 TRP 101 5.645 7.316 2.180 771 HE3 TRP 101 HE3 TRP 101 9.018 3.185 2.458 772 HZ2 TRP 101 HZ2 TRP 101 4.843 5.350 4.058 773 HZ3 TRP 101 HZ3 TRP 101 7.622 2.124 4.148 774 HH2 TRP 101 HH2 TRP 101 5.573 3.184 4.950 775 H LEU 102 H LEU 102 7.475 3.034 -0.367 776 HA LEU 102 HA LEU 102 8.919 0.952 0.818 777 HB2 LEU 102 HB2 LEU 102 6.256 1.201 -0.393 778 HB3 LEU 102 HB3 LEU 102 6.855 -0.438 -0.167 779 HG LEU 102 HG LEU 102 6.404 1.655 1.971 780 HD11 LEU 102 HD11 LEU 102 4.559 0.228 2.642 781 HD12 LEU 102 HD12 LEU 102 4.912 -0.878 1.312 782 HD13 LEU 102 HD13 LEU 102 4.348 0.759 0.971 783 HD21 LEU 102 HD21 LEU 102 7.315 -1.213 2.114 784 HD22 LEU 102 HD22 LEU 102 6.760 -0.267 3.504 785 HD23 LEU 102 HD23 LEU 102 8.193 0.234 2.629 786 H PHE 103 H PHE 103 8.099 1.460 -2.591 787 HA PHE 103 HA PHE 103 9.403 -1.063 -3.184 788 HB2 PHE 103 HB2 PHE 103 7.749 0.770 -4.915 789 HB3 PHE 103 HB3 PHE 103 8.629 -0.604 -5.567 790 HD1 PHE 103 HD1 PHE 103 6.031 0.296 -3.051 791 HD2 PHE 103 HD2 PHE 103 7.665 -2.752 -5.536 792 HE1 PHE 103 HE1 PHE 103 4.153 -1.171 -2.487 793 HE2 PHE 103 HE2 PHE 103 5.791 -4.216 -4.964 794 HZ PHE 103 HZ PHE 103 4.028 -3.423 -3.437 795 H THR 104 H THR 104 10.450 1.938 -2.734 796 HA THR 104 HA THR 104 12.436 1.946 -4.839 797 HB THR 104 HB THR 104 11.941 3.819 -2.502 798 HG1 THR 104 HG1 THR 104 10.408 3.988 -4.120 799 HG21 THR 104 HG21 THR 104 13.571 5.340 -3.575 800 HG22 THR 104 HG22 THR 104 13.932 4.092 -4.770 801 HG23 THR 104 HG23 THR 104 14.328 3.827 -3.073 802 HA PRO 105 HA PRO 105 15.257 -0.491 -2.242 803 HB2 PRO 105 HB2 PRO 105 17.252 0.714 -4.103 804 HB3 PRO 105 HB3 PRO 105 16.994 -0.986 -3.693 805 HG2 PRO 105 HG2 PRO 105 16.238 -0.050 -6.058 806 HG3 PRO 105 HG3 PRO 105 15.223 -1.208 -5.181 807 HD2 PRO 105 HD2 PRO 105 14.901 1.755 -5.463 808 HD3 PRO 105 HD3 PRO 105 13.674 0.471 -5.507 809 H ASP 106 H ASP 106 16.169 0.231 -0.388 810 HA ASP 106 HA ASP 106 16.607 3.084 -0.058 811 HB2 ASP 106 HB2 ASP 106 15.390 1.764 1.692 812 HB3 ASP 106 HB3 ASP 106 16.867 0.847 1.950 813 HA PRO 107 HA PRO 107 20.899 2.663 -1.051 814 HB2 PRO 107 HB2 PRO 107 21.748 5.015 0.063 815 HB3 PRO 107 HB3 PRO 107 20.968 4.894 -1.519 816 HG2 PRO 107 HG2 PRO 107 19.775 5.618 1.130 817 HG3 PRO 107 HG3 PRO 107 19.502 6.355 -0.460 818 HD2 PRO 107 HD2 PRO 107 17.748 4.661 0.600 819 HD3 PRO 107 HD3 PRO 107 18.083 4.663 -1.144 820 H SER 108 H SER 108 19.734 2.876 2.233 821 HA SER 108 HA SER 108 22.416 2.129 3.145 822 HB2 SER 108 HB2 SER 108 20.295 3.652 4.654 823 HB3 SER 108 HB3 SER 108 21.954 3.338 5.176 824 HG SER 108 HG SER 108 22.640 4.561 3.355 825 H LEU 109 H LEU 109 19.785 0.560 2.339 826 HA LEU 109 HA LEU 109 19.399 -0.756 4.934 827 HB2 LEU 109 HB2 LEU 109 17.383 0.205 3.920 828 HB3 LEU 109 HB3 LEU 109 17.649 -0.817 2.515 829 HG LEU 109 HG LEU 109 17.294 -2.815 3.902 830 HD11 LEU 109 HD11 LEU 109 16.307 -2.563 6.136 831 HD12 LEU 109 HD12 LEU 109 16.608 -0.826 6.066 832 HD13 LEU 109 HD13 LEU 109 17.960 -1.959 6.067 833 HD21 LEU 109 HD21 LEU 109 14.893 -2.526 4.168 834 HD22 LEU 109 HD22 LEU 109 15.474 -1.855 2.642 835 HD23 LEU 109 HD23 LEU 109 15.085 -0.779 3.989 836 H THR 110 H THR 110 20.134 -2.668 5.227 837 HA THR 110 HA THR 110 20.567 -4.495 2.974 838 HB THR 110 HB THR 110 21.997 -4.554 5.663 839 HG1 THR 110 HG1 THR 110 22.589 -2.694 4.704 840 HG21 THR 110 HG21 THR 110 22.649 -5.808 2.982 841 HG22 THR 110 HG22 THR 110 21.988 -6.656 4.380 842 HG23 THR 110 HG23 THR 110 23.615 -5.973 4.446 843 H ILE 111 H ILE 111 19.433 -6.442 3.261 844 HA ILE 111 HA ILE 111 18.004 -6.553 5.799 845 HB ILE 111 HB ILE 111 16.064 -7.616 4.679 846 HG12 ILE 111 HG12 ILE 111 15.908 -6.957 2.139 847 HG13 ILE 111 HG13 ILE 111 17.658 -7.035 2.213 848 HG21 ILE 111 HG21 ILE 111 15.978 -5.334 5.282 849 HG22 ILE 111 HG22 ILE 111 15.183 -5.549 3.713 850 HG23 ILE 111 HG23 ILE 111 16.808 -4.868 3.798 851 HD11 ILE 111 HD11 ILE 111 15.763 -9.252 2.895 852 HD12 ILE 111 HD12 ILE 111 17.524 -9.369 2.928 853 HD13 ILE 111 HD13 ILE 111 16.683 -9.114 1.390 854 H THR 112 H THR 112 17.076 -8.567 6.407 855 HA THR 112 HA THR 112 19.161 -10.589 6.347 856 HB THR 112 HB THR 112 18.362 -9.737 8.549 857 HG1 THR 112 HG1 THR 112 19.066 -11.757 8.830 858 HG21 THR 112 HG21 THR 112 15.728 -11.007 7.806 859 HG22 THR 112 HG22 THR 112 16.041 -9.271 7.894 860 HG23 THR 112 HG23 THR 112 16.139 -10.255 9.350 861 H ARG 113 H ARG 113 18.516 -12.832 6.212 862 HA ARG 113 HA ARG 113 17.016 -13.453 3.975 863 HB2 ARG 113 HB2 ARG 113 18.675 -15.030 4.666 864 HB3 ARG 113 HB3 ARG 113 17.944 -15.218 6.250 865 HG2 ARG 113 HG2 ARG 113 16.448 -16.075 3.778 866 HG3 ARG 113 HG3 ARG 113 17.678 -17.122 4.482 867 HD2 ARG 113 HD2 ARG 113 16.464 -17.377 6.491 868 HD3 ARG 113 HD3 ARG 113 15.467 -15.971 6.150 869 HE ARG 113 HE ARG 113 15.237 -18.309 4.422 870 HH11 ARG 113 HH11 ARG 113 13.808 -16.182 6.890 871 HH12 ARG 113 HH12 ARG 113 12.251 -16.827 6.769 872 HH21 ARG 113 HH21 ARG 113 13.055 -19.211 4.259 873 HH22 ARG 113 HH22 ARG 113 11.807 -18.593 5.229 874 H ASP 114 H ASP 114 15.072 -13.365 3.578 875 HA ASP 114 HA ASP 114 12.998 -14.873 4.380 876 HB2 ASP 114 HB2 ASP 114 13.215 -13.238 6.514 877 HB3 ASP 114 HB3 ASP 114 12.346 -12.173 5.402 878 H GLY 115 H GLY 115 11.841 -14.733 2.554 879 HA2 GLY 115 HA2 GLY 115 10.837 -13.749 0.673 880 HA3 GLY 115 HA3 GLY 115 11.404 -12.170 1.242 881 H SER 116 H SER 116 13.913 -12.287 1.458 882 HA SER 116 HA SER 116 15.046 -13.188 -1.068 883 HB2 SER 116 HB2 SER 116 16.094 -11.218 0.987 884 HB3 SER 116 HB3 SER 116 16.822 -11.564 -0.586 885 HG SER 116 HG SER 116 14.166 -10.657 -0.300 886 H ARG 117 H ARG 117 16.216 -14.920 -0.934 887 HA ARG 117 HA ARG 117 16.490 -16.555 1.321 888 HB2 ARG 117 HB2 ARG 117 17.619 -18.044 -0.096 889 HB3 ARG 117 HB3 ARG 117 16.504 -17.160 -1.125 890 HG2 ARG 117 HG2 ARG 117 18.571 -15.597 -1.487 891 HG3 ARG 117 HG3 ARG 117 19.463 -17.035 -1.009 892 HD2 ARG 117 HD2 ARG 117 19.304 -17.063 -3.369 893 HD3 ARG 117 HD3 ARG 117 18.170 -18.263 -2.719 894 HE ARG 117 HE ARG 117 16.491 -17.163 -3.690 895 HH11 ARG 117 HH11 ARG 117 19.010 -14.600 -3.110 896 HH12 ARG 117 HH12 ARG 117 18.216 -13.502 -4.126 897 HH21 ARG 117 HH21 ARG 117 15.503 -15.562 -4.999 898 HH22 ARG 117 HH22 ARG 117 16.196 -14.014 -5.200 899 H ASP 118 H ASP 118 18.554 -14.008 0.162 900 HA ASP 118 HA ASP 118 20.545 -14.658 2.155 901 HB2 ASP 118 HB2 ASP 118 22.313 -14.214 0.560 902 HB3 ASP 118 HB3 ASP 118 21.316 -15.545 -0.007 903 H ALA 119 H ALA 119 22.178 -12.669 2.000 904 HA ALA 119 HA ALA 119 20.613 -10.451 2.888 905 HB1 ALA 119 HB1 ALA 119 22.743 -9.445 3.474 906 HB2 ALA 119 HB2 ALA 119 23.596 -10.698 2.571 907 HB3 ALA 119 HB3 ALA 119 22.678 -11.125 4.016 908 H VAL 120 H VAL 120 20.136 -8.685 1.845 909 HA VAL 120 HA VAL 120 21.395 -8.177 -0.764 910 HB VAL 120 HB VAL 120 18.504 -7.633 -0.000 911 HG11 VAL 120 HG11 VAL 120 18.185 -7.034 -2.361 912 HG12 VAL 120 HG12 VAL 120 19.912 -7.260 -2.641 913 HG13 VAL 120 HG13 VAL 120 19.357 -5.975 -1.570 914 HG21 VAL 120 HG21 VAL 120 19.626 -9.684 -1.908 915 HG22 VAL 120 HG22 VAL 120 17.914 -9.361 -1.646 916 HG23 VAL 120 HG23 VAL 120 18.897 -10.024 -0.338 917 H SER 121 H SER 121 22.514 -6.302 -0.742 918 HA SER 121 HA SER 121 21.923 -4.245 1.173 919 HB2 SER 121 HB2 SER 121 23.950 -3.233 -0.126 920 HB3 SER 121 HB3 SER 121 24.236 -4.646 0.897 921 HG SER 121 HG SER 121 24.787 -4.421 -1.630 922 H ASN 122 H ASN 122 21.361 -2.025 0.443 923 HA ASN 122 HA ASN 122 20.004 -0.625 -0.616 924 HB2 ASN 122 HB2 ASN 122 20.998 -2.027 -3.132 925 HB3 ASN 122 HB3 ASN 122 19.973 -0.602 -3.108 926 HD21 ASN 122 HD21 ASN 122 21.432 0.546 -0.820 927 HD22 ASN 122 HD22 ASN 122 22.923 1.122 -1.473 928 H ALA 123 H ALA 123 18.940 -2.674 0.539 929 HA ALA 123 HA ALA 123 17.206 -4.190 -1.131 930 HB1 ALA 123 HB1 ALA 123 17.258 -3.873 1.845 931 HB2 ALA 123 HB2 ALA 123 18.132 -5.091 0.916 932 HB3 ALA 123 HB3 ALA 123 16.365 -5.091 0.939 933 H ARG 124 H ARG 124 14.923 -4.267 -0.696 934 HA ARG 124 HA ARG 124 13.811 -1.597 -0.769 935 HB2 ARG 124 HB2 ARG 124 13.428 -2.996 -2.672 936 HB3 ARG 124 HB3 ARG 124 12.888 -4.317 -1.658 937 HG2 ARG 124 HG2 ARG 124 10.905 -3.053 -1.067 938 HG3 ARG 124 HG3 ARG 124 11.459 -1.714 -2.083 939 HD2 ARG 124 HD2 ARG 124 9.809 -3.209 -3.198 940 HD3 ARG 124 HD3 ARG 124 11.366 -3.086 -4.038 941 HE ARG 124 HE ARG 124 11.305 -5.264 -2.207 942 HH11 ARG 124 HH11 ARG 124 10.298 -4.368 -5.498 943 HH12 ARG 124 HH12 ARG 124 10.326 -5.980 -6.045 944 HH21 ARG 124 HH21 ARG 124 11.377 -7.367 -2.938 945 HH22 ARG 124 HH22 ARG 124 10.981 -7.755 -4.561 946 HA PRO 125 HA PRO 125 12.267 -1.964 3.435 947 HB2 PRO 125 HB2 PRO 125 10.002 -0.429 2.254 948 HB3 PRO 125 HB3 PRO 125 10.904 -0.115 3.745 949 HG2 PRO 125 HG2 PRO 125 11.404 1.334 1.603 950 HG3 PRO 125 HG3 PRO 125 12.749 0.728 2.588 951 HD2 PRO 125 HD2 PRO 125 11.750 -0.245 -0.056 952 HD3 PRO 125 HD3 PRO 125 13.414 -0.110 0.558 953 H VAL 126 H VAL 126 10.125 -2.702 0.720 954 HA VAL 126 HA VAL 126 8.028 -3.906 2.170 955 HB VAL 126 HB VAL 126 8.952 -4.612 -0.640 956 HG11 VAL 126 HG11 VAL 126 6.686 -5.462 -0.981 957 HG12 VAL 126 HG12 VAL 126 6.294 -5.118 0.698 958 HG13 VAL 126 HG13 VAL 126 7.506 -6.347 0.308 959 HG21 VAL 126 HG21 VAL 126 8.372 -2.258 -0.414 960 HG22 VAL 126 HG22 VAL 126 6.818 -2.703 0.289 961 HG23 VAL 126 HG23 VAL 126 7.174 -3.112 -1.390 962 H ASP 127 H ASP 127 10.998 -5.297 0.852 963 HA ASP 127 HA ASP 127 10.454 -7.968 1.584 964 HB2 ASP 127 HB2 ASP 127 13.139 -6.608 1.214 965 HB3 ASP 127 HB3 ASP 127 12.837 -8.342 1.169 966 H ALA 128 H ALA 128 12.060 -5.280 3.083 967 HA ALA 128 HA ALA 128 13.224 -6.544 5.266 968 HB1 ALA 128 HB1 ALA 128 12.192 -3.713 5.136 969 HB2 ALA 128 HB2 ALA 128 13.764 -4.260 4.569 970 HB3 ALA 128 HB3 ALA 128 13.374 -4.335 6.288 971 H LEU 129 H LEU 129 9.950 -5.223 4.887 972 HA LEU 129 HA LEU 129 9.311 -5.531 7.649 973 HB2 LEU 129 HB2 LEU 129 6.986 -5.061 7.039 974 HB3 LEU 129 HB3 LEU 129 8.082 -3.880 6.375 975 HG LEU 129 HG LEU 129 7.911 -5.401 4.255 976 HD11 LEU 129 HD11 LEU 129 5.313 -5.989 5.628 977 HD12 LEU 129 HD12 LEU 129 6.620 -7.120 5.300 978 HD13 LEU 129 HD13 LEU 129 5.717 -6.405 3.949 979 HD21 LEU 129 HD21 LEU 129 7.263 -3.061 4.318 980 HD22 LEU 129 HD22 LEU 129 5.741 -3.479 5.103 981 HD23 LEU 129 HD23 LEU 129 6.046 -3.997 3.447 982 H HIS 130 H HIS 130 9.010 -7.640 4.911 983 HA HIS 130 HA HIS 130 7.466 -9.616 6.329 984 HB2 HIS 130 HB2 HIS 130 7.626 -9.268 3.760 985 HB3 HIS 130 HB3 HIS 130 9.167 -10.104 3.872 986 HD1 HIS 130 HD1 HIS 130 9.020 -12.772 4.552 987 HD2 HIS 130 HD2 HIS 130 5.393 -10.834 3.824 988 HE1 HIS 130 HE1 HIS 130 7.342 -14.559 4.155 989 H ALA 131 H ALA 131 10.708 -8.700 5.920 990 HA ALA 131 HA ALA 131 11.899 -11.165 6.908 991 HB1 ALA 131 HB1 ALA 131 13.221 -8.500 6.378 992 HB2 ALA 131 HB2 ALA 131 13.051 -9.787 5.188 993 HB3 ALA 131 HB3 ALA 131 14.037 -10.042 6.628 994 H HIS 132 H HIS 132 10.141 -9.164 8.438 995 HA HIS 132 HA HIS 132 9.756 -8.687 10.634 996 HB2 HIS 132 HB2 HIS 132 12.134 -10.506 11.158 997 HB3 HIS 132 HB3 HIS 132 11.000 -9.946 12.383 998 HD1 HIS 132 HD1 HIS 132 11.505 -12.641 9.875 999 HD2 HIS 132 HD2 HIS 132 8.362 -11.020 12.066 1000 HE1 HIS 132 HE1 HIS 132 9.628 -14.286 9.715 1001 H GLN 133 H GLN 133 11.571 -7.128 8.972 1002 HA GLN 133 HA GLN 133 13.034 -5.696 11.066 1003 HB2 GLN 133 HB2 GLN 133 13.398 -5.690 8.056 1004 HB3 GLN 133 HB3 GLN 133 14.291 -4.656 9.161 1005 HG2 GLN 133 HG2 GLN 133 15.301 -6.610 10.202 1006 HG3 GLN 133 HG3 GLN 133 14.361 -7.667 9.152 1007 HE21 GLN 133 HE21 GLN 133 17.018 -5.463 9.327 1008 HE22 GLN 133 HE22 GLN 133 17.701 -5.844 7.785 1009 H ALA 134 H ALA 134 10.228 -5.750 10.413 1010 HA ALA 134 HA ALA 134 9.223 -3.687 8.881 1011 HB1 ALA 134 HB1 ALA 134 7.160 -3.939 10.113 1012 HB2 ALA 134 HB2 ALA 134 8.006 -4.798 11.398 1013 HB3 ALA 134 HB3 ALA 134 7.877 -5.518 9.794 1014 H ARG 135 H ARG 135 10.503 -3.488 12.159 1015 HA ARG 135 HA ARG 135 9.402 -0.940 12.715 1016 HB2 ARG 135 HB2 ARG 135 11.789 -2.336 13.888 1017 HB3 ARG 135 HB3 ARG 135 11.219 -0.778 14.461 1018 HG2 ARG 135 HG2 ARG 135 9.586 -3.316 14.449 1019 HG3 ARG 135 HG3 ARG 135 10.391 -2.624 15.860 1020 HD2 ARG 135 HD2 ARG 135 9.043 -0.644 15.731 1021 HD3 ARG 135 HD3 ARG 135 8.294 -1.169 14.230 1022 HE ARG 135 HE ARG 135 7.941 -3.013 16.346 1023 HH11 ARG 135 HH11 ARG 135 6.703 0.083 15.096 1024 HH12 ARG 135 HH12 ARG 135 5.104 -0.191 15.600 1025 HH21 ARG 135 HH21 ARG 135 5.717 -3.347 17.085 1026 HH22 ARG 135 HH22 ARG 135 4.547 -2.170 16.751 1027 H GLU 136 H GLU 136 12.311 -1.911 11.097 1028 HA GLU 136 HA GLU 136 13.443 0.684 10.952 1029 HB2 GLU 136 HB2 GLU 136 13.815 -1.825 9.338 1030 HB3 GLU 136 HB3 GLU 136 14.788 -0.372 9.092 1031 HG2 GLU 136 HG2 GLU 136 14.581 -1.814 11.717 1032 HG3 GLU 136 HG3 GLU 136 15.818 -2.161 10.508 1033 H VAL 137 H VAL 137 11.090 -1.077 9.158 1034 HA VAL 137 HA VAL 137 10.980 0.669 6.899 1035 HB VAL 137 HB VAL 137 8.874 -1.259 7.934 1036 HG11 VAL 137 HG11 VAL 137 7.927 0.375 6.391 1037 HG12 VAL 137 HG12 VAL 137 7.987 -1.220 5.644 1038 HG13 VAL 137 HG13 VAL 137 9.181 0.005 5.208 1039 HG21 VAL 137 HG21 VAL 137 9.772 -2.803 6.219 1040 HG22 VAL 137 HG22 VAL 137 10.947 -2.411 7.478 1041 HG23 VAL 137 HG23 VAL 137 11.053 -1.642 5.893 1042 H VAL 138 H VAL 138 9.064 0.257 9.845 1043 HA VAL 138 HA VAL 138 7.332 2.438 9.515 1044 HB VAL 138 HB VAL 138 8.401 1.310 12.134 1045 HG11 VAL 138 HG11 VAL 138 6.381 2.279 13.161 1046 HG12 VAL 138 HG12 VAL 138 5.960 3.014 11.615 1047 HG13 VAL 138 HG13 VAL 138 7.426 3.514 12.459 1048 HG21 VAL 138 HG21 VAL 138 7.277 -0.395 10.799 1049 HG22 VAL 138 HG22 VAL 138 5.870 0.656 10.619 1050 HG23 VAL 138 HG23 VAL 138 6.308 0.029 12.208 1051 H ARG 139 H ARG 139 10.508 2.199 10.963 1052 HA ARG 139 HA ARG 139 10.907 4.780 11.857 1053 HB2 ARG 139 HB2 ARG 139 12.396 2.939 12.325 1054 HB3 ARG 139 HB3 ARG 139 12.803 2.800 10.630 1055 HG2 ARG 139 HG2 ARG 139 13.927 4.943 10.707 1056 HG3 ARG 139 HG3 ARG 139 13.494 5.123 12.411 1057 HD2 ARG 139 HD2 ARG 139 14.715 3.103 12.954 1058 HD3 ARG 139 HD3 ARG 139 15.118 2.872 11.255 1059 HE ARG 139 HE ARG 139 15.926 5.385 12.306 1060 HH11 ARG 139 HH11 ARG 139 16.827 1.957 12.040 1061 HH12 ARG 139 HH12 ARG 139 18.504 2.256 12.142 1062 HH21 ARG 139 HH21 ARG 139 18.237 5.769 12.427 1063 HH22 ARG 139 HH22 ARG 139 19.317 4.447 12.337 1064 H ARG 140 H ARG 140 11.590 3.424 8.606 1065 HA ARG 140 HA ARG 140 12.544 5.829 7.471 1066 HB2 ARG 140 HB2 ARG 140 12.877 3.618 6.377 1067 HB3 ARG 140 HB3 ARG 140 11.151 3.527 6.048 1068 HG2 ARG 140 HG2 ARG 140 12.173 4.205 4.023 1069 HG3 ARG 140 HG3 ARG 140 11.415 5.645 4.694 1070 HD2 ARG 140 HD2 ARG 140 13.767 6.080 5.748 1071 HD3 ARG 140 HD3 ARG 140 14.327 4.943 4.526 1072 HE ARG 140 HE ARG 140 12.786 7.337 3.861 1073 HH11 ARG 140 HH11 ARG 140 15.577 5.227 3.084 1074 HH12 ARG 140 HH12 ARG 140 16.233 6.360 2.000 1075 HH21 ARG 140 HH21 ARG 140 13.747 8.810 2.269 1076 HH22 ARG 140 HH22 ARG 140 15.198 8.348 1.508 1077 H ALA 141 H ALA 141 9.344 4.466 7.807 1078 HA ALA 141 HA ALA 141 7.883 6.305 6.258 1079 HB1 ALA 141 HB1 ALA 141 6.929 4.194 6.901 1080 HB2 ALA 141 HB2 ALA 141 5.960 5.490 7.643 1081 HB3 ALA 141 HB3 ALA 141 7.121 4.592 8.602 1082 H GLN 142 H GLN 142 8.663 6.213 9.711 1083 HA GLN 142 HA GLN 142 7.294 8.603 10.344 1084 HB2 GLN 142 HB2 GLN 142 9.591 7.307 11.813 1085 HB3 GLN 142 HB3 GLN 142 8.562 8.577 12.458 1086 HG2 GLN 142 HG2 GLN 142 6.627 7.080 12.263 1087 HG3 GLN 142 HG3 GLN 142 7.685 5.810 11.661 1088 HE21 GLN 142 HE21 GLN 142 6.015 5.769 14.000 1089 HE22 GLN 142 HE22 GLN 142 7.060 5.502 15.334 1090 H ALA 143 H ALA 143 10.577 7.913 9.365 1091 HA ALA 143 HA ALA 143 11.517 10.577 9.609 1092 HB1 ALA 143 HB1 ALA 143 12.548 8.341 7.857 1093 HB2 ALA 143 HB2 ALA 143 13.038 8.652 9.522 1094 HB3 ALA 143 HB3 ALA 143 13.415 9.823 8.258 1095 H MET 144 H MET 144 9.541 8.996 7.320 1096 HA MET 144 HA MET 144 9.997 10.835 5.150 1097 HB2 MET 144 HB2 MET 144 9.246 8.574 4.630 1098 HB3 MET 144 HB3 MET 144 7.835 8.768 5.648 1099 HG2 MET 144 HG2 MET 144 7.258 8.880 3.287 1100 HG3 MET 144 HG3 MET 144 6.916 10.401 4.101 1101 HE1 MET 144 HE1 MET 144 10.502 9.748 1.250 1102 HE2 MET 144 HE2 MET 144 9.334 8.495 1.654 1103 HE3 MET 144 HE3 MET 144 10.472 9.071 2.875 1104 H ALA 145 H ALA 145 7.881 10.557 7.866 1105 HA ALA 145 HA ALA 145 6.248 12.785 6.991 1106 HB1 ALA 145 HB1 ALA 145 6.173 11.256 9.587 1107 HB2 ALA 145 HB2 ALA 145 5.199 10.901 8.161 1108 HB3 ALA 145 HB3 ALA 145 4.969 12.422 9.029 1109 H TYR 146 H TYR 146 8.707 12.130 9.474 1110 HA TYR 146 HA TYR 146 8.841 15.012 9.945 1111 HB2 TYR 146 HB2 TYR 146 9.257 12.780 11.953 1112 HB3 TYR 146 HB3 TYR 146 9.579 14.479 12.265 1113 HD1 TYR 146 HD1 TYR 146 7.718 16.083 12.430 1114 HD2 TYR 146 HD2 TYR 146 7.016 11.918 11.944 1115 HE1 TYR 146 HE1 TYR 146 5.380 16.406 13.105 1116 HE2 TYR 146 HE2 TYR 146 4.677 12.227 12.618 1117 HH TYR 146 HH TYR 146 3.358 13.751 13.828 Start of MODEL 25 1 H MET 1 H MET 1 -8.849 29.513 -3.454 2 HA MET 1 HA MET 1 -10.846 31.522 -2.684 3 HB2 MET 1 HB2 MET 1 -10.959 30.369 -5.005 4 HB3 MET 1 HB3 MET 1 -11.226 28.883 -4.113 5 HG2 MET 1 HG2 MET 1 -12.996 31.326 -4.111 6 HG3 MET 1 HG3 MET 1 -13.289 29.838 -4.995 7 HE1 MET 1 HE1 MET 1 -15.484 31.099 -3.341 8 HE2 MET 1 HE2 MET 1 -16.120 29.774 -2.365 9 HE3 MET 1 HE3 MET 1 -15.695 29.506 -4.061 10 HA PRO 2 HA PRO 2 -10.268 29.077 1.038 11 HB2 PRO 2 HB2 PRO 2 -12.766 30.428 1.869 12 HB3 PRO 2 HB3 PRO 2 -11.189 30.373 2.660 13 HG2 PRO 2 HG2 PRO 2 -12.040 32.586 1.430 14 HG3 PRO 2 HG3 PRO 2 -10.334 32.104 1.406 15 HD2 PRO 2 HD2 PRO 2 -12.400 31.859 -0.732 16 HD3 PRO 2 HD3 PRO 2 -10.671 32.261 -0.842 17 H GLY 3 H GLY 3 -10.829 27.070 1.203 18 HA2 GLY 3 HA2 GLY 3 -13.597 26.254 0.656 19 HA3 GLY 3 HA3 GLY 3 -12.222 25.329 0.046 20 H ARG 4 H ARG 4 -12.769 26.908 3.076 21 HA ARG 4 HA ARG 4 -11.795 24.827 4.684 22 HB2 ARG 4 HB2 ARG 4 -12.704 25.986 6.621 23 HB3 ARG 4 HB3 ARG 4 -11.964 27.154 5.544 24 HG2 ARG 4 HG2 ARG 4 -14.935 26.638 5.652 25 HG3 ARG 4 HG3 ARG 4 -14.132 27.836 6.655 26 HD2 ARG 4 HD2 ARG 4 -13.428 29.055 4.683 27 HD3 ARG 4 HD3 ARG 4 -14.084 27.793 3.641 28 HE ARG 4 HE ARG 4 -16.265 28.344 4.594 29 HH11 ARG 4 HH11 ARG 4 -13.711 30.841 4.611 30 HH12 ARG 4 HH12 ARG 4 -14.764 32.145 4.444 31 HH21 ARG 4 HH21 ARG 4 -17.742 30.184 4.351 32 HH22 ARG 4 HH22 ARG 4 -17.124 31.771 4.330 33 H ALA 5 H ALA 5 -12.789 23.202 5.844 34 HA ALA 5 HA ALA 5 -15.542 22.679 5.023 35 HB1 ALA 5 HB1 ALA 5 -13.346 20.661 5.492 36 HB2 ALA 5 HB2 ALA 5 -13.954 21.177 3.918 37 HB3 ALA 5 HB3 ALA 5 -15.010 20.305 5.025 38 HA PRO 6 HA PRO 6 -15.783 22.871 9.541 39 HB2 PRO 6 HB2 PRO 6 -18.488 23.200 9.641 40 HB3 PRO 6 HB3 PRO 6 -17.370 24.538 9.356 41 HG2 PRO 6 HG2 PRO 6 -19.032 23.009 7.410 42 HG3 PRO 6 HG3 PRO 6 -18.660 24.738 7.446 43 HD2 PRO 6 HD2 PRO 6 -17.427 22.951 5.795 44 HD3 PRO 6 HD3 PRO 6 -16.663 24.452 6.357 45 H GLY 7 H GLY 7 -15.789 21.054 10.706 46 HA2 GLY 7 HA2 GLY 7 -17.377 18.783 9.754 47 HA3 GLY 7 HA3 GLY 7 -15.963 18.684 10.799 48 H SER 8 H SER 8 -19.385 19.144 10.645 49 HA SER 8 HA SER 8 -19.820 19.959 13.307 50 HB2 SER 8 HB2 SER 8 -21.647 18.380 11.494 51 HB3 SER 8 HB3 SER 8 -22.128 19.387 12.857 52 HG SER 8 HG SER 8 -21.791 21.141 11.737 53 H THR 9 H THR 9 -19.534 16.896 11.724 54 HA THR 9 HA THR 9 -19.281 15.538 14.291 55 HB THR 9 HB THR 9 -20.762 14.515 11.841 56 HG1 THR 9 HG1 THR 9 -21.560 15.791 14.210 57 HG21 THR 9 HG21 THR 9 -19.701 12.720 13.172 58 HG22 THR 9 HG22 THR 9 -21.458 12.665 13.307 59 HG23 THR 9 HG23 THR 9 -20.493 13.336 14.623 60 H LEU 10 H LEU 10 -17.625 13.969 14.238 61 HA LEU 10 HA LEU 10 -15.681 14.420 12.177 62 HB2 LEU 10 HB2 LEU 10 -15.593 12.597 14.571 63 HB3 LEU 10 HB3 LEU 10 -14.240 12.981 13.535 64 HG LEU 10 HG LEU 10 -15.697 14.894 15.355 65 HD11 LEU 10 HD11 LEU 10 -13.569 14.980 16.553 66 HD12 LEU 10 HD12 LEU 10 -12.910 13.763 15.457 67 HD13 LEU 10 HD13 LEU 10 -14.247 13.352 16.529 68 HD21 LEU 10 HD21 LEU 10 -13.339 15.408 13.532 69 HD22 LEU 10 HD22 LEU 10 -14.021 16.543 14.695 70 HD23 LEU 10 HD23 LEU 10 -14.976 16.033 13.309 71 H ALA 11 H ALA 11 -14.666 12.788 10.985 72 HA ALA 11 HA ALA 11 -16.389 10.470 10.468 73 HB1 ALA 11 HB1 ALA 11 -16.429 12.061 8.599 74 HB2 ALA 11 HB2 ALA 11 -15.618 10.568 8.137 75 HB3 ALA 11 HB3 ALA 11 -14.668 12.007 8.514 76 H ARG 12 H ARG 12 -15.389 8.817 11.452 77 HA ARG 12 HA ARG 12 -12.511 8.790 11.642 78 HB2 ARG 12 HB2 ARG 12 -14.563 6.788 12.625 79 HB3 ARG 12 HB3 ARG 12 -12.839 6.591 12.831 80 HG2 ARG 12 HG2 ARG 12 -13.775 7.357 14.898 81 HG3 ARG 12 HG3 ARG 12 -12.823 8.664 14.205 82 HD2 ARG 12 HD2 ARG 12 -14.968 9.432 15.175 83 HD3 ARG 12 HD3 ARG 12 -14.829 9.784 13.455 84 HE ARG 12 HE ARG 12 -16.109 7.382 13.550 85 HH11 ARG 12 HH11 ARG 12 -16.818 10.480 15.126 86 HH12 ARG 12 HH12 ARG 12 -18.495 10.343 14.956 87 HH21 ARG 12 HH21 ARG 12 -18.461 7.196 13.339 88 HH22 ARG 12 HH22 ARG 12 -19.435 8.466 13.923 89 H VAL 13 H VAL 13 -11.778 8.570 9.655 90 HA VAL 13 HA VAL 13 -12.300 5.996 8.393 91 HB VAL 13 HB VAL 13 -11.971 7.141 6.121 92 HG11 VAL 13 HG11 VAL 13 -14.146 6.318 6.834 93 HG12 VAL 13 HG12 VAL 13 -14.326 7.849 5.972 94 HG13 VAL 13 HG13 VAL 13 -14.423 7.811 7.731 95 HG21 VAL 13 HG21 VAL 13 -12.600 9.516 6.001 96 HG22 VAL 13 HG22 VAL 13 -11.103 9.282 6.909 97 HG23 VAL 13 HG23 VAL 13 -12.614 9.592 7.763 98 H GLY 14 H GLY 14 -10.573 4.833 8.334 99 HA2 GLY 14 HA2 GLY 14 -7.956 6.134 8.275 100 HA3 GLY 14 HA3 GLY 14 -8.269 4.436 8.652 101 H SER 15 H SER 15 -10.192 5.295 6.144 102 HA SER 15 HA SER 15 -8.629 3.857 4.271 103 HB2 SER 15 HB2 SER 15 -10.817 4.558 2.972 104 HB3 SER 15 HB3 SER 15 -10.773 3.187 4.077 105 HG SER 15 HG SER 15 -12.322 5.266 4.216 106 H ILE 16 H ILE 16 -7.079 5.000 3.373 107 HA ILE 16 HA ILE 16 -7.633 7.606 2.276 108 HB ILE 16 HB ILE 16 -5.230 5.743 1.872 109 HG12 ILE 16 HG12 ILE 16 -3.950 7.556 3.149 110 HG13 ILE 16 HG13 ILE 16 -5.512 8.217 3.604 111 HG21 ILE 16 HG21 ILE 16 -5.527 7.150 -0.070 112 HG22 ILE 16 HG22 ILE 16 -4.078 7.618 0.821 113 HG23 ILE 16 HG23 ILE 16 -5.540 8.591 0.950 114 HD11 ILE 16 HD11 ILE 16 -4.550 6.874 5.387 115 HD12 ILE 16 HD12 ILE 16 -4.466 5.481 4.309 116 HD13 ILE 16 HD13 ILE 16 -6.032 6.138 4.784 117 HA PRO 17 HA PRO 17 -9.688 5.622 -1.188 118 HB2 PRO 17 HB2 PRO 17 -9.173 7.645 -3.049 119 HB3 PRO 17 HB3 PRO 17 -10.575 7.581 -1.976 120 HG2 PRO 17 HG2 PRO 17 -8.036 9.116 -1.684 121 HG3 PRO 17 HG3 PRO 17 -9.687 9.568 -1.225 122 HD2 PRO 17 HD2 PRO 17 -7.878 8.794 0.588 123 HD3 PRO 17 HD3 PRO 17 -9.597 8.382 0.758 124 H ALA 18 H ALA 18 -9.090 4.735 -3.282 125 HA ALA 18 HA ALA 18 -6.288 4.026 -3.262 126 HB1 ALA 18 HB1 ALA 18 -6.902 2.445 -5.018 127 HB2 ALA 18 HB2 ALA 18 -8.511 3.167 -5.113 128 HB3 ALA 18 HB3 ALA 18 -8.007 2.322 -3.647 129 H GLY 19 H GLY 19 -4.757 4.996 -4.428 130 HA2 GLY 19 HA2 GLY 19 -5.587 7.014 -6.331 131 HA3 GLY 19 HA3 GLY 19 -4.017 6.854 -5.567 132 H ASP 20 H ASP 20 -2.406 5.923 -6.690 133 HA ASP 20 HA ASP 20 -3.135 4.659 -9.250 134 HB2 ASP 20 HB2 ASP 20 -2.554 7.070 -9.513 135 HB3 ASP 20 HB3 ASP 20 -0.966 6.717 -8.848 136 H ASP 21 H ASP 21 -2.159 2.814 -9.529 137 HA ASP 21 HA ASP 21 -0.540 1.631 -7.546 138 HB2 ASP 21 HB2 ASP 21 -2.011 0.266 -8.867 139 HB3 ASP 21 HB3 ASP 21 -1.149 0.701 -10.338 140 H VAL 22 H VAL 22 1.507 1.298 -7.261 141 HA VAL 22 HA VAL 22 3.356 2.775 -8.973 142 HB VAL 22 HB VAL 22 3.691 1.826 -6.102 143 HG11 VAL 22 HG11 VAL 22 5.772 3.111 -6.038 144 HG12 VAL 22 HG12 VAL 22 5.596 3.498 -7.747 145 HG13 VAL 22 HG13 VAL 22 5.875 1.831 -7.249 146 HG21 VAL 22 HG21 VAL 22 2.158 3.687 -6.336 147 HG22 VAL 22 HG22 VAL 22 3.349 4.570 -7.292 148 HG23 VAL 22 HG23 VAL 22 3.666 4.237 -5.596 149 H LEU 23 H LEU 23 2.609 -0.527 -8.146 150 HA LEU 23 HA LEU 23 5.269 -1.269 -9.011 151 HB2 LEU 23 HB2 LEU 23 4.645 -3.654 -8.414 152 HB3 LEU 23 HB3 LEU 23 4.770 -2.528 -7.098 153 HG LEU 23 HG LEU 23 2.332 -2.503 -6.847 154 HD11 LEU 23 HD11 LEU 23 0.919 -4.004 -8.127 155 HD12 LEU 23 HD12 LEU 23 2.305 -4.537 -9.080 156 HD13 LEU 23 HD13 LEU 23 1.726 -2.877 -9.215 157 HD21 LEU 23 HD21 LEU 23 2.032 -4.840 -6.174 158 HD22 LEU 23 HD22 LEU 23 3.564 -4.154 -5.636 159 HD23 LEU 23 HD23 LEU 23 3.528 -5.249 -7.018 160 H ASP 24 H ASP 24 4.938 -3.691 -10.229 161 HA ASP 24 HA ASP 24 3.988 -2.778 -12.824 162 HB2 ASP 24 HB2 ASP 24 5.403 -5.353 -12.087 163 HB3 ASP 24 HB3 ASP 24 5.009 -4.839 -13.718 164 HA PRO 25 HA PRO 25 0.124 -5.008 -12.412 165 HB2 PRO 25 HB2 PRO 25 0.332 -5.288 -15.361 166 HB3 PRO 25 HB3 PRO 25 -0.976 -4.604 -14.392 167 HG2 PRO 25 HG2 PRO 25 0.649 -3.021 -15.795 168 HG3 PRO 25 HG3 PRO 25 0.071 -2.552 -14.187 169 HD2 PRO 25 HD2 PRO 25 2.749 -3.603 -14.996 170 HD3 PRO 25 HD3 PRO 25 2.323 -2.341 -13.822 171 H ASP 26 H ASP 26 2.907 -6.166 -14.097 172 HA ASP 26 HA ASP 26 2.043 -8.810 -14.641 173 HB2 ASP 26 HB2 ASP 26 4.850 -7.739 -14.334 174 HB3 ASP 26 HB3 ASP 26 4.443 -9.340 -14.938 175 H GLU 27 H GLU 27 3.245 -7.270 -11.802 176 HA GLU 27 HA GLU 27 3.999 -9.658 -10.422 177 HB2 GLU 27 HB2 GLU 27 3.329 -6.863 -9.448 178 HB3 GLU 27 HB3 GLU 27 3.905 -8.153 -8.405 179 HG2 GLU 27 HG2 GLU 27 5.449 -7.120 -10.771 180 HG3 GLU 27 HG3 GLU 27 5.634 -6.491 -9.134 181 HA PRO 28 HA PRO 28 -0.329 -10.825 -9.931 182 HB2 PRO 28 HB2 PRO 28 0.850 -12.794 -8.040 183 HB3 PRO 28 HB3 PRO 28 -0.232 -13.066 -9.415 184 HG2 PRO 28 HG2 PRO 28 2.320 -13.716 -9.636 185 HG3 PRO 28 HG3 PRO 28 1.491 -12.903 -10.972 186 HD2 PRO 28 HD2 PRO 28 3.319 -11.719 -8.908 187 HD3 PRO 28 HD3 PRO 28 3.308 -11.489 -10.678 188 H THR 29 H THR 29 -1.161 -9.171 -8.838 189 HA THR 29 HA THR 29 -0.637 -8.891 -6.002 190 HB THR 29 HB THR 29 -1.934 -6.770 -6.305 191 HG1 THR 29 HG1 THR 29 -3.181 -6.982 -8.045 192 HG21 THR 29 HG21 THR 29 0.359 -7.070 -8.245 193 HG22 THR 29 HG22 THR 29 0.539 -6.816 -6.508 194 HG23 THR 29 HG23 THR 29 -0.219 -5.576 -7.506 195 H TYR 30 H TYR 30 -3.036 -7.745 -5.337 196 HA TYR 30 HA TYR 30 -4.878 -9.919 -5.722 197 HB2 TYR 30 HB2 TYR 30 -4.455 -8.006 -3.442 198 HB3 TYR 30 HB3 TYR 30 -5.960 -8.910 -3.648 199 HD1 TYR 30 HD1 TYR 30 -5.878 -11.361 -3.748 200 HD2 TYR 30 HD2 TYR 30 -2.544 -9.068 -2.515 201 HE1 TYR 30 HE1 TYR 30 -4.914 -13.355 -2.759 202 HE2 TYR 30 HE2 TYR 30 -1.543 -11.066 -1.487 203 HH TYR 30 HH TYR 30 -2.217 -13.246 -0.661 204 H ASP 31 H ASP 31 -7.078 -9.187 -5.780 205 HA ASP 31 HA ASP 31 -7.502 -6.588 -7.045 206 HB2 ASP 31 HB2 ASP 31 -8.446 -9.318 -8.054 207 HB3 ASP 31 HB3 ASP 31 -9.026 -7.787 -8.673 208 H LEU 32 H LEU 32 -9.952 -6.210 -6.932 209 HA LEU 32 HA LEU 32 -10.670 -6.326 -4.342 210 HB2 LEU 32 HB2 LEU 32 -11.506 -4.745 -5.998 211 HB3 LEU 32 HB3 LEU 32 -12.445 -6.015 -6.749 212 HG LEU 32 HG LEU 32 -13.695 -6.260 -4.703 213 HD11 LEU 32 HD11 LEU 32 -13.595 -4.384 -3.013 214 HD12 LEU 32 HD12 LEU 32 -12.164 -3.784 -3.847 215 HD13 LEU 32 HD13 LEU 32 -12.134 -5.365 -3.070 216 HD21 LEU 32 HD21 LEU 32 -15.044 -4.191 -4.988 217 HD22 LEU 32 HD22 LEU 32 -14.594 -4.945 -6.518 218 HD23 LEU 32 HD23 LEU 32 -13.732 -3.515 -5.953 219 HA PRO 33 HA PRO 33 -13.682 -10.098 -5.010 220 HB2 PRO 33 HB2 PRO 33 -13.112 -11.769 -7.103 221 HB3 PRO 33 HB3 PRO 33 -14.311 -10.478 -7.196 222 HG2 PRO 33 HG2 PRO 33 -11.460 -10.471 -8.126 223 HG3 PRO 33 HG3 PRO 33 -12.907 -9.877 -8.963 224 HD2 PRO 33 HD2 PRO 33 -11.244 -8.199 -7.713 225 HD3 PRO 33 HD3 PRO 33 -13.001 -7.942 -7.681 226 H ARG 34 H ARG 34 -10.329 -10.400 -6.107 227 HA ARG 34 HA ARG 34 -9.838 -12.952 -5.067 228 HB2 ARG 34 HB2 ARG 34 -8.495 -11.654 -6.798 229 HB3 ARG 34 HB3 ARG 34 -7.822 -10.767 -5.439 230 HG2 ARG 34 HG2 ARG 34 -6.293 -12.503 -6.088 231 HG3 ARG 34 HG3 ARG 34 -6.985 -12.880 -4.504 232 HD2 ARG 34 HD2 ARG 34 -8.532 -14.399 -5.451 233 HD3 ARG 34 HD3 ARG 34 -8.056 -13.927 -7.084 234 HE ARG 34 HE ARG 34 -5.855 -14.914 -5.551 235 HH11 ARG 34 HH11 ARG 34 -8.667 -16.042 -7.373 236 HH12 ARG 34 HH12 ARG 34 -8.037 -17.595 -7.638 237 HH21 ARG 34 HH21 ARG 34 -5.012 -17.006 -5.898 238 HH22 ARG 34 HH22 ARG 34 -5.894 -18.169 -6.778 239 H VAL 35 H VAL 35 -9.583 -9.706 -3.680 240 HA VAL 35 HA VAL 35 -8.256 -10.550 -1.315 241 HB VAL 35 HB VAL 35 -9.991 -8.074 -1.683 242 HG11 VAL 35 HG11 VAL 35 -8.721 -7.141 0.201 243 HG12 VAL 35 HG12 VAL 35 -7.883 -8.682 0.394 244 HG13 VAL 35 HG13 VAL 35 -9.622 -8.584 0.666 245 HG21 VAL 35 HG21 VAL 35 -7.974 -6.859 -2.146 246 HG22 VAL 35 HG22 VAL 35 -8.127 -8.193 -3.280 247 HG23 VAL 35 HG23 VAL 35 -6.996 -8.311 -1.919 248 H ALA 36 H ALA 36 -11.592 -10.054 -2.216 249 HA ALA 36 HA ALA 36 -12.799 -10.642 0.239 250 HB1 ALA 36 HB1 ALA 36 -13.818 -11.175 -2.562 251 HB2 ALA 36 HB2 ALA 36 -14.008 -9.665 -1.666 252 HB3 ALA 36 HB3 ALA 36 -14.800 -11.136 -1.095 253 H GLU 37 H GLU 37 -11.617 -12.637 -2.352 254 HA GLU 37 HA GLU 37 -12.558 -15.123 -1.408 255 HB2 GLU 37 HB2 GLU 37 -11.545 -14.370 -3.711 256 HB3 GLU 37 HB3 GLU 37 -10.048 -14.839 -2.959 257 HG2 GLU 37 HG2 GLU 37 -10.966 -16.697 -4.251 258 HG3 GLU 37 HG3 GLU 37 -10.829 -17.078 -2.533 259 H LEU 38 H LEU 38 -9.481 -13.428 -1.038 260 HA LEU 38 HA LEU 38 -8.124 -15.458 0.365 261 HB2 LEU 38 HB2 LEU 38 -6.977 -13.651 -0.787 262 HB3 LEU 38 HB3 LEU 38 -7.664 -12.480 0.321 263 HG LEU 38 HG LEU 38 -6.426 -13.616 2.169 264 HD11 LEU 38 HD11 LEU 38 -6.073 -15.777 1.153 265 HD12 LEU 38 HD12 LEU 38 -4.530 -15.047 1.589 266 HD13 LEU 38 HD13 LEU 38 -5.056 -15.053 -0.093 267 HD21 LEU 38 HD21 LEU 38 -4.264 -12.617 1.606 268 HD22 LEU 38 HD22 LEU 38 -5.608 -11.560 1.184 269 HD23 LEU 38 HD23 LEU 38 -4.778 -12.471 -0.076 270 H LEU 39 H LEU 39 -9.886 -12.600 1.480 271 HA LEU 39 HA LEU 39 -9.339 -13.237 4.238 272 HB2 LEU 39 HB2 LEU 39 -11.063 -11.116 3.001 273 HB3 LEU 39 HB3 LEU 39 -10.771 -11.262 4.725 274 HG LEU 39 HG LEU 39 -8.730 -10.620 2.591 275 HD11 LEU 39 HD11 LEU 39 -10.239 -8.782 3.060 276 HD12 LEU 39 HD12 LEU 39 -8.626 -8.441 3.683 277 HD13 LEU 39 HD13 LEU 39 -9.914 -8.932 4.788 278 HD21 LEU 39 HD21 LEU 39 -7.684 -11.924 4.366 279 HD22 LEU 39 HD22 LEU 39 -8.396 -10.868 5.586 280 HD23 LEU 39 HD23 LEU 39 -7.183 -10.240 4.475 281 H GLY 40 H GLY 40 -11.591 -14.237 2.012 282 HA2 GLY 40 HA2 GLY 40 -13.386 -15.655 2.191 283 HA3 GLY 40 HA3 GLY 40 -12.953 -15.878 3.879 284 H VAL 41 H VAL 41 -13.653 -12.808 2.445 285 HA VAL 41 HA VAL 41 -16.230 -12.711 3.838 286 HB VAL 41 HB VAL 41 -15.761 -10.419 4.629 287 HG11 VAL 41 HG11 VAL 41 -13.742 -12.423 5.600 288 HG12 VAL 41 HG12 VAL 41 -15.400 -12.244 6.171 289 HG13 VAL 41 HG13 VAL 41 -14.225 -10.955 6.452 290 HG21 VAL 41 HG21 VAL 41 -14.088 -9.737 3.003 291 HG22 VAL 41 HG22 VAL 41 -12.954 -10.917 3.660 292 HG23 VAL 41 HG23 VAL 41 -13.458 -9.537 4.639 293 HA PRO 42 HA PRO 42 -17.645 -10.791 0.102 294 HB2 PRO 42 HB2 PRO 42 -19.444 -8.969 1.061 295 HB3 PRO 42 HB3 PRO 42 -19.784 -10.701 0.950 296 HG2 PRO 42 HG2 PRO 42 -18.887 -9.097 3.310 297 HG3 PRO 42 HG3 PRO 42 -20.145 -10.346 3.226 298 HD2 PRO 42 HD2 PRO 42 -17.715 -10.900 4.196 299 HD3 PRO 42 HD3 PRO 42 -18.599 -12.076 3.202 300 H VAL 43 H VAL 43 -17.831 -8.690 -0.989 301 HA VAL 43 HA VAL 43 -15.483 -7.192 -0.861 302 HB VAL 43 HB VAL 43 -18.140 -6.392 -2.088 303 HG11 VAL 43 HG11 VAL 43 -16.629 -4.485 -1.905 304 HG12 VAL 43 HG12 VAL 43 -16.826 -4.977 -3.589 305 HG13 VAL 43 HG13 VAL 43 -15.361 -5.413 -2.709 306 HG21 VAL 43 HG21 VAL 43 -15.797 -7.850 -3.283 307 HG22 VAL 43 HG22 VAL 43 -17.246 -7.328 -4.152 308 HG23 VAL 43 HG23 VAL 43 -17.368 -8.538 -2.865 309 H SER 44 H SER 44 -18.651 -6.576 0.494 310 HA SER 44 HA SER 44 -18.368 -3.990 1.360 311 HB2 SER 44 HB2 SER 44 -19.815 -6.279 2.636 312 HB3 SER 44 HB3 SER 44 -20.203 -4.558 2.853 313 HG SER 44 HG SER 44 -20.399 -4.608 0.458 314 H LYS 45 H LYS 45 -17.342 -7.028 2.992 315 HA LYS 45 HA LYS 45 -16.549 -5.581 5.280 316 HB2 LYS 45 HB2 LYS 45 -15.863 -8.391 4.478 317 HB3 LYS 45 HB3 LYS 45 -15.295 -7.649 5.967 318 HG2 LYS 45 HG2 LYS 45 -17.750 -7.210 6.504 319 HG3 LYS 45 HG3 LYS 45 -18.129 -8.297 5.173 320 HD2 LYS 45 HD2 LYS 45 -18.185 -9.516 7.271 321 HD3 LYS 45 HD3 LYS 45 -16.818 -10.083 6.314 322 HE2 LYS 45 HE2 LYS 45 -15.298 -8.680 7.633 323 HE3 LYS 45 HE3 LYS 45 -16.664 -8.056 8.557 324 HZ1 LYS 45 HZ1 LYS 45 -17.052 -10.305 9.355 325 HZ2 LYS 45 HZ2 LYS 45 -15.520 -9.754 9.761 326 HZ3 LYS 45 HZ3 LYS 45 -15.703 -10.869 8.521 327 H VAL 46 H VAL 46 -14.918 -6.628 2.397 328 HA VAL 46 HA VAL 46 -12.264 -5.918 3.172 329 HB VAL 46 HB VAL 46 -13.530 -5.791 0.410 330 HG11 VAL 46 HG11 VAL 46 -11.489 -4.514 0.562 331 HG12 VAL 46 HG12 VAL 46 -11.239 -5.949 -0.446 332 HG13 VAL 46 HG13 VAL 46 -10.630 -5.907 1.218 333 HG21 VAL 46 HG21 VAL 46 -13.710 -8.031 1.348 334 HG22 VAL 46 HG22 VAL 46 -11.988 -8.030 1.724 335 HG23 VAL 46 HG23 VAL 46 -12.521 -8.007 0.046 336 H ALA 47 H ALA 47 -14.887 -4.075 1.751 337 HA ALA 47 HA ALA 47 -13.554 -1.651 1.432 338 HB1 ALA 47 HB1 ALA 47 -16.455 -2.083 2.151 339 HB2 ALA 47 HB2 ALA 47 -15.792 -2.068 0.515 340 HB3 ALA 47 HB3 ALA 47 -15.764 -0.601 1.495 341 H GLN 48 H GLN 48 -15.217 -3.003 4.234 342 HA GLN 48 HA GLN 48 -14.742 -0.673 5.796 343 HB2 GLN 48 HB2 GLN 48 -15.707 -1.732 7.706 344 HB3 GLN 48 HB3 GLN 48 -16.659 -2.210 6.317 345 HG2 GLN 48 HG2 GLN 48 -15.453 -4.360 6.291 346 HG3 GLN 48 HG3 GLN 48 -14.606 -3.859 7.741 347 HE21 GLN 48 HE21 GLN 48 -16.921 -2.505 8.878 348 HE22 GLN 48 HE22 GLN 48 -17.975 -3.751 9.414 349 H GLN 49 H GLN 49 -12.985 -3.662 5.374 350 HA GLN 49 HA GLN 49 -11.107 -3.439 7.440 351 HB2 GLN 49 HB2 GLN 49 -10.507 -4.304 4.596 352 HB3 GLN 49 HB3 GLN 49 -9.557 -4.697 6.018 353 HG2 GLN 49 HG2 GLN 49 -12.345 -5.640 5.413 354 HG3 GLN 49 HG3 GLN 49 -10.867 -6.590 5.288 355 HE21 GLN 49 HE21 GLN 49 -9.902 -7.303 7.120 356 HE22 GLN 49 HE22 GLN 49 -10.700 -7.277 8.657 357 H LEU 50 H LEU 50 -11.118 -2.143 4.207 358 HA LEU 50 HA LEU 50 -8.754 -0.638 4.279 359 HB2 LEU 50 HB2 LEU 50 -11.318 -0.366 2.759 360 HB3 LEU 50 HB3 LEU 50 -9.921 0.656 2.405 361 HG LEU 50 HG LEU 50 -10.104 -2.356 2.124 362 HD11 LEU 50 HD11 LEU 50 -10.056 -1.911 -0.283 363 HD12 LEU 50 HD12 LEU 50 -10.094 -0.178 0.037 364 HD13 LEU 50 HD13 LEU 50 -11.470 -1.187 0.481 365 HD21 LEU 50 HD21 LEU 50 -7.832 -1.614 2.626 366 HD22 LEU 50 HD22 LEU 50 -7.914 -0.443 1.309 367 HD23 LEU 50 HD23 LEU 50 -7.962 -2.169 0.959 368 H ARG 51 H ARG 51 -12.117 0.197 5.059 369 HA ARG 51 HA ARG 51 -11.691 2.934 5.687 370 HB2 ARG 51 HB2 ARG 51 -13.868 1.082 6.632 371 HB3 ARG 51 HB3 ARG 51 -13.853 2.819 6.899 372 HG2 ARG 51 HG2 ARG 51 -13.857 3.159 4.462 373 HG3 ARG 51 HG3 ARG 51 -13.962 1.412 4.246 374 HD2 ARG 51 HD2 ARG 51 -16.155 2.401 4.043 375 HD3 ARG 51 HD3 ARG 51 -16.081 1.409 5.498 376 HE ARG 51 HE ARG 51 -15.607 3.663 6.632 377 HH11 ARG 51 HH11 ARG 51 -17.863 3.178 3.915 378 HH12 ARG 51 HH12 ARG 51 -18.770 4.568 4.274 379 HH21 ARG 51 HH21 ARG 51 -16.910 5.503 7.138 380 HH22 ARG 51 HH22 ARG 51 -18.245 5.906 6.131 381 H GLU 52 H GLU 52 -11.097 0.099 7.543 382 HA GLU 52 HA GLU 52 -10.897 1.704 9.941 383 HB2 GLU 52 HB2 GLU 52 -10.729 -1.264 9.488 384 HB3 GLU 52 HB3 GLU 52 -10.469 -0.513 11.054 385 HG2 GLU 52 HG2 GLU 52 -12.736 0.434 10.956 386 HG3 GLU 52 HG3 GLU 52 -12.988 -0.376 9.412 387 H GLY 53 H GLY 53 -8.990 1.343 7.445 388 HA2 GLY 53 HA2 GLY 53 -6.805 1.920 7.126 389 HA3 GLY 53 HA3 GLY 53 -6.716 2.282 8.839 390 H HIS 54 H HIS 54 -7.525 -0.840 7.471 391 HA HIS 54 HA HIS 54 -5.306 -1.998 8.926 392 HB2 HIS 54 HB2 HIS 54 -7.470 -3.278 7.255 393 HB3 HIS 54 HB3 HIS 54 -6.182 -4.185 8.034 394 HD1 HIS 54 HD1 HIS 54 -9.563 -3.040 8.609 395 HD2 HIS 54 HD2 HIS 54 -6.216 -3.784 10.946 396 HE1 HIS 54 HE1 HIS 54 -10.417 -3.401 10.946 397 H LEU 55 H LEU 55 -6.120 -1.212 5.632 398 HA LEU 55 HA LEU 55 -3.474 -1.612 4.777 399 HB2 LEU 55 HB2 LEU 55 -3.841 -3.298 3.081 400 HB3 LEU 55 HB3 LEU 55 -4.255 -3.962 4.638 401 HG LEU 55 HG LEU 55 -6.251 -3.056 2.544 402 HD11 LEU 55 HD11 LEU 55 -6.639 -5.429 2.186 403 HD12 LEU 55 HD12 LEU 55 -5.370 -5.814 3.347 404 HD13 LEU 55 HD13 LEU 55 -4.963 -4.994 1.841 405 HD21 LEU 55 HD21 LEU 55 -7.915 -4.249 3.895 406 HD22 LEU 55 HD22 LEU 55 -7.171 -2.952 4.828 407 HD23 LEU 55 HD23 LEU 55 -6.682 -4.624 5.100 408 H VAL 56 H VAL 56 -3.452 -1.185 2.279 409 HA VAL 56 HA VAL 56 -5.602 0.651 1.599 410 HB VAL 56 HB VAL 56 -3.902 2.158 0.486 411 HG11 VAL 56 HG11 VAL 56 -4.896 2.803 2.605 412 HG12 VAL 56 HG12 VAL 56 -3.209 3.313 2.539 413 HG13 VAL 56 HG13 VAL 56 -3.665 1.891 3.476 414 HG21 VAL 56 HG21 VAL 56 -1.569 2.053 1.248 415 HG22 VAL 56 HG22 VAL 56 -2.037 0.599 0.362 416 HG23 VAL 56 HG23 VAL 56 -1.937 0.563 2.121 417 H ALA 57 H ALA 57 -5.595 1.147 -0.766 418 HA ALA 57 HA ALA 57 -4.665 -1.129 -2.326 419 HB1 ALA 57 HB1 ALA 57 -6.859 -1.222 -3.429 420 HB2 ALA 57 HB2 ALA 57 -7.454 0.033 -2.342 421 HB3 ALA 57 HB3 ALA 57 -7.009 -1.546 -1.698 422 H VAL 58 H VAL 58 -4.741 -0.592 -4.646 423 HA VAL 58 HA VAL 58 -4.699 2.269 -5.180 424 HB VAL 58 HB VAL 58 -2.752 1.814 -6.786 425 HG11 VAL 58 HG11 VAL 58 -2.279 1.619 -3.825 426 HG12 VAL 58 HG12 VAL 58 -2.513 3.106 -4.746 427 HG13 VAL 58 HG13 VAL 58 -1.082 2.105 -5.024 428 HG21 VAL 58 HG21 VAL 58 -1.267 -0.054 -6.166 429 HG22 VAL 58 HG22 VAL 58 -2.837 -0.624 -6.736 430 HG23 VAL 58 HG23 VAL 58 -2.475 -0.616 -5.010 431 H ARG 59 H ARG 59 -4.693 2.656 -7.594 432 HA ARG 59 HA ARG 59 -6.353 0.605 -8.832 433 HB2 ARG 59 HB2 ARG 59 -6.745 3.586 -8.851 434 HB3 ARG 59 HB3 ARG 59 -7.523 2.488 -9.985 435 HG2 ARG 59 HG2 ARG 59 -8.713 1.402 -8.265 436 HG3 ARG 59 HG3 ARG 59 -7.803 2.248 -7.011 437 HD2 ARG 59 HD2 ARG 59 -10.064 3.169 -7.339 438 HD3 ARG 59 HD3 ARG 59 -8.802 4.350 -7.659 439 HE ARG 59 HE ARG 59 -9.179 3.771 -10.075 440 HH11 ARG 59 HH11 ARG 59 -11.823 3.538 -7.686 441 HH12 ARG 59 HH12 ARG 59 -13.036 3.807 -8.851 442 HH21 ARG 59 HH21 ARG 59 -10.905 4.252 -11.621 443 HH22 ARG 59 HH22 ARG 59 -12.518 4.253 -11.074 444 H ARG 60 H ARG 60 -6.070 0.175 -10.875 445 HA ARG 60 HA ARG 60 -4.459 1.838 -12.594 446 HB2 ARG 60 HB2 ARG 60 -2.980 -0.009 -13.316 447 HB3 ARG 60 HB3 ARG 60 -2.752 0.350 -11.613 448 HG2 ARG 60 HG2 ARG 60 -4.125 -1.591 -11.036 449 HG3 ARG 60 HG3 ARG 60 -4.336 -1.944 -12.749 450 HD2 ARG 60 HD2 ARG 60 -1.895 -2.195 -12.961 451 HD3 ARG 60 HD3 ARG 60 -1.739 -1.914 -11.225 452 HE ARG 60 HE ARG 60 -3.364 -4.098 -12.282 453 HH11 ARG 60 HH11 ARG 60 -0.671 -3.017 -10.210 454 HH12 ARG 60 HH12 ARG 60 -0.456 -4.534 -9.504 455 HH21 ARG 60 HH21 ARG 60 -3.052 -6.170 -11.279 456 HH22 ARG 60 HH22 ARG 60 -1.869 -6.381 -10.099 457 H ALA 61 H ALA 61 -5.352 1.896 -14.528 458 HA ALA 61 HA ALA 61 -6.761 1.598 -16.252 459 HB1 ALA 61 HB1 ALA 61 -7.288 -0.661 -17.033 460 HB2 ALA 61 HB2 ALA 61 -6.800 -1.329 -15.479 461 HB3 ALA 61 HB3 ALA 61 -5.595 -0.586 -16.532 462 H GLY 62 H GLY 62 -7.646 1.949 -13.437 463 HA2 GLY 62 HA2 GLY 62 -9.769 2.588 -12.636 464 HA3 GLY 62 HA3 GLY 62 -10.512 1.649 -13.920 465 H GLY 63 H GLY 63 -8.301 -0.396 -12.769 466 HA2 GLY 63 HA2 GLY 63 -10.271 -1.815 -11.157 467 HA3 GLY 63 HA3 GLY 63 -8.748 -2.450 -11.770 468 H VAL 64 H VAL 64 -10.046 -2.382 -9.088 469 HA VAL 64 HA VAL 64 -8.090 -0.822 -7.575 470 HB VAL 64 HB VAL 64 -10.490 -2.403 -6.583 471 HG11 VAL 64 HG11 VAL 64 -8.800 -2.087 -4.866 472 HG12 VAL 64 HG12 VAL 64 -10.228 -1.124 -4.507 473 HG13 VAL 64 HG13 VAL 64 -8.789 -0.350 -5.173 474 HG21 VAL 64 HG21 VAL 64 -11.234 -0.562 -8.011 475 HG22 VAL 64 HG22 VAL 64 -10.275 0.572 -7.062 476 HG23 VAL 64 HG23 VAL 64 -11.648 -0.255 -6.325 477 H VAL 65 H VAL 65 -6.359 -1.838 -6.902 478 HA VAL 65 HA VAL 65 -6.437 -4.717 -6.491 479 HB VAL 65 HB VAL 65 -4.164 -4.882 -7.558 480 HG11 VAL 65 HG11 VAL 65 -6.130 -5.608 -8.800 481 HG12 VAL 65 HG12 VAL 65 -4.958 -4.860 -9.886 482 HG13 VAL 65 HG13 VAL 65 -6.387 -3.963 -9.381 483 HG21 VAL 65 HG21 VAL 65 -3.459 -3.141 -9.100 484 HG22 VAL 65 HG22 VAL 65 -3.549 -2.541 -7.439 485 HG23 VAL 65 HG23 VAL 65 -4.835 -2.145 -8.606 486 H ILE 66 H ILE 66 -4.719 -5.466 -5.195 487 HA ILE 66 HA ILE 66 -3.457 -3.419 -3.508 488 HB ILE 66 HB ILE 66 -4.627 -6.051 -2.507 489 HG12 ILE 66 HG12 ILE 66 -5.562 -3.204 -2.050 490 HG13 ILE 66 HG13 ILE 66 -6.384 -4.412 -3.025 491 HG21 ILE 66 HG21 ILE 66 -3.298 -3.800 -0.980 492 HG22 ILE 66 HG22 ILE 66 -2.615 -5.396 -1.274 493 HG23 ILE 66 HG23 ILE 66 -4.045 -5.226 -0.257 494 HD11 ILE 66 HD11 ILE 66 -5.980 -4.469 -0.045 495 HD12 ILE 66 HD12 ILE 66 -6.727 -5.762 -0.984 496 HD13 ILE 66 HD13 ILE 66 -7.489 -4.175 -0.908 497 HA PRO 67 HA PRO 67 0.204 -5.623 -4.919 498 HB2 PRO 67 HB2 PRO 67 1.260 -4.437 -2.398 499 HB3 PRO 67 HB3 PRO 67 1.964 -4.432 -4.017 500 HG2 PRO 67 HG2 PRO 67 0.814 -2.246 -3.094 501 HG3 PRO 67 HG3 PRO 67 0.548 -2.747 -4.773 502 HD2 PRO 67 HD2 PRO 67 -1.280 -2.987 -2.419 503 HD3 PRO 67 HD3 PRO 67 -1.653 -2.612 -4.117 504 H GLN 68 H GLN 68 0.868 -7.641 -4.555 505 HA GLN 68 HA GLN 68 -0.237 -9.490 -2.843 506 HB2 GLN 68 HB2 GLN 68 1.087 -10.066 -4.826 507 HB3 GLN 68 HB3 GLN 68 2.540 -9.477 -4.040 508 HG2 GLN 68 HG2 GLN 68 2.620 -11.833 -3.904 509 HG3 GLN 68 HG3 GLN 68 2.208 -11.253 -2.297 510 HE21 GLN 68 HE21 GLN 68 0.027 -11.546 -5.064 511 HE22 GLN 68 HE22 GLN 68 -0.960 -12.769 -4.365 512 H VAL 69 H VAL 69 2.641 -7.628 -2.424 513 HA VAL 69 HA VAL 69 3.657 -8.949 -0.156 514 HB VAL 69 HB VAL 69 5.240 -6.980 -0.058 515 HG11 VAL 69 HG11 VAL 69 5.711 -9.084 -1.245 516 HG12 VAL 69 HG12 VAL 69 6.390 -7.699 -2.093 517 HG13 VAL 69 HG13 VAL 69 4.906 -8.450 -2.681 518 HG21 VAL 69 HG21 VAL 69 3.682 -5.368 -1.079 519 HG22 VAL 69 HG22 VAL 69 3.778 -6.237 -2.606 520 HG23 VAL 69 HG23 VAL 69 5.216 -5.448 -1.961 521 H PHE 70 H PHE 70 1.078 -6.762 -0.243 522 HA PHE 70 HA PHE 70 1.610 -5.611 2.346 523 HB2 PHE 70 HB2 PHE 70 -0.691 -5.480 0.430 524 HB3 PHE 70 HB3 PHE 70 -0.979 -5.060 2.115 525 HD1 PHE 70 HD1 PHE 70 1.629 -4.343 -0.464 526 HD2 PHE 70 HD2 PHE 70 -0.916 -2.829 2.572 527 HE1 PHE 70 HE1 PHE 70 2.495 -2.077 -0.874 528 HE2 PHE 70 HE2 PHE 70 -0.057 -0.565 2.194 529 HZ PHE 70 HZ PHE 70 1.648 -0.176 0.459 530 H PHE 71 H PHE 71 0.554 -8.482 1.148 531 HA PHE 71 HA PHE 71 -0.587 -9.278 3.707 532 HB2 PHE 71 HB2 PHE 71 -0.835 -10.536 0.964 533 HB3 PHE 71 HB3 PHE 71 -1.423 -11.278 2.443 534 HD1 PHE 71 HD1 PHE 71 -3.375 -10.378 3.589 535 HD2 PHE 71 HD2 PHE 71 -1.989 -8.704 -0.065 536 HE1 PHE 71 HE1 PHE 71 -5.530 -9.235 3.298 537 HE2 PHE 71 HE2 PHE 71 -4.136 -7.560 -0.363 538 HZ PHE 71 HZ PHE 71 -5.914 -7.823 1.320 539 H THR 72 H THR 72 0.178 -11.358 4.458 540 HA THR 72 HA THR 72 3.011 -11.583 4.023 541 HB THR 72 HB THR 72 2.894 -13.198 5.865 542 HG1 THR 72 HG1 THR 72 0.762 -13.131 6.998 543 HG21 THR 72 HG21 THR 72 1.487 -10.577 6.420 544 HG22 THR 72 HG22 THR 72 3.231 -10.829 6.379 545 HG23 THR 72 HG23 THR 72 2.261 -11.592 7.635 546 H ASN 73 H ASN 73 3.839 -13.942 3.997 547 HA ASN 73 HA ASN 73 2.863 -15.187 1.635 548 HB2 ASN 73 HB2 ASN 73 5.249 -15.274 2.386 549 HB3 ASN 73 HB3 ASN 73 4.762 -16.334 3.702 550 HD21 ASN 73 HD21 ASN 73 6.075 -18.004 2.979 551 HD22 ASN 73 HD22 ASN 73 5.730 -18.912 1.563 552 H SER 74 H SER 74 1.947 -15.423 4.916 553 HA SER 74 HA SER 74 0.777 -18.058 4.676 554 HB2 SER 74 HB2 SER 74 0.577 -16.066 6.938 555 HB3 SER 74 HB3 SER 74 0.233 -17.794 7.011 556 HG SER 74 HG SER 74 2.438 -18.198 6.566 557 H GLY 75 H GLY 75 -0.108 -15.115 3.515 558 HA2 GLY 75 HA2 GLY 75 -2.084 -14.556 2.468 559 HA3 GLY 75 HA3 GLY 75 -2.832 -15.976 3.183 560 H GLN 76 H GLN 76 -1.212 -13.814 5.291 561 HA GLN 76 HA GLN 76 -3.812 -12.788 6.226 562 HB2 GLN 76 HB2 GLN 76 -1.224 -13.221 7.739 563 HB3 GLN 76 HB3 GLN 76 -2.647 -12.454 8.425 564 HG2 GLN 76 HG2 GLN 76 -3.898 -14.545 8.086 565 HG3 GLN 76 HG3 GLN 76 -2.435 -15.301 7.464 566 HE21 GLN 76 HE21 GLN 76 -0.667 -13.988 9.408 567 HE22 GLN 76 HE22 GLN 76 -1.006 -14.753 10.913 568 H VAL 77 H VAL 77 -3.530 -10.489 7.207 569 HA VAL 77 HA VAL 77 -1.822 -9.093 5.324 570 HB VAL 77 HB VAL 77 -4.295 -8.428 6.229 571 HG11 VAL 77 HG11 VAL 77 -2.490 -6.759 7.925 572 HG12 VAL 77 HG12 VAL 77 -3.628 -7.980 8.514 573 HG13 VAL 77 HG13 VAL 77 -4.221 -6.509 7.722 574 HG21 VAL 77 HG21 VAL 77 -2.173 -6.510 5.320 575 HG22 VAL 77 HG22 VAL 77 -3.903 -6.145 5.365 576 HG23 VAL 77 HG23 VAL 77 -3.295 -7.428 4.319 577 H VAL 78 H VAL 78 -0.180 -7.561 6.060 578 HA VAL 78 HA VAL 78 1.424 -8.709 8.088 579 HB VAL 78 HB VAL 78 1.732 -5.948 6.865 580 HG11 VAL 78 HG11 VAL 78 3.760 -7.696 8.255 581 HG12 VAL 78 HG12 VAL 78 3.077 -6.192 8.869 582 HG13 VAL 78 HG13 VAL 78 4.113 -6.169 7.446 583 HG21 VAL 78 HG21 VAL 78 2.922 -8.571 5.968 584 HG22 VAL 78 HG22 VAL 78 3.303 -6.983 5.302 585 HG23 VAL 78 HG23 VAL 78 1.678 -7.644 5.126 586 H LYS 79 H LYS 79 1.760 -8.192 10.183 587 HA LYS 79 HA LYS 79 -0.274 -6.927 11.656 588 HB2 LYS 79 HB2 LYS 79 1.061 -8.703 12.616 589 HB3 LYS 79 HB3 LYS 79 2.514 -7.720 12.484 590 HG2 LYS 79 HG2 LYS 79 1.666 -6.166 14.082 591 HG3 LYS 79 HG3 LYS 79 0.131 -7.036 14.199 592 HD2 LYS 79 HD2 LYS 79 1.446 -9.028 14.989 593 HD3 LYS 79 HD3 LYS 79 2.871 -7.991 15.036 594 HE2 LYS 79 HE2 LYS 79 1.869 -8.159 17.252 595 HE3 LYS 79 HE3 LYS 79 1.740 -6.511 16.640 596 HZ1 LYS 79 HZ1 LYS 79 -0.329 -7.265 17.673 597 HZ2 LYS 79 HZ2 LYS 79 -0.422 -8.547 16.591 598 HZ3 LYS 79 HZ3 LYS 79 -0.586 -6.981 16.032 599 H SER 80 H SER 80 2.873 -5.802 10.650 600 HA SER 80 HA SER 80 2.655 -3.392 12.215 601 HB2 SER 80 HB2 SER 80 4.747 -4.728 11.859 602 HB3 SER 80 HB3 SER 80 4.783 -4.161 10.193 603 HG SER 80 HG SER 80 5.754 -3.021 12.339 604 H LEU 81 H LEU 81 1.233 -4.318 9.435 605 HA LEU 81 HA LEU 81 1.751 -2.191 7.671 606 HB2 LEU 81 HB2 LEU 81 0.997 -4.188 6.742 607 HB3 LEU 81 HB3 LEU 81 -0.448 -4.253 7.720 608 HG LEU 81 HG LEU 81 -1.297 -2.284 6.449 609 HD11 LEU 81 HD11 LEU 81 0.839 -1.343 5.803 610 HD12 LEU 81 HD12 LEU 81 -0.170 -1.686 4.388 611 HD13 LEU 81 HD13 LEU 81 1.165 -2.770 4.809 612 HD21 LEU 81 HD21 LEU 81 -1.892 -4.536 5.847 613 HD22 LEU 81 HD22 LEU 81 -0.460 -4.658 4.824 614 HD23 LEU 81 HD23 LEU 81 -1.748 -3.514 4.415 615 HA PRO 82 HA PRO 82 -2.506 -0.270 9.198 616 HB2 PRO 82 HB2 PRO 82 -2.477 -1.274 12.003 617 HB3 PRO 82 HB3 PRO 82 -3.853 -0.998 10.928 618 HG2 PRO 82 HG2 PRO 82 -3.024 -3.471 11.449 619 HG3 PRO 82 HG3 PRO 82 -3.555 -3.017 9.820 620 HD2 PRO 82 HD2 PRO 82 -0.791 -3.390 10.878 621 HD3 PRO 82 HD3 PRO 82 -1.481 -3.835 9.303 622 H GLY 83 H GLY 83 0.150 -0.962 11.356 623 HA2 GLY 83 HA2 GLY 83 0.148 1.482 12.794 624 HA3 GLY 83 HA3 GLY 83 1.499 0.361 12.674 625 H LEU 84 H LEU 84 2.000 0.396 9.930 626 HA LEU 84 HA LEU 84 3.471 2.794 9.772 627 HB2 LEU 84 HB2 LEU 84 4.339 2.050 7.673 628 HB3 LEU 84 HB3 LEU 84 4.202 0.652 8.706 629 HG LEU 84 HG LEU 84 1.904 0.384 7.363 630 HD11 LEU 84 HD11 LEU 84 3.661 1.822 5.394 631 HD12 LEU 84 HD12 LEU 84 2.132 2.398 6.042 632 HD13 LEU 84 HD13 LEU 84 2.168 0.969 5.018 633 HD21 LEU 84 HD21 LEU 84 3.683 -1.287 7.521 634 HD22 LEU 84 HD22 LEU 84 4.616 -0.410 6.310 635 HD23 LEU 84 HD23 LEU 84 3.077 -1.152 5.867 636 H LEU 85 H LEU 85 0.485 1.742 8.326 637 HA LEU 85 HA LEU 85 0.113 3.939 6.633 638 HB2 LEU 85 HB2 LEU 85 -1.941 2.218 8.005 639 HB3 LEU 85 HB3 LEU 85 -2.289 3.337 6.701 640 HG LEU 85 HG LEU 85 -0.498 0.920 6.474 641 HD11 LEU 85 HD11 LEU 85 -2.315 0.003 5.132 642 HD12 LEU 85 HD12 LEU 85 -3.325 1.387 5.568 643 HD13 LEU 85 HD13 LEU 85 -2.780 0.258 6.812 644 HD21 LEU 85 HD21 LEU 85 -1.546 2.833 4.383 645 HD22 LEU 85 HD22 LEU 85 -0.627 1.362 4.063 646 HD23 LEU 85 HD23 LEU 85 0.126 2.701 4.923 647 H THR 86 H THR 86 -0.508 3.460 9.987 648 HA THR 86 HA THR 86 -2.152 5.770 10.313 649 HB THR 86 HB THR 86 -0.669 4.212 12.461 650 HG1 THR 86 HG1 THR 86 -2.108 2.893 11.385 651 HG21 THR 86 HG21 THR 86 -2.328 5.169 14.004 652 HG22 THR 86 HG22 THR 86 -3.051 6.080 12.676 653 HG23 THR 86 HG23 THR 86 -1.417 6.457 13.211 654 H ILE 87 H ILE 87 1.336 5.210 10.858 655 HA ILE 87 HA ILE 87 1.752 7.823 11.837 656 HB ILE 87 HB ILE 87 3.319 6.079 12.444 657 HG12 ILE 87 HG12 ILE 87 4.222 8.461 12.224 658 HG13 ILE 87 HG13 ILE 87 5.406 7.173 12.328 659 HG21 ILE 87 HG21 ILE 87 4.950 5.081 10.900 660 HG22 ILE 87 HG22 ILE 87 4.056 5.822 9.570 661 HG23 ILE 87 HG23 ILE 87 3.265 4.638 10.601 662 HD11 ILE 87 HD11 ILE 87 6.027 8.901 10.710 663 HD12 ILE 87 HD12 ILE 87 4.553 8.584 9.801 664 HD13 ILE 87 HD13 ILE 87 5.802 7.342 9.918 665 H LEU 88 H LEU 88 2.045 6.461 8.595 666 HA LEU 88 HA LEU 88 2.910 8.879 7.417 667 HB2 LEU 88 HB2 LEU 88 1.670 6.415 6.286 668 HB3 LEU 88 HB3 LEU 88 1.824 7.841 5.290 669 HG LEU 88 HG LEU 88 3.616 6.345 4.802 670 HD11 LEU 88 HD11 LEU 88 5.560 7.748 5.191 671 HD12 LEU 88 HD12 LEU 88 4.656 8.675 6.380 672 HD13 LEU 88 HD13 LEU 88 4.155 8.687 4.690 673 HD21 LEU 88 HD21 LEU 88 3.634 5.132 6.947 674 HD22 LEU 88 HD22 LEU 88 4.440 6.514 7.685 675 HD23 LEU 88 HD23 LEU 88 5.240 5.596 6.393 676 H HIS 89 H HIS 89 -0.253 7.606 8.107 677 HA HIS 89 HA HIS 89 -1.796 9.478 6.745 678 HB2 HIS 89 HB2 HIS 89 -2.750 7.459 7.790 679 HB3 HIS 89 HB3 HIS 89 -2.390 8.103 9.385 680 HD1 HIS 89 HD1 HIS 89 -4.199 9.548 10.450 681 HD2 HIS 89 HD2 HIS 89 -4.787 8.944 6.378 682 HE1 HIS 89 HE1 HIS 89 -6.471 10.480 9.928 683 H ASP 90 H ASP 90 -0.157 9.683 9.870 684 HA ASP 90 HA ASP 90 -1.354 12.158 10.612 685 HB2 ASP 90 HB2 ASP 90 -0.304 10.742 12.330 686 HB3 ASP 90 HB3 ASP 90 1.267 10.964 11.568 687 H GLY 91 H GLY 91 1.383 11.298 8.695 688 HA2 GLY 91 HA2 GLY 91 2.378 14.017 8.496 689 HA3 GLY 91 HA3 GLY 91 2.993 12.612 7.629 690 H GLY 92 H GLY 92 -0.080 12.256 7.100 691 HA2 GLY 92 HA2 GLY 92 -1.646 12.902 5.571 692 HA3 GLY 92 HA3 GLY 92 -0.720 14.375 5.304 693 H TYR 93 H TYR 93 0.130 10.951 4.861 694 HA TYR 93 HA TYR 93 0.758 11.657 2.109 695 HB2 TYR 93 HB2 TYR 93 1.995 9.547 3.880 696 HB3 TYR 93 HB3 TYR 93 2.304 9.657 2.148 697 HD1 TYR 93 HD1 TYR 93 2.873 11.244 5.407 698 HD2 TYR 93 HD2 TYR 93 3.637 11.460 1.234 699 HE1 TYR 93 HE1 TYR 93 4.609 12.933 5.820 700 HE2 TYR 93 HE2 TYR 93 5.380 13.148 1.635 701 HH TYR 93 HH TYR 93 5.937 14.788 3.310 702 H ARG 94 H ARG 94 -0.223 10.704 0.508 703 HA ARG 94 HA ARG 94 -2.480 9.032 1.045 704 HB2 ARG 94 HB2 ARG 94 -2.923 9.110 -1.366 705 HB3 ARG 94 HB3 ARG 94 -2.572 10.726 -0.765 706 HG2 ARG 94 HG2 ARG 94 -0.378 10.634 -1.619 707 HG3 ARG 94 HG3 ARG 94 -0.562 8.948 -2.121 708 HD2 ARG 94 HD2 ARG 94 -2.331 9.728 -3.702 709 HD3 ARG 94 HD3 ARG 94 -1.950 11.392 -3.237 710 HE ARG 94 HE ARG 94 0.463 10.280 -3.972 711 HH11 ARG 94 HH11 ARG 94 -2.574 10.939 -5.660 712 HH12 ARG 94 HH12 ARG 94 -1.845 10.939 -7.205 713 HH21 ARG 94 HH21 ARG 94 1.398 10.293 -5.970 714 HH22 ARG 94 HH22 ARG 94 0.485 10.540 -7.405 715 H ASP 95 H ASP 95 -2.828 7.146 -0.514 716 HA ASP 95 HA ASP 95 -1.441 4.929 0.383 717 HB2 ASP 95 HB2 ASP 95 -2.751 3.756 -1.363 718 HB3 ASP 95 HB3 ASP 95 -3.748 4.914 -0.481 719 H THR 96 H THR 96 -1.254 6.632 -2.648 720 HA THR 96 HA THR 96 0.490 4.943 -3.989 721 HB THR 96 HB THR 96 0.017 7.900 -4.340 722 HG1 THR 96 HG1 THR 96 -1.715 5.865 -4.538 723 HG21 THR 96 HG21 THR 96 0.668 7.503 -6.664 724 HG22 THR 96 HG22 THR 96 0.916 5.788 -6.309 725 HG23 THR 96 HG23 THR 96 1.962 6.986 -5.567 726 H GLU 97 H GLU 97 1.025 7.754 -1.934 727 HA GLU 97 HA GLU 97 3.794 7.944 -2.522 728 HB2 GLU 97 HB2 GLU 97 2.381 9.057 -0.105 729 HB3 GLU 97 HB3 GLU 97 3.964 9.531 -0.701 730 HG2 GLU 97 HG2 GLU 97 1.311 9.968 -2.001 731 HG3 GLU 97 HG3 GLU 97 2.381 11.208 -1.329 732 H ILE 98 H ILE 98 1.916 6.207 -0.141 733 HA ILE 98 HA ILE 98 3.975 5.581 1.705 734 HB ILE 98 HB ILE 98 1.839 3.590 0.943 735 HG12 ILE 98 HG12 ILE 98 0.574 5.632 1.218 736 HG13 ILE 98 HG13 ILE 98 0.336 4.603 2.622 737 HG21 ILE 98 HG21 ILE 98 3.158 4.216 3.568 738 HG22 ILE 98 HG22 ILE 98 3.494 2.840 2.523 739 HG23 ILE 98 HG23 ILE 98 1.923 2.985 3.315 740 HD11 ILE 98 HD11 ILE 98 2.182 6.970 2.517 741 HD12 ILE 98 HD12 ILE 98 1.834 5.956 3.915 742 HD13 ILE 98 HD13 ILE 98 0.561 6.958 3.212 743 H MET 99 H MET 99 2.694 3.863 -1.092 744 HA MET 99 HA MET 99 4.705 1.871 -0.911 745 HB2 MET 99 HB2 MET 99 3.771 0.921 -2.988 746 HB3 MET 99 HB3 MET 99 2.599 1.156 -1.706 747 HG2 MET 99 HG2 MET 99 1.737 3.105 -2.819 748 HG3 MET 99 HG3 MET 99 2.970 2.957 -4.073 749 HE1 MET 99 HE1 MET 99 1.051 -0.017 -2.322 750 HE2 MET 99 HE2 MET 99 -0.356 -0.160 -3.368 751 HE3 MET 99 HE3 MET 99 -0.136 1.286 -2.382 752 H ARG 100 H ARG 100 4.695 4.923 -2.252 753 HA ARG 100 HA ARG 100 6.293 4.621 -4.522 754 HB2 ARG 100 HB2 ARG 100 5.060 6.654 -3.932 755 HB3 ARG 100 HB3 ARG 100 6.112 6.897 -2.555 756 HG2 ARG 100 HG2 ARG 100 7.995 7.265 -4.058 757 HG3 ARG 100 HG3 ARG 100 6.933 7.002 -5.446 758 HD2 ARG 100 HD2 ARG 100 5.547 8.872 -4.782 759 HD3 ARG 100 HD3 ARG 100 6.528 9.109 -3.340 760 HE ARG 100 HE ARG 100 8.243 9.255 -5.501 761 HH11 ARG 100 HH11 ARG 100 5.429 11.089 -4.314 762 HH12 ARG 100 HH12 ARG 100 5.959 12.545 -4.975 763 HH21 ARG 100 HH21 ARG 100 8.962 11.256 -6.343 764 HH22 ARG 100 HH22 ARG 100 8.006 12.680 -6.147 765 H TRP 101 H TRP 101 7.362 5.699 -1.278 766 HA TRP 101 HA TRP 101 10.071 5.119 -1.892 767 HB2 TRP 101 HB2 TRP 101 10.458 5.515 0.626 768 HB3 TRP 101 HB3 TRP 101 9.894 6.861 -0.346 769 HD1 TRP 101 HD1 TRP 101 7.593 7.916 0.277 770 HE1 TRP 101 HE1 TRP 101 5.944 7.573 2.200 771 HE3 TRP 101 HE3 TRP 101 9.498 3.595 2.240 772 HZ2 TRP 101 HZ2 TRP 101 5.497 5.732 4.273 773 HZ3 TRP 101 HZ3 TRP 101 8.399 2.616 4.177 774 HH2 TRP 101 HH2 TRP 101 6.439 3.663 5.192 775 H LEU 102 H LEU 102 7.580 3.293 -0.451 776 HA LEU 102 HA LEU 102 9.086 1.285 0.784 777 HB2 LEU 102 HB2 LEU 102 6.388 1.680 -0.111 778 HB3 LEU 102 HB3 LEU 102 6.810 -0.025 0.034 779 HG LEU 102 HG LEU 102 6.793 2.129 2.167 780 HD11 LEU 102 HD11 LEU 102 5.003 0.814 3.135 781 HD12 LEU 102 HD12 LEU 102 5.112 -0.344 1.806 782 HD13 LEU 102 HD13 LEU 102 4.594 1.317 1.495 783 HD21 LEU 102 HD21 LEU 102 7.625 -0.757 2.291 784 HD22 LEU 102 HD22 LEU 102 7.259 0.233 3.716 785 HD23 LEU 102 HD23 LEU 102 8.581 0.688 2.660 786 H PHE 103 H PHE 103 7.981 1.502 -2.585 787 HA PHE 103 HA PHE 103 8.991 -1.153 -3.060 788 HB2 PHE 103 HB2 PHE 103 7.440 0.759 -4.732 789 HB3 PHE 103 HB3 PHE 103 8.277 -0.589 -5.495 790 HD1 PHE 103 HD1 PHE 103 5.827 0.205 -2.808 791 HD2 PHE 103 HD2 PHE 103 7.336 -2.685 -5.533 792 HE1 PHE 103 HE1 PHE 103 3.971 -1.283 -2.243 793 HE2 PHE 103 HE2 PHE 103 5.493 -4.191 -4.965 794 HZ PHE 103 HZ PHE 103 3.792 -3.492 -3.334 795 H THR 104 H THR 104 10.273 1.955 -3.260 796 HA THR 104 HA THR 104 12.234 1.171 -5.190 797 HB THR 104 HB THR 104 13.275 3.402 -4.455 798 HG1 THR 104 HG1 THR 104 11.916 3.332 -2.456 799 HG21 THR 104 HG21 THR 104 11.970 3.143 -6.519 800 HG22 THR 104 HG22 THR 104 11.642 4.701 -5.762 801 HG23 THR 104 HG23 THR 104 10.479 3.385 -5.612 802 HA PRO 105 HA PRO 105 14.722 -0.997 -2.172 803 HB2 PRO 105 HB2 PRO 105 16.831 -0.240 -4.145 804 HB3 PRO 105 HB3 PRO 105 16.495 -1.812 -3.414 805 HG2 PRO 105 HG2 PRO 105 15.775 -1.356 -5.909 806 HG3 PRO 105 HG3 PRO 105 14.683 -2.218 -4.808 807 HD2 PRO 105 HD2 PRO 105 14.562 0.618 -5.745 808 HD3 PRO 105 HD3 PRO 105 13.250 -0.553 -5.472 809 H ASP 106 H ASP 106 15.784 -0.304 -0.441 810 HA ASP 106 HA ASP 106 16.482 2.515 -0.336 811 HB2 ASP 106 HB2 ASP 106 15.021 1.585 1.436 812 HB3 ASP 106 HB3 ASP 106 16.331 0.489 1.877 813 HA PRO 107 HA PRO 107 20.751 1.424 -0.986 814 HB2 PRO 107 HB2 PRO 107 21.789 3.848 -0.211 815 HB3 PRO 107 HB3 PRO 107 21.130 3.502 -1.814 816 HG2 PRO 107 HG2 PRO 107 19.826 4.834 0.525 817 HG3 PRO 107 HG3 PRO 107 19.772 5.289 -1.189 818 HD2 PRO 107 HD2 PRO 107 17.748 4.017 -0.029 819 HD3 PRO 107 HD3 PRO 107 18.220 3.635 -1.701 820 H SER 108 H SER 108 19.460 2.543 2.072 821 HA SER 108 HA SER 108 21.970 1.961 3.420 822 HB2 SER 108 HB2 SER 108 19.449 3.263 4.455 823 HB3 SER 108 HB3 SER 108 20.997 3.159 5.297 824 HG SER 108 HG SER 108 21.687 4.220 3.110 825 H LEU 109 H LEU 109 19.329 0.299 2.449 826 HA LEU 109 HA LEU 109 19.029 -1.158 4.947 827 HB2 LEU 109 HB2 LEU 109 17.009 -0.348 3.827 828 HB3 LEU 109 HB3 LEU 109 17.425 -1.300 2.411 829 HG LEU 109 HG LEU 109 17.266 -3.344 3.847 830 HD11 LEU 109 HD11 LEU 109 16.064 -1.410 5.816 831 HD12 LEU 109 HD12 LEU 109 17.550 -2.337 6.022 832 HD13 LEU 109 HD13 LEU 109 15.999 -3.166 5.936 833 HD21 LEU 109 HD21 LEU 109 14.853 -3.416 3.800 834 HD22 LEU 109 HD22 LEU 109 15.497 -2.683 2.331 835 HD23 LEU 109 HD23 LEU 109 14.787 -1.660 3.591 836 H THR 110 H THR 110 19.982 -2.970 5.196 837 HA THR 110 HA THR 110 20.531 -4.719 2.930 838 HB THR 110 HB THR 110 22.393 -4.233 5.281 839 HG1 THR 110 HG1 THR 110 22.009 -2.887 3.022 840 HG21 THR 110 HG21 THR 110 22.767 -5.832 2.729 841 HG22 THR 110 HG22 THR 110 22.494 -6.513 4.332 842 HG23 THR 110 HG23 THR 110 23.976 -5.620 3.996 843 H ILE 111 H ILE 111 19.395 -6.535 3.309 844 HA ILE 111 HA ILE 111 18.992 -7.399 6.082 845 HB ILE 111 HB ILE 111 16.612 -7.977 5.487 846 HG12 ILE 111 HG12 ILE 111 17.014 -5.907 3.315 847 HG13 ILE 111 HG13 ILE 111 16.879 -7.632 3.018 848 HG21 ILE 111 HG21 ILE 111 17.101 -6.262 7.052 849 HG22 ILE 111 HG22 ILE 111 15.748 -5.750 6.040 850 HG23 ILE 111 HG23 ILE 111 17.362 -5.084 5.764 851 HD11 ILE 111 HD11 ILE 111 14.795 -6.467 2.565 852 HD12 ILE 111 HD12 ILE 111 14.770 -5.864 4.221 853 HD13 ILE 111 HD13 ILE 111 14.607 -7.594 3.912 854 H THR 112 H THR 112 18.181 -9.553 6.261 855 HA THR 112 HA THR 112 18.872 -11.224 3.995 856 HB THR 112 HB THR 112 19.956 -11.985 5.955 857 HG1 THR 112 HG1 THR 112 18.712 -13.665 4.706 858 HG21 THR 112 HG21 THR 112 18.669 -10.792 7.656 859 HG22 THR 112 HG22 THR 112 18.815 -12.494 8.098 860 HG23 THR 112 HG23 THR 112 17.308 -11.878 7.413 861 H ARG 113 H ARG 113 17.386 -12.285 2.956 862 HA ARG 113 HA ARG 113 14.600 -11.508 3.502 863 HB2 ARG 113 HB2 ARG 113 15.632 -11.067 1.232 864 HB3 ARG 113 HB3 ARG 113 15.710 -12.808 0.998 865 HG2 ARG 113 HG2 ARG 113 13.272 -12.931 1.230 866 HG3 ARG 113 HG3 ARG 113 13.223 -11.180 1.407 867 HD2 ARG 113 HD2 ARG 113 14.258 -10.991 -0.845 868 HD3 ARG 113 HD3 ARG 113 14.104 -12.745 -1.000 869 HE ARG 113 HE ARG 113 11.817 -10.960 -0.535 870 HH11 ARG 113 HH11 ARG 113 13.230 -13.740 -2.289 871 HH12 ARG 113 HH12 ARG 113 11.836 -14.006 -3.225 872 HH21 ARG 113 HH21 ARG 113 9.909 -11.395 -1.870 873 HH22 ARG 113 HH22 ARG 113 9.936 -12.691 -2.972 874 H ASP 114 H ASP 114 12.902 -13.144 3.432 875 HA ASP 114 HA ASP 114 13.686 -15.587 4.663 876 HB2 ASP 114 HB2 ASP 114 11.468 -14.537 5.101 877 HB3 ASP 114 HB3 ASP 114 11.018 -14.885 3.435 878 H GLY 115 H GLY 115 14.807 -16.983 3.577 879 HA2 GLY 115 HA2 GLY 115 14.645 -18.832 2.009 880 HA3 GLY 115 HA3 GLY 115 13.901 -17.703 0.876 881 H SER 116 H SER 116 16.200 -15.987 2.459 882 HA SER 116 HA SER 116 18.407 -16.818 0.785 883 HB2 SER 116 HB2 SER 116 17.325 -13.999 0.952 884 HB3 SER 116 HB3 SER 116 18.817 -14.470 0.148 885 HG SER 116 HG SER 116 17.768 -15.267 -1.440 886 H ARG 117 H ARG 117 19.751 -17.373 2.381 887 HA ARG 117 HA ARG 117 19.864 -16.050 4.918 888 HB2 ARG 117 HB2 ARG 117 21.834 -17.464 5.342 889 HB3 ARG 117 HB3 ARG 117 20.428 -18.374 4.819 890 HG2 ARG 117 HG2 ARG 117 21.352 -18.669 2.635 891 HG3 ARG 117 HG3 ARG 117 22.670 -17.557 2.997 892 HD2 ARG 117 HD2 ARG 117 23.367 -19.895 3.148 893 HD3 ARG 117 HD3 ARG 117 23.502 -18.999 4.671 894 HE ARG 117 HE ARG 117 21.076 -20.531 4.302 895 HH11 ARG 117 HH11 ARG 117 24.364 -20.532 5.600 896 HH12 ARG 117 HH12 ARG 117 24.059 -21.664 6.836 897 HH21 ARG 117 HH21 ARG 117 20.640 -22.133 6.044 898 HH22 ARG 117 HH22 ARG 117 21.912 -22.606 7.085 899 H ASP 118 H ASP 118 21.222 -15.483 1.907 900 HA ASP 118 HA ASP 118 23.561 -14.093 2.752 901 HB2 ASP 118 HB2 ASP 118 23.809 -13.454 0.422 902 HB3 ASP 118 HB3 ASP 118 23.388 -15.155 0.513 903 H ALA 119 H ALA 119 23.883 -11.863 2.638 904 HA ALA 119 HA ALA 119 21.529 -10.394 3.475 905 HB1 ALA 119 HB1 ALA 119 24.431 -9.557 3.350 906 HB2 ALA 119 HB2 ALA 119 23.591 -10.164 4.778 907 HB3 ALA 119 HB3 ALA 119 23.121 -8.621 4.069 908 H VAL 120 H VAL 120 20.422 -9.172 2.151 909 HA VAL 120 HA VAL 120 21.496 -8.631 -0.507 910 HB VAL 120 HB VAL 120 18.658 -8.328 0.539 911 HG11 VAL 120 HG11 VAL 120 19.110 -6.899 -1.371 912 HG12 VAL 120 HG12 VAL 120 18.016 -8.207 -1.822 913 HG13 VAL 120 HG13 VAL 120 19.720 -8.281 -2.280 914 HG21 VAL 120 HG21 VAL 120 19.858 -10.567 -1.098 915 HG22 VAL 120 HG22 VAL 120 18.149 -10.394 -0.698 916 HG23 VAL 120 HG23 VAL 120 19.327 -10.679 0.582 917 H SER 121 H SER 121 22.354 -6.723 -0.796 918 HA SER 121 HA SER 121 21.771 -4.522 1.002 919 HB2 SER 121 HB2 SER 121 23.709 -4.671 -1.312 920 HB3 SER 121 HB3 SER 121 23.700 -3.496 0.004 921 HG SER 121 HG SER 121 24.904 -5.825 -0.128 922 H ASN 122 H ASN 122 20.616 -2.750 0.439 923 HA ASN 122 HA ASN 122 19.360 -1.320 -0.674 924 HB2 ASN 122 HB2 ASN 122 21.328 -1.047 -2.198 925 HB3 ASN 122 HB3 ASN 122 20.716 -2.359 -3.194 926 HD21 ASN 122 HD21 ASN 122 20.461 -1.155 -5.009 927 HD22 ASN 122 HD22 ASN 122 19.274 0.090 -5.160 928 H ALA 123 H ALA 123 17.936 -3.054 0.173 929 HA ALA 123 HA ALA 123 16.454 -4.378 -1.979 930 HB1 ALA 123 HB1 ALA 123 17.265 -5.873 -0.220 931 HB2 ALA 123 HB2 ALA 123 15.504 -5.820 -0.230 932 HB3 ALA 123 HB3 ALA 123 16.408 -4.924 0.994 933 H ARG 124 H ARG 124 14.041 -4.393 -1.704 934 HA ARG 124 HA ARG 124 13.241 -1.713 -1.039 935 HB2 ARG 124 HB2 ARG 124 11.068 -2.121 -2.000 936 HB3 ARG 124 HB3 ARG 124 12.272 -2.789 -3.076 937 HG2 ARG 124 HG2 ARG 124 10.629 -4.429 -1.145 938 HG3 ARG 124 HG3 ARG 124 10.163 -4.119 -2.809 939 HD2 ARG 124 HD2 ARG 124 12.263 -5.219 -3.541 940 HD3 ARG 124 HD3 ARG 124 12.607 -5.607 -1.851 941 HE ARG 124 HE ARG 124 10.091 -6.554 -2.321 942 HH11 ARG 124 HH11 ARG 124 13.259 -7.197 -3.785 943 HH12 ARG 124 HH12 ARG 124 12.858 -8.794 -4.233 944 HH21 ARG 124 HH21 ARG 124 9.587 -8.748 -2.929 945 HH22 ARG 124 HH22 ARG 124 10.749 -9.674 -3.748 946 HA PRO 125 HA PRO 125 12.317 -2.269 3.194 947 HB2 PRO 125 HB2 PRO 125 10.280 -0.193 2.600 948 HB3 PRO 125 HB3 PRO 125 11.482 -0.235 3.896 949 HG2 PRO 125 HG2 PRO 125 11.861 1.322 1.792 950 HG3 PRO 125 HG3 PRO 125 13.212 0.398 2.472 951 HD2 PRO 125 HD2 PRO 125 11.631 -0.101 -0.008 952 HD3 PRO 125 HD3 PRO 125 13.360 -0.349 0.326 953 H VAL 126 H VAL 126 9.763 -2.542 0.784 954 HA VAL 126 HA VAL 126 7.696 -3.306 2.563 955 HB VAL 126 HB VAL 126 7.953 -4.387 -0.256 956 HG11 VAL 126 HG11 VAL 126 5.506 -4.520 -0.109 957 HG12 VAL 126 HG12 VAL 126 5.583 -3.931 1.549 958 HG13 VAL 126 HG13 VAL 126 6.297 -5.489 1.135 959 HG21 VAL 126 HG21 VAL 126 6.587 -2.520 -0.977 960 HG22 VAL 126 HG22 VAL 126 8.097 -1.939 -0.267 961 HG23 VAL 126 HG23 VAL 126 6.595 -1.885 0.669 962 H ASP 127 H ASP 127 10.252 -5.166 0.987 963 HA ASP 127 HA ASP 127 9.206 -7.696 1.812 964 HB2 ASP 127 HB2 ASP 127 10.861 -7.368 -0.085 965 HB3 ASP 127 HB3 ASP 127 12.091 -7.072 1.140 966 H ALA 128 H ALA 128 11.336 -5.320 3.072 967 HA ALA 128 HA ALA 128 12.454 -6.708 5.221 968 HB1 ALA 128 HB1 ALA 128 11.818 -3.765 5.087 969 HB2 ALA 128 HB2 ALA 128 13.243 -4.518 4.391 970 HB3 ALA 128 HB3 ALA 128 13.014 -4.525 6.140 971 H LEU 129 H LEU 129 9.561 -4.608 5.147 972 HA LEU 129 HA LEU 129 8.898 -5.064 7.877 973 HB2 LEU 129 HB2 LEU 129 6.778 -3.995 7.403 974 HB3 LEU 129 HB3 LEU 129 8.064 -3.111 6.623 975 HG LEU 129 HG LEU 129 7.354 -4.623 4.579 976 HD11 LEU 129 HD11 LEU 129 4.790 -4.377 6.129 977 HD12 LEU 129 HD12 LEU 129 5.696 -5.849 5.797 978 HD13 LEU 129 HD13 LEU 129 4.945 -4.962 4.461 979 HD21 LEU 129 HD21 LEU 129 7.405 -2.207 4.524 980 HD22 LEU 129 HD22 LEU 129 5.911 -2.120 5.460 981 HD23 LEU 129 HD23 LEU 129 5.887 -2.771 3.824 982 H HIS 130 H HIS 130 8.133 -6.750 4.962 983 HA HIS 130 HA HIS 130 6.105 -8.455 5.944 984 HB2 HIS 130 HB2 HIS 130 6.626 -7.941 3.538 985 HB3 HIS 130 HB3 HIS 130 8.104 -8.865 3.700 986 HD1 HIS 130 HD1 HIS 130 4.735 -9.181 2.501 987 HD2 HIS 130 HD2 HIS 130 7.431 -11.717 4.391 988 HE1 HIS 130 HE1 HIS 130 4.042 -11.509 1.896 989 H ALA 131 H ALA 131 9.560 -8.531 5.815 990 HA ALA 131 HA ALA 131 9.771 -11.230 6.915 991 HB1 ALA 131 HB1 ALA 131 11.279 -10.491 5.122 992 HB2 ALA 131 HB2 ALA 131 12.152 -11.011 6.564 993 HB3 ALA 131 HB3 ALA 131 11.966 -9.290 6.213 994 H HIS 132 H HIS 132 9.016 -8.522 8.316 995 HA HIS 132 HA HIS 132 8.970 -7.711 10.420 996 HB2 HIS 132 HB2 HIS 132 8.726 -10.194 10.992 997 HB3 HIS 132 HB3 HIS 132 10.448 -10.204 11.340 998 HD1 HIS 132 HD1 HIS 132 10.687 -10.230 13.848 999 HD2 HIS 132 HD2 HIS 132 7.611 -7.749 12.577 1000 HE1 HIS 132 HE1 HIS 132 9.715 -9.193 15.933 1001 H GLN 133 H GLN 133 11.182 -7.240 8.632 1002 HA GLN 133 HA GLN 133 13.355 -6.380 10.405 1003 HB2 GLN 133 HB2 GLN 133 12.988 -6.126 7.403 1004 HB3 GLN 133 HB3 GLN 133 14.440 -5.672 8.274 1005 HG2 GLN 133 HG2 GLN 133 13.347 -8.466 7.970 1006 HG3 GLN 133 HG3 GLN 133 14.682 -7.782 7.053 1007 HE21 GLN 133 HE21 GLN 133 14.741 -10.115 8.630 1008 HE22 GLN 133 HE22 GLN 133 15.876 -9.902 9.891 1009 H ALA 134 H ALA 134 10.646 -5.514 10.409 1010 HA ALA 134 HA ALA 134 9.894 -3.238 9.089 1011 HB1 ALA 134 HB1 ALA 134 9.020 -4.049 11.845 1012 HB2 ALA 134 HB2 ALA 134 8.387 -4.703 10.332 1013 HB3 ALA 134 HB3 ALA 134 8.154 -2.998 10.723 1014 H ARG 135 H ARG 135 12.083 -3.402 11.743 1015 HA ARG 135 HA ARG 135 11.537 -0.945 13.000 1016 HB2 ARG 135 HB2 ARG 135 14.231 -2.341 12.836 1017 HB3 ARG 135 HB3 ARG 135 13.869 -1.003 13.896 1018 HG2 ARG 135 HG2 ARG 135 13.794 -2.933 15.247 1019 HG3 ARG 135 HG3 ARG 135 12.107 -2.508 14.969 1020 HD2 ARG 135 HD2 ARG 135 11.974 -4.241 13.238 1021 HD3 ARG 135 HD3 ARG 135 13.676 -4.627 13.493 1022 HE ARG 135 HE ARG 135 11.827 -4.848 15.737 1023 HH11 ARG 135 HH11 ARG 135 13.860 -6.500 13.326 1024 HH12 ARG 135 HH12 ARG 135 13.751 -8.019 14.063 1025 HH21 ARG 135 HH21 ARG 135 11.683 -6.978 16.749 1026 HH22 ARG 135 HH22 ARG 135 12.508 -8.282 16.051 1027 H GLU 136 H GLU 136 13.903 -1.635 10.397 1028 HA GLU 136 HA GLU 136 14.666 1.066 10.051 1029 HB2 GLU 136 HB2 GLU 136 14.977 -1.412 8.439 1030 HB3 GLU 136 HB3 GLU 136 15.218 0.129 7.627 1031 HG2 GLU 136 HG2 GLU 136 16.661 -0.701 10.130 1032 HG3 GLU 136 HG3 GLU 136 17.297 -0.906 8.495 1033 H VAL 137 H VAL 137 12.004 -0.756 8.814 1034 HA VAL 137 HA VAL 137 11.338 0.987 6.663 1035 HB VAL 137 HB VAL 137 9.509 -0.907 8.157 1036 HG11 VAL 137 HG11 VAL 137 9.297 0.240 5.372 1037 HG12 VAL 137 HG12 VAL 137 8.314 0.697 6.761 1038 HG13 VAL 137 HG13 VAL 137 8.191 -0.931 6.094 1039 HG21 VAL 137 HG21 VAL 137 11.470 -2.086 7.350 1040 HG22 VAL 137 HG22 VAL 137 11.240 -1.407 5.739 1041 HG23 VAL 137 HG23 VAL 137 10.057 -2.534 6.393 1042 H VAL 138 H VAL 138 10.053 0.557 9.934 1043 HA VAL 138 HA VAL 138 8.198 2.666 9.809 1044 HB VAL 138 HB VAL 138 9.550 1.527 12.281 1045 HG11 VAL 138 HG11 VAL 138 8.490 3.664 12.733 1046 HG12 VAL 138 HG12 VAL 138 7.559 2.361 13.484 1047 HG13 VAL 138 HG13 VAL 138 6.996 3.105 11.984 1048 HG21 VAL 138 HG21 VAL 138 6.938 0.754 10.973 1049 HG22 VAL 138 HG22 VAL 138 7.550 0.119 12.501 1050 HG23 VAL 138 HG23 VAL 138 8.414 -0.213 11.000 1051 H ARG 139 H ARG 139 11.528 2.489 10.920 1052 HA ARG 139 HA ARG 139 11.837 5.091 11.872 1053 HB2 ARG 139 HB2 ARG 139 13.517 3.397 12.266 1054 HB3 ARG 139 HB3 ARG 139 13.820 3.248 10.546 1055 HG2 ARG 139 HG2 ARG 139 14.647 5.583 10.533 1056 HG3 ARG 139 HG3 ARG 139 14.462 5.617 12.288 1057 HD2 ARG 139 HD2 ARG 139 16.022 3.792 12.519 1058 HD3 ARG 139 HD3 ARG 139 16.144 3.637 10.769 1059 HE ARG 139 HE ARG 139 16.852 6.196 11.910 1060 HH11 ARG 139 HH11 ARG 139 17.973 3.124 10.519 1061 HH12 ARG 139 HH12 ARG 139 19.574 3.663 10.319 1062 HH21 ARG 139 HH21 ARG 139 19.042 6.908 11.644 1063 HH22 ARG 139 HH22 ARG 139 20.211 5.841 11.003 1064 H ARG 140 H ARG 140 12.362 3.784 8.597 1065 HA ARG 140 HA ARG 140 13.278 6.199 7.458 1066 HB2 ARG 140 HB2 ARG 140 13.387 3.767 6.512 1067 HB3 ARG 140 HB3 ARG 140 11.777 4.099 5.891 1068 HG2 ARG 140 HG2 ARG 140 13.222 4.578 4.107 1069 HG3 ARG 140 HG3 ARG 140 12.807 6.156 4.782 1070 HD2 ARG 140 HD2 ARG 140 15.136 6.263 4.456 1071 HD3 ARG 140 HD3 ARG 140 14.963 5.922 6.174 1072 HE ARG 140 HE ARG 140 15.803 4.049 4.069 1073 HH11 ARG 140 HH11 ARG 140 15.584 4.701 7.585 1074 HH12 ARG 140 HH12 ARG 140 16.572 3.354 7.982 1075 HH21 ARG 140 HH21 ARG 140 17.220 2.313 4.726 1076 HH22 ARG 140 HH22 ARG 140 17.467 2.023 6.429 1077 H ALA 141 H ALA 141 10.096 4.747 7.832 1078 HA ALA 141 HA ALA 141 8.585 6.600 6.344 1079 HB1 ALA 141 HB1 ALA 141 6.697 5.771 7.682 1080 HB2 ALA 141 HB2 ALA 141 7.833 4.899 8.719 1081 HB3 ALA 141 HB3 ALA 141 7.680 4.470 7.010 1082 H GLN 142 H GLN 142 9.358 6.435 9.818 1083 HA GLN 142 HA GLN 142 8.060 8.806 10.579 1084 HB2 GLN 142 HB2 GLN 142 10.433 7.420 11.823 1085 HB3 GLN 142 HB3 GLN 142 9.582 8.759 12.573 1086 HG2 GLN 142 HG2 GLN 142 7.531 7.442 12.665 1087 HG3 GLN 142 HG3 GLN 142 8.354 6.119 11.835 1088 HE21 GLN 142 HE21 GLN 142 7.041 6.265 14.483 1089 HE22 GLN 142 HE22 GLN 142 8.247 5.727 15.593 1090 H ALA 143 H ALA 143 11.283 8.258 9.346 1091 HA ALA 143 HA ALA 143 12.237 10.877 9.777 1092 HB1 ALA 143 HB1 ALA 143 13.727 8.976 9.360 1093 HB2 ALA 143 HB2 ALA 143 14.024 10.283 8.213 1094 HB3 ALA 143 HB3 ALA 143 13.113 8.858 7.712 1095 H MET 144 H MET 144 10.668 9.308 7.060 1096 HA MET 144 HA MET 144 10.771 11.505 5.282 1097 HB2 MET 144 HB2 MET 144 10.483 9.258 4.441 1098 HB3 MET 144 HB3 MET 144 8.998 9.060 5.352 1099 HG2 MET 144 HG2 MET 144 8.542 9.408 2.992 1100 HG3 MET 144 HG3 MET 144 7.910 10.741 3.957 1101 HE1 MET 144 HE1 MET 144 8.925 12.460 0.589 1102 HE2 MET 144 HE2 MET 144 7.629 12.196 1.756 1103 HE3 MET 144 HE3 MET 144 8.250 10.846 0.807 1104 H ALA 145 H ALA 145 8.266 10.330 7.481 1105 HA ALA 145 HA ALA 145 6.365 12.270 6.639 1106 HB1 ALA 145 HB1 ALA 145 4.939 11.422 8.390 1107 HB2 ALA 145 HB2 ALA 145 6.303 10.574 9.119 1108 HB3 ALA 145 HB3 ALA 145 5.710 10.083 7.535 1109 H TYR 146 H TYR 146 8.773 12.221 9.193 1110 HA TYR 146 HA TYR 146 7.692 14.795 10.067 1111 HB2 TYR 146 HB2 TYR 146 9.260 12.774 11.680 1112 HB3 TYR 146 HB3 TYR 146 8.767 14.360 12.268 1113 HD1 TYR 146 HD1 TYR 146 6.267 14.822 12.284 1114 HD2 TYR 146 HD2 TYR 146 7.901 10.929 11.951 1115 HE1 TYR 146 HE1 TYR 146 4.138 13.874 13.055 1116 HE2 TYR 146 HE2 TYR 146 5.781 9.963 12.721 1117 HH TYR 146 HH TYR 146 2.937 11.905 12.992 Start of MODEL 26 1 H MET 1 H MET 1 -7.385 15.682 42.901 2 HA MET 1 HA MET 1 -8.553 17.718 43.022 3 HB2 MET 1 HB2 MET 1 -6.197 18.804 41.422 4 HB3 MET 1 HB3 MET 1 -7.691 19.682 41.694 5 HG2 MET 1 HG2 MET 1 -7.272 19.677 44.083 6 HG3 MET 1 HG3 MET 1 -5.788 18.763 43.832 7 HE1 MET 1 HE1 MET 1 -4.476 22.245 44.948 8 HE2 MET 1 HE2 MET 1 -4.457 20.505 45.237 9 HE3 MET 1 HE3 MET 1 -5.933 21.426 45.510 10 HA PRO 2 HA PRO 2 -10.456 16.214 39.362 11 HB2 PRO 2 HB2 PRO 2 -11.775 18.439 38.396 12 HB3 PRO 2 HB3 PRO 2 -12.378 17.404 39.689 13 HG2 PRO 2 HG2 PRO 2 -10.943 20.012 39.865 14 HG3 PRO 2 HG3 PRO 2 -12.302 19.412 40.836 15 HD2 PRO 2 HD2 PRO 2 -9.789 19.415 41.784 16 HD3 PRO 2 HD3 PRO 2 -10.935 18.118 42.173 17 H GLY 3 H GLY 3 -9.453 15.726 37.579 18 HA2 GLY 3 HA2 GLY 3 -7.966 17.833 36.173 19 HA3 GLY 3 HA3 GLY 3 -7.506 16.133 36.169 20 H ARG 4 H ARG 4 -9.299 18.530 34.685 21 HA ARG 4 HA ARG 4 -11.192 16.857 33.351 22 HB2 ARG 4 HB2 ARG 4 -11.652 19.205 33.784 23 HB3 ARG 4 HB3 ARG 4 -10.259 19.683 32.838 24 HG2 ARG 4 HG2 ARG 4 -11.324 19.034 30.814 25 HG3 ARG 4 HG3 ARG 4 -12.644 18.254 31.687 26 HD2 ARG 4 HD2 ARG 4 -12.005 21.201 31.868 27 HD3 ARG 4 HD3 ARG 4 -13.218 20.518 30.787 28 HE ARG 4 HE ARG 4 -14.449 19.785 32.705 29 HH11 ARG 4 HH11 ARG 4 -11.846 22.109 33.543 30 HH12 ARG 4 HH12 ARG 4 -12.624 22.647 34.934 31 HH21 ARG 4 HH21 ARG 4 -15.497 20.618 34.654 32 HH22 ARG 4 HH22 ARG 4 -14.723 21.797 35.590 33 H ALA 5 H ALA 5 -11.020 15.843 31.433 34 HA ALA 5 HA ALA 5 -8.346 15.529 30.401 35 HB1 ALA 5 HB1 ALA 5 -9.267 13.577 29.233 36 HB2 ALA 5 HB2 ALA 5 -10.888 14.024 29.770 37 HB3 ALA 5 HB3 ALA 5 -9.669 13.546 30.951 38 HA PRO 6 HA PRO 6 -9.378 17.743 26.656 39 HB2 PRO 6 HB2 PRO 6 -7.237 16.682 25.148 40 HB3 PRO 6 HB3 PRO 6 -7.213 18.168 26.090 41 HG2 PRO 6 HG2 PRO 6 -5.737 15.851 26.643 42 HG3 PRO 6 HG3 PRO 6 -6.012 17.195 27.757 43 HD2 PRO 6 HD2 PRO 6 -7.382 14.553 27.597 44 HD3 PRO 6 HD3 PRO 6 -7.002 15.558 29.013 45 H GLY 7 H GLY 7 -11.306 16.446 26.274 46 HA2 GLY 7 HA2 GLY 7 -11.052 14.151 24.551 47 HA3 GLY 7 HA3 GLY 7 -12.556 14.873 25.114 48 H SER 8 H SER 8 -10.159 14.849 22.697 49 HA SER 8 HA SER 8 -11.743 16.765 21.147 50 HB2 SER 8 HB2 SER 8 -9.540 17.697 21.935 51 HB3 SER 8 HB3 SER 8 -8.730 16.418 21.035 52 HG SER 8 HG SER 8 -10.377 18.485 19.982 53 H THR 9 H THR 9 -11.330 16.441 18.742 54 HA THR 9 HA THR 9 -11.935 13.755 18.067 55 HB THR 9 HB THR 9 -11.272 16.049 16.215 56 HG1 THR 9 HG1 THR 9 -13.820 15.371 17.276 57 HG21 THR 9 HG21 THR 9 -11.544 13.813 15.173 58 HG22 THR 9 HG22 THR 9 -12.848 14.910 14.705 59 HG23 THR 9 HG23 THR 9 -13.126 13.666 15.927 60 H LEU 10 H LEU 10 -10.590 12.246 17.176 61 HA LEU 10 HA LEU 10 -7.740 12.775 17.093 62 HB2 LEU 10 HB2 LEU 10 -9.332 10.287 16.491 63 HB3 LEU 10 HB3 LEU 10 -7.582 10.352 16.581 64 HG LEU 10 HG LEU 10 -9.496 10.820 18.876 65 HD11 LEU 10 HD11 LEU 10 -9.405 8.489 18.198 66 HD12 LEU 10 HD12 LEU 10 -8.605 8.722 19.753 67 HD13 LEU 10 HD13 LEU 10 -7.644 8.517 18.290 68 HD21 LEU 10 HD21 LEU 10 -7.476 10.821 20.282 69 HD22 LEU 10 HD22 LEU 10 -7.475 12.161 19.139 70 HD23 LEU 10 HD23 LEU 10 -6.474 10.744 18.832 71 H ALA 11 H ALA 11 -6.723 11.391 15.033 72 HA ALA 11 HA ALA 11 -7.215 13.017 12.782 73 HB1 ALA 11 HB1 ALA 11 -5.754 10.372 12.938 74 HB2 ALA 11 HB2 ALA 11 -5.035 11.963 13.191 75 HB3 ALA 11 HB3 ALA 11 -5.662 11.521 11.603 76 H ARG 12 H ARG 12 -8.718 12.849 11.252 77 HA ARG 12 HA ARG 12 -10.701 10.846 11.451 78 HB2 ARG 12 HB2 ARG 12 -11.291 13.157 11.035 79 HB3 ARG 12 HB3 ARG 12 -10.326 13.164 9.563 80 HG2 ARG 12 HG2 ARG 12 -11.726 11.362 8.713 81 HG3 ARG 12 HG3 ARG 12 -12.774 11.552 10.123 82 HD2 ARG 12 HD2 ARG 12 -13.223 13.889 9.438 83 HD3 ARG 12 HD3 ARG 12 -12.197 13.653 8.020 84 HE ARG 12 HE ARG 12 -14.381 11.788 8.346 85 HH11 ARG 12 HH11 ARG 12 -13.319 14.768 6.716 86 HH12 ARG 12 HH12 ARG 12 -14.475 14.621 5.483 87 HH21 ARG 12 HH21 ARG 12 -15.896 11.625 6.648 88 HH22 ARG 12 HH22 ARG 12 -15.933 12.790 5.403 89 H VAL 13 H VAL 13 -10.406 8.934 10.533 90 HA VAL 13 HA VAL 13 -9.241 8.929 7.883 91 HB VAL 13 HB VAL 13 -8.750 6.471 8.235 92 HG11 VAL 13 HG11 VAL 13 -7.455 8.431 10.126 93 HG12 VAL 13 HG12 VAL 13 -6.998 8.144 8.450 94 HG13 VAL 13 HG13 VAL 13 -6.761 6.878 9.659 95 HG21 VAL 13 HG21 VAL 13 -8.684 5.608 10.531 96 HG22 VAL 13 HG22 VAL 13 -10.331 6.058 10.089 97 HG23 VAL 13 HG23 VAL 13 -9.377 7.119 11.125 98 H GLY 14 H GLY 14 -10.874 9.262 6.637 99 HA2 GLY 14 HA2 GLY 14 -13.385 7.886 6.953 100 HA3 GLY 14 HA3 GLY 14 -12.953 9.020 5.670 101 H SER 15 H SER 15 -10.812 8.070 4.538 102 HA SER 15 HA SER 15 -10.326 5.396 4.279 103 HB2 SER 15 HB2 SER 15 -12.711 5.393 3.273 104 HB3 SER 15 HB3 SER 15 -12.041 6.361 1.964 105 HG SER 15 HG SER 15 -10.970 3.869 2.753 106 H ILE 16 H ILE 16 -8.905 5.063 2.344 107 HA ILE 16 HA ILE 16 -7.766 7.616 1.511 108 HB ILE 16 HB ILE 16 -6.418 4.876 1.576 109 HG12 ILE 16 HG12 ILE 16 -4.847 6.012 3.267 110 HG13 ILE 16 HG13 ILE 16 -6.059 7.273 3.395 111 HG21 ILE 16 HG21 ILE 16 -5.272 7.563 0.841 112 HG22 ILE 16 HG22 ILE 16 -5.596 6.222 -0.254 113 HG23 ILE 16 HG23 ILE 16 -4.349 6.066 0.987 114 HD11 ILE 16 HD11 ILE 16 -7.670 5.624 4.227 115 HD12 ILE 16 HD12 ILE 16 -6.223 5.693 5.234 116 HD13 ILE 16 HD13 ILE 16 -6.441 4.365 4.094 117 HA PRO 17 HA PRO 17 -9.537 6.180 -2.385 118 HB2 PRO 17 HB2 PRO 17 -8.313 8.543 -3.587 119 HB3 PRO 17 HB3 PRO 17 -10.026 8.168 -3.384 120 HG2 PRO 17 HG2 PRO 17 -8.786 10.140 -2.000 121 HG3 PRO 17 HG3 PRO 17 -10.152 9.215 -1.351 122 HD2 PRO 17 HD2 PRO 17 -7.228 8.925 -0.788 123 HD3 PRO 17 HD3 PRO 17 -8.627 8.833 0.308 124 H ALA 18 H ALA 18 -8.690 5.144 -4.149 125 HA ALA 18 HA ALA 18 -5.840 4.651 -4.066 126 HB1 ALA 18 HB1 ALA 18 -6.317 2.913 -5.713 127 HB2 ALA 18 HB2 ALA 18 -7.989 3.473 -5.832 128 HB3 ALA 18 HB3 ALA 18 -7.392 2.781 -4.323 129 H GLY 19 H GLY 19 -4.399 5.562 -5.376 130 HA2 GLY 19 HA2 GLY 19 -5.465 7.129 -7.623 131 HA3 GLY 19 HA3 GLY 19 -4.062 7.599 -6.681 132 H ASP 20 H ASP 20 -2.107 7.028 -7.405 133 HA ASP 20 HA ASP 20 -2.091 5.548 -9.910 134 HB2 ASP 20 HB2 ASP 20 -1.142 7.784 -9.983 135 HB3 ASP 20 HB3 ASP 20 -0.069 7.397 -8.647 136 H ASP 21 H ASP 21 -1.262 3.639 -10.076 137 HA ASP 21 HA ASP 21 -0.313 2.206 -7.815 138 HB2 ASP 21 HB2 ASP 21 -1.581 0.977 -9.402 139 HB3 ASP 21 HB3 ASP 21 -0.576 1.509 -10.736 140 H VAL 22 H VAL 22 1.594 1.475 -7.319 141 HA VAL 22 HA VAL 22 3.843 2.988 -8.432 142 HB VAL 22 HB VAL 22 3.629 1.559 -5.749 143 HG11 VAL 22 HG11 VAL 22 5.649 2.779 -5.119 144 HG12 VAL 22 HG12 VAL 22 5.740 3.488 -6.731 145 HG13 VAL 22 HG13 VAL 22 5.955 1.749 -6.519 146 HG21 VAL 22 HG21 VAL 22 3.391 4.491 -6.427 147 HG22 VAL 22 HG22 VAL 22 3.463 3.836 -4.794 148 HG23 VAL 22 HG23 VAL 22 2.104 3.443 -5.847 149 H LEU 23 H LEU 23 2.456 -0.075 -8.467 150 HA LEU 23 HA LEU 23 4.908 -1.550 -8.946 151 HB2 LEU 23 HB2 LEU 23 1.972 -2.210 -8.930 152 HB3 LEU 23 HB3 LEU 23 3.159 -3.342 -9.520 153 HG LEU 23 HG LEU 23 3.162 -2.292 -6.667 154 HD11 LEU 23 HD11 LEU 23 2.141 -4.435 -6.126 155 HD12 LEU 23 HD12 LEU 23 2.016 -4.818 -7.846 156 HD13 LEU 23 HD13 LEU 23 1.081 -3.485 -7.168 157 HD21 LEU 23 HD21 LEU 23 4.409 -4.670 -8.002 158 HD22 LEU 23 HD22 LEU 23 4.561 -4.220 -6.307 159 HD23 LEU 23 HD23 LEU 23 5.289 -3.197 -7.558 160 H ASP 24 H ASP 24 4.315 -3.127 -10.944 161 HA ASP 24 HA ASP 24 3.597 -1.446 -13.214 162 HB2 ASP 24 HB2 ASP 24 5.803 -2.537 -13.436 163 HB3 ASP 24 HB3 ASP 24 5.076 -4.104 -13.112 164 HA PRO 25 HA PRO 25 -0.407 -3.324 -13.150 165 HB2 PRO 25 HB2 PRO 25 -0.056 -3.560 -16.103 166 HB3 PRO 25 HB3 PRO 25 -1.419 -2.920 -15.173 167 HG2 PRO 25 HG2 PRO 25 0.262 -1.251 -16.334 168 HG3 PRO 25 HG3 PRO 25 -0.328 -0.925 -14.694 169 HD2 PRO 25 HD2 PRO 25 2.330 -1.953 -15.581 170 HD3 PRO 25 HD3 PRO 25 1.934 -0.834 -14.262 171 H ASP 26 H ASP 26 2.184 -5.016 -14.842 172 HA ASP 26 HA ASP 26 0.574 -7.430 -15.008 173 HB2 ASP 26 HB2 ASP 26 2.043 -6.843 -16.906 174 HB3 ASP 26 HB3 ASP 26 3.447 -6.984 -15.860 175 H GLU 27 H GLU 27 2.324 -6.051 -12.541 176 HA GLU 27 HA GLU 27 3.602 -8.425 -11.622 177 HB2 GLU 27 HB2 GLU 27 3.059 -5.801 -10.223 178 HB3 GLU 27 HB3 GLU 27 3.936 -7.134 -9.484 179 HG2 GLU 27 HG2 GLU 27 4.716 -5.606 -11.940 180 HG3 GLU 27 HG3 GLU 27 5.488 -5.508 -10.353 181 HA PRO 28 HA PRO 28 0.338 -10.611 -9.686 182 HB2 PRO 28 HB2 PRO 28 1.659 -11.394 -7.355 183 HB3 PRO 28 HB3 PRO 28 1.731 -12.239 -8.898 184 HG2 PRO 28 HG2 PRO 28 3.656 -10.280 -7.726 185 HG3 PRO 28 HG3 PRO 28 3.986 -11.768 -8.635 186 HD2 PRO 28 HD2 PRO 28 4.205 -9.385 -9.796 187 HD3 PRO 28 HD3 PRO 28 3.516 -10.764 -10.678 188 H THR 29 H THR 29 -1.350 -9.820 -8.670 189 HA THR 29 HA THR 29 -1.010 -8.062 -6.393 190 HB THR 29 HB THR 29 -2.849 -6.628 -7.590 191 HG1 THR 29 HG1 THR 29 -1.373 -7.437 -9.849 192 HG21 THR 29 HG21 THR 29 0.086 -6.470 -8.356 193 HG22 THR 29 HG22 THR 29 -0.652 -5.737 -6.938 194 HG23 THR 29 HG23 THR 29 -1.076 -5.163 -8.549 195 H TYR 30 H TYR 30 -3.157 -7.520 -5.470 196 HA TYR 30 HA TYR 30 -5.024 -9.763 -5.523 197 HB2 TYR 30 HB2 TYR 30 -4.231 -7.797 -3.399 198 HB3 TYR 30 HB3 TYR 30 -5.747 -8.678 -3.323 199 HD1 TYR 30 HD1 TYR 30 -5.347 -11.297 -3.830 200 HD2 TYR 30 HD2 TYR 30 -2.558 -8.625 -2.113 201 HE1 TYR 30 HE1 TYR 30 -4.277 -13.177 -2.722 202 HE2 TYR 30 HE2 TYR 30 -1.450 -10.477 -0.978 203 HH TYR 30 HH TYR 30 -1.983 -12.756 -0.223 204 H ASP 31 H ASP 31 -7.211 -9.138 -5.196 205 HA ASP 31 HA ASP 31 -7.986 -6.424 -5.962 206 HB2 ASP 31 HB2 ASP 31 -8.070 -8.141 -7.929 207 HB3 ASP 31 HB3 ASP 31 -9.309 -8.964 -6.997 208 H LEU 32 H LEU 32 -10.340 -6.259 -5.245 209 HA LEU 32 HA LEU 32 -10.359 -6.885 -2.524 210 HB2 LEU 32 HB2 LEU 32 -12.643 -5.856 -4.208 211 HB3 LEU 32 HB3 LEU 32 -12.765 -6.115 -2.484 212 HG LEU 32 HG LEU 32 -10.908 -4.451 -2.170 213 HD11 LEU 32 HD11 LEU 32 -9.911 -4.506 -4.380 214 HD12 LEU 32 HD12 LEU 32 -10.423 -2.873 -3.959 215 HD13 LEU 32 HD13 LEU 32 -11.386 -3.836 -5.077 216 HD21 LEU 32 HD21 LEU 32 -12.351 -2.514 -2.502 217 HD22 LEU 32 HD22 LEU 32 -13.228 -3.873 -1.804 218 HD23 LEU 32 HD23 LEU 32 -13.420 -3.485 -3.515 219 HA PRO 33 HA PRO 33 -13.656 -10.387 -3.285 220 HB2 PRO 33 HB2 PRO 33 -13.271 -11.612 -5.744 221 HB3 PRO 33 HB3 PRO 33 -14.625 -10.548 -5.347 222 HG2 PRO 33 HG2 PRO 33 -12.090 -9.950 -6.805 223 HG3 PRO 33 HG3 PRO 33 -13.724 -9.333 -7.098 224 HD2 PRO 33 HD2 PRO 33 -11.864 -7.841 -5.893 225 HD3 PRO 33 HD3 PRO 33 -13.568 -7.767 -5.402 226 H ARG 34 H ARG 34 -10.466 -10.523 -4.949 227 HA ARG 34 HA ARG 34 -9.820 -13.144 -4.228 228 HB2 ARG 34 HB2 ARG 34 -8.767 -11.742 -6.007 229 HB3 ARG 34 HB3 ARG 34 -8.032 -10.775 -4.748 230 HG2 ARG 34 HG2 ARG 34 -6.415 -12.297 -5.650 231 HG3 ARG 34 HG3 ARG 34 -6.797 -12.764 -3.991 232 HD2 ARG 34 HD2 ARG 34 -8.068 -14.593 -4.676 233 HD3 ARG 34 HD3 ARG 34 -8.210 -13.945 -6.315 234 HE ARG 34 HE ARG 34 -5.594 -14.270 -6.194 235 HH11 ARG 34 HH11 ARG 34 -7.915 -16.706 -4.901 236 HH12 ARG 34 HH12 ARG 34 -6.905 -17.991 -5.367 237 HH21 ARG 34 HH21 ARG 34 -4.317 -16.066 -6.720 238 HH22 ARG 34 HH22 ARG 34 -4.845 -17.662 -6.354 239 H VAL 35 H VAL 35 -9.352 -10.016 -2.666 240 HA VAL 35 HA VAL 35 -7.835 -11.015 -0.489 241 HB VAL 35 HB VAL 35 -9.439 -8.442 -0.721 242 HG11 VAL 35 HG11 VAL 35 -8.175 -7.619 1.207 243 HG12 VAL 35 HG12 VAL 35 -7.410 -9.199 1.380 244 HG13 VAL 35 HG13 VAL 35 -9.146 -9.028 1.636 245 HG21 VAL 35 HG21 VAL 35 -7.233 -7.385 -1.008 246 HG22 VAL 35 HG22 VAL 35 -7.616 -8.537 -2.288 247 HG23 VAL 35 HG23 VAL 35 -6.493 -8.986 -1.006 248 H ALA 36 H ALA 36 -11.214 -10.388 -1.013 249 HA ALA 36 HA ALA 36 -12.235 -10.886 1.530 250 HB1 ALA 36 HB1 ALA 36 -13.569 -9.980 -0.326 251 HB2 ALA 36 HB2 ALA 36 -14.341 -11.409 0.365 252 HB3 ALA 36 HB3 ALA 36 -13.461 -11.530 -1.159 253 H GLU 37 H GLU 37 -11.549 -12.983 -1.133 254 HA GLU 37 HA GLU 37 -12.308 -15.494 -0.172 255 HB2 GLU 37 HB2 GLU 37 -11.578 -14.660 -2.484 256 HB3 GLU 37 HB3 GLU 37 -9.973 -14.799 -1.878 257 HG2 GLU 37 HG2 GLU 37 -10.271 -17.177 -1.433 258 HG3 GLU 37 HG3 GLU 37 -11.874 -17.090 -2.176 259 H LEU 38 H LEU 38 -9.252 -13.730 -0.063 260 HA LEU 38 HA LEU 38 -7.590 -15.714 1.017 261 HB2 LEU 38 HB2 LEU 38 -6.850 -13.724 -0.231 262 HB3 LEU 38 HB3 LEU 38 -7.334 -12.721 1.114 263 HG LEU 38 HG LEU 38 -5.647 -13.918 2.511 264 HD11 LEU 38 HD11 LEU 38 -4.811 -15.020 -0.162 265 HD12 LEU 38 HD12 LEU 38 -5.369 -15.951 1.234 266 HD13 LEU 38 HD13 LEU 38 -3.834 -15.084 1.296 267 HD21 LEU 38 HD21 LEU 38 -5.225 -11.717 1.591 268 HD22 LEU 38 HD22 LEU 38 -4.664 -12.436 0.083 269 HD23 LEU 38 HD23 LEU 38 -3.751 -12.684 1.572 270 H LEU 39 H LEU 39 -9.414 -13.089 2.506 271 HA LEU 39 HA LEU 39 -8.427 -13.872 5.140 272 HB2 LEU 39 HB2 LEU 39 -10.272 -11.624 4.385 273 HB3 LEU 39 HB3 LEU 39 -9.541 -11.870 5.959 274 HG LEU 39 HG LEU 39 -8.096 -11.150 3.404 275 HD11 LEU 39 HD11 LEU 39 -7.638 -9.045 4.540 276 HD12 LEU 39 HD12 LEU 39 -8.612 -9.574 5.909 277 HD13 LEU 39 HD13 LEU 39 -9.368 -9.323 4.335 278 HD21 LEU 39 HD21 LEU 39 -6.103 -10.922 4.826 279 HD22 LEU 39 HD22 LEU 39 -6.693 -12.584 4.791 280 HD23 LEU 39 HD23 LEU 39 -7.015 -11.558 6.191 281 H GLY 40 H GLY 40 -11.158 -14.398 3.160 282 HA2 GLY 40 HA2 GLY 40 -12.938 -15.802 3.528 283 HA3 GLY 40 HA3 GLY 40 -12.412 -16.005 5.196 284 H VAL 41 H VAL 41 -12.794 -12.870 3.855 285 HA VAL 41 HA VAL 41 -15.148 -12.435 5.574 286 HB VAL 41 HB VAL 41 -14.433 -10.121 5.917 287 HG11 VAL 41 HG11 VAL 41 -13.573 -11.705 7.492 288 HG12 VAL 41 HG12 VAL 41 -12.388 -10.429 7.209 289 HG13 VAL 41 HG13 VAL 41 -12.174 -12.013 6.465 290 HG21 VAL 41 HG21 VAL 41 -13.394 -9.634 3.786 291 HG22 VAL 41 HG22 VAL 41 -12.076 -10.758 4.126 292 HG23 VAL 41 HG23 VAL 41 -12.257 -9.283 5.082 293 HA PRO 42 HA PRO 42 -17.236 -10.976 1.904 294 HB2 PRO 42 HB2 PRO 42 -18.562 -8.778 2.810 295 HB3 PRO 42 HB3 PRO 42 -19.116 -10.431 3.114 296 HG2 PRO 42 HG2 PRO 42 -17.564 -8.594 4.891 297 HG3 PRO 42 HG3 PRO 42 -18.918 -9.666 5.300 298 HD2 PRO 42 HD2 PRO 42 -16.389 -10.338 5.854 299 HD3 PRO 42 HD3 PRO 42 -17.573 -11.549 5.337 300 H VAL 43 H VAL 43 -17.172 -9.368 0.322 301 HA VAL 43 HA VAL 43 -14.797 -7.901 0.016 302 HB VAL 43 HB VAL 43 -17.445 -7.453 -1.369 303 HG11 VAL 43 HG11 VAL 43 -14.650 -6.751 -2.264 304 HG12 VAL 43 HG12 VAL 43 -15.896 -5.609 -1.753 305 HG13 VAL 43 HG13 VAL 43 -16.109 -6.543 -3.235 306 HG21 VAL 43 HG21 VAL 43 -15.162 -9.260 -2.157 307 HG22 VAL 43 HG22 VAL 43 -16.590 -8.941 -3.140 308 HG23 VAL 43 HG23 VAL 43 -16.752 -9.777 -1.595 309 H SER 44 H SER 44 -17.984 -7.026 1.157 310 HA SER 44 HA SER 44 -17.686 -4.270 1.296 311 HB2 SER 44 HB2 SER 44 -19.839 -5.503 1.581 312 HB3 SER 44 HB3 SER 44 -19.295 -6.024 3.176 313 HG SER 44 HG SER 44 -19.616 -3.358 2.309 314 H LYS 45 H LYS 45 -16.672 -6.797 3.596 315 HA LYS 45 HA LYS 45 -15.817 -4.896 5.514 316 HB2 LYS 45 HB2 LYS 45 -15.419 -7.848 5.312 317 HB3 LYS 45 HB3 LYS 45 -14.421 -6.915 6.419 318 HG2 LYS 45 HG2 LYS 45 -16.491 -6.031 7.462 319 HG3 LYS 45 HG3 LYS 45 -17.428 -7.115 6.436 320 HD2 LYS 45 HD2 LYS 45 -16.414 -9.036 7.434 321 HD3 LYS 45 HD3 LYS 45 -15.262 -8.039 8.321 322 HE2 LYS 45 HE2 LYS 45 -17.002 -8.782 9.823 323 HE3 LYS 45 HE3 LYS 45 -17.143 -7.048 9.577 324 HZ1 LYS 45 HZ1 LYS 45 -19.275 -8.047 9.527 325 HZ2 LYS 45 HZ2 LYS 45 -18.839 -9.148 8.333 326 HZ3 LYS 45 HZ3 LYS 45 -18.952 -7.484 7.989 327 H VAL 46 H VAL 46 -14.266 -6.413 2.822 328 HA VAL 46 HA VAL 46 -11.630 -5.491 3.350 329 HB VAL 46 HB VAL 46 -12.975 -5.836 0.641 330 HG11 VAL 46 HG11 VAL 46 -10.948 -4.515 0.516 331 HG12 VAL 46 HG12 VAL 46 -10.699 -6.093 -0.240 332 HG13 VAL 46 HG13 VAL 46 -10.048 -5.767 1.369 333 HG21 VAL 46 HG21 VAL 46 -11.933 -8.065 0.600 334 HG22 VAL 46 HG22 VAL 46 -13.073 -7.901 1.935 335 HG23 VAL 46 HG23 VAL 46 -11.338 -7.810 2.241 336 H ALA 47 H ALA 47 -14.369 -4.029 1.703 337 HA ALA 47 HA ALA 47 -13.168 -1.574 1.056 338 HB1 ALA 47 HB1 ALA 47 -16.064 -2.119 1.709 339 HB2 ALA 47 HB2 ALA 47 -15.325 -2.336 0.126 340 HB3 ALA 47 HB3 ALA 47 -15.443 -0.716 0.839 341 H GLN 48 H GLN 48 -14.752 -2.715 3.949 342 HA GLN 48 HA GLN 48 -14.739 -0.249 5.343 343 HB2 GLN 48 HB2 GLN 48 -14.832 -3.064 6.445 344 HB3 GLN 48 HB3 GLN 48 -15.047 -1.622 7.420 345 HG2 GLN 48 HG2 GLN 48 -16.815 -2.483 5.131 346 HG3 GLN 48 HG3 GLN 48 -17.185 -2.659 6.844 347 HE21 GLN 48 HE21 GLN 48 -16.125 -0.045 7.578 348 HE22 GLN 48 HE22 GLN 48 -17.227 1.117 6.979 349 H GLN 49 H GLN 49 -12.387 -2.842 5.112 350 HA GLN 49 HA GLN 49 -10.529 -1.922 7.024 351 HB2 GLN 49 HB2 GLN 49 -10.017 -3.335 4.410 352 HB3 GLN 49 HB3 GLN 49 -8.831 -3.146 5.692 353 HG2 GLN 49 HG2 GLN 49 -10.328 -4.348 7.175 354 HG3 GLN 49 HG3 GLN 49 -11.413 -4.652 5.827 355 HE21 GLN 49 HE21 GLN 49 -11.140 -6.886 5.937 356 HE22 GLN 49 HE22 GLN 49 -9.676 -7.642 5.413 357 H LEU 50 H LEU 50 -10.913 -1.291 3.678 358 HA LEU 50 HA LEU 50 -8.818 0.562 3.244 359 HB2 LEU 50 HB2 LEU 50 -11.334 -0.146 1.870 360 HB3 LEU 50 HB3 LEU 50 -10.695 1.438 1.474 361 HG LEU 50 HG LEU 50 -10.078 -0.263 -0.171 362 HD11 LEU 50 HD11 LEU 50 -8.608 1.602 0.127 363 HD12 LEU 50 HD12 LEU 50 -7.665 0.149 -0.217 364 HD13 LEU 50 HD13 LEU 50 -7.770 0.770 1.433 365 HD21 LEU 50 HD21 LEU 50 -8.584 -1.593 2.092 366 HD22 LEU 50 HD22 LEU 50 -8.492 -2.052 0.392 367 HD23 LEU 50 HD23 LEU 50 -10.010 -2.232 1.273 368 H ARG 51 H ARG 51 -12.068 0.972 4.402 369 HA ARG 51 HA ARG 51 -12.026 3.797 4.587 370 HB2 ARG 51 HB2 ARG 51 -13.779 1.679 5.772 371 HB3 ARG 51 HB3 ARG 51 -13.977 3.379 6.185 372 HG2 ARG 51 HG2 ARG 51 -14.433 3.901 3.861 373 HG3 ARG 51 HG3 ARG 51 -14.136 2.220 3.411 374 HD2 ARG 51 HD2 ARG 51 -16.551 2.837 3.631 375 HD3 ARG 51 HD3 ARG 51 -16.054 1.477 4.635 376 HE ARG 51 HE ARG 51 -15.802 3.394 6.395 377 HH11 ARG 51 HH11 ARG 51 -18.439 3.096 4.035 378 HH12 ARG 51 HH12 ARG 51 -19.586 3.833 5.051 379 HH21 ARG 51 HH21 ARG 51 -17.354 4.363 7.763 380 HH22 ARG 51 HH22 ARG 51 -18.950 4.600 7.247 381 H GLU 52 H GLU 52 -10.998 1.259 6.772 382 HA GLU 52 HA GLU 52 -10.791 3.160 8.965 383 HB2 GLU 52 HB2 GLU 52 -10.337 0.195 8.818 384 HB3 GLU 52 HB3 GLU 52 -10.066 1.145 10.272 385 HG2 GLU 52 HG2 GLU 52 -12.409 1.813 10.273 386 HG3 GLU 52 HG3 GLU 52 -12.671 0.882 8.801 387 H GLY 53 H GLY 53 -8.865 2.081 6.495 388 HA2 GLY 53 HA2 GLY 53 -6.648 2.626 6.050 389 HA3 GLY 53 HA3 GLY 53 -6.555 3.335 7.663 390 H HIS 54 H HIS 54 -7.658 0.133 6.988 391 HA HIS 54 HA HIS 54 -5.467 -1.016 8.559 392 HB2 HIS 54 HB2 HIS 54 -7.757 -1.784 9.062 393 HB3 HIS 54 HB3 HIS 54 -7.985 -2.262 7.391 394 HD1 HIS 54 HD1 HIS 54 -7.242 -4.685 6.767 395 HD2 HIS 54 HD2 HIS 54 -5.894 -3.436 10.515 396 HE1 HIS 54 HE1 HIS 54 -6.229 -6.682 7.836 397 H LEU 55 H LEU 55 -6.622 -0.620 5.361 398 HA LEU 55 HA LEU 55 -4.375 -2.046 4.252 399 HB2 LEU 55 HB2 LEU 55 -6.249 -3.663 4.539 400 HB3 LEU 55 HB3 LEU 55 -7.272 -2.608 3.605 401 HG LEU 55 HG LEU 55 -5.885 -3.028 1.619 402 HD11 LEU 55 HD11 LEU 55 -4.201 -4.816 1.695 403 HD12 LEU 55 HD12 LEU 55 -4.392 -4.918 3.444 404 HD13 LEU 55 HD13 LEU 55 -3.749 -3.450 2.710 405 HD21 LEU 55 HD21 LEU 55 -7.839 -4.396 2.038 406 HD22 LEU 55 HD22 LEU 55 -6.892 -5.473 3.064 407 HD23 LEU 55 HD23 LEU 55 -6.557 -5.384 1.339 408 H VAL 56 H VAL 56 -4.027 -1.246 2.039 409 HA VAL 56 HA VAL 56 -5.776 0.894 1.211 410 HB VAL 56 HB VAL 56 -3.907 1.879 2.535 411 HG11 VAL 56 HG11 VAL 56 -1.651 2.002 1.585 412 HG12 VAL 56 HG12 VAL 56 -2.134 0.825 0.359 413 HG13 VAL 56 HG13 VAL 56 -2.134 0.376 2.064 414 HG21 VAL 56 HG21 VAL 56 -3.300 3.637 0.932 415 HG22 VAL 56 HG22 VAL 56 -5.018 3.242 0.900 416 HG23 VAL 56 HG23 VAL 56 -3.952 2.642 -0.371 417 H ALA 57 H ALA 57 -5.427 1.437 -1.084 418 HA ALA 57 HA ALA 57 -4.355 -0.809 -2.618 419 HB1 ALA 57 HB1 ALA 57 -6.748 -1.233 -2.213 420 HB2 ALA 57 HB2 ALA 57 -6.408 -0.930 -3.915 421 HB3 ALA 57 HB3 ALA 57 -7.133 0.332 -2.921 422 H VAL 58 H VAL 58 -4.216 -0.270 -4.925 423 HA VAL 58 HA VAL 58 -4.159 2.583 -5.534 424 HB VAL 58 HB VAL 58 -2.091 2.146 -6.943 425 HG11 VAL 58 HG11 VAL 58 -0.528 2.402 -5.057 426 HG12 VAL 58 HG12 VAL 58 -1.811 1.903 -3.953 427 HG13 VAL 58 HG13 VAL 58 -1.974 3.399 -4.867 428 HG21 VAL 58 HG21 VAL 58 -0.635 0.267 -6.270 429 HG22 VAL 58 HG22 VAL 58 -2.158 -0.294 -6.962 430 HG23 VAL 58 HG23 VAL 58 -1.914 -0.332 -5.216 431 H ARG 59 H ARG 59 -3.972 2.874 -8.020 432 HA ARG 59 HA ARG 59 -5.659 0.782 -9.171 433 HB2 ARG 59 HB2 ARG 59 -5.613 3.712 -9.845 434 HB3 ARG 59 HB3 ARG 59 -6.536 2.500 -10.719 435 HG2 ARG 59 HG2 ARG 59 -7.726 1.969 -8.622 436 HG3 ARG 59 HG3 ARG 59 -6.875 3.306 -7.846 437 HD2 ARG 59 HD2 ARG 59 -8.695 3.511 -10.236 438 HD3 ARG 59 HD3 ARG 59 -9.118 3.961 -8.588 439 HE ARG 59 HE ARG 59 -6.858 5.381 -9.229 440 HH11 ARG 59 HH11 ARG 59 -10.178 5.145 -10.431 441 HH12 ARG 59 HH12 ARG 59 -10.272 6.719 -11.017 442 HH21 ARG 59 HH21 ARG 59 -6.968 7.624 -10.012 443 HH22 ARG 59 HH22 ARG 59 -8.379 8.158 -10.788 444 H ARG 60 H ARG 60 -5.111 -0.236 -10.886 445 HA ARG 60 HA ARG 60 -2.828 0.724 -12.466 446 HB2 ARG 60 HB2 ARG 60 -2.285 -1.624 -13.041 447 HB3 ARG 60 HB3 ARG 60 -2.286 -1.432 -11.295 448 HG2 ARG 60 HG2 ARG 60 -4.399 -2.537 -11.104 449 HG3 ARG 60 HG3 ARG 60 -4.628 -2.507 -12.844 450 HD2 ARG 60 HD2 ARG 60 -2.704 -4.032 -13.093 451 HD3 ARG 60 HD3 ARG 60 -2.563 -4.108 -11.330 452 HE ARG 60 HE ARG 60 -5.161 -4.697 -11.853 453 HH11 ARG 60 HH11 ARG 60 -2.111 -6.204 -12.957 454 HH12 ARG 60 HH12 ARG 60 -2.782 -7.756 -13.012 455 HH21 ARG 60 HH21 ARG 60 -6.030 -6.835 -11.970 456 HH22 ARG 60 HH22 ARG 60 -5.047 -8.136 -12.443 457 H ALA 61 H ALA 61 -3.487 1.425 -14.372 458 HA ALA 61 HA ALA 61 -4.683 1.830 -16.246 459 HB1 ALA 61 HB1 ALA 61 -4.175 -0.532 -16.799 460 HB2 ALA 61 HB2 ALA 61 -5.748 -0.039 -17.424 461 HB3 ALA 61 HB3 ALA 61 -5.650 -1.030 -15.968 462 H GLY 62 H GLY 62 -5.869 1.991 -13.482 463 HA2 GLY 62 HA2 GLY 62 -7.828 3.270 -12.987 464 HA3 GLY 62 HA3 GLY 62 -8.641 2.475 -14.334 465 H GLY 63 H GLY 63 -7.357 -0.136 -13.244 466 HA2 GLY 63 HA2 GLY 63 -9.667 -0.868 -11.664 467 HA3 GLY 63 HA3 GLY 63 -8.353 -1.926 -12.174 468 H VAL 64 H VAL 64 -9.632 -1.546 -9.528 469 HA VAL 64 HA VAL 64 -7.473 -0.275 -8.010 470 HB VAL 64 HB VAL 64 -10.119 -1.388 -7.017 471 HG11 VAL 64 HG11 VAL 64 -8.461 -1.278 -5.266 472 HG12 VAL 64 HG12 VAL 64 -9.702 -0.049 -5.006 473 HG13 VAL 64 HG13 VAL 64 -8.127 0.410 -5.649 474 HG21 VAL 64 HG21 VAL 64 -10.928 0.906 -6.925 475 HG22 VAL 64 HG22 VAL 64 -10.473 0.482 -8.573 476 HG23 VAL 64 HG23 VAL 64 -9.411 1.496 -7.590 477 H VAL 65 H VAL 65 -5.915 -1.491 -7.205 478 HA VAL 65 HA VAL 65 -6.442 -4.277 -6.513 479 HB VAL 65 HB VAL 65 -4.155 -4.849 -7.436 480 HG11 VAL 65 HG11 VAL 65 -6.323 -4.073 -9.392 481 HG12 VAL 65 HG12 VAL 65 -6.196 -5.603 -8.522 482 HG13 VAL 65 HG13 VAL 65 -4.991 -5.175 -9.737 483 HG21 VAL 65 HG21 VAL 65 -3.315 -2.581 -7.734 484 HG22 VAL 65 HG22 VAL 65 -4.579 -2.264 -8.925 485 HG23 VAL 65 HG23 VAL 65 -3.314 -3.440 -9.276 486 H ILE 66 H ILE 66 -4.722 -5.202 -5.287 487 HA ILE 66 HA ILE 66 -3.353 -3.260 -3.551 488 HB ILE 66 HB ILE 66 -4.768 -5.813 -2.684 489 HG12 ILE 66 HG12 ILE 66 -5.514 -2.939 -2.122 490 HG13 ILE 66 HG13 ILE 66 -6.287 -3.934 -3.346 491 HG21 ILE 66 HG21 ILE 66 -4.285 -5.051 -0.401 492 HG22 ILE 66 HG22 ILE 66 -3.388 -3.676 -1.049 493 HG23 ILE 66 HG23 ILE 66 -2.802 -5.316 -1.319 494 HD11 ILE 66 HD11 ILE 66 -7.623 -3.782 -1.330 495 HD12 ILE 66 HD12 ILE 66 -6.283 -4.433 -0.386 496 HD13 ILE 66 HD13 ILE 66 -7.082 -5.438 -1.601 497 HA PRO 67 HA PRO 67 0.143 -5.853 -4.919 498 HB2 PRO 67 HB2 PRO 67 1.308 -4.719 -2.435 499 HB3 PRO 67 HB3 PRO 67 1.985 -4.764 -4.064 500 HG2 PRO 67 HG2 PRO 67 1.028 -2.495 -3.092 501 HG3 PRO 67 HG3 PRO 67 0.710 -2.945 -4.777 502 HD2 PRO 67 HD2 PRO 67 -1.105 -3.077 -2.405 503 HD3 PRO 67 HD3 PRO 67 -1.461 -2.626 -4.089 504 H GLN 68 H GLN 68 0.686 -7.883 -4.507 505 HA GLN 68 HA GLN 68 -0.371 -9.622 -2.682 506 HB2 GLN 68 HB2 GLN 68 2.272 -9.591 -4.063 507 HB3 GLN 68 HB3 GLN 68 1.797 -10.953 -3.055 508 HG2 GLN 68 HG2 GLN 68 0.266 -9.954 -5.455 509 HG3 GLN 68 HG3 GLN 68 1.455 -11.258 -5.460 510 HE21 GLN 68 HE21 GLN 68 -1.416 -11.296 -6.100 511 HE22 GLN 68 HE22 GLN 68 -2.081 -12.487 -5.056 512 H VAL 69 H VAL 69 2.377 -7.560 -2.267 513 HA VAL 69 HA VAL 69 3.518 -8.822 -0.009 514 HB VAL 69 HB VAL 69 4.949 -6.809 0.110 515 HG11 VAL 69 HG11 VAL 69 6.028 -7.142 -2.081 516 HG12 VAL 69 HG12 VAL 69 4.591 -7.990 -2.651 517 HG13 VAL 69 HG13 VAL 69 5.560 -8.676 -1.347 518 HG21 VAL 69 HG21 VAL 69 3.210 -5.870 -2.167 519 HG22 VAL 69 HG22 VAL 69 4.717 -5.099 -1.668 520 HG23 VAL 69 HG23 VAL 69 3.338 -5.141 -0.570 521 H PHE 70 H PHE 70 0.721 -7.011 -0.137 522 HA PHE 70 HA PHE 70 1.131 -5.816 2.463 523 HB2 PHE 70 HB2 PHE 70 -1.082 -5.698 0.445 524 HB3 PHE 70 HB3 PHE 70 -1.433 -5.282 2.119 525 HD1 PHE 70 HD1 PHE 70 1.326 -4.526 -0.338 526 HD2 PHE 70 HD2 PHE 70 -1.413 -3.060 2.567 527 HE1 PHE 70 HE1 PHE 70 2.212 -2.252 -0.641 528 HE2 PHE 70 HE2 PHE 70 -0.514 -0.807 2.291 529 HZ PHE 70 HZ PHE 70 1.272 -0.381 0.695 530 H PHE 71 H PHE 71 0.504 -8.755 1.344 531 HA PHE 71 HA PHE 71 -0.695 -9.604 3.860 532 HB2 PHE 71 HB2 PHE 71 -1.419 -10.673 1.119 533 HB3 PHE 71 HB3 PHE 71 -1.951 -11.347 2.649 534 HD1 PHE 71 HD1 PHE 71 -2.331 -8.626 0.269 535 HD2 PHE 71 HD2 PHE 71 -3.672 -10.279 3.938 536 HE1 PHE 71 HE1 PHE 71 -4.276 -7.184 0.184 537 HE2 PHE 71 HE2 PHE 71 -5.640 -8.821 3.877 538 HZ PHE 71 HZ PHE 71 -5.955 -7.269 2.004 539 H THR 72 H THR 72 -0.231 -11.892 4.181 540 HA THR 72 HA THR 72 2.426 -12.501 3.175 541 HB THR 72 HB THR 72 2.411 -14.289 4.887 542 HG1 THR 72 HG1 THR 72 -0.158 -13.232 5.507 543 HG21 THR 72 HG21 THR 72 3.197 -12.058 5.552 544 HG22 THR 72 HG22 THR 72 2.372 -12.852 6.892 545 HG23 THR 72 HG23 THR 72 1.546 -11.594 5.966 546 H ASN 73 H ASN 73 2.759 -14.626 2.298 547 HA ASN 73 HA ASN 73 0.695 -15.541 0.589 548 HB2 ASN 73 HB2 ASN 73 2.238 -17.361 -0.025 549 HB3 ASN 73 HB3 ASN 73 3.029 -15.792 -0.056 550 HD21 ASN 73 HD21 ASN 73 4.634 -15.337 1.446 551 HD22 ASN 73 HD22 ASN 73 5.341 -16.591 2.398 552 H SER 74 H SER 74 1.378 -16.131 3.834 553 HA SER 74 HA SER 74 0.368 -18.776 4.020 554 HB2 SER 74 HB2 SER 74 0.828 -16.721 6.174 555 HB3 SER 74 HB3 SER 74 0.746 -18.473 6.370 556 HG SER 74 HG SER 74 2.565 -18.516 4.835 557 H GLY 75 H GLY 75 -1.188 -15.792 3.572 558 HA2 GLY 75 HA2 GLY 75 -3.563 -15.918 3.163 559 HA3 GLY 75 HA3 GLY 75 -3.680 -17.080 4.469 560 H GLN 76 H GLN 76 -1.722 -14.893 5.750 561 HA GLN 76 HA GLN 76 -4.018 -13.386 6.798 562 HB2 GLN 76 HB2 GLN 76 -2.713 -12.882 8.797 563 HB3 GLN 76 HB3 GLN 76 -2.794 -14.619 8.545 564 HG2 GLN 76 HG2 GLN 76 -0.543 -14.709 7.841 565 HG3 GLN 76 HG3 GLN 76 -0.457 -12.959 7.654 566 HE21 GLN 76 HE21 GLN 76 -0.265 -11.673 9.470 567 HE22 GLN 76 HE22 GLN 76 0.241 -12.317 10.992 568 H VAL 77 H VAL 77 -3.625 -11.142 7.385 569 HA VAL 77 HA VAL 77 -2.178 -9.742 5.331 570 HB VAL 77 HB VAL 77 -4.383 -8.981 6.471 571 HG11 VAL 77 HG11 VAL 77 -2.474 -8.054 8.567 572 HG12 VAL 77 HG12 VAL 77 -3.728 -9.284 8.783 573 HG13 VAL 77 HG13 VAL 77 -4.171 -7.594 8.470 574 HG21 VAL 77 HG21 VAL 77 -3.836 -6.595 6.298 575 HG22 VAL 77 HG22 VAL 77 -3.182 -7.530 4.951 576 HG23 VAL 77 HG23 VAL 77 -2.122 -7.010 6.262 577 H VAL 78 H VAL 78 -0.363 -8.233 5.863 578 HA VAL 78 HA VAL 78 1.477 -9.454 7.640 579 HB VAL 78 HB VAL 78 1.617 -6.645 6.496 580 HG11 VAL 78 HG11 VAL 78 3.773 -8.441 7.603 581 HG12 VAL 78 HG12 VAL 78 3.156 -6.960 8.341 582 HG13 VAL 78 HG13 VAL 78 4.044 -6.888 6.819 583 HG21 VAL 78 HG21 VAL 78 1.402 -8.289 4.706 584 HG22 VAL 78 HG22 VAL 78 2.741 -9.217 5.382 585 HG23 VAL 78 HG23 VAL 78 3.025 -7.604 4.726 586 H LYS 79 H LYS 79 1.707 -9.188 9.725 587 HA LYS 79 HA LYS 79 -0.307 -7.942 11.217 588 HB2 LYS 79 HB2 LYS 79 0.919 -8.611 13.210 589 HB3 LYS 79 HB3 LYS 79 0.803 -9.915 12.032 590 HG2 LYS 79 HG2 LYS 79 3.051 -9.159 11.248 591 HG3 LYS 79 HG3 LYS 79 3.134 -8.214 12.729 592 HD2 LYS 79 HD2 LYS 79 2.720 -11.227 12.642 593 HD3 LYS 79 HD3 LYS 79 4.278 -10.467 12.892 594 HE2 LYS 79 HE2 LYS 79 3.472 -11.162 15.023 595 HE3 LYS 79 HE3 LYS 79 3.346 -9.414 14.970 596 HZ1 LYS 79 HZ1 LYS 79 1.091 -11.304 14.534 597 HZ2 LYS 79 HZ2 LYS 79 0.950 -9.624 14.633 598 HZ3 LYS 79 HZ3 LYS 79 1.413 -10.512 15.977 599 H SER 80 H SER 80 2.617 -6.585 10.102 600 HA SER 80 HA SER 80 2.370 -4.381 12.013 601 HB2 SER 80 HB2 SER 80 4.585 -5.544 11.793 602 HB3 SER 80 HB3 SER 80 4.655 -5.001 10.119 603 HG SER 80 HG SER 80 4.607 -2.871 10.872 604 H LEU 81 H LEU 81 0.886 -5.076 9.303 605 HA LEU 81 HA LEU 81 1.567 -3.068 7.464 606 HB2 LEU 81 HB2 LEU 81 0.148 -5.156 7.061 607 HB3 LEU 81 HB3 LEU 81 -1.190 -4.254 7.727 608 HG LEU 81 HG LEU 81 -0.671 -2.499 5.965 609 HD11 LEU 81 HD11 LEU 81 1.531 -3.329 5.362 610 HD12 LEU 81 HD12 LEU 81 0.443 -3.394 3.966 611 HD13 LEU 81 HD13 LEU 81 0.805 -4.864 4.882 612 HD21 LEU 81 HD21 LEU 81 -2.019 -3.667 4.334 613 HD22 LEU 81 HD22 LEU 81 -2.609 -4.002 5.958 614 HD23 LEU 81 HD23 LEU 81 -1.648 -5.212 5.099 615 HA PRO 82 HA PRO 82 -2.133 -0.472 9.345 616 HB2 PRO 82 HB2 PRO 82 -2.123 -1.418 12.156 617 HB3 PRO 82 HB3 PRO 82 -3.492 -0.988 11.129 618 HG2 PRO 82 HG2 PRO 82 -2.993 -3.533 11.699 619 HG3 PRO 82 HG3 PRO 82 -3.514 -3.057 10.070 620 HD2 PRO 82 HD2 PRO 82 -0.765 -3.702 11.067 621 HD3 PRO 82 HD3 PRO 82 -1.562 -4.211 9.570 622 H GLY 83 H GLY 83 0.608 -1.536 11.237 623 HA2 GLY 83 HA2 GLY 83 1.005 0.752 12.821 624 HA3 GLY 83 HA3 GLY 83 2.256 -0.399 12.379 625 H LEU 84 H LEU 84 2.348 -0.064 9.646 626 HA LEU 84 HA LEU 84 3.855 2.335 9.478 627 HB2 LEU 84 HB2 LEU 84 4.333 1.753 7.187 628 HB3 LEU 84 HB3 LEU 84 4.411 0.300 8.150 629 HG LEU 84 HG LEU 84 1.881 0.111 7.249 630 HD11 LEU 84 HD11 LEU 84 3.326 1.558 5.031 631 HD12 LEU 84 HD12 LEU 84 1.927 2.141 5.915 632 HD13 LEU 84 HD13 LEU 84 1.779 0.740 4.871 633 HD21 LEU 84 HD21 LEU 84 3.566 -1.632 7.076 634 HD22 LEU 84 HD22 LEU 84 4.365 -0.758 5.766 635 HD23 LEU 84 HD23 LEU 84 2.748 -1.424 5.529 636 H LEU 85 H LEU 85 0.691 1.371 8.413 637 HA LEU 85 HA LEU 85 0.084 3.667 6.927 638 HB2 LEU 85 HB2 LEU 85 -1.725 1.705 8.326 639 HB3 LEU 85 HB3 LEU 85 -2.293 2.961 7.249 640 HG LEU 85 HG LEU 85 -0.440 0.721 6.423 641 HD11 LEU 85 HD11 LEU 85 -2.648 -0.129 7.004 642 HD12 LEU 85 HD12 LEU 85 -2.386 -0.189 5.264 643 HD13 LEU 85 HD13 LEU 85 -3.397 1.078 5.960 644 HD21 LEU 85 HD21 LEU 85 -1.927 2.792 4.806 645 HD22 LEU 85 HD22 LEU 85 -0.978 1.461 4.147 646 HD23 LEU 85 HD23 LEU 85 -0.182 2.734 5.062 647 H THR 86 H THR 86 -0.402 2.878 10.299 648 HA THR 86 HA THR 86 -2.019 5.054 11.003 649 HB THR 86 HB THR 86 -0.007 3.615 12.761 650 HG1 THR 86 HG1 THR 86 -2.172 2.758 11.583 651 HG21 THR 86 HG21 THR 86 -2.432 5.271 13.512 652 HG22 THR 86 HG22 THR 86 -0.750 5.737 13.770 653 HG23 THR 86 HG23 THR 86 -1.427 4.359 14.638 654 H ILE 87 H ILE 87 1.538 4.851 11.071 655 HA ILE 87 HA ILE 87 1.796 7.502 12.019 656 HB ILE 87 HB ILE 87 3.574 5.984 12.538 657 HG12 ILE 87 HG12 ILE 87 4.273 8.389 12.018 658 HG13 ILE 87 HG13 ILE 87 5.554 7.191 12.085 659 HG21 ILE 87 HG21 ILE 87 4.031 5.523 9.627 660 HG22 ILE 87 HG22 ILE 87 3.410 4.382 10.817 661 HG23 ILE 87 HG23 ILE 87 5.079 4.945 10.919 662 HD11 ILE 87 HD11 ILE 87 4.312 8.324 9.581 663 HD12 ILE 87 HD12 ILE 87 5.619 7.150 9.629 664 HD13 ILE 87 HD13 ILE 87 5.876 8.783 10.247 665 H LEU 88 H LEU 88 1.873 6.128 8.807 666 HA LEU 88 HA LEU 88 2.528 8.526 7.471 667 HB2 LEU 88 HB2 LEU 88 1.186 6.010 6.563 668 HB3 LEU 88 HB3 LEU 88 1.620 7.314 5.474 669 HG LEU 88 HG LEU 88 3.715 5.925 7.181 670 HD11 LEU 88 HD11 LEU 88 2.368 4.430 5.635 671 HD12 LEU 88 HD12 LEU 88 4.094 4.395 5.657 672 HD13 LEU 88 HD13 LEU 88 3.259 5.260 4.337 673 HD21 LEU 88 HD21 LEU 88 3.866 7.535 4.638 674 HD22 LEU 88 HD22 LEU 88 5.221 6.896 5.564 675 HD23 LEU 88 HD23 LEU 88 4.219 8.171 6.244 676 H HIS 89 H HIS 89 -0.549 7.121 8.401 677 HA HIS 89 HA HIS 89 -2.173 8.967 7.033 678 HB2 HIS 89 HB2 HIS 89 -2.801 7.339 9.509 679 HB3 HIS 89 HB3 HIS 89 -3.985 8.336 8.676 680 HD1 HIS 89 HD1 HIS 89 -4.346 5.218 8.949 681 HD2 HIS 89 HD2 HIS 89 -2.685 7.160 5.662 682 HE1 HIS 89 HE1 HIS 89 -4.570 3.653 7.012 683 H ASP 90 H ASP 90 -0.561 9.104 10.126 684 HA ASP 90 HA ASP 90 -1.863 11.393 11.155 685 HB2 ASP 90 HB2 ASP 90 -0.417 10.007 12.561 686 HB3 ASP 90 HB3 ASP 90 0.977 10.428 11.582 687 H GLY 91 H GLY 91 0.713 10.975 8.849 688 HA2 GLY 91 HA2 GLY 91 1.247 13.842 8.724 689 HA3 GLY 91 HA3 GLY 91 2.118 12.584 7.856 690 H GLY 92 H GLY 92 -0.979 11.830 7.421 691 HA2 GLY 92 HA2 GLY 92 -2.565 12.180 5.785 692 HA3 GLY 92 HA3 GLY 92 -1.853 13.766 5.528 693 H TYR 93 H TYR 93 -0.339 10.577 5.181 694 HA TYR 93 HA TYR 93 0.327 11.347 2.475 695 HB2 TYR 93 HB2 TYR 93 1.475 9.285 4.322 696 HB3 TYR 93 HB3 TYR 93 1.807 9.230 2.591 697 HD1 TYR 93 HD1 TYR 93 2.185 11.329 5.635 698 HD2 TYR 93 HD2 TYR 93 3.316 10.722 1.588 699 HE1 TYR 93 HE1 TYR 93 3.939 13.036 5.866 700 HE2 TYR 93 HE2 TYR 93 5.072 12.403 1.807 701 HH TYR 93 HH TYR 93 6.127 13.561 4.745 702 H ARG 94 H ARG 94 -0.385 10.484 0.727 703 HA ARG 94 HA ARG 94 -2.721 8.818 0.900 704 HB2 ARG 94 HB2 ARG 94 -3.092 9.343 -1.401 705 HB3 ARG 94 HB3 ARG 94 -2.557 10.814 -0.610 706 HG2 ARG 94 HG2 ARG 94 -0.275 10.349 -1.469 707 HG3 ARG 94 HG3 ARG 94 -0.949 9.023 -2.420 708 HD2 ARG 94 HD2 ARG 94 -0.888 10.836 -3.903 709 HD3 ARG 94 HD3 ARG 94 -2.563 10.793 -3.351 710 HE ARG 94 HE ARG 94 -0.787 12.488 -1.844 711 HH11 ARG 94 HH11 ARG 94 -3.322 12.389 -4.338 712 HH12 ARG 94 HH12 ARG 94 -3.438 14.091 -4.439 713 HH21 ARG 94 HH21 ARG 94 -0.983 14.776 -2.023 714 HH22 ARG 94 HH22 ARG 94 -2.097 15.453 -3.118 715 H ASP 95 H ASP 95 -2.956 7.160 -0.979 716 HA ASP 95 HA ASP 95 -1.623 4.845 -0.239 717 HB2 ASP 95 HB2 ASP 95 -2.731 3.866 -2.224 718 HB3 ASP 95 HB3 ASP 95 -3.827 4.862 -1.276 719 H THR 96 H THR 96 -1.159 6.825 -3.129 720 HA THR 96 HA THR 96 0.850 5.300 -4.274 721 HB THR 96 HB THR 96 0.360 8.294 -4.575 722 HG1 THR 96 HG1 THR 96 -0.622 6.027 -5.973 723 HG21 THR 96 HG21 THR 96 1.758 6.330 -6.418 724 HG22 THR 96 HG22 THR 96 2.574 7.559 -5.451 725 HG23 THR 96 HG23 THR 96 1.475 8.041 -6.745 726 H GLU 97 H GLU 97 1.024 7.900 -1.910 727 HA GLU 97 HA GLU 97 3.843 8.175 -1.911 728 HB2 GLU 97 HB2 GLU 97 1.820 8.857 0.213 729 HB3 GLU 97 HB3 GLU 97 3.531 9.264 0.275 730 HG2 GLU 97 HG2 GLU 97 1.648 10.153 -1.875 731 HG3 GLU 97 HG3 GLU 97 2.090 11.129 -0.468 732 H ILE 98 H ILE 98 1.606 6.167 -0.051 733 HA ILE 98 HA ILE 98 3.390 5.253 1.967 734 HB ILE 98 HB ILE 98 1.256 3.563 0.649 735 HG12 ILE 98 HG12 ILE 98 -0.010 5.495 1.254 736 HG13 ILE 98 HG13 ILE 98 -0.249 4.284 2.512 737 HG21 ILE 98 HG21 ILE 98 2.391 3.429 3.411 738 HG22 ILE 98 HG22 ILE 98 2.622 2.286 2.084 739 HG23 ILE 98 HG23 ILE 98 1.033 2.473 2.822 740 HD11 ILE 98 HD11 ILE 98 -0.026 6.555 3.383 741 HD12 ILE 98 HD12 ILE 98 1.616 6.617 2.745 742 HD13 ILE 98 HD13 ILE 98 1.197 5.445 4.000 743 H MET 99 H MET 99 2.466 3.905 -1.140 744 HA MET 99 HA MET 99 4.309 1.738 -0.961 745 HB2 MET 99 HB2 MET 99 2.671 2.666 -3.312 746 HB3 MET 99 HB3 MET 99 3.512 1.125 -3.189 747 HG2 MET 99 HG2 MET 99 2.101 0.580 -1.231 748 HG3 MET 99 HG3 MET 99 1.218 2.077 -1.498 749 HE1 MET 99 HE1 MET 99 -1.457 -0.426 -2.658 750 HE2 MET 99 HE2 MET 99 -1.108 1.028 -1.722 751 HE3 MET 99 HE3 MET 99 -0.387 -0.513 -1.258 752 H ARG 100 H ARG 100 4.575 4.952 -1.964 753 HA ARG 100 HA ARG 100 6.276 4.855 -4.162 754 HB2 ARG 100 HB2 ARG 100 5.102 6.850 -3.361 755 HB3 ARG 100 HB3 ARG 100 6.116 6.885 -1.938 756 HG2 ARG 100 HG2 ARG 100 8.055 7.375 -3.329 757 HG3 ARG 100 HG3 ARG 100 7.035 7.311 -4.775 758 HD2 ARG 100 HD2 ARG 100 5.643 9.106 -3.857 759 HD3 ARG 100 HD3 ARG 100 6.691 9.188 -2.445 760 HE ARG 100 HE ARG 100 8.421 9.588 -4.416 761 HH11 ARG 100 HH11 ARG 100 5.225 11.054 -3.796 762 HH12 ARG 100 HH12 ARG 100 5.619 12.548 -4.470 763 HH21 ARG 100 HH21 ARG 100 8.965 11.672 -5.372 764 HH22 ARG 100 HH22 ARG 100 7.798 12.917 -5.400 765 H TRP 101 H TRP 101 7.279 5.612 -0.847 766 HA TRP 101 HA TRP 101 9.970 5.043 -1.488 767 HB2 TRP 101 HB2 TRP 101 10.368 5.322 1.018 768 HB3 TRP 101 HB3 TRP 101 9.717 6.706 0.153 769 HD1 TRP 101 HD1 TRP 101 7.370 7.603 0.880 770 HE1 TRP 101 HE1 TRP 101 5.789 7.025 2.834 771 HE3 TRP 101 HE3 TRP 101 9.533 3.249 2.484 772 HZ2 TRP 101 HZ2 TRP 101 5.519 5.077 4.724 773 HZ3 TRP 101 HZ3 TRP 101 8.529 2.085 4.365 774 HH2 TRP 101 HH2 TRP 101 6.538 2.993 5.495 775 H LEU 102 H LEU 102 7.435 3.162 -0.117 776 HA LEU 102 HA LEU 102 8.923 1.089 0.998 777 HB2 LEU 102 HB2 LEU 102 6.186 1.524 0.159 778 HB3 LEU 102 HB3 LEU 102 6.642 -0.181 0.167 779 HG LEU 102 HG LEU 102 6.835 1.732 2.504 780 HD11 LEU 102 HD11 LEU 102 4.888 0.559 3.364 781 HD12 LEU 102 HD12 LEU 102 4.786 -0.390 1.874 782 HD13 LEU 102 HD13 LEU 102 4.531 1.362 1.835 783 HD21 LEU 102 HD21 LEU 102 7.100 -1.253 2.300 784 HD22 LEU 102 HD22 LEU 102 7.101 -0.327 3.801 785 HD23 LEU 102 HD23 LEU 102 8.400 -0.108 2.624 786 H PHE 103 H PHE 103 7.833 1.501 -2.345 787 HA PHE 103 HA PHE 103 9.035 -1.061 -2.974 788 HB2 PHE 103 HB2 PHE 103 7.277 0.772 -4.572 789 HB3 PHE 103 HB3 PHE 103 8.098 -0.608 -5.291 790 HD1 PHE 103 HD1 PHE 103 5.564 0.396 -2.797 791 HD2 PHE 103 HD2 PHE 103 7.299 -2.801 -4.981 792 HE1 PHE 103 HE1 PHE 103 3.693 -1.053 -2.151 793 HE2 PHE 103 HE2 PHE 103 5.441 -4.259 -4.327 794 HZ PHE 103 HZ PHE 103 3.631 -3.386 -2.928 795 H THR 104 H THR 104 10.236 1.935 -2.706 796 HA THR 104 HA THR 104 11.861 1.811 -5.101 797 HB THR 104 HB THR 104 12.009 3.784 -2.792 798 HG1 THR 104 HG1 THR 104 10.008 3.905 -4.055 799 HG21 THR 104 HG21 THR 104 13.304 5.176 -4.347 800 HG22 THR 104 HG22 THR 104 13.203 3.904 -5.567 801 HG23 THR 104 HG23 THR 104 14.093 3.620 -4.073 802 HA PRO 105 HA PRO 105 14.879 -0.675 -2.799 803 HB2 PRO 105 HB2 PRO 105 16.584 -0.232 -5.155 804 HB3 PRO 105 HB3 PRO 105 15.993 -1.754 -4.486 805 HG2 PRO 105 HG2 PRO 105 15.073 -0.771 -6.807 806 HG3 PRO 105 HG3 PRO 105 14.030 -1.674 -5.693 807 HD2 PRO 105 HD2 PRO 105 14.223 1.279 -6.147 808 HD3 PRO 105 HD3 PRO 105 12.792 0.256 -5.887 809 H ASP 106 H ASP 106 16.316 0.110 -1.371 810 HA ASP 106 HA ASP 106 17.468 2.729 -1.978 811 HB2 ASP 106 HB2 ASP 106 16.113 2.468 0.138 812 HB3 ASP 106 HB3 ASP 106 17.357 1.377 0.725 813 HA PRO 107 HA PRO 107 21.318 0.640 -2.832 814 HB2 PRO 107 HB2 PRO 107 22.924 2.856 -2.582 815 HB3 PRO 107 HB3 PRO 107 22.017 2.437 -4.037 816 HG2 PRO 107 HG2 PRO 107 21.309 4.348 -1.847 817 HG3 PRO 107 HG3 PRO 107 21.124 4.544 -3.598 818 HD2 PRO 107 HD2 PRO 107 19.063 3.937 -2.052 819 HD3 PRO 107 HD3 PRO 107 19.225 3.201 -3.663 820 H SER 108 H SER 108 20.755 2.504 0.081 821 HA SER 108 HA SER 108 23.169 1.345 1.200 822 HB2 SER 108 HB2 SER 108 21.544 3.719 2.104 823 HB3 SER 108 HB3 SER 108 22.990 3.113 2.921 824 HG SER 108 HG SER 108 23.895 3.301 0.688 825 H LEU 109 H LEU 109 20.181 0.417 0.855 826 HA LEU 109 HA LEU 109 19.902 -0.553 3.585 827 HB2 LEU 109 HB2 LEU 109 17.920 0.489 2.596 828 HB3 LEU 109 HB3 LEU 109 17.968 -0.664 1.269 829 HG LEU 109 HG LEU 109 17.631 -2.480 2.967 830 HD11 LEU 109 HD11 LEU 109 16.732 -1.856 5.148 831 HD12 LEU 109 HD12 LEU 109 17.071 -0.162 4.794 832 HD13 LEU 109 HD13 LEU 109 18.396 -1.320 4.933 833 HD21 LEU 109 HD21 LEU 109 15.812 -1.672 1.607 834 HD22 LEU 109 HD22 LEU 109 15.496 -0.377 2.770 835 HD23 LEU 109 HD23 LEU 109 15.258 -2.067 3.239 836 H THR 110 H THR 110 20.544 -2.498 3.979 837 HA THR 110 HA THR 110 20.640 -4.485 1.841 838 HB THR 110 HB THR 110 22.786 -4.063 3.945 839 HG1 THR 110 HG1 THR 110 23.236 -2.534 2.528 840 HG21 THR 110 HG21 THR 110 22.557 -6.403 3.269 841 HG22 THR 110 HG22 THR 110 24.059 -5.732 2.638 842 HG23 THR 110 HG23 THR 110 22.671 -5.942 1.571 843 H ILE 111 H ILE 111 19.295 -6.004 2.424 844 HA ILE 111 HA ILE 111 18.935 -6.530 5.287 845 HB ILE 111 HB ILE 111 16.481 -6.940 4.723 846 HG12 ILE 111 HG12 ILE 111 17.219 -5.167 2.376 847 HG13 ILE 111 HG13 ILE 111 16.737 -6.847 2.240 848 HG21 ILE 111 HG21 ILE 111 17.226 -5.174 6.138 849 HG22 ILE 111 HG22 ILE 111 15.933 -4.571 5.099 850 HG23 ILE 111 HG23 ILE 111 17.616 -4.150 4.756 851 HD11 ILE 111 HD11 ILE 111 14.916 -5.380 1.646 852 HD12 ILE 111 HD12 ILE 111 15.045 -4.549 3.193 853 HD13 ILE 111 HD13 ILE 111 14.524 -6.235 3.139 854 H THR 112 H THR 112 18.433 -8.535 5.904 855 HA THR 112 HA THR 112 18.974 -10.649 3.991 856 HB THR 112 HB THR 112 20.158 -10.727 6.142 857 HG1 THR 112 HG1 THR 112 19.957 -12.744 5.612 858 HG21 THR 112 HG21 THR 112 18.522 -9.546 7.537 859 HG22 THR 112 HG22 THR 112 18.956 -11.095 8.271 860 HG23 THR 112 HG23 THR 112 17.422 -10.912 7.416 861 H ARG 113 H ARG 113 17.502 -12.463 3.849 862 HA ARG 113 HA ARG 113 14.741 -11.806 4.490 863 HB2 ARG 113 HB2 ARG 113 15.433 -10.802 2.234 864 HB3 ARG 113 HB3 ARG 113 15.635 -12.442 1.667 865 HG2 ARG 113 HG2 ARG 113 13.026 -11.461 2.762 866 HG3 ARG 113 HG3 ARG 113 13.472 -11.212 1.079 867 HD2 ARG 113 HD2 ARG 113 13.643 -13.628 0.772 868 HD3 ARG 113 HD3 ARG 113 13.253 -13.878 2.477 869 HE ARG 113 HE ARG 113 11.207 -12.381 1.513 870 HH11 ARG 113 HH11 ARG 113 12.590 -15.505 0.645 871 HH12 ARG 113 HH12 ARG 113 11.158 -16.164 0.049 872 HH21 ARG 113 HH21 ARG 113 9.181 -13.251 0.706 873 HH22 ARG 113 HH22 ARG 113 9.121 -14.818 0.087 874 H ASP 114 H ASP 114 13.559 -13.615 4.877 875 HA ASP 114 HA ASP 114 14.799 -15.975 5.592 876 HB2 ASP 114 HB2 ASP 114 12.628 -15.311 6.470 877 HB3 ASP 114 HB3 ASP 114 11.885 -15.568 4.893 878 H GLY 115 H GLY 115 15.363 -17.788 4.644 879 HA2 GLY 115 HA2 GLY 115 14.816 -19.470 2.908 880 HA3 GLY 115 HA3 GLY 115 14.729 -18.116 1.780 881 H SER 116 H SER 116 16.949 -16.814 3.299 882 HA SER 116 HA SER 116 19.238 -18.478 2.854 883 HB2 SER 116 HB2 SER 116 18.817 -15.885 1.313 884 HB3 SER 116 HB3 SER 116 20.279 -16.871 1.285 885 HG SER 116 HG SER 116 18.261 -18.456 0.727 886 H ARG 117 H ARG 117 21.045 -17.564 3.999 887 HA ARG 117 HA ARG 117 20.116 -15.623 5.934 888 HB2 ARG 117 HB2 ARG 117 22.206 -16.069 7.236 889 HB3 ARG 117 HB3 ARG 117 21.168 -17.456 7.032 890 HG2 ARG 117 HG2 ARG 117 23.448 -18.171 6.892 891 HG3 ARG 117 HG3 ARG 117 22.743 -18.292 5.286 892 HD2 ARG 117 HD2 ARG 117 23.996 -16.498 4.475 893 HD3 ARG 117 HD3 ARG 117 24.294 -15.850 6.087 894 HE ARG 117 HE ARG 117 25.667 -17.922 6.413 895 HH11 ARG 117 HH11 ARG 117 25.351 -16.508 3.137 896 HH12 ARG 117 HH12 ARG 117 26.917 -16.962 2.691 897 HH21 ARG 117 HH21 ARG 117 27.869 -18.525 5.686 898 HH22 ARG 117 HH22 ARG 117 28.314 -18.125 4.095 899 H ASP 118 H ASP 118 21.583 -15.536 3.109 900 HA ASP 118 HA ASP 118 23.450 -13.418 3.502 901 HB2 ASP 118 HB2 ASP 118 22.222 -14.614 1.021 902 HB3 ASP 118 HB3 ASP 118 23.383 -13.290 0.989 903 H ALA 119 H ALA 119 23.261 -11.316 2.758 904 HA ALA 119 HA ALA 119 20.528 -10.317 2.900 905 HB1 ALA 119 HB1 ALA 119 22.106 -9.516 4.609 906 HB2 ALA 119 HB2 ALA 119 21.488 -8.218 3.593 907 HB3 ALA 119 HB3 ALA 119 23.120 -8.841 3.330 908 H VAL 120 H VAL 120 19.763 -8.858 1.466 909 HA VAL 120 HA VAL 120 21.145 -8.725 -1.110 910 HB VAL 120 HB VAL 120 18.235 -8.130 -0.443 911 HG11 VAL 120 HG11 VAL 120 17.876 -8.154 -2.863 912 HG12 VAL 120 HG12 VAL 120 19.602 -8.395 -3.120 913 HG13 VAL 120 HG13 VAL 120 19.021 -6.897 -2.390 914 HG21 VAL 120 HG21 VAL 120 17.701 -10.233 -1.582 915 HG22 VAL 120 HG22 VAL 120 18.712 -10.501 -0.160 916 HG23 VAL 120 HG23 VAL 120 19.421 -10.561 -1.777 917 H SER 121 H SER 121 22.105 -6.855 -1.536 918 HA SER 121 HA SER 121 21.443 -4.522 0.039 919 HB2 SER 121 HB2 SER 121 23.839 -5.311 -0.458 920 HB3 SER 121 HB3 SER 121 23.555 -4.750 -2.107 921 HG SER 121 HG SER 121 23.455 -3.281 0.288 922 H ASN 122 H ASN 122 20.762 -2.619 -0.915 923 HA ASN 122 HA ASN 122 19.545 -1.293 -2.242 924 HB2 ASN 122 HB2 ASN 122 21.430 -1.582 -3.896 925 HB3 ASN 122 HB3 ASN 122 20.577 -2.949 -4.587 926 HD21 ASN 122 HD21 ASN 122 18.804 -2.566 -5.943 927 HD22 ASN 122 HD22 ASN 122 18.422 -0.992 -6.542 928 H ALA 123 H ALA 123 18.003 -2.572 -0.981 929 HA ALA 123 HA ALA 123 16.144 -3.921 -2.794 930 HB1 ALA 123 HB1 ALA 123 15.450 -5.334 -0.921 931 HB2 ALA 123 HB2 ALA 123 16.648 -4.553 0.113 932 HB3 ALA 123 HB3 ALA 123 17.171 -5.528 -1.260 933 H ARG 124 H ARG 124 13.930 -3.814 -1.999 934 HA ARG 124 HA ARG 124 13.308 -1.123 -1.163 935 HB2 ARG 124 HB2 ARG 124 10.990 -1.753 -1.745 936 HB3 ARG 124 HB3 ARG 124 12.113 -2.058 -3.064 937 HG2 ARG 124 HG2 ARG 124 12.167 -4.426 -2.457 938 HG3 ARG 124 HG3 ARG 124 11.022 -4.110 -1.157 939 HD2 ARG 124 HD2 ARG 124 9.372 -3.384 -2.785 940 HD3 ARG 124 HD3 ARG 124 10.523 -3.665 -4.091 941 HE ARG 124 HE ARG 124 10.179 -5.949 -2.464 942 HH11 ARG 124 HH11 ARG 124 8.825 -4.166 -5.247 943 HH12 ARG 124 HH12 ARG 124 7.923 -5.486 -5.824 944 HH21 ARG 124 HH21 ARG 124 8.891 -7.762 -3.309 945 HH22 ARG 124 HH22 ARG 124 7.966 -7.546 -4.736 946 HA PRO 125 HA PRO 125 12.633 -2.079 3.136 947 HB2 PRO 125 HB2 PRO 125 10.306 -0.238 2.956 948 HB3 PRO 125 HB3 PRO 125 11.680 -0.203 4.059 949 HG2 PRO 125 HG2 PRO 125 11.525 1.527 2.043 950 HG3 PRO 125 HG3 PRO 125 13.074 0.807 2.508 951 HD2 PRO 125 HD2 PRO 125 11.303 0.158 0.191 952 HD3 PRO 125 HD3 PRO 125 13.076 0.218 0.289 953 H VAL 126 H VAL 126 10.069 -2.542 0.822 954 HA VAL 126 HA VAL 126 8.078 -3.666 2.483 955 HB VAL 126 HB VAL 126 8.695 -4.428 -0.402 956 HG11 VAL 126 HG11 VAL 126 6.193 -4.861 1.225 957 HG12 VAL 126 HG12 VAL 126 7.331 -6.113 0.725 958 HG13 VAL 126 HG13 VAL 126 6.393 -5.233 -0.482 959 HG21 VAL 126 HG21 VAL 126 6.899 -2.918 -1.005 960 HG22 VAL 126 HG22 VAL 126 8.162 -2.053 -0.130 961 HG23 VAL 126 HG23 VAL 126 6.659 -2.499 0.687 962 H ASP 127 H ASP 127 10.864 -5.130 0.887 963 HA ASP 127 HA ASP 127 10.307 -7.800 1.529 964 HB2 ASP 127 HB2 ASP 127 12.849 -6.350 0.841 965 HB3 ASP 127 HB3 ASP 127 12.855 -8.061 1.240 966 H ALA 128 H ALA 128 11.763 -5.255 3.295 967 HA ALA 128 HA ALA 128 12.950 -6.817 5.366 968 HB1 ALA 128 HB1 ALA 128 13.704 -4.533 4.872 969 HB2 ALA 128 HB2 ALA 128 13.191 -4.664 6.550 970 HB3 ALA 128 HB3 ALA 128 12.135 -3.907 5.362 971 H LEU 129 H LEU 129 9.812 -5.336 4.824 972 HA LEU 129 HA LEU 129 8.771 -5.327 7.385 973 HB2 LEU 129 HB2 LEU 129 7.764 -4.092 5.706 974 HB3 LEU 129 HB3 LEU 129 7.750 -5.450 4.613 975 HG LEU 129 HG LEU 129 6.104 -6.510 6.033 976 HD11 LEU 129 HD11 LEU 129 6.450 -5.371 8.106 977 HD12 LEU 129 HD12 LEU 129 4.797 -5.043 7.584 978 HD13 LEU 129 HD13 LEU 129 6.048 -3.803 7.398 979 HD21 LEU 129 HD21 LEU 129 4.267 -5.153 5.114 980 HD22 LEU 129 HD22 LEU 129 5.629 -5.393 4.002 981 HD23 LEU 129 HD23 LEU 129 5.453 -3.850 4.831 982 H HIS 130 H HIS 130 8.669 -7.809 4.835 983 HA HIS 130 HA HIS 130 6.926 -9.532 6.242 984 HB2 HIS 130 HB2 HIS 130 8.785 -10.032 3.927 985 HB3 HIS 130 HB3 HIS 130 7.718 -11.265 4.568 986 HD1 HIS 130 HD1 HIS 130 5.446 -11.363 3.489 987 HD2 HIS 130 HD2 HIS 130 7.402 -7.768 2.792 988 HE1 HIS 130 HE1 HIS 130 4.028 -10.101 1.839 989 H ALA 131 H ALA 131 10.115 -8.824 6.534 990 HA ALA 131 HA ALA 131 10.886 -11.465 7.570 991 HB1 ALA 131 HB1 ALA 131 13.206 -10.749 7.316 992 HB2 ALA 131 HB2 ALA 131 12.665 -9.149 6.811 993 HB3 ALA 131 HB3 ALA 131 12.319 -10.552 5.808 994 H HIS 132 H HIS 132 9.416 -9.054 8.846 995 HA HIS 132 HA HIS 132 9.117 -8.176 10.908 996 HB2 HIS 132 HB2 HIS 132 9.265 -10.451 11.732 997 HB3 HIS 132 HB3 HIS 132 11.012 -10.440 11.644 998 HD1 HIS 132 HD1 HIS 132 12.060 -10.230 13.898 999 HD2 HIS 132 HD2 HIS 132 8.325 -8.432 13.736 1000 HE1 HIS 132 HE1 HIS 132 11.614 -9.344 16.222 1001 H GLN 133 H GLN 133 11.172 -7.239 9.090 1002 HA GLN 133 HA GLN 133 12.939 -5.816 10.943 1003 HB2 GLN 133 HB2 GLN 133 13.063 -6.108 7.933 1004 HB3 GLN 133 HB3 GLN 133 14.279 -5.297 8.929 1005 HG2 GLN 133 HG2 GLN 133 14.766 -7.408 10.032 1006 HG3 GLN 133 HG3 GLN 133 13.531 -8.206 9.070 1007 HE21 GLN 133 HE21 GLN 133 14.928 -9.604 8.181 1008 HE22 GLN 133 HE22 GLN 133 16.045 -9.173 6.942 1009 H ALA 134 H ALA 134 10.173 -5.583 10.413 1010 HA ALA 134 HA ALA 134 9.210 -3.479 8.933 1011 HB1 ALA 134 HB1 ALA 134 7.821 -5.126 10.087 1012 HB2 ALA 134 HB2 ALA 134 7.314 -3.477 10.456 1013 HB3 ALA 134 HB3 ALA 134 8.251 -4.397 11.633 1014 H ARG 135 H ARG 135 10.982 -3.406 11.884 1015 HA ARG 135 HA ARG 135 10.358 -0.907 12.907 1016 HB2 ARG 135 HB2 ARG 135 13.010 -2.302 12.900 1017 HB3 ARG 135 HB3 ARG 135 12.578 -0.947 13.933 1018 HG2 ARG 135 HG2 ARG 135 10.752 -2.331 14.886 1019 HG3 ARG 135 HG3 ARG 135 11.369 -3.694 13.942 1020 HD2 ARG 135 HD2 ARG 135 12.219 -3.723 16.202 1021 HD3 ARG 135 HD3 ARG 135 13.516 -3.454 15.017 1022 HE ARG 135 HE ARG 135 12.244 -1.241 16.427 1023 HH11 ARG 135 HH11 ARG 135 15.203 -3.019 15.578 1024 HH12 ARG 135 HH12 ARG 135 16.248 -1.897 16.308 1025 HH21 ARG 135 HH21 ARG 135 13.725 0.316 17.377 1026 HH22 ARG 135 HH22 ARG 135 15.408 -0.008 17.344 1027 H GLU 136 H GLU 136 12.697 -1.785 10.350 1028 HA GLU 136 HA GLU 136 13.594 0.877 9.995 1029 HB2 GLU 136 HB2 GLU 136 13.991 -1.662 8.544 1030 HB3 GLU 136 HB3 GLU 136 14.131 -0.203 7.574 1031 HG2 GLU 136 HG2 GLU 136 15.674 -0.812 10.084 1032 HG3 GLU 136 HG3 GLU 136 16.290 -0.911 8.431 1033 H VAL 137 H VAL 137 10.982 -0.968 8.708 1034 HA VAL 137 HA VAL 137 10.234 0.773 6.612 1035 HB VAL 137 HB VAL 137 8.445 -0.985 8.324 1036 HG11 VAL 137 HG11 VAL 137 7.978 0.197 5.590 1037 HG12 VAL 137 HG12 VAL 137 7.147 0.648 7.077 1038 HG13 VAL 137 HG13 VAL 137 6.913 -0.962 6.389 1039 HG21 VAL 137 HG21 VAL 137 10.264 -2.229 7.273 1040 HG22 VAL 137 HG22 VAL 137 9.791 -1.598 5.696 1041 HG23 VAL 137 HG23 VAL 137 8.699 -2.661 6.594 1042 H VAL 138 H VAL 138 9.339 0.582 10.016 1043 HA VAL 138 HA VAL 138 7.619 2.810 10.106 1044 HB VAL 138 HB VAL 138 9.422 1.783 12.329 1045 HG11 VAL 138 HG11 VAL 138 8.602 4.034 12.797 1046 HG12 VAL 138 HG12 VAL 138 7.829 2.852 13.856 1047 HG13 VAL 138 HG13 VAL 138 6.947 3.508 12.479 1048 HG21 VAL 138 HG21 VAL 138 7.952 0.053 11.506 1049 HG22 VAL 138 HG22 VAL 138 6.562 1.130 11.668 1050 HG23 VAL 138 HG23 VAL 138 7.434 0.598 13.105 1051 H ARG 139 H ARG 139 11.082 2.525 10.752 1052 HA ARG 139 HA ARG 139 11.568 5.202 11.316 1053 HB2 ARG 139 HB2 ARG 139 13.191 3.520 11.907 1054 HB3 ARG 139 HB3 ARG 139 13.371 3.027 10.238 1055 HG2 ARG 139 HG2 ARG 139 14.141 5.804 11.032 1056 HG3 ARG 139 HG3 ARG 139 15.215 4.456 11.413 1057 HD2 ARG 139 HD2 ARG 139 15.285 3.835 9.061 1058 HD3 ARG 139 HD3 ARG 139 14.151 5.121 8.671 1059 HE ARG 139 HE ARG 139 15.874 6.696 9.378 1060 HH11 ARG 139 HH11 ARG 139 16.933 3.375 8.535 1061 HH12 ARG 139 HH12 ARG 139 18.481 3.886 8.060 1062 HH21 ARG 139 HH21 ARG 139 18.003 7.338 8.661 1063 HH22 ARG 139 HH22 ARG 139 19.095 6.176 8.095 1064 H ARG 140 H ARG 140 11.575 3.546 8.204 1065 HA ARG 140 HA ARG 140 12.415 5.824 6.724 1066 HB2 ARG 140 HB2 ARG 140 10.859 3.405 5.761 1067 HB3 ARG 140 HB3 ARG 140 11.638 4.585 4.721 1068 HG2 ARG 140 HG2 ARG 140 13.029 2.719 6.647 1069 HG3 ARG 140 HG3 ARG 140 12.973 2.555 4.893 1070 HD2 ARG 140 HD2 ARG 140 14.222 4.588 4.623 1071 HD3 ARG 140 HD3 ARG 140 14.180 4.900 6.359 1072 HE ARG 140 HE ARG 140 15.451 2.636 6.414 1073 HH11 ARG 140 HH11 ARG 140 15.836 5.212 3.998 1074 HH12 ARG 140 HH12 ARG 140 17.491 4.903 3.744 1075 HH21 ARG 140 HH21 ARG 140 17.723 2.214 6.030 1076 HH22 ARG 140 HH22 ARG 140 18.568 3.179 4.895 1077 H ALA 141 H ALA 141 9.279 4.552 7.657 1078 HA ALA 141 HA ALA 141 7.696 6.339 6.198 1079 HB1 ALA 141 HB1 ALA 141 5.907 5.763 7.766 1080 HB2 ALA 141 HB2 ALA 141 7.087 5.037 8.856 1081 HB3 ALA 141 HB3 ALA 141 6.796 4.321 7.272 1082 H GLN 142 H GLN 142 9.050 6.491 9.444 1083 HA GLN 142 HA GLN 142 7.970 8.921 10.339 1084 HB2 GLN 142 HB2 GLN 142 10.693 7.744 10.957 1085 HB3 GLN 142 HB3 GLN 142 9.903 9.018 11.869 1086 HG2 GLN 142 HG2 GLN 142 8.228 7.528 12.654 1087 HG3 GLN 142 HG3 GLN 142 8.738 6.266 11.533 1088 HE21 GLN 142 HE21 GLN 142 8.511 6.089 14.409 1089 HE22 GLN 142 HE22 GLN 142 10.084 5.688 14.992 1090 H ALA 143 H ALA 143 11.021 8.255 8.674 1091 HA ALA 143 HA ALA 143 11.957 10.897 8.530 1092 HB1 ALA 143 HB1 ALA 143 12.568 8.589 6.690 1093 HB2 ALA 143 HB2 ALA 143 13.367 8.914 8.227 1094 HB3 ALA 143 HB3 ALA 143 13.538 10.051 6.887 1095 H MET 144 H MET 144 9.757 9.123 6.503 1096 HA MET 144 HA MET 144 9.863 11.136 4.441 1097 HB2 MET 144 HB2 MET 144 8.045 8.744 4.725 1098 HB3 MET 144 HB3 MET 144 8.062 9.824 3.340 1099 HG2 MET 144 HG2 MET 144 10.334 8.081 4.273 1100 HG3 MET 144 HG3 MET 144 9.305 7.790 2.875 1101 HE1 MET 144 HE1 MET 144 9.006 10.689 1.612 1102 HE2 MET 144 HE2 MET 144 9.371 9.261 0.647 1103 HE3 MET 144 HE3 MET 144 10.352 10.717 0.479 1104 H ALA 145 H ALA 145 7.744 10.251 7.074 1105 HA ALA 145 HA ALA 145 5.670 12.005 6.223 1106 HB1 ALA 145 HB1 ALA 145 5.981 10.659 8.891 1107 HB2 ALA 145 HB2 ALA 145 5.193 9.958 7.478 1108 HB3 ALA 145 HB3 ALA 145 4.514 11.395 8.246 1109 H TYR 146 H TYR 146 8.220 12.226 8.681 1110 HA TYR 146 HA TYR 146 7.214 14.885 9.335 1111 HB2 TYR 146 HB2 TYR 146 9.065 13.076 10.911 1112 HB3 TYR 146 HB3 TYR 146 8.518 14.671 11.420 1113 HD1 TYR 146 HD1 TYR 146 6.103 15.023 11.949 1114 HD2 TYR 146 HD2 TYR 146 7.693 11.153 11.199 1115 HE1 TYR 146 HE1 TYR 146 4.108 14.007 12.969 1116 HE2 TYR 146 HE2 TYR 146 5.700 10.130 12.213 1117 HH TYR 146 HH TYR 146 2.873 11.915 12.872 Start of MODEL 27 1 H MET 1 H MET 1 -30.880 40.160 12.796 2 HA MET 1 HA MET 1 -29.881 41.766 14.249 3 HB2 MET 1 HB2 MET 1 -28.733 41.136 16.266 4 HB3 MET 1 HB3 MET 1 -30.282 40.325 16.342 5 HG2 MET 1 HG2 MET 1 -27.670 39.053 15.542 6 HG3 MET 1 HG3 MET 1 -28.444 38.913 17.118 7 HE1 MET 1 HE1 MET 1 -27.431 36.491 15.334 8 HE2 MET 1 HE2 MET 1 -28.756 35.342 15.511 9 HE3 MET 1 HE3 MET 1 -28.187 36.255 16.908 10 HA PRO 2 HA PRO 2 -26.290 40.737 11.847 11 HB2 PRO 2 HB2 PRO 2 -24.376 42.352 12.876 12 HB3 PRO 2 HB3 PRO 2 -25.695 42.974 11.874 13 HG2 PRO 2 HG2 PRO 2 -25.335 43.077 14.827 14 HG3 PRO 2 HG3 PRO 2 -26.068 44.267 13.743 15 HD2 PRO 2 HD2 PRO 2 -27.461 42.492 15.331 16 HD3 PRO 2 HD3 PRO 2 -28.120 43.291 13.896 17 H GLY 3 H GLY 3 -25.841 38.616 12.413 18 HA2 GLY 3 HA2 GLY 3 -23.478 38.219 13.950 19 HA3 GLY 3 HA3 GLY 3 -24.906 37.681 14.819 20 H ARG 4 H ARG 4 -23.793 37.493 11.479 21 HA ARG 4 HA ARG 4 -24.728 34.799 11.247 22 HB2 ARG 4 HB2 ARG 4 -23.860 34.757 9.005 23 HB3 ARG 4 HB3 ARG 4 -24.585 36.332 9.260 24 HG2 ARG 4 HG2 ARG 4 -21.614 35.768 9.354 25 HG3 ARG 4 HG3 ARG 4 -22.472 36.388 7.948 26 HD2 ARG 4 HD2 ARG 4 -22.255 37.727 10.634 27 HD3 ARG 4 HD3 ARG 4 -21.333 38.168 9.204 28 HE ARG 4 HE ARG 4 -23.993 38.270 8.505 29 HH11 ARG 4 HH11 ARG 4 -21.904 39.930 10.821 30 HH12 ARG 4 HH12 ARG 4 -22.689 41.434 10.715 31 HH21 ARG 4 HH21 ARG 4 -25.128 40.331 8.366 32 HH22 ARG 4 HH22 ARG 4 -24.611 41.662 9.281 33 H ALA 5 H ALA 5 -23.486 32.897 11.201 34 HA ALA 5 HA ALA 5 -20.662 33.108 11.793 35 HB1 ALA 5 HB1 ALA 5 -20.848 31.716 13.805 36 HB2 ALA 5 HB2 ALA 5 -22.606 31.768 13.678 37 HB3 ALA 5 HB3 ALA 5 -21.698 33.249 13.998 38 HA PRO 6 HA PRO 6 -21.070 29.297 9.459 39 HB2 PRO 6 HB2 PRO 6 -18.387 28.779 9.253 40 HB3 PRO 6 HB3 PRO 6 -19.228 29.903 8.183 41 HG2 PRO 6 HG2 PRO 6 -17.458 30.459 10.498 42 HG3 PRO 6 HG3 PRO 6 -17.694 31.396 9.014 43 HD2 PRO 6 HD2 PRO 6 -18.796 31.987 11.490 44 HD3 PRO 6 HD3 PRO 6 -19.390 32.604 9.939 45 H GLY 7 H GLY 7 -21.833 27.784 10.832 46 HA2 GLY 7 HA2 GLY 7 -20.469 27.264 13.307 47 HA3 GLY 7 HA3 GLY 7 -22.026 26.629 12.810 48 H SER 8 H SER 8 -21.632 24.594 13.354 49 HA SER 8 HA SER 8 -19.279 23.171 13.015 50 HB2 SER 8 HB2 SER 8 -22.089 22.132 13.294 51 HB3 SER 8 HB3 SER 8 -20.594 21.272 13.691 52 HG SER 8 HG SER 8 -21.719 22.331 15.466 53 H THR 9 H THR 9 -18.377 22.414 11.288 54 HA THR 9 HA THR 9 -19.981 21.613 8.968 55 HB THR 9 HB THR 9 -17.111 22.603 9.023 56 HG1 THR 9 HG1 THR 9 -19.004 24.057 9.688 57 HG21 THR 9 HG21 THR 9 -17.781 21.291 7.027 58 HG22 THR 9 HG22 THR 9 -17.480 22.981 6.620 59 HG23 THR 9 HG23 THR 9 -19.135 22.398 6.773 60 H LEU 10 H LEU 10 -19.249 19.582 8.045 61 HA LEU 10 HA LEU 10 -18.105 17.839 10.034 62 HB2 LEU 10 HB2 LEU 10 -19.079 17.229 7.259 63 HB3 LEU 10 HB3 LEU 10 -18.595 16.045 8.452 64 HG LEU 10 HG LEU 10 -20.967 17.898 8.650 65 HD11 LEU 10 HD11 LEU 10 -21.270 16.130 7.040 66 HD12 LEU 10 HD12 LEU 10 -22.250 15.830 8.479 67 HD13 LEU 10 HD13 LEU 10 -20.752 14.935 8.228 68 HD21 LEU 10 HD21 LEU 10 -21.541 16.621 10.665 69 HD22 LEU 10 HD22 LEU 10 -20.010 17.473 10.859 70 HD23 LEU 10 HD23 LEU 10 -20.020 15.739 10.536 71 H ALA 11 H ALA 11 -16.363 16.488 9.793 72 HA ALA 11 HA ALA 11 -14.438 17.101 7.671 73 HB1 ALA 11 HB1 ALA 11 -13.835 16.739 10.611 74 HB2 ALA 11 HB2 ALA 11 -13.658 18.240 9.690 75 HB3 ALA 11 HB3 ALA 11 -12.630 16.850 9.334 76 H ARG 12 H ARG 12 -13.157 15.280 7.063 77 HA ARG 12 HA ARG 12 -13.676 12.777 8.334 78 HB2 ARG 12 HB2 ARG 12 -14.606 11.624 6.378 79 HB3 ARG 12 HB3 ARG 12 -15.672 12.902 6.921 80 HG2 ARG 12 HG2 ARG 12 -13.778 13.205 4.594 81 HG3 ARG 12 HG3 ARG 12 -15.435 12.634 4.424 82 HD2 ARG 12 HD2 ARG 12 -16.257 14.740 5.336 83 HD3 ARG 12 HD3 ARG 12 -14.605 15.295 5.580 84 HE ARG 12 HE ARG 12 -14.461 14.969 3.047 85 HH11 ARG 12 HH11 ARG 12 -17.349 16.095 4.756 86 HH12 ARG 12 HH12 ARG 12 -17.932 17.039 3.480 87 HH21 ARG 12 HH21 ARG 12 -15.250 16.278 1.279 88 HH22 ARG 12 HH22 ARG 12 -16.716 17.112 1.428 89 H VAL 13 H VAL 13 -12.026 11.470 8.112 90 HA VAL 13 HA VAL 13 -10.480 11.405 5.757 91 HB VAL 13 HB VAL 13 -9.395 13.278 6.882 92 HG11 VAL 13 HG11 VAL 13 -9.846 12.891 9.181 93 HG12 VAL 13 HG12 VAL 13 -8.096 12.977 8.965 94 HG13 VAL 13 HG13 VAL 13 -8.883 11.414 9.176 95 HG21 VAL 13 HG21 VAL 13 -7.697 10.802 6.834 96 HG22 VAL 13 HG22 VAL 13 -7.088 12.455 6.903 97 HG23 VAL 13 HG23 VAL 13 -8.009 11.918 5.498 98 H GLY 14 H GLY 14 -10.790 9.384 5.433 99 HA2 GLY 14 HA2 GLY 14 -9.729 7.470 7.358 100 HA3 GLY 14 HA3 GLY 14 -11.424 7.308 6.919 101 H SER 15 H SER 15 -11.960 6.849 4.696 102 HA SER 15 HA SER 15 -10.169 4.899 3.702 103 HB2 SER 15 HB2 SER 15 -11.961 4.744 1.858 104 HB3 SER 15 HB3 SER 15 -12.420 4.312 3.502 105 HG SER 15 HG SER 15 -12.839 6.901 2.375 106 H ILE 16 H ILE 16 -8.508 5.205 2.469 107 HA ILE 16 HA ILE 16 -8.176 7.650 0.969 108 HB ILE 16 HB ILE 16 -6.311 5.244 1.003 109 HG12 ILE 16 HG12 ILE 16 -4.870 6.795 2.539 110 HG13 ILE 16 HG13 ILE 16 -6.394 7.591 2.896 111 HG21 ILE 16 HG21 ILE 16 -4.583 6.829 0.279 112 HG22 ILE 16 HG22 ILE 16 -5.803 8.100 0.221 113 HG23 ILE 16 HG23 ILE 16 -5.925 6.713 -0.858 114 HD11 ILE 16 HD11 ILE 16 -7.286 5.501 3.779 115 HD12 ILE 16 HD12 ILE 16 -5.793 5.948 4.597 116 HD13 ILE 16 HD13 ILE 16 -5.779 4.676 3.377 117 HA PRO 17 HA PRO 17 -9.802 5.509 -2.701 118 HB2 PRO 17 HB2 PRO 17 -8.954 7.979 -4.075 119 HB3 PRO 17 HB3 PRO 17 -10.562 7.258 -3.984 120 HG2 PRO 17 HG2 PRO 17 -9.996 9.510 -2.672 121 HG3 PRO 17 HG3 PRO 17 -11.058 8.280 -1.967 122 HD2 PRO 17 HD2 PRO 17 -8.160 8.818 -1.394 123 HD3 PRO 17 HD3 PRO 17 -9.499 8.487 -0.270 124 H ALA 18 H ALA 18 -8.790 4.817 -4.714 125 HA ALA 18 HA ALA 18 -5.940 4.508 -4.362 126 HB1 ALA 18 HB1 ALA 18 -7.328 2.559 -4.789 127 HB2 ALA 18 HB2 ALA 18 -6.178 2.808 -6.104 128 HB3 ALA 18 HB3 ALA 18 -7.870 3.260 -6.312 129 H GLY 19 H GLY 19 -4.421 5.352 -5.679 130 HA2 GLY 19 HA2 GLY 19 -5.394 7.186 -7.779 131 HA3 GLY 19 HA3 GLY 19 -3.987 7.491 -6.775 132 H ASP 20 H ASP 20 -2.015 6.523 -7.303 133 HA ASP 20 HA ASP 20 -1.968 5.521 -10.062 134 HB2 ASP 20 HB2 ASP 20 -0.783 7.621 -9.812 135 HB3 ASP 20 HB3 ASP 20 0.181 6.963 -8.500 136 H ASP 21 H ASP 21 -1.191 3.619 -10.535 137 HA ASP 21 HA ASP 21 -0.447 1.839 -8.459 138 HB2 ASP 21 HB2 ASP 21 -0.222 0.183 -10.334 139 HB3 ASP 21 HB3 ASP 21 -1.790 0.972 -10.256 140 H VAL 22 H VAL 22 1.347 2.474 -7.564 141 HA VAL 22 HA VAL 22 3.686 3.387 -8.792 142 HB VAL 22 HB VAL 22 3.487 1.907 -6.150 143 HG11 VAL 22 HG11 VAL 22 5.543 3.086 -5.543 144 HG12 VAL 22 HG12 VAL 22 5.617 3.800 -7.155 145 HG13 VAL 22 HG13 VAL 22 5.794 2.059 -6.955 146 HG21 VAL 22 HG21 VAL 22 3.378 4.160 -5.150 147 HG22 VAL 22 HG22 VAL 22 1.997 3.821 -6.194 148 HG23 VAL 22 HG23 VAL 22 3.306 4.852 -6.768 149 H LEU 23 H LEU 23 2.803 0.106 -7.808 150 HA LEU 23 HA LEU 23 5.250 -0.924 -8.755 151 HB2 LEU 23 HB2 LEU 23 4.130 -3.208 -8.559 152 HB3 LEU 23 HB3 LEU 23 4.437 -2.302 -7.105 153 HG LEU 23 HG LEU 23 2.081 -1.829 -6.831 154 HD11 LEU 23 HD11 LEU 23 1.636 -3.331 -9.427 155 HD12 LEU 23 HD12 LEU 23 1.419 -1.595 -9.210 156 HD13 LEU 23 HD13 LEU 23 0.372 -2.727 -8.354 157 HD21 LEU 23 HD21 LEU 23 2.910 -3.918 -5.998 158 HD22 LEU 23 HD22 LEU 23 2.579 -4.699 -7.542 159 HD23 LEU 23 HD23 LEU 23 1.248 -4.101 -6.557 160 H ASP 24 H ASP 24 5.648 -2.313 -10.430 161 HA ASP 24 HA ASP 24 4.544 -1.441 -12.897 162 HB2 ASP 24 HB2 ASP 24 6.468 -3.681 -12.213 163 HB3 ASP 24 HB3 ASP 24 6.010 -3.251 -13.851 164 HA PRO 25 HA PRO 25 1.200 -4.290 -13.398 165 HB2 PRO 25 HB2 PRO 25 1.646 -5.038 -16.058 166 HB3 PRO 25 HB3 PRO 25 0.700 -3.653 -15.520 167 HG2 PRO 25 HG2 PRO 25 3.520 -3.774 -16.456 168 HG3 PRO 25 HG3 PRO 25 2.299 -2.520 -16.719 169 HD2 PRO 25 HD2 PRO 25 4.287 -2.194 -14.963 170 HD3 PRO 25 HD3 PRO 25 2.658 -1.569 -14.640 171 H ASP 26 H ASP 26 4.450 -5.280 -14.270 172 HA ASP 26 HA ASP 26 3.875 -8.060 -14.474 173 HB2 ASP 26 HB2 ASP 26 5.941 -7.158 -15.440 174 HB3 ASP 26 HB3 ASP 26 6.518 -6.731 -13.829 175 H GLU 27 H GLU 27 4.422 -5.945 -11.785 176 HA GLU 27 HA GLU 27 5.010 -7.972 -9.853 177 HB2 GLU 27 HB2 GLU 27 3.861 -5.198 -9.417 178 HB3 GLU 27 HB3 GLU 27 4.667 -6.193 -8.215 179 HG2 GLU 27 HG2 GLU 27 5.982 -5.026 -10.664 180 HG3 GLU 27 HG3 GLU 27 6.050 -4.317 -9.054 181 HA PRO 28 HA PRO 28 0.811 -9.402 -10.113 182 HB2 PRO 28 HB2 PRO 28 0.868 -11.206 -8.081 183 HB3 PRO 28 HB3 PRO 28 1.590 -11.491 -9.664 184 HG2 PRO 28 HG2 PRO 28 2.927 -10.609 -7.134 185 HG3 PRO 28 HG3 PRO 28 3.462 -11.815 -8.320 186 HD2 PRO 28 HD2 PRO 28 4.453 -9.314 -8.268 187 HD3 PRO 28 HD3 PRO 28 4.244 -10.217 -9.783 188 H THR 29 H THR 29 -1.163 -9.130 -9.149 189 HA THR 29 HA THR 29 -1.170 -7.707 -6.599 190 HB THR 29 HB THR 29 -3.098 -6.375 -7.606 191 HG1 THR 29 HG1 THR 29 -1.866 -6.907 -10.090 192 HG21 THR 29 HG21 THR 29 -0.928 -5.352 -7.128 193 HG22 THR 29 HG22 THR 29 -1.568 -4.725 -8.648 194 HG23 THR 29 HG23 THR 29 -0.293 -5.943 -8.664 195 H TYR 30 H TYR 30 -3.410 -7.506 -5.774 196 HA TYR 30 HA TYR 30 -5.120 -9.849 -6.196 197 HB2 TYR 30 HB2 TYR 30 -4.329 -8.307 -3.748 198 HB3 TYR 30 HB3 TYR 30 -5.935 -8.998 -3.842 199 HD1 TYR 30 HD1 TYR 30 -5.729 -11.567 -4.830 200 HD2 TYR 30 HD2 TYR 30 -2.887 -9.527 -2.436 201 HE1 TYR 30 HE1 TYR 30 -4.938 -13.709 -3.995 202 HE2 TYR 30 HE2 TYR 30 -2.065 -11.675 -1.568 203 HH TYR 30 HH TYR 30 -2.765 -13.952 -1.305 204 H ASP 31 H ASP 31 -7.373 -9.341 -5.879 205 HA ASP 31 HA ASP 31 -8.158 -6.533 -6.338 206 HB2 ASP 31 HB2 ASP 31 -9.249 -9.014 -7.747 207 HB3 ASP 31 HB3 ASP 31 -10.052 -7.462 -7.719 208 H LEU 32 H LEU 32 -10.492 -6.349 -5.796 209 HA LEU 32 HA LEU 32 -10.906 -6.903 -3.197 210 HB2 LEU 32 HB2 LEU 32 -12.980 -6.356 -5.278 211 HB3 LEU 32 HB3 LEU 32 -13.377 -6.515 -3.584 212 HG LEU 32 HG LEU 32 -13.264 -4.251 -3.964 213 HD11 LEU 32 HD11 LEU 32 -10.616 -4.943 -2.757 214 HD12 LEU 32 HD12 LEU 32 -12.165 -4.847 -1.932 215 HD13 LEU 32 HD13 LEU 32 -11.445 -3.393 -2.627 216 HD21 LEU 32 HD21 LEU 32 -10.614 -4.564 -5.374 217 HD22 LEU 32 HD22 LEU 32 -11.442 -3.043 -5.060 218 HD23 LEU 32 HD23 LEU 32 -12.165 -4.227 -6.150 219 HA PRO 33 HA PRO 33 -13.808 -10.761 -3.953 220 HB2 PRO 33 HB2 PRO 33 -13.093 -12.268 -6.159 221 HB3 PRO 33 HB3 PRO 33 -14.456 -11.144 -6.115 222 HG2 PRO 33 HG2 PRO 33 -11.679 -10.712 -7.142 223 HG3 PRO 33 HG3 PRO 33 -13.227 -10.241 -7.870 224 HD2 PRO 33 HD2 PRO 33 -11.744 -8.445 -6.588 225 HD3 PRO 33 HD3 PRO 33 -13.510 -8.450 -6.391 226 H ARG 34 H ARG 34 -10.457 -10.951 -5.225 227 HA ARG 34 HA ARG 34 -10.021 -13.492 -4.032 228 HB2 ARG 34 HB2 ARG 34 -8.726 -12.154 -5.997 229 HB3 ARG 34 HB3 ARG 34 -7.668 -11.826 -4.629 230 HG2 ARG 34 HG2 ARG 34 -6.845 -13.799 -5.712 231 HG3 ARG 34 HG3 ARG 34 -7.605 -14.305 -4.195 232 HD2 ARG 34 HD2 ARG 34 -9.695 -14.782 -5.482 233 HD3 ARG 34 HD3 ARG 34 -8.811 -14.421 -6.954 234 HE ARG 34 HE ARG 34 -8.354 -16.663 -5.132 235 HH11 ARG 34 HH11 ARG 34 -7.862 -15.192 -8.347 236 HH12 ARG 34 HH12 ARG 34 -7.455 -16.635 -9.121 237 HH21 ARG 34 HH21 ARG 34 -7.830 -18.699 -6.266 238 HH22 ARG 34 HH22 ARG 34 -7.457 -18.675 -7.932 239 H VAL 35 H VAL 35 -9.453 -10.185 -3.039 240 HA VAL 35 HA VAL 35 -7.938 -10.876 -0.734 241 HB VAL 35 HB VAL 35 -9.604 -8.377 -1.228 242 HG11 VAL 35 HG11 VAL 35 -7.424 -8.864 0.803 243 HG12 VAL 35 HG12 VAL 35 -9.140 -8.646 1.143 244 HG13 VAL 35 HG13 VAL 35 -8.195 -7.310 0.482 245 HG21 VAL 35 HG21 VAL 35 -7.862 -8.734 -2.898 246 HG22 VAL 35 HG22 VAL 35 -6.652 -8.834 -1.623 247 HG23 VAL 35 HG23 VAL 35 -7.525 -7.319 -1.908 248 H ALA 36 H ALA 36 -11.319 -10.285 -1.345 249 HA ALA 36 HA ALA 36 -12.340 -10.582 1.228 250 HB1 ALA 36 HB1 ALA 36 -14.449 -11.071 0.108 251 HB2 ALA 36 HB2 ALA 36 -13.597 -11.353 -1.410 252 HB3 ALA 36 HB3 ALA 36 -13.620 -9.738 -0.698 253 H GLU 37 H GLU 37 -11.450 -12.861 -1.216 254 HA GLU 37 HA GLU 37 -12.435 -15.279 -0.176 255 HB2 GLU 37 HB2 GLU 37 -11.526 -14.764 -2.477 256 HB3 GLU 37 HB3 GLU 37 -9.950 -14.790 -1.767 257 HG2 GLU 37 HG2 GLU 37 -10.143 -17.100 -1.153 258 HG3 GLU 37 HG3 GLU 37 -11.792 -17.158 -1.775 259 H LEU 38 H LEU 38 -9.313 -13.646 0.135 260 HA LEU 38 HA LEU 38 -7.913 -15.569 1.610 261 HB2 LEU 38 HB2 LEU 38 -7.625 -12.575 1.677 262 HB3 LEU 38 HB3 LEU 38 -6.467 -13.706 2.335 263 HG LEU 38 HG LEU 38 -7.178 -13.441 -0.583 264 HD11 LEU 38 HD11 LEU 38 -4.960 -12.450 -0.787 265 HD12 LEU 38 HD12 LEU 38 -4.743 -12.565 0.959 266 HD13 LEU 38 HD13 LEU 38 -5.981 -11.500 0.293 267 HD21 LEU 38 HD21 LEU 38 -6.487 -15.706 -0.036 268 HD22 LEU 38 HD22 LEU 38 -5.081 -15.082 0.837 269 HD23 LEU 38 HD23 LEU 38 -5.202 -14.862 -0.903 270 H LEU 39 H LEU 39 -9.809 -12.812 2.629 271 HA LEU 39 HA LEU 39 -9.331 -13.344 5.436 272 HB2 LEU 39 HB2 LEU 39 -11.028 -11.299 4.053 273 HB3 LEU 39 HB3 LEU 39 -10.712 -11.321 5.782 274 HG LEU 39 HG LEU 39 -8.723 -10.822 3.561 275 HD11 LEU 39 HD11 LEU 39 -9.826 -9.005 5.690 276 HD12 LEU 39 HD12 LEU 39 -10.199 -8.951 3.969 277 HD13 LEU 39 HD13 LEU 39 -8.565 -8.588 4.529 278 HD21 LEU 39 HD21 LEU 39 -8.288 -10.916 6.550 279 HD22 LEU 39 HD22 LEU 39 -7.107 -10.347 5.368 280 HD23 LEU 39 HD23 LEU 39 -7.621 -12.031 5.356 281 H GLY 40 H GLY 40 -11.626 -14.194 3.094 282 HA2 GLY 40 HA2 GLY 40 -13.459 -15.519 3.184 283 HA3 GLY 40 HA3 GLY 40 -13.111 -15.837 4.879 284 H VAL 41 H VAL 41 -13.548 -12.684 3.493 285 HA VAL 41 HA VAL 41 -16.121 -12.417 4.903 286 HB VAL 41 HB VAL 41 -15.536 -10.172 5.690 287 HG11 VAL 41 HG11 VAL 41 -13.448 -12.175 6.495 288 HG12 VAL 41 HG12 VAL 41 -15.049 -11.972 7.206 289 HG13 VAL 41 HG13 VAL 41 -13.840 -10.698 7.374 290 HG21 VAL 41 HG21 VAL 41 -14.014 -9.482 3.924 291 HG22 VAL 41 HG22 VAL 41 -12.823 -10.660 4.473 292 HG23 VAL 41 HG23 VAL 41 -13.238 -9.284 5.498 293 HA PRO 42 HA PRO 42 -17.477 -10.395 1.126 294 HB2 PRO 42 HB2 PRO 42 -19.030 -8.368 2.122 295 HB3 PRO 42 HB3 PRO 42 -19.573 -10.047 1.992 296 HG2 PRO 42 HG2 PRO 42 -18.470 -8.599 4.373 297 HG3 PRO 42 HG3 PRO 42 -19.861 -9.697 4.282 298 HD2 PRO 42 HD2 PRO 42 -17.514 -10.567 5.213 299 HD3 PRO 42 HD3 PRO 42 -18.520 -11.588 4.172 300 H VAL 43 H VAL 43 -17.308 -8.422 -0.055 301 HA VAL 43 HA VAL 43 -14.853 -7.117 0.225 302 HB VAL 43 HB VAL 43 -17.235 -6.318 -1.463 303 HG11 VAL 43 HG11 VAL 43 -14.327 -5.520 -1.716 304 HG12 VAL 43 HG12 VAL 43 -15.661 -4.459 -1.261 305 HG13 VAL 43 HG13 VAL 43 -15.591 -5.144 -2.886 306 HG21 VAL 43 HG21 VAL 43 -14.817 -7.974 -2.156 307 HG22 VAL 43 HG22 VAL 43 -16.102 -7.502 -3.270 308 HG23 VAL 43 HG23 VAL 43 -16.457 -8.576 -1.911 309 H SER 44 H SER 44 -18.025 -6.190 1.312 310 HA SER 44 HA SER 44 -17.547 -3.516 1.845 311 HB2 SER 44 HB2 SER 44 -19.472 -3.857 3.445 312 HB3 SER 44 HB3 SER 44 -19.704 -4.405 1.768 313 HG SER 44 HG SER 44 -20.159 -6.246 2.544 314 H LYS 45 H LYS 45 -16.948 -6.403 3.794 315 HA LYS 45 HA LYS 45 -15.973 -4.949 6.028 316 HB2 LYS 45 HB2 LYS 45 -15.758 -7.866 5.307 317 HB3 LYS 45 HB3 LYS 45 -15.030 -7.199 6.767 318 HG2 LYS 45 HG2 LYS 45 -17.218 -6.408 7.506 319 HG3 LYS 45 HG3 LYS 45 -17.947 -7.056 6.041 320 HD2 LYS 45 HD2 LYS 45 -18.325 -8.517 7.968 321 HD3 LYS 45 HD3 LYS 45 -17.357 -9.314 6.733 322 HE2 LYS 45 HE2 LYS 45 -15.350 -8.966 8.008 323 HE3 LYS 45 HE3 LYS 45 -16.215 -7.977 9.183 324 HZ1 LYS 45 HZ1 LYS 45 -15.782 -10.315 9.864 325 HZ2 LYS 45 HZ2 LYS 45 -16.857 -10.851 8.692 326 HZ3 LYS 45 HZ3 LYS 45 -17.374 -9.863 9.972 327 H VAL 46 H VAL 46 -14.498 -6.241 3.181 328 HA VAL 46 HA VAL 46 -11.777 -5.744 3.879 329 HB VAL 46 HB VAL 46 -13.076 -5.644 1.128 330 HG11 VAL 46 HG11 VAL 46 -10.834 -6.080 0.247 331 HG12 VAL 46 HG12 VAL 46 -10.181 -5.997 1.891 332 HG13 VAL 46 HG13 VAL 46 -10.901 -4.567 1.156 333 HG21 VAL 46 HG21 VAL 46 -11.724 -7.946 2.537 334 HG22 VAL 46 HG22 VAL 46 -12.295 -7.960 0.869 335 HG23 VAL 46 HG23 VAL 46 -13.446 -7.799 2.198 336 H ALA 47 H ALA 47 -14.270 -3.781 2.394 337 HA ALA 47 HA ALA 47 -12.793 -1.433 2.015 338 HB1 ALA 47 HB1 ALA 47 -15.015 -1.784 1.022 339 HB2 ALA 47 HB2 ALA 47 -14.948 -0.276 1.943 340 HB3 ALA 47 HB3 ALA 47 -15.735 -1.694 2.631 341 H GLN 48 H GLN 48 -14.458 -2.705 4.805 342 HA GLN 48 HA GLN 48 -14.292 -0.440 6.487 343 HB2 GLN 48 HB2 GLN 48 -14.205 -3.345 7.273 344 HB3 GLN 48 HB3 GLN 48 -14.460 -2.012 8.387 345 HG2 GLN 48 HG2 GLN 48 -16.523 -1.455 7.182 346 HG3 GLN 48 HG3 GLN 48 -16.271 -2.854 6.145 347 HE21 GLN 48 HE21 GLN 48 -15.173 -4.458 8.394 348 HE22 GLN 48 HE22 GLN 48 -16.539 -4.891 9.345 349 H GLN 49 H GLN 49 -12.039 -3.066 5.872 350 HA GLN 49 HA GLN 49 -10.063 -2.438 7.769 351 HB2 GLN 49 HB2 GLN 49 -9.614 -3.493 4.962 352 HB3 GLN 49 HB3 GLN 49 -8.489 -3.606 6.299 353 HG2 GLN 49 HG2 GLN 49 -11.189 -4.935 6.211 354 HG3 GLN 49 HG3 GLN 49 -9.672 -5.707 5.777 355 HE21 GLN 49 HE21 GLN 49 -9.924 -7.260 7.370 356 HE22 GLN 49 HE22 GLN 49 -9.723 -6.932 9.036 357 H LEU 50 H LEU 50 -10.537 -1.386 4.467 358 HA LEU 50 HA LEU 50 -8.339 0.346 4.199 359 HB2 LEU 50 HB2 LEU 50 -9.644 -0.494 2.322 360 HB3 LEU 50 HB3 LEU 50 -11.052 0.371 2.878 361 HG LEU 50 HG LEU 50 -9.854 2.521 2.440 362 HD11 LEU 50 HD11 LEU 50 -7.565 1.736 2.572 363 HD12 LEU 50 HD12 LEU 50 -7.870 2.487 1.006 364 HD13 LEU 50 HD13 LEU 50 -7.810 0.730 1.149 365 HD21 LEU 50 HD21 LEU 50 -11.438 1.632 0.829 366 HD22 LEU 50 HD22 LEU 50 -10.164 0.660 0.089 367 HD23 LEU 50 HD23 LEU 50 -10.092 2.418 0.001 368 H ARG 51 H ARG 51 -11.625 0.888 5.344 369 HA ARG 51 HA ARG 51 -11.486 3.719 5.641 370 HB2 ARG 51 HB2 ARG 51 -13.241 1.722 7.055 371 HB3 ARG 51 HB3 ARG 51 -13.444 3.464 7.110 372 HG2 ARG 51 HG2 ARG 51 -13.941 3.490 4.745 373 HG3 ARG 51 HG3 ARG 51 -13.650 1.745 4.655 374 HD2 ARG 51 HD2 ARG 51 -15.441 1.408 6.326 375 HD3 ARG 51 HD3 ARG 51 -15.775 3.134 6.277 376 HE ARG 51 HE ARG 51 -16.045 2.567 3.746 377 HH11 ARG 51 HH11 ARG 51 -17.258 0.771 6.571 378 HH12 ARG 51 HH12 ARG 51 -18.575 0.110 5.749 379 HH21 ARG 51 HH21 ARG 51 -17.880 1.621 2.626 380 HH22 ARG 51 HH22 ARG 51 -18.941 0.583 3.467 381 H GLU 52 H GLU 52 -10.438 1.075 7.660 382 HA GLU 52 HA GLU 52 -10.208 2.826 9.983 383 HB2 GLU 52 HB2 GLU 52 -9.695 -0.136 9.710 384 HB3 GLU 52 HB3 GLU 52 -9.573 0.774 11.202 385 HG2 GLU 52 HG2 GLU 52 -11.970 1.295 11.063 386 HG3 GLU 52 HG3 GLU 52 -12.076 0.347 9.581 387 H GLY 53 H GLY 53 -8.358 1.972 7.375 388 HA2 GLY 53 HA2 GLY 53 -6.153 2.566 6.931 389 HA3 GLY 53 HA3 GLY 53 -5.953 2.972 8.632 390 H HIS 54 H HIS 54 -7.262 -0.090 7.733 391 HA HIS 54 HA HIS 54 -4.873 -1.404 8.800 392 HB2 HIS 54 HB2 HIS 54 -7.651 -2.491 8.252 393 HB3 HIS 54 HB3 HIS 54 -6.308 -3.475 8.802 394 HD1 HIS 54 HD1 HIS 54 -9.238 -2.255 10.198 395 HD2 HIS 54 HD2 HIS 54 -5.254 -1.931 11.343 396 HE1 HIS 54 HE1 HIS 54 -9.252 -1.793 12.661 397 H LEU 55 H LEU 55 -6.022 -0.462 5.861 398 HA LEU 55 HA LEU 55 -4.344 -2.253 4.397 399 HB2 LEU 55 HB2 LEU 55 -6.407 -3.594 4.839 400 HB3 LEU 55 HB3 LEU 55 -7.343 -2.355 4.043 401 HG LEU 55 HG LEU 55 -6.221 -2.891 1.917 402 HD11 LEU 55 HD11 LEU 55 -4.848 -4.925 1.765 403 HD12 LEU 55 HD12 LEU 55 -4.902 -5.086 3.520 404 HD13 LEU 55 HD13 LEU 55 -4.090 -3.703 2.783 405 HD21 LEU 55 HD21 LEU 55 -7.461 -5.232 3.359 406 HD22 LEU 55 HD22 LEU 55 -7.303 -5.075 1.608 407 HD23 LEU 55 HD23 LEU 55 -8.325 -3.954 2.505 408 H VAL 56 H VAL 56 -4.115 -1.421 2.147 409 HA VAL 56 HA VAL 56 -5.714 0.850 1.425 410 HB VAL 56 HB VAL 56 -3.653 1.701 2.632 411 HG11 VAL 56 HG11 VAL 56 -2.182 0.569 0.278 412 HG12 VAL 56 HG12 VAL 56 -2.047 0.085 1.969 413 HG13 VAL 56 HG13 VAL 56 -1.495 1.682 1.465 414 HG21 VAL 56 HG21 VAL 56 -3.914 2.517 -0.260 415 HG22 VAL 56 HG22 VAL 56 -3.103 3.453 0.995 416 HG23 VAL 56 HG23 VAL 56 -4.839 3.159 1.099 417 H ALA 57 H ALA 57 -5.252 1.347 -0.957 418 HA ALA 57 HA ALA 57 -4.321 -0.976 -2.430 419 HB1 ALA 57 HB1 ALA 57 -7.117 0.131 -2.677 420 HB2 ALA 57 HB2 ALA 57 -6.692 -1.407 -1.934 421 HB3 ALA 57 HB3 ALA 57 -6.414 -1.155 -3.659 422 H VAL 58 H VAL 58 -4.278 -0.494 -4.767 423 HA VAL 58 HA VAL 58 -4.199 2.365 -5.348 424 HB VAL 58 HB VAL 58 -2.315 1.894 -6.995 425 HG11 VAL 58 HG11 VAL 58 -1.939 3.112 -4.947 426 HG12 VAL 58 HG12 VAL 58 -0.557 2.071 -5.304 427 HG13 VAL 58 HG13 VAL 58 -1.724 1.602 -4.064 428 HG21 VAL 58 HG21 VAL 58 -0.858 -0.038 -6.518 429 HG22 VAL 58 HG22 VAL 58 -2.464 -0.541 -7.043 430 HG23 VAL 58 HG23 VAL 58 -2.030 -0.620 -5.337 431 H ARG 59 H ARG 59 -4.189 2.720 -7.744 432 HA ARG 59 HA ARG 59 -6.302 0.988 -8.829 433 HB2 ARG 59 HB2 ARG 59 -6.981 3.257 -8.261 434 HB3 ARG 59 HB3 ARG 59 -5.702 3.900 -9.270 435 HG2 ARG 59 HG2 ARG 59 -6.833 2.739 -11.204 436 HG3 ARG 59 HG3 ARG 59 -8.194 2.460 -10.111 437 HD2 ARG 59 HD2 ARG 59 -8.503 4.492 -11.432 438 HD3 ARG 59 HD3 ARG 59 -8.372 4.862 -9.705 439 HE ARG 59 HE ARG 59 -5.823 5.075 -10.601 440 HH11 ARG 59 HH11 ARG 59 -8.832 6.626 -11.599 441 HH12 ARG 59 HH12 ARG 59 -8.049 8.030 -12.177 442 HH21 ARG 59 HH21 ARG 59 -4.787 6.950 -11.387 443 HH22 ARG 59 HH22 ARG 59 -5.714 8.209 -12.072 444 H ARG 60 H ARG 60 -5.921 0.027 -10.712 445 HA ARG 60 HA ARG 60 -3.979 1.192 -12.504 446 HB2 ARG 60 HB2 ARG 60 -3.017 -1.044 -13.074 447 HB3 ARG 60 HB3 ARG 60 -2.673 -0.548 -11.437 448 HG2 ARG 60 HG2 ARG 60 -3.161 -2.789 -11.182 449 HG3 ARG 60 HG3 ARG 60 -4.712 -2.035 -10.822 450 HD2 ARG 60 HD2 ARG 60 -5.426 -2.506 -13.148 451 HD3 ARG 60 HD3 ARG 60 -3.902 -3.343 -13.432 452 HE ARG 60 HE ARG 60 -6.094 -4.205 -11.702 453 HH11 ARG 60 HH11 ARG 60 -2.963 -4.929 -13.245 454 HH12 ARG 60 HH12 ARG 60 -3.015 -6.572 -12.839 455 HH21 ARG 60 HH21 ARG 60 -6.091 -6.519 -11.118 456 HH22 ARG 60 HH22 ARG 60 -4.763 -7.471 -11.615 457 H ALA 61 H ALA 61 -4.806 1.484 -14.416 458 HA ALA 61 HA ALA 61 -6.123 1.390 -16.251 459 HB1 ALA 61 HB1 ALA 61 -6.246 -1.561 -15.616 460 HB2 ALA 61 HB2 ALA 61 -4.948 -0.760 -16.499 461 HB3 ALA 61 HB3 ALA 61 -6.573 -0.815 -17.181 462 H GLY 62 H GLY 62 -7.400 1.929 -13.741 463 HA2 GLY 62 HA2 GLY 62 -9.613 2.628 -13.373 464 HA3 GLY 62 HA3 GLY 62 -10.156 1.454 -14.562 465 H GLY 63 H GLY 63 -8.118 -0.261 -12.670 466 HA2 GLY 63 HA2 GLY 63 -10.356 -1.204 -10.987 467 HA3 GLY 63 HA3 GLY 63 -9.010 -2.181 -11.558 468 H VAL 64 H VAL 64 -10.102 -1.616 -8.866 469 HA VAL 64 HA VAL 64 -7.815 -0.321 -7.599 470 HB VAL 64 HB VAL 64 -10.406 -1.367 -6.390 471 HG11 VAL 64 HG11 VAL 64 -9.798 -0.031 -4.428 472 HG12 VAL 64 HG12 VAL 64 -8.269 0.394 -5.200 473 HG13 VAL 64 HG13 VAL 64 -8.603 -1.282 -4.770 474 HG21 VAL 64 HG21 VAL 64 -9.638 1.463 -7.100 475 HG22 VAL 64 HG22 VAL 64 -11.098 0.986 -6.234 476 HG23 VAL 64 HG23 VAL 64 -10.859 0.482 -7.908 477 H VAL 65 H VAL 65 -6.244 -1.562 -6.864 478 HA VAL 65 HA VAL 65 -6.752 -4.391 -6.327 479 HB VAL 65 HB VAL 65 -4.566 -4.916 -7.455 480 HG11 VAL 65 HG11 VAL 65 -6.740 -3.766 -9.197 481 HG12 VAL 65 HG12 VAL 65 -6.694 -5.405 -8.542 482 HG13 VAL 65 HG13 VAL 65 -5.492 -4.891 -9.727 483 HG21 VAL 65 HG21 VAL 65 -3.656 -2.637 -7.483 484 HG22 VAL 65 HG22 VAL 65 -4.938 -2.165 -8.599 485 HG23 VAL 65 HG23 VAL 65 -3.714 -3.330 -9.111 486 H ILE 66 H ILE 66 -5.043 -5.368 -5.124 487 HA ILE 66 HA ILE 66 -3.503 -3.478 -3.487 488 HB ILE 66 HB ILE 66 -4.805 -6.054 -2.514 489 HG12 ILE 66 HG12 ILE 66 -5.544 -3.177 -1.952 490 HG13 ILE 66 HG13 ILE 66 -6.454 -4.267 -2.987 491 HG21 ILE 66 HG21 ILE 66 -3.331 -3.888 -0.997 492 HG22 ILE 66 HG22 ILE 66 -2.715 -5.501 -1.345 493 HG23 ILE 66 HG23 ILE 66 -4.106 -5.303 -0.280 494 HD11 ILE 66 HD11 ILE 66 -6.894 -5.691 -1.015 495 HD12 ILE 66 HD12 ILE 66 -7.516 -4.046 -0.841 496 HD13 ILE 66 HD13 ILE 66 -6.027 -4.515 -0.031 497 HA PRO 67 HA PRO 67 -0.103 -5.973 -5.112 498 HB2 PRO 67 HB2 PRO 67 1.274 -4.967 -2.699 499 HB3 PRO 67 HB3 PRO 67 1.759 -4.862 -4.392 500 HG2 PRO 67 HG2 PRO 67 0.861 -2.707 -3.115 501 HG3 PRO 67 HG3 PRO 67 0.410 -3.010 -4.801 502 HD2 PRO 67 HD2 PRO 67 -1.185 -3.415 -2.312 503 HD3 PRO 67 HD3 PRO 67 -1.684 -2.805 -3.909 504 H GLN 68 H GLN 68 0.514 -7.990 -4.815 505 HA GLN 68 HA GLN 68 -0.446 -9.805 -2.962 506 HB2 GLN 68 HB2 GLN 68 2.056 -9.754 -4.592 507 HB3 GLN 68 HB3 GLN 68 1.592 -11.165 -3.649 508 HG2 GLN 68 HG2 GLN 68 -0.115 -9.934 -5.797 509 HG3 GLN 68 HG3 GLN 68 1.062 -11.211 -6.089 510 HE21 GLN 68 HE21 GLN 68 -1.855 -11.190 -6.419 511 HE22 GLN 68 HE22 GLN 68 -2.404 -12.516 -5.482 512 H VAL 69 H VAL 69 2.404 -7.837 -2.844 513 HA VAL 69 HA VAL 69 3.767 -9.167 -0.763 514 HB VAL 69 HB VAL 69 5.240 -7.188 -0.738 515 HG11 VAL 69 HG11 VAL 69 5.636 -8.987 -2.343 516 HG12 VAL 69 HG12 VAL 69 6.047 -7.427 -3.055 517 HG13 VAL 69 HG13 VAL 69 4.535 -8.221 -3.486 518 HG21 VAL 69 HG21 VAL 69 4.844 -5.382 -2.385 519 HG22 VAL 69 HG22 VAL 69 3.574 -5.464 -1.159 520 HG23 VAL 69 HG23 VAL 69 3.284 -6.111 -2.769 521 H PHE 70 H PHE 70 1.052 -7.173 -0.577 522 HA PHE 70 HA PHE 70 1.635 -6.034 2.008 523 HB2 PHE 70 HB2 PHE 70 -0.713 -6.036 0.166 524 HB3 PHE 70 HB3 PHE 70 -0.996 -5.703 1.870 525 HD1 PHE 70 HD1 PHE 70 1.518 -4.658 -0.713 526 HD2 PHE 70 HD2 PHE 70 -1.154 -3.533 2.378 527 HE1 PHE 70 HE1 PHE 70 2.159 -2.293 -1.015 528 HE2 PHE 70 HE2 PHE 70 -0.511 -1.188 2.102 529 HZ PHE 70 HZ PHE 70 1.103 -0.551 0.424 530 H PHE 71 H PHE 71 0.672 -8.987 0.827 531 HA PHE 71 HA PHE 71 -0.521 -9.732 3.384 532 HB2 PHE 71 HB2 PHE 71 -0.878 -11.002 0.660 533 HB3 PHE 71 HB3 PHE 71 -1.552 -11.628 2.158 534 HD1 PHE 71 HD1 PHE 71 -1.777 -9.022 -0.386 535 HD2 PHE 71 HD2 PHE 71 -3.446 -10.547 3.214 536 HE1 PHE 71 HE1 PHE 71 -3.760 -7.625 -0.722 537 HE2 PHE 71 HE2 PHE 71 -5.443 -9.149 2.882 538 HZ PHE 71 HZ PHE 71 -5.597 -7.679 0.909 539 H THR 72 H THR 72 -0.030 -11.886 4.033 540 HA THR 72 HA THR 72 2.764 -12.543 3.640 541 HB THR 72 HB THR 72 2.294 -14.294 5.371 542 HG1 THR 72 HG1 THR 72 -0.307 -13.136 5.383 543 HG21 THR 72 HG21 THR 72 2.963 -12.030 6.104 544 HG22 THR 72 HG22 THR 72 1.843 -12.761 7.252 545 HG23 THR 72 HG23 THR 72 1.272 -11.538 6.122 546 H ASN 73 H ASN 73 3.262 -14.891 3.152 547 HA ASN 73 HA ASN 73 1.922 -15.759 0.812 548 HB2 ASN 73 HB2 ASN 73 4.300 -16.270 1.214 549 HB3 ASN 73 HB3 ASN 73 3.870 -17.242 2.613 550 HD21 ASN 73 HD21 ASN 73 3.965 -17.094 -0.857 551 HD22 ASN 73 HD22 ASN 73 3.617 -18.763 -1.124 552 H SER 74 H SER 74 1.407 -16.239 4.143 553 HA SER 74 HA SER 74 -0.062 -18.666 3.989 554 HB2 SER 74 HB2 SER 74 0.090 -16.659 6.225 555 HB3 SER 74 HB3 SER 74 -0.301 -18.380 6.333 556 HG SER 74 HG SER 74 1.877 -18.573 5.220 557 H GLY 75 H GLY 75 -0.868 -15.534 3.059 558 HA2 GLY 75 HA2 GLY 75 -2.955 -15.156 2.006 559 HA3 GLY 75 HA3 GLY 75 -3.681 -16.316 3.097 560 H GLN 76 H GLN 76 -2.143 -14.710 5.324 561 HA GLN 76 HA GLN 76 -4.376 -12.846 5.631 562 HB2 GLN 76 HB2 GLN 76 -3.655 -12.545 7.952 563 HB3 GLN 76 HB3 GLN 76 -3.901 -14.242 7.587 564 HG2 GLN 76 HG2 GLN 76 -1.591 -14.678 7.579 565 HG3 GLN 76 HG3 GLN 76 -1.193 -12.961 7.514 566 HE21 GLN 76 HE21 GLN 76 -1.399 -11.719 9.345 567 HE22 GLN 76 HE22 GLN 76 -1.524 -12.407 10.920 568 H VAL 77 H VAL 77 -3.829 -10.649 6.586 569 HA VAL 77 HA VAL 77 -1.839 -9.542 4.824 570 HB VAL 77 HB VAL 77 -4.199 -8.557 5.329 571 HG11 VAL 77 HG11 VAL 77 -2.722 -7.418 7.654 572 HG12 VAL 77 HG12 VAL 77 -4.111 -8.514 7.731 573 HG13 VAL 77 HG13 VAL 77 -4.295 -6.869 7.087 574 HG21 VAL 77 HG21 VAL 77 -2.627 -7.434 3.902 575 HG22 VAL 77 HG22 VAL 77 -1.778 -6.778 5.302 576 HG23 VAL 77 HG23 VAL 77 -3.425 -6.256 4.945 577 H VAL 78 H VAL 78 -0.146 -8.099 5.647 578 HA VAL 78 HA VAL 78 1.250 -9.246 7.827 579 HB VAL 78 HB VAL 78 1.723 -6.526 6.583 580 HG11 VAL 78 HG11 VAL 78 2.932 -6.776 8.637 581 HG12 VAL 78 HG12 VAL 78 4.070 -6.878 7.296 582 HG13 VAL 78 HG13 VAL 78 3.556 -8.343 8.128 583 HG21 VAL 78 HG21 VAL 78 3.351 -7.607 5.116 584 HG22 VAL 78 HG22 VAL 78 1.719 -8.215 4.839 585 HG23 VAL 78 HG23 VAL 78 2.878 -9.189 5.753 586 H LYS 79 H LYS 79 1.041 -8.836 9.904 587 HA LYS 79 HA LYS 79 -0.995 -7.214 10.951 588 HB2 LYS 79 HB2 LYS 79 -0.081 -7.689 13.167 589 HB3 LYS 79 HB3 LYS 79 -0.204 -9.139 12.175 590 HG2 LYS 79 HG2 LYS 79 2.144 -8.904 11.629 591 HG3 LYS 79 HG3 LYS 79 2.239 -7.531 12.722 592 HD2 LYS 79 HD2 LYS 79 1.495 -10.363 13.561 593 HD3 LYS 79 HD3 LYS 79 3.097 -9.668 13.748 594 HE2 LYS 79 HE2 LYS 79 2.121 -9.464 15.879 595 HE3 LYS 79 HE3 LYS 79 1.949 -7.865 15.175 596 HZ1 LYS 79 HZ1 LYS 79 -0.179 -9.937 15.408 597 HZ2 LYS 79 HZ2 LYS 79 -0.434 -8.425 14.694 598 HZ3 LYS 79 HZ3 LYS 79 -0.044 -8.549 16.310 599 H SER 80 H SER 80 2.281 -6.444 10.271 600 HA SER 80 HA SER 80 2.367 -4.031 11.820 601 HB2 SER 80 HB2 SER 80 4.246 -5.034 9.690 602 HB3 SER 80 HB3 SER 80 4.596 -3.853 10.958 603 HG SER 80 HG SER 80 4.092 -5.522 12.470 604 H LEU 81 H LEU 81 0.777 -4.757 9.010 605 HA LEU 81 HA LEU 81 1.529 -2.738 7.260 606 HB2 LEU 81 HB2 LEU 81 0.209 -4.630 6.536 607 HB3 LEU 81 HB3 LEU 81 -1.148 -4.095 7.502 608 HG LEU 81 HG LEU 81 -1.262 -2.037 6.128 609 HD11 LEU 81 HD11 LEU 81 0.790 -3.492 4.520 610 HD12 LEU 81 HD12 LEU 81 1.017 -1.959 5.388 611 HD13 LEU 81 HD13 LEU 81 -0.069 -2.046 3.996 612 HD21 LEU 81 HD21 LEU 81 -1.435 -4.617 4.605 613 HD22 LEU 81 HD22 LEU 81 -2.239 -3.102 4.183 614 HD23 LEU 81 HD23 LEU 81 -2.684 -3.955 5.665 615 HA PRO 82 HA PRO 82 -2.247 -0.076 8.994 616 HB2 PRO 82 HB2 PRO 82 -2.699 -0.526 11.693 617 HB3 PRO 82 HB3 PRO 82 -3.723 -1.093 10.376 618 HG2 PRO 82 HG2 PRO 82 -1.624 -2.551 11.911 619 HG3 PRO 82 HG3 PRO 82 -3.174 -3.148 11.289 620 HD2 PRO 82 HD2 PRO 82 -0.821 -3.692 10.100 621 HD3 PRO 82 HD3 PRO 82 -2.323 -3.462 9.159 622 H GLY 83 H GLY 83 0.450 -1.113 10.973 623 HA2 GLY 83 HA2 GLY 83 0.749 1.215 12.526 624 HA3 GLY 83 HA3 GLY 83 2.026 0.062 12.160 625 H LEU 84 H LEU 84 2.187 0.287 9.429 626 HA LEU 84 HA LEU 84 3.633 2.736 9.201 627 HB2 LEU 84 HB2 LEU 84 4.301 2.049 7.014 628 HB3 LEU 84 HB3 LEU 84 4.322 0.634 8.033 629 HG LEU 84 HG LEU 84 1.877 0.362 6.928 630 HD11 LEU 84 HD11 LEU 84 3.487 1.768 4.805 631 HD12 LEU 84 HD12 LEU 84 2.013 2.356 5.557 632 HD13 LEU 84 HD13 LEU 84 1.966 0.926 4.546 633 HD21 LEU 84 HD21 LEU 84 4.511 -0.494 5.713 634 HD22 LEU 84 HD22 LEU 84 2.943 -1.199 5.322 635 HD23 LEU 84 HD23 LEU 84 3.597 -1.354 6.950 636 H LEU 85 H LEU 85 0.554 1.601 8.036 637 HA LEU 85 HA LEU 85 -0.011 3.762 6.336 638 HB2 LEU 85 HB2 LEU 85 -1.886 1.897 7.772 639 HB3 LEU 85 HB3 LEU 85 -2.384 3.041 6.546 640 HG LEU 85 HG LEU 85 -0.483 0.736 6.092 641 HD11 LEU 85 HD11 LEU 85 -2.752 -0.024 6.537 642 HD12 LEU 85 HD12 LEU 85 -2.330 -0.246 4.838 643 HD13 LEU 85 HD13 LEU 85 -3.372 1.091 5.320 644 HD21 LEU 85 HD21 LEU 85 -1.756 2.688 4.174 645 HD22 LEU 85 HD22 LEU 85 -0.792 1.283 3.726 646 HD23 LEU 85 HD23 LEU 85 -0.046 2.612 4.603 647 H THR 86 H THR 86 -0.694 3.220 9.688 648 HA THR 86 HA THR 86 -2.438 5.420 10.023 649 HB THR 86 HB THR 86 -0.746 4.082 12.159 650 HG1 THR 86 HG1 THR 86 -2.082 2.599 11.196 651 HG21 THR 86 HG21 THR 86 -1.654 6.252 12.907 652 HG22 THR 86 HG22 THR 86 -2.464 4.917 13.729 653 HG23 THR 86 HG23 THR 86 -3.266 5.751 12.400 654 H ILE 87 H ILE 87 1.091 5.222 10.558 655 HA ILE 87 HA ILE 87 1.246 7.864 11.524 656 HB ILE 87 HB ILE 87 2.983 6.309 12.129 657 HG12 ILE 87 HG12 ILE 87 3.681 8.754 11.850 658 HG13 ILE 87 HG13 ILE 87 4.976 7.578 11.941 659 HG21 ILE 87 HG21 ILE 87 3.717 6.033 9.254 660 HG22 ILE 87 HG22 ILE 87 3.015 4.819 10.313 661 HG23 ILE 87 HG23 ILE 87 4.660 5.399 10.602 662 HD11 ILE 87 HD11 ILE 87 5.402 9.336 10.290 663 HD12 ILE 87 HD12 ILE 87 3.949 8.866 9.411 664 HD13 ILE 87 HD13 ILE 87 5.311 7.749 9.528 665 H LEU 88 H LEU 88 1.679 6.534 8.288 666 HA LEU 88 HA LEU 88 2.271 9.017 7.077 667 HB2 LEU 88 HB2 LEU 88 1.391 6.379 6.038 668 HB3 LEU 88 HB3 LEU 88 1.350 7.765 4.979 669 HG LEU 88 HG LEU 88 3.328 6.462 4.608 670 HD11 LEU 88 HD11 LEU 88 3.540 8.824 4.244 671 HD12 LEU 88 HD12 LEU 88 5.057 8.173 4.860 672 HD13 LEU 88 HD13 LEU 88 3.986 9.073 5.930 673 HD21 LEU 88 HD21 LEU 88 3.624 5.443 6.788 674 HD22 LEU 88 HD22 LEU 88 4.055 7.020 7.465 675 HD23 LEU 88 HD23 LEU 88 5.094 6.269 6.252 676 H HIS 89 H HIS 89 -0.741 7.379 7.742 677 HA HIS 89 HA HIS 89 -2.449 8.972 6.185 678 HB2 HIS 89 HB2 HIS 89 -3.086 6.801 7.282 679 HB3 HIS 89 HB3 HIS 89 -3.091 7.634 8.830 680 HD1 HIS 89 HD1 HIS 89 -5.287 8.723 9.490 681 HD2 HIS 89 HD2 HIS 89 -5.100 7.774 5.455 682 HE1 HIS 89 HE1 HIS 89 -7.595 9.116 8.566 683 H ASP 90 H ASP 90 -1.329 9.290 9.512 684 HA ASP 90 HA ASP 90 -2.708 11.665 10.146 685 HB2 ASP 90 HB2 ASP 90 -1.752 10.368 11.926 686 HB3 ASP 90 HB3 ASP 90 -0.147 10.470 11.218 687 H GLY 91 H GLY 91 0.247 11.064 8.443 688 HA2 GLY 91 HA2 GLY 91 1.070 13.832 8.341 689 HA3 GLY 91 HA3 GLY 91 1.807 12.487 7.481 690 H GLY 92 H GLY 92 -1.208 11.984 6.704 691 HA2 GLY 92 HA2 GLY 92 -2.721 12.719 5.110 692 HA3 GLY 92 HA3 GLY 92 -1.731 14.147 4.861 693 H TYR 93 H TYR 93 -0.300 10.993 4.649 694 HA TYR 93 HA TYR 93 0.256 11.562 1.862 695 HB2 TYR 93 HB2 TYR 93 1.364 9.476 3.736 696 HB3 TYR 93 HB3 TYR 93 1.807 9.572 2.034 697 HD1 TYR 93 HD1 TYR 93 2.057 11.258 5.303 698 HD2 TYR 93 HD2 TYR 93 3.287 11.287 1.238 699 HE1 TYR 93 HE1 TYR 93 3.791 12.914 5.843 700 HE2 TYR 93 HE2 TYR 93 5.028 12.934 1.770 701 HH TYR 93 HH TYR 93 5.298 14.723 3.570 702 H ARG 94 H ARG 94 -0.546 10.604 0.201 703 HA ARG 94 HA ARG 94 -2.876 8.942 0.502 704 HB2 ARG 94 HB2 ARG 94 -3.282 9.353 -1.790 705 HB3 ARG 94 HB3 ARG 94 -2.584 10.843 -1.173 706 HG2 ARG 94 HG2 ARG 94 -0.368 9.926 -1.997 707 HG3 ARG 94 HG3 ARG 94 -1.309 8.771 -2.933 708 HD2 ARG 94 HD2 ARG 94 -0.887 10.605 -4.383 709 HD3 ARG 94 HD3 ARG 94 -2.561 10.797 -3.855 710 HE ARG 94 HE ARG 94 -0.902 12.142 -2.061 711 HH11 ARG 94 HH11 ARG 94 -1.868 12.468 -5.462 712 HH12 ARG 94 HH12 ARG 94 -1.712 14.164 -5.481 713 HH21 ARG 94 HH21 ARG 94 -0.723 14.490 -2.119 714 HH22 ARG 94 HH22 ARG 94 -1.043 15.330 -3.554 715 H ASP 95 H ASP 95 -3.101 7.149 -1.243 716 HA ASP 95 HA ASP 95 -1.751 4.872 -0.404 717 HB2 ASP 95 HB2 ASP 95 -2.885 3.772 -2.276 718 HB3 ASP 95 HB3 ASP 95 -3.974 4.946 -1.547 719 H THR 96 H THR 96 -1.334 6.799 -3.279 720 HA THR 96 HA THR 96 0.658 5.336 -4.545 721 HB THR 96 HB THR 96 0.156 8.305 -4.676 722 HG1 THR 96 HG1 THR 96 -1.564 6.391 -5.173 723 HG21 THR 96 HG21 THR 96 2.234 7.532 -5.759 724 HG22 THR 96 HG22 THR 96 1.058 8.108 -6.946 725 HG23 THR 96 HG23 THR 96 1.303 6.375 -6.699 726 H GLU 97 H GLU 97 0.800 7.954 -2.198 727 HA GLU 97 HA GLU 97 3.585 8.398 -2.402 728 HB2 GLU 97 HB2 GLU 97 1.582 9.140 -0.264 729 HB3 GLU 97 HB3 GLU 97 3.275 9.623 -0.208 730 HG2 GLU 97 HG2 GLU 97 3.051 10.934 -2.168 731 HG3 GLU 97 HG3 GLU 97 1.451 10.316 -2.514 732 H ILE 98 H ILE 98 1.560 6.397 -0.353 733 HA ILE 98 HA ILE 98 3.494 5.578 1.551 734 HB ILE 98 HB ILE 98 1.351 3.734 0.483 735 HG12 ILE 98 HG12 ILE 98 0.103 5.731 0.993 736 HG13 ILE 98 HG13 ILE 98 -0.113 4.569 2.302 737 HG21 ILE 98 HG21 ILE 98 1.339 2.832 2.746 738 HG22 ILE 98 HG22 ILE 98 2.597 3.979 3.201 739 HG23 ILE 98 HG23 ILE 98 2.935 2.739 1.996 740 HD11 ILE 98 HD11 ILE 98 1.425 5.776 3.679 741 HD12 ILE 98 HD12 ILE 98 0.139 6.838 3.114 742 HD13 ILE 98 HD13 ILE 98 1.737 6.922 2.371 743 H MET 99 H MET 99 2.452 4.139 -1.508 744 HA MET 99 HA MET 99 4.265 1.983 -1.255 745 HB2 MET 99 HB2 MET 99 2.634 2.795 -3.639 746 HB3 MET 99 HB3 MET 99 3.515 1.280 -3.470 747 HG2 MET 99 HG2 MET 99 2.170 0.846 -1.415 748 HG3 MET 99 HG3 MET 99 1.209 2.256 -1.851 749 HE1 MET 99 HE1 MET 99 -1.328 -0.474 -2.739 750 HE2 MET 99 HE2 MET 99 -1.002 1.051 -1.912 751 HE3 MET 99 HE3 MET 99 -0.234 -0.435 -1.350 752 H ARG 100 H ARG 100 4.673 5.143 -2.408 753 HA ARG 100 HA ARG 100 6.555 4.785 -4.446 754 HB2 ARG 100 HB2 ARG 100 6.367 6.960 -2.371 755 HB3 ARG 100 HB3 ARG 100 7.550 6.988 -3.664 756 HG2 ARG 100 HG2 ARG 100 5.716 6.986 -5.301 757 HG3 ARG 100 HG3 ARG 100 4.561 7.015 -3.968 758 HD2 ARG 100 HD2 ARG 100 5.446 9.129 -3.196 759 HD3 ARG 100 HD3 ARG 100 6.694 9.083 -4.437 760 HE ARG 100 HE ARG 100 3.988 8.975 -5.425 761 HH11 ARG 100 HH11 ARG 100 6.660 11.113 -4.504 762 HH12 ARG 100 HH12 ARG 100 6.222 12.366 -5.539 763 HH21 ARG 100 HH21 ARG 100 3.337 10.744 -6.834 764 HH22 ARG 100 HH22 ARG 100 4.273 12.156 -6.913 765 H TRP 101 H TRP 101 7.341 5.506 -1.075 766 HA TRP 101 HA TRP 101 10.011 4.701 -1.458 767 HB2 TRP 101 HB2 TRP 101 10.142 4.923 1.108 768 HB3 TRP 101 HB3 TRP 101 9.815 6.364 0.160 769 HD1 TRP 101 HD1 TRP 101 7.534 7.591 0.562 770 HE1 TRP 101 HE1 TRP 101 5.650 7.300 2.272 771 HE3 TRP 101 HE3 TRP 101 8.865 3.042 2.476 772 HZ2 TRP 101 HZ2 TRP 101 4.843 5.397 4.191 773 HZ3 TRP 101 HZ3 TRP 101 7.486 2.061 4.216 774 HH2 TRP 101 HH2 TRP 101 5.510 3.215 5.078 775 H LEU 102 H LEU 102 7.206 2.992 -0.370 776 HA LEU 102 HA LEU 102 8.472 0.821 0.893 777 HB2 LEU 102 HB2 LEU 102 5.853 1.326 -0.294 778 HB3 LEU 102 HB3 LEU 102 6.246 -0.371 -0.050 779 HG LEU 102 HG LEU 102 6.079 1.804 2.053 780 HD11 LEU 102 HD11 LEU 102 4.050 0.669 2.734 781 HD12 LEU 102 HD12 LEU 102 4.250 -0.505 1.433 782 HD13 LEU 102 HD13 LEU 102 3.926 1.189 1.051 783 HD21 LEU 102 HD21 LEU 102 7.653 0.118 2.733 784 HD22 LEU 102 HD22 LEU 102 6.530 -1.166 2.264 785 HD23 LEU 102 HD23 LEU 102 6.149 -0.106 3.620 786 H PHE 103 H PHE 103 7.673 1.278 -2.534 787 HA PHE 103 HA PHE 103 8.693 -1.388 -3.072 788 HB2 PHE 103 HB2 PHE 103 7.219 0.593 -4.775 789 HB3 PHE 103 HB3 PHE 103 7.971 -0.841 -5.462 790 HD1 PHE 103 HD1 PHE 103 5.459 0.278 -2.964 791 HD2 PHE 103 HD2 PHE 103 6.896 -2.903 -5.389 792 HE1 PHE 103 HE1 PHE 103 3.455 -1.038 -2.423 793 HE2 PHE 103 HE2 PHE 103 4.895 -4.224 -4.839 794 HZ PHE 103 HZ PHE 103 3.174 -3.286 -3.371 795 H THR 104 H THR 104 9.845 1.747 -3.066 796 HA THR 104 HA THR 104 11.801 1.233 -5.120 797 HB THR 104 HB THR 104 11.447 3.641 -3.308 798 HG1 THR 104 HG1 THR 104 9.760 3.735 -4.565 799 HG21 THR 104 HG21 THR 104 12.867 4.812 -4.945 800 HG22 THR 104 HG22 THR 104 13.060 3.314 -5.856 801 HG23 THR 104 HG23 THR 104 13.734 3.450 -4.234 802 HA PRO 105 HA PRO 105 14.614 -0.760 -2.214 803 HB2 PRO 105 HB2 PRO 105 16.556 0.270 -4.235 804 HB3 PRO 105 HB3 PRO 105 16.422 -1.346 -3.536 805 HG2 PRO 105 HG2 PRO 105 15.563 -0.927 -5.990 806 HG3 PRO 105 HG3 PRO 105 14.600 -1.912 -4.875 807 HD2 PRO 105 HD2 PRO 105 14.180 0.918 -5.744 808 HD3 PRO 105 HD3 PRO 105 12.992 -0.375 -5.470 809 H ASP 106 H ASP 106 15.463 0.128 -0.422 810 HA ASP 106 HA ASP 106 16.045 2.951 -0.344 811 HB2 ASP 106 HB2 ASP 106 14.959 1.801 1.592 812 HB3 ASP 106 HB3 ASP 106 16.416 0.826 1.769 813 HA PRO 107 HA PRO 107 20.208 2.349 -1.682 814 HB2 PRO 107 HB2 PRO 107 21.229 4.738 -0.778 815 HB3 PRO 107 HB3 PRO 107 20.327 4.535 -2.283 816 HG2 PRO 107 HG2 PRO 107 19.377 5.498 0.380 817 HG3 PRO 107 HG3 PRO 107 18.984 6.108 -1.237 818 HD2 PRO 107 HD2 PRO 107 17.293 4.544 0.126 819 HD3 PRO 107 HD3 PRO 107 17.450 4.417 -1.640 820 H SER 108 H SER 108 19.403 2.841 1.690 821 HA SER 108 HA SER 108 22.156 2.103 2.410 822 HB2 SER 108 HB2 SER 108 20.138 3.633 4.044 823 HB3 SER 108 HB3 SER 108 21.829 3.333 4.456 824 HG SER 108 HG SER 108 21.365 4.447 1.999 825 H LEU 109 H LEU 109 19.244 0.682 2.018 826 HA LEU 109 HA LEU 109 19.314 -0.655 4.610 827 HB2 LEU 109 HB2 LEU 109 17.164 0.346 3.888 828 HB3 LEU 109 HB3 LEU 109 17.177 -0.772 2.531 829 HG LEU 109 HG LEU 109 17.093 -2.667 4.087 830 HD11 LEU 109 HD11 LEU 109 18.107 -1.671 6.053 831 HD12 LEU 109 HD12 LEU 109 16.500 -2.284 6.432 832 HD13 LEU 109 HD13 LEU 109 16.748 -0.554 6.208 833 HD21 LEU 109 HD21 LEU 109 14.909 -0.631 4.395 834 HD22 LEU 109 HD22 LEU 109 14.778 -2.358 4.750 835 HD23 LEU 109 HD23 LEU 109 15.085 -1.819 3.094 836 H THR 110 H THR 110 20.154 -2.445 4.767 837 HA THR 110 HA THR 110 20.300 -4.319 2.506 838 HB THR 110 HB THR 110 22.230 -4.068 4.835 839 HG1 THR 110 HG1 THR 110 22.014 -2.543 2.607 840 HG21 THR 110 HG21 THR 110 22.449 -5.545 2.194 841 HG22 THR 110 HG22 THR 110 22.170 -6.285 3.769 842 HG23 THR 110 HG23 THR 110 23.699 -5.470 3.433 843 H ILE 111 H ILE 111 19.354 -6.270 2.990 844 HA ILE 111 HA ILE 111 18.593 -6.628 5.789 845 HB ILE 111 HB ILE 111 16.650 -8.019 4.950 846 HG12 ILE 111 HG12 ILE 111 17.024 -6.380 2.477 847 HG13 ILE 111 HG13 ILE 111 17.548 -8.040 2.502 848 HG21 ILE 111 HG21 ILE 111 16.430 -5.897 6.007 849 HG22 ILE 111 HG22 ILE 111 15.242 -6.022 4.699 850 HG23 ILE 111 HG23 ILE 111 16.707 -5.048 4.487 851 HD11 ILE 111 HD11 ILE 111 15.165 -8.671 3.018 852 HD12 ILE 111 HD12 ILE 111 15.375 -7.872 1.458 853 HD13 ILE 111 HD13 ILE 111 14.742 -6.968 2.831 854 H THR 112 H THR 112 18.227 -8.734 6.539 855 HA THR 112 HA THR 112 20.521 -10.298 5.882 856 HB THR 112 HB THR 112 19.902 -11.365 8.066 857 HG1 THR 112 HG1 THR 112 17.782 -11.054 8.390 858 HG21 THR 112 HG21 THR 112 21.420 -9.406 7.928 859 HG22 THR 112 HG22 THR 112 20.432 -9.361 9.396 860 HG23 THR 112 HG23 THR 112 20.007 -8.352 8.009 861 H ARG 113 H ARG 113 20.406 -12.591 5.841 862 HA ARG 113 HA ARG 113 18.535 -13.729 4.035 863 HB2 ARG 113 HB2 ARG 113 20.963 -14.343 4.309 864 HB3 ARG 113 HB3 ARG 113 20.570 -15.043 5.863 865 HG2 ARG 113 HG2 ARG 113 19.051 -16.621 4.655 866 HG3 ARG 113 HG3 ARG 113 19.729 -16.028 3.137 867 HD2 ARG 113 HD2 ARG 113 20.908 -18.011 3.775 868 HD3 ARG 113 HD3 ARG 113 21.986 -16.637 4.035 869 HE ARG 113 HE ARG 113 20.423 -17.455 6.333 870 HH11 ARG 113 HH11 ARG 113 23.581 -17.632 4.704 871 HH12 ARG 113 HH12 ARG 113 24.375 -18.298 6.052 872 HH21 ARG 113 HH21 ARG 113 21.507 -18.398 8.140 873 HH22 ARG 113 HH22 ARG 113 23.181 -18.740 8.050 874 H ASP 114 H ASP 114 17.393 -15.893 4.686 875 HA ASP 114 HA ASP 114 16.038 -17.177 5.906 876 HB2 ASP 114 HB2 ASP 114 17.179 -15.755 8.336 877 HB3 ASP 114 HB3 ASP 114 16.093 -17.135 8.414 878 H GLY 115 H GLY 115 15.634 -14.422 5.104 879 HA2 GLY 115 HA2 GLY 115 12.858 -14.193 5.961 880 HA3 GLY 115 HA3 GLY 115 13.891 -12.771 6.183 881 H SER 116 H SER 116 15.562 -12.981 4.032 882 HA SER 116 HA SER 116 13.816 -12.863 1.744 883 HB2 SER 116 HB2 SER 116 15.722 -11.416 0.881 884 HB3 SER 116 HB3 SER 116 14.821 -10.722 2.233 885 HG SER 116 HG SER 116 16.568 -10.951 3.500 886 H ARG 117 H ARG 117 15.543 -13.267 -0.199 887 HA ARG 117 HA ARG 117 16.178 -16.009 0.034 888 HB2 ARG 117 HB2 ARG 117 17.094 -15.816 -2.330 889 HB3 ARG 117 HB3 ARG 117 15.410 -15.409 -2.098 890 HG2 ARG 117 HG2 ARG 117 16.290 -13.835 -3.635 891 HG3 ARG 117 HG3 ARG 117 16.112 -12.974 -2.115 892 HD2 ARG 117 HD2 ARG 117 18.205 -12.390 -3.203 893 HD3 ARG 117 HD3 ARG 117 18.513 -13.249 -1.693 894 HE ARG 117 HE ARG 117 18.468 -15.163 -3.663 895 HH11 ARG 117 HH11 ARG 117 20.459 -12.272 -3.046 896 HH12 ARG 117 HH12 ARG 117 21.853 -12.965 -3.750 897 HH21 ARG 117 HH21 ARG 117 20.351 -16.044 -4.586 898 HH22 ARG 117 HH22 ARG 117 21.804 -15.150 -4.640 899 H ASP 118 H ASP 118 18.158 -13.259 0.551 900 HA ASP 118 HA ASP 118 20.246 -14.660 1.750 901 HB2 ASP 118 HB2 ASP 118 20.710 -15.082 -0.821 902 HB3 ASP 118 HB3 ASP 118 21.078 -13.368 -0.887 903 H ALA 119 H ALA 119 22.152 -12.641 1.643 904 HA ALA 119 HA ALA 119 20.683 -10.526 2.889 905 HB1 ALA 119 HB1 ALA 119 22.883 -9.435 3.130 906 HB2 ALA 119 HB2 ALA 119 23.602 -10.666 2.094 907 HB3 ALA 119 HB3 ALA 119 22.939 -11.114 3.664 908 H VAL 120 H VAL 120 19.851 -8.827 1.919 909 HA VAL 120 HA VAL 120 20.548 -8.407 -0.910 910 HB VAL 120 HB VAL 120 17.881 -7.797 0.414 911 HG11 VAL 120 HG11 VAL 120 17.067 -7.353 -1.854 912 HG12 VAL 120 HG12 VAL 120 18.694 -7.600 -2.486 913 HG13 VAL 120 HG13 VAL 120 18.368 -6.252 -1.399 914 HG21 VAL 120 HG21 VAL 120 18.210 -10.204 0.171 915 HG22 VAL 120 HG22 VAL 120 18.607 -9.989 -1.534 916 HG23 VAL 120 HG23 VAL 120 16.981 -9.629 -0.954 917 H SER 121 H SER 121 21.619 -6.667 -1.247 918 HA SER 121 HA SER 121 21.550 -4.438 0.606 919 HB2 SER 121 HB2 SER 121 23.080 -4.769 -1.990 920 HB3 SER 121 HB3 SER 121 23.449 -3.661 -0.661 921 HG SER 121 HG SER 121 23.619 -6.482 -0.693 922 H ASN 122 H ASN 122 20.592 -2.416 0.044 923 HA ASN 122 HA ASN 122 19.134 -1.062 -0.829 924 HB2 ASN 122 HB2 ASN 122 19.859 -2.286 -3.518 925 HB3 ASN 122 HB3 ASN 122 18.887 -0.841 -3.268 926 HD21 ASN 122 HD21 ASN 122 22.046 -2.177 -3.311 927 HD22 ASN 122 HD22 ASN 122 22.925 -0.703 -3.151 928 H ALA 123 H ALA 123 17.986 -2.887 0.431 929 HA ALA 123 HA ALA 123 16.118 -4.346 -1.173 930 HB1 ALA 123 HB1 ALA 123 17.033 -5.290 0.830 931 HB2 ALA 123 HB2 ALA 123 15.279 -5.125 0.965 932 HB3 ALA 123 HB3 ALA 123 16.343 -3.987 1.796 933 H ARG 124 H ARG 124 13.969 -3.903 -1.365 934 HA ARG 124 HA ARG 124 13.122 -1.225 -0.796 935 HB2 ARG 124 HB2 ARG 124 11.006 -1.848 -1.832 936 HB3 ARG 124 HB3 ARG 124 12.301 -2.522 -2.808 937 HG2 ARG 124 HG2 ARG 124 11.947 -4.700 -1.730 938 HG3 ARG 124 HG3 ARG 124 10.623 -4.002 -0.806 939 HD2 ARG 124 HD2 ARG 124 9.688 -5.192 -2.653 940 HD3 ARG 124 HD3 ARG 124 9.493 -3.471 -2.963 941 HE ARG 124 HE ARG 124 11.050 -3.599 -4.668 942 HH11 ARG 124 HH11 ARG 124 10.850 -6.766 -3.032 943 HH12 ARG 124 HH12 ARG 124 11.399 -7.655 -4.379 944 HH21 ARG 124 HH21 ARG 124 11.801 -4.838 -6.506 945 HH22 ARG 124 HH22 ARG 124 11.959 -6.528 -6.410 946 HA PRO 125 HA PRO 125 11.885 -1.781 3.430 947 HB2 PRO 125 HB2 PRO 125 9.511 -0.217 2.528 948 HB3 PRO 125 HB3 PRO 125 10.512 0.014 3.975 949 HG2 PRO 125 HG2 PRO 125 10.867 1.601 1.910 950 HG3 PRO 125 HG3 PRO 125 12.281 0.925 2.739 951 HD2 PRO 125 HD2 PRO 125 11.070 0.137 0.121 952 HD3 PRO 125 HD3 PRO 125 12.779 0.213 0.610 953 H VAL 126 H VAL 126 9.479 -2.475 0.908 954 HA VAL 126 HA VAL 126 7.602 -3.833 2.526 955 HB VAL 126 HB VAL 126 8.268 -4.393 -0.390 956 HG11 VAL 126 HG11 VAL 126 5.842 -5.151 1.231 957 HG12 VAL 126 HG12 VAL 126 7.061 -6.257 0.589 958 HG13 VAL 126 HG13 VAL 126 6.023 -5.336 -0.512 959 HG21 VAL 126 HG21 VAL 126 6.335 -3.013 -0.896 960 HG22 VAL 126 HG22 VAL 126 7.549 -2.103 0.001 961 HG23 VAL 126 HG23 VAL 126 6.100 -2.694 0.822 962 H ASP 127 H ASP 127 10.470 -5.025 0.854 963 HA ASP 127 HA ASP 127 10.073 -7.735 1.610 964 HB2 ASP 127 HB2 ASP 127 12.395 -6.247 0.422 965 HB3 ASP 127 HB3 ASP 127 12.593 -7.899 0.994 966 H ALA 128 H ALA 128 11.613 -5.025 3.018 967 HA ALA 128 HA ALA 128 13.120 -6.440 4.953 968 HB1 ALA 128 HB1 ALA 128 13.638 -4.138 4.302 969 HB2 ALA 128 HB2 ALA 128 13.424 -4.296 6.047 970 HB3 ALA 128 HB3 ALA 128 12.142 -3.592 5.059 971 H LEU 129 H LEU 129 9.882 -4.995 5.011 972 HA LEU 129 HA LEU 129 9.468 -5.562 7.766 973 HB2 LEU 129 HB2 LEU 129 7.114 -5.032 7.392 974 HB3 LEU 129 HB3 LEU 129 8.151 -3.816 6.690 975 HG LEU 129 HG LEU 129 7.766 -5.254 4.526 976 HD11 LEU 129 HD11 LEU 129 5.267 -5.790 6.089 977 HD12 LEU 129 HD12 LEU 129 6.501 -6.964 5.654 978 HD13 LEU 129 HD13 LEU 129 5.530 -6.197 4.382 979 HD21 LEU 129 HD21 LEU 129 5.774 -3.282 5.652 980 HD22 LEU 129 HD22 LEU 129 5.863 -3.765 3.958 981 HD23 LEU 129 HD23 LEU 129 7.213 -2.912 4.699 982 H HIS 130 H HIS 130 8.885 -7.385 4.866 983 HA HIS 130 HA HIS 130 7.448 -9.507 6.118 984 HB2 HIS 130 HB2 HIS 130 7.395 -8.983 3.652 985 HB3 HIS 130 HB3 HIS 130 9.056 -9.542 3.537 986 HD1 HIS 130 HD1 HIS 130 9.305 -12.022 2.915 987 HD2 HIS 130 HD2 HIS 130 5.564 -11.117 4.510 988 HE1 HIS 130 HE1 HIS 130 7.929 -14.095 2.687 989 H ALA 131 H ALA 131 10.701 -8.620 5.779 990 HA ALA 131 HA ALA 131 11.753 -11.238 6.562 991 HB1 ALA 131 HB1 ALA 131 13.958 -10.280 6.149 992 HB2 ALA 131 HB2 ALA 131 13.234 -8.690 5.909 993 HB3 ALA 131 HB3 ALA 131 12.889 -9.997 4.775 994 H HIS 132 H HIS 132 10.199 -9.349 8.321 995 HA HIS 132 HA HIS 132 10.000 -8.840 10.538 996 HB2 HIS 132 HB2 HIS 132 12.405 -10.660 10.861 997 HB3 HIS 132 HB3 HIS 132 11.401 -10.075 12.182 998 HD1 HIS 132 HD1 HIS 132 11.839 -12.990 10.241 999 HD2 HIS 132 HD2 HIS 132 8.529 -10.877 11.583 1000 HE1 HIS 132 HE1 HIS 132 9.880 -14.582 10.111 1001 H GLN 133 H GLN 133 11.714 -7.257 8.806 1002 HA GLN 133 HA GLN 133 13.293 -5.912 10.847 1003 HB2 GLN 133 HB2 GLN 133 13.702 -6.213 7.875 1004 HB3 GLN 133 HB3 GLN 133 14.573 -5.001 8.824 1005 HG2 GLN 133 HG2 GLN 133 15.681 -6.595 10.094 1006 HG3 GLN 133 HG3 GLN 133 14.535 -7.855 9.691 1007 HE21 GLN 133 HE21 GLN 133 14.787 -9.000 7.911 1008 HE22 GLN 133 HE22 GLN 133 16.188 -8.975 6.904 1009 H ALA 134 H ALA 134 10.533 -5.851 10.220 1010 HA ALA 134 HA ALA 134 9.532 -3.591 8.986 1011 HB1 ALA 134 HB1 ALA 134 8.470 -4.914 11.478 1012 HB2 ALA 134 HB2 ALA 134 8.148 -5.437 9.825 1013 HB3 ALA 134 HB3 ALA 134 7.560 -3.871 10.388 1014 H ARG 135 H ARG 135 11.167 -3.880 12.010 1015 HA ARG 135 HA ARG 135 10.455 -1.566 13.385 1016 HB2 ARG 135 HB2 ARG 135 13.199 -2.829 13.149 1017 HB3 ARG 135 HB3 ARG 135 12.739 -1.652 14.364 1018 HG2 ARG 135 HG2 ARG 135 11.450 -4.356 14.061 1019 HG3 ARG 135 HG3 ARG 135 12.793 -4.017 15.147 1020 HD2 ARG 135 HD2 ARG 135 10.127 -2.611 15.233 1021 HD3 ARG 135 HD3 ARG 135 10.563 -3.973 16.264 1022 HE ARG 135 HE ARG 135 12.257 -1.600 16.289 1023 HH11 ARG 135 HH11 ARG 135 9.858 -3.573 18.004 1024 HH12 ARG 135 HH12 ARG 135 10.132 -2.836 19.502 1025 HH21 ARG 135 HH21 ARG 135 12.619 -0.590 18.329 1026 HH22 ARG 135 HH22 ARG 135 11.729 -1.073 19.690 1027 H GLU 136 H GLU 136 12.969 -2.020 10.888 1028 HA GLU 136 HA GLU 136 13.743 0.712 10.870 1029 HB2 GLU 136 HB2 GLU 136 14.311 -1.572 9.001 1030 HB3 GLU 136 HB3 GLU 136 14.898 0.059 8.706 1031 HG2 GLU 136 HG2 GLU 136 15.513 -1.639 11.107 1032 HG3 GLU 136 HG3 GLU 136 16.604 -1.288 9.762 1033 H VAL 137 H VAL 137 11.382 -1.147 9.231 1034 HA VAL 137 HA VAL 137 10.952 0.637 7.060 1035 HB VAL 137 HB VAL 137 9.071 -1.433 8.226 1036 HG11 VAL 137 HG11 VAL 137 7.874 0.188 6.841 1037 HG12 VAL 137 HG12 VAL 137 7.958 -1.379 6.037 1038 HG13 VAL 137 HG13 VAL 137 9.019 -0.067 5.526 1039 HG21 VAL 137 HG21 VAL 137 9.899 -2.855 6.377 1040 HG22 VAL 137 HG22 VAL 137 11.166 -2.414 7.523 1041 HG23 VAL 137 HG23 VAL 137 11.053 -1.594 5.967 1042 H VAL 138 H VAL 138 9.270 0.123 10.140 1043 HA VAL 138 HA VAL 138 7.428 2.234 9.799 1044 HB VAL 138 HB VAL 138 8.495 1.114 12.421 1045 HG11 VAL 138 HG11 VAL 138 5.993 2.718 11.863 1046 HG12 VAL 138 HG12 VAL 138 7.418 3.279 12.739 1047 HG13 VAL 138 HG13 VAL 138 6.416 1.995 13.415 1048 HG21 VAL 138 HG21 VAL 138 6.449 -0.255 12.438 1049 HG22 VAL 138 HG22 VAL 138 7.473 -0.624 11.049 1050 HG23 VAL 138 HG23 VAL 138 6.030 0.369 10.843 1051 H ARG 139 H ARG 139 10.604 2.068 11.270 1052 HA ARG 139 HA ARG 139 10.874 4.660 12.280 1053 HB2 ARG 139 HB2 ARG 139 12.410 2.773 12.686 1054 HB3 ARG 139 HB3 ARG 139 12.939 2.856 11.021 1055 HG2 ARG 139 HG2 ARG 139 13.840 5.121 11.470 1056 HG3 ARG 139 HG3 ARG 139 13.402 4.911 13.172 1057 HD2 ARG 139 HD2 ARG 139 14.766 2.852 13.224 1058 HD3 ARG 139 HD3 ARG 139 15.283 3.183 11.574 1059 HE ARG 139 HE ARG 139 15.766 5.324 13.416 1060 HH11 ARG 139 HH11 ARG 139 17.152 2.392 11.919 1061 HH12 ARG 139 HH12 ARG 139 18.729 2.741 12.450 1062 HH21 ARG 139 HH21 ARG 139 17.923 5.777 14.088 1063 HH22 ARG 139 HH22 ARG 139 19.200 4.705 13.710 1064 H ARG 140 H ARG 140 11.596 3.311 9.099 1065 HA ARG 140 HA ARG 140 12.709 5.581 7.863 1066 HB2 ARG 140 HB2 ARG 140 12.602 3.022 7.221 1067 HB3 ARG 140 HB3 ARG 140 11.147 3.505 6.378 1068 HG2 ARG 140 HG2 ARG 140 13.008 3.435 4.857 1069 HG3 ARG 140 HG3 ARG 140 12.471 5.105 5.057 1070 HD2 ARG 140 HD2 ARG 140 14.980 4.729 5.086 1071 HD3 ARG 140 HD3 ARG 140 14.320 5.644 6.438 1072 HE ARG 140 HE ARG 140 14.546 3.665 7.800 1073 HH11 ARG 140 HH11 ARG 140 16.258 3.386 4.658 1074 HH12 ARG 140 HH12 ARG 140 17.468 2.406 5.301 1075 HH21 ARG 140 HH21 ARG 140 16.296 2.235 8.636 1076 HH22 ARG 140 HH22 ARG 140 17.478 1.750 7.528 1077 H ALA 141 H ALA 141 9.435 4.316 8.151 1078 HA ALA 141 HA ALA 141 8.120 6.093 6.415 1079 HB1 ALA 141 HB1 ALA 141 6.091 5.292 7.596 1080 HB2 ALA 141 HB2 ALA 141 7.130 4.505 8.779 1081 HB3 ALA 141 HB3 ALA 141 7.157 3.978 7.098 1082 H GLN 142 H GLN 142 8.677 6.100 9.904 1083 HA GLN 142 HA GLN 142 7.268 8.437 10.593 1084 HB2 GLN 142 HB2 GLN 142 9.802 7.357 11.829 1085 HB3 GLN 142 HB3 GLN 142 8.734 8.544 12.554 1086 HG2 GLN 142 HG2 GLN 142 6.985 6.924 12.763 1087 HG3 GLN 142 HG3 GLN 142 7.931 5.733 11.869 1088 HE21 GLN 142 HE21 GLN 142 6.857 5.631 14.555 1089 HE22 GLN 142 HE22 GLN 142 8.203 5.341 15.598 1090 H ALA 143 H ALA 143 10.649 7.932 9.807 1091 HA ALA 143 HA ALA 143 11.431 10.642 9.963 1092 HB1 ALA 143 HB1 ALA 143 12.791 8.337 8.578 1093 HB2 ALA 143 HB2 ALA 143 12.990 8.778 10.271 1094 HB3 ALA 143 HB3 ALA 143 13.534 9.878 9.001 1095 H MET 144 H MET 144 9.844 8.869 7.534 1096 HA MET 144 HA MET 144 10.742 10.502 5.333 1097 HB2 MET 144 HB2 MET 144 10.023 8.094 5.097 1098 HB3 MET 144 HB3 MET 144 8.387 8.617 5.436 1099 HG2 MET 144 HG2 MET 144 8.653 8.341 3.076 1100 HG3 MET 144 HG3 MET 144 8.448 10.053 3.436 1101 HE1 MET 144 HE1 MET 144 11.738 7.859 3.915 1102 HE2 MET 144 HE2 MET 144 12.513 8.107 2.354 1103 HE3 MET 144 HE3 MET 144 10.993 7.218 2.449 1104 H ALA 145 H ALA 145 7.929 10.232 7.395 1105 HA ALA 145 HA ALA 145 6.479 12.293 5.968 1106 HB1 ALA 145 HB1 ALA 145 5.307 10.349 6.860 1107 HB2 ALA 145 HB2 ALA 145 4.692 11.846 7.571 1108 HB3 ALA 145 HB3 ALA 145 5.777 10.811 8.493 1109 H TYR 146 H TYR 146 7.919 11.889 9.202 1110 HA TYR 146 HA TYR 146 7.676 14.767 9.549 1111 HB2 TYR 146 HB2 TYR 146 7.444 12.561 11.610 1112 HB3 TYR 146 HB3 TYR 146 7.655 14.258 12.026 1113 HD1 TYR 146 HD1 TYR 146 5.323 11.760 10.679 1114 HD2 TYR 146 HD2 TYR 146 5.867 15.848 11.708 1115 HE1 TYR 146 HE1 TYR 146 2.896 12.118 10.520 1116 HE2 TYR 146 HE2 TYR 146 3.446 16.214 11.564 1117 HH TYR 146 HH TYR 146 1.210 13.725 11.456 Start of MODEL 28 1 H MET 1 H MET 1 -36.487 40.046 4.166 2 HA MET 1 HA MET 1 -34.401 40.825 3.413 3 HB2 MET 1 HB2 MET 1 -33.918 41.386 6.356 4 HB3 MET 1 HB3 MET 1 -32.683 41.442 5.110 5 HG2 MET 1 HG2 MET 1 -33.873 43.305 4.035 6 HG3 MET 1 HG3 MET 1 -35.102 43.212 5.294 7 HE1 MET 1 HE1 MET 1 -30.717 44.441 6.136 8 HE2 MET 1 HE2 MET 1 -31.309 43.982 4.540 9 HE3 MET 1 HE3 MET 1 -31.196 42.775 5.820 10 HA PRO 2 HA PRO 2 -33.701 36.553 4.240 11 HB2 PRO 2 HB2 PRO 2 -31.262 36.246 3.039 12 HB3 PRO 2 HB3 PRO 2 -32.781 36.331 2.148 13 HG2 PRO 2 HG2 PRO 2 -30.759 38.480 2.628 14 HG3 PRO 2 HG3 PRO 2 -31.665 38.103 1.155 15 HD2 PRO 2 HD2 PRO 2 -32.345 40.119 2.816 16 HD3 PRO 2 HD3 PRO 2 -33.553 39.214 1.881 17 H GLY 3 H GLY 3 -32.410 35.201 5.481 18 HA2 GLY 3 HA2 GLY 3 -30.138 36.161 6.924 19 HA3 GLY 3 HA3 GLY 3 -31.594 35.972 7.906 20 H ARG 4 H ARG 4 -28.938 34.415 6.784 21 HA ARG 4 HA ARG 4 -30.074 31.893 6.215 22 HB2 ARG 4 HB2 ARG 4 -27.236 32.676 6.816 23 HB3 ARG 4 HB3 ARG 4 -27.729 31.052 6.367 24 HG2 ARG 4 HG2 ARG 4 -28.580 31.933 4.235 25 HG3 ARG 4 HG3 ARG 4 -27.993 33.536 4.689 26 HD2 ARG 4 HD2 ARG 4 -26.395 32.455 3.231 27 HD3 ARG 4 HD3 ARG 4 -25.715 32.633 4.845 28 HE ARG 4 HE ARG 4 -26.769 30.147 4.904 29 HH11 ARG 4 HH11 ARG 4 -24.421 31.770 2.796 30 HH12 ARG 4 HH12 ARG 4 -23.664 30.337 2.292 31 HH21 ARG 4 HH21 ARG 4 -25.681 28.130 4.201 32 HH22 ARG 4 HH22 ARG 4 -24.416 28.247 3.065 33 H ALA 5 H ALA 5 -30.240 30.133 7.399 34 HA ALA 5 HA ALA 5 -29.969 30.373 10.286 35 HB1 ALA 5 HB1 ALA 5 -31.146 28.186 8.545 36 HB2 ALA 5 HB2 ALA 5 -32.058 29.419 9.413 37 HB3 ALA 5 HB3 ALA 5 -31.159 28.192 10.309 38 HA PRO 6 HA PRO 6 -25.924 28.558 9.308 39 HB2 PRO 6 HB2 PRO 6 -25.411 28.983 12.172 40 HB3 PRO 6 HB3 PRO 6 -24.550 29.639 10.776 41 HG2 PRO 6 HG2 PRO 6 -26.100 31.195 12.311 42 HG3 PRO 6 HG3 PRO 6 -26.001 31.419 10.554 43 HD2 PRO 6 HD2 PRO 6 -28.117 30.042 12.168 44 HD3 PRO 6 HD3 PRO 6 -28.279 31.203 10.828 45 H GLY 7 H GLY 7 -25.391 26.499 9.336 46 HA2 GLY 7 HA2 GLY 7 -26.783 24.699 11.115 47 HA3 GLY 7 HA3 GLY 7 -25.758 24.255 9.755 48 H SER 8 H SER 8 -23.932 23.349 10.289 49 HA SER 8 HA SER 8 -22.264 24.470 12.310 50 HB2 SER 8 HB2 SER 8 -23.799 22.808 13.520 51 HB3 SER 8 HB3 SER 8 -23.116 21.556 12.490 52 HG SER 8 HG SER 8 -21.452 23.238 13.961 53 H THR 9 H THR 9 -20.088 23.453 12.036 54 HA THR 9 HA THR 9 -19.472 22.963 9.348 55 HB THR 9 HB THR 9 -17.814 22.267 11.785 56 HG1 THR 9 HG1 THR 9 -18.542 24.729 10.621 57 HG21 THR 9 HG21 THR 9 -17.068 23.180 8.989 58 HG22 THR 9 HG22 THR 9 -16.924 21.532 9.600 59 HG23 THR 9 HG23 THR 9 -15.930 22.818 10.289 60 H LEU 10 H LEU 10 -19.545 21.090 8.270 61 HA LEU 10 HA LEU 10 -20.833 18.836 9.323 62 HB2 LEU 10 HB2 LEU 10 -19.207 19.081 6.814 63 HB3 LEU 10 HB3 LEU 10 -20.246 17.725 7.207 64 HG LEU 10 HG LEU 10 -21.114 20.562 6.660 65 HD11 LEU 10 HD11 LEU 10 -20.455 19.347 4.676 66 HD12 LEU 10 HD12 LEU 10 -22.206 19.568 4.707 67 HD13 LEU 10 HD13 LEU 10 -21.503 18.006 5.132 68 HD21 LEU 10 HD21 LEU 10 -22.776 18.140 7.366 69 HD22 LEU 10 HD22 LEU 10 -23.405 19.697 6.825 70 HD23 LEU 10 HD23 LEU 10 -22.554 19.583 8.362 71 H ALA 11 H ALA 11 -20.179 16.831 9.722 72 HA ALA 11 HA ALA 11 -17.506 16.508 10.783 73 HB1 ALA 11 HB1 ALA 11 -19.394 15.647 12.072 74 HB2 ALA 11 HB2 ALA 11 -18.366 14.314 11.500 75 HB3 ALA 11 HB3 ALA 11 -19.881 14.661 10.686 76 H ARG 12 H ARG 12 -15.935 15.430 9.697 77 HA ARG 12 HA ARG 12 -16.747 14.173 7.188 78 HB2 ARG 12 HB2 ARG 12 -14.140 15.562 7.830 79 HB3 ARG 12 HB3 ARG 12 -14.494 14.705 6.341 80 HG2 ARG 12 HG2 ARG 12 -16.001 17.129 7.298 81 HG3 ARG 12 HG3 ARG 12 -14.632 17.196 6.191 82 HD2 ARG 12 HD2 ARG 12 -16.616 17.337 4.866 83 HD3 ARG 12 HD3 ARG 12 -15.982 15.712 4.642 84 HE ARG 12 HE ARG 12 -17.823 15.510 6.683 85 HH11 ARG 12 HH11 ARG 12 -17.981 16.535 3.277 86 HH12 ARG 12 HH12 ARG 12 -19.606 16.084 3.104 87 HH21 ARG 12 HH21 ARG 12 -20.029 14.904 6.400 88 HH22 ARG 12 HH22 ARG 12 -20.783 15.156 4.896 89 H VAL 13 H VAL 13 -16.026 12.237 6.754 90 HA VAL 13 HA VAL 13 -14.439 10.906 8.777 91 HB VAL 13 HB VAL 13 -15.556 8.763 8.008 92 HG11 VAL 13 HG11 VAL 13 -17.658 9.193 9.239 93 HG12 VAL 13 HG12 VAL 13 -17.320 10.927 9.158 94 HG13 VAL 13 HG13 VAL 13 -16.246 9.861 10.059 95 HG21 VAL 13 HG21 VAL 13 -17.432 10.689 6.622 96 HG22 VAL 13 HG22 VAL 13 -17.705 8.959 6.826 97 HG23 VAL 13 HG23 VAL 13 -16.369 9.527 5.821 98 H GLY 14 H GLY 14 -12.710 10.001 8.194 99 HA2 GLY 14 HA2 GLY 14 -11.846 10.380 5.411 100 HA3 GLY 14 HA3 GLY 14 -10.776 10.394 6.796 101 H SER 15 H SER 15 -12.381 8.490 4.445 102 HA SER 15 HA SER 15 -11.052 6.077 5.361 103 HB2 SER 15 HB2 SER 15 -12.507 5.198 3.354 104 HB3 SER 15 HB3 SER 15 -13.287 5.579 4.892 105 HG SER 15 HG SER 15 -13.401 6.957 2.441 106 H ILE 16 H ILE 16 -9.726 4.937 3.657 107 HA ILE 16 HA ILE 16 -8.278 6.995 2.226 108 HB ILE 16 HB ILE 16 -7.619 4.049 2.505 109 HG12 ILE 16 HG12 ILE 16 -7.607 5.102 4.694 110 HG13 ILE 16 HG13 ILE 16 -5.954 4.787 4.196 111 HG21 ILE 16 HG21 ILE 16 -5.341 4.709 1.815 112 HG22 ILE 16 HG22 ILE 16 -5.910 6.357 1.562 113 HG23 ILE 16 HG23 ILE 16 -6.536 5.047 0.563 114 HD11 ILE 16 HD11 ILE 16 -7.371 7.449 4.144 115 HD12 ILE 16 HD12 ILE 16 -5.722 7.166 3.567 116 HD13 ILE 16 HD13 ILE 16 -6.117 6.938 5.272 117 HA PRO 17 HA PRO 17 -10.246 5.746 -1.630 118 HB2 PRO 17 HB2 PRO 17 -9.149 7.721 -3.138 119 HB3 PRO 17 HB3 PRO 17 -10.547 7.992 -2.100 120 HG2 PRO 17 HG2 PRO 17 -7.698 8.736 -1.673 121 HG3 PRO 17 HG3 PRO 17 -9.167 9.580 -1.172 122 HD2 PRO 17 HD2 PRO 17 -7.579 8.014 0.469 123 HD3 PRO 17 HD3 PRO 17 -9.264 8.456 0.796 124 H ALA 18 H ALA 18 -9.330 5.072 -3.786 125 HA ALA 18 HA ALA 18 -6.703 3.917 -3.396 126 HB1 ALA 18 HB1 ALA 18 -8.537 3.624 -5.790 127 HB2 ALA 18 HB2 ALA 18 -8.505 2.545 -4.392 128 HB3 ALA 18 HB3 ALA 18 -7.080 2.692 -5.421 129 H GLY 19 H GLY 19 -4.884 4.523 -4.444 130 HA2 GLY 19 HA2 GLY 19 -5.139 6.993 -6.008 131 HA3 GLY 19 HA3 GLY 19 -3.763 6.574 -5.008 132 H ASP 20 H ASP 20 -2.119 6.468 -6.330 133 HA ASP 20 HA ASP 20 -2.465 5.404 -9.021 134 HB2 ASP 20 HB2 ASP 20 -1.633 7.653 -8.944 135 HB3 ASP 20 HB3 ASP 20 -0.375 7.196 -7.804 136 H ASP 21 H ASP 21 -1.728 3.569 -9.565 137 HA ASP 21 HA ASP 21 -0.397 1.852 -7.727 138 HB2 ASP 21 HB2 ASP 21 -2.042 1.044 -9.413 139 HB3 ASP 21 HB3 ASP 21 -0.913 1.459 -10.695 140 H VAL 22 H VAL 22 1.680 1.514 -7.484 141 HA VAL 22 HA VAL 22 3.560 3.027 -9.155 142 HB VAL 22 HB VAL 22 3.868 2.041 -6.292 143 HG11 VAL 22 HG11 VAL 22 5.976 3.301 -6.219 144 HG12 VAL 22 HG12 VAL 22 5.813 3.685 -7.932 145 HG13 VAL 22 HG13 VAL 22 6.054 2.013 -7.424 146 HG21 VAL 22 HG21 VAL 22 2.368 3.962 -6.613 147 HG22 VAL 22 HG22 VAL 22 3.674 4.835 -7.395 148 HG23 VAL 22 HG23 VAL 22 3.813 4.394 -5.691 149 H LEU 23 H LEU 23 2.622 -0.186 -8.477 150 HA LEU 23 HA LEU 23 5.235 -1.042 -9.382 151 HB2 LEU 23 HB2 LEU 23 4.530 -3.395 -8.618 152 HB3 LEU 23 HB3 LEU 23 4.936 -2.219 -7.394 153 HG LEU 23 HG LEU 23 2.526 -1.935 -6.895 154 HD11 LEU 23 HD11 LEU 23 1.617 -2.498 -9.079 155 HD12 LEU 23 HD12 LEU 23 0.907 -3.490 -7.805 156 HD13 LEU 23 HD13 LEU 23 2.140 -4.169 -8.870 157 HD21 LEU 23 HD21 LEU 23 3.480 -4.785 -6.837 158 HD22 LEU 23 HD22 LEU 23 2.168 -4.113 -5.863 159 HD23 LEU 23 HD23 LEU 23 3.821 -3.537 -5.640 160 H ASP 24 H ASP 24 5.028 -3.273 -10.612 161 HA ASP 24 HA ASP 24 3.664 -2.505 -13.039 162 HB2 ASP 24 HB2 ASP 24 5.418 -4.916 -12.461 163 HB3 ASP 24 HB3 ASP 24 4.689 -4.581 -14.018 164 HA PRO 25 HA PRO 25 0.007 -4.933 -12.518 165 HB2 PRO 25 HB2 PRO 25 0.341 -5.803 -15.332 166 HB3 PRO 25 HB3 PRO 25 -1.028 -4.988 -14.565 167 HG2 PRO 25 HG2 PRO 25 0.579 -3.650 -16.204 168 HG3 PRO 25 HG3 PRO 25 -0.028 -2.891 -14.721 169 HD2 PRO 25 HD2 PRO 25 2.658 -4.079 -15.282 170 HD3 PRO 25 HD3 PRO 25 2.236 -2.578 -14.427 171 H ASP 26 H ASP 26 2.885 -6.342 -13.830 172 HA ASP 26 HA ASP 26 1.958 -9.066 -13.622 173 HB2 ASP 26 HB2 ASP 26 4.756 -8.042 -14.114 174 HB3 ASP 26 HB3 ASP 26 4.194 -9.694 -14.344 175 H GLU 27 H GLU 27 3.086 -6.796 -11.449 176 HA GLU 27 HA GLU 27 4.573 -8.551 -9.736 177 HB2 GLU 27 HB2 GLU 27 3.420 -5.790 -9.361 178 HB3 GLU 27 HB3 GLU 27 4.277 -6.626 -8.076 179 HG2 GLU 27 HG2 GLU 27 5.394 -5.916 -10.769 180 HG3 GLU 27 HG3 GLU 27 5.703 -5.039 -9.267 181 HA PRO 28 HA PRO 28 1.346 -10.554 -7.583 182 HB2 PRO 28 HB2 PRO 28 2.137 -10.337 -4.949 183 HB3 PRO 28 HB3 PRO 28 2.826 -11.476 -6.100 184 HG2 PRO 28 HG2 PRO 28 3.841 -8.787 -5.288 185 HG3 PRO 28 HG3 PRO 28 4.731 -10.315 -5.460 186 HD2 PRO 28 HD2 PRO 28 4.834 -8.472 -7.370 187 HD3 PRO 28 HD3 PRO 28 4.719 -10.189 -7.789 188 H THR 29 H THR 29 -0.569 -9.588 -7.673 189 HA THR 29 HA THR 29 -1.158 -7.569 -5.673 190 HB THR 29 HB THR 29 -2.758 -6.616 -7.499 191 HG1 THR 29 HG1 THR 29 -2.474 -7.950 -9.181 192 HG21 THR 29 HG21 THR 29 -0.989 -5.059 -8.254 193 HG22 THR 29 HG22 THR 29 0.227 -6.141 -7.578 194 HG23 THR 29 HG23 THR 29 -0.932 -5.337 -6.515 195 H TYR 30 H TYR 30 -3.515 -7.255 -5.442 196 HA TYR 30 HA TYR 30 -5.055 -9.665 -5.855 197 HB2 TYR 30 HB2 TYR 30 -4.737 -8.111 -3.293 198 HB3 TYR 30 HB3 TYR 30 -6.152 -9.107 -3.630 199 HD1 TYR 30 HD1 TYR 30 -5.132 -11.499 -4.805 200 HD2 TYR 30 HD2 TYR 30 -3.440 -9.144 -1.702 201 HE1 TYR 30 HE1 TYR 30 -3.951 -13.475 -3.968 202 HE2 TYR 30 HE2 TYR 30 -2.256 -11.113 -0.846 203 HH TYR 30 HH TYR 30 -1.958 -13.965 -2.657 204 H ASP 31 H ASP 31 -7.329 -9.195 -5.571 205 HA ASP 31 HA ASP 31 -8.070 -6.549 -6.608 206 HB2 ASP 31 HB2 ASP 31 -8.951 -9.269 -7.677 207 HB3 ASP 31 HB3 ASP 31 -9.568 -7.723 -8.219 208 H LEU 32 H LEU 32 -10.471 -6.360 -6.281 209 HA LEU 32 HA LEU 32 -11.080 -6.756 -3.640 210 HB2 LEU 32 HB2 LEU 32 -13.042 -6.340 -5.895 211 HB3 LEU 32 HB3 LEU 32 -13.448 -6.201 -4.200 212 HG LEU 32 HG LEU 32 -11.493 -4.449 -5.697 213 HD11 LEU 32 HD11 LEU 32 -13.154 -2.691 -5.361 214 HD12 LEU 32 HD12 LEU 32 -14.243 -3.864 -4.621 215 HD13 LEU 32 HD13 LEU 32 -13.803 -4.022 -6.322 216 HD21 LEU 32 HD21 LEU 32 -10.810 -4.696 -3.370 217 HD22 LEU 32 HD22 LEU 32 -12.447 -4.316 -2.834 218 HD23 LEU 32 HD23 LEU 32 -11.475 -3.090 -3.644 219 HA PRO 33 HA PRO 33 -13.790 -10.662 -4.374 220 HB2 PRO 33 HB2 PRO 33 -13.349 -12.093 -6.659 221 HB3 PRO 33 HB3 PRO 33 -14.636 -10.893 -6.507 222 HG2 PRO 33 HG2 PRO 33 -11.913 -10.596 -7.724 223 HG3 PRO 33 HG3 PRO 33 -13.483 -10.033 -8.335 224 HD2 PRO 33 HD2 PRO 33 -11.783 -8.370 -7.112 225 HD3 PRO 33 HD3 PRO 33 -13.541 -8.233 -6.888 226 H ARG 34 H ARG 34 -10.514 -10.497 -5.678 227 HA ARG 34 HA ARG 34 -9.774 -13.154 -5.045 228 HB2 ARG 34 HB2 ARG 34 -8.698 -11.455 -6.701 229 HB3 ARG 34 HB3 ARG 34 -7.848 -10.885 -5.272 230 HG2 ARG 34 HG2 ARG 34 -6.426 -12.420 -6.410 231 HG3 ARG 34 HG3 ARG 34 -6.997 -13.194 -4.930 232 HD2 ARG 34 HD2 ARG 34 -8.640 -14.430 -6.137 233 HD3 ARG 34 HD3 ARG 34 -8.275 -13.553 -7.619 234 HE ARG 34 HE ARG 34 -6.127 -15.060 -6.371 235 HH11 ARG 34 HH11 ARG 34 -8.458 -14.850 -9.016 236 HH12 ARG 34 HH12 ARG 34 -7.890 -16.218 -9.846 237 HH21 ARG 34 HH21 ARG 34 -5.273 -16.909 -7.534 238 HH22 ARG 34 HH22 ARG 34 -6.037 -17.452 -8.955 239 H VAL 35 H VAL 35 -9.510 -10.043 -3.373 240 HA VAL 35 HA VAL 35 -7.946 -11.048 -1.215 241 HB VAL 35 HB VAL 35 -9.827 -8.655 -1.129 242 HG11 VAL 35 HG11 VAL 35 -7.447 -9.319 0.601 243 HG12 VAL 35 HG12 VAL 35 -9.140 -9.394 1.084 244 HG13 VAL 35 HG13 VAL 35 -8.403 -7.839 0.688 245 HG21 VAL 35 HG21 VAL 35 -8.194 -8.427 -2.932 246 HG22 VAL 35 HG22 VAL 35 -6.894 -8.703 -1.773 247 HG23 VAL 35 HG23 VAL 35 -7.907 -7.265 -1.637 248 H ALA 36 H ALA 36 -11.351 -10.598 -1.786 249 HA ALA 36 HA ALA 36 -12.342 -11.421 0.687 250 HB1 ALA 36 HB1 ALA 36 -13.565 -11.782 -2.056 251 HB2 ALA 36 HB2 ALA 36 -13.713 -10.346 -1.042 252 HB3 ALA 36 HB3 ALA 36 -14.419 -11.873 -0.515 253 H GLU 37 H GLU 37 -11.330 -13.151 -2.150 254 HA GLU 37 HA GLU 37 -12.184 -15.728 -1.432 255 HB2 GLU 37 HB2 GLU 37 -11.334 -14.709 -3.690 256 HB3 GLU 37 HB3 GLU 37 -9.773 -15.169 -3.084 257 HG2 GLU 37 HG2 GLU 37 -10.669 -16.916 -4.523 258 HG3 GLU 37 HG3 GLU 37 -10.422 -17.482 -2.869 259 H LEU 38 H LEU 38 -9.123 -14.007 -1.139 260 HA LEU 38 HA LEU 38 -7.510 -16.044 -0.101 261 HB2 LEU 38 HB2 LEU 38 -6.662 -13.987 -1.092 262 HB3 LEU 38 HB3 LEU 38 -7.346 -13.055 0.218 263 HG LEU 38 HG LEU 38 -5.810 -14.317 1.771 264 HD11 LEU 38 HD11 LEU 38 -3.822 -15.334 0.792 265 HD12 LEU 38 HD12 LEU 38 -4.504 -15.122 -0.818 266 HD13 LEU 38 HD13 LEU 38 -5.289 -16.202 0.340 267 HD21 LEU 38 HD21 LEU 38 -5.392 -12.017 1.103 268 HD22 LEU 38 HD22 LEU 38 -4.583 -12.578 -0.361 269 HD23 LEU 38 HD23 LEU 38 -3.878 -12.913 1.217 270 H LEU 39 H LEU 39 -9.241 -13.415 1.531 271 HA LEU 39 HA LEU 39 -8.409 -14.403 4.111 272 HB2 LEU 39 HB2 LEU 39 -10.134 -12.074 3.349 273 HB3 LEU 39 HB3 LEU 39 -9.656 -12.448 4.995 274 HG LEU 39 HG LEU 39 -7.813 -11.657 2.731 275 HD11 LEU 39 HD11 LEU 39 -9.172 -9.810 3.531 276 HD12 LEU 39 HD12 LEU 39 -7.490 -9.607 4.023 277 HD13 LEU 39 HD13 LEU 39 -8.688 -10.160 5.191 278 HD21 LEU 39 HD21 LEU 39 -6.071 -11.547 4.470 279 HD22 LEU 39 HD22 LEU 39 -6.688 -13.187 4.270 280 HD23 LEU 39 HD23 LEU 39 -7.209 -12.210 5.641 281 H GLY 40 H GLY 40 -11.093 -14.906 2.089 282 HA2 GLY 40 HA2 GLY 40 -12.908 -16.292 2.434 283 HA3 GLY 40 HA3 GLY 40 -12.259 -16.661 4.032 284 H VAL 41 H VAL 41 -12.835 -13.486 2.866 285 HA VAL 41 HA VAL 41 -15.112 -13.174 4.696 286 HB VAL 41 HB VAL 41 -14.305 -10.996 5.410 287 HG11 VAL 41 HG11 VAL 41 -13.475 -12.841 6.710 288 HG12 VAL 41 HG12 VAL 41 -12.283 -11.541 6.639 289 HG13 VAL 41 HG13 VAL 41 -12.074 -12.982 5.651 290 HG21 VAL 41 HG21 VAL 41 -11.985 -11.404 3.518 291 HG22 VAL 41 HG22 VAL 41 -12.094 -10.100 4.709 292 HG23 VAL 41 HG23 VAL 41 -13.259 -10.192 3.395 293 HA PRO 42 HA PRO 42 -16.955 -11.224 1.140 294 HB2 PRO 42 HB2 PRO 42 -18.388 -9.193 2.210 295 HB3 PRO 42 HB3 PRO 42 -18.883 -10.883 2.375 296 HG2 PRO 42 HG2 PRO 42 -17.388 -9.156 4.320 297 HG3 PRO 42 HG3 PRO 42 -18.761 -10.228 4.633 298 HD2 PRO 42 HD2 PRO 42 -16.268 -10.979 5.188 299 HD3 PRO 42 HD3 PRO 42 -17.445 -12.139 4.550 300 H VAL 43 H VAL 43 -16.873 -9.347 -0.179 301 HA VAL 43 HA VAL 43 -14.481 -7.852 -0.129 302 HB VAL 43 HB VAL 43 -17.056 -7.184 -1.588 303 HG11 VAL 43 HG11 VAL 43 -15.504 -5.309 -1.575 304 HG12 VAL 43 HG12 VAL 43 -15.602 -6.006 -3.194 305 HG13 VAL 43 HG13 VAL 43 -14.212 -6.352 -2.166 306 HG21 VAL 43 HG21 VAL 43 -16.349 -9.425 -2.094 307 HG22 VAL 43 HG22 VAL 43 -14.723 -8.860 -2.482 308 HG23 VAL 43 HG23 VAL 43 -16.089 -8.371 -3.490 309 H SER 44 H SER 44 -17.691 -7.295 1.033 310 HA SER 44 HA SER 44 -17.689 -4.626 1.644 311 HB2 SER 44 HB2 SER 44 -18.856 -6.894 3.226 312 HB3 SER 44 HB3 SER 44 -19.489 -5.234 3.110 313 HG SER 44 HG SER 44 -19.978 -5.617 0.973 314 H LYS 45 H LYS 45 -16.380 -7.409 3.529 315 HA LYS 45 HA LYS 45 -15.713 -5.855 5.826 316 HB2 LYS 45 HB2 LYS 45 -16.033 -8.411 5.772 317 HB3 LYS 45 HB3 LYS 45 -14.407 -8.468 5.087 318 HG2 LYS 45 HG2 LYS 45 -13.517 -7.379 7.066 319 HG3 LYS 45 HG3 LYS 45 -15.134 -7.311 7.764 320 HD2 LYS 45 HD2 LYS 45 -15.226 -9.795 7.622 321 HD3 LYS 45 HD3 LYS 45 -13.544 -9.779 7.090 322 HE2 LYS 45 HE2 LYS 45 -14.588 -8.755 9.734 323 HE3 LYS 45 HE3 LYS 45 -13.683 -10.243 9.473 324 HZ1 LYS 45 HZ1 LYS 45 -11.782 -8.891 8.749 325 HZ2 LYS 45 HZ2 LYS 45 -12.274 -8.484 10.306 326 HZ3 LYS 45 HZ3 LYS 45 -12.682 -7.488 9.033 327 H VAL 46 H VAL 46 -14.052 -6.871 2.942 328 HA VAL 46 HA VAL 46 -11.449 -5.965 3.579 329 HB VAL 46 HB VAL 46 -12.777 -6.048 0.848 330 HG11 VAL 46 HG11 VAL 46 -10.495 -6.205 -0.048 331 HG12 VAL 46 HG12 VAL 46 -9.857 -6.030 1.588 332 HG13 VAL 46 HG13 VAL 46 -10.760 -4.707 0.851 333 HG21 VAL 46 HG21 VAL 46 -11.140 -8.160 2.258 334 HG22 VAL 46 HG22 VAL 46 -11.714 -8.251 0.592 335 HG23 VAL 46 HG23 VAL 46 -12.870 -8.232 1.921 336 H ALA 47 H ALA 47 -14.217 -4.434 2.101 337 HA ALA 47 HA ALA 47 -13.090 -1.926 1.621 338 HB1 ALA 47 HB1 ALA 47 -15.981 -2.618 2.156 339 HB2 ALA 47 HB2 ALA 47 -15.182 -2.677 0.589 340 HB3 ALA 47 HB3 ALA 47 -15.395 -1.130 1.411 341 H GLN 48 H GLN 48 -14.561 -3.321 4.481 342 HA GLN 48 HA GLN 48 -14.838 -0.980 6.056 343 HB2 GLN 48 HB2 GLN 48 -14.128 -3.757 7.046 344 HB3 GLN 48 HB3 GLN 48 -14.723 -2.439 8.036 345 HG2 GLN 48 HG2 GLN 48 -16.233 -3.876 5.870 346 HG3 GLN 48 HG3 GLN 48 -16.453 -4.089 7.602 347 HE21 GLN 48 HE21 GLN 48 -18.342 -3.385 5.655 348 HE22 GLN 48 HE22 GLN 48 -18.993 -1.832 6.060 349 H GLN 49 H GLN 49 -12.194 -3.221 5.561 350 HA GLN 49 HA GLN 49 -10.334 -2.230 7.411 351 HB2 GLN 49 HB2 GLN 49 -9.690 -3.364 4.677 352 HB3 GLN 49 HB3 GLN 49 -8.638 -3.360 6.077 353 HG2 GLN 49 HG2 GLN 49 -11.235 -4.890 5.895 354 HG3 GLN 49 HG3 GLN 49 -9.653 -5.570 5.553 355 HE21 GLN 49 HE21 GLN 49 -9.978 -7.111 7.149 356 HE22 GLN 49 HE22 GLN 49 -9.830 -6.748 8.824 357 H LEU 50 H LEU 50 -10.892 -1.435 4.027 358 HA LEU 50 HA LEU 50 -8.884 0.505 3.717 359 HB2 LEU 50 HB2 LEU 50 -10.024 -0.673 1.871 360 HB3 LEU 50 HB3 LEU 50 -11.492 0.208 2.234 361 HG LEU 50 HG LEU 50 -10.341 2.317 1.631 362 HD11 LEU 50 HD11 LEU 50 -8.208 2.214 0.438 363 HD12 LEU 50 HD12 LEU 50 -8.086 0.492 0.796 364 HD13 LEU 50 HD13 LEU 50 -8.049 1.666 2.106 365 HD21 LEU 50 HD21 LEU 50 -10.315 1.909 -0.780 366 HD22 LEU 50 HD22 LEU 50 -11.699 1.139 -0.003 367 HD23 LEU 50 HD23 LEU 50 -10.307 0.170 -0.483 368 H ARG 51 H ARG 51 -12.218 0.713 4.817 369 HA ARG 51 HA ARG 51 -12.369 3.531 4.860 370 HB2 ARG 51 HB2 ARG 51 -14.029 1.356 5.965 371 HB3 ARG 51 HB3 ARG 51 -14.120 2.885 6.822 372 HG2 ARG 51 HG2 ARG 51 -15.891 2.788 5.230 373 HG3 ARG 51 HG3 ARG 51 -14.724 3.989 4.690 374 HD2 ARG 51 HD2 ARG 51 -13.764 2.185 3.209 375 HD3 ARG 51 HD3 ARG 51 -15.177 1.215 3.629 376 HE ARG 51 HE ARG 51 -15.588 3.890 2.576 377 HH11 ARG 51 HH11 ARG 51 -16.201 0.433 2.207 378 HH12 ARG 51 HH12 ARG 51 -16.819 0.566 0.624 379 HH21 ARG 51 HH21 ARG 51 -16.458 4.088 0.426 380 HH22 ARG 51 HH22 ARG 51 -16.957 2.704 -0.415 381 H GLU 52 H GLU 52 -11.126 1.213 7.159 382 HA GLU 52 HA GLU 52 -10.947 3.239 9.242 383 HB2 GLU 52 HB2 GLU 52 -9.901 0.407 9.241 384 HB3 GLU 52 HB3 GLU 52 -10.060 1.461 10.637 385 HG2 GLU 52 HG2 GLU 52 -12.300 0.296 8.993 386 HG3 GLU 52 HG3 GLU 52 -11.814 -0.181 10.615 387 H GLY 53 H GLY 53 -9.141 2.248 6.625 388 HA2 GLY 53 HA2 GLY 53 -7.041 2.933 5.911 389 HA3 GLY 53 HA3 GLY 53 -6.815 3.734 7.466 390 H HIS 54 H HIS 54 -7.798 0.444 7.225 391 HA HIS 54 HA HIS 54 -5.435 -0.450 8.688 392 HB2 HIS 54 HB2 HIS 54 -7.774 -1.113 9.345 393 HB3 HIS 54 HB3 HIS 54 -7.923 -1.965 7.820 394 HD1 HIS 54 HD1 HIS 54 -6.843 -4.342 7.705 395 HD2 HIS 54 HD2 HIS 54 -6.164 -2.332 11.278 396 HE1 HIS 54 HE1 HIS 54 -5.957 -6.057 9.309 397 H LEU 55 H LEU 55 -6.459 -0.111 5.542 398 HA LEU 55 HA LEU 55 -4.310 -1.611 4.416 399 HB2 LEU 55 HB2 LEU 55 -6.107 -3.324 4.672 400 HB3 LEU 55 HB3 LEU 55 -7.207 -2.282 3.803 401 HG LEU 55 HG LEU 55 -5.809 -2.540 1.771 402 HD11 LEU 55 HD11 LEU 55 -4.283 -4.531 3.445 403 HD12 LEU 55 HD12 LEU 55 -3.664 -3.010 2.796 404 HD13 LEU 55 HD13 LEU 55 -4.124 -4.313 1.703 405 HD21 LEU 55 HD21 LEU 55 -7.756 -3.963 2.128 406 HD22 LEU 55 HD22 LEU 55 -6.762 -5.114 3.018 407 HD23 LEU 55 HD23 LEU 55 -6.475 -4.847 1.299 408 H VAL 56 H VAL 56 -4.113 -0.908 2.076 409 HA VAL 56 HA VAL 56 -5.857 1.321 1.419 410 HB VAL 56 HB VAL 56 -3.994 2.547 0.398 411 HG11 VAL 56 HG11 VAL 56 -3.371 1.865 3.258 412 HG12 VAL 56 HG12 VAL 56 -4.552 3.045 2.722 413 HG13 VAL 56 HG13 VAL 56 -2.833 3.309 2.399 414 HG21 VAL 56 HG21 VAL 56 -2.525 0.703 -0.191 415 HG22 VAL 56 HG22 VAL 56 -2.218 0.383 1.516 416 HG23 VAL 56 HG23 VAL 56 -1.647 1.884 0.785 417 H ALA 57 H ALA 57 -5.964 1.709 -0.904 418 HA ALA 57 HA ALA 57 -5.512 -0.742 -2.448 419 HB1 ALA 57 HB1 ALA 57 -7.950 1.040 -2.430 420 HB2 ALA 57 HB2 ALA 57 -7.856 -0.596 -1.779 421 HB3 ALA 57 HB3 ALA 57 -7.686 -0.329 -3.512 422 H VAL 58 H VAL 58 -5.342 -0.301 -4.735 423 HA VAL 58 HA VAL 58 -4.843 2.494 -5.408 424 HB VAL 58 HB VAL 58 -2.882 1.864 -6.766 425 HG11 VAL 58 HG11 VAL 58 -2.763 1.073 -3.886 426 HG12 VAL 58 HG12 VAL 58 -2.574 2.690 -4.548 427 HG13 VAL 58 HG13 VAL 58 -1.351 1.443 -4.880 428 HG21 VAL 58 HG21 VAL 58 -3.215 -0.866 -5.507 429 HG22 VAL 58 HG22 VAL 58 -1.820 -0.343 -6.457 430 HG23 VAL 58 HG23 VAL 58 -3.403 -0.466 -7.214 431 H ARG 59 H ARG 59 -4.770 2.772 -7.833 432 HA ARG 59 HA ARG 59 -6.763 0.961 -9.025 433 HB2 ARG 59 HB2 ARG 59 -7.670 3.160 -8.271 434 HB3 ARG 59 HB3 ARG 59 -6.541 3.954 -9.349 435 HG2 ARG 59 HG2 ARG 59 -7.663 2.972 -11.278 436 HG3 ARG 59 HG3 ARG 59 -8.758 2.095 -10.202 437 HD2 ARG 59 HD2 ARG 59 -9.519 4.241 -9.268 438 HD3 ARG 59 HD3 ARG 59 -8.479 5.086 -10.409 439 HE ARG 59 HE ARG 59 -10.123 3.487 -11.915 440 HH11 ARG 59 HH11 ARG 59 -10.542 6.139 -9.593 441 HH12 ARG 59 HH12 ARG 59 -11.997 6.688 -10.272 442 HH21 ARG 59 HH21 ARG 59 -12.167 4.305 -12.872 443 HH22 ARG 59 HH22 ARG 59 -12.923 5.633 -12.133 444 H ARG 60 H ARG 60 -6.063 0.006 -10.740 445 HA ARG 60 HA ARG 60 -4.005 1.324 -12.381 446 HB2 ARG 60 HB2 ARG 60 -3.295 -0.960 -13.127 447 HB3 ARG 60 HB3 ARG 60 -3.003 -0.656 -11.425 448 HG2 ARG 60 HG2 ARG 60 -4.863 -2.030 -10.793 449 HG3 ARG 60 HG3 ARG 60 -5.383 -2.174 -12.472 450 HD2 ARG 60 HD2 ARG 60 -4.212 -4.193 -11.643 451 HD3 ARG 60 HD3 ARG 60 -3.411 -3.446 -13.019 452 HE ARG 60 HE ARG 60 -2.115 -2.327 -10.951 453 HH11 ARG 60 HH11 ARG 60 -2.938 -5.718 -11.468 454 HH12 ARG 60 HH12 ARG 60 -1.496 -6.299 -10.767 455 HH21 ARG 60 HH21 ARG 60 -0.243 -3.021 -10.130 456 HH22 ARG 60 HH22 ARG 60 0.180 -4.682 -10.020 457 H ALA 61 H ALA 61 -4.854 2.088 -14.103 458 HA ALA 61 HA ALA 61 -5.809 2.332 -16.115 459 HB1 ALA 61 HB1 ALA 61 -6.668 0.432 -17.391 460 HB2 ALA 61 HB2 ALA 61 -6.679 -0.558 -15.937 461 HB3 ALA 61 HB3 ALA 61 -5.147 -0.008 -16.608 462 H GLY 62 H GLY 62 -7.662 0.717 -13.817 463 HA2 GLY 62 HA2 GLY 62 -9.777 2.518 -13.623 464 HA3 GLY 62 HA3 GLY 62 -10.262 1.302 -14.797 465 H GLY 63 H GLY 63 -8.372 -0.576 -12.970 466 HA2 GLY 63 HA2 GLY 63 -10.630 -1.398 -11.320 467 HA3 GLY 63 HA3 GLY 63 -9.264 -2.386 -11.819 468 H VAL 64 H VAL 64 -10.460 -1.766 -9.218 469 HA VAL 64 HA VAL 64 -8.298 -0.383 -7.849 470 HB VAL 64 HB VAL 64 -10.964 -1.420 -6.808 471 HG11 VAL 64 HG11 VAL 64 -10.504 -0.079 -4.813 472 HG12 VAL 64 HG12 VAL 64 -8.917 0.343 -5.462 473 HG13 VAL 64 HG13 VAL 64 -9.285 -1.332 -5.050 474 HG21 VAL 64 HG21 VAL 64 -10.121 1.405 -7.462 475 HG22 VAL 64 HG22 VAL 64 -11.652 0.931 -6.727 476 HG23 VAL 64 HG23 VAL 64 -11.267 0.425 -8.373 477 H VAL 65 H VAL 65 -6.789 -1.516 -6.959 478 HA VAL 65 HA VAL 65 -7.168 -4.359 -6.374 479 HB VAL 65 HB VAL 65 -4.853 -4.749 -7.320 480 HG11 VAL 65 HG11 VAL 65 -5.591 -4.830 -9.659 481 HG12 VAL 65 HG12 VAL 65 -6.976 -3.813 -9.252 482 HG13 VAL 65 HG13 VAL 65 -6.837 -5.431 -8.564 483 HG21 VAL 65 HG21 VAL 65 -5.344 -2.066 -8.579 484 HG22 VAL 65 HG22 VAL 65 -3.996 -3.143 -8.949 485 HG23 VAL 65 HG23 VAL 65 -4.123 -2.409 -7.344 486 H ILE 66 H ILE 66 -5.388 -5.189 -5.106 487 HA ILE 66 HA ILE 66 -4.417 -3.219 -3.128 488 HB ILE 66 HB ILE 66 -5.185 -6.114 -2.672 489 HG12 ILE 66 HG12 ILE 66 -7.216 -4.784 -3.074 490 HG13 ILE 66 HG13 ILE 66 -7.140 -5.348 -1.414 491 HG21 ILE 66 HG21 ILE 66 -3.458 -5.405 -1.153 492 HG22 ILE 66 HG22 ILE 66 -4.976 -5.616 -0.275 493 HG23 ILE 66 HG23 ILE 66 -4.410 -3.996 -0.679 494 HD11 ILE 66 HD11 ILE 66 -7.960 -3.085 -1.518 495 HD12 ILE 66 HD12 ILE 66 -6.511 -2.584 -2.393 496 HD13 ILE 66 HD13 ILE 66 -6.387 -3.125 -0.718 497 HA PRO 67 HA PRO 67 -0.507 -5.155 -4.453 498 HB2 PRO 67 HB2 PRO 67 0.626 -3.952 -2.005 499 HB3 PRO 67 HB3 PRO 67 1.091 -3.688 -3.688 500 HG2 PRO 67 HG2 PRO 67 -0.190 -1.798 -2.280 501 HG3 PRO 67 HG3 PRO 67 -0.499 -2.033 -4.008 502 HD2 PRO 67 HD2 PRO 67 -2.130 -2.918 -1.656 503 HD3 PRO 67 HD3 PRO 67 -2.652 -2.232 -3.213 504 H GLN 68 H GLN 68 -0.190 -7.302 -4.080 505 HA GLN 68 HA GLN 68 -1.108 -8.664 -1.813 506 HB2 GLN 68 HB2 GLN 68 -1.059 -9.754 -3.870 507 HB3 GLN 68 HB3 GLN 68 0.627 -9.372 -4.136 508 HG2 GLN 68 HG2 GLN 68 1.264 -10.960 -2.410 509 HG3 GLN 68 HG3 GLN 68 -0.438 -11.306 -2.088 510 HE21 GLN 68 HE21 GLN 68 -1.215 -11.179 -4.921 511 HE22 GLN 68 HE22 GLN 68 -0.575 -12.607 -5.615 512 H VAL 69 H VAL 69 1.882 -7.190 -2.529 513 HA VAL 69 HA VAL 69 3.537 -8.530 -0.695 514 HB VAL 69 HB VAL 69 5.005 -6.501 -0.879 515 HG11 VAL 69 HG11 VAL 69 5.195 -8.378 -2.441 516 HG12 VAL 69 HG12 VAL 69 5.512 -6.843 -3.254 517 HG13 VAL 69 HG13 VAL 69 3.956 -7.650 -3.464 518 HG21 VAL 69 HG21 VAL 69 3.277 -4.810 -1.158 519 HG22 VAL 69 HG22 VAL 69 2.791 -5.540 -2.694 520 HG23 VAL 69 HG23 VAL 69 4.386 -4.800 -2.529 521 H PHE 70 H PHE 70 0.936 -6.469 -0.079 522 HA PHE 70 HA PHE 70 1.851 -5.419 2.444 523 HB2 PHE 70 HB2 PHE 70 -0.728 -5.371 0.909 524 HB3 PHE 70 HB3 PHE 70 -0.739 -4.979 2.619 525 HD1 PHE 70 HD1 PHE 70 1.735 -4.087 -0.051 526 HD2 PHE 70 HD2 PHE 70 -1.134 -2.755 2.768 527 HE1 PHE 70 HE1 PHE 70 2.359 -1.735 -0.525 528 HE2 PHE 70 HE2 PHE 70 -0.517 -0.436 2.340 529 HZ PHE 70 HZ PHE 70 1.189 0.100 0.695 530 H PHE 71 H PHE 71 0.946 -8.377 1.365 531 HA PHE 71 HA PHE 71 -0.140 -9.216 3.941 532 HB2 PHE 71 HB2 PHE 71 -0.376 -10.514 1.214 533 HB3 PHE 71 HB3 PHE 71 -0.959 -11.223 2.712 534 HD1 PHE 71 HD1 PHE 71 -1.487 -8.559 0.244 535 HD2 PHE 71 HD2 PHE 71 -2.983 -10.447 3.748 536 HE1 PHE 71 HE1 PHE 71 -3.644 -7.421 -0.065 537 HE2 PHE 71 HE2 PHE 71 -5.138 -9.315 3.444 538 HZ PHE 71 HZ PHE 71 -5.475 -7.796 1.537 539 H THR 72 H THR 72 0.692 -11.162 4.783 540 HA THR 72 HA THR 72 3.513 -11.506 4.485 541 HB THR 72 HB THR 72 3.124 -13.323 6.199 542 HG1 THR 72 HG1 THR 72 0.845 -12.946 7.115 543 HG21 THR 72 HG21 THR 72 1.884 -10.638 6.831 544 HG22 THR 72 HG22 THR 72 3.613 -10.997 6.876 545 HG23 THR 72 HG23 THR 72 2.518 -11.791 8.008 546 H ASN 73 H ASN 73 4.326 -13.885 4.411 547 HA ASN 73 HA ASN 73 3.811 -15.163 1.985 548 HB2 ASN 73 HB2 ASN 73 5.057 -16.089 4.573 549 HB3 ASN 73 HB3 ASN 73 4.843 -17.213 3.239 550 HD21 ASN 73 HD21 ASN 73 7.238 -15.847 4.632 551 HD22 ASN 73 HD22 ASN 73 8.169 -15.242 3.329 552 H SER 74 H SER 74 2.282 -15.508 5.111 553 HA SER 74 HA SER 74 0.755 -17.834 4.460 554 HB2 SER 74 HB2 SER 74 0.385 -15.873 6.717 555 HB3 SER 74 HB3 SER 74 -0.151 -17.553 6.651 556 HG SER 74 HG SER 74 1.907 -18.243 6.789 557 H GLY 75 H GLY 75 0.486 -14.701 3.414 558 HA2 GLY 75 HA2 GLY 75 -1.174 -13.665 2.218 559 HA3 GLY 75 HA3 GLY 75 -2.153 -15.111 2.421 560 H GLN 76 H GLN 76 -0.792 -13.352 5.085 561 HA GLN 76 HA GLN 76 -3.514 -12.440 5.797 562 HB2 GLN 76 HB2 GLN 76 -1.188 -12.996 7.634 563 HB3 GLN 76 HB3 GLN 76 -2.783 -12.466 8.125 564 HG2 GLN 76 HG2 GLN 76 -3.719 -14.565 7.290 565 HG3 GLN 76 HG3 GLN 76 -2.093 -15.090 6.839 566 HE21 GLN 76 HE21 GLN 76 -3.988 -16.216 8.739 567 HE22 GLN 76 HE22 GLN 76 -3.134 -16.303 10.233 568 H VAL 77 H VAL 77 -3.631 -10.368 6.868 569 HA VAL 77 HA VAL 77 -1.932 -8.400 5.771 570 HB VAL 77 HB VAL 77 -4.041 -8.294 7.970 571 HG11 VAL 77 HG11 VAL 77 -2.455 -6.012 6.814 572 HG12 VAL 77 HG12 VAL 77 -2.387 -6.571 8.488 573 HG13 VAL 77 HG13 VAL 77 -3.867 -5.835 7.859 574 HG21 VAL 77 HG21 VAL 77 -5.284 -7.006 6.321 575 HG22 VAL 77 HG22 VAL 77 -4.837 -8.592 5.673 576 HG23 VAL 77 HG23 VAL 77 -3.936 -7.139 5.201 577 H VAL 78 H VAL 78 -0.078 -7.601 6.496 578 HA VAL 78 HA VAL 78 1.348 -8.813 8.604 579 HB VAL 78 HB VAL 78 1.871 -6.080 7.368 580 HG11 VAL 78 HG11 VAL 78 3.179 -6.462 9.385 581 HG12 VAL 78 HG12 VAL 78 4.215 -6.487 7.959 582 HG13 VAL 78 HG13 VAL 78 3.752 -8.000 8.736 583 HG21 VAL 78 HG21 VAL 78 3.362 -7.213 5.794 584 HG22 VAL 78 HG22 VAL 78 1.701 -7.771 5.613 585 HG23 VAL 78 HG23 VAL 78 2.882 -8.774 6.457 586 H LYS 79 H LYS 79 1.398 -8.339 10.731 587 HA LYS 79 HA LYS 79 -0.593 -6.876 11.966 588 HB2 LYS 79 HB2 LYS 79 0.651 -7.193 14.056 589 HB3 LYS 79 HB3 LYS 79 0.545 -8.659 13.091 590 HG2 LYS 79 HG2 LYS 79 2.767 -8.159 12.213 591 HG3 LYS 79 HG3 LYS 79 2.875 -6.823 13.360 592 HD2 LYS 79 HD2 LYS 79 2.511 -9.751 14.090 593 HD3 LYS 79 HD3 LYS 79 4.020 -8.861 14.230 594 HE2 LYS 79 HE2 LYS 79 1.469 -8.227 15.728 595 HE3 LYS 79 HE3 LYS 79 2.847 -9.096 16.387 596 HZ1 LYS 79 HZ1 LYS 79 2.919 -6.819 17.052 597 HZ2 LYS 79 HZ2 LYS 79 2.876 -6.265 15.458 598 HZ3 LYS 79 HZ3 LYS 79 4.204 -7.125 16.033 599 H SER 80 H SER 80 2.473 -5.785 10.883 600 HA SER 80 HA SER 80 2.369 -3.296 12.351 601 HB2 SER 80 HB2 SER 80 4.294 -4.147 10.197 602 HB3 SER 80 HB3 SER 80 4.525 -2.897 11.424 603 HG SER 80 HG SER 80 4.175 -4.690 12.951 604 H LEU 81 H LEU 81 0.816 -4.415 9.604 605 HA LEU 81 HA LEU 81 1.324 -2.365 7.757 606 HB2 LEU 81 HB2 LEU 81 0.299 -4.507 7.103 607 HB3 LEU 81 HB3 LEU 81 -1.160 -4.070 7.971 608 HG LEU 81 HG LEU 81 -1.427 -2.127 6.453 609 HD11 LEU 81 HD11 LEU 81 0.832 -3.443 4.999 610 HD12 LEU 81 HD12 LEU 81 0.884 -1.865 5.808 611 HD13 LEU 81 HD13 LEU 81 -0.145 -2.107 4.393 612 HD21 LEU 81 HD21 LEU 81 -1.274 -4.838 5.169 613 HD22 LEU 81 HD22 LEU 81 -2.139 -3.446 4.513 614 HD23 LEU 81 HD23 LEU 81 -2.652 -4.148 6.040 615 HA PRO 82 HA PRO 82 -2.714 -0.146 9.420 616 HB2 PRO 82 HB2 PRO 82 -3.090 -0.687 12.137 617 HB3 PRO 82 HB3 PRO 82 -4.093 -1.320 10.826 618 HG2 PRO 82 HG2 PRO 82 -1.826 -2.609 12.279 619 HG3 PRO 82 HG3 PRO 82 -3.346 -3.320 11.708 620 HD2 PRO 82 HD2 PRO 82 -1.073 -3.732 10.397 621 HD3 PRO 82 HD3 PRO 82 -2.599 -3.470 9.521 622 H GLY 83 H GLY 83 -0.132 -1.086 11.602 623 HA2 GLY 83 HA2 GLY 83 0.158 1.338 13.003 624 HA3 GLY 83 HA3 GLY 83 1.397 0.103 12.835 625 H LEU 84 H LEU 84 1.855 0.143 10.091 626 HA LEU 84 HA LEU 84 3.420 2.494 9.912 627 HB2 LEU 84 HB2 LEU 84 4.304 1.687 7.866 628 HB3 LEU 84 HB3 LEU 84 4.035 0.278 8.854 629 HG LEU 84 HG LEU 84 1.770 0.211 7.434 630 HD11 LEU 84 HD11 LEU 84 2.184 2.236 6.178 631 HD12 LEU 84 HD12 LEU 84 2.159 0.846 5.103 632 HD13 LEU 84 HD13 LEU 84 3.696 1.575 5.558 633 HD21 LEU 84 HD21 LEU 84 4.470 -0.759 6.482 634 HD22 LEU 84 HD22 LEU 84 2.918 -1.367 5.907 635 HD23 LEU 84 HD23 LEU 84 3.391 -1.604 7.588 636 H LEU 85 H LEU 85 0.394 1.496 8.482 637 HA LEU 85 HA LEU 85 0.112 3.708 6.773 638 HB2 LEU 85 HB2 LEU 85 -2.005 1.984 8.046 639 HB3 LEU 85 HB3 LEU 85 -2.304 3.148 6.773 640 HG LEU 85 HG LEU 85 -0.542 0.708 6.505 641 HD11 LEU 85 HD11 LEU 85 -3.316 1.249 5.487 642 HD12 LEU 85 HD12 LEU 85 -2.872 0.121 6.768 643 HD13 LEU 85 HD13 LEU 85 -2.332 -0.168 5.108 644 HD21 LEU 85 HD21 LEU 85 -0.611 1.233 4.102 645 HD22 LEU 85 HD22 LEU 85 0.161 2.520 5.028 646 HD23 LEU 85 HD23 LEU 85 -1.493 2.717 4.463 647 H THR 86 H THR 86 -0.681 3.220 10.110 648 HA THR 86 HA THR 86 -2.142 5.625 10.400 649 HB THR 86 HB THR 86 -0.725 4.038 12.568 650 HG1 THR 86 HG1 THR 86 -2.799 3.507 11.050 651 HG21 THR 86 HG21 THR 86 -2.291 5.149 14.111 652 HG22 THR 86 HG22 THR 86 -2.935 6.106 12.775 653 HG23 THR 86 HG23 THR 86 -1.267 6.334 13.300 654 H ILE 87 H ILE 87 1.351 4.959 10.883 655 HA ILE 87 HA ILE 87 1.799 7.598 11.778 656 HB ILE 87 HB ILE 87 3.396 5.868 12.439 657 HG12 ILE 87 HG12 ILE 87 4.263 8.245 12.161 658 HG13 ILE 87 HG13 ILE 87 5.472 6.975 12.256 659 HG21 ILE 87 HG21 ILE 87 4.172 5.573 9.577 660 HG22 ILE 87 HG22 ILE 87 3.337 4.399 10.595 661 HG23 ILE 87 HG23 ILE 87 5.015 4.844 10.940 662 HD11 ILE 87 HD11 ILE 87 5.788 7.115 9.822 663 HD12 ILE 87 HD12 ILE 87 6.050 8.684 10.591 664 HD13 ILE 87 HD13 ILE 87 4.539 8.347 9.735 665 H LEU 88 H LEU 88 1.973 6.149 8.571 666 HA LEU 88 HA LEU 88 2.776 8.584 7.374 667 HB2 LEU 88 HB2 LEU 88 1.523 6.135 6.237 668 HB3 LEU 88 HB3 LEU 88 1.695 7.555 5.245 669 HG LEU 88 HG LEU 88 3.490 6.240 4.686 670 HD11 LEU 88 HD11 LEU 88 5.500 7.361 5.397 671 HD12 LEU 88 HD12 LEU 88 4.638 8.109 6.730 672 HD13 LEU 88 HD13 LEU 88 4.203 8.510 5.065 673 HD21 LEU 88 HD21 LEU 88 3.302 4.605 6.467 674 HD22 LEU 88 HD22 LEU 88 4.065 5.734 7.584 675 HD23 LEU 88 HD23 LEU 88 4.974 5.088 6.204 676 H HIS 89 H HIS 89 -0.337 7.297 8.146 677 HA HIS 89 HA HIS 89 -1.932 9.212 6.811 678 HB2 HIS 89 HB2 HIS 89 -2.835 7.100 7.752 679 HB3 HIS 89 HB3 HIS 89 -2.515 7.688 9.371 680 HD1 HIS 89 HD1 HIS 89 -4.422 8.891 10.483 681 HD2 HIS 89 HD2 HIS 89 -4.885 8.658 6.366 682 HE1 HIS 89 HE1 HIS 89 -6.744 9.730 9.996 683 H ASP 90 H ASP 90 -0.288 9.185 9.839 684 HA ASP 90 HA ASP 90 -1.316 11.488 11.081 685 HB2 ASP 90 HB2 ASP 90 0.085 9.718 12.133 686 HB3 ASP 90 HB3 ASP 90 1.461 10.302 11.222 687 H GLY 91 H GLY 91 1.093 11.009 8.594 688 HA2 GLY 91 HA2 GLY 91 1.733 13.873 8.529 689 HA3 GLY 91 HA3 GLY 91 2.591 12.613 7.653 690 H GLY 92 H GLY 92 -0.398 11.732 7.108 691 HA2 GLY 92 HA2 GLY 92 -2.092 12.234 5.595 692 HA3 GLY 92 HA3 GLY 92 -1.263 13.731 5.209 693 H TYR 93 H TYR 93 0.374 10.652 5.070 694 HA TYR 93 HA TYR 93 0.869 11.143 2.273 695 HB2 TYR 93 HB2 TYR 93 2.031 9.108 4.173 696 HB3 TYR 93 HB3 TYR 93 2.367 9.097 2.453 697 HD1 TYR 93 HD1 TYR 93 2.778 11.092 5.557 698 HD2 TYR 93 HD2 TYR 93 3.861 10.617 1.475 699 HE1 TYR 93 HE1 TYR 93 4.561 12.760 5.835 700 HE2 TYR 93 HE2 TYR 93 5.643 12.259 1.741 701 HH TYR 93 HH TYR 93 6.798 13.323 4.682 702 H ARG 94 H ARG 94 -0.004 10.234 0.648 703 HA ARG 94 HA ARG 94 -2.221 8.433 0.974 704 HB2 ARG 94 HB2 ARG 94 -2.623 8.784 -1.368 705 HB3 ARG 94 HB3 ARG 94 -2.195 10.337 -0.665 706 HG2 ARG 94 HG2 ARG 94 0.118 9.956 -1.471 707 HG3 ARG 94 HG3 ARG 94 -0.469 8.548 -2.361 708 HD2 ARG 94 HD2 ARG 94 -0.451 10.306 -3.929 709 HD3 ARG 94 HD3 ARG 94 -2.135 10.171 -3.430 710 HE ARG 94 HE ARG 94 -1.265 12.012 -1.733 711 HH11 ARG 94 HH11 ARG 94 -0.842 11.782 -5.271 712 HH12 ARG 94 HH12 ARG 94 -0.618 13.447 -5.482 713 HH21 ARG 94 HH21 ARG 94 -0.945 14.312 -2.059 714 HH22 ARG 94 HH22 ARG 94 -0.689 14.916 -3.624 715 H ASP 95 H ASP 95 -2.383 6.583 -0.699 716 HA ASP 95 HA ASP 95 -0.722 4.478 -0.002 717 HB2 ASP 95 HB2 ASP 95 -1.810 3.320 -1.937 718 HB3 ASP 95 HB3 ASP 95 -2.956 4.150 -0.882 719 H THR 96 H THR 96 -0.689 6.489 -2.887 720 HA THR 96 HA THR 96 1.257 5.226 -4.358 721 HB THR 96 HB THR 96 0.732 8.187 -4.255 722 HG1 THR 96 HG1 THR 96 -0.929 6.066 -4.839 723 HG21 THR 96 HG21 THR 96 1.493 6.321 -6.518 724 HG22 THR 96 HG22 THR 96 2.601 7.414 -5.692 725 HG23 THR 96 HG23 THR 96 1.271 8.068 -6.649 726 H GLU 97 H GLU 97 1.523 7.729 -1.875 727 HA GLU 97 HA GLU 97 4.282 8.214 -2.164 728 HB2 GLU 97 HB2 GLU 97 2.429 8.646 0.175 729 HB3 GLU 97 HB3 GLU 97 4.108 9.165 0.134 730 HG2 GLU 97 HG2 GLU 97 1.998 10.047 -1.806 731 HG3 GLU 97 HG3 GLU 97 2.512 10.981 -0.388 732 H ILE 98 H ILE 98 2.367 5.999 -0.240 733 HA ILE 98 HA ILE 98 4.348 5.097 1.557 734 HB ILE 98 HB ILE 98 2.219 3.288 0.385 735 HG12 ILE 98 HG12 ILE 98 1.021 5.308 1.061 736 HG13 ILE 98 HG13 ILE 98 0.692 3.991 2.185 737 HG21 ILE 98 HG21 ILE 98 2.251 2.224 2.590 738 HG22 ILE 98 HG22 ILE 98 3.485 3.373 3.105 739 HG23 ILE 98 HG23 ILE 98 3.848 2.210 1.826 740 HD11 ILE 98 HD11 ILE 98 0.968 6.104 3.315 741 HD12 ILE 98 HD12 ILE 98 2.596 6.254 2.649 742 HD13 ILE 98 HD13 ILE 98 2.213 4.943 3.772 743 H MET 99 H MET 99 3.261 3.944 -1.555 744 HA MET 99 HA MET 99 5.066 1.766 -1.658 745 HB2 MET 99 HB2 MET 99 3.436 3.054 -3.816 746 HB3 MET 99 HB3 MET 99 4.367 1.580 -4.031 747 HG2 MET 99 HG2 MET 99 3.030 0.511 -2.257 748 HG3 MET 99 HG3 MET 99 2.094 1.999 -2.128 749 HE1 MET 99 HE1 MET 99 0.348 2.214 -5.590 750 HE2 MET 99 HE2 MET 99 1.781 3.008 -4.960 751 HE3 MET 99 HE3 MET 99 0.350 2.846 -3.940 752 H ARG 100 H ARG 100 5.347 5.085 -2.583 753 HA ARG 100 HA ARG 100 7.341 4.817 -4.525 754 HB2 ARG 100 HB2 ARG 100 6.605 7.067 -2.704 755 HB3 ARG 100 HB3 ARG 100 8.018 7.190 -3.744 756 HG2 ARG 100 HG2 ARG 100 6.652 6.812 -5.695 757 HG3 ARG 100 HG3 ARG 100 5.228 6.604 -4.676 758 HD2 ARG 100 HD2 ARG 100 5.235 8.837 -4.017 759 HD3 ARG 100 HD3 ARG 100 6.870 9.098 -4.585 760 HE ARG 100 HE ARG 100 5.455 8.303 -6.800 761 HH11 ARG 100 HH11 ARG 100 4.890 10.921 -4.535 762 HH12 ARG 100 HH12 ARG 100 4.641 12.118 -5.725 763 HH21 ARG 100 HH21 ARG 100 5.053 9.931 -8.484 764 HH22 ARG 100 HH22 ARG 100 4.726 11.532 -8.025 765 H TRP 101 H TRP 101 7.948 5.788 -1.170 766 HA TRP 101 HA TRP 101 10.718 5.268 -1.468 767 HB2 TRP 101 HB2 TRP 101 10.685 5.434 1.128 768 HB3 TRP 101 HB3 TRP 101 10.375 6.866 0.158 769 HD1 TRP 101 HD1 TRP 101 8.065 7.992 0.359 770 HE1 TRP 101 HE1 TRP 101 6.059 7.671 1.863 771 HE3 TRP 101 HE3 TRP 101 9.339 3.471 2.453 772 HZ2 TRP 101 HZ2 TRP 101 5.122 5.764 3.740 773 HZ3 TRP 101 HZ3 TRP 101 7.827 2.497 4.099 774 HH2 TRP 101 HH2 TRP 101 5.758 3.608 4.729 775 H LEU 102 H LEU 102 8.080 3.343 -0.416 776 HA LEU 102 HA LEU 102 9.518 1.389 0.991 777 HB2 LEU 102 HB2 LEU 102 7.085 1.861 1.105 778 HB3 LEU 102 HB3 LEU 102 6.921 1.132 -0.469 779 HG LEU 102 HG LEU 102 7.649 -1.031 0.470 780 HD11 LEU 102 HD11 LEU 102 9.013 -0.077 2.305 781 HD12 LEU 102 HD12 LEU 102 7.884 -1.316 2.815 782 HD13 LEU 102 HD13 LEU 102 7.513 0.384 3.114 783 HD21 LEU 102 HD21 LEU 102 5.411 0.319 1.921 784 HD22 LEU 102 HD22 LEU 102 5.609 -1.424 1.734 785 HD23 LEU 102 HD23 LEU 102 5.290 -0.411 0.315 786 H PHE 103 H PHE 103 8.517 1.658 -2.402 787 HA PHE 103 HA PHE 103 9.618 -0.932 -2.986 788 HB2 PHE 103 HB2 PHE 103 8.135 1.082 -4.639 789 HB3 PHE 103 HB3 PHE 103 8.977 -0.264 -5.398 790 HD1 PHE 103 HD1 PHE 103 6.449 0.412 -2.694 791 HD2 PHE 103 HD2 PHE 103 7.851 -2.229 -5.729 792 HE1 PHE 103 HE1 PHE 103 4.517 -1.034 -2.325 793 HE2 PHE 103 HE2 PHE 103 5.904 -3.675 -5.353 794 HZ PHE 103 HZ PHE 103 4.236 -3.070 -3.641 795 H THR 104 H THR 104 10.996 1.973 -2.552 796 HA THR 104 HA THR 104 12.904 1.739 -4.713 797 HB THR 104 HB THR 104 12.836 3.679 -2.373 798 HG1 THR 104 HG1 THR 104 11.053 3.957 -3.805 799 HG21 THR 104 HG21 THR 104 15.086 3.426 -3.344 800 HG22 THR 104 HG22 THR 104 14.414 5.013 -3.721 801 HG23 THR 104 HG23 THR 104 14.434 3.747 -4.948 802 HA PRO 105 HA PRO 105 15.204 -1.121 -2.026 803 HB2 PRO 105 HB2 PRO 105 17.091 -1.147 -4.295 804 HB3 PRO 105 HB3 PRO 105 16.225 -2.496 -3.554 805 HG2 PRO 105 HG2 PRO 105 15.573 -1.599 -5.984 806 HG3 PRO 105 HG3 PRO 105 14.338 -2.164 -4.849 807 HD2 PRO 105 HD2 PRO 105 15.128 0.648 -5.525 808 HD3 PRO 105 HD3 PRO 105 13.512 -0.062 -5.303 809 H ASP 106 H ASP 106 16.890 -0.764 -0.702 810 HA ASP 106 HA ASP 106 18.324 1.748 -1.137 811 HB2 ASP 106 HB2 ASP 106 17.131 1.481 1.030 812 HB3 ASP 106 HB3 ASP 106 18.150 0.101 1.392 813 HA PRO 107 HA PRO 107 21.636 -0.811 -2.611 814 HB2 PRO 107 HB2 PRO 107 23.308 1.546 -2.120 815 HB3 PRO 107 HB3 PRO 107 22.999 0.673 -3.621 816 HG2 PRO 107 HG2 PRO 107 21.962 3.113 -3.087 817 HG3 PRO 107 HG3 PRO 107 21.144 1.924 -4.119 818 HD2 PRO 107 HD2 PRO 107 20.562 2.781 -1.344 819 HD3 PRO 107 HD3 PRO 107 19.477 2.189 -2.624 820 H SER 108 H SER 108 21.728 0.931 0.365 821 HA SER 108 HA SER 108 24.083 -0.596 1.192 822 HB2 SER 108 HB2 SER 108 24.168 1.197 3.034 823 HB3 SER 108 HB3 SER 108 24.609 1.671 1.395 824 HG SER 108 HG SER 108 21.903 1.944 2.044 825 H LEU 109 H LEU 109 20.954 -1.070 1.304 826 HA LEU 109 HA LEU 109 20.805 -1.746 4.146 827 HB2 LEU 109 HB2 LEU 109 19.022 -0.384 3.164 828 HB3 LEU 109 HB3 LEU 109 18.716 -1.668 2.003 829 HG LEU 109 HG LEU 109 17.974 -3.121 3.829 830 HD11 LEU 109 HD11 LEU 109 18.394 -0.688 5.543 831 HD12 LEU 109 HD12 LEU 109 19.298 -2.209 5.611 832 HD13 LEU 109 HD13 LEU 109 17.585 -2.183 6.037 833 HD21 LEU 109 HD21 LEU 109 16.623 -0.438 3.719 834 HD22 LEU 109 HD22 LEU 109 15.897 -1.939 4.305 835 HD23 LEU 109 HD23 LEU 109 16.370 -1.788 2.608 836 H THR 110 H THR 110 20.878 -3.795 4.755 837 HA THR 110 HA THR 110 20.804 -5.877 2.686 838 HB THR 110 HB THR 110 22.241 -5.923 5.344 839 HG1 THR 110 HG1 THR 110 23.675 -4.850 4.238 840 HG21 THR 110 HG21 THR 110 22.291 -7.897 3.046 841 HG22 THR 110 HG22 THR 110 21.545 -8.158 4.621 842 HG23 THR 110 HG23 THR 110 23.297 -7.992 4.491 843 H ILE 111 H ILE 111 19.006 -6.958 2.740 844 HA ILE 111 HA ILE 111 17.582 -7.308 5.294 845 HB ILE 111 HB ILE 111 16.510 -7.100 2.492 846 HG12 ILE 111 HG12 ILE 111 17.239 -4.954 3.368 847 HG13 ILE 111 HG13 ILE 111 15.497 -4.985 3.153 848 HG21 ILE 111 HG21 ILE 111 15.119 -8.604 3.724 849 HG22 ILE 111 HG22 ILE 111 14.275 -7.086 3.413 850 HG23 ILE 111 HG23 ILE 111 14.932 -7.414 5.025 851 HD11 ILE 111 HD11 ILE 111 16.997 -5.270 5.759 852 HD12 ILE 111 HD12 ILE 111 15.244 -5.377 5.586 853 HD13 ILE 111 HD13 ILE 111 16.076 -3.865 5.225 854 H THR 112 H THR 112 16.721 -9.250 5.629 855 HA THR 112 HA THR 112 17.491 -11.457 3.860 856 HB THR 112 HB THR 112 18.702 -11.677 5.947 857 HG1 THR 112 HG1 THR 112 16.587 -13.543 6.205 858 HG21 THR 112 HG21 THR 112 17.585 -11.873 8.148 859 HG22 THR 112 HG22 THR 112 16.045 -11.501 7.377 860 HG23 THR 112 HG23 THR 112 17.324 -10.292 7.412 861 H ARG 113 H ARG 113 15.864 -13.020 3.556 862 HA ARG 113 HA ARG 113 13.268 -11.701 3.865 863 HB2 ARG 113 HB2 ARG 113 14.009 -12.255 1.544 864 HB3 ARG 113 HB3 ARG 113 13.890 -13.963 1.958 865 HG2 ARG 113 HG2 ARG 113 11.530 -13.739 2.387 866 HG3 ARG 113 HG3 ARG 113 11.615 -12.007 2.105 867 HD2 ARG 113 HD2 ARG 113 12.292 -12.477 -0.236 868 HD3 ARG 113 HD3 ARG 113 12.054 -14.201 0.085 869 HE ARG 113 HE ARG 113 9.995 -12.147 0.349 870 HH11 ARG 113 HH11 ARG 113 10.996 -15.266 -0.949 871 HH12 ARG 113 HH12 ARG 113 9.451 -15.924 -1.136 872 HH21 ARG 113 HH21 ARG 113 7.757 -13.038 0.102 873 HH22 ARG 113 HH22 ARG 113 7.530 -14.598 -0.514 874 H ASP 114 H ASP 114 11.425 -12.712 4.594 875 HA ASP 114 HA ASP 114 11.780 -14.646 6.623 876 HB2 ASP 114 HB2 ASP 114 10.030 -13.045 6.876 877 HB3 ASP 114 HB3 ASP 114 9.243 -13.557 5.375 878 H GLY 115 H GLY 115 11.706 -16.753 6.539 879 HA2 GLY 115 HA2 GLY 115 11.050 -18.853 5.769 880 HA3 GLY 115 HA3 GLY 115 10.461 -18.115 4.279 881 H SER 116 H SER 116 13.489 -16.984 5.318 882 HA SER 116 HA SER 116 14.972 -18.891 3.770 883 HB2 SER 116 HB2 SER 116 14.190 -17.219 2.116 884 HB3 SER 116 HB3 SER 116 14.834 -15.922 3.113 885 HG SER 116 HG SER 116 16.158 -17.781 1.494 886 H ARG 117 H ARG 117 17.264 -18.236 3.934 887 HA ARG 117 HA ARG 117 17.848 -16.782 6.398 888 HB2 ARG 117 HB2 ARG 117 19.899 -18.336 6.589 889 HB3 ARG 117 HB3 ARG 117 18.331 -18.929 7.117 890 HG2 ARG 117 HG2 ARG 117 19.507 -20.674 5.945 891 HG3 ARG 117 HG3 ARG 117 18.129 -20.161 4.989 892 HD2 ARG 117 HD2 ARG 117 20.014 -20.513 3.530 893 HD3 ARG 117 HD3 ARG 117 19.659 -18.794 3.599 894 HE ARG 117 HE ARG 117 21.588 -18.468 4.917 895 HH11 ARG 117 HH11 ARG 117 21.290 -21.788 3.695 896 HH12 ARG 117 HH12 ARG 117 22.948 -22.122 3.765 897 HH21 ARG 117 HH21 ARG 117 23.895 -18.939 5.019 898 HH22 ARG 117 HH22 ARG 117 24.475 -20.458 4.543 899 H ASP 118 H ASP 118 18.084 -16.654 3.213 900 HA ASP 118 HA ASP 118 20.833 -15.801 3.003 901 HB2 ASP 118 HB2 ASP 118 18.604 -15.705 0.976 902 HB3 ASP 118 HB3 ASP 118 20.220 -15.121 0.667 903 H ALA 119 H ALA 119 21.556 -13.868 3.015 904 HA ALA 119 HA ALA 119 19.687 -11.668 3.526 905 HB1 ALA 119 HB1 ALA 119 21.595 -10.508 4.547 906 HB2 ALA 119 HB2 ALA 119 22.637 -11.876 4.151 907 HB3 ALA 119 HB3 ALA 119 21.326 -12.075 5.316 908 H VAL 120 H VAL 120 19.540 -10.095 2.071 909 HA VAL 120 HA VAL 120 21.430 -10.151 -0.172 910 HB VAL 120 HB VAL 120 18.546 -9.225 -0.212 911 HG11 VAL 120 HG11 VAL 120 19.910 -8.110 -1.876 912 HG12 VAL 120 HG12 VAL 120 18.800 -9.246 -2.653 913 HG13 VAL 120 HG13 VAL 120 20.500 -9.667 -2.461 914 HG21 VAL 120 HG21 VAL 120 19.718 -11.815 -1.234 915 HG22 VAL 120 HG22 VAL 120 18.062 -11.272 -1.503 916 HG23 VAL 120 HG23 VAL 120 18.615 -11.632 0.130 917 H SER 121 H SER 121 22.726 -8.445 -0.153 918 HA SER 121 HA SER 121 21.968 -5.977 1.115 919 HB2 SER 121 HB2 SER 121 24.416 -6.721 -0.528 920 HB3 SER 121 HB3 SER 121 24.208 -5.208 0.363 921 HG SER 121 HG SER 121 23.985 -6.437 2.259 922 H ASN 122 H ASN 122 21.212 -4.239 0.196 923 HA ASN 122 HA ASN 122 20.158 -2.916 -1.195 924 HB2 ASN 122 HB2 ASN 122 22.022 -2.914 -2.801 925 HB3 ASN 122 HB3 ASN 122 21.515 -4.461 -3.447 926 HD21 ASN 122 HD21 ASN 122 19.869 -4.504 -4.959 927 HD22 ASN 122 HD22 ASN 122 19.204 -3.077 -5.684 928 H ALA 123 H ALA 123 18.493 -3.974 -0.092 929 HA ALA 123 HA ALA 123 16.915 -5.644 -1.895 930 HB1 ALA 123 HB1 ALA 123 17.640 -6.847 0.089 931 HB2 ALA 123 HB2 ALA 123 15.892 -6.588 0.123 932 HB3 ALA 123 HB3 ALA 123 16.956 -5.582 1.108 933 H ARG 124 H ARG 124 14.569 -5.471 -1.361 934 HA ARG 124 HA ARG 124 13.884 -2.647 -1.385 935 HB2 ARG 124 HB2 ARG 124 11.673 -3.435 -2.244 936 HB3 ARG 124 HB3 ARG 124 13.032 -3.919 -3.253 937 HG2 ARG 124 HG2 ARG 124 12.985 -6.129 -2.316 938 HG3 ARG 124 HG3 ARG 124 11.677 -5.678 -1.223 939 HD2 ARG 124 HD2 ARG 124 10.258 -5.252 -3.185 940 HD3 ARG 124 HD3 ARG 124 11.584 -5.786 -4.228 941 HE ARG 124 HE ARG 124 11.352 -7.865 -2.613 942 HH11 ARG 124 HH11 ARG 124 8.861 -6.096 -4.406 943 HH12 ARG 124 HH12 ARG 124 7.828 -7.424 -4.548 944 HH21 ARG 124 HH21 ARG 124 9.918 -9.673 -2.765 945 HH22 ARG 124 HH22 ARG 124 8.436 -9.500 -3.594 946 HA PRO 125 HA PRO 125 12.529 -2.805 2.897 947 HB2 PRO 125 HB2 PRO 125 10.859 -0.532 1.921 948 HB3 PRO 125 HB3 PRO 125 11.895 -0.616 3.354 949 HG2 PRO 125 HG2 PRO 125 12.700 0.716 1.225 950 HG3 PRO 125 HG3 PRO 125 13.840 -0.330 2.092 951 HD2 PRO 125 HD2 PRO 125 12.407 -0.822 -0.491 952 HD3 PRO 125 HD3 PRO 125 14.080 -1.204 -0.019 953 H VAL 126 H VAL 126 10.387 -2.887 0.162 954 HA VAL 126 HA VAL 126 7.851 -3.300 1.337 955 HB VAL 126 HB VAL 126 8.899 -4.770 -1.087 956 HG11 VAL 126 HG11 VAL 126 6.799 -5.582 -0.286 957 HG12 VAL 126 HG12 VAL 126 6.591 -4.746 -1.828 958 HG13 VAL 126 HG13 VAL 126 6.116 -3.955 -0.325 959 HG21 VAL 126 HG21 VAL 126 9.287 -2.327 -1.252 960 HG22 VAL 126 HG22 VAL 126 7.549 -2.092 -1.101 961 HG23 VAL 126 HG23 VAL 126 8.196 -2.976 -2.478 962 H ASP 127 H ASP 127 10.426 -5.532 0.493 963 HA ASP 127 HA ASP 127 8.991 -7.862 1.235 964 HB2 ASP 127 HB2 ASP 127 10.747 -7.788 -0.526 965 HB3 ASP 127 HB3 ASP 127 11.949 -7.562 0.737 966 H ALA 128 H ALA 128 11.119 -5.671 2.770 967 HA ALA 128 HA ALA 128 11.878 -7.197 4.993 968 HB1 ALA 128 HB1 ALA 128 12.469 -5.093 6.057 969 HB2 ALA 128 HB2 ALA 128 11.543 -4.200 4.850 970 HB3 ALA 128 HB3 ALA 128 12.984 -5.096 4.371 971 H LEU 129 H LEU 129 9.030 -5.070 4.534 972 HA LEU 129 HA LEU 129 8.104 -5.512 7.230 973 HB2 LEU 129 HB2 LEU 129 6.025 -4.444 6.592 974 HB3 LEU 129 HB3 LEU 129 7.359 -3.506 5.981 975 HG LEU 129 HG LEU 129 6.868 -4.868 3.789 976 HD11 LEU 129 HD11 LEU 129 4.477 -5.296 3.455 977 HD12 LEU 129 HD12 LEU 129 4.189 -4.888 5.156 978 HD13 LEU 129 HD13 LEU 129 5.181 -6.287 4.746 979 HD21 LEU 129 HD21 LEU 129 6.772 -2.451 4.005 980 HD22 LEU 129 HD22 LEU 129 5.167 -2.565 4.721 981 HD23 LEU 129 HD23 LEU 129 5.417 -3.049 3.042 982 H HIS 130 H HIS 130 7.606 -7.023 4.208 983 HA HIS 130 HA HIS 130 5.591 -8.871 4.873 984 HB2 HIS 130 HB2 HIS 130 6.121 -8.266 2.589 985 HB3 HIS 130 HB3 HIS 130 7.788 -8.751 2.801 986 HD1 HIS 130 HD1 HIS 130 4.340 -10.175 2.142 987 HD2 HIS 130 HD2 HIS 130 8.308 -11.396 2.359 988 HE1 HIS 130 HE1 HIS 130 4.445 -12.432 1.057 989 H ALA 131 H ALA 131 8.950 -8.676 5.390 990 HA ALA 131 HA ALA 131 9.181 -11.430 6.296 991 HB1 ALA 131 HB1 ALA 131 11.316 -9.314 6.062 992 HB2 ALA 131 HB2 ALA 131 10.952 -10.548 4.856 993 HB3 ALA 131 HB3 ALA 131 11.590 -11.016 6.432 994 H HIS 132 H HIS 132 7.967 -8.870 7.645 995 HA HIS 132 HA HIS 132 7.526 -8.109 9.705 996 HB2 HIS 132 HB2 HIS 132 8.741 -10.741 10.576 997 HB3 HIS 132 HB3 HIS 132 7.961 -9.618 11.685 998 HD1 HIS 132 HD1 HIS 132 7.166 -12.593 9.900 999 HD2 HIS 132 HD2 HIS 132 5.189 -9.010 10.618 1000 HE1 HIS 132 HE1 HIS 132 4.739 -13.039 9.478 1001 H GLN 133 H GLN 133 9.966 -7.451 8.442 1002 HA GLN 133 HA GLN 133 11.630 -6.590 10.692 1003 HB2 GLN 133 HB2 GLN 133 12.183 -6.720 7.719 1004 HB3 GLN 133 HB3 GLN 133 13.314 -6.095 8.915 1005 HG2 GLN 133 HG2 GLN 133 13.514 -8.219 9.955 1006 HG3 GLN 133 HG3 GLN 133 12.198 -8.875 8.987 1007 HE21 GLN 133 HE21 GLN 133 13.405 -10.483 8.202 1008 HE22 GLN 133 HE22 GLN 133 14.591 -10.239 6.974 1009 H ALA 134 H ALA 134 9.091 -5.710 9.905 1010 HA ALA 134 HA ALA 134 8.796 -3.416 8.430 1011 HB1 ALA 134 HB1 ALA 134 6.952 -4.760 9.314 1012 HB2 ALA 134 HB2 ALA 134 6.755 -3.039 9.642 1013 HB3 ALA 134 HB3 ALA 134 7.282 -4.125 10.926 1014 H ARG 135 H ARG 135 10.203 -3.734 11.552 1015 HA ARG 135 HA ARG 135 9.942 -1.196 12.671 1016 HB2 ARG 135 HB2 ARG 135 12.357 -3.019 12.695 1017 HB3 ARG 135 HB3 ARG 135 12.105 -1.655 13.769 1018 HG2 ARG 135 HG2 ARG 135 10.304 -4.055 13.649 1019 HG3 ARG 135 HG3 ARG 135 11.641 -3.864 14.781 1020 HD2 ARG 135 HD2 ARG 135 9.221 -2.078 14.545 1021 HD3 ARG 135 HD3 ARG 135 9.538 -3.243 15.825 1022 HE ARG 135 HE ARG 135 10.966 -0.722 15.373 1023 HH11 ARG 135 HH11 ARG 135 10.453 -3.563 17.453 1024 HH12 ARG 135 HH12 ARG 135 11.050 -2.788 18.846 1025 HH21 ARG 135 HH21 ARG 135 11.795 0.304 17.325 1026 HH22 ARG 135 HH22 ARG 135 11.834 -0.565 18.772 1027 H GLU 136 H GLU 136 12.321 -2.383 10.274 1028 HA GLU 136 HA GLU 136 13.745 0.078 10.095 1029 HB2 GLU 136 HB2 GLU 136 13.670 -2.376 8.354 1030 HB3 GLU 136 HB3 GLU 136 14.631 -0.971 7.929 1031 HG2 GLU 136 HG2 GLU 136 14.907 -2.584 10.459 1032 HG3 GLU 136 HG3 GLU 136 15.956 -2.696 9.042 1033 H VAL 137 H VAL 137 10.949 -1.188 8.601 1034 HA VAL 137 HA VAL 137 10.847 0.608 6.372 1035 HB VAL 137 HB VAL 137 8.678 -1.078 7.658 1036 HG11 VAL 137 HG11 VAL 137 7.691 0.764 6.412 1037 HG12 VAL 137 HG12 VAL 137 7.422 -0.766 5.578 1038 HG13 VAL 137 HG13 VAL 137 8.666 0.346 5.003 1039 HG21 VAL 137 HG21 VAL 137 10.468 -2.434 6.767 1040 HG22 VAL 137 HG22 VAL 137 10.416 -1.550 5.242 1041 HG23 VAL 137 HG23 VAL 137 9.060 -2.563 5.710 1042 H VAL 138 H VAL 138 9.170 0.369 9.466 1043 HA VAL 138 HA VAL 138 7.724 2.762 9.338 1044 HB VAL 138 HB VAL 138 8.794 1.373 11.827 1045 HG11 VAL 138 HG11 VAL 138 6.576 3.407 11.533 1046 HG12 VAL 138 HG12 VAL 138 8.139 3.679 12.302 1047 HG13 VAL 138 HG13 VAL 138 6.984 2.558 13.025 1048 HG21 VAL 138 HG21 VAL 138 6.110 1.144 10.457 1049 HG22 VAL 138 HG22 VAL 138 6.550 0.374 11.983 1050 HG23 VAL 138 HG23 VAL 138 7.366 -0.093 10.491 1051 H ARG 139 H ARG 139 10.927 2.036 10.487 1052 HA ARG 139 HA ARG 139 11.742 4.452 11.565 1053 HB2 ARG 139 HB2 ARG 139 12.948 2.309 11.645 1054 HB3 ARG 139 HB3 ARG 139 13.289 2.440 9.934 1055 HG2 ARG 139 HG2 ARG 139 14.678 4.396 10.371 1056 HG3 ARG 139 HG3 ARG 139 14.323 4.250 12.097 1057 HD2 ARG 139 HD2 ARG 139 15.261 1.970 12.069 1058 HD3 ARG 139 HD3 ARG 139 15.696 2.189 10.374 1059 HE ARG 139 HE ARG 139 16.803 4.294 11.642 1060 HH11 ARG 139 HH11 ARG 139 17.160 0.741 11.875 1061 HH12 ARG 139 HH12 ARG 139 18.697 0.838 12.598 1062 HH21 ARG 139 HH21 ARG 139 18.903 4.387 12.570 1063 HH22 ARG 139 HH22 ARG 139 19.724 2.962 13.004 1064 H ARG 140 H ARG 140 11.980 3.310 8.176 1065 HA ARG 140 HA ARG 140 13.029 5.733 7.177 1066 HB2 ARG 140 HB2 ARG 140 11.739 3.408 5.825 1067 HB3 ARG 140 HB3 ARG 140 12.197 4.852 4.924 1068 HG2 ARG 140 HG2 ARG 140 14.496 4.600 5.740 1069 HG3 ARG 140 HG3 ARG 140 14.013 3.115 6.563 1070 HD2 ARG 140 HD2 ARG 140 15.108 2.714 4.441 1071 HD3 ARG 140 HD3 ARG 140 13.445 2.096 4.476 1072 HE ARG 140 HE ARG 140 13.163 4.543 3.359 1073 HH11 ARG 140 HH11 ARG 140 15.435 1.949 2.536 1074 HH12 ARG 140 HH12 ARG 140 15.412 2.302 0.863 1075 HH21 ARG 140 HH21 ARG 140 13.133 4.975 1.109 1076 HH22 ARG 140 HH22 ARG 140 14.072 4.055 0.024 1077 H ALA 141 H ALA 141 9.765 4.513 7.513 1078 HA ALA 141 HA ALA 141 8.409 6.514 6.088 1079 HB1 ALA 141 HB1 ALA 141 7.487 4.898 8.457 1080 HB2 ALA 141 HB2 ALA 141 7.335 4.445 6.749 1081 HB3 ALA 141 HB3 ALA 141 6.459 5.843 7.380 1082 H GLN 142 H GLN 142 9.343 6.297 9.478 1083 HA GLN 142 HA GLN 142 8.269 8.709 10.406 1084 HB2 GLN 142 HB2 GLN 142 10.834 7.365 11.250 1085 HB3 GLN 142 HB3 GLN 142 10.039 8.652 12.136 1086 HG2 GLN 142 HG2 GLN 142 8.129 7.226 12.545 1087 HG3 GLN 142 HG3 GLN 142 8.864 5.946 11.578 1088 HE21 GLN 142 HE21 GLN 142 8.072 5.948 14.357 1089 HE22 GLN 142 HE22 GLN 142 9.483 5.542 15.263 1090 H ALA 143 H ALA 143 11.317 8.032 8.786 1091 HA ALA 143 HA ALA 143 12.353 10.669 8.982 1092 HB1 ALA 143 HB1 ALA 143 13.025 8.521 6.966 1093 HB2 ALA 143 HB2 ALA 143 13.781 8.720 8.547 1094 HB3 ALA 143 HB3 ALA 143 13.985 9.961 7.312 1095 H MET 144 H MET 144 10.138 9.155 6.811 1096 HA MET 144 HA MET 144 10.284 11.274 4.846 1097 HB2 MET 144 HB2 MET 144 8.226 9.073 5.105 1098 HB3 MET 144 HB3 MET 144 8.405 10.149 3.735 1099 HG2 MET 144 HG2 MET 144 10.342 8.034 4.652 1100 HG3 MET 144 HG3 MET 144 9.331 7.997 3.211 1101 HE1 MET 144 HE1 MET 144 11.006 10.806 1.008 1102 HE2 MET 144 HE2 MET 144 9.674 11.039 2.140 1103 HE3 MET 144 HE3 MET 144 9.713 9.614 1.100 1104 H ALA 145 H ALA 145 8.105 10.286 7.415 1105 HA ALA 145 HA ALA 145 6.205 12.334 6.813 1106 HB1 ALA 145 HB1 ALA 145 5.013 11.596 8.790 1107 HB2 ALA 145 HB2 ALA 145 6.407 10.637 9.290 1108 HB3 ALA 145 HB3 ALA 145 5.522 10.209 7.825 1109 H TYR 146 H TYR 146 8.577 11.899 9.438 1110 HA TYR 146 HA TYR 146 8.013 14.632 10.283 1111 HB2 TYR 146 HB2 TYR 146 9.575 12.446 11.689 1112 HB3 TYR 146 HB3 TYR 146 9.148 14.015 12.361 1113 HD1 TYR 146 HD1 TYR 146 6.679 14.534 12.670 1114 HD2 TYR 146 HD2 TYR 146 8.122 10.618 11.897 1115 HE1 TYR 146 HE1 TYR 146 4.569 13.593 13.518 1116 HE2 TYR 146 HE2 TYR 146 6.022 9.670 12.741 1117 HH TYR 146 HH TYR 146 3.260 11.562 13.234 Start of MODEL 29 1 H MET 1 H MET 1 -16.476 -13.728 -16.101 2 HA MET 1 HA MET 1 -15.737 -11.130 -17.264 3 HB2 MET 1 HB2 MET 1 -18.431 -12.456 -16.910 4 HB3 MET 1 HB3 MET 1 -18.253 -10.731 -17.156 5 HG2 MET 1 HG2 MET 1 -18.865 -11.879 -19.209 6 HG3 MET 1 HG3 MET 1 -17.293 -11.117 -19.361 7 HE1 MET 1 HE1 MET 1 -16.743 -12.492 -21.525 8 HE2 MET 1 HE2 MET 1 -18.347 -13.218 -21.444 9 HE3 MET 1 HE3 MET 1 -16.928 -14.241 -21.658 10 HA PRO 2 HA PRO 2 -15.791 -10.232 -12.871 11 HB2 PRO 2 HB2 PRO 2 -15.025 -7.531 -13.412 12 HB3 PRO 2 HB3 PRO 2 -14.009 -8.838 -12.820 13 HG2 PRO 2 HG2 PRO 2 -13.801 -7.632 -15.315 14 HG3 PRO 2 HG3 PRO 2 -13.103 -9.192 -14.865 15 HD2 PRO 2 HD2 PRO 2 -15.553 -8.596 -16.442 16 HD3 PRO 2 HD3 PRO 2 -14.419 -9.964 -16.536 17 H GLY 3 H GLY 3 -17.589 -9.712 -11.773 18 HA2 GLY 3 HA2 GLY 3 -19.513 -7.887 -13.018 19 HA3 GLY 3 HA3 GLY 3 -19.870 -9.065 -11.767 20 H ARG 4 H ARG 4 -17.051 -7.405 -11.030 21 HA ARG 4 HA ARG 4 -18.404 -5.946 -8.947 22 HB2 ARG 4 HB2 ARG 4 -15.475 -5.762 -9.719 23 HB3 ARG 4 HB3 ARG 4 -16.197 -5.014 -8.312 24 HG2 ARG 4 HG2 ARG 4 -15.147 -6.884 -7.436 25 HG3 ARG 4 HG3 ARG 4 -16.809 -7.439 -7.636 26 HD2 ARG 4 HD2 ARG 4 -15.243 -9.126 -8.417 27 HD3 ARG 4 HD3 ARG 4 -16.186 -8.485 -9.763 28 HE ARG 4 HE ARG 4 -13.917 -6.943 -9.682 29 HH11 ARG 4 HH11 ARG 4 -14.572 -10.382 -10.172 30 HH12 ARG 4 HH12 ARG 4 -13.148 -10.675 -11.035 31 HH21 ARG 4 HH21 ARG 4 -11.983 -7.321 -10.889 32 HH22 ARG 4 HH22 ARG 4 -11.624 -8.872 -11.462 33 H ALA 5 H ALA 5 -19.004 -3.924 -8.939 34 HA ALA 5 HA ALA 5 -19.477 -1.829 -9.516 35 HB1 ALA 5 HB1 ALA 5 -16.894 -1.832 -11.090 36 HB2 ALA 5 HB2 ALA 5 -17.039 -1.447 -9.375 37 HB3 ALA 5 HB3 ALA 5 -17.808 -0.411 -10.579 38 HA PRO 6 HA PRO 6 -21.440 -2.792 -13.481 39 HB2 PRO 6 HB2 PRO 6 -23.889 -2.044 -12.785 40 HB3 PRO 6 HB3 PRO 6 -23.207 -3.545 -12.144 41 HG2 PRO 6 HG2 PRO 6 -23.475 -0.867 -10.838 42 HG3 PRO 6 HG3 PRO 6 -23.772 -2.475 -10.153 43 HD2 PRO 6 HD2 PRO 6 -21.456 -1.012 -9.797 44 HD3 PRO 6 HD3 PRO 6 -21.568 -2.775 -9.632 45 H GLY 7 H GLY 7 -20.041 -0.266 -12.632 46 HA2 GLY 7 HA2 GLY 7 -19.798 1.856 -13.568 47 HA3 GLY 7 HA3 GLY 7 -21.248 1.550 -14.529 48 H SER 8 H SER 8 -20.218 2.138 -11.192 49 HA SER 8 HA SER 8 -22.549 3.794 -10.825 50 HB2 SER 8 HB2 SER 8 -22.827 2.646 -8.579 51 HB3 SER 8 HB3 SER 8 -23.274 1.682 -9.987 52 HG SER 8 HG SER 8 -21.855 0.754 -8.239 53 H THR 9 H THR 9 -22.238 5.286 -9.045 54 HA THR 9 HA THR 9 -19.395 5.707 -8.427 55 HB THR 9 HB THR 9 -21.589 7.797 -8.324 56 HG1 THR 9 HG1 THR 9 -21.251 6.828 -10.430 57 HG21 THR 9 HG21 THR 9 -18.575 8.011 -8.562 58 HG22 THR 9 HG22 THR 9 -19.487 8.253 -7.074 59 HG23 THR 9 HG23 THR 9 -19.701 9.362 -8.433 60 H LEU 10 H LEU 10 -18.831 6.144 -6.253 61 HA LEU 10 HA LEU 10 -20.880 5.326 -4.334 62 HB2 LEU 10 HB2 LEU 10 -17.893 5.377 -4.171 63 HB3 LEU 10 HB3 LEU 10 -18.941 4.825 -2.874 64 HG LEU 10 HG LEU 10 -18.527 3.517 -5.570 65 HD11 LEU 10 HD11 LEU 10 -16.670 3.200 -4.039 66 HD12 LEU 10 HD12 LEU 10 -17.554 1.695 -4.263 67 HD13 LEU 10 HD13 LEU 10 -17.777 2.632 -2.790 68 HD21 LEU 10 HD21 LEU 10 -19.957 1.709 -4.715 69 HD22 LEU 10 HD22 LEU 10 -20.841 3.229 -4.855 70 HD23 LEU 10 HD23 LEU 10 -20.292 2.668 -3.277 71 H ALA 11 H ALA 11 -20.287 6.266 -2.094 72 HA ALA 11 HA ALA 11 -19.876 9.166 -2.315 73 HB1 ALA 11 HB1 ALA 11 -21.059 9.287 -0.159 74 HB2 ALA 11 HB2 ALA 11 -21.216 7.530 -0.144 75 HB3 ALA 11 HB3 ALA 11 -22.050 8.484 -1.373 76 H ARG 12 H ARG 12 -19.040 9.737 0.297 77 HA ARG 12 HA ARG 12 -16.905 7.882 0.765 78 HB2 ARG 12 HB2 ARG 12 -15.089 9.545 0.791 79 HB3 ARG 12 HB3 ARG 12 -15.792 9.269 -0.784 80 HG2 ARG 12 HG2 ARG 12 -16.463 11.656 0.930 81 HG3 ARG 12 HG3 ARG 12 -15.153 11.635 -0.252 82 HD2 ARG 12 HD2 ARG 12 -18.077 11.202 -0.777 83 HD3 ARG 12 HD3 ARG 12 -17.139 12.632 -1.225 84 HE ARG 12 HE ARG 12 -15.824 10.594 -2.406 85 HH11 ARG 12 HH11 ARG 12 -19.201 11.651 -2.487 86 HH12 ARG 12 HH12 ARG 12 -19.496 11.107 -4.067 87 HH21 ARG 12 HH21 ARG 12 -16.225 9.797 -4.583 88 HH22 ARG 12 HH22 ARG 12 -17.755 10.027 -5.291 89 H VAL 13 H VAL 13 -16.844 7.351 2.690 90 HA VAL 13 HA VAL 13 -16.810 9.321 4.784 91 HB VAL 13 HB VAL 13 -19.168 8.704 4.761 92 HG11 VAL 13 HG11 VAL 13 -19.089 6.605 3.575 93 HG12 VAL 13 HG12 VAL 13 -19.973 6.408 5.089 94 HG13 VAL 13 HG13 VAL 13 -18.315 5.823 4.952 95 HG21 VAL 13 HG21 VAL 13 -19.456 7.786 7.025 96 HG22 VAL 13 HG22 VAL 13 -18.198 9.022 6.963 97 HG23 VAL 13 HG23 VAL 13 -17.757 7.315 7.035 98 H GLY 14 H GLY 14 -14.895 9.009 5.613 99 HA2 GLY 14 HA2 GLY 14 -13.024 7.984 6.516 100 HA3 GLY 14 HA3 GLY 14 -14.013 6.537 6.737 101 H SER 15 H SER 15 -13.327 8.258 3.775 102 HA SER 15 HA SER 15 -12.790 5.725 2.510 103 HB2 SER 15 HB2 SER 15 -13.026 7.111 0.462 104 HB3 SER 15 HB3 SER 15 -14.445 7.106 1.520 105 HG SER 15 HG SER 15 -12.398 9.026 1.507 106 H ILE 16 H ILE 16 -10.655 5.224 2.923 107 HA ILE 16 HA ILE 16 -8.582 7.075 2.273 108 HB ILE 16 HB ILE 16 -8.562 4.074 2.822 109 HG12 ILE 16 HG12 ILE 16 -7.060 4.691 4.712 110 HG13 ILE 16 HG13 ILE 16 -7.222 6.381 4.272 111 HG21 ILE 16 HG21 ILE 16 -6.153 5.700 2.017 112 HG22 ILE 16 HG22 ILE 16 -6.913 4.425 1.070 113 HG23 ILE 16 HG23 ILE 16 -6.120 4.033 2.598 114 HD11 ILE 16 HD11 ILE 16 -8.598 5.820 6.190 115 HD12 ILE 16 HD12 ILE 16 -9.419 4.570 5.254 116 HD13 ILE 16 HD13 ILE 16 -9.608 6.268 4.814 117 HA PRO 17 HA PRO 17 -9.362 6.529 -2.044 118 HB2 PRO 17 HB2 PRO 17 -7.429 8.134 -3.003 119 HB3 PRO 17 HB3 PRO 17 -8.868 8.772 -2.202 120 HG2 PRO 17 HG2 PRO 17 -6.119 8.358 -1.099 121 HG3 PRO 17 HG3 PRO 17 -7.209 9.739 -0.885 122 HD2 PRO 17 HD2 PRO 17 -6.908 7.778 0.981 123 HD3 PRO 17 HD3 PRO 17 -8.414 8.696 0.763 124 H ALA 18 H ALA 18 -8.331 5.810 -3.963 125 HA ALA 18 HA ALA 18 -5.765 4.435 -3.661 126 HB1 ALA 18 HB1 ALA 18 -6.699 2.670 -5.158 127 HB2 ALA 18 HB2 ALA 18 -8.274 3.459 -5.058 128 HB3 ALA 18 HB3 ALA 18 -7.549 2.754 -3.613 129 H GLY 19 H GLY 19 -4.389 5.281 -5.173 130 HA2 GLY 19 HA2 GLY 19 -5.674 6.570 -7.485 131 HA3 GLY 19 HA3 GLY 19 -4.361 7.304 -6.590 132 H ASP 20 H ASP 20 -2.243 6.559 -6.908 133 HA ASP 20 HA ASP 20 -1.990 5.492 -9.624 134 HB2 ASP 20 HB2 ASP 20 -1.155 7.699 -9.448 135 HB3 ASP 20 HB3 ASP 20 -0.229 7.310 -8.003 136 H ASP 21 H ASP 21 -1.323 3.582 -9.888 137 HA ASP 21 HA ASP 21 -0.225 1.980 -7.846 138 HB2 ASP 21 HB2 ASP 21 0.098 0.235 -9.590 139 HB3 ASP 21 HB3 ASP 21 -1.512 0.927 -9.646 140 H VAL 22 H VAL 22 1.674 2.301 -7.017 141 HA VAL 22 HA VAL 22 3.830 3.473 -8.534 142 HB VAL 22 HB VAL 22 3.877 2.387 -5.697 143 HG11 VAL 22 HG11 VAL 22 5.824 4.235 -7.089 144 HG12 VAL 22 HG12 VAL 22 6.124 2.553 -6.661 145 HG13 VAL 22 HG13 VAL 22 5.886 3.753 -5.392 146 HG21 VAL 22 HG21 VAL 22 3.483 5.201 -6.702 147 HG22 VAL 22 HG22 VAL 22 3.657 4.734 -5.011 148 HG23 VAL 22 HG23 VAL 22 2.262 4.184 -5.944 149 H LEU 23 H LEU 23 2.966 0.311 -7.374 150 HA LEU 23 HA LEU 23 5.441 -0.853 -8.251 151 HB2 LEU 23 HB2 LEU 23 4.262 -3.060 -7.867 152 HB3 LEU 23 HB3 LEU 23 4.518 -2.061 -6.464 153 HG LEU 23 HG LEU 23 2.129 -1.484 -6.402 154 HD11 LEU 23 HD11 LEU 23 1.808 -3.339 -8.776 155 HD12 LEU 23 HD12 LEU 23 1.584 -1.591 -8.809 156 HD13 LEU 23 HD13 LEU 23 0.500 -2.604 -7.849 157 HD21 LEU 23 HD21 LEU 23 2.904 -3.430 -5.226 158 HD22 LEU 23 HD22 LEU 23 2.653 -4.426 -6.657 159 HD23 LEU 23 HD23 LEU 23 1.272 -3.690 -5.844 160 H ASP 24 H ASP 24 5.202 -2.834 -9.785 161 HA ASP 24 HA ASP 24 3.897 -1.756 -12.133 162 HB2 ASP 24 HB2 ASP 24 6.227 -2.622 -12.292 163 HB3 ASP 24 HB3 ASP 24 5.625 -4.224 -11.869 164 HA PRO 25 HA PRO 25 0.195 -4.100 -11.374 165 HB2 PRO 25 HB2 PRO 25 0.161 -4.215 -14.344 166 HB3 PRO 25 HB3 PRO 25 -1.131 -3.765 -13.225 167 HG2 PRO 25 HG2 PRO 25 0.163 -1.889 -14.550 168 HG3 PRO 25 HG3 PRO 25 -0.222 -1.654 -12.835 169 HD2 PRO 25 HD2 PRO 25 2.389 -2.340 -14.108 170 HD3 PRO 25 HD3 PRO 25 2.038 -1.298 -12.711 171 H ASP 26 H ASP 26 2.776 -5.397 -13.391 172 HA ASP 26 HA ASP 26 1.540 -7.977 -13.735 173 HB2 ASP 26 HB2 ASP 26 3.227 -7.142 -15.343 174 HB3 ASP 26 HB3 ASP 26 4.440 -7.174 -14.072 175 H GLU 27 H GLU 27 3.366 -6.437 -11.307 176 HA GLU 27 HA GLU 27 4.578 -8.705 -10.122 177 HB2 GLU 27 HB2 GLU 27 4.008 -5.943 -9.061 178 HB3 GLU 27 HB3 GLU 27 4.928 -7.148 -8.173 179 HG2 GLU 27 HG2 GLU 27 5.633 -5.977 -10.843 180 HG3 GLU 27 HG3 GLU 27 6.414 -5.607 -9.301 181 HA PRO 28 HA PRO 28 1.663 -10.828 -7.583 182 HB2 PRO 28 HB2 PRO 28 3.282 -9.798 -5.283 183 HB3 PRO 28 HB3 PRO 28 2.655 -11.426 -5.561 184 HG2 PRO 28 HG2 PRO 28 5.192 -10.883 -6.059 185 HG3 PRO 28 HG3 PRO 28 4.266 -11.911 -7.165 186 HD2 PRO 28 HD2 PRO 28 5.177 -9.109 -7.502 187 HD3 PRO 28 HD3 PRO 28 4.904 -10.364 -8.725 188 H THR 29 H THR 29 -0.252 -9.872 -7.638 189 HA THR 29 HA THR 29 -0.807 -7.831 -5.667 190 HB THR 29 HB THR 29 -2.452 -6.987 -7.555 191 HG1 THR 29 HG1 THR 29 -0.265 -7.863 -9.112 192 HG21 THR 29 HG21 THR 29 -0.722 -5.585 -6.526 193 HG22 THR 29 HG22 THR 29 -0.758 -5.329 -8.270 194 HG23 THR 29 HG23 THR 29 0.506 -6.330 -7.552 195 H TYR 30 H TYR 30 -3.099 -7.648 -5.289 196 HA TYR 30 HA TYR 30 -4.701 -10.054 -5.758 197 HB2 TYR 30 HB2 TYR 30 -4.369 -8.451 -3.214 198 HB3 TYR 30 HB3 TYR 30 -5.682 -9.581 -3.502 199 HD1 TYR 30 HD1 TYR 30 -4.383 -11.866 -4.686 200 HD2 TYR 30 HD2 TYR 30 -3.031 -9.339 -1.567 201 HE1 TYR 30 HE1 TYR 30 -3.084 -13.707 -3.804 202 HE2 TYR 30 HE2 TYR 30 -1.698 -11.185 -0.647 203 HH TYR 30 HH TYR 30 -1.133 -14.079 -2.366 204 H ASP 31 H ASP 31 -6.932 -9.549 -5.581 205 HA ASP 31 HA ASP 31 -7.619 -6.772 -6.160 206 HB2 ASP 31 HB2 ASP 31 -9.144 -7.580 -7.982 207 HB3 ASP 31 HB3 ASP 31 -7.444 -7.824 -8.352 208 H LEU 32 H LEU 32 -10.138 -6.736 -6.238 209 HA LEU 32 HA LEU 32 -10.909 -7.003 -3.643 210 HB2 LEU 32 HB2 LEU 32 -12.721 -6.856 -6.044 211 HB3 LEU 32 HB3 LEU 32 -13.255 -6.603 -4.398 212 HG LEU 32 HG LEU 32 -11.272 -4.890 -5.908 213 HD11 LEU 32 HD11 LEU 32 -13.028 -3.192 -5.838 214 HD12 LEU 32 HD12 LEU 32 -14.113 -4.354 -5.077 215 HD13 LEU 32 HD13 LEU 32 -13.545 -4.628 -6.725 216 HD21 LEU 32 HD21 LEU 32 -12.433 -4.559 -3.137 217 HD22 LEU 32 HD22 LEU 32 -11.452 -3.363 -3.983 218 HD23 LEU 32 HD23 LEU 32 -10.745 -4.906 -3.526 219 HA PRO 33 HA PRO 33 -13.493 -11.030 -4.154 220 HB2 PRO 33 HB2 PRO 33 -12.989 -12.588 -6.367 221 HB3 PRO 33 HB3 PRO 33 -14.353 -11.477 -6.218 222 HG2 PRO 33 HG2 PRO 33 -11.739 -11.101 -7.591 223 HG3 PRO 33 HG3 PRO 33 -13.357 -10.596 -8.107 224 HD2 PRO 33 HD2 PRO 33 -11.585 -8.868 -7.039 225 HD3 PRO 33 HD3 PRO 33 -13.334 -8.726 -6.765 226 H ARG 34 H ARG 34 -10.207 -10.901 -5.471 227 HA ARG 34 HA ARG 34 -9.354 -13.434 -4.628 228 HB2 ARG 34 HB2 ARG 34 -8.307 -11.810 -6.286 229 HB3 ARG 34 HB3 ARG 34 -7.786 -10.924 -4.867 230 HG2 ARG 34 HG2 ARG 34 -6.007 -12.244 -5.787 231 HG3 ARG 34 HG3 ARG 34 -6.427 -12.792 -4.158 232 HD2 ARG 34 HD2 ARG 34 -7.530 -14.685 -4.996 233 HD3 ARG 34 HD3 ARG 34 -7.544 -14.028 -6.637 234 HE ARG 34 HE ARG 34 -4.924 -14.153 -6.093 235 HH11 ARG 34 HH11 ARG 34 -7.406 -16.681 -5.785 236 HH12 ARG 34 HH12 ARG 34 -6.330 -17.946 -6.113 237 HH21 ARG 34 HH21 ARG 34 -3.464 -15.907 -6.548 238 HH22 ARG 34 HH22 ARG 34 -4.058 -17.504 -6.556 239 H VAL 35 H VAL 35 -9.105 -10.189 -3.142 240 HA VAL 35 HA VAL 35 -7.756 -11.098 -0.810 241 HB VAL 35 HB VAL 35 -9.417 -8.565 -1.119 242 HG11 VAL 35 HG11 VAL 35 -8.101 -7.690 0.767 243 HG12 VAL 35 HG12 VAL 35 -7.307 -9.257 0.929 244 HG13 VAL 35 HG13 VAL 35 -9.037 -9.114 1.224 245 HG21 VAL 35 HG21 VAL 35 -7.271 -7.431 -1.495 246 HG22 VAL 35 HG22 VAL 35 -7.617 -8.628 -2.745 247 HG23 VAL 35 HG23 VAL 35 -6.456 -8.994 -1.467 248 H ALA 36 H ALA 36 -11.083 -10.607 -1.639 249 HA ALA 36 HA ALA 36 -12.246 -10.968 0.884 250 HB1 ALA 36 HB1 ALA 36 -13.375 -11.676 -1.830 251 HB2 ALA 36 HB2 ALA 36 -13.451 -10.090 -1.067 252 HB3 ALA 36 HB3 ALA 36 -14.295 -11.455 -0.340 253 H GLU 37 H GLU 37 -11.194 -13.187 -1.578 254 HA GLU 37 HA GLU 37 -12.261 -15.585 -0.516 255 HB2 GLU 37 HB2 GLU 37 -11.220 -14.906 -2.852 256 HB3 GLU 37 HB3 GLU 37 -9.754 -15.487 -2.102 257 HG2 GLU 37 HG2 GLU 37 -10.685 -17.288 -3.348 258 HG3 GLU 37 HG3 GLU 37 -10.888 -17.633 -1.627 259 H LEU 38 H LEU 38 -9.103 -13.987 -0.347 260 HA LEU 38 HA LEU 38 -7.591 -15.862 1.054 261 HB2 LEU 38 HB2 LEU 38 -7.420 -12.867 1.194 262 HB3 LEU 38 HB3 LEU 38 -6.207 -13.961 1.801 263 HG LEU 38 HG LEU 38 -6.978 -13.656 -1.100 264 HD11 LEU 38 HD11 LEU 38 -5.862 -11.680 -0.163 265 HD12 LEU 38 HD12 LEU 38 -4.815 -12.545 -1.287 266 HD13 LEU 38 HD13 LEU 38 -4.571 -12.715 0.446 267 HD21 LEU 38 HD21 LEU 38 -6.136 -15.904 -0.584 268 HD22 LEU 38 HD22 LEU 38 -4.739 -15.183 0.224 269 HD23 LEU 38 HD23 LEU 38 -4.950 -14.976 -1.509 270 H LEU 39 H LEU 39 -9.627 -13.278 2.263 271 HA LEU 39 HA LEU 39 -8.995 -14.042 5.001 272 HB2 LEU 39 HB2 LEU 39 -10.639 -11.763 3.952 273 HB3 LEU 39 HB3 LEU 39 -10.224 -12.021 5.638 274 HG LEU 39 HG LEU 39 -8.268 -11.416 3.412 275 HD11 LEU 39 HD11 LEU 39 -9.674 -9.513 3.943 276 HD12 LEU 39 HD12 LEU 39 -8.022 -9.255 4.502 277 HD13 LEU 39 HD13 LEU 39 -9.285 -9.686 5.656 278 HD21 LEU 39 HD21 LEU 39 -7.843 -11.671 6.394 279 HD22 LEU 39 HD22 LEU 39 -6.637 -11.136 5.225 280 HD23 LEU 39 HD23 LEU 39 -7.247 -12.784 5.156 281 H GLY 40 H GLY 40 -11.427 -14.628 2.704 282 HA2 GLY 40 HA2 GLY 40 -13.363 -15.861 2.874 283 HA3 GLY 40 HA3 GLY 40 -12.948 -16.185 4.556 284 H VAL 41 H VAL 41 -13.202 -13.064 3.132 285 HA VAL 41 HA VAL 41 -15.586 -12.459 4.772 286 HB VAL 41 HB VAL 41 -14.729 -10.213 5.176 287 HG11 VAL 41 HG11 VAL 41 -12.776 -10.670 6.577 288 HG12 VAL 41 HG12 VAL 41 -12.651 -12.270 5.849 289 HG13 VAL 41 HG13 VAL 41 -14.070 -11.845 6.802 290 HG21 VAL 41 HG21 VAL 41 -12.397 -9.584 4.480 291 HG22 VAL 41 HG22 VAL 41 -13.539 -9.761 3.142 292 HG23 VAL 41 HG23 VAL 41 -12.387 -11.038 3.473 293 HA PRO 42 HA PRO 42 -17.264 -10.735 0.982 294 HB2 PRO 42 HB2 PRO 42 -18.563 -8.509 1.862 295 HB3 PRO 42 HB3 PRO 42 -19.210 -10.136 2.075 296 HG2 PRO 42 HG2 PRO 42 -17.736 -8.412 4.021 297 HG3 PRO 42 HG3 PRO 42 -19.154 -9.447 4.286 298 HD2 PRO 42 HD2 PRO 42 -16.681 -10.202 5.013 299 HD3 PRO 42 HD3 PRO 42 -17.888 -11.360 4.434 300 H VAL 43 H VAL 43 -16.996 -8.976 -0.484 301 HA VAL 43 HA VAL 43 -14.506 -7.679 -0.491 302 HB VAL 43 HB VAL 43 -16.998 -6.885 -2.029 303 HG11 VAL 43 HG11 VAL 43 -15.358 -5.126 -2.099 304 HG12 VAL 43 HG12 VAL 43 -15.424 -5.923 -3.674 305 HG13 VAL 43 HG13 VAL 43 -14.100 -6.270 -2.558 306 HG21 VAL 43 HG21 VAL 43 -16.421 -9.232 -2.423 307 HG22 VAL 43 HG22 VAL 43 -14.767 -8.767 -2.819 308 HG23 VAL 43 HG23 VAL 43 -16.097 -8.264 -3.860 309 H SER 44 H SER 44 -17.662 -6.646 0.562 310 HA SER 44 HA SER 44 -17.104 -3.942 0.947 311 HB2 SER 44 HB2 SER 44 -19.385 -4.946 0.903 312 HB3 SER 44 HB3 SER 44 -19.076 -5.655 2.483 313 HG SER 44 HG SER 44 -20.082 -3.845 2.953 314 H LYS 45 H LYS 45 -16.494 -6.756 3.084 315 HA LYS 45 HA LYS 45 -15.715 -5.100 5.261 316 HB2 LYS 45 HB2 LYS 45 -16.403 -7.478 5.662 317 HB3 LYS 45 HB3 LYS 45 -14.929 -7.999 4.841 318 HG2 LYS 45 HG2 LYS 45 -13.546 -7.042 6.513 319 HG3 LYS 45 HG3 LYS 45 -14.920 -6.249 7.275 320 HD2 LYS 45 HD2 LYS 45 -14.518 -9.244 7.112 321 HD3 LYS 45 HD3 LYS 45 -14.132 -8.252 8.514 322 HE2 LYS 45 HE2 LYS 45 -16.547 -7.526 8.539 323 HE3 LYS 45 HE3 LYS 45 -16.834 -8.739 7.291 324 HZ1 LYS 45 HZ1 LYS 45 -15.803 -9.284 10.009 325 HZ2 LYS 45 HZ2 LYS 45 -16.110 -10.461 8.836 326 HZ3 LYS 45 HZ3 LYS 45 -17.363 -9.558 9.476 327 H VAL 46 H VAL 46 -14.079 -6.472 2.529 328 HA VAL 46 HA VAL 46 -11.421 -5.884 3.275 329 HB VAL 46 HB VAL 46 -12.649 -5.791 0.491 330 HG11 VAL 46 HG11 VAL 46 -9.759 -6.060 1.307 331 HG12 VAL 46 HG12 VAL 46 -10.515 -4.646 0.573 332 HG13 VAL 46 HG13 VAL 46 -10.376 -6.147 -0.349 333 HG21 VAL 46 HG21 VAL 46 -11.250 -8.056 1.914 334 HG22 VAL 46 HG22 VAL 46 -11.792 -8.081 0.237 335 HG23 VAL 46 HG23 VAL 46 -12.971 -7.970 1.544 336 H ALA 47 H ALA 47 -13.908 -4.008 1.686 337 HA ALA 47 HA ALA 47 -12.488 -1.614 1.330 338 HB1 ALA 47 HB1 ALA 47 -15.464 -1.984 1.723 339 HB2 ALA 47 HB2 ALA 47 -14.622 -2.156 0.194 340 HB3 ALA 47 HB3 ALA 47 -14.681 -0.578 0.995 341 H GLN 48 H GLN 48 -14.307 -2.893 4.026 342 HA GLN 48 HA GLN 48 -14.259 -0.570 5.648 343 HB2 GLN 48 HB2 GLN 48 -14.492 -3.468 6.443 344 HB3 GLN 48 HB3 GLN 48 -14.754 -2.119 7.534 345 HG2 GLN 48 HG2 GLN 48 -16.610 -1.360 6.119 346 HG3 GLN 48 HG3 GLN 48 -16.346 -2.748 5.063 347 HE21 GLN 48 HE21 GLN 48 -17.508 -1.663 8.100 348 HE22 GLN 48 HE22 GLN 48 -18.279 -3.126 8.576 349 H GLN 49 H GLN 49 -12.054 -3.295 5.331 350 HA GLN 49 HA GLN 49 -10.283 -2.604 7.432 351 HB2 GLN 49 HB2 GLN 49 -9.580 -3.931 4.804 352 HB3 GLN 49 HB3 GLN 49 -8.629 -3.987 6.282 353 HG2 GLN 49 HG2 GLN 49 -11.398 -5.123 5.997 354 HG3 GLN 49 HG3 GLN 49 -9.912 -6.033 5.769 355 HE21 GLN 49 HE21 GLN 49 -10.524 -7.425 7.416 356 HE22 GLN 49 HE22 GLN 49 -10.417 -7.007 9.088 357 H LEU 50 H LEU 50 -10.415 -1.762 4.057 358 HA LEU 50 HA LEU 50 -8.143 -0.116 3.838 359 HB2 LEU 50 HB2 LEU 50 -9.398 -0.923 1.901 360 HB3 LEU 50 HB3 LEU 50 -10.807 -0.024 2.408 361 HG LEU 50 HG LEU 50 -9.555 2.087 1.974 362 HD11 LEU 50 HD11 LEU 50 -7.500 0.242 0.773 363 HD12 LEU 50 HD12 LEU 50 -7.286 1.266 2.193 364 HD13 LEU 50 HD13 LEU 50 -7.535 1.996 0.607 365 HD21 LEU 50 HD21 LEU 50 -9.728 1.952 -0.463 366 HD22 LEU 50 HD22 LEU 50 -11.104 1.191 0.335 367 HD23 LEU 50 HD23 LEU 50 -9.822 0.194 -0.357 368 H ARG 51 H ARG 51 -11.518 0.606 4.721 369 HA ARG 51 HA ARG 51 -11.394 3.337 5.039 370 HB2 ARG 51 HB2 ARG 51 -13.454 2.098 4.910 371 HB3 ARG 51 HB3 ARG 51 -13.061 1.215 6.373 372 HG2 ARG 51 HG2 ARG 51 -13.191 3.251 7.640 373 HG3 ARG 51 HG3 ARG 51 -13.585 4.143 6.159 374 HD2 ARG 51 HD2 ARG 51 -15.583 2.755 5.877 375 HD3 ARG 51 HD3 ARG 51 -15.215 1.908 7.381 376 HE ARG 51 HE ARG 51 -15.315 4.533 8.048 377 HH11 ARG 51 HH11 ARG 51 -17.569 2.227 6.633 378 HH12 ARG 51 HH12 ARG 51 -18.972 3.034 7.157 379 HH21 ARG 51 HH21 ARG 51 -17.250 5.640 8.822 380 HH22 ARG 51 HH22 ARG 51 -18.785 5.009 8.434 381 H GLU 52 H GLU 52 -10.382 0.752 7.204 382 HA GLU 52 HA GLU 52 -10.183 2.555 9.469 383 HB2 GLU 52 HB2 GLU 52 -9.348 -0.325 9.164 384 HB3 GLU 52 HB3 GLU 52 -9.299 0.583 10.663 385 HG2 GLU 52 HG2 GLU 52 -11.750 -0.113 9.077 386 HG3 GLU 52 HG3 GLU 52 -11.235 -0.845 10.595 387 H GLY 53 H GLY 53 -8.314 1.887 6.819 388 HA2 GLY 53 HA2 GLY 53 -6.139 2.406 6.302 389 HA3 GLY 53 HA3 GLY 53 -5.961 3.078 7.926 390 H HIS 54 H HIS 54 -7.116 -0.123 7.282 391 HA HIS 54 HA HIS 54 -4.825 -1.253 8.701 392 HB2 HIS 54 HB2 HIS 54 -7.158 -1.816 9.436 393 HB3 HIS 54 HB3 HIS 54 -7.460 -2.526 7.862 394 HD1 HIS 54 HD1 HIS 54 -7.149 -5.065 7.822 395 HD2 HIS 54 HD2 HIS 54 -4.946 -3.225 10.838 396 HE1 HIS 54 HE1 HIS 54 -6.098 -6.900 9.127 397 H LEU 55 H LEU 55 -6.078 -0.764 5.600 398 HA LEU 55 HA LEU 55 -4.012 -2.359 4.377 399 HB2 LEU 55 HB2 LEU 55 -6.025 -3.852 4.637 400 HB3 LEU 55 HB3 LEU 55 -6.938 -2.706 3.683 401 HG LEU 55 HG LEU 55 -5.447 -3.168 1.754 402 HD11 LEU 55 HD11 LEU 55 -4.288 -5.261 3.585 403 HD12 LEU 55 HD12 LEU 55 -3.448 -3.849 2.939 404 HD13 LEU 55 HD13 LEU 55 -3.974 -5.135 1.857 405 HD21 LEU 55 HD21 LEU 55 -6.342 -5.406 1.282 406 HD22 LEU 55 HD22 LEU 55 -7.565 -4.352 1.991 407 HD23 LEU 55 HD23 LEU 55 -6.783 -5.580 2.983 408 H VAL 56 H VAL 56 -3.761 -1.660 2.087 409 HA VAL 56 HA VAL 56 -5.195 0.770 1.325 410 HB VAL 56 HB VAL 56 -2.164 0.438 1.379 411 HG11 VAL 56 HG11 VAL 56 -3.694 2.688 0.076 412 HG12 VAL 56 HG12 VAL 56 -2.808 1.421 -0.772 413 HG13 VAL 56 HG13 VAL 56 -1.936 2.567 0.244 414 HG21 VAL 56 HG21 VAL 56 -2.217 2.549 2.618 415 HG22 VAL 56 HG22 VAL 56 -3.094 1.255 3.440 416 HG23 VAL 56 HG23 VAL 56 -3.979 2.511 2.574 417 H ALA 57 H ALA 57 -5.303 1.067 -0.934 418 HA ALA 57 HA ALA 57 -4.485 -1.192 -2.599 419 HB1 ALA 57 HB1 ALA 57 -6.692 -1.245 -3.634 420 HB2 ALA 57 HB2 ALA 57 -7.237 0.044 -2.565 421 HB3 ALA 57 HB3 ALA 57 -6.840 -1.537 -1.898 422 H VAL 58 H VAL 58 -4.578 -0.610 -4.886 423 HA VAL 58 HA VAL 58 -4.639 2.243 -5.463 424 HB VAL 58 HB VAL 58 -2.716 1.896 -7.119 425 HG11 VAL 58 HG11 VAL 58 -2.435 3.211 -5.110 426 HG12 VAL 58 HG12 VAL 58 -0.978 2.264 -5.419 427 HG13 VAL 58 HG13 VAL 58 -2.115 1.754 -4.172 428 HG21 VAL 58 HG21 VAL 58 -2.648 -0.544 -7.095 429 HG22 VAL 58 HG22 VAL 58 -2.226 -0.527 -5.382 430 HG23 VAL 58 HG23 VAL 58 -1.098 0.118 -6.573 431 H ARG 59 H ARG 59 -4.662 2.582 -7.926 432 HA ARG 59 HA ARG 59 -6.493 0.546 -8.975 433 HB2 ARG 59 HB2 ARG 59 -6.425 3.496 -9.530 434 HB3 ARG 59 HB3 ARG 59 -7.520 2.359 -10.304 435 HG2 ARG 59 HG2 ARG 59 -8.500 1.864 -8.081 436 HG3 ARG 59 HG3 ARG 59 -7.442 3.091 -7.378 437 HD2 ARG 59 HD2 ARG 59 -9.566 4.110 -7.733 438 HD3 ARG 59 HD3 ARG 59 -8.466 4.747 -8.949 439 HE ARG 59 HE ARG 59 -10.456 2.641 -9.457 440 HH11 ARG 59 HH11 ARG 59 -8.725 5.543 -10.570 441 HH12 ARG 59 HH12 ARG 59 -9.561 5.647 -12.034 442 HH21 ARG 59 HH21 ARG 59 -11.668 2.849 -11.467 443 HH22 ARG 59 HH22 ARG 59 -11.260 4.055 -12.577 444 H ARG 60 H ARG 60 -5.916 -0.444 -10.729 445 HA ARG 60 HA ARG 60 -4.106 0.893 -12.556 446 HB2 ARG 60 HB2 ARG 60 -2.800 -1.160 -12.984 447 HB3 ARG 60 HB3 ARG 60 -2.691 -0.690 -11.306 448 HG2 ARG 60 HG2 ARG 60 -2.900 -2.975 -11.135 449 HG3 ARG 60 HG3 ARG 60 -4.583 -2.472 -10.978 450 HD2 ARG 60 HD2 ARG 60 -4.922 -2.972 -13.374 451 HD3 ARG 60 HD3 ARG 60 -3.245 -3.492 -13.489 452 HE ARG 60 HE ARG 60 -5.262 -4.803 -11.788 453 HH11 ARG 60 HH11 ARG 60 -2.626 -5.071 -14.157 454 HH12 ARG 60 HH12 ARG 60 -2.462 -6.762 -13.958 455 HH21 ARG 60 HH21 ARG 60 -5.062 -7.162 -11.629 456 HH22 ARG 60 HH22 ARG 60 -3.850 -7.943 -12.547 457 H ALA 61 H ALA 61 -4.897 1.041 -14.492 458 HA ALA 61 HA ALA 61 -6.199 0.795 -16.326 459 HB1 ALA 61 HB1 ALA 61 -4.984 -1.340 -16.533 460 HB2 ALA 61 HB2 ALA 61 -6.632 -1.475 -17.149 461 HB3 ALA 61 HB3 ALA 61 -6.227 -2.134 -15.565 462 H GLY 62 H GLY 62 -7.440 1.302 -13.721 463 HA2 GLY 62 HA2 GLY 62 -9.652 1.952 -13.310 464 HA3 GLY 62 HA3 GLY 62 -10.201 0.820 -14.535 465 H GLY 63 H GLY 63 -8.093 -0.952 -12.850 466 HA2 GLY 63 HA2 GLY 63 -10.240 -2.132 -11.244 467 HA3 GLY 63 HA3 GLY 63 -8.752 -2.922 -11.756 468 H VAL 64 H VAL 64 -9.960 -2.694 -9.155 469 HA VAL 64 HA VAL 64 -8.043 -1.015 -7.718 470 HB VAL 64 HB VAL 64 -10.398 -2.600 -6.628 471 HG11 VAL 64 HG11 VAL 64 -8.704 -0.470 -5.327 472 HG12 VAL 64 HG12 VAL 64 -8.675 -2.196 -4.966 473 HG13 VAL 64 HG13 VAL 64 -10.117 -1.246 -4.606 474 HG21 VAL 64 HG21 VAL 64 -10.220 0.346 -7.249 475 HG22 VAL 64 HG22 VAL 64 -11.560 -0.444 -6.417 476 HG23 VAL 64 HG23 VAL 64 -11.202 -0.849 -8.095 477 H VAL 65 H VAL 65 -6.291 -1.959 -7.008 478 HA VAL 65 HA VAL 65 -6.358 -4.815 -6.434 479 HB VAL 65 HB VAL 65 -3.988 -4.946 -7.350 480 HG11 VAL 65 HG11 VAL 65 -6.208 -4.365 -9.315 481 HG12 VAL 65 HG12 VAL 65 -5.891 -5.923 -8.555 482 HG13 VAL 65 HG13 VAL 65 -4.722 -5.238 -9.680 483 HG21 VAL 65 HG21 VAL 65 -3.363 -3.291 -9.044 484 HG22 VAL 65 HG22 VAL 65 -3.564 -2.536 -7.456 485 HG23 VAL 65 HG23 VAL 65 -4.834 -2.387 -8.679 486 H ILE 66 H ILE 66 -4.907 -5.506 -4.983 487 HA ILE 66 HA ILE 66 -3.749 -3.454 -3.241 488 HB ILE 66 HB ILE 66 -4.878 -6.176 -2.433 489 HG12 ILE 66 HG12 ILE 66 -6.441 -4.774 -0.954 490 HG13 ILE 66 HG13 ILE 66 -5.948 -3.391 -1.911 491 HG21 ILE 66 HG21 ILE 66 -2.956 -5.622 -1.100 492 HG22 ILE 66 HG22 ILE 66 -4.426 -5.505 -0.131 493 HG23 ILE 66 HG23 ILE 66 -3.641 -4.041 -0.720 494 HD11 ILE 66 HD11 ILE 66 -8.109 -4.263 -2.619 495 HD12 ILE 66 HD12 ILE 66 -7.384 -5.836 -2.952 496 HD13 ILE 66 HD13 ILE 66 -6.912 -4.431 -3.903 497 HA PRO 67 HA PRO 67 0.008 -5.641 -4.462 498 HB2 PRO 67 HB2 PRO 67 1.061 -4.480 -1.952 499 HB3 PRO 67 HB3 PRO 67 1.699 -4.351 -3.595 500 HG2 PRO 67 HG2 PRO 67 0.505 -2.273 -2.450 501 HG3 PRO 67 HG3 PRO 67 0.242 -2.633 -4.163 502 HD2 PRO 67 HD2 PRO 67 -1.543 -3.167 -1.825 503 HD3 PRO 67 HD3 PRO 67 -1.944 -2.594 -3.464 504 H GLN 68 H GLN 68 0.441 -7.759 -4.044 505 HA GLN 68 HA GLN 68 -0.685 -9.160 -1.918 506 HB2 GLN 68 HB2 GLN 68 -0.234 -10.205 -3.965 507 HB3 GLN 68 HB3 GLN 68 1.462 -9.782 -3.909 508 HG2 GLN 68 HG2 GLN 68 1.886 -11.386 -2.204 509 HG3 GLN 68 HG3 GLN 68 0.160 -11.689 -1.986 510 HE21 GLN 68 HE21 GLN 68 -0.443 -11.640 -4.828 511 HE22 GLN 68 HE22 GLN 68 0.183 -13.094 -5.469 512 H VAL 69 H VAL 69 2.297 -7.542 -2.216 513 HA VAL 69 HA VAL 69 3.749 -8.802 -0.174 514 HB VAL 69 HB VAL 69 5.178 -6.764 -0.219 515 HG11 VAL 69 HG11 VAL 69 5.906 -7.035 -2.552 516 HG12 VAL 69 HG12 VAL 69 4.396 -7.868 -2.920 517 HG13 VAL 69 HG13 VAL 69 5.551 -8.591 -1.800 518 HG21 VAL 69 HG21 VAL 69 3.075 -5.778 -2.158 519 HG22 VAL 69 HG22 VAL 69 4.656 -5.025 -1.919 520 HG23 VAL 69 HG23 VAL 69 3.502 -5.072 -0.596 521 H PHE 70 H PHE 70 1.099 -6.595 0.006 522 HA PHE 70 HA PHE 70 1.686 -5.500 2.582 523 HB2 PHE 70 HB2 PHE 70 -0.700 -5.483 0.764 524 HB3 PHE 70 HB3 PHE 70 -0.929 -5.051 2.449 525 HD1 PHE 70 HD1 PHE 70 1.780 -4.235 -0.006 526 HD2 PHE 70 HD2 PHE 70 -1.238 -2.784 2.593 527 HE1 PHE 70 HE1 PHE 70 2.493 -1.915 -0.465 528 HE2 PHE 70 HE2 PHE 70 -0.523 -0.483 2.179 529 HZ PHE 70 HZ PHE 70 1.304 -0.025 0.640 530 H PHE 71 H PHE 71 0.792 -8.515 1.555 531 HA PHE 71 HA PHE 71 -0.458 -9.191 4.112 532 HB2 PHE 71 HB2 PHE 71 -0.672 -10.573 1.431 533 HB3 PHE 71 HB3 PHE 71 -1.332 -11.194 2.935 534 HD1 PHE 71 HD1 PHE 71 -1.692 -8.718 0.285 535 HD2 PHE 71 HD2 PHE 71 -3.319 -10.222 3.905 536 HE1 PHE 71 HE1 PHE 71 -3.784 -7.519 -0.160 537 HE2 PHE 71 HE2 PHE 71 -5.417 -9.030 3.467 538 HZ PHE 71 HZ PHE 71 -5.654 -7.672 1.432 539 H THR 72 H THR 72 0.144 -11.265 4.917 540 HA THR 72 HA THR 72 2.921 -11.893 4.587 541 HB THR 72 HB THR 72 2.425 -13.565 6.375 542 HG1 THR 72 HG1 THR 72 0.189 -13.099 7.311 543 HG21 THR 72 HG21 THR 72 1.323 -10.803 6.931 544 HG22 THR 72 HG22 THR 72 3.028 -11.255 6.966 545 HG23 THR 72 HG23 THR 72 1.915 -11.947 8.137 546 H ASN 73 H ASN 73 3.314 -14.465 4.494 547 HA ASN 73 HA ASN 73 2.512 -15.349 1.940 548 HB2 ASN 73 HB2 ASN 73 3.640 -17.011 4.224 549 HB3 ASN 73 HB3 ASN 73 3.481 -17.561 2.571 550 HD21 ASN 73 HD21 ASN 73 5.660 -17.937 2.295 551 HD22 ASN 73 HD22 ASN 73 6.826 -16.679 2.209 552 H SER 74 H SER 74 1.011 -15.621 4.998 553 HA SER 74 HA SER 74 -0.739 -17.805 4.364 554 HB2 SER 74 HB2 SER 74 0.017 -17.286 6.688 555 HB3 SER 74 HB3 SER 74 -0.866 -15.767 6.618 556 HG SER 74 HG SER 74 -1.915 -18.374 6.419 557 H GLY 75 H GLY 75 -0.637 -14.550 3.471 558 HA2 GLY 75 HA2 GLY 75 -2.132 -13.382 2.162 559 HA3 GLY 75 HA3 GLY 75 -3.305 -14.673 2.393 560 H GLN 76 H GLN 76 -1.751 -13.256 5.134 561 HA GLN 76 HA GLN 76 -4.265 -11.889 5.803 562 HB2 GLN 76 HB2 GLN 76 -3.680 -13.792 7.307 563 HB3 GLN 76 HB3 GLN 76 -2.152 -13.002 7.673 564 HG2 GLN 76 HG2 GLN 76 -3.388 -11.102 8.621 565 HG3 GLN 76 HG3 GLN 76 -4.895 -11.938 8.281 566 HE21 GLN 76 HE21 GLN 76 -5.495 -11.960 10.376 567 HE22 GLN 76 HE22 GLN 76 -4.783 -12.962 11.582 568 H VAL 77 H VAL 77 -4.023 -9.807 6.825 569 HA VAL 77 HA VAL 77 -1.977 -8.218 5.751 570 HB VAL 77 HB VAL 77 -4.077 -7.683 7.874 571 HG11 VAL 77 HG11 VAL 77 -2.222 -6.255 8.460 572 HG12 VAL 77 HG12 VAL 77 -3.464 -5.271 7.665 573 HG13 VAL 77 HG13 VAL 77 -2.025 -5.797 6.775 574 HG21 VAL 77 HG21 VAL 77 -4.840 -7.910 5.572 575 HG22 VAL 77 HG22 VAL 77 -3.681 -6.675 5.073 576 HG23 VAL 77 HG23 VAL 77 -5.014 -6.244 6.142 577 H VAL 78 H VAL 78 -0.080 -7.547 6.500 578 HA VAL 78 HA VAL 78 1.249 -8.883 8.607 579 HB VAL 78 HB VAL 78 2.010 -6.212 7.377 580 HG11 VAL 78 HG11 VAL 78 3.307 -6.741 9.350 581 HG12 VAL 78 HG12 VAL 78 4.309 -6.842 7.903 582 HG13 VAL 78 HG13 VAL 78 3.724 -8.319 8.677 583 HG21 VAL 78 HG21 VAL 78 3.360 -7.452 5.757 584 HG22 VAL 78 HG22 VAL 78 1.646 -7.820 5.586 585 HG23 VAL 78 HG23 VAL 78 2.718 -8.973 6.383 586 H LYS 79 H LYS 79 1.291 -8.396 10.745 587 HA LYS 79 HA LYS 79 -0.494 -6.636 11.974 588 HB2 LYS 79 HB2 LYS 79 0.463 -7.154 14.060 589 HB3 LYS 79 HB3 LYS 79 0.594 -8.603 13.076 590 HG2 LYS 79 HG2 LYS 79 2.701 -6.608 13.325 591 HG3 LYS 79 HG3 LYS 79 2.593 -7.935 14.510 592 HD2 LYS 79 HD2 LYS 79 2.865 -9.523 12.590 593 HD3 LYS 79 HD3 LYS 79 3.031 -8.141 11.504 594 HE2 LYS 79 HE2 LYS 79 5.206 -9.075 12.046 595 HE3 LYS 79 HE3 LYS 79 5.044 -7.453 12.706 596 HZ1 LYS 79 HZ1 LYS 79 6.070 -9.053 14.227 597 HZ2 LYS 79 HZ2 LYS 79 4.657 -9.948 14.276 598 HZ3 LYS 79 HZ3 LYS 79 4.710 -8.360 14.890 599 H SER 80 H SER 80 2.524 -5.818 10.685 600 HA SER 80 HA SER 80 2.697 -3.375 12.269 601 HB2 SER 80 HB2 SER 80 4.704 -4.828 11.874 602 HB3 SER 80 HB3 SER 80 4.597 -4.432 10.168 603 HG SER 80 HG SER 80 5.477 -2.906 12.301 604 H LEU 81 H LEU 81 1.264 -4.415 9.393 605 HA LEU 81 HA LEU 81 1.858 -2.337 7.627 606 HB2 LEU 81 HB2 LEU 81 0.865 -4.449 6.908 607 HB3 LEU 81 HB3 LEU 81 -0.621 -4.045 7.747 608 HG LEU 81 HG LEU 81 -0.810 -2.053 6.258 609 HD11 LEU 81 HD11 LEU 81 1.424 -3.435 4.817 610 HD12 LEU 81 HD12 LEU 81 1.472 -1.836 5.582 611 HD13 LEU 81 HD13 LEU 81 0.458 -2.113 4.163 612 HD21 LEU 81 HD21 LEU 81 -1.630 -3.326 4.361 613 HD22 LEU 81 HD22 LEU 81 -2.098 -4.042 5.894 614 HD23 LEU 81 HD23 LEU 81 -0.775 -4.757 4.955 615 HA PRO 82 HA PRO 82 -2.326 -0.197 9.167 616 HB2 PRO 82 HB2 PRO 82 -2.834 -0.736 11.843 617 HB3 PRO 82 HB3 PRO 82 -3.702 -1.467 10.493 618 HG2 PRO 82 HG2 PRO 82 -1.400 -2.543 12.068 619 HG3 PRO 82 HG3 PRO 82 -2.862 -3.384 11.518 620 HD2 PRO 82 HD2 PRO 82 -0.571 -3.707 10.235 621 HD3 PRO 82 HD3 PRO 82 -2.086 -3.522 9.318 622 H GLY 83 H GLY 83 0.417 -0.956 11.180 623 HA2 GLY 83 HA2 GLY 83 0.397 1.424 12.729 624 HA3 GLY 83 HA3 GLY 83 1.755 0.318 12.541 625 H LEU 84 H LEU 84 2.206 0.419 9.833 626 HA LEU 84 HA LEU 84 3.597 2.882 9.636 627 HB2 LEU 84 HB2 LEU 84 4.550 2.106 7.630 628 HB3 LEU 84 HB3 LEU 84 4.308 0.666 8.581 629 HG LEU 84 HG LEU 84 2.059 0.590 7.100 630 HD11 LEU 84 HD11 LEU 84 2.530 1.255 4.796 631 HD12 LEU 84 HD12 LEU 84 4.042 1.993 5.317 632 HD13 LEU 84 HD13 LEU 84 2.509 2.639 5.882 633 HD21 LEU 84 HD21 LEU 84 3.291 -0.946 5.582 634 HD22 LEU 84 HD22 LEU 84 3.686 -1.220 7.282 635 HD23 LEU 84 HD23 LEU 84 4.802 -0.337 6.245 636 H LEU 85 H LEU 85 0.660 1.647 8.233 637 HA LEU 85 HA LEU 85 0.165 3.721 6.422 638 HB2 LEU 85 HB2 LEU 85 -1.839 2.037 7.913 639 HB3 LEU 85 HB3 LEU 85 -2.165 2.971 6.469 640 HG LEU 85 HG LEU 85 -0.349 0.574 6.660 641 HD11 LEU 85 HD11 LEU 85 -3.071 0.918 5.445 642 HD12 LEU 85 HD12 LEU 85 -2.630 -0.092 6.821 643 HD13 LEU 85 HD13 LEU 85 -2.035 -0.486 5.208 644 HD21 LEU 85 HD21 LEU 85 -0.246 0.735 4.196 645 HD22 LEU 85 HD22 LEU 85 0.492 2.122 5.002 646 HD23 LEU 85 HD23 LEU 85 -1.111 2.271 4.296 647 H THR 86 H THR 86 -0.736 3.316 9.762 648 HA THR 86 HA THR 86 -2.356 5.661 9.822 649 HB THR 86 HB THR 86 -1.223 4.145 12.199 650 HG1 THR 86 HG1 THR 86 -2.417 2.740 11.123 651 HG21 THR 86 HG21 THR 86 -3.624 5.987 11.975 652 HG22 THR 86 HG22 THR 86 -2.108 6.379 12.785 653 HG23 THR 86 HG23 THR 86 -3.142 5.101 13.424 654 H ILE 87 H ILE 87 1.075 5.119 10.599 655 HA ILE 87 HA ILE 87 1.344 7.694 11.741 656 HB ILE 87 HB ILE 87 2.927 5.956 12.395 657 HG12 ILE 87 HG12 ILE 87 3.739 8.374 12.379 658 HG13 ILE 87 HG13 ILE 87 4.973 7.136 12.495 659 HG21 ILE 87 HG21 ILE 87 3.957 5.908 9.601 660 HG22 ILE 87 HG22 ILE 87 3.036 4.665 10.429 661 HG23 ILE 87 HG23 ILE 87 4.670 5.061 10.976 662 HD11 ILE 87 HD11 ILE 87 4.230 8.671 10.009 663 HD12 ILE 87 HD12 ILE 87 5.505 7.457 10.125 664 HD13 ILE 87 HD13 ILE 87 5.645 8.971 11.026 665 H LEU 88 H LEU 88 1.968 6.503 8.477 666 HA LEU 88 HA LEU 88 2.755 9.037 7.492 667 HB2 LEU 88 HB2 LEU 88 1.801 6.550 6.161 668 HB3 LEU 88 HB3 LEU 88 1.944 8.012 5.227 669 HG LEU 88 HG LEU 88 3.856 6.645 4.870 670 HD11 LEU 88 HD11 LEU 88 5.674 8.126 5.482 671 HD12 LEU 88 HD12 LEU 88 4.619 8.963 6.614 672 HD13 LEU 88 HD13 LEU 88 4.276 9.019 4.884 673 HD21 LEU 88 HD21 LEU 88 3.767 5.349 6.925 674 HD22 LEU 88 HD22 LEU 88 4.334 6.760 7.820 675 HD23 LEU 88 HD23 LEU 88 5.378 5.997 6.610 676 H HIS 89 H HIS 89 -0.370 7.516 7.817 677 HA HIS 89 HA HIS 89 -1.895 9.316 6.271 678 HB2 HIS 89 HB2 HIS 89 -2.686 7.107 7.315 679 HB3 HIS 89 HB3 HIS 89 -2.854 7.990 8.823 680 HD1 HIS 89 HD1 HIS 89 -4.922 6.822 6.213 681 HD2 HIS 89 HD2 HIS 89 -4.595 10.457 8.186 682 HE1 HIS 89 HE1 HIS 89 -7.127 7.995 5.886 683 H ASP 90 H ASP 90 -0.762 9.478 9.577 684 HA ASP 90 HA ASP 90 -2.128 11.813 10.378 685 HB2 ASP 90 HB2 ASP 90 -1.061 10.374 12.007 686 HB3 ASP 90 HB3 ASP 90 0.515 10.665 11.291 687 H GLY 91 H GLY 91 0.760 11.327 8.493 688 HA2 GLY 91 HA2 GLY 91 1.552 14.120 8.603 689 HA3 GLY 91 HA3 GLY 91 2.349 12.833 7.713 690 H GLY 92 H GLY 92 -0.779 12.459 6.951 691 HA2 GLY 92 HA2 GLY 92 -2.206 13.254 5.305 692 HA3 GLY 92 HA3 GLY 92 -1.098 14.592 5.035 693 H TYR 93 H TYR 93 -0.360 11.144 4.915 694 HA TYR 93 HA TYR 93 0.518 11.547 2.167 695 HB2 TYR 93 HB2 TYR 93 1.222 9.471 4.214 696 HB3 TYR 93 HB3 TYR 93 1.693 9.331 2.527 697 HD1 TYR 93 HD1 TYR 93 2.118 11.416 5.580 698 HD2 TYR 93 HD2 TYR 93 3.563 10.488 1.705 699 HE1 TYR 93 HE1 TYR 93 4.140 12.748 6.018 700 HE2 TYR 93 HE2 TYR 93 5.584 11.803 2.128 701 HH TYR 93 HH TYR 93 6.312 13.588 3.528 702 H ARG 94 H ARG 94 -0.676 10.900 0.624 703 HA ARG 94 HA ARG 94 -2.965 9.221 0.829 704 HB2 ARG 94 HB2 ARG 94 -3.044 9.413 -1.636 705 HB3 ARG 94 HB3 ARG 94 -2.794 10.987 -0.887 706 HG2 ARG 94 HG2 ARG 94 -0.439 10.824 -1.312 707 HG3 ARG 94 HG3 ARG 94 -0.653 9.259 -2.093 708 HD2 ARG 94 HD2 ARG 94 -2.017 10.366 -3.821 709 HD3 ARG 94 HD3 ARG 94 -1.748 11.919 -3.017 710 HE ARG 94 HE ARG 94 0.768 10.848 -3.449 711 HH11 ARG 94 HH11 ARG 94 -1.860 11.949 -5.545 712 HH12 ARG 94 HH12 ARG 94 -0.822 12.266 -6.857 713 HH21 ARG 94 HH21 ARG 94 2.113 11.298 -5.099 714 HH22 ARG 94 HH22 ARG 94 1.571 11.929 -6.598 715 H ASP 95 H ASP 95 -3.183 7.347 -0.795 716 HA ASP 95 HA ASP 95 -1.798 5.106 0.038 717 HB2 ASP 95 HB2 ASP 95 -2.877 4.046 -1.956 718 HB3 ASP 95 HB3 ASP 95 -3.995 5.023 -1.005 719 H THR 96 H THR 96 -1.422 7.024 -2.845 720 HA THR 96 HA THR 96 0.499 5.545 -4.158 721 HB THR 96 HB THR 96 -0.053 8.516 -4.279 722 HG1 THR 96 HG1 THR 96 -1.689 6.485 -4.810 723 HG21 THR 96 HG21 THR 96 2.036 7.816 -5.401 724 HG22 THR 96 HG22 THR 96 0.823 8.373 -6.557 725 HG23 THR 96 HG23 THR 96 1.124 6.644 -6.348 726 H GLU 97 H GLU 97 0.811 8.141 -1.761 727 HA GLU 97 HA GLU 97 3.615 8.414 -2.069 728 HB2 GLU 97 HB2 GLU 97 1.899 9.266 0.262 729 HB3 GLU 97 HB3 GLU 97 3.594 9.678 -0.013 730 HG2 GLU 97 HG2 GLU 97 1.307 10.418 -1.784 731 HG3 GLU 97 HG3 GLU 97 2.126 11.514 -0.654 732 H ILE 98 H ILE 98 1.577 6.408 -0.062 733 HA ILE 98 HA ILE 98 3.512 5.556 1.810 734 HB ILE 98 HB ILE 98 1.303 3.831 0.644 735 HG12 ILE 98 HG12 ILE 98 0.159 5.796 1.451 736 HG13 ILE 98 HG13 ILE 98 -0.021 4.493 2.632 737 HG21 ILE 98 HG21 ILE 98 2.704 3.692 3.294 738 HG22 ILE 98 HG22 ILE 98 2.879 2.567 1.942 739 HG23 ILE 98 HG23 ILE 98 1.346 2.681 2.805 740 HD11 ILE 98 HD11 ILE 98 1.916 6.763 2.873 741 HD12 ILE 98 HD12 ILE 98 1.645 5.473 4.044 742 HD13 ILE 98 HD13 ILE 98 0.362 6.631 3.699 743 H MET 99 H MET 99 2.499 4.297 -1.288 744 HA MET 99 HA MET 99 4.404 2.182 -1.284 745 HB2 MET 99 HB2 MET 99 2.723 3.236 -3.547 746 HB3 MET 99 HB3 MET 99 3.612 1.719 -3.558 747 HG2 MET 99 HG2 MET 99 2.264 0.972 -1.628 748 HG3 MET 99 HG3 MET 99 1.320 2.453 -1.766 749 HE1 MET 99 HE1 MET 99 -0.936 1.300 -1.977 750 HE2 MET 99 HE2 MET 99 -0.113 -0.227 -1.665 751 HE3 MET 99 HE3 MET 99 -1.249 -0.101 -3.006 752 H ARG 100 H ARG 100 4.561 5.476 -2.127 753 HA ARG 100 HA ARG 100 6.388 5.585 -4.232 754 HB2 ARG 100 HB2 ARG 100 5.198 7.533 -3.390 755 HB3 ARG 100 HB3 ARG 100 6.016 7.396 -1.850 756 HG2 ARG 100 HG2 ARG 100 8.153 7.925 -2.984 757 HG3 ARG 100 HG3 ARG 100 7.251 8.171 -4.488 758 HD2 ARG 100 HD2 ARG 100 5.924 9.920 -3.422 759 HD3 ARG 100 HD3 ARG 100 6.763 9.641 -1.907 760 HE ARG 100 HE ARG 100 8.680 10.237 -3.818 761 HH11 ARG 100 HH11 ARG 100 5.868 11.910 -2.393 762 HH12 ARG 100 HH12 ARG 100 6.651 13.428 -2.368 763 HH21 ARG 100 HH21 ARG 100 9.698 12.406 -3.779 764 HH22 ARG 100 HH22 ARG 100 8.793 13.706 -3.161 765 H TRP 101 H TRP 101 7.144 6.056 -0.814 766 HA TRP 101 HA TRP 101 9.897 5.621 -1.252 767 HB2 TRP 101 HB2 TRP 101 10.060 5.679 1.292 768 HB3 TRP 101 HB3 TRP 101 9.451 7.123 0.496 769 HD1 TRP 101 HD1 TRP 101 7.031 7.908 1.110 770 HE1 TRP 101 HE1 TRP 101 5.323 7.159 2.877 771 HE3 TRP 101 HE3 TRP 101 9.170 3.492 2.522 772 HZ2 TRP 101 HZ2 TRP 101 4.940 4.995 4.629 773 HZ3 TRP 101 HZ3 TRP 101 8.081 2.163 4.214 774 HH2 TRP 101 HH2 TRP 101 6.009 2.890 5.278 775 H LEU 102 H LEU 102 7.317 3.542 -0.330 776 HA LEU 102 HA LEU 102 8.785 1.454 0.840 777 HB2 LEU 102 HB2 LEU 102 6.137 1.872 -0.229 778 HB3 LEU 102 HB3 LEU 102 6.636 0.181 -0.241 779 HG LEU 102 HG LEU 102 6.435 2.040 2.133 780 HD11 LEU 102 HD11 LEU 102 4.302 1.403 1.114 781 HD12 LEU 102 HD12 LEU 102 4.527 0.732 2.735 782 HD13 LEU 102 HD13 LEU 102 4.730 -0.303 1.312 783 HD21 LEU 102 HD21 LEU 102 8.114 0.452 2.590 784 HD22 LEU 102 HD22 LEU 102 7.158 -0.858 1.871 785 HD23 LEU 102 HD23 LEU 102 6.641 -0.102 3.375 786 H PHE 103 H PHE 103 7.874 1.989 -2.566 787 HA PHE 103 HA PHE 103 8.970 -0.608 -3.137 788 HB2 PHE 103 HB2 PHE 103 7.362 1.261 -4.830 789 HB3 PHE 103 HB3 PHE 103 8.194 -0.126 -5.528 790 HD1 PHE 103 HD1 PHE 103 5.573 0.894 -3.135 791 HD2 PHE 103 HD2 PHE 103 7.383 -2.332 -5.236 792 HE1 PHE 103 HE1 PHE 103 3.708 -0.573 -2.487 793 HE2 PHE 103 HE2 PHE 103 5.519 -3.802 -4.583 794 HZ PHE 103 HZ PHE 103 3.682 -2.919 -3.205 795 H THR 104 H THR 104 10.190 2.422 -3.062 796 HA THR 104 HA THR 104 11.998 2.118 -5.270 797 HB THR 104 HB THR 104 11.972 4.173 -3.025 798 HG1 THR 104 HG1 THR 104 10.088 4.490 -4.129 799 HG21 THR 104 HG21 THR 104 14.133 4.035 -4.230 800 HG22 THR 104 HG22 THR 104 13.298 5.550 -4.580 801 HG23 THR 104 HG23 THR 104 13.280 4.243 -5.761 802 HA PRO 105 HA PRO 105 14.766 -0.444 -2.744 803 HB2 PRO 105 HB2 PRO 105 16.836 -0.510 -4.549 804 HB3 PRO 105 HB3 PRO 105 15.419 -1.560 -4.654 805 HG2 PRO 105 HG2 PRO 105 16.007 0.980 -6.117 806 HG3 PRO 105 HG3 PRO 105 15.286 -0.521 -6.727 807 HD2 PRO 105 HD2 PRO 105 13.796 1.636 -6.141 808 HD3 PRO 105 HD3 PRO 105 13.199 -0.016 -5.870 809 H ASP 106 H ASP 106 16.167 0.174 -1.205 810 HA ASP 106 HA ASP 106 17.222 2.886 -1.477 811 HB2 ASP 106 HB2 ASP 106 15.764 2.315 0.484 812 HB3 ASP 106 HB3 ASP 106 17.047 1.221 1.006 813 HA PRO 107 HA PRO 107 21.183 1.065 -2.187 814 HB2 PRO 107 HB2 PRO 107 22.686 3.324 -1.705 815 HB3 PRO 107 HB3 PRO 107 21.861 2.975 -3.225 816 HG2 PRO 107 HG2 PRO 107 21.005 4.726 -0.964 817 HG3 PRO 107 HG3 PRO 107 20.872 5.004 -2.708 818 HD2 PRO 107 HD2 PRO 107 18.781 4.214 -1.225 819 HD3 PRO 107 HD3 PRO 107 18.989 3.675 -2.903 820 H SER 108 H SER 108 20.287 2.585 0.826 821 HA SER 108 HA SER 108 22.702 1.522 2.086 822 HB2 SER 108 HB2 SER 108 20.783 3.610 3.119 823 HB3 SER 108 HB3 SER 108 22.345 3.167 3.807 824 HG SER 108 HG SER 108 21.722 4.688 1.582 825 H LEU 109 H LEU 109 19.810 0.356 1.424 826 HA LEU 109 HA LEU 109 19.290 -0.518 4.157 827 HB2 LEU 109 HB2 LEU 109 17.468 0.641 2.995 828 HB3 LEU 109 HB3 LEU 109 17.465 -0.624 1.773 829 HG LEU 109 HG LEU 109 16.839 -2.248 3.502 830 HD11 LEU 109 HD11 LEU 109 16.059 -1.422 5.682 831 HD12 LEU 109 HD12 LEU 109 16.704 0.175 5.278 832 HD13 LEU 109 HD13 LEU 109 17.788 -1.210 5.426 833 HD21 LEU 109 HD21 LEU 109 15.136 -1.195 2.147 834 HD22 LEU 109 HD22 LEU 109 15.027 0.142 3.298 835 HD23 LEU 109 HD23 LEU 109 14.550 -1.488 3.788 836 H THR 110 H THR 110 19.685 -2.510 4.693 837 HA THR 110 HA THR 110 20.232 -4.493 2.585 838 HB THR 110 HB THR 110 21.452 -4.405 5.357 839 HG1 THR 110 HG1 THR 110 22.049 -3.005 3.040 840 HG21 THR 110 HG21 THR 110 21.501 -6.593 4.219 841 HG22 THR 110 HG22 THR 110 23.124 -5.913 4.356 842 HG23 THR 110 HG23 THR 110 22.267 -5.843 2.817 843 H ILE 111 H ILE 111 18.629 -5.905 2.530 844 HA ILE 111 HA ILE 111 17.155 -6.614 4.993 845 HB ILE 111 HB ILE 111 16.173 -6.174 2.178 846 HG12 ILE 111 HG12 ILE 111 16.665 -4.150 3.333 847 HG13 ILE 111 HG13 ILE 111 14.934 -4.281 3.063 848 HG21 ILE 111 HG21 ILE 111 14.905 -7.958 3.130 849 HG22 ILE 111 HG22 ILE 111 13.933 -6.494 2.947 850 HG23 ILE 111 HG23 ILE 111 14.523 -6.964 4.550 851 HD11 ILE 111 HD11 ILE 111 15.319 -3.397 5.278 852 HD12 ILE 111 HD12 ILE 111 16.440 -4.709 5.656 853 HD13 ILE 111 HD13 ILE 111 14.727 -5.048 5.450 854 H THR 112 H THR 112 16.257 -8.750 4.933 855 HA THR 112 HA THR 112 17.377 -10.546 2.947 856 HB THR 112 HB THR 112 18.868 -10.749 4.884 857 HG1 THR 112 HG1 THR 112 18.847 -12.736 4.278 858 HG21 THR 112 HG21 THR 112 18.074 -11.477 7.093 859 HG22 THR 112 HG22 THR 112 16.408 -11.392 6.520 860 HG23 THR 112 HG23 THR 112 17.375 -9.921 6.642 861 H ARG 113 H ARG 113 16.082 -12.626 2.926 862 HA ARG 113 HA ARG 113 13.341 -12.082 3.830 863 HB2 ARG 113 HB2 ARG 113 12.522 -13.273 1.791 864 HB3 ARG 113 HB3 ARG 113 13.292 -11.730 1.469 865 HG2 ARG 113 HG2 ARG 113 15.112 -12.695 0.443 866 HG3 ARG 113 HG3 ARG 113 14.915 -14.223 1.305 867 HD2 ARG 113 HD2 ARG 113 12.940 -13.223 -0.714 868 HD3 ARG 113 HD3 ARG 113 14.308 -14.248 -1.154 869 HE ARG 113 HE ARG 113 13.208 -15.663 0.820 870 HH11 ARG 113 HH11 ARG 113 11.593 -14.151 -1.944 871 HH12 ARG 113 HH12 ARG 113 10.416 -15.359 -2.097 872 HH21 ARG 113 HH21 ARG 113 11.637 -17.258 0.667 873 HH22 ARG 113 HH22 ARG 113 10.403 -17.190 -0.517 874 H ASP 114 H ASP 114 11.986 -14.140 3.726 875 HA ASP 114 HA ASP 114 13.116 -16.108 5.409 876 HB2 ASP 114 HB2 ASP 114 10.647 -15.524 5.126 877 HB3 ASP 114 HB3 ASP 114 10.697 -16.432 3.620 878 H GLY 115 H GLY 115 14.331 -17.818 4.855 879 HA2 GLY 115 HA2 GLY 115 14.966 -19.659 3.526 880 HA3 GLY 115 HA3 GLY 115 14.109 -18.933 2.171 881 H SER 116 H SER 116 16.343 -17.227 4.218 882 HA SER 116 HA SER 116 18.494 -17.466 2.306 883 HB2 SER 116 HB2 SER 116 17.281 -14.788 3.075 884 HB3 SER 116 HB3 SER 116 18.768 -15.003 2.149 885 HG SER 116 HG SER 116 16.749 -16.440 1.108 886 H ARG 117 H ARG 117 20.423 -17.311 3.290 887 HA ARG 117 HA ARG 117 20.413 -17.061 6.207 888 HB2 ARG 117 HB2 ARG 117 22.660 -18.101 6.096 889 HB3 ARG 117 HB3 ARG 117 21.397 -19.094 5.384 890 HG2 ARG 117 HG2 ARG 117 22.085 -18.370 3.157 891 HG3 ARG 117 HG3 ARG 117 23.355 -17.380 3.877 892 HD2 ARG 117 HD2 ARG 117 23.067 -20.324 4.237 893 HD3 ARG 117 HD3 ARG 117 24.096 -19.572 3.006 894 HE ARG 117 HE ARG 117 25.058 -18.427 5.159 895 HH11 ARG 117 HH11 ARG 117 24.089 -21.828 4.886 896 HH12 ARG 117 HH12 ARG 117 25.351 -22.402 5.866 897 HH21 ARG 117 HH21 ARG 117 26.804 -19.234 6.500 898 HH22 ARG 117 HH22 ARG 117 26.957 -20.910 6.775 899 H ASP 118 H ASP 118 21.385 -15.454 3.391 900 HA ASP 118 HA ASP 118 22.824 -13.520 5.036 901 HB2 ASP 118 HB2 ASP 118 23.374 -14.312 2.190 902 HB3 ASP 118 HB3 ASP 118 23.882 -12.750 2.811 903 H ALA 119 H ALA 119 22.874 -11.320 3.860 904 HA ALA 119 HA ALA 119 20.072 -10.707 3.314 905 HB1 ALA 119 HB1 ALA 119 20.506 -8.499 4.194 906 HB2 ALA 119 HB2 ALA 119 22.210 -8.895 4.414 907 HB3 ALA 119 HB3 ALA 119 20.980 -9.722 5.374 908 H VAL 120 H VAL 120 19.607 -8.970 1.892 909 HA VAL 120 HA VAL 120 21.418 -8.845 -0.386 910 HB VAL 120 HB VAL 120 18.436 -8.293 -0.229 911 HG11 VAL 120 HG11 VAL 120 18.500 -8.338 -2.690 912 HG12 VAL 120 HG12 VAL 120 20.258 -8.503 -2.621 913 HG13 VAL 120 HG13 VAL 120 19.485 -7.045 -2.009 914 HG21 VAL 120 HG21 VAL 120 18.122 -10.411 -1.441 915 HG22 VAL 120 HG22 VAL 120 18.867 -10.664 0.137 916 HG23 VAL 120 HG23 VAL 120 19.853 -10.727 -1.325 917 H SER 121 H SER 121 22.423 -6.933 -0.555 918 HA SER 121 HA SER 121 21.598 -4.628 0.958 919 HB2 SER 121 HB2 SER 121 23.701 -4.846 -1.200 920 HB3 SER 121 HB3 SER 121 23.598 -3.622 0.063 921 HG SER 121 HG SER 121 24.420 -4.933 1.455 922 H ASN 122 H ASN 122 20.956 -2.575 -0.032 923 HA ASN 122 HA ASN 122 19.997 -1.183 -1.486 924 HB2 ASN 122 HB2 ASN 122 20.928 -3.148 -3.605 925 HB3 ASN 122 HB3 ASN 122 20.236 -1.552 -3.897 926 HD21 ASN 122 HD21 ASN 122 21.526 0.202 -3.777 927 HD22 ASN 122 HD22 ASN 122 23.204 0.154 -3.397 928 H ALA 123 H ALA 123 18.416 -3.134 -0.129 929 HA ALA 123 HA ALA 123 16.554 -4.077 -2.134 930 HB1 ALA 123 HB1 ALA 123 15.523 -5.280 -0.261 931 HB2 ALA 123 HB2 ALA 123 16.664 -4.517 0.848 932 HB3 ALA 123 HB3 ALA 123 17.250 -5.635 -0.384 933 H ARG 124 H ARG 124 14.244 -3.720 -1.655 934 HA ARG 124 HA ARG 124 13.840 -0.931 -0.881 935 HB2 ARG 124 HB2 ARG 124 11.663 -1.071 -1.983 936 HB3 ARG 124 HB3 ARG 124 12.904 -1.672 -3.070 937 HG2 ARG 124 HG2 ARG 124 12.298 -3.952 -2.528 938 HG3 ARG 124 HG3 ARG 124 11.093 -3.371 -1.389 939 HD2 ARG 124 HD2 ARG 124 10.073 -4.055 -3.484 940 HD3 ARG 124 HD3 ARG 124 9.866 -2.329 -3.222 941 HE ARG 124 HE ARG 124 11.192 -1.891 -5.015 942 HH11 ARG 124 HH11 ARG 124 11.448 -5.368 -4.233 943 HH12 ARG 124 HH12 ARG 124 11.984 -5.813 -5.787 944 HH21 ARG 124 HH21 ARG 124 11.974 -2.540 -7.187 945 HH22 ARG 124 HH22 ARG 124 12.331 -4.171 -7.481 946 HA PRO 125 HA PRO 125 12.000 -1.795 3.077 947 HB2 PRO 125 HB2 PRO 125 9.867 0.037 2.114 948 HB3 PRO 125 HB3 PRO 125 10.735 0.077 3.664 949 HG2 PRO 125 HG2 PRO 125 11.368 1.805 1.789 950 HG3 PRO 125 HG3 PRO 125 12.671 0.953 2.640 951 HD2 PRO 125 HD2 PRO 125 11.564 0.471 -0.095 952 HD3 PRO 125 HD3 PRO 125 13.249 0.446 0.473 953 H VAL 126 H VAL 126 9.966 -2.057 0.213 954 HA VAL 126 HA VAL 126 7.702 -3.300 1.328 955 HB VAL 126 HB VAL 126 8.916 -3.490 -1.434 956 HG11 VAL 126 HG11 VAL 126 7.713 -5.593 -1.020 957 HG12 VAL 126 HG12 VAL 126 6.866 -4.572 -2.183 958 HG13 VAL 126 HG13 VAL 126 6.299 -4.668 -0.512 959 HG21 VAL 126 HG21 VAL 126 6.974 -2.176 -2.016 960 HG22 VAL 126 HG22 VAL 126 7.976 -1.421 -0.775 961 HG23 VAL 126 HG23 VAL 126 6.458 -2.212 -0.322 962 H ASP 127 H ASP 127 10.678 -4.692 0.122 963 HA ASP 127 HA ASP 127 9.920 -7.395 0.482 964 HB2 ASP 127 HB2 ASP 127 12.647 -6.105 0.261 965 HB3 ASP 127 HB3 ASP 127 12.448 -7.836 0.478 966 H ALA 128 H ALA 128 11.268 -5.007 2.528 967 HA ALA 128 HA ALA 128 12.087 -6.684 4.647 968 HB1 ALA 128 HB1 ALA 128 12.238 -4.675 5.983 969 HB2 ALA 128 HB2 ALA 128 11.298 -3.783 4.790 970 HB3 ALA 128 HB3 ALA 128 12.905 -4.385 4.375 971 H LEU 129 H LEU 129 9.055 -4.893 4.083 972 HA LEU 129 HA LEU 129 8.008 -5.632 6.636 973 HB2 LEU 129 HB2 LEU 129 5.909 -4.675 5.960 974 HB3 LEU 129 HB3 LEU 129 7.191 -3.598 5.492 975 HG LEU 129 HG LEU 129 6.883 -4.884 3.186 976 HD11 LEU 129 HD11 LEU 129 4.157 -4.990 4.444 977 HD12 LEU 129 HD12 LEU 129 5.191 -6.360 4.061 978 HD13 LEU 129 HD13 LEU 129 4.535 -5.359 2.752 979 HD21 LEU 129 HD21 LEU 129 5.416 -3.052 2.472 980 HD22 LEU 129 HD22 LEU 129 6.734 -2.480 3.495 981 HD23 LEU 129 HD23 LEU 129 5.109 -2.651 4.161 982 H HIS 130 H HIS 130 7.760 -7.041 3.457 983 HA HIS 130 HA HIS 130 5.812 -8.989 4.220 984 HB2 HIS 130 HB2 HIS 130 6.111 -8.216 1.876 985 HB3 HIS 130 HB3 HIS 130 7.718 -8.915 1.853 986 HD1 HIS 130 HD1 HIS 130 4.043 -10.093 2.092 987 HD2 HIS 130 HD2 HIS 130 7.816 -11.470 0.972 988 HE1 HIS 130 HE1 HIS 130 3.681 -12.303 1.002 989 H ALA 131 H ALA 131 9.149 -8.644 4.570 990 HA ALA 131 HA ALA 131 9.575 -11.464 5.192 991 HB1 ALA 131 HB1 ALA 131 11.938 -10.907 5.410 992 HB2 ALA 131 HB2 ALA 131 11.559 -9.195 5.219 993 HB3 ALA 131 HB3 ALA 131 11.297 -10.311 3.878 994 H HIS 132 H HIS 132 8.177 -9.130 6.769 995 HA HIS 132 HA HIS 132 7.650 -8.657 8.924 996 HB2 HIS 132 HB2 HIS 132 9.037 -11.297 9.415 997 HB3 HIS 132 HB3 HIS 132 8.168 -10.408 10.664 998 HD1 HIS 132 HD1 HIS 132 7.599 -12.494 7.574 999 HD2 HIS 132 HD2 HIS 132 5.404 -10.432 10.435 1000 HE1 HIS 132 HE1 HIS 132 5.212 -13.213 7.278 1001 H GLN 133 H GLN 133 10.057 -7.749 7.765 1002 HA GLN 133 HA GLN 133 11.712 -7.148 10.097 1003 HB2 GLN 133 HB2 GLN 133 12.312 -7.150 7.145 1004 HB3 GLN 133 HB3 GLN 133 13.435 -6.551 8.366 1005 HG2 GLN 133 HG2 GLN 133 13.544 -8.709 9.400 1006 HG3 GLN 133 HG3 GLN 133 12.283 -9.323 8.342 1007 HE21 GLN 133 HE21 GLN 133 13.510 -10.927 7.596 1008 HE22 GLN 133 HE22 GLN 133 14.789 -10.667 6.467 1009 H ALA 134 H ALA 134 9.256 -6.177 9.364 1010 HA ALA 134 HA ALA 134 8.945 -3.820 8.025 1011 HB1 ALA 134 HB1 ALA 134 7.433 -4.705 10.463 1012 HB2 ALA 134 HB2 ALA 134 7.129 -5.240 8.810 1013 HB3 ALA 134 HB3 ALA 134 6.889 -3.549 9.249 1014 H ARG 135 H ARG 135 10.394 -4.233 11.175 1015 HA ARG 135 HA ARG 135 10.006 -1.784 12.390 1016 HB2 ARG 135 HB2 ARG 135 11.370 -3.969 13.015 1017 HB3 ARG 135 HB3 ARG 135 12.706 -3.064 12.342 1018 HG2 ARG 135 HG2 ARG 135 10.993 -2.200 14.664 1019 HG3 ARG 135 HG3 ARG 135 12.578 -2.953 14.760 1020 HD2 ARG 135 HD2 ARG 135 11.967 -0.263 13.515 1021 HD3 ARG 135 HD3 ARG 135 12.626 -0.497 15.130 1022 HE ARG 135 HE ARG 135 14.122 -1.506 12.813 1023 HH11 ARG 135 HH11 ARG 135 13.960 0.790 15.546 1024 HH12 ARG 135 HH12 ARG 135 15.548 1.337 15.304 1025 HH21 ARG 135 HH21 ARG 135 16.210 -0.684 12.498 1026 HH22 ARG 135 HH22 ARG 135 16.891 0.467 13.577 1027 H GLU 136 H GLU 136 12.336 -2.676 9.791 1028 HA GLU 136 HA GLU 136 13.661 -0.142 9.764 1029 HB2 GLU 136 HB2 GLU 136 13.517 -2.280 7.629 1030 HB3 GLU 136 HB3 GLU 136 14.521 -0.843 7.517 1031 HG2 GLU 136 HG2 GLU 136 14.741 -3.046 9.544 1032 HG3 GLU 136 HG3 GLU 136 15.852 -2.719 8.213 1033 H VAL 137 H VAL 137 10.803 -1.344 8.363 1034 HA VAL 137 HA VAL 137 10.441 0.655 6.354 1035 HB VAL 137 HB VAL 137 8.427 -1.200 7.655 1036 HG11 VAL 137 HG11 VAL 137 8.280 0.281 5.039 1037 HG12 VAL 137 HG12 VAL 137 7.370 0.678 6.498 1038 HG13 VAL 137 HG13 VAL 137 7.078 -0.850 5.658 1039 HG21 VAL 137 HG21 VAL 137 10.059 -1.528 5.154 1040 HG22 VAL 137 HG22 VAL 137 8.802 -2.633 5.698 1041 HG23 VAL 137 HG23 VAL 137 10.259 -2.422 6.660 1042 H VAL 138 H VAL 138 9.117 0.015 9.560 1043 HA VAL 138 HA VAL 138 7.585 2.352 9.848 1044 HB VAL 138 HB VAL 138 8.978 0.754 12.026 1045 HG11 VAL 138 HG11 VAL 138 8.264 2.932 12.809 1046 HG12 VAL 138 HG12 VAL 138 7.250 1.665 13.514 1047 HG13 VAL 138 HG13 VAL 138 6.639 2.652 12.183 1048 HG21 VAL 138 HG21 VAL 138 6.193 0.480 10.895 1049 HG22 VAL 138 HG22 VAL 138 6.822 -0.401 12.288 1050 HG23 VAL 138 HG23 VAL 138 7.519 -0.664 10.689 1051 H ARG 139 H ARG 139 10.892 1.599 10.659 1052 HA ARG 139 HA ARG 139 11.769 3.938 11.825 1053 HB2 ARG 139 HB2 ARG 139 13.048 1.854 11.665 1054 HB3 ARG 139 HB3 ARG 139 13.190 2.057 9.934 1055 HG2 ARG 139 HG2 ARG 139 14.528 4.084 10.323 1056 HG3 ARG 139 HG3 ARG 139 14.449 3.759 12.062 1057 HD2 ARG 139 HD2 ARG 139 15.475 1.537 11.641 1058 HD3 ARG 139 HD3 ARG 139 15.647 1.976 9.942 1059 HE ARG 139 HE ARG 139 16.788 3.968 11.484 1060 HH11 ARG 139 HH11 ARG 139 17.499 0.578 10.496 1061 HH12 ARG 139 HH12 ARG 139 19.135 0.697 10.910 1062 HH21 ARG 139 HH21 ARG 139 19.069 4.064 12.021 1063 HH22 ARG 139 HH22 ARG 139 20.046 2.701 11.804 1064 H ARG 140 H ARG 140 11.676 3.017 8.381 1065 HA ARG 140 HA ARG 140 12.655 5.484 7.368 1066 HB2 ARG 140 HB2 ARG 140 12.712 3.338 6.126 1067 HB3 ARG 140 HB3 ARG 140 10.966 3.446 5.943 1068 HG2 ARG 140 HG2 ARG 140 11.199 5.527 4.718 1069 HG3 ARG 140 HG3 ARG 140 12.949 5.458 4.924 1070 HD2 ARG 140 HD2 ARG 140 12.936 3.292 3.725 1071 HD3 ARG 140 HD3 ARG 140 11.206 3.538 3.478 1072 HE ARG 140 HE ARG 140 11.697 5.404 2.087 1073 HH11 ARG 140 HH11 ARG 140 14.578 3.557 3.015 1074 HH12 ARG 140 HH12 ARG 140 15.532 4.184 1.749 1075 HH21 ARG 140 HH21 ARG 140 13.047 6.221 0.347 1076 HH22 ARG 140 HH22 ARG 140 14.661 5.649 0.211 1077 H ALA 141 H ALA 141 9.457 4.228 8.019 1078 HA ALA 141 HA ALA 141 7.891 6.137 6.770 1079 HB1 ALA 141 HB1 ALA 141 6.163 5.451 8.402 1080 HB2 ALA 141 HB2 ALA 141 7.401 4.581 9.307 1081 HB3 ALA 141 HB3 ALA 141 6.992 4.084 7.665 1082 H GLN 142 H GLN 142 9.201 6.046 10.059 1083 HA GLN 142 HA GLN 142 8.151 8.526 10.916 1084 HB2 GLN 142 HB2 GLN 142 10.657 7.149 11.871 1085 HB3 GLN 142 HB3 GLN 142 9.822 8.456 12.686 1086 HG2 GLN 142 HG2 GLN 142 7.871 6.985 12.979 1087 HG3 GLN 142 HG3 GLN 142 8.787 5.673 12.232 1088 HE21 GLN 142 HE21 GLN 142 7.717 5.828 14.916 1089 HE22 GLN 142 HE22 GLN 142 9.076 5.678 15.974 1090 H ALA 143 H ALA 143 11.164 7.644 9.325 1091 HA ALA 143 HA ALA 143 12.384 10.191 9.550 1092 HB1 ALA 143 HB1 ALA 143 13.944 9.388 7.839 1093 HB2 ALA 143 HB2 ALA 143 12.889 8.014 7.520 1094 HB3 ALA 143 HB3 ALA 143 13.685 8.169 9.086 1095 H MET 144 H MET 144 10.225 8.744 7.263 1096 HA MET 144 HA MET 144 10.480 10.751 5.275 1097 HB2 MET 144 HB2 MET 144 9.730 8.447 4.796 1098 HB3 MET 144 HB3 MET 144 8.272 8.742 5.719 1099 HG2 MET 144 HG2 MET 144 7.577 8.930 3.519 1100 HG3 MET 144 HG3 MET 144 7.796 10.601 4.014 1101 HE1 MET 144 HE1 MET 144 10.849 11.788 1.889 1102 HE2 MET 144 HE2 MET 144 10.999 11.270 3.565 1103 HE3 MET 144 HE3 MET 144 9.605 12.217 3.059 1104 H ALA 145 H ALA 145 8.076 10.089 7.808 1105 HA ALA 145 HA ALA 145 6.484 12.353 7.043 1106 HB1 ALA 145 HB1 ALA 145 6.237 10.652 9.513 1107 HB2 ALA 145 HB2 ALA 145 5.464 10.321 7.964 1108 HB3 ALA 145 HB3 ALA 145 5.027 11.769 8.874 1109 H TYR 146 H TYR 146 8.947 11.787 9.509 1110 HA TYR 146 HA TYR 146 8.422 14.507 10.466 1111 HB2 TYR 146 HB2 TYR 146 9.992 12.349 11.901 1112 HB3 TYR 146 HB3 TYR 146 9.491 13.901 12.549 1113 HD1 TYR 146 HD1 TYR 146 6.853 14.265 12.642 1114 HD2 TYR 146 HD2 TYR 146 8.768 10.476 12.398 1115 HE1 TYR 146 HE1 TYR 146 4.841 13.183 13.574 1116 HE2 TYR 146 HE2 TYR 146 6.772 9.393 13.317 1117 HH TYR 146 HH TYR 146 3.823 10.879 13.486 Start of MODEL 30 1 H MET 1 H MET 1 -28.004 30.343 11.974 2 HA MET 1 HA MET 1 -27.523 32.347 9.907 3 HB2 MET 1 HB2 MET 1 -28.827 33.452 11.568 4 HB3 MET 1 HB3 MET 1 -27.877 32.803 12.883 5 HG2 MET 1 HG2 MET 1 -27.367 35.135 12.544 6 HG3 MET 1 HG3 MET 1 -25.964 34.161 12.115 7 HE1 MET 1 HE1 MET 1 -25.668 37.143 9.633 8 HE2 MET 1 HE2 MET 1 -24.874 36.192 10.885 9 HE3 MET 1 HE3 MET 1 -26.250 37.216 11.295 10 HA PRO 2 HA PRO 2 -23.271 31.937 11.820 11 HB2 PRO 2 HB2 PRO 2 -22.773 30.197 13.827 12 HB3 PRO 2 HB3 PRO 2 -23.325 31.851 14.106 13 HG2 PRO 2 HG2 PRO 2 -24.859 29.301 14.215 14 HG3 PRO 2 HG3 PRO 2 -25.028 30.757 15.209 15 HD2 PRO 2 HD2 PRO 2 -26.658 30.107 13.012 16 HD3 PRO 2 HD3 PRO 2 -26.494 31.728 13.674 17 H GLY 3 H GLY 3 -21.588 30.666 11.083 18 HA2 GLY 3 HA2 GLY 3 -22.320 28.246 9.655 19 HA3 GLY 3 HA3 GLY 3 -20.756 29.060 9.603 20 H ARG 4 H ARG 4 -22.799 27.481 11.978 21 HA ARG 4 HA ARG 4 -20.620 26.680 13.634 22 HB2 ARG 4 HB2 ARG 4 -22.834 27.217 14.516 23 HB3 ARG 4 HB3 ARG 4 -23.532 25.891 13.609 24 HG2 ARG 4 HG2 ARG 4 -22.297 24.292 14.965 25 HG3 ARG 4 HG3 ARG 4 -21.524 25.627 15.833 26 HD2 ARG 4 HD2 ARG 4 -24.493 25.057 15.772 27 HD3 ARG 4 HD3 ARG 4 -23.408 24.687 17.105 28 HE ARG 4 HE ARG 4 -22.989 27.096 17.268 29 HH11 ARG 4 HH11 ARG 4 -25.985 26.108 15.615 30 HH12 ARG 4 HH12 ARG 4 -26.835 27.521 16.056 31 HH21 ARG 4 HH21 ARG 4 -24.194 29.007 17.880 32 HH22 ARG 4 HH22 ARG 4 -25.822 29.182 17.387 33 H ALA 5 H ALA 5 -19.526 24.874 13.628 34 HA ALA 5 HA ALA 5 -20.007 22.300 13.140 35 HB1 ALA 5 HB1 ALA 5 -19.190 21.857 10.829 36 HB2 ALA 5 HB2 ALA 5 -19.154 23.591 10.514 37 HB3 ALA 5 HB3 ALA 5 -20.693 22.781 10.798 38 HA PRO 6 HA PRO 6 -15.667 22.987 14.134 39 HB2 PRO 6 HB2 PRO 6 -15.071 20.467 14.957 40 HB3 PRO 6 HB3 PRO 6 -15.949 21.607 15.982 41 HG2 PRO 6 HG2 PRO 6 -16.991 19.312 14.390 42 HG3 PRO 6 HG3 PRO 6 -17.530 19.929 15.960 43 HD2 PRO 6 HD2 PRO 6 -18.780 20.427 13.542 44 HD3 PRO 6 HD3 PRO 6 -18.960 21.414 15.005 45 H GLY 7 H GLY 7 -15.413 23.278 11.874 46 HA2 GLY 7 HA2 GLY 7 -13.960 22.640 10.073 47 HA3 GLY 7 HA3 GLY 7 -14.266 20.947 10.509 48 H SER 8 H SER 8 -15.188 23.484 8.511 49 HA SER 8 HA SER 8 -17.920 22.954 8.277 50 HB2 SER 8 HB2 SER 8 -17.434 24.425 6.156 51 HB3 SER 8 HB3 SER 8 -17.389 25.106 7.788 52 HG SER 8 HG SER 8 -15.320 24.622 5.996 53 H THR 9 H THR 9 -15.195 21.511 6.752 54 HA THR 9 HA THR 9 -17.007 20.267 4.810 55 HB THR 9 HB THR 9 -14.002 20.669 4.563 56 HG1 THR 9 HG1 THR 9 -14.613 22.612 4.036 57 HG21 THR 9 HG21 THR 9 -16.056 19.759 2.521 58 HG22 THR 9 HG22 THR 9 -14.850 18.727 3.287 59 HG23 THR 9 HG23 THR 9 -14.339 20.022 2.206 60 H LEU 10 H LEU 10 -16.952 18.006 4.614 61 HA LEU 10 HA LEU 10 -15.976 16.513 6.852 62 HB2 LEU 10 HB2 LEU 10 -17.173 15.616 4.230 63 HB3 LEU 10 HB3 LEU 10 -16.755 14.529 5.530 64 HG LEU 10 HG LEU 10 -18.855 16.695 5.669 65 HD11 LEU 10 HD11 LEU 10 -19.484 14.865 4.197 66 HD12 LEU 10 HD12 LEU 10 -20.431 14.833 5.687 67 HD13 LEU 10 HD13 LEU 10 -19.085 13.708 5.465 68 HD21 LEU 10 HD21 LEU 10 -17.843 16.270 7.853 69 HD22 LEU 10 HD22 LEU 10 -18.107 14.537 7.642 70 HD23 LEU 10 HD23 LEU 10 -19.481 15.624 7.786 71 H ALA 11 H ALA 11 -14.464 14.825 6.769 72 HA ALA 11 HA ALA 11 -12.517 14.997 4.590 73 HB1 ALA 11 HB1 ALA 11 -11.658 16.267 6.509 74 HB2 ALA 11 HB2 ALA 11 -10.704 14.812 6.232 75 HB3 ALA 11 HB3 ALA 11 -11.884 14.858 7.546 76 H ARG 12 H ARG 12 -11.678 13.075 3.990 77 HA ARG 12 HA ARG 12 -13.064 10.744 4.962 78 HB2 ARG 12 HB2 ARG 12 -11.134 11.127 2.672 79 HB3 ARG 12 HB3 ARG 12 -11.909 9.598 3.064 80 HG2 ARG 12 HG2 ARG 12 -14.080 10.524 2.599 81 HG3 ARG 12 HG3 ARG 12 -13.383 12.128 2.370 82 HD2 ARG 12 HD2 ARG 12 -12.145 11.328 0.437 83 HD3 ARG 12 HD3 ARG 12 -12.782 9.701 0.682 84 HE ARG 12 HE ARG 12 -15.031 10.807 0.365 85 HH11 ARG 12 HH11 ARG 12 -12.131 12.086 -1.234 86 HH12 ARG 12 HH12 ARG 12 -12.994 12.695 -2.565 87 HH21 ARG 12 HH21 ARG 12 -16.181 11.621 -1.464 88 HH22 ARG 12 HH22 ARG 12 -15.349 12.435 -2.705 89 H VAL 13 H VAL 13 -12.245 10.323 6.928 90 HA VAL 13 HA VAL 13 -9.409 10.060 7.236 91 HB VAL 13 HB VAL 13 -9.913 9.677 9.665 92 HG11 VAL 13 HG11 VAL 13 -9.399 11.914 8.840 93 HG12 VAL 13 HG12 VAL 13 -10.577 11.982 10.148 94 HG13 VAL 13 HG13 VAL 13 -11.103 12.180 8.476 95 HG21 VAL 13 HG21 VAL 13 -12.755 10.314 8.854 96 HG22 VAL 13 HG22 VAL 13 -12.168 10.161 10.509 97 HG23 VAL 13 HG23 VAL 13 -12.180 8.753 9.448 98 H GLY 14 H GLY 14 -8.487 8.352 6.905 99 HA2 GLY 14 HA2 GLY 14 -7.974 6.053 7.155 100 HA3 GLY 14 HA3 GLY 14 -9.668 5.755 7.543 101 H SER 15 H SER 15 -10.945 6.879 5.529 102 HA SER 15 HA SER 15 -10.652 4.967 3.458 103 HB2 SER 15 HB2 SER 15 -12.841 5.892 4.215 104 HB3 SER 15 HB3 SER 15 -12.386 7.453 3.541 105 HG SER 15 HG SER 15 -13.646 6.393 2.096 106 H ILE 16 H ILE 16 -8.821 5.144 2.371 107 HA ILE 16 HA ILE 16 -8.065 7.710 1.198 108 HB ILE 16 HB ILE 16 -6.544 5.080 1.249 109 HG12 ILE 16 HG12 ILE 16 -6.771 5.972 3.518 110 HG13 ILE 16 HG13 ILE 16 -5.106 6.073 2.968 111 HG21 ILE 16 HG21 ILE 16 -4.592 6.402 0.577 112 HG22 ILE 16 HG22 ILE 16 -5.610 7.835 0.467 113 HG23 ILE 16 HG23 ILE 16 -5.883 6.477 -0.621 114 HD11 ILE 16 HD11 ILE 16 -5.430 8.473 2.520 115 HD12 ILE 16 HD12 ILE 16 -5.734 8.053 4.209 116 HD13 ILE 16 HD13 ILE 16 -7.088 8.335 3.120 117 HA PRO 17 HA PRO 17 -9.790 5.969 -2.571 118 HB2 PRO 17 HB2 PRO 17 -9.296 8.115 -4.174 119 HB3 PRO 17 HB3 PRO 17 -10.665 8.061 -3.061 120 HG2 PRO 17 HG2 PRO 17 -8.036 9.441 -2.755 121 HG3 PRO 17 HG3 PRO 17 -9.653 9.981 -2.275 122 HD2 PRO 17 HD2 PRO 17 -7.821 8.912 -0.539 123 HD3 PRO 17 HD3 PRO 17 -9.575 8.838 -0.287 124 H ALA 18 H ALA 18 -8.869 5.277 -4.565 125 HA ALA 18 HA ALA 18 -6.057 4.653 -4.313 126 HB1 ALA 18 HB1 ALA 18 -7.663 2.930 -4.937 127 HB2 ALA 18 HB2 ALA 18 -6.484 3.175 -6.230 128 HB3 ALA 18 HB3 ALA 18 -8.106 3.846 -6.372 129 H GLY 19 H GLY 19 -4.452 5.772 -5.281 130 HA2 GLY 19 HA2 GLY 19 -5.192 7.703 -7.334 131 HA3 GLY 19 HA3 GLY 19 -3.735 7.707 -6.353 132 H ASP 20 H ASP 20 -1.930 6.802 -7.121 133 HA ASP 20 HA ASP 20 -2.100 5.634 -9.814 134 HB2 ASP 20 HB2 ASP 20 -1.111 7.840 -9.914 135 HB3 ASP 20 HB3 ASP 20 -0.014 7.462 -8.598 136 H ASP 21 H ASP 21 -1.077 3.746 -10.190 137 HA ASP 21 HA ASP 21 -0.199 2.273 -7.905 138 HB2 ASP 21 HB2 ASP 21 -0.017 0.345 -9.359 139 HB3 ASP 21 HB3 ASP 21 -1.498 1.196 -9.753 140 H VAL 22 H VAL 22 1.728 2.005 -7.173 141 HA VAL 22 HA VAL 22 4.004 3.115 -8.645 142 HB VAL 22 HB VAL 22 3.871 2.195 -5.751 143 HG11 VAL 22 HG11 VAL 22 5.933 3.467 -5.434 144 HG12 VAL 22 HG12 VAL 22 5.951 3.877 -7.149 145 HG13 VAL 22 HG13 VAL 22 6.148 2.198 -6.642 146 HG21 VAL 22 HG21 VAL 22 3.748 4.578 -5.167 147 HG22 VAL 22 HG22 VAL 22 2.362 4.071 -6.132 148 HG23 VAL 22 HG23 VAL 22 3.671 4.992 -6.875 149 H LEU 23 H LEU 23 2.633 0.121 -7.804 150 HA LEU 23 HA LEU 23 5.134 -1.214 -7.936 151 HB2 LEU 23 HB2 LEU 23 3.730 -3.356 -7.827 152 HB3 LEU 23 HB3 LEU 23 3.900 -2.351 -6.417 153 HG LEU 23 HG LEU 23 1.631 -1.533 -6.676 154 HD11 LEU 23 HD11 LEU 23 1.426 -1.635 -9.143 155 HD12 LEU 23 HD12 LEU 23 0.105 -2.496 -8.351 156 HD13 LEU 23 HD13 LEU 23 1.445 -3.396 -9.064 157 HD21 LEU 23 HD21 LEU 23 1.840 -4.517 -6.854 158 HD22 LEU 23 HD22 LEU 23 0.468 -3.616 -6.204 159 HD23 LEU 23 HD23 LEU 23 2.047 -3.531 -5.410 160 H ASP 24 H ASP 24 5.725 -2.855 -9.326 161 HA ASP 24 HA ASP 24 5.352 -2.197 -12.071 162 HB2 ASP 24 HB2 ASP 24 6.550 -4.731 -10.882 163 HB3 ASP 24 HB3 ASP 24 6.755 -4.136 -12.514 164 HA PRO 25 HA PRO 25 1.804 -4.845 -12.883 165 HB2 PRO 25 HB2 PRO 25 3.280 -5.647 -15.352 166 HB3 PRO 25 HB3 PRO 25 1.634 -5.028 -15.195 167 HG2 PRO 25 HG2 PRO 25 3.547 -3.457 -16.133 168 HG3 PRO 25 HG3 PRO 25 2.348 -2.817 -15.000 169 HD2 PRO 25 HD2 PRO 25 5.189 -3.627 -14.485 170 HD3 PRO 25 HD3 PRO 25 4.275 -2.236 -13.862 171 H ASP 26 H ASP 26 5.083 -5.922 -13.113 172 HA ASP 26 HA ASP 26 4.615 -8.732 -13.014 173 HB2 ASP 26 HB2 ASP 26 7.088 -7.113 -12.383 174 HB3 ASP 26 HB3 ASP 26 7.044 -8.871 -12.399 175 H GLU 27 H GLU 27 4.393 -6.283 -10.659 176 HA GLU 27 HA GLU 27 4.893 -8.084 -8.471 177 HB2 GLU 27 HB2 GLU 27 3.772 -5.276 -8.519 178 HB3 GLU 27 HB3 GLU 27 4.073 -6.193 -7.051 179 HG2 GLU 27 HG2 GLU 27 6.141 -5.253 -9.034 180 HG3 GLU 27 HG3 GLU 27 5.852 -4.589 -7.429 181 HA PRO 28 HA PRO 28 0.859 -9.760 -8.775 182 HB2 PRO 28 HB2 PRO 28 0.757 -10.991 -6.370 183 HB3 PRO 28 HB3 PRO 28 1.757 -11.574 -7.704 184 HG2 PRO 28 HG2 PRO 28 2.558 -9.912 -5.341 185 HG3 PRO 28 HG3 PRO 28 3.361 -11.334 -6.030 186 HD2 PRO 28 HD2 PRO 28 4.187 -8.839 -6.560 187 HD3 PRO 28 HD3 PRO 28 4.271 -10.140 -7.767 188 H THR 29 H THR 29 -1.231 -9.341 -8.169 189 HA THR 29 HA THR 29 -1.600 -7.435 -6.009 190 HB THR 29 HB THR 29 -3.456 -6.449 -7.487 191 HG1 THR 29 HG1 THR 29 -3.605 -7.708 -9.200 192 HG21 THR 29 HG21 THR 29 -1.875 -4.910 -8.603 193 HG22 THR 29 HG22 THR 29 -0.555 -6.018 -8.239 194 HG23 THR 29 HG23 THR 29 -1.418 -5.213 -6.927 195 H TYR 30 H TYR 30 -3.827 -7.253 -5.338 196 HA TYR 30 HA TYR 30 -5.478 -9.600 -5.690 197 HB2 TYR 30 HB2 TYR 30 -4.724 -8.208 -3.110 198 HB3 TYR 30 HB3 TYR 30 -6.194 -9.155 -3.259 199 HD1 TYR 30 HD1 TYR 30 -5.166 -11.438 -4.870 200 HD2 TYR 30 HD2 TYR 30 -3.469 -9.413 -1.555 201 HE1 TYR 30 HE1 TYR 30 -3.988 -13.476 -4.259 202 HE2 TYR 30 HE2 TYR 30 -2.260 -11.463 -0.929 203 HH TYR 30 HH TYR 30 -1.952 -14.085 -3.030 204 H ASP 31 H ASP 31 -7.712 -9.058 -5.163 205 HA ASP 31 HA ASP 31 -8.360 -6.210 -5.445 206 HB2 ASP 31 HB2 ASP 31 -8.534 -7.596 -7.653 207 HB3 ASP 31 HB3 ASP 31 -9.834 -8.467 -6.857 208 H LEU 32 H LEU 32 -10.879 -6.205 -4.893 209 HA LEU 32 HA LEU 32 -10.858 -6.935 -2.203 210 HB2 LEU 32 HB2 LEU 32 -13.187 -5.945 -3.843 211 HB3 LEU 32 HB3 LEU 32 -13.283 -6.266 -2.123 212 HG LEU 32 HG LEU 32 -11.474 -4.555 -1.786 213 HD11 LEU 32 HD11 LEU 32 -12.065 -3.847 -4.651 214 HD12 LEU 32 HD12 LEU 32 -10.542 -4.470 -4.017 215 HD13 LEU 32 HD13 LEU 32 -11.118 -2.878 -3.520 216 HD21 LEU 32 HD21 LEU 32 -13.005 -2.662 -1.987 217 HD22 LEU 32 HD22 LEU 32 -13.800 -4.084 -1.314 218 HD23 LEU 32 HD23 LEU 32 -14.070 -3.636 -3.000 219 HA PRO 33 HA PRO 33 -14.018 -10.564 -3.124 220 HB2 PRO 33 HB2 PRO 33 -13.541 -11.705 -5.613 221 HB3 PRO 33 HB3 PRO 33 -14.913 -10.662 -5.227 222 HG2 PRO 33 HG2 PRO 33 -12.310 -9.967 -6.525 223 HG3 PRO 33 HG3 PRO 33 -13.946 -9.420 -6.941 224 HD2 PRO 33 HD2 PRO 33 -12.297 -7.829 -5.592 225 HD3 PRO 33 HD3 PRO 33 -14.019 -7.911 -5.159 226 H ARG 34 H ARG 34 -10.824 -10.455 -4.674 227 HA ARG 34 HA ARG 34 -10.089 -13.107 -4.118 228 HB2 ARG 34 HB2 ARG 34 -9.161 -11.570 -5.853 229 HB3 ARG 34 HB3 ARG 34 -8.371 -10.684 -4.567 230 HG2 ARG 34 HG2 ARG 34 -6.828 -12.140 -5.691 231 HG3 ARG 34 HG3 ARG 34 -7.052 -12.671 -4.019 232 HD2 ARG 34 HD2 ARG 34 -8.337 -14.498 -4.678 233 HD3 ARG 34 HD3 ARG 34 -8.644 -13.783 -6.266 234 HE ARG 34 HE ARG 34 -5.929 -14.073 -6.170 235 HH11 ARG 34 HH11 ARG 34 -8.386 -16.558 -5.529 236 HH12 ARG 34 HH12 ARG 34 -7.608 -17.715 -6.506 237 HH21 ARG 34 HH21 ARG 34 -4.877 -15.712 -7.410 238 HH22 ARG 34 HH22 ARG 34 -5.587 -17.248 -7.583 239 H VAL 35 H VAL 35 -9.592 -10.019 -2.444 240 HA VAL 35 HA VAL 35 -8.021 -11.146 -0.358 241 HB VAL 35 HB VAL 35 -9.654 -8.577 -0.329 242 HG11 VAL 35 HG11 VAL 35 -8.227 -7.878 1.546 243 HG12 VAL 35 HG12 VAL 35 -7.466 -9.471 1.548 244 HG13 VAL 35 HG13 VAL 35 -9.177 -9.312 1.943 245 HG21 VAL 35 HG21 VAL 35 -7.953 -8.514 -2.042 246 HG22 VAL 35 HG22 VAL 35 -6.734 -9.056 -0.887 247 HG23 VAL 35 HG23 VAL 35 -7.475 -7.472 -0.698 248 H ALA 36 H ALA 36 -11.417 -10.517 -0.781 249 HA ALA 36 HA ALA 36 -12.404 -11.248 1.722 250 HB1 ALA 36 HB1 ALA 36 -13.730 -10.173 -0.052 251 HB2 ALA 36 HB2 ALA 36 -14.513 -11.627 0.554 252 HB3 ALA 36 HB3 ALA 36 -13.667 -11.662 -0.994 253 H GLU 37 H GLU 37 -11.500 -13.101 -1.054 254 HA GLU 37 HA GLU 37 -12.368 -15.668 -0.330 255 HB2 GLU 37 HB2 GLU 37 -11.582 -14.792 -2.571 256 HB3 GLU 37 HB3 GLU 37 -9.971 -14.876 -1.937 257 HG2 GLU 37 HG2 GLU 37 -10.131 -17.273 -1.646 258 HG3 GLU 37 HG3 GLU 37 -11.785 -17.240 -2.269 259 H LEU 38 H LEU 38 -9.318 -13.941 0.128 260 HA LEU 38 HA LEU 38 -7.852 -16.037 1.310 261 HB2 LEU 38 HB2 LEU 38 -7.498 -13.066 1.647 262 HB3 LEU 38 HB3 LEU 38 -6.320 -14.282 2.071 263 HG LEU 38 HG LEU 38 -7.257 -13.676 -0.735 264 HD11 LEU 38 HD11 LEU 38 -4.713 -12.977 0.705 265 HD12 LEU 38 HD12 LEU 38 -5.983 -11.846 0.235 266 HD13 LEU 38 HD13 LEU 38 -5.043 -12.689 -0.999 267 HD21 LEU 38 HD21 LEU 38 -5.031 -15.440 0.289 268 HD22 LEU 38 HD22 LEU 38 -5.351 -15.057 -1.400 269 HD23 LEU 38 HD23 LEU 38 -6.525 -15.993 -0.474 270 H LEU 39 H LEU 39 -9.557 -13.266 2.701 271 HA LEU 39 HA LEU 39 -8.861 -14.034 5.389 272 HB2 LEU 39 HB2 LEU 39 -10.681 -11.861 4.410 273 HB3 LEU 39 HB3 LEU 39 -10.123 -12.039 6.064 274 HG LEU 39 HG LEU 39 -8.448 -11.354 3.645 275 HD11 LEU 39 HD11 LEU 39 -9.231 -9.721 6.047 276 HD12 LEU 39 HD12 LEU 39 -9.831 -9.522 4.401 277 HD13 LEU 39 HD13 LEU 39 -8.132 -9.211 4.764 278 HD21 LEU 39 HD21 LEU 39 -7.145 -12.723 5.194 279 HD22 LEU 39 HD22 LEU 39 -7.608 -11.668 6.530 280 HD23 LEU 39 HD23 LEU 39 -6.593 -11.050 5.230 281 H GLY 40 H GLY 40 -11.449 -14.709 3.303 282 HA2 GLY 40 HA2 GLY 40 -13.171 -16.240 3.666 283 HA3 GLY 40 HA3 GLY 40 -12.663 -16.338 5.344 284 H VAL 41 H VAL 41 -13.230 -13.278 3.925 285 HA VAL 41 HA VAL 41 -15.712 -13.031 5.493 286 HB VAL 41 HB VAL 41 -15.151 -10.691 5.982 287 HG11 VAL 41 HG11 VAL 41 -14.515 -12.350 7.613 288 HG12 VAL 41 HG12 VAL 41 -13.344 -11.036 7.577 289 HG13 VAL 41 HG13 VAL 41 -12.965 -12.579 6.805 290 HG21 VAL 41 HG21 VAL 41 -12.540 -11.262 4.587 291 HG22 VAL 41 HG22 VAL 41 -12.878 -9.808 5.534 292 HG23 VAL 41 HG23 VAL 41 -13.790 -10.138 4.065 293 HA PRO 42 HA PRO 42 -17.641 -11.383 1.825 294 HB2 PRO 42 HB2 PRO 42 -18.947 -9.188 2.896 295 HB3 PRO 42 HB3 PRO 42 -19.598 -10.825 2.848 296 HG2 PRO 42 HG2 PRO 42 -18.241 -9.391 5.077 297 HG3 PRO 42 HG3 PRO 42 -19.601 -10.525 5.141 298 HD2 PRO 42 HD2 PRO 42 -17.134 -11.286 5.850 299 HD3 PRO 42 HD3 PRO 42 -18.217 -12.377 4.974 300 H VAL 43 H VAL 43 -17.525 -9.746 0.374 301 HA VAL 43 HA VAL 43 -15.145 -8.330 0.101 302 HB VAL 43 HB VAL 43 -17.799 -7.904 -1.283 303 HG11 VAL 43 HG11 VAL 43 -16.529 -6.905 -3.123 304 HG12 VAL 43 HG12 VAL 43 -15.039 -7.127 -2.216 305 HG13 VAL 43 HG13 VAL 43 -16.262 -5.995 -1.631 306 HG21 VAL 43 HG21 VAL 43 -17.012 -10.185 -1.515 307 HG22 VAL 43 HG22 VAL 43 -15.439 -9.596 -2.051 308 HG23 VAL 43 HG23 VAL 43 -16.866 -9.334 -3.056 309 H SER 44 H SER 44 -18.285 -7.324 1.340 310 HA SER 44 HA SER 44 -17.781 -4.580 1.362 311 HB2 SER 44 HB2 SER 44 -20.041 -5.661 1.552 312 HB3 SER 44 HB3 SER 44 -19.639 -6.106 3.205 313 HG SER 44 HG SER 44 -19.945 -4.122 3.828 314 H LYS 45 H LYS 45 -16.973 -7.121 3.705 315 HA LYS 45 HA LYS 45 -16.142 -5.290 5.728 316 HB2 LYS 45 HB2 LYS 45 -15.520 -8.211 5.314 317 HB3 LYS 45 HB3 LYS 45 -14.826 -7.290 6.636 318 HG2 LYS 45 HG2 LYS 45 -17.085 -6.796 7.455 319 HG3 LYS 45 HG3 LYS 45 -17.761 -7.770 6.154 320 HD2 LYS 45 HD2 LYS 45 -16.596 -9.736 6.999 321 HD3 LYS 45 HD3 LYS 45 -15.864 -8.776 8.281 322 HE2 LYS 45 HE2 LYS 45 -18.818 -9.239 7.897 323 HE3 LYS 45 HE3 LYS 45 -17.792 -10.092 9.052 324 HZ1 LYS 45 HZ1 LYS 45 -18.995 -8.301 10.125 325 HZ2 LYS 45 HZ2 LYS 45 -18.348 -7.169 9.058 326 HZ3 LYS 45 HZ3 LYS 45 -17.353 -7.967 10.140 327 H VAL 46 H VAL 46 -14.582 -6.856 3.051 328 HA VAL 46 HA VAL 46 -11.933 -5.968 3.556 329 HB VAL 46 HB VAL 46 -13.262 -6.454 0.865 330 HG11 VAL 46 HG11 VAL 46 -10.336 -6.401 1.601 331 HG12 VAL 46 HG12 VAL 46 -11.196 -5.173 0.675 332 HG13 VAL 46 HG13 VAL 46 -10.995 -6.796 0.009 333 HG21 VAL 46 HG21 VAL 46 -13.401 -8.423 2.293 334 HG22 VAL 46 HG22 VAL 46 -11.671 -8.326 2.616 335 HG23 VAL 46 HG23 VAL 46 -12.243 -8.691 0.989 336 H ALA 47 H ALA 47 -14.605 -4.508 1.775 337 HA ALA 47 HA ALA 47 -13.317 -2.166 0.946 338 HB1 ALA 47 HB1 ALA 47 -15.558 -1.215 0.687 339 HB2 ALA 47 HB2 ALA 47 -16.233 -2.524 1.662 340 HB3 ALA 47 HB3 ALA 47 -15.517 -2.876 0.092 341 H GLN 48 H GLN 48 -14.902 -2.996 3.956 342 HA GLN 48 HA GLN 48 -14.732 -0.424 5.103 343 HB2 GLN 48 HB2 GLN 48 -14.984 -3.097 6.446 344 HB3 GLN 48 HB3 GLN 48 -15.031 -1.562 7.296 345 HG2 GLN 48 HG2 GLN 48 -16.970 -0.934 5.842 346 HG3 GLN 48 HG3 GLN 48 -16.980 -2.605 5.272 347 HE21 GLN 48 HE21 GLN 48 -17.447 -0.511 7.942 348 HE22 GLN 48 HE22 GLN 48 -18.293 -1.618 8.959 349 H GLN 49 H GLN 49 -12.509 -3.108 5.033 350 HA GLN 49 HA GLN 49 -10.677 -2.196 6.968 351 HB2 GLN 49 HB2 GLN 49 -10.014 -3.632 4.373 352 HB3 GLN 49 HB3 GLN 49 -8.978 -3.535 5.787 353 HG2 GLN 49 HG2 GLN 49 -11.675 -4.875 5.743 354 HG3 GLN 49 HG3 GLN 49 -10.148 -5.710 5.494 355 HE21 GLN 49 HE21 GLN 49 -10.611 -7.024 7.303 356 HE22 GLN 49 HE22 GLN 49 -10.461 -6.443 8.904 357 H LEU 50 H LEU 50 -10.858 -1.627 3.510 358 HA LEU 50 HA LEU 50 -8.727 0.186 3.248 359 HB2 LEU 50 HB2 LEU 50 -9.733 -0.950 1.346 360 HB3 LEU 50 HB3 LEU 50 -11.264 -0.170 1.649 361 HG LEU 50 HG LEU 50 -10.246 2.018 1.058 362 HD11 LEU 50 HD11 LEU 50 -7.840 0.367 0.319 363 HD12 LEU 50 HD12 LEU 50 -7.939 1.559 1.614 364 HD13 LEU 50 HD13 LEU 50 -8.084 2.071 -0.065 365 HD21 LEU 50 HD21 LEU 50 -9.984 -0.131 -1.041 366 HD22 LEU 50 HD22 LEU 50 -10.106 1.601 -1.346 367 HD23 LEU 50 HD23 LEU 50 -11.458 0.737 -0.616 368 H ARG 51 H ARG 51 -12.169 0.672 3.866 369 HA ARG 51 HA ARG 51 -11.979 3.476 3.842 370 HB2 ARG 51 HB2 ARG 51 -14.194 1.670 4.738 371 HB3 ARG 51 HB3 ARG 51 -14.297 3.417 4.900 372 HG2 ARG 51 HG2 ARG 51 -13.897 3.619 2.459 373 HG3 ARG 51 HG3 ARG 51 -13.955 1.860 2.346 374 HD2 ARG 51 HD2 ARG 51 -16.232 1.844 3.129 375 HD3 ARG 51 HD3 ARG 51 -16.190 3.579 3.418 376 HE ARG 51 HE ARG 51 -15.811 2.453 0.740 377 HH11 ARG 51 HH11 ARG 51 -17.511 4.694 2.890 378 HH12 ARG 51 HH12 ARG 51 -18.465 5.380 1.658 379 HH21 ARG 51 HH21 ARG 51 -17.129 3.434 -0.961 380 HH22 ARG 51 HH22 ARG 51 -18.254 4.653 -0.554 381 H GLU 52 H GLU 52 -11.259 1.257 6.385 382 HA GLU 52 HA GLU 52 -11.505 3.435 8.302 383 HB2 GLU 52 HB2 GLU 52 -10.709 0.558 8.756 384 HB3 GLU 52 HB3 GLU 52 -10.962 1.759 10.009 385 HG2 GLU 52 HG2 GLU 52 -13.039 0.693 8.116 386 HG3 GLU 52 HG3 GLU 52 -12.869 0.285 9.814 387 H GLY 53 H GLY 53 -9.299 2.410 6.125 388 HA2 GLY 53 HA2 GLY 53 -7.094 2.981 5.818 389 HA3 GLY 53 HA3 GLY 53 -7.135 3.819 7.367 390 H HIS 54 H HIS 54 -7.992 0.501 6.828 391 HA HIS 54 HA HIS 54 -5.750 -0.328 8.533 392 HB2 HIS 54 HB2 HIS 54 -8.067 -0.838 9.342 393 HB3 HIS 54 HB3 HIS 54 -8.352 -1.764 7.880 394 HD1 HIS 54 HD1 HIS 54 -8.584 -4.106 8.811 395 HD2 HIS 54 HD2 HIS 54 -5.253 -2.120 10.299 396 HE1 HIS 54 HE1 HIS 54 -7.307 -5.801 10.173 397 H LEU 55 H LEU 55 -6.675 -0.057 5.386 398 HA LEU 55 HA LEU 55 -4.654 -1.814 4.438 399 HB2 LEU 55 HB2 LEU 55 -6.699 -3.278 4.723 400 HB3 LEU 55 HB3 LEU 55 -7.535 -2.237 3.595 401 HG LEU 55 HG LEU 55 -6.010 -2.936 1.807 402 HD11 LEU 55 HD11 LEU 55 -4.433 -4.772 2.186 403 HD12 LEU 55 HD12 LEU 55 -4.784 -4.722 3.917 404 HD13 LEU 55 HD13 LEU 55 -4.001 -3.350 3.133 405 HD21 LEU 55 HD21 LEU 55 -7.282 -5.183 3.366 406 HD22 LEU 55 HD22 LEU 55 -6.743 -5.301 1.691 407 HD23 LEU 55 HD23 LEU 55 -8.042 -4.192 2.122 408 H VAL 56 H VAL 56 -4.248 -1.271 2.133 409 HA VAL 56 HA VAL 56 -5.457 1.277 1.308 410 HB VAL 56 HB VAL 56 -2.489 0.575 1.263 411 HG11 VAL 56 HG11 VAL 56 -3.104 1.877 -0.713 412 HG12 VAL 56 HG12 VAL 56 -2.083 2.801 0.384 413 HG13 VAL 56 HG13 VAL 56 -3.820 3.118 0.322 414 HG21 VAL 56 HG21 VAL 56 -3.224 1.223 3.474 415 HG22 VAL 56 HG22 VAL 56 -3.951 2.695 2.824 416 HG23 VAL 56 HG23 VAL 56 -2.201 2.473 2.763 417 H ALA 57 H ALA 57 -5.562 1.551 -0.968 418 HA ALA 57 HA ALA 57 -4.802 -0.718 -2.619 419 HB1 ALA 57 HB1 ALA 57 -7.168 -1.032 -1.996 420 HB2 ALA 57 HB2 ALA 57 -6.983 -0.681 -3.714 421 HB3 ALA 57 HB3 ALA 57 -7.532 0.580 -2.614 422 H VAL 58 H VAL 58 -4.618 -0.144 -4.816 423 HA VAL 58 HA VAL 58 -4.546 2.703 -5.415 424 HB VAL 58 HB VAL 58 -2.496 2.288 -6.869 425 HG11 VAL 58 HG11 VAL 58 -2.182 2.069 -3.887 426 HG12 VAL 58 HG12 VAL 58 -2.355 3.556 -4.822 427 HG13 VAL 58 HG13 VAL 58 -0.918 2.551 -5.015 428 HG21 VAL 58 HG21 VAL 58 -2.541 -0.156 -6.888 429 HG22 VAL 58 HG22 VAL 58 -2.277 -0.185 -5.144 430 HG23 VAL 58 HG23 VAL 58 -1.017 0.426 -6.217 431 H ARG 59 H ARG 59 -4.272 2.998 -7.871 432 HA ARG 59 HA ARG 59 -6.182 1.110 -9.047 433 HB2 ARG 59 HB2 ARG 59 -6.931 3.499 -8.730 434 HB3 ARG 59 HB3 ARG 59 -5.661 3.985 -9.839 435 HG2 ARG 59 HG2 ARG 59 -6.712 2.628 -11.603 436 HG3 ARG 59 HG3 ARG 59 -7.995 2.189 -10.481 437 HD2 ARG 59 HD2 ARG 59 -8.543 4.595 -10.238 438 HD3 ARG 59 HD3 ARG 59 -7.325 4.958 -11.460 439 HE ARG 59 HE ARG 59 -9.668 3.259 -11.972 440 HH11 ARG 59 HH11 ARG 59 -7.549 5.971 -12.946 441 HH12 ARG 59 HH12 ARG 59 -8.324 6.200 -14.432 442 HH21 ARG 59 HH21 ARG 59 -10.725 3.627 -14.047 443 HH22 ARG 59 HH22 ARG 59 -10.146 4.846 -15.088 444 H ARG 60 H ARG 60 -5.433 -0.116 -10.454 445 HA ARG 60 HA ARG 60 -3.017 0.520 -11.987 446 HB2 ARG 60 HB2 ARG 60 -2.305 -1.079 -10.423 447 HB3 ARG 60 HB3 ARG 60 -3.835 -1.937 -10.482 448 HG2 ARG 60 HG2 ARG 60 -3.348 -2.693 -12.694 449 HG3 ARG 60 HG3 ARG 60 -1.781 -1.875 -12.674 450 HD2 ARG 60 HD2 ARG 60 -1.081 -3.254 -10.756 451 HD3 ARG 60 HD3 ARG 60 -2.657 -4.038 -10.745 452 HE ARG 60 HE ARG 60 -1.849 -4.534 -13.211 453 HH11 ARG 60 HH11 ARG 60 -0.073 -4.899 -10.193 454 HH12 ARG 60 HH12 ARG 60 0.794 -6.285 -10.658 455 HH21 ARG 60 HH21 ARG 60 -0.694 -6.398 -13.903 456 HH22 ARG 60 HH22 ARG 60 0.435 -7.140 -12.880 457 H ALA 61 H ALA 61 -3.435 0.513 -14.068 458 HA ALA 61 HA ALA 61 -4.267 0.141 -16.102 459 HB1 ALA 61 HB1 ALA 61 -3.568 -2.182 -15.657 460 HB2 ALA 61 HB2 ALA 61 -4.985 -2.118 -16.699 461 HB3 ALA 61 HB3 ALA 61 -5.161 -2.525 -14.991 462 H GLY 62 H GLY 62 -5.988 1.164 -13.862 463 HA2 GLY 62 HA2 GLY 62 -8.022 2.345 -14.253 464 HA3 GLY 62 HA3 GLY 62 -8.507 1.066 -15.360 465 H GLY 63 H GLY 63 -7.298 -0.755 -13.013 466 HA2 GLY 63 HA2 GLY 63 -9.925 -0.939 -11.705 467 HA3 GLY 63 HA3 GLY 63 -8.760 -2.245 -11.891 468 H VAL 64 H VAL 64 -9.967 -1.432 -9.465 469 HA VAL 64 HA VAL 64 -7.762 -0.115 -8.063 470 HB VAL 64 HB VAL 64 -10.538 -0.864 -7.054 471 HG11 VAL 64 HG11 VAL 64 -9.996 0.516 -5.094 472 HG12 VAL 64 HG12 VAL 64 -8.368 0.760 -5.724 473 HG13 VAL 64 HG13 VAL 64 -8.896 -0.854 -5.250 474 HG21 VAL 64 HG21 VAL 64 -11.000 1.538 -7.103 475 HG22 VAL 64 HG22 VAL 64 -10.597 0.932 -8.709 476 HG23 VAL 64 HG23 VAL 64 -9.400 1.837 -7.777 477 H VAL 65 H VAL 65 -6.333 -1.329 -7.079 478 HA VAL 65 HA VAL 65 -7.060 -4.036 -6.305 479 HB VAL 65 HB VAL 65 -4.774 -4.789 -7.112 480 HG11 VAL 65 HG11 VAL 65 -5.506 -5.133 -9.418 481 HG12 VAL 65 HG12 VAL 65 -6.745 -3.893 -9.210 482 HG13 VAL 65 HG13 VAL 65 -6.837 -5.394 -8.289 483 HG21 VAL 65 HG21 VAL 65 -3.763 -3.496 -8.928 484 HG22 VAL 65 HG22 VAL 65 -3.782 -2.579 -7.415 485 HG23 VAL 65 HG23 VAL 65 -4.966 -2.230 -8.677 486 H ILE 66 H ILE 66 -5.647 -4.969 -4.869 487 HA ILE 66 HA ILE 66 -4.302 -3.086 -3.075 488 HB ILE 66 HB ILE 66 -5.590 -5.788 -2.494 489 HG12 ILE 66 HG12 ILE 66 -6.559 -3.025 -1.727 490 HG13 ILE 66 HG13 ILE 66 -7.193 -3.942 -3.085 491 HG21 ILE 66 HG21 ILE 66 -4.464 -3.710 -0.604 492 HG22 ILE 66 HG22 ILE 66 -3.700 -5.242 -1.008 493 HG23 ILE 66 HG23 ILE 66 -5.236 -5.226 -0.137 494 HD11 ILE 66 HD11 ILE 66 -8.002 -5.645 -1.556 495 HD12 ILE 66 HD12 ILE 66 -8.639 -4.061 -1.130 496 HD13 ILE 66 HD13 ILE 66 -7.322 -4.756 -0.189 497 HA PRO 67 HA PRO 67 -0.671 -5.333 -4.575 498 HB2 PRO 67 HB2 PRO 67 0.471 -4.373 -2.009 499 HB3 PRO 67 HB3 PRO 67 1.101 -4.198 -3.651 500 HG2 PRO 67 HG2 PRO 67 0.016 -2.119 -2.427 501 HG3 PRO 67 HG3 PRO 67 -0.322 -2.419 -4.140 502 HD2 PRO 67 HD2 PRO 67 -2.040 -2.973 -1.752 503 HD3 PRO 67 HD3 PRO 67 -2.478 -2.310 -3.345 504 H GLN 68 H GLN 68 -0.276 -7.475 -4.361 505 HA GLN 68 HA GLN 68 -1.235 -8.991 -2.204 506 HB2 GLN 68 HB2 GLN 68 -1.101 -9.852 -4.416 507 HB3 GLN 68 HB3 GLN 68 0.627 -9.587 -4.479 508 HG2 GLN 68 HG2 GLN 68 1.032 -11.358 -2.945 509 HG3 GLN 68 HG3 GLN 68 -0.684 -11.506 -2.578 510 HE21 GLN 68 HE21 GLN 68 -1.516 -11.177 -5.383 511 HE22 GLN 68 HE22 GLN 68 -1.094 -12.638 -6.149 512 H VAL 69 H VAL 69 1.712 -7.422 -2.832 513 HA VAL 69 HA VAL 69 3.340 -8.838 -1.008 514 HB VAL 69 HB VAL 69 4.875 -6.830 -1.191 515 HG11 VAL 69 HG11 VAL 69 5.420 -7.247 -3.552 516 HG12 VAL 69 HG12 VAL 69 3.859 -8.039 -3.770 517 HG13 VAL 69 HG13 VAL 69 5.068 -8.752 -2.703 518 HG21 VAL 69 HG21 VAL 69 3.118 -5.149 -1.567 519 HG22 VAL 69 HG22 VAL 69 2.754 -5.887 -3.123 520 HG23 VAL 69 HG23 VAL 69 4.324 -5.128 -2.855 521 H PHE 70 H PHE 70 0.750 -6.757 -0.392 522 HA PHE 70 HA PHE 70 1.696 -5.760 2.158 523 HB2 PHE 70 HB2 PHE 70 -0.866 -5.590 0.615 524 HB3 PHE 70 HB3 PHE 70 -0.938 -5.355 2.353 525 HD1 PHE 70 HD1 PHE 70 1.548 -4.212 -0.211 526 HD2 PHE 70 HD2 PHE 70 -1.304 -3.140 2.757 527 HE1 PHE 70 HE1 PHE 70 2.133 -1.839 -0.502 528 HE2 PHE 70 HE2 PHE 70 -0.721 -0.770 2.483 529 HZ PHE 70 HZ PHE 70 0.978 -0.105 0.855 530 H PHE 71 H PHE 71 0.749 -8.641 0.970 531 HA PHE 71 HA PHE 71 -0.348 -9.596 3.496 532 HB2 PHE 71 HB2 PHE 71 -0.672 -10.674 0.682 533 HB3 PHE 71 HB3 PHE 71 -1.235 -11.499 2.128 534 HD1 PHE 71 HD1 PHE 71 -1.637 -8.356 0.181 535 HD2 PHE 71 HD2 PHE 71 -3.355 -11.070 2.967 536 HE1 PHE 71 HE1 PHE 71 -3.777 -7.165 0.012 537 HE2 PHE 71 HE2 PHE 71 -5.501 -9.877 2.806 538 HZ PHE 71 HZ PHE 71 -5.708 -7.920 1.326 539 H THR 72 H THR 72 0.306 -11.785 3.944 540 HA THR 72 HA THR 72 3.138 -12.159 3.420 541 HB THR 72 HB THR 72 2.888 -13.931 5.199 542 HG1 THR 72 HG1 THR 72 0.371 -12.808 5.732 543 HG21 THR 72 HG21 THR 72 2.594 -12.344 7.055 544 HG22 THR 72 HG22 THR 72 1.884 -11.176 5.943 545 HG23 THR 72 HG23 THR 72 3.580 -11.629 5.779 546 H ASN 73 H ASN 73 3.721 -14.595 3.195 547 HA ASN 73 HA ASN 73 2.577 -15.636 0.815 548 HB2 ASN 73 HB2 ASN 73 4.927 -16.030 1.596 549 HB3 ASN 73 HB3 ASN 73 4.284 -17.065 2.862 550 HD21 ASN 73 HD21 ASN 73 5.358 -18.862 2.177 551 HD22 ASN 73 HD22 ASN 73 4.993 -19.711 0.728 552 H SER 74 H SER 74 1.709 -15.852 4.093 553 HA SER 74 HA SER 74 0.264 -18.312 4.004 554 HB2 SER 74 HB2 SER 74 0.208 -16.040 5.989 555 HB3 SER 74 HB3 SER 74 -0.401 -17.672 6.273 556 HG SER 74 HG SER 74 1.653 -18.450 6.080 557 H GLY 75 H GLY 75 -0.350 -15.226 2.722 558 HA2 GLY 75 HA2 GLY 75 -2.228 -14.538 1.565 559 HA3 GLY 75 HA3 GLY 75 -3.093 -15.937 2.181 560 H GLN 76 H GLN 76 -1.460 -13.935 4.415 561 HA GLN 76 HA GLN 76 -3.990 -12.654 5.137 562 HB2 GLN 76 HB2 GLN 76 -3.391 -12.958 7.534 563 HB3 GLN 76 HB3 GLN 76 -3.631 -14.482 6.698 564 HG2 GLN 76 HG2 GLN 76 -1.113 -14.560 6.428 565 HG3 GLN 76 HG3 GLN 76 -1.054 -13.239 7.587 566 HE21 GLN 76 HE21 GLN 76 0.056 -14.500 9.096 567 HE22 GLN 76 HE22 GLN 76 -0.712 -15.770 9.965 568 H VAL 77 H VAL 77 -3.744 -10.621 6.200 569 HA VAL 77 HA VAL 77 -1.827 -8.977 4.935 570 HB VAL 77 HB VAL 77 -3.490 -8.304 7.389 571 HG11 VAL 77 HG11 VAL 77 -3.336 -5.977 6.617 572 HG12 VAL 77 HG12 VAL 77 -2.284 -6.492 5.299 573 HG13 VAL 77 HG13 VAL 77 -1.748 -6.660 6.970 574 HG21 VAL 77 HG21 VAL 77 -4.212 -7.993 4.478 575 HG22 VAL 77 HG22 VAL 77 -5.159 -7.389 5.837 576 HG23 VAL 77 HG23 VAL 77 -4.942 -9.126 5.615 577 H VAL 78 H VAL 78 0.055 -8.024 5.724 578 HA VAL 78 HA VAL 78 1.526 -9.392 7.701 579 HB VAL 78 HB VAL 78 1.919 -6.584 6.699 580 HG11 VAL 78 HG11 VAL 78 3.878 -8.475 7.998 581 HG12 VAL 78 HG12 VAL 78 3.214 -7.003 8.712 582 HG13 VAL 78 HG13 VAL 78 4.300 -6.900 7.325 583 HG21 VAL 78 HG21 VAL 78 3.508 -7.487 5.109 584 HG22 VAL 78 HG22 VAL 78 1.889 -8.131 4.844 585 HG23 VAL 78 HG23 VAL 78 3.123 -9.133 5.632 586 H LYS 79 H LYS 79 1.357 -9.264 9.774 587 HA LYS 79 HA LYS 79 -0.708 -7.946 11.072 588 HB2 LYS 79 HB2 LYS 79 0.355 -10.019 11.866 589 HB3 LYS 79 HB3 LYS 79 1.784 -9.100 12.311 590 HG2 LYS 79 HG2 LYS 79 0.493 -9.517 14.267 591 HG3 LYS 79 HG3 LYS 79 0.410 -7.793 13.872 592 HD2 LYS 79 HD2 LYS 79 -1.793 -8.143 12.824 593 HD3 LYS 79 HD3 LYS 79 -1.707 -9.864 13.210 594 HE2 LYS 79 HE2 LYS 79 -1.631 -9.283 15.599 595 HE3 LYS 79 HE3 LYS 79 -1.789 -7.581 15.173 596 HZ1 LYS 79 HZ1 LYS 79 -3.926 -8.126 14.108 597 HZ2 LYS 79 HZ2 LYS 79 -3.919 -8.448 15.754 598 HZ3 LYS 79 HZ3 LYS 79 -3.805 -9.717 14.664 599 H SER 80 H SER 80 2.674 -7.032 10.845 600 HA SER 80 HA SER 80 2.189 -4.789 12.623 601 HB2 SER 80 HB2 SER 80 4.152 -6.192 12.941 602 HB3 SER 80 HB3 SER 80 4.769 -5.730 11.351 603 HG SER 80 HG SER 80 4.579 -3.489 12.222 604 H LEU 81 H LEU 81 1.600 -5.204 9.482 605 HA LEU 81 HA LEU 81 2.885 -3.003 8.320 606 HB2 LEU 81 HB2 LEU 81 2.259 -4.770 6.953 607 HB3 LEU 81 HB3 LEU 81 0.559 -4.670 7.375 608 HG LEU 81 HG LEU 81 1.965 -2.480 5.831 609 HD11 LEU 81 HD11 LEU 81 1.230 -3.624 3.793 610 HD12 LEU 81 HD12 LEU 81 0.659 -4.982 4.764 611 HD13 LEU 81 HD13 LEU 81 2.382 -4.608 4.694 612 HD21 LEU 81 HD21 LEU 81 -0.303 -2.015 6.708 613 HD22 LEU 81 HD22 LEU 81 -0.903 -3.451 5.878 614 HD23 LEU 81 HD23 LEU 81 -0.284 -2.089 4.945 615 HA PRO 82 HA PRO 82 -1.524 -0.695 8.957 616 HB2 PRO 82 HB2 PRO 82 -1.977 -1.727 11.717 617 HB3 PRO 82 HB3 PRO 82 -3.160 -1.304 10.472 618 HG2 PRO 82 HG2 PRO 82 -2.639 -3.844 10.983 619 HG3 PRO 82 HG3 PRO 82 -2.825 -3.295 9.305 620 HD2 PRO 82 HD2 PRO 82 -0.298 -3.858 10.837 621 HD3 PRO 82 HD3 PRO 82 -0.723 -4.307 9.162 622 H GLY 83 H GLY 83 0.955 -1.378 11.287 623 HA2 GLY 83 HA2 GLY 83 0.835 0.932 12.874 624 HA3 GLY 83 HA3 GLY 83 2.284 -0.018 12.568 625 H LEU 84 H LEU 84 2.404 0.285 9.775 626 HA LEU 84 HA LEU 84 3.734 2.815 9.683 627 HB2 LEU 84 HB2 LEU 84 4.499 2.283 7.510 628 HB3 LEU 84 HB3 LEU 84 4.433 0.752 8.340 629 HG LEU 84 HG LEU 84 2.059 0.644 7.134 630 HD11 LEU 84 HD11 LEU 84 2.160 1.564 4.852 631 HD12 LEU 84 HD12 LEU 84 3.671 2.358 5.236 632 HD13 LEU 84 HD13 LEU 84 2.198 2.836 6.066 633 HD21 LEU 84 HD21 LEU 84 4.702 0.014 5.812 634 HD22 LEU 84 HD22 LEU 84 3.143 -0.645 5.325 635 HD23 LEU 84 HD23 LEU 84 3.807 -1.032 6.915 636 H LEU 85 H LEU 85 0.719 1.583 8.498 637 HA LEU 85 HA LEU 85 -0.054 3.767 6.920 638 HB2 LEU 85 HB2 LEU 85 -1.859 1.943 8.514 639 HB3 LEU 85 HB3 LEU 85 -2.341 2.940 7.164 640 HG LEU 85 HG LEU 85 -0.522 0.535 7.038 641 HD11 LEU 85 HD11 LEU 85 -3.329 0.962 6.030 642 HD12 LEU 85 HD12 LEU 85 -2.864 -0.029 7.412 643 HD13 LEU 85 HD13 LEU 85 -2.350 -0.483 5.787 644 HD21 LEU 85 HD21 LEU 85 -1.537 2.330 4.838 645 HD22 LEU 85 HD22 LEU 85 -0.640 0.827 4.607 646 HD23 LEU 85 HD23 LEU 85 0.132 2.206 5.389 647 H THR 86 H THR 86 -0.473 3.043 10.278 648 HA THR 86 HA THR 86 -2.254 5.112 10.939 649 HB THR 86 HB THR 86 -0.196 3.811 12.756 650 HG1 THR 86 HG1 THR 86 -1.603 2.296 11.753 651 HG21 THR 86 HG21 THR 86 -2.810 5.212 13.406 652 HG22 THR 86 HG22 THR 86 -1.198 5.854 13.729 653 HG23 THR 86 HG23 THR 86 -1.757 4.409 14.569 654 H ILE 87 H ILE 87 1.315 5.100 11.094 655 HA ILE 87 HA ILE 87 1.403 7.759 12.018 656 HB ILE 87 HB ILE 87 3.230 6.342 12.604 657 HG12 ILE 87 HG12 ILE 87 3.837 8.787 12.040 658 HG13 ILE 87 HG13 ILE 87 5.158 7.648 12.233 659 HG21 ILE 87 HG21 ILE 87 4.839 5.355 11.036 660 HG22 ILE 87 HG22 ILE 87 3.754 5.828 9.721 661 HG23 ILE 87 HG23 ILE 87 3.200 4.703 10.951 662 HD11 ILE 87 HD11 ILE 87 5.537 9.189 10.373 663 HD12 ILE 87 HD12 ILE 87 4.042 8.642 9.610 664 HD13 ILE 87 HD13 ILE 87 5.403 7.530 9.797 665 H LEU 88 H LEU 88 1.761 6.422 8.740 666 HA LEU 88 HA LEU 88 2.293 8.953 7.582 667 HB2 LEU 88 HB2 LEU 88 1.461 6.354 6.398 668 HB3 LEU 88 HB3 LEU 88 1.465 7.802 5.424 669 HG LEU 88 HG LEU 88 3.446 6.616 4.978 670 HD11 LEU 88 HD11 LEU 88 4.145 8.940 6.736 671 HD12 LEU 88 HD12 LEU 88 3.712 8.996 5.028 672 HD13 LEU 88 HD13 LEU 88 5.192 8.187 5.535 673 HD21 LEU 88 HD21 LEU 88 3.536 5.264 7.014 674 HD22 LEU 88 HD22 LEU 88 4.100 6.682 7.902 675 HD23 LEU 88 HD23 LEU 88 5.084 6.004 6.596 676 H HIS 89 H HIS 89 -0.729 7.243 8.094 677 HA HIS 89 HA HIS 89 -2.359 8.943 6.573 678 HB2 HIS 89 HB2 HIS 89 -2.895 7.193 8.947 679 HB3 HIS 89 HB3 HIS 89 -4.149 8.273 8.378 680 HD1 HIS 89 HD1 HIS 89 -5.775 6.849 7.172 681 HD2 HIS 89 HD2 HIS 89 -1.865 5.802 6.268 682 HE1 HIS 89 HE1 HIS 89 -5.913 4.944 5.509 683 H ASP 90 H ASP 90 -1.371 9.134 9.950 684 HA ASP 90 HA ASP 90 -2.756 11.572 10.422 685 HB2 ASP 90 HB2 ASP 90 -2.178 10.099 12.290 686 HB3 ASP 90 HB3 ASP 90 -0.482 10.274 11.914 687 H GLY 91 H GLY 91 0.354 10.791 9.089 688 HA2 GLY 91 HA2 GLY 91 1.470 13.425 9.381 689 HA3 GLY 91 HA3 GLY 91 2.145 12.093 8.457 690 H GLY 92 H GLY 92 -0.769 12.056 7.260 691 HA2 GLY 92 HA2 GLY 92 -1.985 13.206 5.648 692 HA3 GLY 92 HA3 GLY 92 -0.795 14.496 5.703 693 H TYR 93 H TYR 93 -0.356 11.031 5.017 694 HA TYR 93 HA TYR 93 0.594 11.834 2.376 695 HB2 TYR 93 HB2 TYR 93 1.577 9.644 4.184 696 HB3 TYR 93 HB3 TYR 93 1.909 9.631 2.454 697 HD1 TYR 93 HD1 TYR 93 2.608 11.344 5.638 698 HD2 TYR 93 HD2 TYR 93 3.419 11.203 1.474 699 HE1 TYR 93 HE1 TYR 93 4.530 12.834 5.960 700 HE2 TYR 93 HE2 TYR 93 5.351 12.678 1.782 701 HH TYR 93 HH TYR 93 6.812 13.212 4.603 702 H ARG 94 H ARG 94 -0.043 10.785 0.623 703 HA ARG 94 HA ARG 94 -2.561 9.337 0.893 704 HB2 ARG 94 HB2 ARG 94 -3.003 9.915 -1.342 705 HB3 ARG 94 HB3 ARG 94 -2.173 11.319 -0.686 706 HG2 ARG 94 HG2 ARG 94 -0.077 10.233 -1.626 707 HG3 ARG 94 HG3 ARG 94 -1.147 9.266 -2.623 708 HD2 ARG 94 HD2 ARG 94 -0.637 11.147 -3.962 709 HD3 ARG 94 HD3 ARG 94 -2.212 11.549 -3.267 710 HE ARG 94 HE ARG 94 -0.188 12.422 -1.550 711 HH11 ARG 94 HH11 ARG 94 -1.746 13.361 -4.585 712 HH12 ARG 94 HH12 ARG 94 -1.099 14.921 -4.643 713 HH21 ARG 94 HH21 ARG 94 0.701 14.589 -1.538 714 HH22 ARG 94 HH22 ARG 94 0.380 15.641 -2.833 715 H ASP 95 H ASP 95 -2.905 7.624 -0.912 716 HA ASP 95 HA ASP 95 -1.611 5.277 -0.211 717 HB2 ASP 95 HB2 ASP 95 -2.772 4.338 -2.201 718 HB3 ASP 95 HB3 ASP 95 -3.835 5.341 -1.213 719 H THR 96 H THR 96 -1.157 7.280 -3.061 720 HA THR 96 HA THR 96 0.694 5.666 -4.364 721 HB THR 96 HB THR 96 0.392 8.668 -4.564 722 HG1 THR 96 HG1 THR 96 -1.459 6.735 -5.009 723 HG21 THR 96 HG21 THR 96 1.210 6.586 -6.605 724 HG22 THR 96 HG22 THR 96 2.314 7.671 -5.758 725 HG23 THR 96 HG23 THR 96 1.115 8.330 -6.870 726 H GLU 97 H GLU 97 1.034 8.282 -2.045 727 HA GLU 97 HA GLU 97 3.846 8.548 -2.227 728 HB2 GLU 97 HB2 GLU 97 1.924 9.341 -0.057 729 HB3 GLU 97 HB3 GLU 97 3.638 9.750 -0.066 730 HG2 GLU 97 HG2 GLU 97 3.383 11.003 -2.057 731 HG3 GLU 97 HG3 GLU 97 1.701 10.540 -2.230 732 H ILE 98 H ILE 98 1.698 6.657 -0.213 733 HA ILE 98 HA ILE 98 3.586 5.724 1.679 734 HB ILE 98 HB ILE 98 1.277 4.077 0.592 735 HG12 ILE 98 HG12 ILE 98 0.226 6.118 1.297 736 HG13 ILE 98 HG13 ILE 98 -0.002 4.905 2.560 737 HG21 ILE 98 HG21 ILE 98 1.263 3.017 2.797 738 HG22 ILE 98 HG22 ILE 98 2.655 3.993 3.256 739 HG23 ILE 98 HG23 ILE 98 2.798 2.817 1.951 740 HD11 ILE 98 HD11 ILE 98 1.705 5.888 3.893 741 HD12 ILE 98 HD12 ILE 98 0.492 7.097 3.467 742 HD13 ILE 98 HD13 ILE 98 2.047 7.083 2.635 743 H MET 99 H MET 99 2.491 4.441 -1.388 744 HA MET 99 HA MET 99 4.229 2.210 -1.259 745 HB2 MET 99 HB2 MET 99 2.604 3.238 -3.564 746 HB3 MET 99 HB3 MET 99 3.420 1.675 -3.504 747 HG2 MET 99 HG2 MET 99 2.093 1.164 -1.458 748 HG3 MET 99 HG3 MET 99 1.185 2.638 -1.763 749 HE1 MET 99 HE1 MET 99 -0.263 -0.026 -1.353 750 HE2 MET 99 HE2 MET 99 -1.436 0.007 -2.671 751 HE3 MET 99 HE3 MET 99 -1.061 1.486 -1.780 752 H ARG 100 H ARG 100 4.679 5.426 -2.304 753 HA ARG 100 HA ARG 100 6.623 5.134 -4.292 754 HB2 ARG 100 HB2 ARG 100 5.670 7.308 -3.751 755 HB3 ARG 100 HB3 ARG 100 6.356 7.245 -2.139 756 HG2 ARG 100 HG2 ARG 100 8.620 7.299 -3.152 757 HG3 ARG 100 HG3 ARG 100 7.867 7.492 -4.734 758 HD2 ARG 100 HD2 ARG 100 6.815 9.561 -4.002 759 HD3 ARG 100 HD3 ARG 100 7.505 9.348 -2.393 760 HE ARG 100 HE ARG 100 9.684 9.298 -3.886 761 HH11 ARG 100 HH11 ARG 100 6.977 11.573 -3.974 762 HH12 ARG 100 HH12 ARG 100 7.879 12.918 -4.449 763 HH21 ARG 100 HH21 ARG 100 10.980 11.171 -4.589 764 HH22 ARG 100 HH22 ARG 100 10.215 12.678 -4.826 765 H TRP 101 H TRP 101 7.242 5.791 -0.871 766 HA TRP 101 HA TRP 101 9.949 5.008 -1.093 767 HB2 TRP 101 HB2 TRP 101 9.969 5.231 1.442 768 HB3 TRP 101 HB3 TRP 101 9.540 6.671 0.528 769 HD1 TRP 101 HD1 TRP 101 7.103 7.613 0.811 770 HE1 TRP 101 HE1 TRP 101 5.249 7.162 2.482 771 HE3 TRP 101 HE3 TRP 101 8.912 3.294 2.835 772 HZ2 TRP 101 HZ2 TRP 101 4.621 5.201 4.444 773 HZ3 TRP 101 HZ3 TRP 101 7.633 2.202 4.566 774 HH2 TRP 101 HH2 TRP 101 5.532 3.129 5.383 775 H LEU 102 H LEU 102 7.081 3.309 -0.140 776 HA LEU 102 HA LEU 102 8.362 1.118 1.048 777 HB2 LEU 102 HB2 LEU 102 5.710 1.777 0.132 778 HB3 LEU 102 HB3 LEU 102 6.021 0.040 0.112 779 HG LEU 102 HG LEU 102 6.100 1.963 2.443 780 HD11 LEU 102 HD11 LEU 102 3.898 1.309 1.538 781 HD12 LEU 102 HD12 LEU 102 4.190 0.810 3.207 782 HD13 LEU 102 HD13 LEU 102 4.297 -0.377 1.897 783 HD21 LEU 102 HD21 LEU 102 6.391 -0.088 3.802 784 HD22 LEU 102 HD22 LEU 102 7.789 0.295 2.799 785 HD23 LEU 102 HD23 LEU 102 6.684 -0.982 2.309 786 H PHE 103 H PHE 103 7.514 1.706 -2.330 787 HA PHE 103 HA PHE 103 8.503 -0.958 -2.976 788 HB2 PHE 103 HB2 PHE 103 6.913 1.034 -4.571 789 HB3 PHE 103 HB3 PHE 103 7.659 -0.375 -5.305 790 HD1 PHE 103 HD1 PHE 103 5.213 0.671 -2.714 791 HD2 PHE 103 HD2 PHE 103 6.560 -2.443 -5.269 792 HE1 PHE 103 HE1 PHE 103 3.203 -0.636 -2.182 793 HE2 PHE 103 HE2 PHE 103 4.557 -3.747 -4.733 794 HZ PHE 103 HZ PHE 103 2.873 -2.844 -3.195 795 H THR 104 H THR 104 10.057 1.752 -2.433 796 HA THR 104 HA THR 104 11.516 1.689 -4.906 797 HB THR 104 HB THR 104 11.084 3.936 -3.837 798 HG1 THR 104 HG1 THR 104 13.857 3.724 -3.802 799 HG21 THR 104 HG21 THR 104 12.475 4.640 -1.942 800 HG22 THR 104 HG22 THR 104 13.144 3.005 -1.856 801 HG23 THR 104 HG23 THR 104 11.439 3.273 -1.493 802 HA PRO 105 HA PRO 105 14.292 -1.384 -3.337 803 HB2 PRO 105 HB2 PRO 105 16.000 -1.344 -5.458 804 HB3 PRO 105 HB3 PRO 105 14.437 -2.165 -5.506 805 HG2 PRO 105 HG2 PRO 105 15.213 0.505 -6.599 806 HG3 PRO 105 HG3 PRO 105 14.156 -0.729 -7.304 807 HD2 PRO 105 HD2 PRO 105 13.242 1.501 -6.011 808 HD3 PRO 105 HD3 PRO 105 12.327 -0.024 -6.084 809 H ASP 106 H ASP 106 16.088 -1.189 -2.050 810 HA ASP 106 HA ASP 106 17.561 1.330 -2.328 811 HB2 ASP 106 HB2 ASP 106 16.487 0.937 -0.105 812 HB3 ASP 106 HB3 ASP 106 17.503 -0.483 0.093 813 HA PRO 107 HA PRO 107 20.640 -1.319 -4.154 814 HB2 PRO 107 HB2 PRO 107 22.567 0.633 -4.401 815 HB3 PRO 107 HB3 PRO 107 21.276 0.337 -5.564 816 HG2 PRO 107 HG2 PRO 107 21.468 2.393 -3.422 817 HG3 PRO 107 HG3 PRO 107 20.785 2.531 -5.047 818 HD2 PRO 107 HD2 PRO 107 19.253 2.278 -2.844 819 HD3 PRO 107 HD3 PRO 107 18.767 1.605 -4.416 820 H SER 108 H SER 108 20.996 0.320 -1.121 821 HA SER 108 HA SER 108 23.516 -1.097 -0.698 822 HB2 SER 108 HB2 SER 108 22.399 1.320 0.714 823 HB3 SER 108 HB3 SER 108 23.938 0.535 1.087 824 HG SER 108 HG SER 108 23.157 2.045 -1.122 825 H LEU 109 H LEU 109 20.347 -1.573 -0.203 826 HA LEU 109 HA LEU 109 20.700 -2.477 2.534 827 HB2 LEU 109 HB2 LEU 109 18.807 -0.972 2.006 828 HB3 LEU 109 HB3 LEU 109 18.202 -2.191 0.908 829 HG LEU 109 HG LEU 109 17.725 -3.692 2.727 830 HD11 LEU 109 HD11 LEU 109 18.046 -3.014 5.048 831 HD12 LEU 109 HD12 LEU 109 18.914 -1.567 4.505 832 HD13 LEU 109 HD13 LEU 109 19.573 -3.177 4.185 833 HD21 LEU 109 HD21 LEU 109 16.058 -2.050 2.148 834 HD22 LEU 109 HD22 LEU 109 16.786 -0.895 3.272 835 HD23 LEU 109 HD23 LEU 109 16.044 -2.376 3.889 836 H THR 110 H THR 110 20.896 -4.482 2.964 837 HA THR 110 HA THR 110 20.207 -6.510 0.954 838 HB THR 110 HB THR 110 22.420 -6.635 3.037 839 HG1 THR 110 HG1 THR 110 22.948 -5.203 1.363 840 HG21 THR 110 HG21 THR 110 23.116 -8.669 1.843 841 HG22 THR 110 HG22 THR 110 21.743 -8.498 0.744 842 HG23 THR 110 HG23 THR 110 21.471 -8.833 2.454 843 H ILE 111 H ILE 111 18.654 -7.816 1.590 844 HA ILE 111 HA ILE 111 17.976 -7.909 4.460 845 HB ILE 111 HB ILE 111 16.102 -7.773 2.102 846 HG12 ILE 111 HG12 ILE 111 16.856 -5.629 4.087 847 HG13 ILE 111 HG13 ILE 111 17.160 -5.642 2.354 848 HG21 ILE 111 HG21 ILE 111 14.327 -7.441 3.707 849 HG22 ILE 111 HG22 ILE 111 15.479 -7.686 5.030 850 HG23 ILE 111 HG23 ILE 111 15.123 -9.008 3.906 851 HD11 ILE 111 HD11 ILE 111 15.334 -4.151 2.832 852 HD12 ILE 111 HD12 ILE 111 14.518 -5.428 3.733 853 HD13 ILE 111 HD13 ILE 111 14.693 -5.575 1.999 854 H THR 112 H THR 112 17.084 -9.887 5.090 855 HA THR 112 HA THR 112 17.591 -12.125 3.307 856 HB THR 112 HB THR 112 16.993 -13.479 5.385 857 HG1 THR 112 HG1 THR 112 17.175 -12.086 7.346 858 HG21 THR 112 HG21 THR 112 19.089 -12.961 6.565 859 HG22 THR 112 HG22 THR 112 19.194 -11.444 5.672 860 HG23 THR 112 HG23 THR 112 19.322 -12.981 4.812 861 H ARG 113 H ARG 113 15.965 -13.128 2.254 862 HA ARG 113 HA ARG 113 13.463 -11.700 2.470 863 HB2 ARG 113 HB2 ARG 113 14.742 -12.177 0.289 864 HB3 ARG 113 HB3 ARG 113 14.071 -13.800 0.416 865 HG2 ARG 113 HG2 ARG 113 11.843 -12.952 0.350 866 HG3 ARG 113 HG3 ARG 113 12.425 -11.295 0.436 867 HD2 ARG 113 HD2 ARG 113 13.614 -11.722 -1.745 868 HD3 ARG 113 HD3 ARG 113 12.703 -13.233 -1.849 869 HE ARG 113 HE ARG 113 11.298 -10.745 -1.371 870 HH11 ARG 113 HH11 ARG 113 12.119 -13.249 -3.760 871 HH12 ARG 113 HH12 ARG 113 10.734 -12.967 -4.718 872 HH21 ARG 113 HH21 ARG 113 9.519 -10.347 -2.679 873 HH22 ARG 113 HH22 ARG 113 9.170 -11.253 -4.119 874 H ASP 114 H ASP 114 11.442 -12.679 2.672 875 HA ASP 114 HA ASP 114 11.392 -14.935 4.452 876 HB2 ASP 114 HB2 ASP 114 9.821 -13.046 4.746 877 HB3 ASP 114 HB3 ASP 114 9.113 -13.410 3.175 878 H GLY 115 H GLY 115 10.162 -16.894 4.033 879 HA2 GLY 115 HA2 GLY 115 9.310 -18.543 2.601 880 HA3 GLY 115 HA3 GLY 115 9.751 -17.534 1.221 881 H SER 116 H SER 116 12.220 -16.950 1.435 882 HA SER 116 HA SER 116 13.649 -19.421 1.337 883 HB2 SER 116 HB2 SER 116 15.339 -17.819 0.317 884 HB3 SER 116 HB3 SER 116 13.832 -18.010 -0.587 885 HG SER 116 HG SER 116 14.168 -15.873 -0.472 886 H ARG 117 H ARG 117 16.109 -18.559 2.001 887 HA ARG 117 HA ARG 117 15.951 -17.259 4.615 888 HB2 ARG 117 HB2 ARG 117 17.585 -18.831 5.489 889 HB3 ARG 117 HB3 ARG 117 16.092 -19.661 5.060 890 HG2 ARG 117 HG2 ARG 117 18.508 -19.607 3.253 891 HG3 ARG 117 HG3 ARG 117 18.303 -20.816 4.517 892 HD2 ARG 117 HD2 ARG 117 16.278 -21.622 3.473 893 HD3 ARG 117 HD3 ARG 117 16.324 -20.327 2.282 894 HE ARG 117 HE ARG 117 18.698 -21.635 2.010 895 HH11 ARG 117 HH11 ARG 117 15.283 -22.599 1.763 896 HH12 ARG 117 HH12 ARG 117 15.578 -23.799 0.603 897 HH21 ARG 117 HH21 ARG 117 19.078 -23.321 0.414 898 HH22 ARG 117 HH22 ARG 117 17.766 -24.235 -0.146 899 H ASP 118 H ASP 118 16.822 -16.881 1.740 900 HA ASP 118 HA ASP 118 19.696 -16.515 1.992 901 HB2 ASP 118 HB2 ASP 118 17.893 -16.334 -0.436 902 HB3 ASP 118 HB3 ASP 118 19.639 -16.130 -0.458 903 H ALA 119 H ALA 119 20.687 -14.595 1.633 904 HA ALA 119 HA ALA 119 19.118 -12.223 2.179 905 HB1 ALA 119 HB1 ALA 119 21.280 -11.131 2.470 906 HB2 ALA 119 HB2 ALA 119 22.101 -12.581 1.896 907 HB3 ALA 119 HB3 ALA 119 21.207 -12.619 3.412 908 H VAL 120 H VAL 120 18.576 -10.776 0.732 909 HA VAL 120 HA VAL 120 19.657 -11.017 -1.988 910 HB VAL 120 HB VAL 120 16.940 -9.939 -1.153 911 HG11 VAL 120 HG11 VAL 120 18.038 -10.598 -3.879 912 HG12 VAL 120 HG12 VAL 120 17.750 -8.985 -3.229 913 HG13 VAL 120 HG13 VAL 120 16.391 -10.068 -3.541 914 HG21 VAL 120 HG21 VAL 120 17.009 -12.331 -0.707 915 HG22 VAL 120 HG22 VAL 120 17.595 -12.640 -2.340 916 HG23 VAL 120 HG23 VAL 120 15.969 -12.001 -2.093 917 H SER 121 H SER 121 20.720 -9.228 -2.656 918 HA SER 121 HA SER 121 20.646 -6.873 -0.997 919 HB2 SER 121 HB2 SER 121 22.458 -6.139 -2.628 920 HB3 SER 121 HB3 SER 121 22.845 -7.556 -1.654 921 HG SER 121 HG SER 121 23.226 -7.536 -4.036 922 H ASN 122 H ASN 122 19.886 -4.938 -1.599 923 HA ASN 122 HA ASN 122 18.598 -3.446 -2.550 924 HB2 ASN 122 HB2 ASN 122 20.000 -3.528 -4.558 925 HB3 ASN 122 HB3 ASN 122 19.130 -4.937 -5.147 926 HD21 ASN 122 HD21 ASN 122 17.200 -4.640 -6.195 927 HD22 ASN 122 HD22 ASN 122 16.559 -3.101 -6.631 928 H ALA 123 H ALA 123 17.148 -4.543 -1.097 929 HA ALA 123 HA ALA 123 14.919 -5.690 -2.596 930 HB1 ALA 123 HB1 ALA 123 15.602 -5.793 0.329 931 HB2 ALA 123 HB2 ALA 123 15.684 -7.130 -0.820 932 HB3 ALA 123 HB3 ALA 123 14.119 -6.452 -0.360 933 H ARG 124 H ARG 124 12.752 -5.064 -1.399 934 HA ARG 124 HA ARG 124 12.751 -2.122 -1.282 935 HB2 ARG 124 HB2 ARG 124 10.421 -4.003 -1.779 936 HB3 ARG 124 HB3 ARG 124 10.306 -2.260 -1.684 937 HG2 ARG 124 HG2 ARG 124 10.186 -2.743 -3.875 938 HG3 ARG 124 HG3 ARG 124 11.889 -2.249 -3.704 939 HD2 ARG 124 HD2 ARG 124 11.893 -4.218 -5.094 940 HD3 ARG 124 HD3 ARG 124 12.341 -4.752 -3.465 941 HE ARG 124 HE ARG 124 9.545 -4.874 -4.254 942 HH11 ARG 124 HH11 ARG 124 12.516 -6.737 -3.777 943 HH12 ARG 124 HH12 ARG 124 11.682 -8.126 -3.239 944 HH21 ARG 124 HH21 ARG 124 8.446 -6.795 -3.615 945 HH22 ARG 124 HH22 ARG 124 9.357 -8.148 -3.092 946 HA PRO 125 HA PRO 125 11.585 -2.151 3.039 947 HB2 PRO 125 HB2 PRO 125 9.534 -0.207 2.066 948 HB3 PRO 125 HB3 PRO 125 10.594 -0.082 3.481 949 HG2 PRO 125 HG2 PRO 125 11.183 1.283 1.316 950 HG3 PRO 125 HG3 PRO 125 12.471 0.407 2.165 951 HD2 PRO 125 HD2 PRO 125 11.041 -0.302 -0.361 952 HD3 PRO 125 HD3 PRO 125 12.756 -0.499 0.063 953 H VAL 126 H VAL 126 8.988 -2.311 0.549 954 HA VAL 126 HA VAL 126 7.034 -3.466 2.258 955 HB VAL 126 HB VAL 126 7.326 -4.054 -0.712 956 HG11 VAL 126 HG11 VAL 126 4.963 -4.314 1.133 957 HG12 VAL 126 HG12 VAL 126 5.907 -5.641 0.457 958 HG13 VAL 126 HG13 VAL 126 4.951 -4.603 -0.606 959 HG21 VAL 126 HG21 VAL 126 7.087 -1.674 -0.290 960 HG22 VAL 126 HG22 VAL 126 5.637 -1.988 0.662 961 HG23 VAL 126 HG23 VAL 126 5.652 -2.347 -1.067 962 H ASP 127 H ASP 127 9.547 -4.917 0.210 963 HA ASP 127 HA ASP 127 8.795 -7.594 0.804 964 HB2 ASP 127 HB2 ASP 127 10.357 -6.593 -1.080 965 HB3 ASP 127 HB3 ASP 127 11.617 -6.837 0.122 966 H ALA 128 H ALA 128 10.825 -5.235 2.305 967 HA ALA 128 HA ALA 128 12.178 -6.826 4.199 968 HB1 ALA 128 HB1 ALA 128 12.706 -4.775 5.334 969 HB2 ALA 128 HB2 ALA 128 11.384 -3.949 4.522 970 HB3 ALA 128 HB3 ALA 128 12.778 -4.477 3.592 971 H LEU 129 H LEU 129 9.123 -5.015 4.441 972 HA LEU 129 HA LEU 129 8.737 -5.735 7.173 973 HB2 LEU 129 HB2 LEU 129 6.508 -4.761 6.969 974 HB3 LEU 129 HB3 LEU 129 7.712 -3.704 6.279 975 HG LEU 129 HG LEU 129 7.001 -4.869 4.057 976 HD11 LEU 129 HD11 LEU 129 5.536 -6.465 5.049 977 HD12 LEU 129 HD12 LEU 129 4.625 -5.403 3.960 978 HD13 LEU 129 HD13 LEU 129 4.520 -5.187 5.717 979 HD21 LEU 129 HD21 LEU 129 5.369 -2.736 5.429 980 HD22 LEU 129 HD22 LEU 129 5.336 -3.074 3.696 981 HD23 LEU 129 HD23 LEU 129 6.819 -2.497 4.449 982 H HIS 130 H HIS 130 7.817 -7.119 4.160 983 HA HIS 130 HA HIS 130 6.091 -9.141 5.110 984 HB2 HIS 130 HB2 HIS 130 6.228 -8.439 2.741 985 HB3 HIS 130 HB3 HIS 130 7.889 -8.974 2.658 986 HD1 HIS 130 HD1 HIS 130 4.368 -10.189 2.244 987 HD2 HIS 130 HD2 HIS 130 8.206 -11.771 2.512 988 HE1 HIS 130 HE1 HIS 130 4.221 -12.524 1.394 989 H ALA 131 H ALA 131 9.473 -8.707 4.957 990 HA ALA 131 HA ALA 131 10.094 -11.452 5.789 991 HB1 ALA 131 HB1 ALA 131 11.969 -9.200 5.088 992 HB2 ALA 131 HB2 ALA 131 11.411 -10.448 3.976 993 HB3 ALA 131 HB3 ALA 131 12.419 -10.884 5.360 994 H HIS 132 H HIS 132 8.973 -9.091 7.449 995 HA HIS 132 HA HIS 132 8.905 -8.456 9.625 996 HB2 HIS 132 HB2 HIS 132 8.905 -10.943 9.961 997 HB3 HIS 132 HB3 HIS 132 10.653 -10.895 10.124 998 HD1 HIS 132 HD1 HIS 132 11.372 -10.952 12.540 999 HD2 HIS 132 HD2 HIS 132 7.678 -9.122 12.034 1000 HE1 HIS 132 HE1 HIS 132 10.567 -10.360 14.839 1001 H GLN 133 H GLN 133 11.060 -7.515 7.905 1002 HA GLN 133 HA GLN 133 12.897 -6.577 9.951 1003 HB2 GLN 133 HB2 GLN 133 13.244 -7.011 6.982 1004 HB3 GLN 133 HB3 GLN 133 14.371 -6.000 7.900 1005 HG2 GLN 133 HG2 GLN 133 15.035 -7.766 9.273 1006 HG3 GLN 133 HG3 GLN 133 13.669 -8.759 8.811 1007 HE21 GLN 133 HE21 GLN 133 13.761 -9.934 7.006 1008 HE22 GLN 133 HE22 GLN 133 15.184 -10.242 6.104 1009 H ALA 134 H ALA 134 10.333 -5.910 9.420 1010 HA ALA 134 HA ALA 134 9.655 -3.579 8.147 1011 HB1 ALA 134 HB1 ALA 134 8.535 -4.590 10.746 1012 HB2 ALA 134 HB2 ALA 134 8.064 -5.148 9.140 1013 HB3 ALA 134 HB3 ALA 134 7.752 -3.480 9.623 1014 H ARG 135 H ARG 135 11.529 -3.902 11.039 1015 HA ARG 135 HA ARG 135 10.884 -1.578 12.472 1016 HB2 ARG 135 HB2 ARG 135 13.677 -2.674 12.238 1017 HB3 ARG 135 HB3 ARG 135 12.965 -1.828 13.596 1018 HG2 ARG 135 HG2 ARG 135 11.496 -3.737 14.015 1019 HG3 ARG 135 HG3 ARG 135 12.227 -4.588 12.654 1020 HD2 ARG 135 HD2 ARG 135 14.453 -4.229 13.819 1021 HD3 ARG 135 HD3 ARG 135 13.514 -3.767 15.237 1022 HE ARG 135 HE ARG 135 12.955 -6.326 13.969 1023 HH11 ARG 135 HH11 ARG 135 14.288 -4.593 16.761 1024 HH12 ARG 135 HH12 ARG 135 14.498 -6.010 17.680 1025 HH21 ARG 135 HH21 ARG 135 13.253 -8.209 15.216 1026 HH22 ARG 135 HH22 ARG 135 13.891 -8.121 16.800 1027 H GLU 136 H GLU 136 13.244 -2.077 9.867 1028 HA GLU 136 HA GLU 136 14.281 0.571 9.857 1029 HB2 GLU 136 HB2 GLU 136 14.237 -1.525 7.682 1030 HB3 GLU 136 HB3 GLU 136 15.135 -0.020 7.590 1031 HG2 GLU 136 HG2 GLU 136 15.559 -2.232 9.579 1032 HG3 GLU 136 HG3 GLU 136 16.592 -1.842 8.203 1033 H VAL 137 H VAL 137 11.660 -1.022 8.295 1034 HA VAL 137 HA VAL 137 11.003 0.937 6.361 1035 HB VAL 137 HB VAL 137 9.175 -1.091 7.675 1036 HG11 VAL 137 HG11 VAL 137 7.873 -0.961 5.612 1037 HG12 VAL 137 HG12 VAL 137 8.948 0.302 5.017 1038 HG13 VAL 137 HG13 VAL 137 7.948 0.594 6.440 1039 HG21 VAL 137 HG21 VAL 137 9.721 -2.554 5.769 1040 HG22 VAL 137 HG22 VAL 137 11.127 -2.204 6.776 1041 HG23 VAL 137 HG23 VAL 137 10.916 -1.379 5.232 1042 H VAL 138 H VAL 138 9.883 0.265 9.634 1043 HA VAL 138 HA VAL 138 7.950 2.298 9.822 1044 HB VAL 138 HB VAL 138 9.651 1.120 12.056 1045 HG11 VAL 138 HG11 VAL 138 8.629 3.227 12.745 1046 HG12 VAL 138 HG12 VAL 138 7.874 1.867 13.575 1047 HG13 VAL 138 HG13 VAL 138 7.046 2.644 12.225 1048 HG21 VAL 138 HG21 VAL 138 8.366 -0.584 10.871 1049 HG22 VAL 138 HG22 VAL 138 6.894 0.360 11.093 1050 HG23 VAL 138 HG23 VAL 138 7.717 -0.328 12.491 1051 H ARG 139 H ARG 139 11.380 2.263 10.671 1052 HA ARG 139 HA ARG 139 11.484 4.944 11.529 1053 HB2 ARG 139 HB2 ARG 139 13.211 3.230 12.054 1054 HB3 ARG 139 HB3 ARG 139 13.749 3.306 10.380 1055 HG2 ARG 139 HG2 ARG 139 14.411 5.592 10.635 1056 HG3 ARG 139 HG3 ARG 139 13.728 5.650 12.259 1057 HD2 ARG 139 HD2 ARG 139 15.330 3.885 12.932 1058 HD3 ARG 139 HD3 ARG 139 16.072 3.998 11.334 1059 HE ARG 139 HE ARG 139 16.474 6.361 11.869 1060 HH11 ARG 139 HH11 ARG 139 16.239 3.973 14.479 1061 HH12 ARG 139 HH12 ARG 139 17.104 4.878 15.614 1062 HH21 ARG 139 HH21 ARG 139 17.665 7.649 13.423 1063 HH22 ARG 139 HH22 ARG 139 17.954 7.057 14.986 1064 H ARG 140 H ARG 140 11.978 3.463 8.380 1065 HA ARG 140 HA ARG 140 12.822 5.701 6.904 1066 HB2 ARG 140 HB2 ARG 140 12.516 3.082 6.352 1067 HB3 ARG 140 HB3 ARG 140 11.002 3.650 5.683 1068 HG2 ARG 140 HG2 ARG 140 13.761 4.550 4.809 1069 HG3 ARG 140 HG3 ARG 140 12.762 3.371 3.985 1070 HD2 ARG 140 HD2 ARG 140 11.085 5.124 3.564 1071 HD3 ARG 140 HD3 ARG 140 12.123 6.292 4.383 1072 HE ARG 140 HE ARG 140 13.272 4.844 2.134 1073 HH11 ARG 140 HH11 ARG 140 11.781 7.843 3.267 1074 HH12 ARG 140 HH12 ARG 140 12.378 8.793 1.986 1075 HH21 ARG 140 HH21 ARG 140 14.114 6.205 0.321 1076 HH22 ARG 140 HH22 ARG 140 13.730 7.857 0.336 1077 H ALA 141 H ALA 141 9.645 4.509 7.851 1078 HA ALA 141 HA ALA 141 8.043 6.287 6.364 1079 HB1 ALA 141 HB1 ALA 141 7.558 4.729 8.889 1080 HB2 ALA 141 HB2 ALA 141 7.110 4.252 7.243 1081 HB3 ALA 141 HB3 ALA 141 6.311 5.614 8.034 1082 H GLN 142 H GLN 142 9.208 6.305 9.704 1083 HA GLN 142 HA GLN 142 8.069 8.695 10.631 1084 HB2 GLN 142 HB2 GLN 142 10.821 7.655 11.308 1085 HB3 GLN 142 HB3 GLN 142 9.868 8.774 12.261 1086 HG2 GLN 142 HG2 GLN 142 8.280 7.042 12.778 1087 HG3 GLN 142 HG3 GLN 142 9.114 5.920 11.697 1088 HE21 GLN 142 HE21 GLN 142 8.632 5.631 14.546 1089 HE22 GLN 142 HE22 GLN 142 10.194 5.492 15.258 1090 H ALA 143 H ALA 143 11.218 8.118 9.139 1091 HA ALA 143 HA ALA 143 12.069 10.812 9.114 1092 HB1 ALA 143 HB1 ALA 143 13.621 8.927 9.009 1093 HB2 ALA 143 HB2 ALA 143 13.854 10.026 7.648 1094 HB3 ALA 143 HB3 ALA 143 12.998 8.502 7.415 1095 H MET 144 H MET 144 10.145 8.929 6.948 1096 HA MET 144 HA MET 144 10.395 10.691 4.691 1097 HB2 MET 144 HB2 MET 144 9.806 8.257 4.543 1098 HB3 MET 144 HB3 MET 144 8.244 8.642 5.244 1099 HG2 MET 144 HG2 MET 144 8.023 8.426 2.872 1100 HG3 MET 144 HG3 MET 144 7.790 10.119 3.316 1101 HE1 MET 144 HE1 MET 144 8.458 9.068 0.294 1102 HE2 MET 144 HE2 MET 144 9.566 10.349 -0.191 1103 HE3 MET 144 HE3 MET 144 8.116 10.743 0.735 1104 H ALA 145 H ALA 145 8.332 10.428 7.462 1105 HA ALA 145 HA ALA 145 6.426 12.302 6.363 1106 HB1 ALA 145 HB1 ALA 145 5.606 10.349 7.595 1107 HB2 ALA 145 HB2 ALA 145 5.088 11.864 8.331 1108 HB3 ALA 145 HB3 ALA 145 6.411 10.943 9.046 1109 H TYR 146 H TYR 146 8.691 12.162 9.122 1110 HA TYR 146 HA TYR 146 8.337 15.060 9.400 1111 HB2 TYR 146 HB2 TYR 146 8.958 13.050 11.570 1112 HB3 TYR 146 HB3 TYR 146 8.783 14.787 11.790 1113 HD1 TYR 146 HD1 TYR 146 6.552 15.820 11.641 1114 HD2 TYR 146 HD2 TYR 146 7.074 11.613 11.393 1115 HE1 TYR 146 HE1 TYR 146 4.153 15.497 12.072 1116 HE2 TYR 146 HE2 TYR 146 4.684 11.283 11.822 1117 HH TYR 146 HH TYR 146 2.862 12.413 12.787
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